O=C(NCc1cn2ccccc2n1)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875000002	GD	On-Demand	Anodyne	NPY2R	47	33
CC(=O)C1CCN(C(=O)C(=O)NCc2ccccc2C)CC1	ZINC000875000003	DD	On-Demand	Anodyne	P2RX7	24	45
CC(=O)C1CCN(C(=O)C(=O)NCc2ccccc2C)CC1	ZINC000875000003	DD	On-Demand	Anodyne	EPHX2	26	48
CC(=O)C1CCN(C(=O)C(=O)NCc2ccccc2C)CC1	ZINC000875000003	DD	On-Demand	Anodyne	CCR8	47	34
C[C@@H](NC(=O)N(C)CCN1CC2(CCOCC2)C1)c1cccc(Cl)c1	ZINC000875000006	FG	On-Demand	Anodyne	CASR	41	37
COC(=O)N(C)NC(=O)N[C@H](C)c1cccc(Cl)c1	ZINC000875000008	CE	On-Demand	Reactive	PDS	19	42
COC(=O)N(C)NC(=O)N[C@@H](C)c1cccc(Cl)c1	ZINC000875000009	CE	On-Demand	Reactive	PDS	19	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccccc2C)C1	ZINC000875000013	DD	On-Demand	Anodyne	SLC6A1	78	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccccc2C)C1	ZINC000875000013	DD	On-Demand	Anodyne	P2RX7	19	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccccc2C)C1	ZINC000875000014	DD	On-Demand	Anodyne	SLC6A1	78	38
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccccc2C)C1	ZINC000875000014	DD	On-Demand	Anodyne	P2RX7	19	42
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1ccc(Cl)cc1	ZINC000875000035	DH	On-Demand	Anodyne	PTGER4	22	40
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1ccc(Cl)cc1	ZINC000875000035	DH	On-Demand	Anodyne	UTS2	44	35
O=C(Oc1ccc(Oc2ccccn2)cc1)c1ccc(NC(=O)c2cccs2)cc1	ZINC000875000054	HK	On-Demand	Anodyne	ACR	67	40
C[C@H](NC(=O)N1C[C@@H]2CN(C(=O)OC(C)(C)C)C[C@]2(C)C1)c1ccccn1	ZINC000875000078	FG	On-Demand	Anodyne	GPR119	20	41
C[C@@H](NC(=O)N1C[C@@H]2CN(C(=O)OC(C)(C)C)C[C@]2(C)C1)c1ccccn1	ZINC000875000079	FG	On-Demand	Anodyne	GPR119	20	41
CCOc1ccccc1OC(=O)[C@H]1COCCN1CC	ZINC000875000105	CD	On-Demand	Anodyne	HCN1	52	36
CCOc1ccccc1OC(=O)[C@H]1COCCN1CC	ZINC000875000105	CD	On-Demand	Anodyne	HCN4	44	34
CCOc1ccccc1OC(=O)[C@@H]1COCCN1CC	ZINC000875000106	CD	On-Demand	Anodyne	HCN1	52	36
CCOc1ccccc1OC(=O)[C@@H]1COCCN1CC	ZINC000875000106	CD	On-Demand	Anodyne	HCN4	44	34
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)c1ccccn1	ZINC000875000134	FG	On-Demand	Anodyne	OPRL1	16	44
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)c1ccccn1	ZINC000875000135	FG	On-Demand	Anodyne	OPRL1	16	44
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1Cl	ZINC000875000136	FD	On-Demand	Anodyne	CXCL8	22	42
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1Cl	ZINC000875000136	FD	On-Demand	Anodyne	EPHX2	25	44
CC(=O)C1CCN(C(=O)C(=O)NCCc2cccc(Cl)c2)CC1	ZINC000875000154	ED	On-Demand	Anodyne	EPHX2	17	52
CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)Oc3ccc(Oc4ccccn4)cc3)cc2)CC1	ZINC000875000186	JF	On-Demand	Anodyne	TGM2	66	37
CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)Oc3ccc(Oc4ccccn4)cc3)cc2)CC1	ZINC000875000186	JF	On-Demand	Anodyne	F13A1	62	37
O=C(Cc1csc(NC(=O)c2ccccc2)n1)Oc1ccc(Oc2ccccn2)cc1	ZINC000875000253	IJ	On-Demand	Anodyne	GCK	21	46
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1cccc(Cl)c1	ZINC000875000258	EE	On-Demand	Anodyne	CACNA1H	63	49
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1cccc(Cl)c1	ZINC000875000258	EE	On-Demand	Anodyne	CCR1	40	37
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1cccc(Cl)c1	ZINC000875000258	EE	On-Demand	Anodyne	MAPK1	44	38
C[C@@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1cccc(Cl)c1	ZINC000875000267	FF	On-Demand	Anodyne	MAPK1	42	37
C[C@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1cccc(Cl)c1	ZINC000875000268	FF	On-Demand	Anodyne	MAPK1	42	37
O=C1CCN(C(=O)C(=O)NCCc2cccc(Cl)c2)CCCCCCN1	ZINC000875000280	GD	On-Demand	Anodyne	DPP7	20	42
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1Cl	ZINC000875000281	DH	On-Demand	Anodyne	OPRL1	33	40
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1Cl	ZINC000875000282	DH	On-Demand	Anodyne	OPRL1	33	40
CCOc1ccccc1OC(=O)c1cc(CC)nn1C	ZINC000875000299	CF	On-Demand	Anodyne	INHA	53	33
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccccc1Cl	ZINC000875000300	EE	On-Demand	Anodyne	CACNA1H	43	41
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccccc1Cl	ZINC000875000300	EE	On-Demand	Anodyne	OPRL1	40	39
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccccc1Cl	ZINC000875000300	EE	On-Demand	Anodyne	CCR1	41	38
C[C@H]1CCCCN1C(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875000319	EI	On-Demand	Anodyne	PREP	30	42
C[C@@H]1CCCCN1C(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875000320	EI	On-Demand	Anodyne	PREP	30	42
CCOc1ccccc1OC(=O)[C@@H]1CCN(C)C[C@H]1c1cnn(C)c1	ZINC000875000322	EE	On-Demand	Anodyne	HCN1	50	35
CCOc1ccccc1OC(=O)[C@@H]1CCN(C)C[C@H]1c1cnn(C)c1	ZINC000875000322	EE	On-Demand	Anodyne	HCN4	42	33
CCOc1ccccc1OC(=O)[C@H]1CCN(C)C[C@H]1c1cnn(C)c1	ZINC000875000323	EE	On-Demand	Anodyne	HCN1	50	35
CCOc1ccccc1OC(=O)[C@H]1CCN(C)C[C@H]1c1cnn(C)c1	ZINC000875000323	EE	On-Demand	Anodyne	HCN4	42	33
CCOc1ccccc1OC(=O)[C@@H]1CCN(C)C[C@@H]1c1cnn(C)c1	ZINC000875000324	EE	On-Demand	Anodyne	HCN1	50	35
CCOc1ccccc1OC(=O)[C@@H]1CCN(C)C[C@@H]1c1cnn(C)c1	ZINC000875000324	EE	On-Demand	Anodyne	HCN4	42	33
CCOc1ccccc1OC(=O)[C@H]1CCN(C)C[C@@H]1c1cnn(C)c1	ZINC000875000325	EE	On-Demand	Anodyne	HCN1	50	35
CCOc1ccccc1OC(=O)[C@H]1CCN(C)C[C@@H]1c1cnn(C)c1	ZINC000875000325	EE	On-Demand	Anodyne	HCN4	42	33
CCOc1ccccc1OC(=O)COCc1ccnc(OC)c1	ZINC000875000326	DF	On-Demand	Anodyne	ALS	23	40
Cc1ccccc1CNC(=O)C(=O)NCc1ccc(C2(C)OCCO2)cc1	ZINC000875000336	FE	On-Demand	Anodyne	AMP1_PLAFQ	29	43
CC(=O)N1CCN(c2ccc(C(=O)Oc3ccc(Oc4ccccn4)cc3)cc2[N+](=O)[O-])CC1	ZINC000875000351	JH	On-Demand	Bother	PDGFRB	22	41
Cc1ccccc1CNC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875000354	FF	On-Demand	Anodyne	C3AR1	41	41
Cc1ccccc1CNC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875000354	FF	On-Demand	Anodyne	AMP1_PLAFQ	16	43
Cc1ccccc1CNC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875000355	FF	On-Demand	Anodyne	C3AR1	41	41
Cc1ccccc1CNC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875000355	FF	On-Demand	Anodyne	AMP1_PLAFQ	16	43
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccc(Cl)cc1	ZINC000875000365	DH	On-Demand	Anodyne	CACNA1H	46	42
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccc(Cl)cc1	ZINC000875000365	DH	On-Demand	Anodyne	PRCP	29	52
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccc(Cl)cc1	ZINC000875000365	DH	On-Demand	Anodyne	CCR1	63	39
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccc(Cl)cc1	ZINC000875000366	DH	On-Demand	Anodyne	CACNA1H	46	42
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccc(Cl)cc1	ZINC000875000366	DH	On-Demand	Anodyne	PRCP	29	52
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccc(Cl)cc1	ZINC000875000366	DH	On-Demand	Anodyne	CCR1	63	39
C[C@@H]1CN(Cc2ccccc2)C[C@H]1CNC(=O)C(=O)NC[C@@H]1CC1(Cl)Cl	ZINC000875000382	GE	On-Demand	Anodyne	DRD4	17	50
C[C@@H]1CN(Cc2ccccc2)C[C@H]1CNC(=O)C(=O)NC[C@H]1CC1(Cl)Cl	ZINC000875000383	GE	On-Demand	Anodyne	DRD4	17	50
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1CNC(=O)C(=O)NC[C@@H]1CC1(Cl)Cl	ZINC000875000384	GE	On-Demand	Anodyne	DRD4	17	50
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1CNC(=O)C(=O)NC[C@H]1CC1(Cl)Cl	ZINC000875000385	GE	On-Demand	Anodyne	DRD4	17	50
Cn1cnc(-c2nnc3n2CCN(C(=O)C(=O)NCCc2ccccc2F)C3)c1	ZINC000875000394	GC	On-Demand	Anodyne	P2RX7	27	43
CC[C@@H](NC(=O)C(=O)NCCc1ccccc1F)c1cccc(OC)c1OC	ZINC000875000396	GF	On-Demand	Anodyne	MTNR1A	45	39
CCC[C@H](NC(=O)C(=O)N1CC[C@H]2[C@@H](CCN2C)C1)c1ccccc1	ZINC000875000397	EE	On-Demand	Anodyne	CCR5	51	42
CCC[C@H](NC(=O)C(=O)N1CC[C@@H]2[C@H](CCN2C)C1)c1ccccc1	ZINC000875000398	EE	On-Demand	Anodyne	CCR5	51	42
CCC[C@H](NC(=O)C(=O)N1CC[C@@H]2[C@@H](CCN2C)C1)c1ccccc1	ZINC000875000399	EE	On-Demand	Anodyne	CCR5	51	42
CCC[C@H](NC(=O)C(=O)N1CC[C@H]2[C@H](CCN2C)C1)c1ccccc1	ZINC000875000400	EE	On-Demand	Anodyne	CCR5	51	42
C[C@H](NC(=O)C(=O)NCCc1ccccc1F)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875000411	GD	On-Demand	Anodyne	SSTR2	40	34
C[C@H](NC(=O)C(=O)NCCc1ccccc1F)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875000411	GD	On-Demand	Anodyne	GPR119	20	53
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(Cl)cc1	ZINC000875000416	CE	On-Demand	Anodyne	PRCP	15	40
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(Cl)cc1	ZINC000875000417	CE	On-Demand	Anodyne	PRCP	15	40
C[C@@H](NC(=O)N(C)CCN1CC2(CCOCC2)C1)c1ccc2ccccc2c1	ZINC000875000439	GH	On-Demand	Anodyne	CASR	41	34
C[C@@H](NC(=O)N1CC(CNC(=O)C(F)(F)F)C1)c1ccccc1Cl	ZINC000875000464	FF	On-Demand	Anodyne	CACNA1I	44	32
CCCCCCCNC(=O)C(=O)NCc1cn2ccccc2n1	ZINC000875000471	DE	On-Demand	Mild	ASAH1	98	38
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1cccc(Cl)c1	ZINC000875000497	DH	On-Demand	Anodyne	PDS	23	40
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H](C)c1ccccc1Cl	ZINC000875000499	FG	On-Demand	Anodyne	CACNA1I	49	32
COCCN(CC1CCN(C)CC1)C(=O)N[C@H](C)c1ccccc1Cl	ZINC000875000500	FG	On-Demand	Anodyne	CACNA1I	49	32
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H]2CCc3ccccc3C2)C1	ZINC000875000507	ED	On-Demand	Anodyne	PREP	42	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCc3ccccc3C2)C1	ZINC000875000508	ED	On-Demand	Anodyne	PREP	42	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H]2CCc3ccccc3C2)C1	ZINC000875000509	ED	On-Demand	Anodyne	PREP	42	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCc3ccccc3C2)C1	ZINC000875000510	ED	On-Demand	Anodyne	PREP	42	41
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1cccc(Cl)c1	ZINC000875000515	EH	On-Demand	Anodyne	CACNA1H	57	46
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1cccc(Cl)c1	ZINC000875000515	EH	On-Demand	Anodyne	CCR1	43	39
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1ccc(Cl)cc1	ZINC000875000531	EH	On-Demand	Anodyne	CACNA1H	54	48
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1ccc(Cl)cc1	ZINC000875000531	EH	On-Demand	Anodyne	PRCP	20	42
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1ccc(Cl)cc1	ZINC000875000531	EH	On-Demand	Anodyne	CCR1	59	44
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1ccc(Cl)cc1	ZINC000875000531	EH	On-Demand	Anodyne	MAPK1	40	36
CCC[C@H](NC(=O)C(=O)N(C)CCN1CC2(CCOCC2)C1)c1ccccc1	ZINC000875000561	GE	On-Demand	Anodyne	CASR	50	38
CCC[C@@H](NC(=O)C(=O)N(C)CCN1CC2(CCOCC2)C1)c1ccccc1	ZINC000875000564	GE	On-Demand	Anodyne	CASR	50	38
C[C@@H](NC(=O)N(C)CCS(N)(=O)=O)c1ccc(-c2ccccc2)cc1	ZINC000875000566	FE	On-Demand	Anodyne	ACACA	24	45
C[C@@H](NC(=O)N(C)CCS(N)(=O)=O)c1ccc(-c2ccccc2)cc1	ZINC000875000566	FE	On-Demand	Anodyne	ACACB	23	45
C[C@@H](NC(=O)N(C)CCS(N)(=O)=O)c1ccc(-c2ccccc2)cc1	ZINC000875000566	FE	On-Demand	Anodyne	MMP2	17	41
C[C@@H](NC(=O)N(C)CCS(N)(=O)=O)c1ccc(-c2ccccc2)cc1	ZINC000875000566	FE	On-Demand	Anodyne	MMP8	15	41
C[C@@H](NC(=O)N(C)CCS(N)(=O)=O)c1ccc(-c2ccccc2)cc1	ZINC000875000566	FE	On-Demand	Anodyne	ACE2	43	34
C[C@@H](NC(=O)N(C)CCS(N)(=O)=O)c1ccc(-c2ccccc2)cc1	ZINC000875000566	FE	On-Demand	Anodyne	UTS2	70	40
O=C(NC[C@H]1CC1(Cl)Cl)C(=O)N1CCN(c2cccc(F)c2)CC1	ZINC000875000567	FD	On-Demand	Anodyne	SSTR1	21	45
O=C(NC[C@@H]1CC1(Cl)Cl)C(=O)N1CCN(c2cccc(F)c2)CC1	ZINC000875000568	FD	On-Demand	Anodyne	SSTR1	21	45
CCc1ccc([C@H](C)NC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)cc1	ZINC000875000569	EG	On-Demand	Anodyne	SLC6A4	26	48
CCc1ccc([C@H](C)NC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)cc1	ZINC000875000569	EG	On-Demand	Anodyne	SLC6A3	55	48
CCc1ccc([C@H](C)NC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)cc1	ZINC000875000570	EG	On-Demand	Anodyne	SLC6A4	26	48
CCc1ccc([C@H](C)NC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)cc1	ZINC000875000570	EG	On-Demand	Anodyne	SLC6A3	55	48
CC[C@H](C[C@H](C)O)NC(=O)NCC(C)(C)N1CCCCC1	ZINC000875000575	CE	On-Demand	Anodyne	RIR1_HHV11	46	36
CC(=O)C1CCN(C(=O)C(=O)NCCc2ccccc2F)CC1	ZINC000875000621	DD	On-Demand	Anodyne	CACNA1G	22	42
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1ccc(Cl)cc1	ZINC000875000623	EH	On-Demand	Anodyne	SLC6A3	21	44
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1ccc(Cl)cc1	ZINC000875000623	EH	On-Demand	Anodyne	PRCP	22	43
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1ccc(Cl)cc1	ZINC000875000624	EH	On-Demand	Anodyne	SLC6A3	21	44
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1ccc(Cl)cc1	ZINC000875000624	EH	On-Demand	Anodyne	PRCP	22	43
COC(=O)C1=NO[C@]2(CCN(C(=O)N[C@@H](C)c3ccc(Cl)cc3)C2)C1	ZINC000875000647	FF	On-Demand	Anodyne	CCR1	44	35
COC(=O)C1=NO[C@@]2(CCN(C(=O)N[C@H](C)c3ccc(Cl)cc3)C2)C1	ZINC000875000648	FF	On-Demand	Anodyne	CCR1	44	35
COC(=O)C1=NO[C@@]2(CCN(C(=O)N[C@@H](C)c3ccc(Cl)cc3)C2)C1	ZINC000875000649	FF	On-Demand	Anodyne	CCR1	44	35
COC(=O)C1=NO[C@]2(CCN(C(=O)N[C@H](C)c3ccc(Cl)cc3)C2)C1	ZINC000875000650	FF	On-Demand	Anodyne	CCR1	44	35
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](CC(C)C)c1ccccc1	ZINC000875000652	EE	On-Demand	Mild	PTGER3	75	39
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](CC(C)C)c1ccccc1	ZINC000875000653	EE	On-Demand	Mild	PTGER3	75	39
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H](CC(C)C)c1ccccc1	ZINC000875000654	EE	On-Demand	Mild	PTGER3	75	39
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H](CC(C)C)c1ccccc1	ZINC000875000655	EE	On-Demand	Mild	PTGER3	75	39
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(Cl)cc1	ZINC000875000658	EE	On-Demand	Anodyne	CACNA1H	57	48
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(Cl)cc1	ZINC000875000658	EE	On-Demand	Anodyne	PTGER4	25	41
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(Cl)cc1	ZINC000875000658	EE	On-Demand	Anodyne	PRCP	21	44
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(Cl)cc1	ZINC000875000658	EE	On-Demand	Anodyne	CCR1	65	42
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(Cl)cc1	ZINC000875000658	EE	On-Demand	Anodyne	MAPK1	41	38
CC(=O)C1CCN(C(=O)C(=O)N[C@H](CC(C)C)c2ccccc2)CC1	ZINC000875000660	EF	On-Demand	Anodyne	CCR5	30	49
CC(=O)C1CCN(C(=O)C(=O)N[C@H](CC(C)C)c2ccccc2)CC1	ZINC000875000660	EF	On-Demand	Anodyne	CAPN2	59	36
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](CC(C)C)c2ccccc2)CC1	ZINC000875000661	EF	On-Demand	Anodyne	CCR5	30	49
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](CC(C)C)c2ccccc2)CC1	ZINC000875000661	EF	On-Demand	Anodyne	CAPN2	59	36
COCC(C)(C)CCNC(=O)C(=O)N[C@@H](CC(C)C)c1ccccc1	ZINC000875000662	EG	On-Demand	Anodyne	PTGER3	41	36
COCC(C)(C)CCNC(=O)C(=O)N[C@@H](CC(C)C)c1ccccc1	ZINC000875000662	EG	On-Demand	Anodyne	CAPN1	44	35
COCC(C)(C)CCNC(=O)C(=O)N[C@@H](CC(C)C)c1ccccc1	ZINC000875000662	EG	On-Demand	Anodyne	CAPN2	80	34
O=C(Oc1ccc(Oc2ccccn2)cc1)c1cccc(NC(=O)c2cccs2)c1	ZINC000875000671	HK	On-Demand	Anodyne	KCNK3	72	53
O=C(Oc1ccc(Oc2ccccn2)cc1)c1cccc(NC(=O)c2cccs2)c1	ZINC000875000671	HK	On-Demand	Anodyne	KCNK9	43	53
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H](C)c1cccc(Cl)c1	ZINC000875000701	FG	On-Demand	Anodyne	CACNA1I	51	39
COCCN(CC1CCN(C)CC1)C(=O)N[C@H](C)c1cccc(Cl)c1	ZINC000875000702	FG	On-Demand	Anodyne	CACNA1I	51	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccccc1Cl	ZINC000875000705	EG	On-Demand	Anodyne	SLC6A4	29	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccccc1Cl	ZINC000875000705	EG	On-Demand	Anodyne	OPRL1	42	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccccc1Cl	ZINC000875000705	EG	On-Demand	Anodyne	SLC6A3	61	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccccc1Cl	ZINC000875000706	EG	On-Demand	Anodyne	SLC6A4	29	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccccc1Cl	ZINC000875000706	EG	On-Demand	Anodyne	OPRL1	42	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccccc1Cl	ZINC000875000706	EG	On-Demand	Anodyne	SLC6A3	61	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccccc1Cl	ZINC000875000707	EG	On-Demand	Anodyne	SLC6A4	29	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccccc1Cl	ZINC000875000707	EG	On-Demand	Anodyne	OPRL1	42	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccccc1Cl	ZINC000875000707	EG	On-Demand	Anodyne	SLC6A3	61	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccccc1Cl	ZINC000875000708	EG	On-Demand	Anodyne	SLC6A4	29	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccccc1Cl	ZINC000875000708	EG	On-Demand	Anodyne	OPRL1	42	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccccc1Cl	ZINC000875000708	EG	On-Demand	Anodyne	SLC6A3	61	42
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1Cl	ZINC000875000718	DG	On-Demand	Anodyne	CCR1	41	37
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1Cl	ZINC000875000721	DG	On-Demand	Anodyne	CCR1	41	37
COCC(C)(C)CCNC(=O)C(=O)N[C@H](CC(C)C)c1ccccc1	ZINC000875000747	EG	On-Demand	Anodyne	PTGER3	41	36
COCC(C)(C)CCNC(=O)C(=O)N[C@H](CC(C)C)c1ccccc1	ZINC000875000747	EG	On-Demand	Anodyne	CAPN1	44	35
COCC(C)(C)CCNC(=O)C(=O)N[C@H](CC(C)C)c1ccccc1	ZINC000875000747	EG	On-Demand	Anodyne	CAPN2	80	34
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(Cl)cc1	ZINC000875000749	EG	On-Demand	Anodyne	SLC6A2	17	47
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(Cl)cc1	ZINC000875000749	EG	On-Demand	Anodyne	SLC6A4	35	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(Cl)cc1	ZINC000875000749	EG	On-Demand	Anodyne	SLC6A3	78	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(Cl)cc1	ZINC000875000749	EG	On-Demand	Anodyne	PRCP	21	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(Cl)cc1	ZINC000875000752	EG	On-Demand	Anodyne	SLC6A2	17	47
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(Cl)cc1	ZINC000875000752	EG	On-Demand	Anodyne	SLC6A4	35	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(Cl)cc1	ZINC000875000752	EG	On-Demand	Anodyne	SLC6A3	78	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(Cl)cc1	ZINC000875000752	EG	On-Demand	Anodyne	PRCP	21	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(Cl)cc1	ZINC000875000754	EG	On-Demand	Anodyne	SLC6A2	17	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(Cl)cc1	ZINC000875000754	EG	On-Demand	Anodyne	SLC6A4	35	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(Cl)cc1	ZINC000875000754	EG	On-Demand	Anodyne	SLC6A3	78	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(Cl)cc1	ZINC000875000754	EG	On-Demand	Anodyne	PRCP	21	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(Cl)cc1	ZINC000875000756	EG	On-Demand	Anodyne	SLC6A2	17	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(Cl)cc1	ZINC000875000756	EG	On-Demand	Anodyne	SLC6A4	35	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(Cl)cc1	ZINC000875000756	EG	On-Demand	Anodyne	SLC6A3	78	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(Cl)cc1	ZINC000875000756	EG	On-Demand	Anodyne	PRCP	21	44
C[C@@H](NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)c1ccccn1	ZINC000875000757	EF	On-Demand	Anodyne	FAAH	20	41
O=C(Oc1ccc(Oc2ccccn2)cc1)C1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1	ZINC000875000763	JI	On-Demand	Anodyne	EPHX2	21	43
C[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1ccc(-c2ccccc2)cc1	ZINC000875000780	GH	On-Demand	Anodyne	CACNA1H	36	46
C[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1ccc(-c2ccccc2)cc1	ZINC000875000780	GH	On-Demand	Anodyne	GHRHR	79	36
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccc(Cl)c(Cl)c1	ZINC000875000781	EF	On-Demand	Anodyne	MAPK1	47	46
CCc1ccc([C@H](C)NC(=O)N(CCOC)C2CCOCC2)cc1	ZINC000875000785	EG	On-Demand	Anodyne	ACACA	15	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccccn1	ZINC000875000796	DD	On-Demand	Anodyne	SLC6A4	23	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccccn1	ZINC000875000796	DD	On-Demand	Anodyne	SLC6A3	48	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccccn1	ZINC000875000798	DD	On-Demand	Anodyne	SLC6A4	23	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccccn1	ZINC000875000798	DD	On-Demand	Anodyne	SLC6A3	48	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccccn1	ZINC000875000800	DD	On-Demand	Anodyne	SLC6A4	23	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccccn1	ZINC000875000800	DD	On-Demand	Anodyne	SLC6A3	48	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccccn1	ZINC000875000802	DD	On-Demand	Anodyne	SLC6A4	23	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccccn1	ZINC000875000802	DD	On-Demand	Anodyne	SLC6A3	48	43
COC(=O)N(C)NC(=O)N[C@H](C)c1ccc2ccccc2c1	ZINC000875000815	DF	On-Demand	Reactive	UTS2	43	43
Cc1ccccc1CNC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875000816	DD	On-Demand	Anodyne	AMP1_PLAFQ	21	44
COC(=O)N(C)NC(=O)N[C@@H](C)c1ccc2ccccc2c1	ZINC000875000817	DF	On-Demand	Reactive	UTS2	43	43
Cc1ccccc1CNC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875000818	DD	On-Demand	Anodyne	AMP1_PLAFQ	21	44
CCN(CCNC(=O)OC(C)(C)C)C(=O)C(=O)NCCc1ccccc1F	ZINC000875000846	GD	On-Demand	Anodyne	NQO2	16	46
CCN(CCNC(=O)OC(C)(C)C)C(=O)C(=O)NCCc1ccccc1F	ZINC000875000846	GD	On-Demand	Anodyne	PAPA1_CARPA	16	42
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(Cl)cc1	ZINC000875000849	DG	On-Demand	Anodyne	CACNA1H	52	43
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(Cl)cc1	ZINC000875000849	DG	On-Demand	Anodyne	PRCP	36	49
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(Cl)cc1	ZINC000875000849	DG	On-Demand	Anodyne	CCR1	63	42
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(Cl)cc1	ZINC000875000851	DG	On-Demand	Anodyne	CACNA1H	52	43
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(Cl)cc1	ZINC000875000851	DG	On-Demand	Anodyne	PRCP	36	49
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(Cl)cc1	ZINC000875000851	DG	On-Demand	Anodyne	CCR1	63	42
CCc1ccc([C@H](C)NC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875000857	DH	On-Demand	Clean	PTGER4	24	40
CCC[C@H](NC(=O)C(=O)N1CC[C@H]2CSC[C@H]2C1)c1ccccc1	ZINC000875000859	EF	On-Demand	Anodyne	CCR5	40	41
CCC[C@H](NC(=O)C(=O)N1CC[C@@H]2CSC[C@@H]2C1)c1ccccc1	ZINC000875000861	EF	On-Demand	Anodyne	CCR5	40	41
CCC[C@H](NC(=O)C(=O)N1CC[C@H]2CSC[C@@H]2C1)c1ccccc1	ZINC000875000863	EF	On-Demand	Anodyne	CCR5	40	41
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1cccc(Cl)c1	ZINC000875000864	DH	On-Demand	Anodyne	CACNA1H	42	40
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1cccc(Cl)c1	ZINC000875000864	DH	On-Demand	Anodyne	REN	17	48
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1cccc(Cl)c1	ZINC000875000865	DH	On-Demand	Anodyne	CACNA1H	42	40
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1cccc(Cl)c1	ZINC000875000865	DH	On-Demand	Anodyne	REN	17	48
CCC[C@H](NC(=O)C(=O)N1CC[C@@H]2CSC[C@H]2C1)c1ccccc1	ZINC000875000866	EF	On-Demand	Anodyne	CCR5	40	41
O=C(NCCc1ccccc1F)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875000873	FE	On-Demand	Anodyne	DPP4	21	40
O=C(NCCc1ccccc1F)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875000874	FE	On-Demand	Anodyne	DPP4	21	40
O=C(NCCc1ccccc1F)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875000875	FE	On-Demand	Anodyne	DPP4	21	40
O=C(NCCc1ccccc1F)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875000876	FE	On-Demand	Anodyne	DPP4	21	40
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccc(Br)cc1	ZINC000875000891	GE	On-Demand	Anodyne	PRCP	15	42
CN(C)[C@@H](CNC(=O)NNC(=O)c1nc2ccccc2s1)Cc1ccccc1	ZINC000875000939	GE	On-Demand	Reactive	ST14	42	38
CN(C)[C@@H](CNC(=O)NNC(=O)c1nc2ccccc2s1)Cc1ccccc1	ZINC000875000939	GE	On-Demand	Reactive	TMPRSS6	69	38
CCOC1CC2(C1)C[C@H]2NC(=O)NC[C@@H](c1ccccc1OC)N1CCCC1	ZINC000875000951	GG	On-Demand	Anodyne	HCN1	60	32
CCOC1CC2(C1)C[C@H]2NC(=O)NC[C@@H](c1ccccc1OC)N1CCCC1	ZINC000875000951	GG	On-Demand	Anodyne	HCN4	49	32
CCOC1CC2(C1)C[C@@H]2NC(=O)NC[C@H](c1ccccc1OC)N1CCCC1	ZINC000875000952	GG	On-Demand	Anodyne	HCN1	60	32
CCOC1CC2(C1)C[C@@H]2NC(=O)NC[C@H](c1ccccc1OC)N1CCCC1	ZINC000875000952	GG	On-Demand	Anodyne	HCN4	49	32
CCOC1CC2(C1)C[C@@H]2NC(=O)NC[C@@H](c1ccccc1OC)N1CCCC1	ZINC000875000953	GG	On-Demand	Anodyne	HCN1	60	32
CCOC1CC2(C1)C[C@@H]2NC(=O)NC[C@@H](c1ccccc1OC)N1CCCC1	ZINC000875000953	GG	On-Demand	Anodyne	HCN4	49	32
CCOC1CC2(C1)C[C@H]2NC(=O)NC[C@H](c1ccccc1OC)N1CCCC1	ZINC000875000954	GG	On-Demand	Anodyne	HCN1	60	32
CCOC1CC2(C1)C[C@H]2NC(=O)NC[C@H](c1ccccc1OC)N1CCCC1	ZINC000875000954	GG	On-Demand	Anodyne	HCN4	49	32
NC(=O)c1c(NC(=O)Cc2ccc3cnccc3c2)sc2c1CCCC2	ZINC000875000957	FG	On-Demand	Anodyne	VIPR1	27	43
O=C(NCCCCCCc1ccccc1)C(=O)NCc1nnc2n1CCCCC2	ZINC000875000958	GF	On-Demand	Anodyne	ACE	26	41
O=C(NCCCCCCc1ccccc1)C(=O)NCc1nnc2n1CCCCC2	ZINC000875000958	GF	On-Demand	Anodyne	FKBP1A	25	42
O=C(NCCCCCCc1ccccc1)C(=O)NCc1nnc2n1CCCCC2	ZINC000875000958	GF	On-Demand	Anodyne	FAAH	43	39
O=C(NCCCCCCc1ccccc1)C(=O)NCc1nnc2n1CCCCC2	ZINC000875000958	GF	On-Demand	Anodyne	CES1	42	33
O=C(NCCCCCCc1ccccc1)C(=O)NCc1nnc2n1CCCCC2	ZINC000875000958	GF	On-Demand	Anodyne	DPP7	32	41
O=C(NCCCCCCc1ccccc1)C(=O)NCc1nnc2n1CCCCC2	ZINC000875000958	GF	On-Demand	Anodyne	AMP1_PLAFQ	18	40
O=C(NCCc1ccccc1F)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875001000	GF	On-Demand	Anodyne	C3AR1	43	42
O=C(NCCc1ccccc1F)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875001001	GF	On-Demand	Anodyne	C3AR1	43	42
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccc(Cl)c(Cl)c1	ZINC000875001006	GF	On-Demand	Anodyne	MAPK1	48	46
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccc(Cl)c(Cl)c1	ZINC000875001006	GF	On-Demand	Anodyne	EPHX2	21	45
CN1CCN(C2CCN(C(=O)C(=O)NCCc3ccccc3F)CC2)CC1	ZINC000875001008	GC	On-Demand	Anodyne	L3MBTL3	61	40
CS(=O)(=O)N1CCCc2cc(C(=O)Oc3ccc(Oc4ccccn4)cc3)ccc21	ZINC000875001043	HH	On-Demand	Anodyne	SRD5A1	19	41
COC(=O)C1(O)CN(C(=O)N[C@H](C)c2ccc(Cl)c(Cl)c2)C1	ZINC000875001044	ED	On-Demand	Anodyne	MAPK1	40	47
COC(=O)C1(O)CN(C(=O)N[C@@H](C)c2ccc(Cl)c(Cl)c2)C1	ZINC000875001045	ED	On-Demand	Anodyne	MAPK1	40	47
CONC(=O)C1CCN(C(=O)N[C@@H](C)c2ccc(-c3ccccc3)cc2)CC1	ZINC000875001070	GH	On-Demand	Anodyne	ACACA	22	42
CONC(=O)C1CCN(C(=O)N[C@@H](C)c2ccc(-c3ccccc3)cc2)CC1	ZINC000875001070	GH	On-Demand	Anodyne	PRCP	22	41
CONC(=O)C1CCN(C(=O)N[C@@H](C)c2ccc(-c3ccccc3)cc2)CC1	ZINC000875001070	GH	On-Demand	Anodyne	ACACB	22	42
CONC(=O)C1CCN(C(=O)N[C@@H](C)c2ccc(-c3ccccc3)cc2)CC1	ZINC000875001070	GH	On-Demand	Anodyne	BIRC8	45	33
CONC(=O)C1CCN(C(=O)N[C@H](C)c2ccc(-c3ccccc3)cc2)CC1	ZINC000875001071	GH	On-Demand	Anodyne	ACACA	22	42
CONC(=O)C1CCN(C(=O)N[C@H](C)c2ccc(-c3ccccc3)cc2)CC1	ZINC000875001071	GH	On-Demand	Anodyne	PRCP	22	41
CONC(=O)C1CCN(C(=O)N[C@H](C)c2ccc(-c3ccccc3)cc2)CC1	ZINC000875001071	GH	On-Demand	Anodyne	ACACB	22	42
CONC(=O)C1CCN(C(=O)N[C@H](C)c2ccc(-c3ccccc3)cc2)CC1	ZINC000875001071	GH	On-Demand	Anodyne	BIRC8	45	33
CCC[C@@H](NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1)c1ccccc1	ZINC000875001082	EE	On-Demand	Anodyne	SLC6A1	53	38
CCC[C@@H](NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1)c1ccccc1	ZINC000875001082	EE	On-Demand	Anodyne	CTSK	24	40
CCC[C@@H](NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1)c1ccccc1	ZINC000875001082	EE	On-Demand	Anodyne	CCR5	47	46
CCC[C@@H](NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1)c1ccccc1	ZINC000875001083	EE	On-Demand	Anodyne	SLC6A1	53	38
CCC[C@@H](NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1)c1ccccc1	ZINC000875001083	EE	On-Demand	Anodyne	CTSK	24	40
CCC[C@@H](NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1)c1ccccc1	ZINC000875001083	EE	On-Demand	Anodyne	CCR5	47	46
CCC[C@H](NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1)c1ccccc1	ZINC000875001084	EE	On-Demand	Anodyne	SLC6A1	53	38
CCC[C@H](NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1)c1ccccc1	ZINC000875001084	EE	On-Demand	Anodyne	CTSK	24	40
CCC[C@H](NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1)c1ccccc1	ZINC000875001084	EE	On-Demand	Anodyne	CCR5	47	46
CCC[C@H](NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1)c1ccccc1	ZINC000875001085	EE	On-Demand	Anodyne	SLC6A1	53	38
CCC[C@H](NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1)c1ccccc1	ZINC000875001085	EE	On-Demand	Anodyne	CTSK	24	40
CCC[C@H](NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1)c1ccccc1	ZINC000875001085	EE	On-Demand	Anodyne	CCR5	47	46
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1cccc(C(F)(F)F)c1	ZINC000875001113	EH	On-Demand	Anodyne	PDS	42	35
C[C@@H](NC(=O)NC[C@@H](Cc1ccccc1)N(C)C)c1ccnn1C	ZINC000875001121	ED	On-Demand	Anodyne	MME	45	34
C[C@H](NC(=O)NC[C@H](Cc1ccccc1)N(C)C)c1ccnn1C	ZINC000875001123	ED	On-Demand	Anodyne	MME	45	34
C[C@@H](NC(=O)NC[C@H](Cc1ccccc1)N(C)C)c1ccnn1C	ZINC000875001124	ED	On-Demand	Anodyne	MME	45	34
CN(C)[C@@H](CNC(=O)N1CCN([S@](C)(=N)=O)CC1)Cc1ccccc1	ZINC000875001125	FD	On-Demand	Anodyne	TRY2_BOVIN	47	38
CN(C)[C@@H](CNC(=O)N1CCN([S@](C)(=N)=O)CC1)Cc1ccccc1	ZINC000875001125	FD	On-Demand	Anodyne	CAPN2	46	34
CN(C)[C@@H](CNC(=O)N1CCN([S@@](C)(=N)=O)CC1)Cc1ccccc1	ZINC000875001128	FD	On-Demand	Anodyne	TRY2_BOVIN	47	38
CN(C)[C@@H](CNC(=O)N1CCN([S@@](C)(=N)=O)CC1)Cc1ccccc1	ZINC000875001128	FD	On-Demand	Anodyne	CAPN2	46	34
CCn1ncc(CNC(=O)NC[C@@H](c2ccccc2OC)N2CCCC2)n1	ZINC000875001135	FD	On-Demand	Anodyne	HCN1	66	36
CCn1ncc(CNC(=O)NC[C@@H](c2ccccc2OC)N2CCCC2)n1	ZINC000875001135	FD	On-Demand	Anodyne	HCN4	50	36
CCn1ncc(CNC(=O)NC[C@H](c2ccccc2OC)N2CCCC2)n1	ZINC000875001136	FD	On-Demand	Anodyne	HCN1	66	36
CCn1ncc(CNC(=O)NC[C@H](c2ccccc2OC)N2CCCC2)n1	ZINC000875001136	FD	On-Demand	Anodyne	HCN4	50	36
N#CCc1ccsc1C(=O)Nc1sc2c(c1C(N)=O)CCCC2	ZINC000875001142	EG	On-Demand	Mild	VIPR1	27	42
CN(C)[C@@H](CNC(=O)N1CCC[C@@H](C(C)(C)O)C1)Cc1ccccc1	ZINC000875001152	EE	On-Demand	Anodyne	OPRM1	25	41
CN(C)[C@@H](CNC(=O)N1CCC[C@@H](C(C)(C)O)C1)Cc1ccccc1	ZINC000875001152	EE	On-Demand	Anodyne	NPFFR2	41	30
CN(C)[C@@H](CNC(=O)N1CCC[C@@H](C(C)(C)O)C1)Cc1ccccc1	ZINC000875001152	EE	On-Demand	Anodyne	AMY2	46	32
CN(C)[C@@H](CNC(=O)N1CCC[C@H](C(C)(C)O)C1)Cc1ccccc1	ZINC000875001154	EE	On-Demand	Anodyne	OPRM1	25	41
CN(C)[C@@H](CNC(=O)N1CCC[C@H](C(C)(C)O)C1)Cc1ccccc1	ZINC000875001154	EE	On-Demand	Anodyne	NPFFR2	41	30
CN(C)[C@@H](CNC(=O)N1CCC[C@H](C(C)(C)O)C1)Cc1ccccc1	ZINC000875001154	EE	On-Demand	Anodyne	AMY2	46	32
Cc1ccnn1-c1ccc(C(=O)Oc2ccc(Oc3ccccn3)cc2)cc1	ZINC000875001173	FJ	On-Demand	Anodyne	ACR	49	34
CS[C@@H]1C[C@@H](NC(=O)NC[C@@H](Cc2ccccc2)N(C)C)C1	ZINC000875001180	DE	On-Demand	Anodyne	MME	42	36
CS[C@@H]1C[C@@H](NC(=O)NC[C@H](Cc2ccccc2)N(C)C)C1	ZINC000875001181	DE	On-Demand	Anodyne	MME	42	36
CN(C)[C@@H](CNC(=O)N1CCC(C(=O)NCCO)CC1)Cc1ccccc1	ZINC000875001190	GC	On-Demand	Anodyne	CAPN1	30	43
CCC[C@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccccc1	ZINC000875001196	GD	On-Demand	Anodyne	CCR5	52	42
CCC[C@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccccc1	ZINC000875001196	GD	On-Demand	Anodyne	L3MBTL3	64	40
CCC[C@@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccccc1	ZINC000875001199	GD	On-Demand	Anodyne	CCR5	52	42
CCC[C@@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccccc1	ZINC000875001199	GD	On-Demand	Anodyne	L3MBTL3	64	40
CC[C@@H](NC(=O)C(=O)N1CCC(C(C)=O)CC1)c1ccc(OC)cc1	ZINC000875001203	EE	On-Demand	Anodyne	CHRM2	48	38
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(Br)cc1	ZINC000875001213	FG	On-Demand	Anodyne	PRCP	15	43
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(Br)cc1	ZINC000875001215	FG	On-Demand	Anodyne	PRCP	15	43
CCc1ccc([C@H](C)NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875001221	EE	On-Demand	Anodyne	EPHX2	16	40
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(-c2ccccc2)cc1	ZINC000875001243	FG	On-Demand	Anodyne	CACNA1H	29	41
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(-c2ccccc2)cc1	ZINC000875001243	FG	On-Demand	Anodyne	GHRHR	62	36
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(-c2ccccc2)cc1	ZINC000875001243	FG	On-Demand	Anodyne	PTGER4	16	41
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(-c2ccccc2)cc1	ZINC000875001243	FG	On-Demand	Anodyne	ACACA	24	43
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(-c2ccccc2)cc1	ZINC000875001243	FG	On-Demand	Anodyne	PRCP	18	42
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(-c2ccccc2)cc1	ZINC000875001243	FG	On-Demand	Anodyne	ACACB	24	43
COc1ccc([C@@H]2CN(C(=O)C(=O)NCCc3ccccc3F)CCO2)cc1	ZINC000875001244	GE	On-Demand	Anodyne	MTNR1A	42	37
CS(=O)(=O)N1CCc2cc(C(=O)Oc3ccc(Oc4ccccn4)cc3)ccc21	ZINC000875001246	HG	On-Demand	Anodyne	SRD5A1	19	42
CS(=O)(=O)N1CCc2cc(C(=O)Oc3ccc(Oc4ccccn4)cc3)ccc21	ZINC000875001246	HG	On-Demand	Anodyne	CYP11B2	20	43
CCC[C@H](NC(=O)C(=O)N1CCC(C(C)=O)CC1)c1ccccc1	ZINC000875001264	EE	On-Demand	Anodyne	P2RY12	48	31
CCC[C@H](NC(=O)C(=O)N1CCC(C(C)=O)CC1)c1ccccc1	ZINC000875001264	EE	On-Demand	Anodyne	CCR5	51	44
CCC[C@@H](NC(=O)C(=O)N1CCC(C(C)=O)CC1)c1ccccc1	ZINC000875001265	EE	On-Demand	Anodyne	P2RY12	48	31
CCC[C@@H](NC(=O)C(=O)N1CCC(C(C)=O)CC1)c1ccccc1	ZINC000875001265	EE	On-Demand	Anodyne	CCR5	51	44
C[C@@H](NC(=O)N1CC(CNC(=O)C(F)(F)F)C1)c1ccc(Cl)cc1	ZINC000875001276	FF	On-Demand	Anodyne	CACNA1I	42	33
COC(=O)C1(O)CN(C(=O)N[C@H](C)c2ccc(Cl)cc2)C1	ZINC000875001278	DD	On-Demand	Anodyne	CACNA1H	38	41
COC(=O)C1(O)CN(C(=O)N[C@H](C)c2ccc(Cl)cc2)C1	ZINC000875001278	DD	On-Demand	Anodyne	CCR1	50	38
COC(=O)C1(O)CN(C(=O)N[C@@H](C)c2ccc(Cl)cc2)C1	ZINC000875001279	DD	On-Demand	Anodyne	CACNA1H	38	41
COC(=O)C1(O)CN(C(=O)N[C@@H](C)c2ccc(Cl)cc2)C1	ZINC000875001279	DD	On-Demand	Anodyne	CCR1	50	38
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NC[C@H]3CC3(Cl)Cl)C2)cc1	ZINC000875001289	GD	On-Demand	Anodyne	DRD4	33	46
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NC[C@H]3CC3(Cl)Cl)C2)cc1	ZINC000875001289	GD	On-Demand	Anodyne	SIGMAR1	22	43
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NC[C@H]3CC3(Cl)Cl)C2)cc1	ZINC000875001289	GD	On-Demand	Anodyne	CCR3	27	40
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NC[C@H]3CC3(Cl)Cl)C2)cc1	ZINC000875001289	GD	On-Demand	Anodyne	UTS2R	21	40
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NC[C@H]3CC3(Cl)Cl)C2)cc1	ZINC000875001289	GD	On-Demand	Anodyne	MLNR	42	35
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NC[C@H]3CC3(Cl)Cl)C2)cc1	ZINC000875001289	GD	On-Demand	Anodyne	CCR2	17	47
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NC[C@H]3CC3(Cl)Cl)C2)cc1	ZINC000875001289	GD	On-Demand	Anodyne	MCHR1	32	48
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NC[C@@H]3CC3(Cl)Cl)C2)cc1	ZINC000875001290	GD	On-Demand	Anodyne	DRD4	33	46
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NC[C@@H]3CC3(Cl)Cl)C2)cc1	ZINC000875001290	GD	On-Demand	Anodyne	SIGMAR1	22	43
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NC[C@@H]3CC3(Cl)Cl)C2)cc1	ZINC000875001290	GD	On-Demand	Anodyne	CCR3	27	40
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NC[C@@H]3CC3(Cl)Cl)C2)cc1	ZINC000875001290	GD	On-Demand	Anodyne	UTS2R	21	40
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NC[C@@H]3CC3(Cl)Cl)C2)cc1	ZINC000875001290	GD	On-Demand	Anodyne	MLNR	42	35
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NC[C@@H]3CC3(Cl)Cl)C2)cc1	ZINC000875001290	GD	On-Demand	Anodyne	CCR2	17	47
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NC[C@@H]3CC3(Cl)Cl)C2)cc1	ZINC000875001290	GD	On-Demand	Anodyne	MCHR1	32	48
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NC[C@H]3CC3(Cl)Cl)C2)cc1	ZINC000875001291	GD	On-Demand	Anodyne	DRD4	33	46
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NC[C@H]3CC3(Cl)Cl)C2)cc1	ZINC000875001291	GD	On-Demand	Anodyne	SIGMAR1	22	43
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NC[C@H]3CC3(Cl)Cl)C2)cc1	ZINC000875001291	GD	On-Demand	Anodyne	CCR3	27	40
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NC[C@H]3CC3(Cl)Cl)C2)cc1	ZINC000875001291	GD	On-Demand	Anodyne	UTS2R	21	40
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NC[C@H]3CC3(Cl)Cl)C2)cc1	ZINC000875001291	GD	On-Demand	Anodyne	MLNR	42	35
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NC[C@H]3CC3(Cl)Cl)C2)cc1	ZINC000875001291	GD	On-Demand	Anodyne	CCR2	17	47
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NC[C@H]3CC3(Cl)Cl)C2)cc1	ZINC000875001291	GD	On-Demand	Anodyne	MCHR1	32	48
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NC[C@@H]3CC3(Cl)Cl)C2)cc1	ZINC000875001292	GD	On-Demand	Anodyne	DRD4	33	46
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NC[C@@H]3CC3(Cl)Cl)C2)cc1	ZINC000875001292	GD	On-Demand	Anodyne	SIGMAR1	22	43
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NC[C@@H]3CC3(Cl)Cl)C2)cc1	ZINC000875001292	GD	On-Demand	Anodyne	CCR3	27	40
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NC[C@@H]3CC3(Cl)Cl)C2)cc1	ZINC000875001292	GD	On-Demand	Anodyne	UTS2R	21	40
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NC[C@@H]3CC3(Cl)Cl)C2)cc1	ZINC000875001292	GD	On-Demand	Anodyne	MLNR	42	35
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NC[C@@H]3CC3(Cl)Cl)C2)cc1	ZINC000875001292	GD	On-Demand	Anodyne	CCR2	17	47
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NC[C@@H]3CC3(Cl)Cl)C2)cc1	ZINC000875001292	GD	On-Demand	Anodyne	MCHR1	32	48
CCC[C@@H](NC(=O)C(=O)N[C@H]1CC12CCC2)c1ccccc1	ZINC000875001293	DF	On-Demand	Anodyne	CTSK	31	40
CCC[C@H](NC(=O)C(=O)N[C@H]1CC12CCC2)c1ccccc1	ZINC000875001294	DF	On-Demand	Anodyne	CTSK	31	40
CCC[C@@H](NC(=O)C(=O)N[C@@H]1CC12CCC2)c1ccccc1	ZINC000875001295	DF	On-Demand	Anodyne	CTSK	31	40
CCC[C@H](NC(=O)C(=O)N[C@@H]1CC12CCC2)c1ccccc1	ZINC000875001296	DF	On-Demand	Anodyne	CTSK	31	40
CONC(=O)C1CCN(C(=O)NC[C@H](Cc2ccccc2)N(C)C)CC1	ZINC000875001304	FD	On-Demand	Anodyne	AMY2	44	30
CONC(=O)C1CCN(C(=O)NC[C@H](Cc2ccccc2)N(C)C)CC1	ZINC000875001304	FD	On-Demand	Anodyne	CAPN1	39	45
CONC(=O)C1CCN(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)CC1	ZINC000875001305	FD	On-Demand	Anodyne	AMY2	44	30
CONC(=O)C1CCN(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)CC1	ZINC000875001305	FD	On-Demand	Anodyne	CAPN1	39	45
C[C@H](CC(=O)Nc1sc2c(c1C(N)=O)CCCC2)c1ccco1	ZINC000875001323	EG	On-Demand	Anodyne	VIPR1	25	40
CO[C@@H]1CC[C@@H](C)N(C(=O)NC[C@H](Cc2ccccc2)N(C)C)C1	ZINC000875001369	EE	On-Demand	Anodyne	TIMP3	65	37
CO[C@@H]1CC[C@@H](C)N(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)C1	ZINC000875001371	EE	On-Demand	Anodyne	TIMP3	65	37
Cc1ccnn1CC(=O)Nc1sc2c(c1C(N)=O)CCCC2	ZINC000875001374	DD	On-Demand	Anodyne	VIPR1	25	42
C[C@H](NC(=O)C(=O)NCCc1ccccc1F)c1ccc(C(F)(F)F)nc1	ZINC000875001377	GF	On-Demand	Anodyne	TRPV1	96	37
C[C@@H](NC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1ccc(Cl)cc1	ZINC000875001407	FH	On-Demand	Anodyne	CACNA1H	41	42
C[C@@H](NC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1ccc(Cl)cc1	ZINC000875001407	FH	On-Demand	Anodyne	PRCP	30	42
C[C@@H](NC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1ccc(Cl)cc1	ZINC000875001407	FH	On-Demand	Anodyne	CCR1	41	38
C[C@@H](NC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1ccc(Cl)cc1	ZINC000875001408	FH	On-Demand	Anodyne	CACNA1H	41	42
C[C@@H](NC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1ccc(Cl)cc1	ZINC000875001408	FH	On-Demand	Anodyne	PRCP	30	42
C[C@@H](NC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1ccc(Cl)cc1	ZINC000875001408	FH	On-Demand	Anodyne	CCR1	41	38
CC(=O)[C@@H]1CCCN(C(=O)NC[C@H](Cc2ccccc2)N(C)C)C1	ZINC000875001411	EE	On-Demand	Anodyne	ACE	47	36
CC(=O)[C@@H]1CCCN(C(=O)NC[C@H](Cc2ccccc2)N(C)C)C1	ZINC000875001411	EE	On-Demand	Anodyne	OPRM1	26	41
CC(=O)[C@@H]1CCCN(C(=O)NC[C@H](Cc2ccccc2)N(C)C)C1	ZINC000875001411	EE	On-Demand	Anodyne	DPP7	60	39
CC(=O)[C@@H]1CCCN(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)C1	ZINC000875001413	EE	On-Demand	Anodyne	ACE	47	36
CC(=O)[C@@H]1CCCN(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)C1	ZINC000875001413	EE	On-Demand	Anodyne	OPRM1	26	41
CC(=O)[C@@H]1CCCN(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)C1	ZINC000875001413	EE	On-Demand	Anodyne	DPP7	60	39
CC(=O)[C@H]1CCCN(C(=O)NC[C@H](Cc2ccccc2)N(C)C)C1	ZINC000875001415	EE	On-Demand	Anodyne	ACE	47	36
CC(=O)[C@H]1CCCN(C(=O)NC[C@H](Cc2ccccc2)N(C)C)C1	ZINC000875001415	EE	On-Demand	Anodyne	OPRM1	26	41
CC(=O)[C@H]1CCCN(C(=O)NC[C@H](Cc2ccccc2)N(C)C)C1	ZINC000875001415	EE	On-Demand	Anodyne	DPP7	60	39
CC(=O)[C@H]1CCCN(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)C1	ZINC000875001417	EE	On-Demand	Anodyne	ACE	47	36
CC(=O)[C@H]1CCCN(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)C1	ZINC000875001417	EE	On-Demand	Anodyne	OPRM1	26	41
CC(=O)[C@H]1CCCN(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)C1	ZINC000875001417	EE	On-Demand	Anodyne	DPP7	60	39
CCC[C@H](NC(=O)C(=O)NC(c1ccnn1C)c1ccnn1C)c1ccccc1	ZINC000875001423	GE	On-Demand	Anodyne	TACR3	40	44
CCC[C@@H](NC(=O)C(=O)NC(c1ccnn1C)c1ccnn1C)c1ccccc1	ZINC000875001425	GE	On-Demand	Anodyne	TACR3	40	44
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccc(Cl)cc1	ZINC000875001429	FD	On-Demand	Anodyne	CACNA1H	41	41
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccc(Cl)cc1	ZINC000875001429	FD	On-Demand	Anodyne	PRCP	20	42
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccc(Cl)cc1	ZINC000875001429	FD	On-Demand	Anodyne	CCR1	45	41
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccc(Cl)cc1	ZINC000875001429	FD	On-Demand	Anodyne	MAPK1	40	35
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccc(Cl)cc1	ZINC000875001429	FD	On-Demand	Anodyne	EPHX2	20	48
O=C(NC[C@H]1CC1(Cl)Cl)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875001447	FE	On-Demand	Anodyne	OXTR	52	37
O=C(NC[C@H]1CC1(Cl)Cl)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875001447	FE	On-Demand	Anodyne	SLC18A3	16	43
O=C(NC[C@H]1CC1(Cl)Cl)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875001448	FE	On-Demand	Anodyne	OXTR	52	37
O=C(NC[C@H]1CC1(Cl)Cl)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875001448	FE	On-Demand	Anodyne	SLC18A3	16	43
O=C(NC[C@@H]1CC1(Cl)Cl)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875001449	FE	On-Demand	Anodyne	OXTR	52	37
O=C(NC[C@@H]1CC1(Cl)Cl)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875001449	FE	On-Demand	Anodyne	SLC18A3	16	43
O=C(NC[C@@H]1CC1(Cl)Cl)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875001450	FE	On-Demand	Anodyne	OXTR	52	37
O=C(NC[C@@H]1CC1(Cl)Cl)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875001450	FE	On-Demand	Anodyne	SLC18A3	16	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2ccccc2F)C1	ZINC000875001456	DD	On-Demand	Anodyne	SLC6A1	59	38
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2ccccc2F)C1	ZINC000875001457	DD	On-Demand	Anodyne	SLC6A1	59	38
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1ccc(Br)cc1	ZINC000875001462	GH	On-Demand	Anodyne	PRCP	19	43
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1ccc(Br)cc1	ZINC000875001463	GH	On-Demand	Anodyne	PRCP	19	43
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(Cl)c(Cl)c1	ZINC000875001466	EH	On-Demand	Anodyne	TACR2	25	46
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(Cl)c(Cl)c1	ZINC000875001466	EH	On-Demand	Anodyne	PRCP	22	42
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(Cl)c(Cl)c1	ZINC000875001466	EH	On-Demand	Anodyne	MAPK1	48	48
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(Cl)c(Cl)c1	ZINC000875001467	EH	On-Demand	Anodyne	TACR2	25	46
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(Cl)c(Cl)c1	ZINC000875001467	EH	On-Demand	Anodyne	PRCP	22	42
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(Cl)c(Cl)c1	ZINC000875001467	EH	On-Demand	Anodyne	MAPK1	48	48
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](CC(C)C)c1ccccc1	ZINC000875001481	EE	On-Demand	Mild	PTGER3	41	36
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](CC(C)C)c1ccccc1	ZINC000875001481	EE	On-Demand	Mild	CAPNS1	42	31
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](CC(C)C)c1ccccc1	ZINC000875001481	EE	On-Demand	Mild	CAPN2	51	32
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](CC(C)C)c1ccccc1	ZINC000875001482	EE	On-Demand	Mild	PTGER3	41	36
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](CC(C)C)c1ccccc1	ZINC000875001482	EE	On-Demand	Mild	CAPNS1	42	31
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](CC(C)C)c1ccccc1	ZINC000875001482	EE	On-Demand	Mild	CAPN2	51	32
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](CC(C)C)c1ccccc1	ZINC000875001483	EE	On-Demand	Mild	PTGER3	41	36
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](CC(C)C)c1ccccc1	ZINC000875001483	EE	On-Demand	Mild	CAPNS1	42	31
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](CC(C)C)c1ccccc1	ZINC000875001483	EE	On-Demand	Mild	CAPN2	51	32
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](CC(C)C)c1ccccc1	ZINC000875001484	EE	On-Demand	Mild	PTGER3	41	36
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](CC(C)C)c1ccccc1	ZINC000875001484	EE	On-Demand	Mild	CAPNS1	42	31
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](CC(C)C)c1ccccc1	ZINC000875001484	EE	On-Demand	Mild	CAPN2	51	32
CCC[C@H](NC(=O)C(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccccc1	ZINC000875001489	GD	On-Demand	Anodyne	UTS2	62	39
CCC[C@@H](NC(=O)C(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccccc1	ZINC000875001490	GD	On-Demand	Anodyne	UTS2	62	39
CC(C)c1ccc([C@H](C)NC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875001497	EF	On-Demand	Anodyne	CACNA1H	41	41
NC(=O)c1c(NC(=O)Cc2cccc3cnccc23)sc2c1CCCC2	ZINC000875001501	FG	On-Demand	Anodyne	TRPV1	17	40
NC(=O)c1c(NC(=O)Cc2cccc3cnccc23)sc2c1CCCC2	ZINC000875001501	FG	On-Demand	Anodyne	MAPK10	16	53
CN(C)[C@@H](CNC(=O)N1CCC2(CCNC2=O)CC1)Cc1ccccc1	ZINC000875001579	FD	On-Demand	Anodyne	GHRHR	58	33
Cc1nccnc1[C@H](C)NC(=O)NC[C@@H](Cc1ccccc1)N(C)C	ZINC000875001585	EE	On-Demand	Anodyne	MME	46	35
Cc1nccnc1[C@@H](C)NC(=O)NC[C@@H](Cc1ccccc1)N(C)C	ZINC000875001586	EE	On-Demand	Anodyne	MME	46	35
Cc1nccnc1[C@H](C)NC(=O)NC[C@H](Cc1ccccc1)N(C)C	ZINC000875001587	EE	On-Demand	Anodyne	MME	46	35
Cc1nccnc1[C@@H](C)NC(=O)NC[C@H](Cc1ccccc1)N(C)C	ZINC000875001588	EE	On-Demand	Anodyne	MME	46	35
CC(C)c1ccc([C@@H](C)NC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875001598	EF	On-Demand	Anodyne	CACNA1H	41	41
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(-c2ccccc2)cc1	ZINC000875001603	DG	On-Demand	Anodyne	ACACA	22	43
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(-c2ccccc2)cc1	ZINC000875001603	DG	On-Demand	Anodyne	ACACB	23	43
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(-c2ccccc2)cc1	ZINC000875001603	DG	On-Demand	Anodyne	ACE2	41	35
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(-c2ccccc2)cc1	ZINC000875001604	DG	On-Demand	Anodyne	ACACA	22	43
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(-c2ccccc2)cc1	ZINC000875001604	DG	On-Demand	Anodyne	ACACB	23	43
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(-c2ccccc2)cc1	ZINC000875001604	DG	On-Demand	Anodyne	ACE2	41	35
CCC[C@H](NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875001605	EE	On-Demand	Anodyne	CCR5	47	38
CCC[C@H](NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875001606	EE	On-Demand	Anodyne	CCR5	47	38
CCC[C@@H](NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875001607	EE	On-Demand	Anodyne	CCR5	47	38
CCC[C@@H](NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875001608	EE	On-Demand	Anodyne	CCR5	47	38
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875001638	EF	On-Demand	Anodyne	SLC6A1	48	38
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875001638	EF	On-Demand	Anodyne	CACNA1B	18	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875001638	EF	On-Demand	Anodyne	CCR5	32	46
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875001638	EF	On-Demand	Anodyne	DPP7	46	36
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875001639	EF	On-Demand	Anodyne	SLC6A1	48	38
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875001639	EF	On-Demand	Anodyne	CACNA1B	18	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875001639	EF	On-Demand	Anodyne	CCR5	32	46
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875001639	EF	On-Demand	Anodyne	DPP7	46	36
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875001640	EF	On-Demand	Anodyne	SLC6A1	48	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875001640	EF	On-Demand	Anodyne	CACNA1B	18	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875001640	EF	On-Demand	Anodyne	CCR5	32	46
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875001640	EF	On-Demand	Anodyne	DPP7	46	36
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875001641	EF	On-Demand	Anodyne	SLC6A1	48	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875001641	EF	On-Demand	Anodyne	CACNA1B	18	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875001641	EF	On-Demand	Anodyne	CCR5	32	46
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875001641	EF	On-Demand	Anodyne	DPP7	46	36
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1ccc2ccccc2c1	ZINC000875001671	EI	On-Demand	Anodyne	UTS2	34	40
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H](CCC)c1ccccc1	ZINC000875001683	EE	On-Demand	Mild	TACR3	26	40
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](CCC)c1ccccc1	ZINC000875001684	EE	On-Demand	Mild	TACR3	26	40
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H](CCC)c1ccccc1	ZINC000875001685	EE	On-Demand	Mild	TACR3	26	40
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](CCC)c1ccccc1	ZINC000875001686	EE	On-Demand	Mild	TACR3	26	40
CCC[C@H](NC(=O)C(=O)NCc1cnn(CC)n1)c1ccccc1	ZINC000875001695	ED	On-Demand	Anodyne	TACR3	41	44
CCC[C@@H](NC(=O)C(=O)NCc1cnn(CC)n1)c1ccccc1	ZINC000875001696	ED	On-Demand	Anodyne	TACR3	41	44
CCCCCCCNC(=O)C(=O)N[C@H](C)c1ccc(C)o1	ZINC000875001706	CF	On-Demand	Mild	ASAH1	95	38
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1ccc(C)o1	ZINC000875001707	CF	On-Demand	Mild	ASAH1	95	38
CN(C)[C@@H](CNC(=O)NCc1ncc(Br)s1)Cc1ccccc1	ZINC000875001723	GF	On-Demand	Anodyne	CDK5	16	44
CN(C)[C@@H](CNC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)Cc1ccccc1	ZINC000875001734	GE	On-Demand	Anodyne	SMO	37	40
CN(C)[C@@H](CNC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)Cc1ccccc1	ZINC000875001735	GE	On-Demand	Anodyne	SMO	37	40
CCCCCCCNC(=O)C(=O)NCc1ccc(Cl)o1	ZINC000875001742	DF	On-Demand	Mild	ASAH1	88	38
CN(C)[C@@H](CNC(=O)NCc1nc(O)c2c(n1)CCOC2)Cc1ccccc1	ZINC000875001751	GD	On-Demand	Anodyne	WNT3A	42	34
C[C@@H](CCc1ccco1)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875001783	GF	On-Demand	Anodyne	ROCK1	24	41
C[C@@H](CCc1ccco1)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875001783	GF	On-Demand	Anodyne	ROCK2	16	41
COC(=O)N(C)NC(=O)NC[C@@H](Cc1ccccc1)N(C)C	ZINC000875001787	DD	On-Demand	Reactive	MME	50	38
COC(=O)N(C)NC(=O)NC[C@@H](Cc1ccccc1)N(C)C	ZINC000875001787	DD	On-Demand	Reactive	PAPA1_CARPA	41	34
COC(=O)N(C)NC(=O)NC[C@@H](Cc1ccccc1)N(C)C	ZINC000875001787	DD	On-Demand	Reactive	NPY5R	17	41
COC(=O)N(C)NC(=O)NC[C@H](Cc1ccccc1)N(C)C	ZINC000875001788	DD	On-Demand	Reactive	MME	50	38
COC(=O)N(C)NC(=O)NC[C@H](Cc1ccccc1)N(C)C	ZINC000875001788	DD	On-Demand	Reactive	PAPA1_CARPA	41	34
COC(=O)N(C)NC(=O)NC[C@H](Cc1ccccc1)N(C)C	ZINC000875001788	DD	On-Demand	Reactive	NPY5R	17	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2ccc(Cl)cc2)C1	ZINC000875001799	EG	On-Demand	Anodyne	PRCP	16	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2ccc(Cl)cc2)C1	ZINC000875001802	EG	On-Demand	Anodyne	PRCP	16	41
C[C@@H](CN(C)C(=O)C(=O)NCCc1ccccc1F)NC(=O)OC(C)(C)C	ZINC000875001815	GD	On-Demand	Anodyne	PAPA1_CARPA	31	47
C[C@@H](CN(C)C(=O)C(=O)NCCc1ccccc1F)NC(=O)OC(C)(C)C	ZINC000875001815	GD	On-Demand	Anodyne	FPR1	42	36
COC(=O)C1(O)CN(C(=O)N[C@H](C)c2ccc3ccccc3c2)C1	ZINC000875001822	ED	On-Demand	Anodyne	CYP26A1	45	36
COC(=O)C1(O)CN(C(=O)N[C@@H](C)c2ccc3ccccc3c2)C1	ZINC000875001823	ED	On-Demand	Anodyne	CYP26A1	45	36
O=C(Oc1ccc(Oc2ccccn2)cc1)C1CCN(c2ccc(C(F)(F)F)cn2)CC1	ZINC000875001826	IK	On-Demand	Anodyne	LIPE	26	52
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccc(-c2ccccc2)cc1	ZINC000875001838	GF	On-Demand	Anodyne	ACACA	21	41
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccc(-c2ccccc2)cc1	ZINC000875001838	GF	On-Demand	Anodyne	ACACB	19	41
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(Cl)c(Cl)c1	ZINC000875001887	FF	On-Demand	Anodyne	CACNA1H	48	40
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(Cl)c(Cl)c1	ZINC000875001887	FF	On-Demand	Anodyne	TACR2	45	36
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(Cl)c(Cl)c1	ZINC000875001887	FF	On-Demand	Anodyne	MAPK1	50	51
CCO[C@@H](C(=O)Nc1nc2ccc(Cl)cc2s1)[C@@H]1CCOC1	ZINC000875001902	EG	On-Demand	Anodyne	CSNK1D	44	47
CCO[C@@H](C(=O)Nc1nc2ccc(Cl)cc2s1)[C@H]1CCOC1	ZINC000875001904	EG	On-Demand	Anodyne	CSNK1D	44	47
COc1cccc([C@H](CNC(=O)N2C[C@@H](OC)CC[C@H]2C)N(C)C)c1	ZINC000875001911	EF	On-Demand	Anodyne	DRD4	42	32
COc1cccc([C@H](CNC(=O)N2C[C@H](OC)CC[C@H]2C)N(C)C)c1	ZINC000875001912	EF	On-Demand	Anodyne	DRD4	42	32
COc1cccc([C@H](CNC(=O)N2C[C@H](OC)CC[C@@H]2C)N(C)C)c1	ZINC000875001913	EF	On-Demand	Anodyne	DRD4	42	32
COc1cccc([C@H](CNC(=O)N2C[C@@H](OC)CC[C@@H]2C)N(C)C)c1	ZINC000875001914	EF	On-Demand	Anodyne	DRD4	42	32
C[C@H](NC(=O)C(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1cccnc1	ZINC000875001920	FC	On-Demand	Anodyne	PTAFR	17	41
C[C@H](NC(=O)C(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1cccnc1	ZINC000875001920	FC	On-Demand	Anodyne	KCNA5	21	42
COc1cccc([C@H](CNC(=O)NC2CCC(C)(N(C)C)CC2)N(C)C)c1	ZINC000875001930	GF	On-Demand	Anodyne	MTNR1A	27	40
COc1cccc([C@H](CNC(=O)NC2CCC(C)(N(C)C)CC2)N(C)C)c1	ZINC000875001930	GF	On-Demand	Anodyne	MTNR1B	27	40
COC(=O)CC[C@@H]1CC[C@H](C(=O)Nc2sc3c(c2C#N)CCCC3)O1	ZINC000875001946	FF	On-Demand	Mild	VIPR1	34	53
CC[C@@H](NC(=O)C(=O)N[C@H](C)c1ccnn1C)c1ccc(OC)cc1	ZINC000875001955	ED	On-Demand	Anodyne	TACR3	43	38
CC[C@@H](NC(=O)C(=O)N[C@@H](C)c1ccnn1C)c1ccc(OC)cc1	ZINC000875001956	ED	On-Demand	Anodyne	TACR3	43	38
C[C@H](NC(=O)C(=O)N1CC[C@H]2CSC[C@H]2C1)c1cccnc1	ZINC000875001968	DD	On-Demand	Anodyne	PTAFR	17	40
C[C@H](NC(=O)C(=O)N1CC[C@@H]2CSC[C@H]2C1)c1cccnc1	ZINC000875001969	DD	On-Demand	Anodyne	PTAFR	17	40
C[C@H](NC(=O)C(=O)N1CC[C@H]2CSC[C@@H]2C1)c1cccnc1	ZINC000875001970	DD	On-Demand	Anodyne	PTAFR	17	40
C[C@H](NC(=O)C(=O)N1CC[C@@H]2CSC[C@@H]2C1)c1cccnc1	ZINC000875001971	DD	On-Demand	Anodyne	PTAFR	17	40
COC(=O)C1(O)CN(C(=O)NC[C@@H](c2cccc(OC)c2)N(C)C)C1	ZINC000875001980	FC	On-Demand	Anodyne	DRD4	40	30
COC(=O)C1(O)CN(C(=O)NC[C@H](c2cccc(OC)c2)N(C)C)C1	ZINC000875001982	FC	On-Demand	Anodyne	DRD4	40	30
N#Cc1c(NC(=O)c2cc(Br)cnc2F)sc2c1CCCC2	ZINC000875001984	GI	On-Demand	Mild	VIPR1	30	47
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1cccc(C(F)(F)F)c1	ZINC000875001988	GE	On-Demand	Anodyne	MTTP	29	44
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1cccc(C(F)(F)F)c1	ZINC000875001988	GE	On-Demand	Anodyne	CCR2	69	38
CCO[C@H]1COCC[C@@H]1CC(=O)Nc1sc2c(c1C#N)CCCC2	ZINC000875001996	EG	On-Demand	Mild	VIPR1	31	48
CCO[C@H]1COCC[C@H]1CC(=O)Nc1sc2c(c1C#N)CCCC2	ZINC000875001999	EG	On-Demand	Mild	VIPR1	31	48
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc2ccccc2c1	ZINC000875002007	CF	On-Demand	Anodyne	F7	15	46
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc2ccccc2c1	ZINC000875002009	CF	On-Demand	Anodyne	F7	15	46
CCC[C@@H](NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1)c1ccccc1	ZINC000875002011	FG	On-Demand	Anodyne	UTS2	46	35
CCC[C@H](NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1)c1ccccc1	ZINC000875002014	FG	On-Demand	Anodyne	UTS2	46	35
CC(=O)N1CCC[C@@H]1C(=O)Nc1sc2c(c1C(N)=O)CCCC2	ZINC000875002018	ED	On-Demand	Anodyne	LGMN	50	35
COc1cccc([C@H](CNC(=O)N2CCCCCCNC(=O)CC2)N(C)C)c1	ZINC000875002020	GE	On-Demand	Anodyne	DRD4	41	32
N#Cc1c(NC(=O)[C@H]2CCC(=O)O2)sc2c1CCCC2	ZINC000875002027	CE	On-Demand	Mild	VIPR1	31	50
COc1cccc([C@H](CNC(=O)NNC(=O)c2cc(C)cs2)N(C)C)c1	ZINC000875002034	GE	On-Demand	Reactive	DRD4	40	32
C[C@@H]1[C@H](C(=O)NNC(=O)NC[C@H](c2cccc(F)c2)N(C)C)CCCN1C	ZINC000875002039	GD	On-Demand	Reactive	ACKR3	58	34
C[C@@H]1[C@H](C(=O)NNC(=O)NC[C@@H](c2cccc(F)c2)N(C)C)CCCN1C	ZINC000875002056	GD	On-Demand	Reactive	ACKR3	58	34
COc1cccc([C@H](CNC(=O)N2CC[C@H]3CSC[C@@H]3C2)N(C)C)c1	ZINC000875002061	FF	On-Demand	Anodyne	DRD4	40	30
COc1cccc([C@H](CNC(=O)N2CC[C@H]3CSC[C@H]3C2)N(C)C)c1	ZINC000875002063	FF	On-Demand	Anodyne	DRD4	40	30
COc1cccc([C@H](CNC(=O)N2CC[C@@H]3CSC[C@H]3C2)N(C)C)c1	ZINC000875002064	FF	On-Demand	Anodyne	DRD4	40	30
COc1cccc([C@H](CNC(=O)N2CC[C@@H]3CSC[C@@H]3C2)N(C)C)c1	ZINC000875002065	FF	On-Demand	Anodyne	DRD4	40	30
N#Cc1c(NC(=O)Cc2ccc3cnccc3c2)sc2c1CCCC2	ZINC000875002068	EI	On-Demand	Mild	VIPR1	39	61
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](Cc1ccccc1)N(C)C	ZINC000875002074	FD	On-Demand	Anodyne	SLC6A4	23	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](Cc1ccccc1)N(C)C	ZINC000875002074	FD	On-Demand	Anodyne	SLC6A3	52	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](Cc1ccccc1)N(C)C	ZINC000875002075	FD	On-Demand	Anodyne	SLC6A4	23	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](Cc1ccccc1)N(C)C	ZINC000875002075	FD	On-Demand	Anodyne	SLC6A3	52	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](Cc1ccccc1)N(C)C	ZINC000875002076	FD	On-Demand	Anodyne	SLC6A4	23	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](Cc1ccccc1)N(C)C	ZINC000875002076	FD	On-Demand	Anodyne	SLC6A3	52	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](Cc1ccccc1)N(C)C	ZINC000875002077	FD	On-Demand	Anodyne	SLC6A4	23	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](Cc1ccccc1)N(C)C	ZINC000875002077	FD	On-Demand	Anodyne	SLC6A3	52	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(OC(F)F)cc2)C1	ZINC000875002088	FD	On-Demand	Anodyne	DPP7	46	39
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(OC(F)F)cc2)C1	ZINC000875002089	FD	On-Demand	Anodyne	DPP7	46	39
C[C@@H](CCc1ccco1)NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875002095	GC	On-Demand	Anodyne	L3MBTL3	48	38
CCOC(=O)Nc1ccc(C(=O)Oc2ccc(Oc3ccccn3)cc2)cc1	ZINC000875002127	GJ	On-Demand	Anodyne	PRSS1	18	48
CCOC(=O)Nc1ccc(C(=O)Oc2ccc(Oc3ccccn3)cc2)cc1	ZINC000875002127	GJ	On-Demand	Anodyne	FAAH	18	41
CCOC(=O)Nc1ccc(C(=O)Oc2ccc(Oc3ccccn3)cc2)cc1	ZINC000875002127	GJ	On-Demand	Anodyne	ACR	93	48
CCOC(=O)Nc1ccc(C(=O)Oc2ccc(Oc3ccccn3)cc2)cc1	ZINC000875002127	GJ	On-Demand	Anodyne	PDGFRA	35	41
N#Cc1cc(C(=O)Nc2sc3c(c2C#N)CCCC3)co1	ZINC000875002131	CG	On-Demand	Mild	VIPR1	33	53
C[C@@H](NC(=O)N(C)CCN1CC2(CCOCC2)C1)c1cccc(C(F)(F)F)c1	ZINC000875002146	GH	On-Demand	Anodyne	CASR	35	44
CCC[C@H](NC(=O)C(=O)N[C@H](C)c1cc2cnccc2o1)c1ccccc1	ZINC000875002149	FH	On-Demand	Anodyne	TACR3	20	41
CCC[C@@H](NC(=O)C(=O)N[C@H](C)c1cc2cnccc2o1)c1ccccc1	ZINC000875002151	FH	On-Demand	Anodyne	TACR3	20	41
CCC[C@@H](NC(=O)C(=O)N[C@@H](C)c1cc2cnccc2o1)c1ccccc1	ZINC000875002152	FH	On-Demand	Anodyne	TACR3	20	41
CCC[C@H](NC(=O)C(=O)N[C@@H](C)c1cc2cnccc2o1)c1ccccc1	ZINC000875002153	FH	On-Demand	Anodyne	TACR3	20	41
CCC[C@H](NC(=O)C(=O)N[C@@H](C)c1ccc(C(F)(F)F)nc1)c1ccccc1	ZINC000875002155	GH	On-Demand	Anodyne	CTSK	32	41
CCC[C@H](NC(=O)C(=O)N[C@H](C)c1ccc(C(F)(F)F)nc1)c1ccccc1	ZINC000875002156	GH	On-Demand	Anodyne	CTSK	32	41
CCC[C@@H](NC(=O)C(=O)N[C@H](C)c1ccc(C(F)(F)F)nc1)c1ccccc1	ZINC000875002157	GH	On-Demand	Anodyne	CTSK	32	41
CCC[C@@H](NC(=O)C(=O)N[C@@H](C)c1ccc(C(F)(F)F)nc1)c1ccccc1	ZINC000875002158	GH	On-Demand	Anodyne	CTSK	32	41
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccc(-c2ccccc2)cc1	ZINC000875002160	FG	On-Demand	Anodyne	ACACA	22	42
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccc(-c2ccccc2)cc1	ZINC000875002160	FG	On-Demand	Anodyne	PRCP	15	41
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccc(-c2ccccc2)cc1	ZINC000875002160	FG	On-Demand	Anodyne	ACACB	21	42
CCC[C@@H](NC(=O)C(=O)N[C@@H](C)c1ccnn1C)c1ccccc1	ZINC000875002162	EE	On-Demand	Anodyne	TACR3	38	43
CCC[C@@H](NC(=O)C(=O)N[C@@H](C)c1ccnn1C)c1ccccc1	ZINC000875002162	EE	On-Demand	Anodyne	SOAT1	41	34
CCC[C@H](NC(=O)C(=O)N[C@H](C)c1ccnn1C)c1ccccc1	ZINC000875002163	EE	On-Demand	Anodyne	TACR3	38	43
CCC[C@H](NC(=O)C(=O)N[C@H](C)c1ccnn1C)c1ccccc1	ZINC000875002163	EE	On-Demand	Anodyne	SOAT1	41	34
CCC[C@@H](NC(=O)C(=O)N[C@H](C)c1ccnn1C)c1ccccc1	ZINC000875002164	EE	On-Demand	Anodyne	TACR3	38	43
CCC[C@@H](NC(=O)C(=O)N[C@H](C)c1ccnn1C)c1ccccc1	ZINC000875002164	EE	On-Demand	Anodyne	SOAT1	41	34
CCC[C@H](NC(=O)C(=O)N[C@@H](C)c1ccnn1C)c1ccccc1	ZINC000875002165	EE	On-Demand	Anodyne	TACR3	38	43
CCC[C@H](NC(=O)C(=O)N[C@@H](C)c1ccnn1C)c1ccccc1	ZINC000875002165	EE	On-Demand	Anodyne	SOAT1	41	34
CONC(=O)C1CCN(C(=O)NC[C@@H](c2cccc(OC)c2)N(C)C)CC1	ZINC000875002200	GD	On-Demand	Anodyne	DRD4	41	32
CONC(=O)C1CCN(C(=O)NC[C@@H](c2cccc(OC)c2)N(C)C)CC1	ZINC000875002200	GD	On-Demand	Anodyne	MTNR1A	29	48
CONC(=O)C1CCN(C(=O)NC[C@@H](c2cccc(OC)c2)N(C)C)CC1	ZINC000875002200	GD	On-Demand	Anodyne	MTNR1B	32	48
CONC(=O)C1CCN(C(=O)NC[C@H](c2cccc(OC)c2)N(C)C)CC1	ZINC000875002201	GD	On-Demand	Anodyne	DRD4	41	32
CONC(=O)C1CCN(C(=O)NC[C@H](c2cccc(OC)c2)N(C)C)CC1	ZINC000875002201	GD	On-Demand	Anodyne	MTNR1A	29	48
CONC(=O)C1CCN(C(=O)NC[C@H](c2cccc(OC)c2)N(C)C)CC1	ZINC000875002201	GD	On-Demand	Anodyne	MTNR1B	32	48
C[C@H](NC(=O)C(=O)NCCCCC1CC1)c1cccnc1	ZINC000875002213	CD	On-Demand	Anodyne	KCNA5	22	43
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1cccc(C(F)(F)F)c1	ZINC000875002223	DF	On-Demand	Anodyne	CCR2	44	39
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1cccc(C(F)(F)F)c1	ZINC000875002223	DF	On-Demand	Anodyne	PDS	42	34
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1cccc(C(F)(F)F)c1	ZINC000875002224	DF	On-Demand	Anodyne	CCR2	44	39
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1cccc(C(F)(F)F)c1	ZINC000875002224	DF	On-Demand	Anodyne	PDS	42	34
NC(=O)[C@@H]1CC[C@H](CCC(=O)Nc2nc3ccc(Cl)cc3s2)O1	ZINC000875002227	FF	On-Demand	Anodyne	LCK	27	42
NC(=O)[C@@H]1CC[C@H](CCC(=O)Nc2nc3ccc(Cl)cc3s2)O1	ZINC000875002227	FF	On-Demand	Anodyne	CSNK1D	47	47
COC(=O)[C@@H]1CO[C@H](CCC(=O)Nc2sc3c(c2C#N)CCCC3)C1	ZINC000875002232	FF	On-Demand	Mild	VIPR1	36	56
N#Cc1c(NC(=O)Cn2ccc(Br)cc2=O)sc2c1CCCC2	ZINC000875002249	GG	On-Demand	Mild	VIPR1	35	55
C[C@H](NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1)c1cccnc1	ZINC000875002271	ED	On-Demand	Anodyne	KCNA5	20	40
C[C@H](NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1)c1cccnc1	ZINC000875002271	ED	On-Demand	Anodyne	C3AR1	37	40
Cc1csc2nc(CC(=O)Nc3sc4c(c3C#N)CCCC4)cn12	ZINC000875002273	FH	On-Demand	Mild	VIPR1	33	53
COC(=O)N(C)NC(=O)NC[C@H](c1cccc(OC)c1)N(C)C	ZINC000875002275	DD	On-Demand	Reactive	MTNR1A	51	42
COC(=O)N(C)NC(=O)NC[C@H](c1cccc(OC)c1)N(C)C	ZINC000875002275	DD	On-Demand	Reactive	MTNR1B	48	42
COC(=O)N(C)NC(=O)NC[C@@H](c1cccc(OC)c1)N(C)C	ZINC000875002277	DD	On-Demand	Reactive	MTNR1A	51	42
COC(=O)N(C)NC(=O)NC[C@@H](c1cccc(OC)c1)N(C)C	ZINC000875002277	DD	On-Demand	Reactive	MTNR1B	48	42
O=C(Nc1nc2ccc(Cl)cc2s1)C1(F)CCOCC1	ZINC000875002279	DG	On-Demand	Anodyne	LCK	29	41
O=C(Nc1nc2ccc(Cl)cc2s1)C1(F)CCOCC1	ZINC000875002279	DG	On-Demand	Anodyne	CSNK1D	47	47
COc1cccc([C@H](CNC(=O)N2C[C@H]3C(=O)N(C)C(=O)[C@H]3C2)N(C)C)c1	ZINC000875002283	FC	On-Demand	Anodyne	DRD4	43	33
COc1cccc([C@H](CNC(=O)N2C[C@H]3C(=O)N(C)C(=O)[C@H]3C2)N(C)C)c1	ZINC000875002283	FC	On-Demand	Anodyne	MTNR1A	37	40
COc1cccc([C@H](CNC(=O)N2C[C@H]3C(=O)N(C)C(=O)[C@H]3C2)N(C)C)c1	ZINC000875002283	FC	On-Demand	Anodyne	MTNR1B	38	40
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](c1cccc(OC)c1)N(C)C	ZINC000875002291	EE	On-Demand	Anodyne	MTNR1A	29	40
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](c1cccc(OC)c1)N(C)C	ZINC000875002291	EE	On-Demand	Anodyne	MTNR1B	30	40
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](c1cccc(OC)c1)N(C)C	ZINC000875002295	EE	On-Demand	Anodyne	MTNR1A	29	40
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](c1cccc(OC)c1)N(C)C	ZINC000875002295	EE	On-Demand	Anodyne	MTNR1B	30	40
CC(C)c1ccc([C@@H](C)NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875002299	EG	On-Demand	Anodyne	EPHX2	17	43
CC(C)c1ccc([C@H](C)NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875002301	EG	On-Demand	Anodyne	EPHX2	17	43
Cc1cc(C(F)(F)F)nc(C(=O)Nc2sc3c(c2C#N)CCCC3)n1	ZINC000875002305	FH	On-Demand	Mild	VIPR1	33	52
CN1CC[C@@H](C(=O)Nc2sc3c(c2C#N)CCCC3)[C@@H](c2cnn(C)c2)C1	ZINC000875002327	GF	On-Demand	Mild	VIPR1	27	42
CN1CC[C@@H](C(=O)Nc2sc3c(c2C#N)CCCC3)[C@H](c2cnn(C)c2)C1	ZINC000875002330	GF	On-Demand	Mild	VIPR1	27	42
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)NC[C@@H]1CC1(Cl)Cl	ZINC000875002333	GE	On-Demand	Anodyne	ROCK1	21	42
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)NC[C@@H]1CC1(Cl)Cl	ZINC000875002333	GE	On-Demand	Anodyne	ROCK2	15	42
C[C@H](NC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1)c1cccnc1	ZINC000875002334	CD	On-Demand	Anodyne	PTAFR	18	41
C[C@H](NC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1)c1cccnc1	ZINC000875002334	CD	On-Demand	Anodyne	KCNA5	21	40
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)NC[C@H]1CC1(Cl)Cl	ZINC000875002335	GE	On-Demand	Anodyne	ROCK1	21	42
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)NC[C@H]1CC1(Cl)Cl	ZINC000875002335	GE	On-Demand	Anodyne	ROCK2	15	42
CCCCCCCNC(=O)C(=O)NCc1nnc2n1CCCCC2	ZINC000875002341	ED	On-Demand	Mild	ASAH1	59	31
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc2ccccc2c1	ZINC000875002361	EF	On-Demand	Anodyne	CACNA1H	32	40
CCc1ccc([C@H](C)NC(=O)NN(C)C(=O)OC)cc1	ZINC000875002366	CE	On-Demand	Reactive	ACACA	23	42
CCc1ccc([C@H](C)NC(=O)NN(C)C(=O)OC)cc1	ZINC000875002366	CE	On-Demand	Reactive	ACACB	22	42
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1	ZINC000875002475	GG	On-Demand	Anodyne	SLC6A3	16	47
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1	ZINC000875002475	GG	On-Demand	Anodyne	PRCP	38	45
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1	ZINC000875002475	GG	On-Demand	Anodyne	CCR1	53	40
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1	ZINC000875002475	GG	On-Demand	Anodyne	CCR5	17	41
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1	ZINC000875002475	GG	On-Demand	Anodyne	BIRC8	56	36
CC(=O)C1CCN(C(=O)C(=O)N[C@H](c2ccccc2)c2ccc(Cl)cc2)CC1	ZINC000875002476	GG	On-Demand	Anodyne	SLC6A3	16	47
CC(=O)C1CCN(C(=O)C(=O)N[C@H](c2ccccc2)c2ccc(Cl)cc2)CC1	ZINC000875002476	GG	On-Demand	Anodyne	PRCP	38	45
CC(=O)C1CCN(C(=O)C(=O)N[C@H](c2ccccc2)c2ccc(Cl)cc2)CC1	ZINC000875002476	GG	On-Demand	Anodyne	CCR1	53	40
CC(=O)C1CCN(C(=O)C(=O)N[C@H](c2ccccc2)c2ccc(Cl)cc2)CC1	ZINC000875002476	GG	On-Demand	Anodyne	CCR5	17	41
CC(=O)C1CCN(C(=O)C(=O)N[C@H](c2ccccc2)c2ccc(Cl)cc2)CC1	ZINC000875002476	GG	On-Demand	Anodyne	BIRC8	56	36
C[C@H]1CC(=O)N[C@@H](C(=O)Nc2nc3ccc(Cl)cc3s2)C1	ZINC000875002486	DF	On-Demand	Anodyne	LCK	28	43
C[C@H]1CC(=O)N[C@@H](C(=O)Nc2nc3ccc(Cl)cc3s2)C1	ZINC000875002486	DF	On-Demand	Anodyne	CSNK1D	44	45
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000875002513	EH	On-Demand	Anodyne	PDS	45	37
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000875002517	EH	On-Demand	Anodyne	PDS	45	37
COC(=O)c1ccc(CC(=O)Nc2sc3c(c2C#N)CCCC3)cn1	ZINC000875002531	FF	On-Demand	Mild	MAPK9	15	48
COC(=O)c1ccc(CC(=O)Nc2sc3c(c2C#N)CCCC3)cn1	ZINC000875002531	FF	On-Demand	Mild	VIPR1	38	61
COc1cccc([C@H](CNC(=O)NC[C@@H]2CCO[C@H]2c2cn[nH]c2)N(C)C)c1	ZINC000875002533	GE	On-Demand	Anodyne	ROCK1	41	39
COc1cccc([C@H](CNC(=O)NC[C@@H]2CCO[C@H]2c2cn[nH]c2)N(C)C)c1	ZINC000875002533	GE	On-Demand	Anodyne	ROCK2	55	39
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1cc(F)c(Cl)cc1Cl	ZINC000875002540	GF	On-Demand	Anodyne	CACNA1H	62	39
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1cccc(C(F)(F)F)c1	ZINC000875002542	FF	On-Demand	Anodyne	CACNA1H	37	42
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1cccc(C(F)(F)F)c1	ZINC000875002542	FF	On-Demand	Anodyne	TACR1	38	40
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1cccc(C(F)(F)F)c1	ZINC000875002542	FF	On-Demand	Anodyne	PTGER4	28	41
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1cccc(C(F)(F)F)c1	ZINC000875002542	FF	On-Demand	Anodyne	CCR2	58	38
NC(=O)c1c(NC(=O)[C@H]2CCN(C(=O)c3ccccc3)C2)sc2c1CCCC2	ZINC000875002555	GF	On-Demand	Anodyne	L3MBTL3	58	36
NC(=O)c1c(NC(=O)[C@@H]2CCN(C(=O)c3ccccc3)C2)sc2c1CCCC2	ZINC000875002556	GF	On-Demand	Anodyne	L3MBTL3	58	36
CN(C)[C@@H](CNC(=O)NCc1nc(-c2ccncc2)cs1)Cc1ccccc1	ZINC000875002573	GG	On-Demand	Anodyne	ROCK1	27	53
CN(C)[C@@H](CNC(=O)NCc1nc(-c2ccncc2)cs1)Cc1ccccc1	ZINC000875002573	GG	On-Demand	Anodyne	TPH1	56	35
CN(C)[C@@H](CNC(=O)NCc1nc(-c2ccncc2)cs1)Cc1ccccc1	ZINC000875002573	GG	On-Demand	Anodyne	ROCK2	22	53
CN(C)[C@@H](CNC(=O)NCc1nc(-c2ccncc2)cs1)Cc1ccccc1	ZINC000875002573	GG	On-Demand	Anodyne	GPR142	70	42
CN(C)[C@@H](CNC(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21)Cc1ccccc1	ZINC000875002576	FE	On-Demand	Anodyne	ACE	40	37
CN(C)[C@@H](CNC(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21)Cc1ccccc1	ZINC000875002576	FE	On-Demand	Anodyne	CTRA_BOVIN	40	32
CN(C)[C@@H](CNC(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21)Cc1ccccc1	ZINC000875002576	FE	On-Demand	Anodyne	CELA2A	40	32
COc1cccc([C@H](CNC(=O)N2CCN(C)C(C)(C)CC2)N(C)C)c1	ZINC000875002592	FE	On-Demand	Anodyne	DRD4	42	32
C[C@@]1(Br)C[C@H]1C(=O)Nc1sc2c(c1C#N)CCCC2	ZINC000875002602	EH	On-Demand	Mild	VIPR1	34	53
C[C@@]1(Br)C[C@@H]1C(=O)Nc1sc2c(c1C#N)CCCC2	ZINC000875002603	EH	On-Demand	Mild	VIPR1	34	53
N#Cc1c(NC(=O)[C@]2(C#N)CCCOC2)sc2c1CCCC2	ZINC000875002610	DF	On-Demand	Mild	VIPR1	31	51
N#Cc1c(NC(=O)[C@@]2(C#N)CCCOC2)sc2c1CCCC2	ZINC000875002612	DF	On-Demand	Mild	VIPR1	31	51
N#Cc1c(NC(=O)Cc2ccc3cccnc3c2)sc2c1CCCC2	ZINC000875002638	EI	On-Demand	Mild	MAPK9	18	54
N#Cc1c(NC(=O)Cc2ccc3cccnc3c2)sc2c1CCCC2	ZINC000875002638	EI	On-Demand	Mild	CDK5	23	43
N#Cc1c(NC(=O)Cc2ccc3cccnc3c2)sc2c1CCCC2	ZINC000875002638	EI	On-Demand	Mild	VIPR1	37	59
N#Cc1c(NC(=O)c2cccn(C3CC3)c2=O)sc2c1CCCC2	ZINC000875002640	EG	On-Demand	Mild	VIPR1	30	50
COc1cccc([C@H](CNC(=O)N[C@H](C)c2ccnn2C)N(C)C)c1	ZINC000875002642	EE	On-Demand	Anodyne	ROCK1	20	40
COc1cccc([C@H](CNC(=O)N[C@H](C)c2ccnn2C)N(C)C)c1	ZINC000875002642	EE	On-Demand	Anodyne	ROCK2	19	40
COc1cccc([C@H](CNC(=O)N[C@@H](C)c2ccnn2C)N(C)C)c1	ZINC000875002643	EE	On-Demand	Anodyne	ROCK1	20	40
COc1cccc([C@H](CNC(=O)N[C@@H](C)c2ccnn2C)N(C)C)c1	ZINC000875002643	EE	On-Demand	Anodyne	ROCK2	19	40
COc1cccc([C@H](CNC(=O)N2CC[C@H](C(C)(C)O)C2)N(C)C)c1	ZINC000875002652	EE	On-Demand	Anodyne	DRD4	43	32
COc1cccc([C@H](CNC(=O)N2CC[C@@H](C(C)(C)O)C2)N(C)C)c1	ZINC000875002653	EE	On-Demand	Anodyne	DRD4	43	32
CCO[C@@H](C(=O)Nc1sc2c(c1C#N)CCCC2)C1CCOCC1	ZINC000875002655	EG	On-Demand	Mild	VIPR1	30	48
C[C@H](NC(=O)C(=O)NCC[C@@H]1CCSC1)c1cccnc1	ZINC000875002672	DD	On-Demand	Anodyne	KCNA5	19	42
C[C@H](NC(=O)C(=O)NCC[C@H]1CCSC1)c1cccnc1	ZINC000875002673	DD	On-Demand	Anodyne	KCNA5	19	42
Cc1nn(-c2cccnc2)nc1C(=O)Nc1sc2c(c1C#N)CCCC2	ZINC000875002675	FG	On-Demand	Mild	VIPR1	30	48
O=C(CCCOC1CCOCC1)Nc1nc2ccc(Cl)cc2s1	ZINC000875002686	FH	On-Demand	Anodyne	LCK	28	42
O=C(CCCOC1CCOCC1)Nc1nc2ccc(Cl)cc2s1	ZINC000875002686	FH	On-Demand	Anodyne	CSNK1D	49	49
N#Cc1c(NC(=O)C2([C@@H]3CCCCO3)CCOCC2)sc2c1CCCC2	ZINC000875002687	FH	On-Demand	Mild	VIPR1	28	44
N#Cc1c(NC(=O)C2([C@H]3CCCCO3)CCOCC2)sc2c1CCCC2	ZINC000875002688	FH	On-Demand	Mild	VIPR1	28	44
CC[C@]1(C(=O)Nc2nc3ccc(Cl)cc3s2)CCNC1=O	ZINC000875002695	DF	On-Demand	Anodyne	LCK	28	42
CC[C@]1(C(=O)Nc2nc3ccc(Cl)cc3s2)CCNC1=O	ZINC000875002695	DF	On-Demand	Anodyne	CSNK1D	45	45
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1cccc(C(F)(F)F)c1	ZINC000875002697	EH	On-Demand	Anodyne	TACR1	47	38
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1cccc(C(F)(F)F)c1	ZINC000875002697	EH	On-Demand	Anodyne	CACNA1B	55	37
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1cccc(C(F)(F)F)c1	ZINC000875002697	EH	On-Demand	Anodyne	CCR2	71	40
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1cccc(C(F)(F)F)c1	ZINC000875002699	EH	On-Demand	Anodyne	TACR1	47	38
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1cccc(C(F)(F)F)c1	ZINC000875002699	EH	On-Demand	Anodyne	CACNA1B	55	37
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1cccc(C(F)(F)F)c1	ZINC000875002699	EH	On-Demand	Anodyne	CCR2	71	40
C[C@H](NC(=O)C(=O)N1CCN(c2ccc(F)cc2C#N)CC1)c1cccnc1	ZINC000875002717	GD	On-Demand	Mild	PTAFR	28	42
C[C@H](NC(=O)C(=O)N1CCN(c2ccc(F)cc2C#N)CC1)c1cccnc1	ZINC000875002717	GD	On-Demand	Mild	NPY2R	54	44
C[C@@H](NC(=O)NC[C@@H](Cc1ccccc1)N(C)C)c1ccccc1O	ZINC000875002723	EF	On-Demand	Clean	MME	69	36
C[C@@H](NC(=O)NC[C@@H](Cc1ccccc1)N(C)C)c1ccccc1O	ZINC000875002723	EF	On-Demand	Clean	PAPA1_CARPA	41	33
C[C@H](NC(=O)NC[C@H](Cc1ccccc1)N(C)C)c1ccccc1O	ZINC000875002725	EF	On-Demand	Clean	MME	69	36
C[C@H](NC(=O)NC[C@H](Cc1ccccc1)N(C)C)c1ccccc1O	ZINC000875002725	EF	On-Demand	Clean	PAPA1_CARPA	41	33
C[C@@H](NC(=O)NC[C@H](Cc1ccccc1)N(C)C)c1ccccc1O	ZINC000875002727	EF	On-Demand	Clean	MME	69	36
C[C@@H](NC(=O)NC[C@H](Cc1ccccc1)N(C)C)c1ccccc1O	ZINC000875002727	EF	On-Demand	Clean	PAPA1_CARPA	41	33
CN1CC[C@@H](C(=O)Nc2nc3ccc(Cl)cc3s2)[C@H](c2cnn(C)c2)C1	ZINC000875002736	GG	On-Demand	Anodyne	SLC6A3	15	41
CN1CC[C@@H](C(=O)Nc2nc3ccc(Cl)cc3s2)[C@H](c2cnn(C)c2)C1	ZINC000875002736	GG	On-Demand	Anodyne	LCK	21	41
CN1CC[C@@H](C(=O)Nc2nc3ccc(Cl)cc3s2)[C@H](c2cnn(C)c2)C1	ZINC000875002736	GG	On-Demand	Anodyne	CSNK1D	36	42
CN1CC[C@@H](C(=O)Nc2nc3ccc(Cl)cc3s2)[C@@H](c2cnn(C)c2)C1	ZINC000875002740	GG	On-Demand	Anodyne	SLC6A3	15	41
CN1CC[C@@H](C(=O)Nc2nc3ccc(Cl)cc3s2)[C@@H](c2cnn(C)c2)C1	ZINC000875002740	GG	On-Demand	Anodyne	LCK	21	41
CN1CC[C@@H](C(=O)Nc2nc3ccc(Cl)cc3s2)[C@@H](c2cnn(C)c2)C1	ZINC000875002740	GG	On-Demand	Anodyne	CSNK1D	36	42
C[C@H](NC(=O)C(=O)N1CCN(C)C(C)(C)CC1)c1cccnc1	ZINC000875002766	DD	On-Demand	Anodyne	PTAFR	19	41
CC(=O)C1CCN(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)CC1	ZINC000875002779	EE	On-Demand	Anodyne	CAPN1	33	42
CC(=O)C1CCN(C(=O)NC[C@H](Cc2ccccc2)N(C)C)CC1	ZINC000875002781	EE	On-Demand	Anodyne	CAPN1	33	42
COC(=O)C1(O)CN(C(=O)NC[C@@H](c2ccccc2OC)N2CCCC2)C1	ZINC000875002801	GC	On-Demand	Anodyne	HCN1	44	35
COC(=O)C1(O)CN(C(=O)NC[C@H](c2ccccc2OC)N2CCCC2)C1	ZINC000875002803	GC	On-Demand	Anodyne	HCN1	44	35
N#Cc1c(NC(=O)C2(F)CCOCC2)sc2c1CCCC2	ZINC000875002807	DF	On-Demand	Mild	VIPR1	32	53
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](Cc1ccccc1)N(C)C	ZINC000875002816	DE	On-Demand	Anodyne	MME	78	39
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](Cc1ccccc1)N(C)C	ZINC000875002816	DE	On-Demand	Anodyne	ANPEP	65	36
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](Cc1ccccc1)N(C)C	ZINC000875002816	DE	On-Demand	Anodyne	PAPA1_CARPA	58	36
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](Cc1ccccc1)N(C)C	ZINC000875002816	DE	On-Demand	Anodyne	CAPNS1	56	33
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](Cc1ccccc1)N(C)C	ZINC000875002816	DE	On-Demand	Anodyne	CAPN1	55	34
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](Cc1ccccc1)N(C)C	ZINC000875002816	DE	On-Demand	Anodyne	CAPN2	69	35
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](Cc1ccccc1)N(C)C	ZINC000875002816	DE	On-Demand	Anodyne	ACE2	42	36
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](Cc1ccccc1)N(C)C	ZINC000875002816	DE	On-Demand	Anodyne	NPR	41	34
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](Cc1ccccc1)N(C)C	ZINC000875002817	DE	On-Demand	Anodyne	MME	78	39
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](Cc1ccccc1)N(C)C	ZINC000875002817	DE	On-Demand	Anodyne	ANPEP	65	36
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](Cc1ccccc1)N(C)C	ZINC000875002817	DE	On-Demand	Anodyne	PAPA1_CARPA	58	36
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](Cc1ccccc1)N(C)C	ZINC000875002817	DE	On-Demand	Anodyne	CAPNS1	56	33
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](Cc1ccccc1)N(C)C	ZINC000875002817	DE	On-Demand	Anodyne	CAPN1	55	34
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](Cc1ccccc1)N(C)C	ZINC000875002817	DE	On-Demand	Anodyne	CAPN2	69	35
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](Cc1ccccc1)N(C)C	ZINC000875002817	DE	On-Demand	Anodyne	ACE2	42	36
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](Cc1ccccc1)N(C)C	ZINC000875002817	DE	On-Demand	Anodyne	NPR	41	34
CN1CCN(C2CCN(C(=O)NC[C@H](Cc3ccccc3)N(C)C)CC2)CC1	ZINC000875002827	GD	On-Demand	Anodyne	L3MBTL3	67	40
CCOC1CC2(C1)C[C@H]2C(=O)Nc1sc2c(c1C#N)CCCC2	ZINC000875002834	EH	On-Demand	Mild	VIPR1	31	48
CN1CCN(C2CCN(C(=O)NC[C@@H](Cc3ccccc3)N(C)C)CC2)CC1	ZINC000875002837	GD	On-Demand	Anodyne	L3MBTL3	67	40
COc1cccc([C@H](CNC(=O)NCc2ccnc(F)c2)N(C)C)c1	ZINC000875002879	EE	On-Demand	Anodyne	ROCK2	40	41
N#Cc1c(NC(=O)CCCOC2CCOCC2)sc2c1CCCC2	ZINC000875002881	EG	On-Demand	Mild	VIPR1	34	53
C[C@H](NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)c1cccnc1	ZINC000875002886	FD	On-Demand	Anodyne	KCNA5	22	40
C[C@H](NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)c1cccnc1	ZINC000875002886	FD	On-Demand	Anodyne	PREP	23	41
C[C@H](NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)c1cccnc1	ZINC000875002887	FD	On-Demand	Anodyne	KCNA5	22	40
C[C@H](NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)c1cccnc1	ZINC000875002887	FD	On-Demand	Anodyne	PREP	23	41
C[C@H](NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)c1cccnc1	ZINC000875002888	FD	On-Demand	Anodyne	KCNA5	22	40
C[C@H](NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)c1cccnc1	ZINC000875002888	FD	On-Demand	Anodyne	PREP	23	41
C[C@H](NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)c1cccnc1	ZINC000875002889	FD	On-Demand	Anodyne	KCNA5	22	40
C[C@H](NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)c1cccnc1	ZINC000875002889	FD	On-Demand	Anodyne	PREP	23	41
N#Cc1c(NC(=O)[C@@H]2[C@H]3CC[C@]4(COC(=O)[C@H]24)O3)sc2c1CCCC2	ZINC000875002913	FE	On-Demand	Mild	VIPR1	26	42
N#Cc1c(NC(=O)c2cnc3nccn3c2)sc2c1CCCC2	ZINC000875002914	DF	On-Demand	Mild	VIPR1	29	46
CCOC1CC2(C1)C[C@@H]2NC(=O)NC[C@@H](Cc1ccccc1)N(C)C	ZINC000875002922	EE	On-Demand	Anodyne	TIMP3	85	39
CCOC1CC2(C1)C[C@H]2NC(=O)NC[C@@H](Cc1ccccc1)N(C)C	ZINC000875002924	EE	On-Demand	Anodyne	TIMP3	85	39
C[C@H](NC(=O)C(=O)NC[C@H]1c2ccccc2CN1C)c1cccnc1	ZINC000875002925	ED	On-Demand	Anodyne	KCNA5	22	41
CCOC1CC2(C1)C[C@@H]2NC(=O)NC[C@H](Cc1ccccc1)N(C)C	ZINC000875002926	EE	On-Demand	Anodyne	TIMP3	85	39
C[C@H](NC(=O)C(=O)NC[C@@H]1c2ccccc2CN1C)c1cccnc1	ZINC000875002927	ED	On-Demand	Anodyne	KCNA5	22	41
CCOC1CC2(C1)C[C@H]2NC(=O)NC[C@H](Cc1ccccc1)N(C)C	ZINC000875002928	EE	On-Demand	Anodyne	TIMP3	85	39
CCOC1CC2(C1)C[C@H]2C(=O)Nc1nc2ccc(Cl)cc2s1	ZINC000875002941	EI	On-Demand	Anodyne	CSNK1D	46	48
COc1cccc([C@H](CNC(=O)N2CCCN(C=O)CC2)N(C)C)c1	ZINC000875002945	ED	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@H](CNC(=O)N2CC[C@H]3[C@H](CCN3C)C2)N(C)C)c1	ZINC000875002986	FE	On-Demand	Anodyne	DRD4	44	34
COc1cccc([C@H](CNC(=O)N2CC[C@@H]3[C@H](CCN3C)C2)N(C)C)c1	ZINC000875002987	FE	On-Demand	Anodyne	DRD4	44	34
COc1cccc([C@H](CNC(=O)N2CC[C@@H]3[C@@H](CCN3C)C2)N(C)C)c1	ZINC000875002988	FE	On-Demand	Anodyne	DRD4	44	34
COc1cccc([C@H](CNC(=O)N2CC[C@H]3[C@@H](CCN3C)C2)N(C)C)c1	ZINC000875002989	FE	On-Demand	Anodyne	DRD4	44	34
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1cccc(OC)c1)N(C)C	ZINC000875003010	GE	On-Demand	Anodyne	SLC6A4	19	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1cccc(OC)c1)N(C)C	ZINC000875003010	GE	On-Demand	Anodyne	SLC6A3	38	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)C1	ZINC000875003012	FD	On-Demand	Anodyne	CAPNS1	65	34
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)C1	ZINC000875003012	FD	On-Demand	Anodyne	CAPN1	54	35
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)C1	ZINC000875003012	FD	On-Demand	Anodyne	CAPN2	60	34
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1cccc(OC)c1)N(C)C	ZINC000875003013	GE	On-Demand	Anodyne	SLC6A4	19	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1cccc(OC)c1)N(C)C	ZINC000875003013	GE	On-Demand	Anodyne	SLC6A3	38	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1cccc(OC)c1)N(C)C	ZINC000875003015	GE	On-Demand	Anodyne	SLC6A4	19	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1cccc(OC)c1)N(C)C	ZINC000875003015	GE	On-Demand	Anodyne	SLC6A3	38	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H](Cc2ccccc2)N(C)C)C1	ZINC000875003016	FD	On-Demand	Anodyne	CAPNS1	65	34
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H](Cc2ccccc2)N(C)C)C1	ZINC000875003016	FD	On-Demand	Anodyne	CAPN1	54	35
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H](Cc2ccccc2)N(C)C)C1	ZINC000875003016	FD	On-Demand	Anodyne	CAPN2	60	34
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1cccc(OC)c1)N(C)C	ZINC000875003017	GE	On-Demand	Anodyne	SLC6A4	19	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1cccc(OC)c1)N(C)C	ZINC000875003017	GE	On-Demand	Anodyne	SLC6A3	38	41
CN(C)[C@@H](CNC(=O)N1CCC[C@H](C(C)(C)O)C1)c1cccc(F)c1	ZINC000875003044	FF	On-Demand	Anodyne	REN	15	42
CN(C)[C@@H](CNC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1cccc(F)c1	ZINC000875003047	FF	On-Demand	Anodyne	REN	15	42
COC(=O)N(C)NC(=O)N[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000875003055	DF	On-Demand	Reactive	PDS	40	33
COC(=O)N(C)NC(=O)N[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000875003057	DF	On-Demand	Reactive	PDS	40	33
COc1cccc([C@H](CNC(=O)NNC(=O)[C@@H]2CCCN(C)[C@@H]2C)N(C)C)c1	ZINC000875003064	GD	On-Demand	Reactive	DRD4	42	32
C[C@H](NC(=O)C(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C)c1cccnc1	ZINC000875003073	GD	On-Demand	Anodyne	GPR119	20	42
COc1cccc([C@H](CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)N(C)C)c1	ZINC000875003079	GD	On-Demand	Anodyne	MTNR1A	17	40
COc1cccc([C@H](CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)N(C)C)c1	ZINC000875003079	GD	On-Demand	Anodyne	MTNR1B	20	40
COc1cccc([C@H](CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)N(C)C)c1	ZINC000875003079	GD	On-Demand	Anodyne	MCHR1	15	43
COc1cccc([C@H](CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)N(C)C)c1	ZINC000875003079	GD	On-Demand	Anodyne	HPGDS	17	40
CN(C)[C@@H](CNC(=O)NCc1ccc2oc(O)nc2c1)Cc1ccccc1	ZINC000875003082	FF	On-Demand	Anodyne	TPH1	41	32
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1cccc(C(F)(F)F)c1	ZINC000875003086	EF	On-Demand	Anodyne	KCNQ2	31	41
COc1cccc([C@H](CNC(=O)N2Cc3cccc(O)c3C2)N(C)C)c1	ZINC000875003093	FF	On-Demand	Clean	DRD4	43	33
CCn1ncc(CNC(=O)NC[C@@H](c2cccc(OC)c2)N(C)C)n1	ZINC000875003096	ED	On-Demand	Anodyne	ROCK2	46	38
CCn1ncc(CNC(=O)NC[C@H](c2cccc(OC)c2)N(C)C)n1	ZINC000875003097	ED	On-Demand	Anodyne	ROCK2	46	38
N#Cc1c(NC(=O)[C@@H]2COC(=O)N2)sc2c1CCCC2	ZINC000875003098	CD	On-Demand	Mild	VIPR1	30	49
N#Cc1c(NC(=O)Cc2ccc(Cl)cn2)sc2c1CCCC2	ZINC000875003124	EH	On-Demand	Mild	VIPR1	36	58
CCO[C@@H](C(=O)Nc1sc2c(c1C#N)CCCC2)[C@@H]1CCOC1	ZINC000875003132	EF	On-Demand	Mild	VIPR1	28	44
CCO[C@@H](C(=O)Nc1sc2c(c1C#N)CCCC2)[C@H]1CCOC1	ZINC000875003135	EF	On-Demand	Mild	VIPR1	28	44
COc1cccc([C@H](CNC(=O)N[C@H](C)c2ccccc2O)N(C)C)c1	ZINC000875003151	FG	On-Demand	Clean	MTNR1A	30	40
COc1cccc([C@H](CNC(=O)N[C@H](C)c2ccccc2O)N(C)C)c1	ZINC000875003151	FG	On-Demand	Clean	MTNR1B	32	40
COc1cccc([C@H](CNC(=O)N[C@H](C)c2ccccc2O)N(C)C)c1	ZINC000875003151	FG	On-Demand	Clean	SOAT1	32	41
COc1cccc([C@H](CNC(=O)N[C@@H](C)c2ccccc2O)N(C)C)c1	ZINC000875003152	FG	On-Demand	Clean	MTNR1A	30	40
COc1cccc([C@H](CNC(=O)N[C@@H](C)c2ccccc2O)N(C)C)c1	ZINC000875003152	FG	On-Demand	Clean	MTNR1B	32	40
COc1cccc([C@H](CNC(=O)N[C@@H](C)c2ccccc2O)N(C)C)c1	ZINC000875003152	FG	On-Demand	Clean	SOAT1	32	41
COc1cccc([C@H](CNC(=O)N2CCN(C)c3ncccc3C2)N(C)C)c1	ZINC000875003176	GE	On-Demand	Anodyne	DRD4	42	32
C[C@@H](CCc1ccco1)NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875003199	GG	On-Demand	Anodyne	C3AR1	40	40
C[C@@H](CCc1ccco1)NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875003201	GG	On-Demand	Anodyne	C3AR1	40	40
C#CC[C@@H](COC)NC(=O)NC[C@@H](Cc1ccccc1)N(C)C	ZINC000875003204	DD	On-Demand	Mild	PAPA1_CARPA	48	36
C#CC[C@H](COC)NC(=O)NC[C@@H](Cc1ccccc1)N(C)C	ZINC000875003205	DD	On-Demand	Mild	PAPA1_CARPA	48	36
C#CC[C@@H](COC)NC(=O)NC[C@H](Cc1ccccc1)N(C)C	ZINC000875003206	DD	On-Demand	Mild	PAPA1_CARPA	48	36
C#CC[C@H](COC)NC(=O)NC[C@H](Cc1ccccc1)N(C)C	ZINC000875003208	DD	On-Demand	Mild	PAPA1_CARPA	48	36
N#Cc1c(NC(=O)[C@H]2OCCO[C@H]2C(F)(F)F)sc2c1CCCC2	ZINC000875003210	FF	On-Demand	Mild	VIPR1	29	47
COc1cccc([C@H](CNC(=O)NCCc2cn(C)c3ncccc23)N(C)C)c1	ZINC000875003244	GF	On-Demand	Anodyne	NQO2	18	41
COc1cccc([C@H](CNC(=O)NCCc2cn(C)c3ncccc23)N(C)C)c1	ZINC000875003244	GF	On-Demand	Anodyne	MTNR1A	57	46
COc1cccc([C@H](CNC(=O)NCCc2cn(C)c3ncccc23)N(C)C)c1	ZINC000875003244	GF	On-Demand	Anodyne	MTNR1B	44	41
COc1cccc([C@H](CNC(=O)N2CCC(CO)(CO)CC2)N(C)C)c1	ZINC000875003256	FD	On-Demand	Anodyne	DRD4	41	32
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1cccnc1	ZINC000875003259	GF	On-Demand	Anodyne	DRD2	20	42
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1cccnc1	ZINC000875003259	GF	On-Demand	Anodyne	DRD4	36	44
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1cccnc1	ZINC000875003259	GF	On-Demand	Anodyne	ACHE	61	65
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1cccnc1	ZINC000875003259	GF	On-Demand	Anodyne	SLC6A3	21	52
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1cccnc1	ZINC000875003259	GF	On-Demand	Anodyne	HTR4	28	43
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1cccnc1	ZINC000875003259	GF	On-Demand	Anodyne	CHRM3	15	42
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1cccnc1	ZINC000875003259	GF	On-Demand	Anodyne	ADRB3	22	43
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1cccnc1	ZINC000875003259	GF	On-Demand	Anodyne	PTAFR	27	45
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1cccnc1	ZINC000875003259	GF	On-Demand	Anodyne	KCNA5	24	41
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1cccnc1	ZINC000875003259	GF	On-Demand	Anodyne	SIGMAR1	46	47
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1cccnc1	ZINC000875003259	GF	On-Demand	Anodyne	CTSK	23	41
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1cccnc1	ZINC000875003259	GF	On-Demand	Anodyne	BCHE	16	47
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1cccnc1	ZINC000875003259	GF	On-Demand	Anodyne	CHRNA7	41	36
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1cccnc1	ZINC000875003259	GF	On-Demand	Anodyne	CAPN2	43	35
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1cccnc1	ZINC000875003259	GF	On-Demand	Anodyne	MCHR1	25	42
N#Cc1c(NC(=O)CN2CCCCC(=O)C2=O)sc2c1CCCC2	ZINC000875003260	EE	On-Demand	Mild	VIPR1	34	54
COc1cccc([C@H](CNC(=O)N[C@H](C)c2ccns2)N(C)C)c1	ZINC000875003261	EF	On-Demand	Anodyne	ROCK1	21	43
COc1cccc([C@H](CNC(=O)N[C@H](C)c2ccns2)N(C)C)c1	ZINC000875003261	EF	On-Demand	Anodyne	ROCK2	21	43
COc1cccc([C@H](CNC(=O)N[C@@H](C)c2ccns2)N(C)C)c1	ZINC000875003264	EF	On-Demand	Anodyne	ROCK1	21	43
COc1cccc([C@H](CNC(=O)N[C@@H](C)c2ccns2)N(C)C)c1	ZINC000875003264	EF	On-Demand	Anodyne	ROCK2	21	43
COc1cccc([C@H](CNC(=O)N2CCC3(CCN(C)CC3)CC2)N(C)C)c1	ZINC000875003276	GF	On-Demand	Anodyne	DRD4	44	33
CC(C)n1ncc(C(=O)Nc2sc3c(c2C#N)CCCC3)c1Cl	ZINC000875003280	EI	On-Demand	Mild	VIPR1	30	47
CCCCCCCNC(=O)C(=O)N[C@H](C)c1cccnc1	ZINC000875003283	CE	On-Demand	Mild	ADRB3	32	43
CCCCCCCNC(=O)C(=O)N[C@H](C)c1cccnc1	ZINC000875003283	CE	On-Demand	Mild	PTAFR	35	44
CCCCCCCNC(=O)C(=O)N[C@H](C)c1cccnc1	ZINC000875003283	CE	On-Demand	Mild	KCNA5	22	43
CCCCCCCNC(=O)C(=O)N[C@H](C)c1cccnc1	ZINC000875003283	CE	On-Demand	Mild	SOAT1	43	37
CCCCCCCNC(=O)C(=O)N[C@H](C)c1cccnc1	ZINC000875003283	CE	On-Demand	Mild	FAAH	17	47
CCCCCCCNC(=O)C(=O)N[C@H](C)c1cccnc1	ZINC000875003283	CE	On-Demand	Mild	ASAH1	88	39
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1cccnc1	ZINC000875003284	CE	On-Demand	Mild	ADRB3	32	43
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1cccnc1	ZINC000875003284	CE	On-Demand	Mild	PTAFR	35	44
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1cccnc1	ZINC000875003284	CE	On-Demand	Mild	KCNA5	22	43
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1cccnc1	ZINC000875003284	CE	On-Demand	Mild	SOAT1	43	37
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1cccnc1	ZINC000875003284	CE	On-Demand	Mild	FAAH	17	47
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1cccnc1	ZINC000875003284	CE	On-Demand	Mild	ASAH1	88	39
O=C(CN1CCCCC(=O)C1=O)Nc1nc2ccc(Cl)cc2s1	ZINC000875003285	FE	On-Demand	Anodyne	CSNK1D	49	48
N#Cc1c(NC(=O)c2scnc2C(F)F)sc2c1CCCC2	ZINC000875003288	EI	On-Demand	Mild	VIPR1	31	49
Cn1nc(Cl)c(C(=O)Nc2sc3c(c2C#N)CCCC3)c1Cl	ZINC000875003305	FH	On-Demand	Mild	VIPR1	30	47
COc1cccc([C@H](CNC(=O)N2CCN([S@](C)(=N)=O)CC2)N(C)C)c1	ZINC000875003308	GD	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@H](CNC(=O)N2CCN([S@@](C)(=N)=O)CC2)N(C)C)c1	ZINC000875003309	GD	On-Demand	Anodyne	DRD4	41	32
C[C@@H](NC(=O)N1CC(CNC(=O)C(F)(F)F)C1)c1cccc(C(F)(F)F)c1	ZINC000875003310	GG	On-Demand	Anodyne	CCR2	61	38
N#Cc1c(NC(=O)Cc2cccc3ncccc23)sc2c1CCCC2	ZINC000875003316	EI	On-Demand	Mild	MAPK9	20	57
N#Cc1c(NC(=O)Cc2cccc3ncccc23)sc2c1CCCC2	ZINC000875003316	EI	On-Demand	Mild	MAPK10	19	57
N#Cc1c(NC(=O)Cc2cccc3ncccc23)sc2c1CCCC2	ZINC000875003316	EI	On-Demand	Mild	MAPK8	17	54
N#Cc1c(NC(=O)Cc2cccc3ncccc23)sc2c1CCCC2	ZINC000875003316	EI	On-Demand	Mild	VIPR1	36	58
C#C[C@@H]1CC[C@@H](NC(=O)NC[C@@H](c2cccc(OC)c2)N(C)C)CC1	ZINC000875003318	EF	On-Demand	Mild	MTNR1A	23	41
C#C[C@@H]1CC[C@@H](NC(=O)NC[C@@H](c2cccc(OC)c2)N(C)C)CC1	ZINC000875003318	EF	On-Demand	Mild	MTNR1B	23	41
C#C[C@@H]1CC[C@@H](NC(=O)NC[C@H](c2cccc(OC)c2)N(C)C)CC1	ZINC000875003319	EF	On-Demand	Mild	MTNR1A	23	41
C#C[C@@H]1CC[C@@H](NC(=O)NC[C@H](c2cccc(OC)c2)N(C)C)CC1	ZINC000875003319	EF	On-Demand	Mild	MTNR1B	23	41
CC[C@@H](NC(=O)C(=O)N[C@H](C)c1cccnc1)c1cccc(OC)c1OC	ZINC000875003322	FF	On-Demand	Anodyne	TACR3	27	40
CC[C@@H](NC(=O)C(=O)N[C@@H](C)c1cccnc1)c1cccc(OC)c1OC	ZINC000875003323	FF	On-Demand	Anodyne	TACR3	27	40
CCO[C@@H](C(=O)Nc1nc2ccc(Cl)cc2s1)C1CCOCC1	ZINC000875003325	FH	On-Demand	Anodyne	LCK	30	41
CCO[C@@H](C(=O)Nc1nc2ccc(Cl)cc2s1)C1CCOCC1	ZINC000875003325	FH	On-Demand	Anodyne	CSNK1D	47	48
Cc1ccn(C[C@H](C)C(=O)Nc2sc3c(c2C#N)CCCC3)n1	ZINC000875003335	EG	On-Demand	Mild	VIPR1	32	52
N#Cc1c(NC(=O)c2cc(C(F)(F)F)ncn2)sc2c1CCCC2	ZINC000875003344	FH	On-Demand	Mild	VIPR1	30	48
CC(C)n1ncc(C(=O)Nc2sc3c(c2C#N)CCCC3)c1Br	ZINC000875003349	GI	On-Demand	Mild	VIPR1	30	47
C[C@H]1CC(=O)N[C@@H](C(=O)Nc2sc3c(c2C#N)CCCC3)C1	ZINC000875003354	DE	On-Demand	Mild	VIPR1	30	47
C[C@H](NC(=O)C(=O)N1CCN(c2ccc(C#N)cc2)CC1)c1cccnc1	ZINC000875003355	FD	On-Demand	Mild	PTAFR	33	45
COc1cccc([C@H](CNC(=O)N[C@@H]2CCCC[C@@H]2F)N(C)C)c1	ZINC000875003371	EF	On-Demand	Anodyne	MTNR1A	28	42
COc1cccc([C@H](CNC(=O)N[C@@H]2CCCC[C@@H]2F)N(C)C)c1	ZINC000875003371	EF	On-Demand	Anodyne	MTNR1B	28	42
COc1cccc([C@H](CNC(=O)NNc2cccc(C)n2)N(C)C)c1	ZINC000875003373	EE	On-Demand	Reactive	MTNR1A	31	40
COc1cccc([C@H](CNC(=O)NNc2cccc(C)n2)N(C)C)c1	ZINC000875003373	EE	On-Demand	Reactive	MTNR1B	32	40
CO[C@H](C(=O)Nc1sc2c(c1C#N)CCCC2)C(=O)OC(C)(C)C	ZINC000875003375	FF	On-Demand	Mild	VIPR1	33	52
CC[C@]1(C(=O)Nc2sc3c(c2C#N)CCCC3)CCNC1=O	ZINC000875003389	DE	On-Demand	Mild	VIPR1	31	48
COc1cccc([C@H](CNC(=O)NC[C@H]2C[C@H](O)C2)N(C)C)c1	ZINC000875003391	DD	On-Demand	Anodyne	MTNR1A	34	40
COc1cccc([C@H](CNC(=O)NC[C@H]2C[C@H](O)C2)N(C)C)c1	ZINC000875003391	DD	On-Demand	Anodyne	MTNR1B	32	40
CN(C)[C@@H](CNC(=O)NCc1nc(-c2ccncc2)cs1)c1cccc(F)c1	ZINC000875003398	GG	On-Demand	Anodyne	ROCK1	28	54
CN(C)[C@@H](CNC(=O)NCc1nc(-c2ccncc2)cs1)c1cccc(F)c1	ZINC000875003398	GG	On-Demand	Anodyne	ROCK2	21	54
N#Cc1c(NC(=O)[C@@H]2CNC(=O)C[C@H]2C(F)(F)F)sc2c1CCCC2	ZINC000875003403	FF	On-Demand	Mild	VIPR1	29	46
N#Cc1c(NC(=O)[C@@H]2CNC(=O)C[C@@H]2C(F)(F)F)sc2c1CCCC2	ZINC000875003404	FF	On-Demand	Mild	VIPR1	29	46
N#Cc1c(NC(=O)[C@H]2CNC(=O)C[C@@H]2C(F)(F)F)sc2c1CCCC2	ZINC000875003405	FF	On-Demand	Mild	VIPR1	29	46
N#Cc1c(NC(=O)[C@H]2CNC(=O)C[C@H]2C(F)(F)F)sc2c1CCCC2	ZINC000875003406	FF	On-Demand	Mild	VIPR1	29	46
O=C1CC[C@H](C(=O)Nc2nc3ccc(Cl)cc3s2)O1	ZINC000875003412	CF	On-Demand	Anodyne	LCK	27	45
O=C1CC[C@H](C(=O)Nc2nc3ccc(Cl)cc3s2)O1	ZINC000875003412	CF	On-Demand	Anodyne	CSNK1D	45	45
CC(=O)[C@H]1CCCN(C(=O)NC[C@H](c2cccc(F)c2)N(C)C)C1	ZINC000875003415	EE	On-Demand	Anodyne	SLC6A1	30	40
CC(=O)[C@@H]1CCCN(C(=O)NC[C@H](c2cccc(F)c2)N(C)C)C1	ZINC000875003416	EE	On-Demand	Anodyne	SLC6A1	30	40
CC(=O)[C@H]1CCCN(C(=O)NC[C@@H](c2cccc(F)c2)N(C)C)C1	ZINC000875003417	EE	On-Demand	Anodyne	SLC6A1	30	40
CC(=O)[C@@H]1CCCN(C(=O)NC[C@@H](c2cccc(F)c2)N(C)C)C1	ZINC000875003418	EE	On-Demand	Anodyne	SLC6A1	30	40
N#Cc1c(NC(=O)c2c(C(F)F)nc3n2CCCC3)sc2c1CCCC2	ZINC000875003424	GI	On-Demand	Mild	VIPR1	27	43
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1cccc(C(F)(F)F)c1	ZINC000875003425	FI	On-Demand	Anodyne	CCR2	58	36
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1cccc(C(F)(F)F)c1	ZINC000875003426	FI	On-Demand	Anodyne	CCR2	58	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2cccc(C(F)(F)F)c2)C1	ZINC000875003433	FH	On-Demand	Anodyne	TACR1	37	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2cccc(C(F)(F)F)c2)C1	ZINC000875003433	FH	On-Demand	Anodyne	CCR2	64	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2cccc(C(F)(F)F)c2)C1	ZINC000875003433	FH	On-Demand	Anodyne	PDS	45	33
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2cccc(C(F)(F)F)c2)C1	ZINC000875003436	FH	On-Demand	Anodyne	TACR1	37	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2cccc(C(F)(F)F)c2)C1	ZINC000875003436	FH	On-Demand	Anodyne	CCR2	64	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2cccc(C(F)(F)F)c2)C1	ZINC000875003436	FH	On-Demand	Anodyne	PDS	45	33
COc1cccc([C@H](CNC(=O)N2CC[C@H]3CS(=O)(=O)C[C@@H]3C2)N(C)C)c1	ZINC000875003445	GD	On-Demand	Anodyne	DRD4	42	32
COc1cccc([C@H](CNC(=O)N2CC[C@H]3CS(=O)(=O)C[C@H]3C2)N(C)C)c1	ZINC000875003446	GD	On-Demand	Anodyne	DRD4	42	32
COc1cccc([C@H](CNC(=O)N2CC[C@@H]3CS(=O)(=O)C[C@H]3C2)N(C)C)c1	ZINC000875003447	GD	On-Demand	Anodyne	DRD4	42	32
COc1cccc([C@H](CNC(=O)N2CC[C@@H]3CS(=O)(=O)C[C@@H]3C2)N(C)C)c1	ZINC000875003448	GD	On-Demand	Anodyne	DRD4	42	32
N#Cc1c(NC(=O)COCc2ccnc(O)c2)sc2c1CCCC2	ZINC000875003468	EF	On-Demand	Mild	VIPR1	35	55
CC[C@@H](CNC(=O)C(=O)N[C@H](C)c1cc2cnccc2o1)c1ccccc1	ZINC000875003477	FG	On-Demand	Anodyne	KCNA5	15	40
CC[C@@H](CNC(=O)C(=O)N[C@@H](C)c1cc2cnccc2o1)c1ccccc1	ZINC000875003478	FG	On-Demand	Anodyne	KCNA5	15	40
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003486	GD	On-Demand	Anodyne	CHRM2	21	43
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003486	GD	On-Demand	Anodyne	CHRM1	22	43
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003486	GD	On-Demand	Anodyne	DRD2	21	56
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003486	GD	On-Demand	Anodyne	DRD4	54	56
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003486	GD	On-Demand	Anodyne	ACHE	39	44
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003486	GD	On-Demand	Anodyne	DRD3	17	48
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003486	GD	On-Demand	Anodyne	CHRM3	28	43
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003486	GD	On-Demand	Anodyne	LTA4H	19	43
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003486	GD	On-Demand	Anodyne	SIGMAR1	56	52
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003486	GD	On-Demand	Anodyne	CCR3	40	48
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003486	GD	On-Demand	Anodyne	CCR5	40	40
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003486	GD	On-Demand	Anodyne	UTS2R	22	44
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003486	GD	On-Demand	Anodyne	MLNR	58	38
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003486	GD	On-Demand	Anodyne	CCR2	19	45
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003486	GD	On-Demand	Anodyne	EPHX2	26	43
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003486	GD	On-Demand	Anodyne	MCHR1	42	53
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003486	GD	On-Demand	Anodyne	CACNA1G	18	42
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003486	GD	On-Demand	Anodyne	BIRC2	28	44
CN(C)C[C@@H]1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003487	GD	On-Demand	Anodyne	CHRM2	21	43
CN(C)C[C@@H]1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003487	GD	On-Demand	Anodyne	CHRM1	22	43
CN(C)C[C@@H]1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003487	GD	On-Demand	Anodyne	DRD2	21	56
CN(C)C[C@@H]1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003487	GD	On-Demand	Anodyne	DRD4	54	56
CN(C)C[C@@H]1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003487	GD	On-Demand	Anodyne	ACHE	39	44
CN(C)C[C@@H]1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003487	GD	On-Demand	Anodyne	DRD3	17	48
CN(C)C[C@@H]1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003487	GD	On-Demand	Anodyne	CHRM3	28	43
CN(C)C[C@@H]1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003487	GD	On-Demand	Anodyne	LTA4H	19	43
CN(C)C[C@@H]1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003487	GD	On-Demand	Anodyne	SIGMAR1	56	52
CN(C)C[C@@H]1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003487	GD	On-Demand	Anodyne	CCR3	40	48
CN(C)C[C@@H]1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003487	GD	On-Demand	Anodyne	CCR5	40	40
CN(C)C[C@@H]1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003487	GD	On-Demand	Anodyne	UTS2R	22	44
CN(C)C[C@@H]1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003487	GD	On-Demand	Anodyne	MLNR	58	38
CN(C)C[C@@H]1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003487	GD	On-Demand	Anodyne	CCR2	19	45
CN(C)C[C@@H]1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003487	GD	On-Demand	Anodyne	EPHX2	26	43
CN(C)C[C@@H]1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003487	GD	On-Demand	Anodyne	MCHR1	42	53
CN(C)C[C@@H]1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003487	GD	On-Demand	Anodyne	CACNA1G	18	42
CN(C)C[C@@H]1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875003487	GD	On-Demand	Anodyne	BIRC2	28	44
C[C@@H](NC(=O)N1CCc2c(CC(N)=O)cccc2C1)c1cccc2ccccc12	ZINC000875003495	GH	On-Demand	Anodyne	Q6PRC7_IXORI	57	38
COc1cccc([C@H](CNC(=O)N[C@H](C)c2nccnc2C)N(C)C)c1	ZINC000875003525	FE	On-Demand	Anodyne	ROCK1	24	41
COc1cccc([C@H](CNC(=O)N[C@@H](C)c2nccnc2C)N(C)C)c1	ZINC000875003531	FE	On-Demand	Anodyne	ROCK1	24	41
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1cccnc1	ZINC000875003535	FG	On-Demand	Anodyne	ADRB3	56	42
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1cccnc1	ZINC000875003535	FG	On-Demand	Anodyne	TBXAS1	58	45
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1cccnc1	ZINC000875003535	FG	On-Demand	Anodyne	PTAFR	51	52
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1cccnc1	ZINC000875003535	FG	On-Demand	Anodyne	KCNA5	26	52
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1cccnc1	ZINC000875003535	FG	On-Demand	Anodyne	CTSB	21	40
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1cccnc1	ZINC000875003535	FG	On-Demand	Anodyne	CYSP_TRYCR	23	40
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1cccnc1	ZINC000875003535	FG	On-Demand	Anodyne	CTSL	15	40
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1cccnc1	ZINC000875003535	FG	On-Demand	Anodyne	BRS3	16	44
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1cccnc1	ZINC000875003535	FG	On-Demand	Anodyne	MTNR1A	18	41
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1cccnc1	ZINC000875003535	FG	On-Demand	Anodyne	MTNR1B	20	41
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1cccnc1	ZINC000875003535	FG	On-Demand	Anodyne	FAAH	65	43
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1cccnc1	ZINC000875003535	FG	On-Demand	Anodyne	CAPN1	30	40
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1cccnc1	ZINC000875003535	FG	On-Demand	Anodyne	CES1	66	40
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1cccnc1	ZINC000875003535	FG	On-Demand	Anodyne	CAPN2	69	40
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1cccnc1	ZINC000875003535	FG	On-Demand	Anodyne	AMP1_PLAFQ	26	46
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1cccnc1	ZINC000875003535	FG	On-Demand	Anodyne	NAMPT	18	45
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1cccnc1	ZINC000875003535	FG	On-Demand	Anodyne	CES1D	46	34
CN(C)[C@@H](CNC(=O)N1CCC(CO)(CO)CC1)c1cccc(F)c1	ZINC000875003545	FD	On-Demand	Anodyne	CACNA1H	43	39
COc1cccc([C@H](CNC(=O)N2CCC(c3nnnn3C)CC2)N(C)C)c1	ZINC000875003549	GD	On-Demand	Anodyne	DRD4	40	30
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1cccc2ccccc12	ZINC000875003556	EF	On-Demand	Anodyne	Q6PRC7_IXORI	48	34
COCC1CC(NC(=O)NC[C@@H](c2cccc(OC)c2)N(C)C)C1	ZINC000875003571	EE	On-Demand	Anodyne	MTNR1A	35	40
COCC1CC(NC(=O)NC[C@@H](c2cccc(OC)c2)N(C)C)C1	ZINC000875003571	EE	On-Demand	Anodyne	MTNR1B	33	40
O=C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CCCCCCN1	ZINC000875003572	FE	On-Demand	Anodyne	CHRM2	20	43
O=C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CCCCCCN1	ZINC000875003572	FE	On-Demand	Anodyne	DRD2	18	50
O=C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CCCCCCN1	ZINC000875003572	FE	On-Demand	Anodyne	DRD4	47	50
O=C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CCCCCCN1	ZINC000875003572	FE	On-Demand	Anodyne	ACHE	40	44
O=C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CCCCCCN1	ZINC000875003572	FE	On-Demand	Anodyne	CHRM3	26	43
O=C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CCCCCCN1	ZINC000875003572	FE	On-Demand	Anodyne	HRH3	15	42
O=C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CCCCCCN1	ZINC000875003572	FE	On-Demand	Anodyne	SIGMAR1	49	52
O=C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CCCCCCN1	ZINC000875003572	FE	On-Demand	Anodyne	CCR3	41	51
O=C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CCCCCCN1	ZINC000875003572	FE	On-Demand	Anodyne	MLNR	45	37
O=C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CCCCCCN1	ZINC000875003572	FE	On-Demand	Anodyne	CCR2	15	41
O=C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CCCCCCN1	ZINC000875003572	FE	On-Demand	Anodyne	MCHR1	34	50
O=C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CCCCCCN1	ZINC000875003572	FE	On-Demand	Anodyne	CACNA1G	28	46
O=C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CCCCCCN1	ZINC000875003572	FE	On-Demand	Anodyne	BIRC2	25	44
O=C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CCCCCCN1	ZINC000875003573	FE	On-Demand	Anodyne	CHRM2	20	43
O=C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CCCCCCN1	ZINC000875003573	FE	On-Demand	Anodyne	DRD2	18	50
O=C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CCCCCCN1	ZINC000875003573	FE	On-Demand	Anodyne	DRD4	47	50
O=C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CCCCCCN1	ZINC000875003573	FE	On-Demand	Anodyne	ACHE	40	44
O=C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CCCCCCN1	ZINC000875003573	FE	On-Demand	Anodyne	CHRM3	26	43
O=C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CCCCCCN1	ZINC000875003573	FE	On-Demand	Anodyne	HRH3	15	42
O=C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CCCCCCN1	ZINC000875003573	FE	On-Demand	Anodyne	SIGMAR1	49	52
O=C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CCCCCCN1	ZINC000875003573	FE	On-Demand	Anodyne	CCR3	41	51
O=C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CCCCCCN1	ZINC000875003573	FE	On-Demand	Anodyne	MLNR	45	37
O=C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CCCCCCN1	ZINC000875003573	FE	On-Demand	Anodyne	CCR2	15	41
O=C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CCCCCCN1	ZINC000875003573	FE	On-Demand	Anodyne	MCHR1	34	50
O=C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CCCCCCN1	ZINC000875003573	FE	On-Demand	Anodyne	CACNA1G	28	46
O=C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CCCCCCN1	ZINC000875003573	FE	On-Demand	Anodyne	BIRC2	25	44
COCC1CC(NC(=O)NC[C@H](c2cccc(OC)c2)N(C)C)C1	ZINC000875003574	EE	On-Demand	Anodyne	MTNR1A	35	40
COCC1CC(NC(=O)NC[C@H](c2cccc(OC)c2)N(C)C)C1	ZINC000875003574	EE	On-Demand	Anodyne	MTNR1B	33	40
N#Cc1c(NC(=O)Cc2csc(C3CC3)n2)sc2c1CCCC2	ZINC000875003584	EI	On-Demand	Mild	VIPR1	33	52
CC[C@H](CNC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875003585	ED	On-Demand	Anodyne	NPY2R	45	38
CC[C@@H](CNC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875003586	ED	On-Demand	Anodyne	NPY2R	45	38
CC[C@@H](CNC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875003587	ED	On-Demand	Anodyne	NPY2R	45	38
CC[C@H](CNC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875003588	ED	On-Demand	Anodyne	NPY2R	45	38
C[C@H](NC(=O)C(=O)N1C[C@@H]2CN(Cc3ccccc3)C[C@]2(C)C1)c1cccnc1	ZINC000875003590	GE	On-Demand	Anodyne	PTAFR	21	43
C[C@H](NC(=O)C(=O)N1C[C@@H]2CN(Cc3ccccc3)C[C@]2(C)C1)c1cccnc1	ZINC000875003590	GE	On-Demand	Anodyne	CTSK	24	45
COc1cccc([C@H](CNC(=O)N2CCC(C(=O)NCCO)CC2)N(C)C)c1	ZINC000875003606	GC	On-Demand	Anodyne	DRD4	42	32
COc1cccc([C@H](CNC(=O)N2CCC(C(=O)NCCO)CC2)N(C)C)c1	ZINC000875003606	GC	On-Demand	Anodyne	MTNR1A	35	46
COc1cccc([C@H](CNC(=O)N2CCC(C(=O)NCCO)CC2)N(C)C)c1	ZINC000875003606	GC	On-Demand	Anodyne	MTNR1B	35	46
C[C@H](NC(=O)C(=O)N1CC[C@@H]2[C@@H](CCN2C)C1)c1cccnc1	ZINC000875003611	DC	On-Demand	Anodyne	CHRNA7	41	34
C[C@H](NC(=O)C(=O)N1CC[C@H]2[C@H](CCN2C)C1)c1cccnc1	ZINC000875003612	DC	On-Demand	Anodyne	CHRNA7	41	34
C[C@H](NC(=O)C(=O)N1CC[C@@H]2[C@H](CCN2C)C1)c1cccnc1	ZINC000875003613	DC	On-Demand	Anodyne	CHRNA7	41	34
C[C@H](NC(=O)C(=O)N1CC[C@H]2[C@@H](CCN2C)C1)c1cccnc1	ZINC000875003614	DC	On-Demand	Anodyne	CHRNA7	41	34
CC(C)(C(=O)Nc1sc2c(c1C#N)CCCC2)c1ccc(C#N)cc1	ZINC000875003618	EI	On-Demand	Mild	VIPR1	34	53
N#C[C@@]1(C(=O)Nc2nc3ccc(Cl)cc3s2)CCCOC1	ZINC000875003619	DG	On-Demand	Mild	CSNK1D	39	41
N#C[C@]1(C(=O)Nc2nc3ccc(Cl)cc3s2)CCCOC1	ZINC000875003620	DG	On-Demand	Mild	CSNK1D	39	41
N#CCc1ccsc1C(=O)Nc1sc2c(c1C#N)CCCC2	ZINC000875003622	EH	On-Demand	Mild	VIPR1	35	56
CN(C)[C@@H](CNC(=O)N1CCC2(CCNC2=O)CC1)c1cccc(F)c1	ZINC000875003634	FD	On-Demand	Anodyne	CACNA1H	58	42
COc1cccc([C@H](CNC(=O)N2CCC[C@@H](C(C)=O)C2)N(C)C)c1	ZINC000875003636	EE	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@H](CNC(=O)N2CCC[C@@H](C(C)=O)C2)N(C)C)c1	ZINC000875003636	EE	On-Demand	Anodyne	OPRD1	15	42
COc1cccc([C@H](CNC(=O)N2CCC[C@@H](C(C)=O)C2)N(C)C)c1	ZINC000875003636	EE	On-Demand	Anodyne	OPRK1	17	42
COc1cccc([C@H](CNC(=O)N2CCC[C@@H](C(C)=O)C2)N(C)C)c1	ZINC000875003636	EE	On-Demand	Anodyne	MTNR1A	36	41
COc1cccc([C@H](CNC(=O)N2CCC[C@@H](C(C)=O)C2)N(C)C)c1	ZINC000875003636	EE	On-Demand	Anodyne	MTNR1B	39	41
COc1cccc([C@H](CNC(=O)N2CCC[C@H](C(C)=O)C2)N(C)C)c1	ZINC000875003639	EE	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@H](CNC(=O)N2CCC[C@H](C(C)=O)C2)N(C)C)c1	ZINC000875003639	EE	On-Demand	Anodyne	OPRD1	15	42
COc1cccc([C@H](CNC(=O)N2CCC[C@H](C(C)=O)C2)N(C)C)c1	ZINC000875003639	EE	On-Demand	Anodyne	OPRK1	17	42
COc1cccc([C@H](CNC(=O)N2CCC[C@H](C(C)=O)C2)N(C)C)c1	ZINC000875003639	EE	On-Demand	Anodyne	MTNR1A	36	41
COc1cccc([C@H](CNC(=O)N2CCC[C@H](C(C)=O)C2)N(C)C)c1	ZINC000875003639	EE	On-Demand	Anodyne	MTNR1B	39	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1cccc(F)c1)N(C)C	ZINC000875003648	FE	On-Demand	Anodyne	SLC6A4	20	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1cccc(F)c1)N(C)C	ZINC000875003648	FE	On-Demand	Anodyne	SLC6A3	43	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1cccc(F)c1)N(C)C	ZINC000875003649	FE	On-Demand	Anodyne	SLC6A4	20	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1cccc(F)c1)N(C)C	ZINC000875003649	FE	On-Demand	Anodyne	SLC6A3	43	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1cccc(F)c1)N(C)C	ZINC000875003650	FE	On-Demand	Anodyne	SLC6A4	20	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1cccc(F)c1)N(C)C	ZINC000875003650	FE	On-Demand	Anodyne	SLC6A3	43	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1cccc(F)c1)N(C)C	ZINC000875003651	FE	On-Demand	Anodyne	SLC6A4	20	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1cccc(F)c1)N(C)C	ZINC000875003651	FE	On-Demand	Anodyne	SLC6A3	43	45
N#Cc1c(NC(=O)Cn2ncc3cccnc32)sc2c1CCCC2	ZINC000875003657	EF	On-Demand	Mild	VIPR1	34	55
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1cccc2ccccc12	ZINC000875003761	EH	On-Demand	Anodyne	Q6PRC7_IXORI	47	34
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1cccc2ccccc12	ZINC000875003767	EH	On-Demand	Anodyne	Q6PRC7_IXORI	47	34
COc1cccc([C@H](CNC(=O)NCCC(C)(C)OC)N(C)C)c1	ZINC000875003795	EE	On-Demand	Anodyne	MTNR1A	37	42
COc1cccc([C@H](CNC(=O)NCCC(C)(C)OC)N(C)C)c1	ZINC000875003795	EE	On-Demand	Anodyne	MTNR1B	37	42
O=C(Oc1ccc(Oc2ccccn2)cc1)c1cnn(Cc2ccccc2)c1	ZINC000875003804	FI	On-Demand	Anodyne	FAAH	15	42
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)N[C@@H](C)c3cccnc3)C2)c1	ZINC000875003820	GD	On-Demand	Anodyne	KCNA5	15	42
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)N[C@@H](C)c3cccnc3)C2)c1	ZINC000875003821	GD	On-Demand	Anodyne	KCNA5	15	42
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)N[C@H](C)c3cccnc3)C2)c1	ZINC000875003822	GD	On-Demand	Anodyne	KCNA5	15	42
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)N[C@H](C)c3cccnc3)C2)c1	ZINC000875003823	GD	On-Demand	Anodyne	KCNA5	15	42
N#Cc1c(NC(=O)c2ccc(CNC(=O)C(F)(F)F)o2)sc2c1CCCC2	ZINC000875003824	GH	On-Demand	Mild	VIPR1	32	51
COc1cccc([C@H](CNC(=O)NC2CC(C(N)=O)C2)N(C)C)c1	ZINC000875003825	EC	On-Demand	Anodyne	MTNR1A	36	41
COc1cccc([C@H](CNC(=O)NC2CC(C(N)=O)C2)N(C)C)c1	ZINC000875003825	EC	On-Demand	Anodyne	MTNR1B	34	41
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H](C)c3cccnc3)CC2)c(OC)c1	ZINC000875003827	GD	On-Demand	Clean	HTR1A	21	40
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H](C)c3cccnc3)CC2)c(OC)c1	ZINC000875003827	GD	On-Demand	Clean	DRD2	15	40
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H](C)c3cccnc3)CC2)c(OC)c1	ZINC000875003827	GD	On-Demand	Clean	PTAFR	28	41
COc1ccc(N2CCN(C(=O)C(=O)N[C@H](C)c3cccnc3)CC2)c(OC)c1	ZINC000875003828	GD	On-Demand	Clean	HTR1A	21	40
COc1ccc(N2CCN(C(=O)C(=O)N[C@H](C)c3cccnc3)CC2)c(OC)c1	ZINC000875003828	GD	On-Demand	Clean	DRD2	15	40
COc1ccc(N2CCN(C(=O)C(=O)N[C@H](C)c3cccnc3)CC2)c(OC)c1	ZINC000875003828	GD	On-Demand	Clean	PTAFR	28	41
N#Cc1c(NC(=O)c2sccc2C(F)F)sc2c1CCCC2	ZINC000875003829	EJ	On-Demand	Mild	VIPR1	34	54
C[C@H](NC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1)c1cccnc1	ZINC000875003834	FD	On-Demand	Anodyne	NPY2R	99	47
CN(C)[C@@H](CNC(=O)NCc1nc(O)c2c(n1)CCOC2)c1cccc(F)c1	ZINC000875003837	GD	On-Demand	Anodyne	WNT3A	50	33
CC[C@@H]1COCCN1CCNC(=O)NC[C@H](c1cccc(OC)c1)N(C)C	ZINC000875003844	GD	On-Demand	Anodyne	DRD4	43	34
CC[C@@H]1COCCN1CCNC(=O)NC[C@@H](c1cccc(OC)c1)N(C)C	ZINC000875003845	GD	On-Demand	Anodyne	DRD4	43	34
COc1cccc([C@H](CNC(=O)N[C@H](C)C(=O)N(C)OC)N(C)C)c1	ZINC000875003847	FD	On-Demand	Anodyne	MTNR1A	30	41
COc1cccc([C@H](CNC(=O)N[C@H](C)C(=O)N(C)OC)N(C)C)c1	ZINC000875003847	FD	On-Demand	Anodyne	MTNR1B	32	41
COc1cccc([C@H](CNC(=O)N[C@@H](C)C(=O)N(C)OC)N(C)C)c1	ZINC000875003850	FD	On-Demand	Anodyne	MTNR1A	30	41
COc1cccc([C@H](CNC(=O)N[C@@H](C)C(=O)N(C)OC)N(C)C)c1	ZINC000875003850	FD	On-Demand	Anodyne	MTNR1B	32	41
COc1cccc([C@H](CNC(=O)NC[C@@]23COCCN2C(=O)OC3)N(C)C)c1	ZINC000875003852	GC	On-Demand	Anodyne	CASR	19	41
COc1cccc([C@H](CNC(=O)NC[C@]23COCCN2C(=O)OC3)N(C)C)c1	ZINC000875003853	GC	On-Demand	Anodyne	CASR	19	41
COc1cccc([C@H](CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)N(C)C)c1	ZINC000875003855	FE	On-Demand	Anodyne	DRD4	40	32
COc1cccc([C@H](CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)N(C)C)c1	ZINC000875003855	FE	On-Demand	Anodyne	REN	16	44
COc1cccc([C@H](CNC(=O)N2CCC[C@H](C(C)(C)O)C2)N(C)C)c1	ZINC000875003858	FE	On-Demand	Anodyne	DRD4	40	32
COc1cccc([C@H](CNC(=O)N2CCC[C@H](C(C)(C)O)C2)N(C)C)c1	ZINC000875003858	FE	On-Demand	Anodyne	REN	16	44
COc1cccc([C@H](CNC(=O)N2CCC(C(C)=O)CC2)N(C)C)c1	ZINC000875003894	EE	On-Demand	Anodyne	DRD4	43	33
COc1cccc([C@H](CNC(=O)N2CCC(C(C)=O)CC2)N(C)C)c1	ZINC000875003894	EE	On-Demand	Anodyne	OPRD1	17	44
COc1cccc([C@H](CNC(=O)N2CCC(C(C)=O)CC2)N(C)C)c1	ZINC000875003894	EE	On-Demand	Anodyne	MTNR1A	40	43
COc1cccc([C@H](CNC(=O)N2CCC(C(C)=O)CC2)N(C)C)c1	ZINC000875003894	EE	On-Demand	Anodyne	MTNR1B	44	43
COc1cccc([C@H](CNC(=O)N[C@H](C)c2cc3cnccc3o2)N(C)C)c1	ZINC000875003903	GG	On-Demand	Anodyne	ROCK1	32	44
COc1cccc([C@H](CNC(=O)N[C@@H](C)c2cc3cnccc3o2)N(C)C)c1	ZINC000875003904	GG	On-Demand	Anodyne	ROCK1	32	44
N#Cc1c(NC(=O)Cc2cn3cc(F)ccc3n2)sc2c1CCCC2	ZINC000875003907	FG	On-Demand	Mild	VIPR1	33	52
COc1cccc([C@H](CNC(=O)NC2(C)CC(F)(F)C2)N(C)C)c1	ZINC000875003926	EF	On-Demand	Anodyne	DRD4	40	30
COc1cccc([C@H](CNC(=O)NC2(C)CC(F)(F)C2)N(C)C)c1	ZINC000875003926	EF	On-Demand	Anodyne	MTNR1A	26	41
COc1cccc([C@H](CNC(=O)NC2(C)CC(F)(F)C2)N(C)C)c1	ZINC000875003926	EF	On-Demand	Anodyne	MTNR1B	27	41
O=C1C[C@@H](C(F)(F)F)[C@H](C(=O)Nc2nc3ccc(Cl)cc3s2)CN1	ZINC000875003941	GG	On-Demand	Anodyne	LCK	21	40
O=C1C[C@@H](C(F)(F)F)[C@H](C(=O)Nc2nc3ccc(Cl)cc3s2)CN1	ZINC000875003941	GG	On-Demand	Anodyne	CSNK1D	45	45
O=C1C[C@@H](C(F)(F)F)[C@@H](C(=O)Nc2nc3ccc(Cl)cc3s2)CN1	ZINC000875003943	GG	On-Demand	Anodyne	LCK	21	40
O=C1C[C@@H](C(F)(F)F)[C@@H](C(=O)Nc2nc3ccc(Cl)cc3s2)CN1	ZINC000875003943	GG	On-Demand	Anodyne	CSNK1D	45	45
O=C1C[C@H](C(F)(F)F)[C@H](C(=O)Nc2nc3ccc(Cl)cc3s2)CN1	ZINC000875003945	GG	On-Demand	Anodyne	LCK	21	40
O=C1C[C@H](C(F)(F)F)[C@H](C(=O)Nc2nc3ccc(Cl)cc3s2)CN1	ZINC000875003945	GG	On-Demand	Anodyne	CSNK1D	45	45
O=C1C[C@H](C(F)(F)F)[C@@H](C(=O)Nc2nc3ccc(Cl)cc3s2)CN1	ZINC000875003947	GG	On-Demand	Anodyne	LCK	21	40
O=C1C[C@H](C(F)(F)F)[C@@H](C(=O)Nc2nc3ccc(Cl)cc3s2)CN1	ZINC000875003947	GG	On-Demand	Anodyne	CSNK1D	45	45
COC(=O)N(C)NC(=O)NCCN1CCN(Cc2ccccc2)CC1	ZINC000875003951	EC	On-Demand	Reactive	HTR1A	42	50
COC(=O)N(C)NC(=O)NCCN1CCN(Cc2ccccc2)CC1	ZINC000875003951	EC	On-Demand	Reactive	DRD2	54	43
COC(=O)N(C)NC(=O)NCCN1CCN(Cc2ccccc2)CC1	ZINC000875003951	EC	On-Demand	Reactive	DRD4	72	45
COC(=O)N(C)NC(=O)NCCN1CCN(Cc2ccccc2)CC1	ZINC000875003951	EC	On-Demand	Reactive	ACHE	46	45
COC(=O)N(C)NC(=O)NCCN1CCN(Cc2ccccc2)CC1	ZINC000875003951	EC	On-Demand	Reactive	HTR2A	23	43
COC(=O)N(C)NC(=O)NCCN1CCN(Cc2ccccc2)CC1	ZINC000875003951	EC	On-Demand	Reactive	DRD3	71	45
COC(=O)N(C)NC(=O)NCCN1CCN(Cc2ccccc2)CC1	ZINC000875003951	EC	On-Demand	Reactive	HTR4	21	40
COC(=O)N(C)NC(=O)NCCN1CCN(Cc2ccccc2)CC1	ZINC000875003951	EC	On-Demand	Reactive	HTR7	19	42
COC(=O)N(C)NC(=O)NCCN1CCN(Cc2ccccc2)CC1	ZINC000875003951	EC	On-Demand	Reactive	SIGMAR1	73	50
COC(=O)N(C)NC(=O)NCCN1CCN(Cc2ccccc2)CC1	ZINC000875003951	EC	On-Demand	Reactive	BCHE	20	45
COC(=O)N(C)NC(=O)NCCN1CCN(Cc2ccccc2)CC1	ZINC000875003951	EC	On-Demand	Reactive	CCR3	26	40
COC(=O)N(C)NC(=O)NCCN1CCN(Cc2ccccc2)CC1	ZINC000875003951	EC	On-Demand	Reactive	TACR3	16	44
COC(=O)N(C)NC(=O)NCCN1CCN(Cc2ccccc2)CC1	ZINC000875003951	EC	On-Demand	Reactive	FAAH	17	41
COC(=O)N(C)NC(=O)NCCN1CCN(Cc2ccccc2)CC1	ZINC000875003951	EC	On-Demand	Reactive	MCHR1	17	52
COC(=O)N(C)NC(=O)NCCN1CCN(Cc2ccccc2)CC1	ZINC000875003951	EC	On-Demand	Reactive	CACNA1G	45	38
COC(=O)N(C)NC(=O)NCCN1CCN(Cc2ccccc2)CC1	ZINC000875003951	EC	On-Demand	Reactive	NPFFR1	43	38
CN1CCN(C2CCN(C(=O)NC[C@@H](c3cccc(F)c3)N(C)C)CC2)CC1	ZINC000875003953	GD	On-Demand	Anodyne	L3MBTL3	59	38
O=C1OC[C@H]2CN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]12	ZINC000875003966	ED	On-Demand	Anodyne	CHRM2	18	40
O=C1OC[C@H]2CN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]12	ZINC000875003966	ED	On-Demand	Anodyne	CHRM1	15	40
O=C1OC[C@H]2CN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]12	ZINC000875003966	ED	On-Demand	Anodyne	DRD4	39	52
O=C1OC[C@H]2CN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]12	ZINC000875003966	ED	On-Demand	Anodyne	ACHE	28	42
O=C1OC[C@H]2CN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]12	ZINC000875003966	ED	On-Demand	Anodyne	CHRM3	21	40
O=C1OC[C@H]2CN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]12	ZINC000875003966	ED	On-Demand	Anodyne	SIGMAR1	43	48
O=C1OC[C@H]2CN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]12	ZINC000875003966	ED	On-Demand	Anodyne	CCR3	31	45
O=C1OC[C@H]2CN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]12	ZINC000875003966	ED	On-Demand	Anodyne	CCR2	15	42
O=C1OC[C@H]2CN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]12	ZINC000875003966	ED	On-Demand	Anodyne	MCHR1	28	49
O=C1OC[C@H]2CN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)C[C@@H]12	ZINC000875003967	ED	On-Demand	Anodyne	CHRM2	18	40
O=C1OC[C@H]2CN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)C[C@@H]12	ZINC000875003967	ED	On-Demand	Anodyne	CHRM1	15	40
O=C1OC[C@H]2CN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)C[C@@H]12	ZINC000875003967	ED	On-Demand	Anodyne	DRD4	39	52
O=C1OC[C@H]2CN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)C[C@@H]12	ZINC000875003967	ED	On-Demand	Anodyne	ACHE	28	42
O=C1OC[C@H]2CN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)C[C@@H]12	ZINC000875003967	ED	On-Demand	Anodyne	CHRM3	21	40
O=C1OC[C@H]2CN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)C[C@@H]12	ZINC000875003967	ED	On-Demand	Anodyne	SIGMAR1	43	48
O=C1OC[C@H]2CN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)C[C@@H]12	ZINC000875003967	ED	On-Demand	Anodyne	CCR3	31	45
O=C1OC[C@H]2CN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)C[C@@H]12	ZINC000875003967	ED	On-Demand	Anodyne	CCR2	15	42
O=C1OC[C@H]2CN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)C[C@@H]12	ZINC000875003967	ED	On-Demand	Anodyne	MCHR1	28	49
CN1CCN(C2CCN(C(=O)NC[C@H](c3cccc(F)c3)N(C)C)CC2)CC1	ZINC000875003968	GD	On-Demand	Anodyne	L3MBTL3	59	38
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCN(C)c2ccccc2)C1	ZINC000875004023	EE	On-Demand	Anodyne	ACE	22	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCN(C)c2ccccc2)C1	ZINC000875004023	EE	On-Demand	Anodyne	AMY2	46	32
Cc1nnc(NNC(=O)NCCN2CCN(Cc3ccccc3)CC2)n1C	ZINC000875004024	FC	On-Demand	Reactive	HTR1A	25	47
Cc1nnc(NNC(=O)NCCN2CCN(Cc3ccccc3)CC2)n1C	ZINC000875004024	FC	On-Demand	Reactive	DRD4	41	38
Cc1nnc(NNC(=O)NCCN2CCN(Cc3ccccc3)CC2)n1C	ZINC000875004024	FC	On-Demand	Reactive	ACHE	32	42
Cc1nnc(NNC(=O)NCCN2CCN(Cc3ccccc3)CC2)n1C	ZINC000875004024	FC	On-Demand	Reactive	HTR2A	21	40
Cc1nnc(NNC(=O)NCCN2CCN(Cc3ccccc3)CC2)n1C	ZINC000875004024	FC	On-Demand	Reactive	DRD3	34	40
Cc1nnc(NNC(=O)NCCN2CCN(Cc3ccccc3)CC2)n1C	ZINC000875004024	FC	On-Demand	Reactive	SIGMAR1	40	47
Cc1nnc(NNC(=O)NCCN2CCN(Cc3ccccc3)CC2)n1C	ZINC000875004024	FC	On-Demand	Reactive	NPFFR1	41	38
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1ccc(-n2cncn2)cc1	ZINC000875004029	FF	On-Demand	Mild	ASAH1	61	34
CCCCCCCNC(=O)C(=O)N[C@H](C)c1ccc(-n2cncn2)cc1	ZINC000875004030	FF	On-Demand	Mild	ASAH1	61	34
COC(=O)C1(O)CN(C(=O)N[C@H](C)c2cccc3ccccc23)C1	ZINC000875004041	ED	On-Demand	Anodyne	Q6PRC7_IXORI	43	31
COC(=O)C1(O)CN(C(=O)N[C@@H](C)c2cccc3ccccc23)C1	ZINC000875004042	ED	On-Demand	Anodyne	Q6PRC7_IXORI	43	31
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1cccc2ccccc12	ZINC000875004056	EI	On-Demand	Anodyne	KCNJ11	53	32
CC(=O)N(C)c1ccc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004075	GF	On-Demand	Anodyne	CHRM2	23	41
CC(=O)N(C)c1ccc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004075	GF	On-Demand	Anodyne	CHRM1	21	41
CC(=O)N(C)c1ccc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004075	GF	On-Demand	Anodyne	DRD2	17	50
CC(=O)N(C)c1ccc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004075	GF	On-Demand	Anodyne	DRD4	44	50
CC(=O)N(C)c1ccc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004075	GF	On-Demand	Anodyne	ACHE	30	44
CC(=O)N(C)c1ccc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004075	GF	On-Demand	Anodyne	CHRM3	33	41
CC(=O)N(C)c1ccc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004075	GF	On-Demand	Anodyne	LTA4H	17	43
CC(=O)N(C)c1ccc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004075	GF	On-Demand	Anodyne	SIGMAR1	45	48
CC(=O)N(C)c1ccc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004075	GF	On-Demand	Anodyne	CCR3	39	46
CC(=O)N(C)c1ccc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004075	GF	On-Demand	Anodyne	CCR5	29	51
CC(=O)N(C)c1ccc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004075	GF	On-Demand	Anodyne	UTS2R	22	41
CC(=O)N(C)c1ccc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004075	GF	On-Demand	Anodyne	MLNR	64	40
CC(=O)N(C)c1ccc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004075	GF	On-Demand	Anodyne	CCR2	18	43
CC(=O)N(C)c1ccc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004075	GF	On-Demand	Anodyne	SLC6A5	16	40
CC(=O)N(C)c1ccc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004075	GF	On-Demand	Anodyne	EPHX2	19	46
CC(=O)N(C)c1ccc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004075	GF	On-Demand	Anodyne	MCHR1	38	51
CC(=O)N(C)c1ccc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004075	GF	On-Demand	Anodyne	CACNA1G	22	40
CC(=O)N(C)c1ccc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004075	GF	On-Demand	Anodyne	BIRC2	21	40
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004076	GF	On-Demand	Anodyne	CHRM2	23	41
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004076	GF	On-Demand	Anodyne	CHRM1	21	41
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004076	GF	On-Demand	Anodyne	DRD2	17	50
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004076	GF	On-Demand	Anodyne	DRD4	44	50
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004076	GF	On-Demand	Anodyne	ACHE	30	44
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004076	GF	On-Demand	Anodyne	CHRM3	33	41
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004076	GF	On-Demand	Anodyne	LTA4H	17	43
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004076	GF	On-Demand	Anodyne	SIGMAR1	45	48
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004076	GF	On-Demand	Anodyne	CCR3	39	46
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004076	GF	On-Demand	Anodyne	CCR5	29	51
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004076	GF	On-Demand	Anodyne	UTS2R	22	41
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004076	GF	On-Demand	Anodyne	MLNR	64	40
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004076	GF	On-Demand	Anodyne	CCR2	18	43
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004076	GF	On-Demand	Anodyne	SLC6A5	16	40
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004076	GF	On-Demand	Anodyne	EPHX2	19	46
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004076	GF	On-Demand	Anodyne	MCHR1	38	51
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004076	GF	On-Demand	Anodyne	CACNA1G	22	40
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875004076	GF	On-Demand	Anodyne	BIRC2	21	40
Cc1nnc(NNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)n1C	ZINC000875004084	ED	On-Demand	Reactive	CHRM2	16	43
Cc1nnc(NNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)n1C	ZINC000875004084	ED	On-Demand	Reactive	DRD2	16	50
Cc1nnc(NNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)n1C	ZINC000875004084	ED	On-Demand	Reactive	DRD4	46	50
Cc1nnc(NNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)n1C	ZINC000875004084	ED	On-Demand	Reactive	ACHE	34	41
Cc1nnc(NNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)n1C	ZINC000875004084	ED	On-Demand	Reactive	DRD3	15	48
Cc1nnc(NNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)n1C	ZINC000875004084	ED	On-Demand	Reactive	CHRM3	22	43
Cc1nnc(NNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)n1C	ZINC000875004084	ED	On-Demand	Reactive	LTA4H	15	41
Cc1nnc(NNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)n1C	ZINC000875004084	ED	On-Demand	Reactive	SIGMAR1	41	46
Cc1nnc(NNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)n1C	ZINC000875004084	ED	On-Demand	Reactive	CCR3	35	44
Cc1nnc(NNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)n1C	ZINC000875004084	ED	On-Demand	Reactive	CCR2	16	41
Cc1nnc(NNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)n1C	ZINC000875004084	ED	On-Demand	Reactive	SLC6A5	26	40
Cc1nnc(NNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)n1C	ZINC000875004084	ED	On-Demand	Reactive	MCHR1	25	50
Cc1nnc(NNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)n1C	ZINC000875004084	ED	On-Demand	Reactive	BIRC2	34	40
Cc1nnc(NNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)n1C	ZINC000875004085	ED	On-Demand	Reactive	CHRM2	16	43
Cc1nnc(NNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)n1C	ZINC000875004085	ED	On-Demand	Reactive	DRD2	16	50
Cc1nnc(NNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)n1C	ZINC000875004085	ED	On-Demand	Reactive	DRD4	46	50
Cc1nnc(NNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)n1C	ZINC000875004085	ED	On-Demand	Reactive	ACHE	34	41
Cc1nnc(NNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)n1C	ZINC000875004085	ED	On-Demand	Reactive	DRD3	15	48
Cc1nnc(NNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)n1C	ZINC000875004085	ED	On-Demand	Reactive	CHRM3	22	43
Cc1nnc(NNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)n1C	ZINC000875004085	ED	On-Demand	Reactive	LTA4H	15	41
Cc1nnc(NNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)n1C	ZINC000875004085	ED	On-Demand	Reactive	SIGMAR1	41	46
Cc1nnc(NNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)n1C	ZINC000875004085	ED	On-Demand	Reactive	CCR3	35	44
Cc1nnc(NNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)n1C	ZINC000875004085	ED	On-Demand	Reactive	CCR2	16	41
Cc1nnc(NNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)n1C	ZINC000875004085	ED	On-Demand	Reactive	SLC6A5	26	40
Cc1nnc(NNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)n1C	ZINC000875004085	ED	On-Demand	Reactive	MCHR1	25	50
Cc1nnc(NNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)n1C	ZINC000875004085	ED	On-Demand	Reactive	BIRC2	34	40
COCC(C)(C)CCNC(=O)C(=O)N[C@H](C)c1cccnc1	ZINC000875004090	DD	On-Demand	Anodyne	KCNA5	20	40
COCC(C)(C)CCNC(=O)C(=O)N[C@@H](C)c1cccnc1	ZINC000875004091	DD	On-Demand	Anodyne	KCNA5	20	40
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1cccc2ccccc12	ZINC000875004099	EF	On-Demand	Anodyne	Q6PRC7_IXORI	51	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1cccs1)N1CCCC1	ZINC000875004107	GF	On-Demand	Anodyne	SLC6A3	41	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1cccs1)N1CCCC1	ZINC000875004108	GF	On-Demand	Anodyne	SLC6A3	41	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1cccs1)N1CCCC1	ZINC000875004109	GF	On-Demand	Anodyne	SLC6A3	41	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1cccs1)N1CCCC1	ZINC000875004110	GF	On-Demand	Anodyne	SLC6A3	41	42
O=C(Oc1ccc(Oc2ccccn2)cc1)[C@@H]1COc2ccc(Cl)cc2C1	ZINC000875004115	GJ	On-Demand	Anodyne	ROCK2	21	42
O=C(Oc1ccc(Oc2ccccn2)cc1)[C@@H]1COc2ccc(Cl)cc2C1	ZINC000875004115	GJ	On-Demand	Anodyne	FAAH	16	43
O=C(Oc1ccc(Oc2ccccn2)cc1)[C@H]1COc2ccc(Cl)cc2C1	ZINC000875004116	GJ	On-Demand	Anodyne	ROCK2	21	42
O=C(Oc1ccc(Oc2ccccn2)cc1)[C@H]1COc2ccc(Cl)cc2C1	ZINC000875004116	GJ	On-Demand	Anodyne	FAAH	16	43
COc1ccc(-c2nc(C(=O)Oc3ccc(Oc4ccccn4)cc3)cs2)cc1OC	ZINC000875004129	IK	On-Demand	Anodyne	PPARD	17	40
CC(=O)C1CCN(C(=O)N[C@@H](C)c2cccc3ccccc23)CC1	ZINC000875004197	DH	On-Demand	Anodyne	Q6PRC7_IXORI	49	36
CC(=O)C1CCN(C(=O)N[C@H](C)c2cccc3ccccc23)CC1	ZINC000875004198	DH	On-Demand	Anodyne	Q6PRC7_IXORI	49	36
C[C@H](NC(=O)C(=O)N(C)CCN1CC2(CCOCC2)C1)c1cccnc1	ZINC000875004212	FC	On-Demand	Anodyne	CASR	34	41
COC(=O)C1(O)CN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000875004218	GB	On-Demand	Anodyne	HTR1A	38	51
COC(=O)C1(O)CN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000875004218	GB	On-Demand	Anodyne	DRD2	48	44
COC(=O)C1(O)CN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000875004218	GB	On-Demand	Anodyne	DRD4	59	44
COC(=O)C1(O)CN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000875004218	GB	On-Demand	Anodyne	ACHE	39	44
COC(=O)C1(O)CN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000875004218	GB	On-Demand	Anodyne	HTR2A	20	41
COC(=O)C1(O)CN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000875004218	GB	On-Demand	Anodyne	DRD3	59	41
COC(=O)C1(O)CN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000875004218	GB	On-Demand	Anodyne	HTR4	21	43
COC(=O)C1(O)CN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000875004218	GB	On-Demand	Anodyne	HTR7	15	43
COC(=O)C1(O)CN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000875004218	GB	On-Demand	Anodyne	SIGMAR1	82	48
COC(=O)C1(O)CN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000875004218	GB	On-Demand	Anodyne	BCHE	15	44
COC(=O)C1(O)CN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000875004218	GB	On-Demand	Anodyne	FAAH	29	44
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)Oc2ccc(Oc3ccccn3)cc2)C1	ZINC000875004221	GI	On-Demand	Anodyne	LIPE	16	42
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)Oc2ccc(Oc3ccccn3)cc2)C1	ZINC000875004221	GI	On-Demand	Anodyne	GPR119	37	45
C[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1cccc2ccccc12	ZINC000875004275	FG	On-Demand	Anodyne	GHRHR	50	35
C[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1cccc2ccccc12	ZINC000875004275	FG	On-Demand	Anodyne	Q6PRC7_IXORI	45	34
C[C@H](NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)c1cccnc1	ZINC000875004288	EE	On-Demand	Anodyne	OXTR	35	41
C[C@H](NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)c1cccnc1	ZINC000875004291	EE	On-Demand	Anodyne	OXTR	35	41
CC[C@H](CNC(=O)C(=O)N1CC[C@@H]2[C@@H](CCN2C)C1)c1ccccc1	ZINC000875004292	ED	On-Demand	Anodyne	NPY2R	51	34
CC[C@H](CNC(=O)C(=O)N1CC[C@@H]2[C@H](CCN2C)C1)c1ccccc1	ZINC000875004293	ED	On-Demand	Anodyne	NPY2R	51	34
CC[C@H](CNC(=O)C(=O)N1CC[C@H]2[C@H](CCN2C)C1)c1ccccc1	ZINC000875004295	ED	On-Demand	Anodyne	NPY2R	51	34
CONC(=O)C1CCN(C(=O)N[C@@H](C)c2cccc3ccccc23)CC1	ZINC000875004338	FG	On-Demand	Anodyne	Q6PRC7_IXORI	50	36
CONC(=O)C1CCN(C(=O)N[C@H](C)c2cccc3ccccc23)CC1	ZINC000875004339	FG	On-Demand	Anodyne	Q6PRC7_IXORI	50	36
C[C@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1cccc2ccccc12	ZINC000875004364	GG	On-Demand	Anodyne	Q6PRC7_IXORI	48	34
C[C@@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1cccc2ccccc12	ZINC000875004365	GG	On-Demand	Anodyne	Q6PRC7_IXORI	48	34
O=C(NCCN1CCN(Cc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875004368	GC	On-Demand	Anodyne	HTR1A	22	55
O=C(NCCN1CCN(Cc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875004368	GC	On-Demand	Anodyne	DRD4	46	40
O=C(NCCN1CCN(Cc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875004368	GC	On-Demand	Anodyne	ACHE	36	44
O=C(NCCN1CCN(Cc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875004368	GC	On-Demand	Anodyne	DRD3	29	44
O=C(NCCN1CCN(Cc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875004368	GC	On-Demand	Anodyne	HTR4	16	44
O=C(NCCN1CCN(Cc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875004368	GC	On-Demand	Anodyne	SIGMAR1	84	52
O=C(NCCN1CCN(Cc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875004368	GC	On-Demand	Anodyne	NPFFR2	38	45
O=C(NCCN1CCN(Cc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875004368	GC	On-Demand	Anodyne	FAAH	27	45
O=C(NCCN1CCN(Cc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875004368	GC	On-Demand	Anodyne	PLD2	41	33
O=C(NCCN1CCN(Cc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875004368	GC	On-Demand	Anodyne	NPFFR1	50	45
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)N[C@H](C)c2cccnc2)c1	ZINC000875004371	EE	On-Demand	Anodyne	CHRNA7	22	40
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)N[C@H](C)c2cccnc2)c1	ZINC000875004371	EE	On-Demand	Anodyne	PREP	15	41
Cc1cncc([C@H]2CCCN2C(=O)C(=O)N[C@H](C)c2cccnc2)c1	ZINC000875004372	EE	On-Demand	Anodyne	CHRNA7	22	40
Cc1cncc([C@H]2CCCN2C(=O)C(=O)N[C@H](C)c2cccnc2)c1	ZINC000875004372	EE	On-Demand	Anodyne	PREP	15	41
Cc1cncc([C@H]2CCCN2C(=O)C(=O)N[C@@H](C)c2cccnc2)c1	ZINC000875004373	EE	On-Demand	Anodyne	CHRNA7	22	40
Cc1cncc([C@H]2CCCN2C(=O)C(=O)N[C@@H](C)c2cccnc2)c1	ZINC000875004373	EE	On-Demand	Anodyne	PREP	15	41
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)N[C@@H](C)c2cccnc2)c1	ZINC000875004374	EE	On-Demand	Anodyne	CHRNA7	22	40
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)N[C@@H](C)c2cccnc2)c1	ZINC000875004374	EE	On-Demand	Anodyne	PREP	15	41
O=C(Oc1ccc(Oc2ccccn2)cc1)c1cc(Cl)ccc1F	ZINC000875004377	EJ	On-Demand	Anodyne	LIPE	25	43
CC(C)(C)OC(=O)NCc1ccc(C(=O)Oc2ccc(Oc3ccccn3)cc2)cc1	ZINC000875004378	HK	On-Demand	Anodyne	ACR	49	35
CC(C)(C)OC(=O)NCc1ccc(C(=O)Oc2ccc(Oc3ccccn3)cc2)cc1	ZINC000875004378	HK	On-Demand	Anodyne	PDS	42	33
CN(C)[C@@H]1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C[C@@H]1n1ccnn1	ZINC000875004393	GD	On-Demand	Anodyne	DRD4	34	46
CN(C)[C@@H]1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C[C@@H]1n1ccnn1	ZINC000875004393	GD	On-Demand	Anodyne	SIGMAR1	27	43
CN(C)[C@@H]1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C[C@@H]1n1ccnn1	ZINC000875004393	GD	On-Demand	Anodyne	CCR3	23	41
CN(C)[C@@H]1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C[C@@H]1n1ccnn1	ZINC000875004393	GD	On-Demand	Anodyne	MCHR1	22	46
CN(C)[C@@H]1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C[C@@H]1n1ccnn1	ZINC000875004394	GD	On-Demand	Anodyne	DRD4	34	46
CN(C)[C@@H]1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C[C@@H]1n1ccnn1	ZINC000875004394	GD	On-Demand	Anodyne	SIGMAR1	27	43
CN(C)[C@@H]1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C[C@@H]1n1ccnn1	ZINC000875004394	GD	On-Demand	Anodyne	CCR3	23	41
CN(C)[C@@H]1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C[C@@H]1n1ccnn1	ZINC000875004394	GD	On-Demand	Anodyne	MCHR1	22	46
C[C@@H](NC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)c1cccc2ccccc12	ZINC000875004395	GH	On-Demand	Anodyne	SMO	39	41
C[C@@H](NC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)c1cccc2ccccc12	ZINC000875004395	GH	On-Demand	Anodyne	ETHR	53	37
C[C@@H](NC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)c1cccc2ccccc12	ZINC000875004397	GH	On-Demand	Anodyne	SMO	39	41
C[C@@H](NC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)c1cccc2ccccc12	ZINC000875004397	GH	On-Demand	Anodyne	ETHR	53	37
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004399	GE	On-Demand	Anodyne	CHRM2	17	41
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004399	GE	On-Demand	Anodyne	DRD2	24	50
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004399	GE	On-Demand	Anodyne	DRD4	44	50
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004399	GE	On-Demand	Anodyne	ACHE	51	44
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004399	GE	On-Demand	Anodyne	DRD3	18	49
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004399	GE	On-Demand	Anodyne	HTR4	49	43
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004399	GE	On-Demand	Anodyne	LTA4H	21	43
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004399	GE	On-Demand	Anodyne	SIGMAR1	50	49
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004399	GE	On-Demand	Anodyne	CCR3	37	42
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004399	GE	On-Demand	Anodyne	CCR5	19	41
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004399	GE	On-Demand	Anodyne	UTS2R	26	45
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004399	GE	On-Demand	Anodyne	MLNR	17	41
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004399	GE	On-Demand	Anodyne	CCR2	20	43
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004399	GE	On-Demand	Anodyne	MCHR1	34	45
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004400	GE	On-Demand	Anodyne	CHRM2	17	41
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004400	GE	On-Demand	Anodyne	DRD2	24	50
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004400	GE	On-Demand	Anodyne	DRD4	44	50
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004400	GE	On-Demand	Anodyne	ACHE	51	44
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004400	GE	On-Demand	Anodyne	DRD3	18	49
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004400	GE	On-Demand	Anodyne	HTR4	49	43
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004400	GE	On-Demand	Anodyne	LTA4H	21	43
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004400	GE	On-Demand	Anodyne	SIGMAR1	50	49
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004400	GE	On-Demand	Anodyne	CCR3	37	42
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004400	GE	On-Demand	Anodyne	CCR5	19	41
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004400	GE	On-Demand	Anodyne	UTS2R	26	45
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004400	GE	On-Demand	Anodyne	MLNR	17	41
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004400	GE	On-Demand	Anodyne	CCR2	20	43
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004400	GE	On-Demand	Anodyne	MCHR1	34	45
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)c2cccnc2)C1	ZINC000875004411	DD	On-Demand	Anodyne	PTAFR	18	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)c2cccnc2)C1	ZINC000875004412	DD	On-Demand	Anodyne	PTAFR	18	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)c2cccnc2)C1	ZINC000875004413	DD	On-Demand	Anodyne	PTAFR	18	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)c2cccnc2)C1	ZINC000875004414	DD	On-Demand	Anodyne	PTAFR	18	40
C=CC(C)(C)CCCNC(=O)C(=O)N[C@H](C)c1cccnc1	ZINC000875004415	DE	On-Demand	Mild	KCNA5	19	42
C=CC(C)(C)CCCNC(=O)C(=O)N[C@@H](C)c1cccnc1	ZINC000875004416	DE	On-Demand	Mild	KCNA5	19	42
C[C@@H](NC(=O)N1CCC(c2nnnn2C)CC1)c1cccc2ccccc12	ZINC000875004430	FG	On-Demand	Anodyne	Q6PRC7_IXORI	46	34
O=CN1CCCN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)CC1	ZINC000875004431	FC	On-Demand	Anodyne	HTR1A	20	53
O=CN1CCCN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)CC1	ZINC000875004431	FC	On-Demand	Anodyne	DRD4	40	32
O=CN1CCCN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)CC1	ZINC000875004431	FC	On-Demand	Anodyne	ACHE	32	43
O=CN1CCCN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)CC1	ZINC000875004431	FC	On-Demand	Anodyne	DRD3	24	43
O=CN1CCCN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)CC1	ZINC000875004431	FC	On-Demand	Anodyne	HTR4	15	42
O=CN1CCCN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)CC1	ZINC000875004431	FC	On-Demand	Anodyne	SIGMAR1	57	50
O=CN1CCCN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)CC1	ZINC000875004431	FC	On-Demand	Anodyne	FAAH	24	46
O=C(NCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875004436	EC	On-Demand	Anodyne	HTR1A	23	57
O=C(NCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875004436	EC	On-Demand	Anodyne	DRD2	33	42
O=C(NCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875004436	EC	On-Demand	Anodyne	DRD4	56	43
O=C(NCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875004436	EC	On-Demand	Anodyne	ACHE	46	50
O=C(NCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875004436	EC	On-Demand	Anodyne	HTR2A	17	44
O=C(NCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875004436	EC	On-Demand	Anodyne	DRD3	35	46
O=C(NCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875004436	EC	On-Demand	Anodyne	SIGMAR1	73	57
O=C(NCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875004436	EC	On-Demand	Anodyne	BCHE	15	41
O=C(NCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875004436	EC	On-Demand	Anodyne	CCR3	39	43
O=C(NCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875004436	EC	On-Demand	Anodyne	CACNA1I	40	35
O=C(NCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875004436	EC	On-Demand	Anodyne	NPFFR1	40	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCN(C)c1ccccc1	ZINC000875004440	EE	On-Demand	Anodyne	SLC6A4	19	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCN(C)c1ccccc1	ZINC000875004440	EE	On-Demand	Anodyne	SLC6A3	41	40
CCOC1CC2(C1)C[C@H]2NC(=O)N[C@@H](C)c1cccc2ccccc12	ZINC000875004450	EI	On-Demand	Anodyne	TIMP3	61	33
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@@H](C)c1cccc2ccccc12	ZINC000875004451	EI	On-Demand	Anodyne	TIMP3	61	33
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@H](C)c1cccc2ccccc12	ZINC000875004452	EI	On-Demand	Anodyne	TIMP3	61	33
CC[C@H](CNC(=O)C(=O)N(C)CCN1CC2(CCOCC2)C1)c1ccccc1	ZINC000875004476	GD	On-Demand	Anodyne	CASR	47	38
CC[C@@H](CNC(=O)C(=O)N(C)CCN1CC2(CCOCC2)C1)c1ccccc1	ZINC000875004477	GD	On-Demand	Anodyne	CASR	47	38
CC[C@@H](CNC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21)c1ccccc1	ZINC000875004485	FE	On-Demand	Anodyne	FKBP1A	23	40
CC[C@H](CNC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21)c1ccccc1	ZINC000875004486	FE	On-Demand	Anodyne	FKBP1A	23	40
CCN1CCC(NC(=O)NNC(=O)COc2ccccc2Br)CC1	ZINC000875004511	GD	On-Demand	Reactive	DRD4	21	40
CCN1CCC(NC(=O)NNC(=O)COc2ccccc2Br)CC1	ZINC000875004511	GD	On-Demand	Reactive	HTR4	17	41
CCN1CCC(NC(=O)NNC(=O)COc2ccccc2Br)CC1	ZINC000875004511	GD	On-Demand	Reactive	SIGMAR1	20	45
CCN1CCC(NC(=O)NNC(=O)COc2ccccc2Br)CC1	ZINC000875004511	GD	On-Demand	Reactive	SSTR5	44	36
CCN1CCC(NC(=O)N[C@H](C)[C@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875004512	FD	On-Demand	Anodyne	HTR4	28	44
CCN1CCC(NC(=O)N[C@H](C)[C@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875004512	FD	On-Demand	Anodyne	EPHX2	24	42
CCN1CCC(NC(=O)N[C@H](C)[C@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875004512	FD	On-Demand	Anodyne	MCHR1	18	45
CCN1CCC(NC(=O)N[C@H](C)[C@@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875004513	FD	On-Demand	Anodyne	HTR4	28	44
CCN1CCC(NC(=O)N[C@H](C)[C@@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875004513	FD	On-Demand	Anodyne	EPHX2	24	42
CCN1CCC(NC(=O)N[C@H](C)[C@@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875004513	FD	On-Demand	Anodyne	MCHR1	18	45
CCN1CCC(NC(=O)N[C@@H](C)[C@@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875004514	FD	On-Demand	Anodyne	HTR4	28	44
CCN1CCC(NC(=O)N[C@@H](C)[C@@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875004514	FD	On-Demand	Anodyne	EPHX2	24	42
CCN1CCC(NC(=O)N[C@@H](C)[C@@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875004514	FD	On-Demand	Anodyne	MCHR1	18	45
CCN1CCC(NC(=O)N[C@@H](C)[C@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875004515	FD	On-Demand	Anodyne	HTR4	28	44
CCN1CCC(NC(=O)N[C@@H](C)[C@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875004515	FD	On-Demand	Anodyne	EPHX2	24	42
CCN1CCC(NC(=O)N[C@@H](C)[C@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875004515	FD	On-Demand	Anodyne	MCHR1	18	45
CC[C@@H](NC(=O)N1CCC[C@H](C(C)=O)C1)c1ccc(C)cc1	ZINC000875004516	DG	On-Demand	Anodyne	CCR5	17	41
CC[C@@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)c1ccc(C)cc1	ZINC000875004517	DG	On-Demand	Anodyne	CCR5	17	41
CC(=O)Nc1cccc2c1CN(C(=O)N[C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875004523	GF	On-Demand	Anodyne	CHRM2	15	41
CC(=O)Nc1cccc2c1CN(C(=O)N[C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875004523	GF	On-Demand	Anodyne	DRD2	15	50
CC(=O)Nc1cccc2c1CN(C(=O)N[C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875004523	GF	On-Demand	Anodyne	DRD4	40	50
CC(=O)Nc1cccc2c1CN(C(=O)N[C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875004523	GF	On-Demand	Anodyne	ACHE	26	42
CC(=O)Nc1cccc2c1CN(C(=O)N[C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875004523	GF	On-Demand	Anodyne	CHRM3	21	41
CC(=O)Nc1cccc2c1CN(C(=O)N[C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875004523	GF	On-Demand	Anodyne	SIGMAR1	37	46
CC(=O)Nc1cccc2c1CN(C(=O)N[C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875004523	GF	On-Demand	Anodyne	CCR3	43	42
CC(=O)Nc1cccc2c1CN(C(=O)N[C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875004523	GF	On-Demand	Anodyne	CCR2	16	43
CC(=O)Nc1cccc2c1CN(C(=O)N[C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875004523	GF	On-Demand	Anodyne	MCHR1	25	45
CC(=O)Nc1cccc2c1CN(C(=O)N[C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875004523	GF	On-Demand	Anodyne	NOD2	43	36
CC(=O)Nc1cccc2c1CN(C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875004524	GF	On-Demand	Anodyne	CHRM2	15	41
CC(=O)Nc1cccc2c1CN(C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875004524	GF	On-Demand	Anodyne	DRD2	15	50
CC(=O)Nc1cccc2c1CN(C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875004524	GF	On-Demand	Anodyne	DRD4	40	50
CC(=O)Nc1cccc2c1CN(C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875004524	GF	On-Demand	Anodyne	ACHE	26	42
CC(=O)Nc1cccc2c1CN(C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875004524	GF	On-Demand	Anodyne	CHRM3	21	41
CC(=O)Nc1cccc2c1CN(C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875004524	GF	On-Demand	Anodyne	SIGMAR1	37	46
CC(=O)Nc1cccc2c1CN(C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875004524	GF	On-Demand	Anodyne	CCR3	43	42
CC(=O)Nc1cccc2c1CN(C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875004524	GF	On-Demand	Anodyne	CCR2	16	43
CC(=O)Nc1cccc2c1CN(C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875004524	GF	On-Demand	Anodyne	MCHR1	25	45
CC(=O)Nc1cccc2c1CN(C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875004524	GF	On-Demand	Anodyne	NOD2	43	36
C[C@@H](NC(=O)N1C[C@@]2(C)CS(=O)(=O)C[C@@]2(C)C1)c1cccc2ccccc12	ZINC000875004566	GG	On-Demand	Anodyne	Q6PRC7_IXORI	40	32
C[C@H](NC(=O)N1C[C@@]2(C)CS(=O)(=O)C[C@@]2(C)C1)c1cccc2ccccc12	ZINC000875004567	GG	On-Demand	Anodyne	Q6PRC7_IXORI	40	32
COC(=O)[C@@]12C[C@@H](NC(=O)NCCc3ccccc3OC)C[C@@H]1C2	ZINC000875004586	ED	On-Demand	Anodyne	MBTPS1	51	35
CCN1CCC(NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)CC1	ZINC000875004596	EE	On-Demand	Anodyne	SIGMAR1	25	40
CCN1CCC(NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)CC1	ZINC000875004596	EE	On-Demand	Anodyne	EPHX2	34	46
CCN1CCC(NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)CC1	ZINC000875004596	EE	On-Demand	Anodyne	CCR8	26	41
CCN1CCC(NC(=O)N2CCC[C@](O)(c3ccccc3)C2)CC1	ZINC000875004597	EE	On-Demand	Anodyne	SIGMAR1	25	40
CCN1CCC(NC(=O)N2CCC[C@](O)(c3ccccc3)C2)CC1	ZINC000875004597	EE	On-Demand	Anodyne	EPHX2	34	46
CCN1CCC(NC(=O)N2CCC[C@](O)(c3ccccc3)C2)CC1	ZINC000875004597	EE	On-Demand	Anodyne	CCR8	26	41
O=C1C[C@@H](C(F)(F)F)[C@H](C(=O)Nc2nc(-c3ccc(F)cc3)cs2)CN1	ZINC000875004598	GG	On-Demand	Anodyne	MPL	45	41
O=C1C[C@@H](C(F)(F)F)[C@H](C(=O)Nc2nc(-c3ccc(F)cc3)cs2)CN1	ZINC000875004598	GG	On-Demand	Anodyne	ROCK1	20	45
O=C1C[C@H](C(F)(F)F)[C@H](C(=O)Nc2nc(-c3ccc(F)cc3)cs2)CN1	ZINC000875004599	GG	On-Demand	Anodyne	MPL	45	41
O=C1C[C@H](C(F)(F)F)[C@H](C(=O)Nc2nc(-c3ccc(F)cc3)cs2)CN1	ZINC000875004599	GG	On-Demand	Anodyne	ROCK1	20	45
O=C1C[C@H](C(F)(F)F)[C@@H](C(=O)Nc2nc(-c3ccc(F)cc3)cs2)CN1	ZINC000875004600	GG	On-Demand	Anodyne	MPL	45	41
O=C1C[C@H](C(F)(F)F)[C@@H](C(=O)Nc2nc(-c3ccc(F)cc3)cs2)CN1	ZINC000875004600	GG	On-Demand	Anodyne	ROCK1	20	45
O=C1C[C@@H](C(F)(F)F)[C@@H](C(=O)Nc2nc(-c3ccc(F)cc3)cs2)CN1	ZINC000875004601	GG	On-Demand	Anodyne	MPL	45	41
O=C1C[C@@H](C(F)(F)F)[C@@H](C(=O)Nc2nc(-c3ccc(F)cc3)cs2)CN1	ZINC000875004601	GG	On-Demand	Anodyne	ROCK1	20	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cccs1	ZINC000875004604	DF	On-Demand	Anodyne	SLC6A4	25	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cccs1	ZINC000875004604	DF	On-Demand	Anodyne	SLC6A3	48	47
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cccs1	ZINC000875004605	DF	On-Demand	Anodyne	SLC6A4	25	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cccs1	ZINC000875004605	DF	On-Demand	Anodyne	SLC6A3	48	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cccs1	ZINC000875004606	DF	On-Demand	Anodyne	SLC6A4	25	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cccs1	ZINC000875004606	DF	On-Demand	Anodyne	SLC6A3	48	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cccs1	ZINC000875004607	DF	On-Demand	Anodyne	SLC6A4	25	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cccs1	ZINC000875004607	DF	On-Demand	Anodyne	SLC6A3	48	47
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004611	DD	On-Demand	Reactive	CHRM2	27	44
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004611	DD	On-Demand	Reactive	CHRM1	27	43
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004611	DD	On-Demand	Reactive	DRD2	29	56
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004611	DD	On-Demand	Reactive	DRD4	62	56
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004611	DD	On-Demand	Reactive	ACHE	46	47
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004611	DD	On-Demand	Reactive	DRD3	22	54
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004611	DD	On-Demand	Reactive	KCNH2	15	40
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004611	DD	On-Demand	Reactive	HTR4	25	47
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004611	DD	On-Demand	Reactive	CHRM3	40	44
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004611	DD	On-Demand	Reactive	LTA4H	33	45
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004611	DD	On-Demand	Reactive	SIGMAR1	68	53
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004611	DD	On-Demand	Reactive	SSTR5	49	37
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004611	DD	On-Demand	Reactive	CCR3	55	48
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004611	DD	On-Demand	Reactive	CCR5	38	44
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004611	DD	On-Demand	Reactive	UTS2R	26	44
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004611	DD	On-Demand	Reactive	SLC18A3	20	43
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004611	DD	On-Demand	Reactive	MLNR	52	34
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004611	DD	On-Demand	Reactive	CCR2	17	45
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004611	DD	On-Demand	Reactive	SLC6A5	32	44
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004611	DD	On-Demand	Reactive	EPHX2	20	48
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004611	DD	On-Demand	Reactive	MCHR1	52	53
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004611	DD	On-Demand	Reactive	CACNA1G	27	42
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004611	DD	On-Demand	Reactive	CCR8	17	43
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004611	DD	On-Demand	Reactive	BIRC2	29	44
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004612	DD	On-Demand	Reactive	CHRM2	27	44
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004612	DD	On-Demand	Reactive	CHRM1	27	43
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004612	DD	On-Demand	Reactive	DRD2	29	56
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004612	DD	On-Demand	Reactive	DRD4	62	56
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004612	DD	On-Demand	Reactive	ACHE	46	47
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004612	DD	On-Demand	Reactive	DRD3	22	54
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004612	DD	On-Demand	Reactive	KCNH2	15	40
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004612	DD	On-Demand	Reactive	HTR4	25	47
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004612	DD	On-Demand	Reactive	CHRM3	40	44
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004612	DD	On-Demand	Reactive	LTA4H	33	45
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004612	DD	On-Demand	Reactive	SIGMAR1	68	53
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004612	DD	On-Demand	Reactive	SSTR5	49	37
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004612	DD	On-Demand	Reactive	CCR3	55	48
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004612	DD	On-Demand	Reactive	CCR5	38	44
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004612	DD	On-Demand	Reactive	UTS2R	26	44
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004612	DD	On-Demand	Reactive	SLC18A3	20	43
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004612	DD	On-Demand	Reactive	MLNR	52	34
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004612	DD	On-Demand	Reactive	CCR2	17	45
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004612	DD	On-Demand	Reactive	SLC6A5	32	44
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004612	DD	On-Demand	Reactive	EPHX2	20	48
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004612	DD	On-Demand	Reactive	MCHR1	52	53
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004612	DD	On-Demand	Reactive	CACNA1G	27	42
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004612	DD	On-Demand	Reactive	CCR8	17	43
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004612	DD	On-Demand	Reactive	BIRC2	29	44
CS(=O)(=O)NCCc1ccc(C(=O)Oc2ccc(Oc3ccccn3)cc2)cc1	ZINC000875004620	HG	On-Demand	Anodyne	ACR	52	33
COC(=O)N(C)NC(=O)NCCc1ccccc1OC	ZINC000875004630	CD	On-Demand	Reactive	NQO2	40	42
COC(=O)N(C)NC(=O)NCCc1ccccc1OC	ZINC000875004630	CD	On-Demand	Reactive	MTNR1A	78	45
COC(=O)N(C)NC(=O)NCCc1ccccc1OC	ZINC000875004630	CD	On-Demand	Reactive	MTNR1B	55	42
COC(=O)N(C)NC(=O)NCCc1ccccc1OC	ZINC000875004630	CD	On-Demand	Reactive	MBTPS1	50	33
CCN1CCC(NC(=O)N2C[C@@H]3C[C@H]2CN3c2ccccc2)CC1	ZINC000875004632	EE	On-Demand	Anodyne	SIGMAR1	15	41
O=C(Oc1ccc(Oc2ccccn2)cc1)c1ccc(Cl)cc1F	ZINC000875004659	EJ	On-Demand	Anodyne	LIPE	21	42
C[C@H](NC(=O)C(=O)NCCC[C@H]1C=CCC1)c1cccnc1	ZINC000875004698	DE	On-Demand	Anodyne	KCNA5	18	40
C[C@H](NC(=O)C(=O)NCCC[C@@H]1C=CCC1)c1cccnc1	ZINC000875004700	DE	On-Demand	Anodyne	KCNA5	18	40
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)c2cccnc2)CC1	ZINC000875004711	DD	On-Demand	Anodyne	PTAFR	23	43
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)c2cccnc2)CC1	ZINC000875004712	DD	On-Demand	Anodyne	PTAFR	23	43
C[C@H](NC(=O)C(=O)N(C)C[C@H]1CCCCN1Cc1ccccc1)c1cccnc1	ZINC000875004713	GF	On-Demand	Anodyne	C3AR1	41	40
O=C(CCc1ccc(S(=O)(=O)N2CCCC2)cc1)Oc1ccc(Oc2ccccn2)cc1	ZINC000875004722	JI	On-Demand	Anodyne	NAMPT	31	41
O=C(Nc1nc(-c2ccc(F)cc2)cs1)C1(F)CCOCC1	ZINC000875004759	DG	On-Demand	Anodyne	MAOB	21	49
O=C(Nc1nc(-c2ccc(F)cc2)cs1)C1(F)CCOCC1	ZINC000875004759	DG	On-Demand	Anodyne	MPL	16	40
O=C(Nc1nc(-c2ccc(F)cc2)cs1)C1(F)CCOCC1	ZINC000875004759	DG	On-Demand	Anodyne	ROCK1	21	52
O=C(Nc1nc(-c2ccc(F)cc2)cs1)C1(F)CCOCC1	ZINC000875004759	DG	On-Demand	Anodyne	HDAC9	15	49
CCN1CCC(NC(=O)NC(C)(C)C(O)(CC)CC)CC1	ZINC000875004766	CE	On-Demand	Anodyne	EPHX2	25	40
CCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(OC)c(OC)c2)CC1	ZINC000875004773	GD	On-Demand	Anodyne	HTR4	29	43
CCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(OC)c(OC)c2)CC1	ZINC000875004773	GD	On-Demand	Anodyne	SSTR5	66	38
CCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(OC)c(OC)c2)CC1	ZINC000875004773	GD	On-Demand	Anodyne	MCHR1	20	44
CCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(OC)c(OC)c2)CC1	ZINC000875004774	GD	On-Demand	Anodyne	HTR4	29	43
CCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(OC)c(OC)c2)CC1	ZINC000875004774	GD	On-Demand	Anodyne	SSTR5	66	38
CCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(OC)c(OC)c2)CC1	ZINC000875004774	GD	On-Demand	Anodyne	MCHR1	20	44
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875004775	EF	On-Demand	Clean	CHRM2	20	41
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875004775	EF	On-Demand	Clean	CHRM1	17	41
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875004775	EF	On-Demand	Clean	DRD2	22	59
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875004775	EF	On-Demand	Clean	DRD4	50	59
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875004775	EF	On-Demand	Clean	ACHE	36	43
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875004775	EF	On-Demand	Clean	DRD3	15	46
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875004775	EF	On-Demand	Clean	CHRM3	27	41
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875004775	EF	On-Demand	Clean	SIGMAR1	54	51
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875004775	EF	On-Demand	Clean	CCR3	41	47
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875004775	EF	On-Demand	Clean	UTS2R	22	43
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875004775	EF	On-Demand	Clean	CCR2	21	50
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875004775	EF	On-Demand	Clean	EPHX2	15	44
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875004775	EF	On-Demand	Clean	MCHR1	26	51
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875004775	EF	On-Demand	Clean	CACNA1G	22	40
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875004775	EF	On-Demand	Clean	BIRC2	21	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875004776	EF	On-Demand	Clean	CHRM2	20	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875004776	EF	On-Demand	Clean	CHRM1	17	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875004776	EF	On-Demand	Clean	DRD2	22	59
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875004776	EF	On-Demand	Clean	DRD4	50	59
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875004776	EF	On-Demand	Clean	ACHE	36	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875004776	EF	On-Demand	Clean	DRD3	15	46
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875004776	EF	On-Demand	Clean	CHRM3	27	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875004776	EF	On-Demand	Clean	SIGMAR1	54	51
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875004776	EF	On-Demand	Clean	CCR3	41	47
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875004776	EF	On-Demand	Clean	UTS2R	22	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875004776	EF	On-Demand	Clean	CCR2	21	50
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875004776	EF	On-Demand	Clean	EPHX2	15	44
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875004776	EF	On-Demand	Clean	MCHR1	26	51
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875004776	EF	On-Demand	Clean	CACNA1G	22	40
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875004776	EF	On-Demand	Clean	BIRC2	21	41
CCN1CCC(NC(=O)NNc2cccc(F)c2Br)CC1	ZINC000875004804	FF	On-Demand	Reactive	SIGMAR1	15	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004813	FD	On-Demand	Anodyne	CHRM2	20	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004813	FD	On-Demand	Anodyne	CHRM1	24	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004813	FD	On-Demand	Anodyne	DRD2	22	51
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004813	FD	On-Demand	Anodyne	DRD4	51	51
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004813	FD	On-Demand	Anodyne	ACHE	40	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004813	FD	On-Demand	Anodyne	SLC6A4	30	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004813	FD	On-Demand	Anodyne	DRD3	18	49
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004813	FD	On-Demand	Anodyne	SLC6A3	68	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004813	FD	On-Demand	Anodyne	HTR4	27	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004813	FD	On-Demand	Anodyne	CHRM3	27	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004813	FD	On-Demand	Anodyne	LTA4H	32	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004813	FD	On-Demand	Anodyne	SIGMAR1	52	49
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004813	FD	On-Demand	Anodyne	SSTR5	62	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004813	FD	On-Demand	Anodyne	CCR3	46	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004813	FD	On-Demand	Anodyne	UTS2R	22	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004813	FD	On-Demand	Anodyne	SLC18A3	19	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004813	FD	On-Demand	Anodyne	CCR2	15	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004813	FD	On-Demand	Anodyne	MCHR1	28	51
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004813	FD	On-Demand	Anodyne	CCR8	21	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004813	FD	On-Demand	Anodyne	BIRC2	39	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004814	FD	On-Demand	Anodyne	CHRM2	20	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004814	FD	On-Demand	Anodyne	CHRM1	24	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004814	FD	On-Demand	Anodyne	DRD2	22	51
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004814	FD	On-Demand	Anodyne	DRD4	51	51
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004814	FD	On-Demand	Anodyne	ACHE	40	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004814	FD	On-Demand	Anodyne	SLC6A4	30	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004814	FD	On-Demand	Anodyne	DRD3	18	49
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004814	FD	On-Demand	Anodyne	SLC6A3	68	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004814	FD	On-Demand	Anodyne	HTR4	27	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004814	FD	On-Demand	Anodyne	CHRM3	27	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004814	FD	On-Demand	Anodyne	LTA4H	32	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004814	FD	On-Demand	Anodyne	SIGMAR1	52	49
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004814	FD	On-Demand	Anodyne	SSTR5	62	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004814	FD	On-Demand	Anodyne	CCR3	46	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004814	FD	On-Demand	Anodyne	UTS2R	22	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004814	FD	On-Demand	Anodyne	SLC18A3	19	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004814	FD	On-Demand	Anodyne	CCR2	15	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004814	FD	On-Demand	Anodyne	MCHR1	28	51
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004814	FD	On-Demand	Anodyne	CCR8	21	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004814	FD	On-Demand	Anodyne	BIRC2	39	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004815	FD	On-Demand	Anodyne	CHRM2	20	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004815	FD	On-Demand	Anodyne	CHRM1	24	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004815	FD	On-Demand	Anodyne	DRD2	22	51
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004815	FD	On-Demand	Anodyne	DRD4	51	51
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004815	FD	On-Demand	Anodyne	ACHE	40	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004815	FD	On-Demand	Anodyne	SLC6A4	30	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004815	FD	On-Demand	Anodyne	DRD3	18	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004815	FD	On-Demand	Anodyne	SLC6A3	68	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004815	FD	On-Demand	Anodyne	HTR4	27	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004815	FD	On-Demand	Anodyne	CHRM3	27	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004815	FD	On-Demand	Anodyne	LTA4H	32	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004815	FD	On-Demand	Anodyne	SIGMAR1	52	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004815	FD	On-Demand	Anodyne	SSTR5	62	36
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004815	FD	On-Demand	Anodyne	CCR3	46	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004815	FD	On-Demand	Anodyne	UTS2R	22	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004815	FD	On-Demand	Anodyne	SLC18A3	19	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004815	FD	On-Demand	Anodyne	CCR2	15	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004815	FD	On-Demand	Anodyne	MCHR1	28	51
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004815	FD	On-Demand	Anodyne	CCR8	21	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004815	FD	On-Demand	Anodyne	BIRC2	39	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004816	FD	On-Demand	Anodyne	CHRM2	20	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004816	FD	On-Demand	Anodyne	CHRM1	24	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004816	FD	On-Demand	Anodyne	DRD2	22	51
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004816	FD	On-Demand	Anodyne	DRD4	51	51
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004816	FD	On-Demand	Anodyne	ACHE	40	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004816	FD	On-Demand	Anodyne	SLC6A4	30	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004816	FD	On-Demand	Anodyne	DRD3	18	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004816	FD	On-Demand	Anodyne	SLC6A3	68	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004816	FD	On-Demand	Anodyne	HTR4	27	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004816	FD	On-Demand	Anodyne	CHRM3	27	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004816	FD	On-Demand	Anodyne	LTA4H	32	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004816	FD	On-Demand	Anodyne	SIGMAR1	52	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004816	FD	On-Demand	Anodyne	SSTR5	62	36
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004816	FD	On-Demand	Anodyne	CCR3	46	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004816	FD	On-Demand	Anodyne	UTS2R	22	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004816	FD	On-Demand	Anodyne	SLC18A3	19	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004816	FD	On-Demand	Anodyne	CCR2	15	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004816	FD	On-Demand	Anodyne	MCHR1	28	51
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004816	FD	On-Demand	Anodyne	CCR8	21	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004816	FD	On-Demand	Anodyne	BIRC2	39	43
CCOC1CC2(C1)C[C@H]2C(=O)N1CCCSC1=Nc1ccccc1	ZINC000875004828	EH	On-Demand	Mild	TIMP3	69	33
CCN1CCC(NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875004833	EE	On-Demand	Anodyne	SIGMAR1	18	40
CCN1CCC(NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875004834	EE	On-Demand	Anodyne	SIGMAR1	18	40
CCN1CCC(NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875004835	EE	On-Demand	Anodyne	SIGMAR1	18	40
CCN1CCC(NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875004836	EE	On-Demand	Anodyne	SIGMAR1	18	40
C[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1cccc2ccccc12	ZINC000875004853	GG	On-Demand	Anodyne	CHRM2	25	41
C[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1cccc2ccccc12	ZINC000875004853	GG	On-Demand	Anodyne	CALCRL	39	42
C[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1cccc2ccccc12	ZINC000875004853	GG	On-Demand	Anodyne	Q6PRC7_IXORI	46	33
C[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1cccc2ccccc12	ZINC000875004853	GG	On-Demand	Anodyne	L3MBTL3	78	44
Cn1nnnc1C1CCN(C(=O)NC[C@@H](c2cccs2)N2CCCC2)CC1	ZINC000875004876	GD	On-Demand	Anodyne	SMO	19	43
Cn1nnnc1C1CCN(C(=O)NC[C@H](c2cccs2)N2CCCC2)CC1	ZINC000875004877	GD	On-Demand	Anodyne	SMO	19	43
C[C@@H](NC(=O)N1CC(CNC(=O)C(F)(F)F)C1)c1cccc2ccccc12	ZINC000875004925	GG	On-Demand	Anodyne	KCNJ11	64	31
CC[C@H](CNC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccccc1	ZINC000875004933	GD	On-Demand	Anodyne	L3MBTL3	62	41
CC[C@@H](CNC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccccc1	ZINC000875004934	GD	On-Demand	Anodyne	L3MBTL3	62	41
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(CC)CC1	ZINC000875004955	CD	On-Demand	Anodyne	EPHX2	19	42
CCN1CCC(NC(=O)N2CCc3c(C(=O)OC)ccc(OC)c3C2)CC1	ZINC000875004958	GE	On-Demand	Anodyne	HTR4	30	44
CCN1CCC(NC(=O)NC2CC(C(=O)OC)C2)CC1	ZINC000875004962	CC	On-Demand	Anodyne	EPHX2	33	45
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004989	FE	On-Demand	Anodyne	DRD4	34	52
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004989	FE	On-Demand	Anodyne	SIGMAR1	31	50
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004989	FE	On-Demand	Anodyne	CCR3	29	44
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004989	FE	On-Demand	Anodyne	CCR2	27	49
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004989	FE	On-Demand	Anodyne	SLC6A5	24	42
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004989	FE	On-Demand	Anodyne	MCHR1	29	47
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004990	FE	On-Demand	Anodyne	DRD4	34	52
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004990	FE	On-Demand	Anodyne	SIGMAR1	31	50
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004990	FE	On-Demand	Anodyne	CCR3	29	44
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004990	FE	On-Demand	Anodyne	CCR2	27	49
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004990	FE	On-Demand	Anodyne	SLC6A5	24	42
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004990	FE	On-Demand	Anodyne	MCHR1	29	47
O=C(NC[C@H]1CC(C(F)(F)F)=NO1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004991	FE	On-Demand	Anodyne	DRD4	34	52
O=C(NC[C@H]1CC(C(F)(F)F)=NO1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004991	FE	On-Demand	Anodyne	SIGMAR1	31	50
O=C(NC[C@H]1CC(C(F)(F)F)=NO1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004991	FE	On-Demand	Anodyne	CCR3	29	44
O=C(NC[C@H]1CC(C(F)(F)F)=NO1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004991	FE	On-Demand	Anodyne	CCR2	27	49
O=C(NC[C@H]1CC(C(F)(F)F)=NO1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004991	FE	On-Demand	Anodyne	SLC6A5	24	42
O=C(NC[C@H]1CC(C(F)(F)F)=NO1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875004991	FE	On-Demand	Anodyne	MCHR1	29	47
O=C(NC[C@H]1CC(C(F)(F)F)=NO1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004992	FE	On-Demand	Anodyne	DRD4	34	52
O=C(NC[C@H]1CC(C(F)(F)F)=NO1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004992	FE	On-Demand	Anodyne	SIGMAR1	31	50
O=C(NC[C@H]1CC(C(F)(F)F)=NO1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004992	FE	On-Demand	Anodyne	CCR3	29	44
O=C(NC[C@H]1CC(C(F)(F)F)=NO1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004992	FE	On-Demand	Anodyne	CCR2	27	49
O=C(NC[C@H]1CC(C(F)(F)F)=NO1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004992	FE	On-Demand	Anodyne	SLC6A5	24	42
O=C(NC[C@H]1CC(C(F)(F)F)=NO1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875004992	FE	On-Demand	Anodyne	MCHR1	29	47
N#C[C@@]1(C(=O)Nc2nc(-c3ccc(F)cc3)cs2)CCCOC1	ZINC000875005001	EG	On-Demand	Mild	MAOB	18	43
N#C[C@@]1(C(=O)Nc2nc(-c3ccc(F)cc3)cs2)CCCOC1	ZINC000875005001	EG	On-Demand	Mild	ROCK1	19	45
N#C[C@]1(C(=O)Nc2nc(-c3ccc(F)cc3)cs2)CCCOC1	ZINC000875005002	EG	On-Demand	Mild	MAOB	18	43
N#C[C@]1(C(=O)Nc2nc(-c3ccc(F)cc3)cs2)CCCOC1	ZINC000875005002	EG	On-Demand	Mild	ROCK1	19	45
CCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875005008	ED	On-Demand	Anodyne	CHRM2	26	45
CCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875005008	ED	On-Demand	Anodyne	CHRM1	26	45
CCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875005008	ED	On-Demand	Anodyne	DRD2	20	51
CCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875005008	ED	On-Demand	Anodyne	DRD4	50	52
CCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875005008	ED	On-Demand	Anodyne	ACHE	38	45
CCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875005008	ED	On-Demand	Anodyne	DRD3	15	51
CCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875005008	ED	On-Demand	Anodyne	HTR4	17	45
CCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875005008	ED	On-Demand	Anodyne	CHRM3	35	45
CCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875005008	ED	On-Demand	Anodyne	LTA4H	15	40
CCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875005008	ED	On-Demand	Anodyne	SIGMAR1	55	55
CCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875005008	ED	On-Demand	Anodyne	SSTR5	51	40
CCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875005008	ED	On-Demand	Anodyne	CCR3	33	48
CCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875005008	ED	On-Demand	Anodyne	EPHX2	31	48
CCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875005008	ED	On-Demand	Anodyne	MCHR1	38	47
CCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875005008	ED	On-Demand	Anodyne	CACNA1G	22	44
CCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875005008	ED	On-Demand	Anodyne	CCR8	27	47
O=C(Cc1ccc(C(F)(F)F)cc1)Oc1ccc(Oc2ccccn2)cc1	ZINC000875005011	FK	On-Demand	Anodyne	LIPE	27	46
CCOC(=O)c1cc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)on1	ZINC000875005015	FD	On-Demand	Anodyne	CHRM2	17	48
CCOC(=O)c1cc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)on1	ZINC000875005015	FD	On-Demand	Anodyne	CHRM1	17	43
CCOC(=O)c1cc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)on1	ZINC000875005015	FD	On-Demand	Anodyne	DRD2	15	48
CCOC(=O)c1cc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)on1	ZINC000875005015	FD	On-Demand	Anodyne	DRD4	49	48
CCOC(=O)c1cc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)on1	ZINC000875005015	FD	On-Demand	Anodyne	ACHE	39	43
CCOC(=O)c1cc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)on1	ZINC000875005015	FD	On-Demand	Anodyne	HTR4	42	38
CCOC(=O)c1cc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)on1	ZINC000875005015	FD	On-Demand	Anodyne	CHRM3	22	48
CCOC(=O)c1cc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)on1	ZINC000875005015	FD	On-Demand	Anodyne	SIGMAR1	35	44
CCOC(=O)c1cc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)on1	ZINC000875005015	FD	On-Demand	Anodyne	SSTR5	68	41
CCOC(=O)c1cc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)on1	ZINC000875005015	FD	On-Demand	Anodyne	CCR3	49	42
CCOC(=O)c1cc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)on1	ZINC000875005015	FD	On-Demand	Anodyne	CCR2	20	41
CCOC(=O)c1cc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C2)on1	ZINC000875005015	FD	On-Demand	Anodyne	MCHR1	28	47
CCOC(=O)c1cc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)on1	ZINC000875005016	FD	On-Demand	Anodyne	CHRM2	17	48
CCOC(=O)c1cc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)on1	ZINC000875005016	FD	On-Demand	Anodyne	CHRM1	17	43
CCOC(=O)c1cc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)on1	ZINC000875005016	FD	On-Demand	Anodyne	DRD2	15	48
CCOC(=O)c1cc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)on1	ZINC000875005016	FD	On-Demand	Anodyne	DRD4	49	48
CCOC(=O)c1cc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)on1	ZINC000875005016	FD	On-Demand	Anodyne	ACHE	39	43
CCOC(=O)c1cc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)on1	ZINC000875005016	FD	On-Demand	Anodyne	HTR4	42	38
CCOC(=O)c1cc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)on1	ZINC000875005016	FD	On-Demand	Anodyne	CHRM3	22	48
CCOC(=O)c1cc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)on1	ZINC000875005016	FD	On-Demand	Anodyne	SIGMAR1	35	44
CCOC(=O)c1cc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)on1	ZINC000875005016	FD	On-Demand	Anodyne	SSTR5	68	41
CCOC(=O)c1cc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)on1	ZINC000875005016	FD	On-Demand	Anodyne	CCR3	49	42
CCOC(=O)c1cc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)on1	ZINC000875005016	FD	On-Demand	Anodyne	CCR2	20	41
CCOC(=O)c1cc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)on1	ZINC000875005016	FD	On-Demand	Anodyne	MCHR1	28	47
CC[C@@H](NC(=O)NC1CCN(CC)CC1)[C@H](O)c1ccccc1	ZINC000875005023	DE	On-Demand	Anodyne	DRD4	15	44
CC[C@@H](NC(=O)NC1CCN(CC)CC1)[C@H](O)c1ccccc1	ZINC000875005023	DE	On-Demand	Anodyne	SIGMAR1	20	42
CC[C@@H](NC(=O)NC1CCN(CC)CC1)[C@H](O)c1ccccc1	ZINC000875005023	DE	On-Demand	Anodyne	CCR5	35	43
CC[C@@H](NC(=O)NC1CCN(CC)CC1)[C@H](O)c1ccccc1	ZINC000875005023	DE	On-Demand	Anodyne	EPHX2	30	42
CC[C@@H](NC(=O)NC1CCN(CC)CC1)[C@H](O)c1ccccc1	ZINC000875005023	DE	On-Demand	Anodyne	XIAP	53	38
CC[C@@H](NC(=O)NC1CCN(CC)CC1)[C@H](O)c1ccccc1	ZINC000875005023	DE	On-Demand	Anodyne	BIRC8	43	30
CC[C@@H](NC(=O)NC1CCN(CC)CC1)[C@@H](O)c1ccccc1	ZINC000875005025	DE	On-Demand	Anodyne	DRD4	15	44
CC[C@@H](NC(=O)NC1CCN(CC)CC1)[C@@H](O)c1ccccc1	ZINC000875005025	DE	On-Demand	Anodyne	SIGMAR1	20	42
CC[C@@H](NC(=O)NC1CCN(CC)CC1)[C@@H](O)c1ccccc1	ZINC000875005025	DE	On-Demand	Anodyne	CCR5	35	43
CC[C@@H](NC(=O)NC1CCN(CC)CC1)[C@@H](O)c1ccccc1	ZINC000875005025	DE	On-Demand	Anodyne	EPHX2	30	42
CC[C@@H](NC(=O)NC1CCN(CC)CC1)[C@@H](O)c1ccccc1	ZINC000875005025	DE	On-Demand	Anodyne	XIAP	53	38
CC[C@@H](NC(=O)NC1CCN(CC)CC1)[C@@H](O)c1ccccc1	ZINC000875005025	DE	On-Demand	Anodyne	BIRC8	43	30
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005026	ED	On-Demand	Anodyne	CHRM2	23	44
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005026	ED	On-Demand	Anodyne	CHRM1	18	44
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005026	ED	On-Demand	Anodyne	DRD2	19	58
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005026	ED	On-Demand	Anodyne	DRD4	52	58
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005026	ED	On-Demand	Anodyne	ACHE	41	44
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005026	ED	On-Demand	Anodyne	DRD3	15	50
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005026	ED	On-Demand	Anodyne	CHRM3	30	44
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005026	ED	On-Demand	Anodyne	LTA4H	19	42
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005026	ED	On-Demand	Anodyne	SIGMAR1	71	54
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005026	ED	On-Demand	Anodyne	CCR3	40	52
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005026	ED	On-Demand	Anodyne	UTS2R	20	42
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005026	ED	On-Demand	Anodyne	MLNR	44	37
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005026	ED	On-Demand	Anodyne	CCR2	19	46
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005026	ED	On-Demand	Anodyne	EPHX2	28	47
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005026	ED	On-Demand	Anodyne	MCHR1	32	55
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005026	ED	On-Demand	Anodyne	CACNA1G	15	48
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005026	ED	On-Demand	Anodyne	BIRC2	22	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005027	ED	On-Demand	Anodyne	CHRM2	23	44
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005027	ED	On-Demand	Anodyne	CHRM1	18	44
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005027	ED	On-Demand	Anodyne	DRD2	19	58
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005027	ED	On-Demand	Anodyne	DRD4	52	58
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005027	ED	On-Demand	Anodyne	ACHE	41	44
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005027	ED	On-Demand	Anodyne	DRD3	15	50
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005027	ED	On-Demand	Anodyne	CHRM3	30	44
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005027	ED	On-Demand	Anodyne	LTA4H	19	42
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005027	ED	On-Demand	Anodyne	SIGMAR1	71	54
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005027	ED	On-Demand	Anodyne	CCR3	40	52
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005027	ED	On-Demand	Anodyne	UTS2R	20	42
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005027	ED	On-Demand	Anodyne	MLNR	44	37
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005027	ED	On-Demand	Anodyne	CCR2	19	46
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005027	ED	On-Demand	Anodyne	EPHX2	28	47
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005027	ED	On-Demand	Anodyne	MCHR1	32	55
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005027	ED	On-Demand	Anodyne	CACNA1G	15	48
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875005027	ED	On-Demand	Anodyne	BIRC2	22	43
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H](C)c1cccnc1)CC2	ZINC000875005061	GE	On-Demand	Anodyne	SLC18A2	47	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H](C)c1cccnc1)CC2	ZINC000875005061	GE	On-Demand	Anodyne	HCRTR1	16	47
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H](C)c1cccnc1)CC2	ZINC000875005061	GE	On-Demand	Anodyne	MTNR1B	15	48
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H](C)c1cccnc1)CC2	ZINC000875005062	GE	On-Demand	Anodyne	SLC18A2	47	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H](C)c1cccnc1)CC2	ZINC000875005062	GE	On-Demand	Anodyne	HCRTR1	16	47
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H](C)c1cccnc1)CC2	ZINC000875005062	GE	On-Demand	Anodyne	MTNR1B	15	48
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@@H](C)c1cccnc1)CC2	ZINC000875005063	GE	On-Demand	Anodyne	SLC18A2	47	35
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@@H](C)c1cccnc1)CC2	ZINC000875005063	GE	On-Demand	Anodyne	HCRTR1	16	47
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@@H](C)c1cccnc1)CC2	ZINC000875005063	GE	On-Demand	Anodyne	MTNR1B	15	48
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@H](C)c1cccnc1)CC2	ZINC000875005064	GE	On-Demand	Anodyne	SLC18A2	47	35
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@H](C)c1cccnc1)CC2	ZINC000875005064	GE	On-Demand	Anodyne	HCRTR1	16	47
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@H](C)c1cccnc1)CC2	ZINC000875005064	GE	On-Demand	Anodyne	MTNR1B	15	48
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)c2cccc3ccccc23)C1	ZINC000875005073	DH	On-Demand	Anodyne	DPP7	37	40
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)c2cccc3ccccc23)C1	ZINC000875005073	DH	On-Demand	Anodyne	Q6PRC7_IXORI	43	38
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)c2cccc3ccccc23)C1	ZINC000875005074	DH	On-Demand	Anodyne	DPP7	37	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)c2cccc3ccccc23)C1	ZINC000875005074	DH	On-Demand	Anodyne	Q6PRC7_IXORI	43	38
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)c2cccc3ccccc23)C1	ZINC000875005075	DH	On-Demand	Anodyne	DPP7	37	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)c2cccc3ccccc23)C1	ZINC000875005075	DH	On-Demand	Anodyne	Q6PRC7_IXORI	43	38
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)c2cccc3ccccc23)C1	ZINC000875005076	DH	On-Demand	Anodyne	DPP7	37	40
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)c2cccc3ccccc23)C1	ZINC000875005076	DH	On-Demand	Anodyne	Q6PRC7_IXORI	43	38
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1cccc2ccccc12	ZINC000875005088	FE	On-Demand	Anodyne	Q6PRC7_IXORI	49	37
O=C(NCC[C@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005124	EF	On-Demand	Anodyne	CHRM2	19	46
O=C(NCC[C@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005124	EF	On-Demand	Anodyne	CHRM1	15	46
O=C(NCC[C@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005124	EF	On-Demand	Anodyne	DRD2	18	56
O=C(NCC[C@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005124	EF	On-Demand	Anodyne	DRD4	43	56
O=C(NCC[C@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005124	EF	On-Demand	Anodyne	ACHE	37	44
O=C(NCC[C@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005124	EF	On-Demand	Anodyne	HRH2	18	45
O=C(NCC[C@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005124	EF	On-Demand	Anodyne	CHRM3	24	46
O=C(NCC[C@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005124	EF	On-Demand	Anodyne	SIGMAR1	47	50
O=C(NCC[C@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005124	EF	On-Demand	Anodyne	CCR3	43	49
O=C(NCC[C@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005124	EF	On-Demand	Anodyne	UTS2R	21	41
O=C(NCC[C@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005124	EF	On-Demand	Anodyne	CCR2	18	46
O=C(NCC[C@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005124	EF	On-Demand	Anodyne	SLC6A5	19	41
O=C(NCC[C@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005124	EF	On-Demand	Anodyne	EPHX2	22	49
O=C(NCC[C@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005124	EF	On-Demand	Anodyne	MCHR1	33	51
O=C(NCC[C@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005124	EF	On-Demand	Anodyne	CACNA1G	16	42
O=C(NCC[C@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005124	EF	On-Demand	Anodyne	BIRC2	39	49
O=C(NCC[C@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005125	EF	On-Demand	Anodyne	CHRM2	19	46
O=C(NCC[C@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005125	EF	On-Demand	Anodyne	CHRM1	15	46
O=C(NCC[C@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005125	EF	On-Demand	Anodyne	DRD2	18	56
O=C(NCC[C@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005125	EF	On-Demand	Anodyne	DRD4	43	56
O=C(NCC[C@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005125	EF	On-Demand	Anodyne	ACHE	37	44
O=C(NCC[C@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005125	EF	On-Demand	Anodyne	HRH2	18	45
O=C(NCC[C@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005125	EF	On-Demand	Anodyne	CHRM3	24	46
O=C(NCC[C@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005125	EF	On-Demand	Anodyne	SIGMAR1	47	50
O=C(NCC[C@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005125	EF	On-Demand	Anodyne	CCR3	43	49
O=C(NCC[C@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005125	EF	On-Demand	Anodyne	UTS2R	21	41
O=C(NCC[C@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005125	EF	On-Demand	Anodyne	CCR2	18	46
O=C(NCC[C@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005125	EF	On-Demand	Anodyne	SLC6A5	19	41
O=C(NCC[C@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005125	EF	On-Demand	Anodyne	EPHX2	22	49
O=C(NCC[C@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005125	EF	On-Demand	Anodyne	MCHR1	33	51
O=C(NCC[C@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005125	EF	On-Demand	Anodyne	CACNA1G	16	42
O=C(NCC[C@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005125	EF	On-Demand	Anodyne	BIRC2	39	49
O=C(NCC[C@@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005126	EF	On-Demand	Anodyne	CHRM2	19	46
O=C(NCC[C@@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005126	EF	On-Demand	Anodyne	CHRM1	15	46
O=C(NCC[C@@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005126	EF	On-Demand	Anodyne	DRD2	18	56
O=C(NCC[C@@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005126	EF	On-Demand	Anodyne	DRD4	43	56
O=C(NCC[C@@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005126	EF	On-Demand	Anodyne	ACHE	37	44
O=C(NCC[C@@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005126	EF	On-Demand	Anodyne	HRH2	18	45
O=C(NCC[C@@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005126	EF	On-Demand	Anodyne	CHRM3	24	46
O=C(NCC[C@@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005126	EF	On-Demand	Anodyne	SIGMAR1	47	50
O=C(NCC[C@@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005126	EF	On-Demand	Anodyne	CCR3	43	49
O=C(NCC[C@@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005126	EF	On-Demand	Anodyne	UTS2R	21	41
O=C(NCC[C@@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005126	EF	On-Demand	Anodyne	CCR2	18	46
O=C(NCC[C@@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005126	EF	On-Demand	Anodyne	SLC6A5	19	41
O=C(NCC[C@@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005126	EF	On-Demand	Anodyne	EPHX2	22	49
O=C(NCC[C@@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005126	EF	On-Demand	Anodyne	MCHR1	33	51
O=C(NCC[C@@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005126	EF	On-Demand	Anodyne	CACNA1G	16	42
O=C(NCC[C@@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005126	EF	On-Demand	Anodyne	BIRC2	39	49
O=C(NCC[C@@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005127	EF	On-Demand	Anodyne	CHRM2	19	46
O=C(NCC[C@@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005127	EF	On-Demand	Anodyne	CHRM1	15	46
O=C(NCC[C@@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005127	EF	On-Demand	Anodyne	DRD2	18	56
O=C(NCC[C@@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005127	EF	On-Demand	Anodyne	DRD4	43	56
O=C(NCC[C@@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005127	EF	On-Demand	Anodyne	ACHE	37	44
O=C(NCC[C@@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005127	EF	On-Demand	Anodyne	HRH2	18	45
O=C(NCC[C@@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005127	EF	On-Demand	Anodyne	CHRM3	24	46
O=C(NCC[C@@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005127	EF	On-Demand	Anodyne	SIGMAR1	47	50
O=C(NCC[C@@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005127	EF	On-Demand	Anodyne	CCR3	43	49
O=C(NCC[C@@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005127	EF	On-Demand	Anodyne	UTS2R	21	41
O=C(NCC[C@@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005127	EF	On-Demand	Anodyne	CCR2	18	46
O=C(NCC[C@@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005127	EF	On-Demand	Anodyne	SLC6A5	19	41
O=C(NCC[C@@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005127	EF	On-Demand	Anodyne	EPHX2	22	49
O=C(NCC[C@@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005127	EF	On-Demand	Anodyne	MCHR1	33	51
O=C(NCC[C@@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005127	EF	On-Demand	Anodyne	CACNA1G	16	42
O=C(NCC[C@@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005127	EF	On-Demand	Anodyne	BIRC2	39	49
CN1CCN(C2CCN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005129	GD	On-Demand	Anodyne	CHRM2	36	41
CN1CCN(C2CCN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005129	GD	On-Demand	Anodyne	CHRM1	26	41
CN1CCN(C2CCN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005129	GD	On-Demand	Anodyne	DRD2	26	54
CN1CCN(C2CCN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005129	GD	On-Demand	Anodyne	DRD4	55	54
CN1CCN(C2CCN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005129	GD	On-Demand	Anodyne	ACHE	39	42
CN1CCN(C2CCN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005129	GD	On-Demand	Anodyne	DRD3	18	47
CN1CCN(C2CCN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005129	GD	On-Demand	Anodyne	HTR4	16	41
CN1CCN(C2CCN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005129	GD	On-Demand	Anodyne	CHRM3	33	41
CN1CCN(C2CCN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005129	GD	On-Demand	Anodyne	LTA4H	18	46
CN1CCN(C2CCN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005129	GD	On-Demand	Anodyne	HRH3	25	49
CN1CCN(C2CCN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005129	GD	On-Demand	Anodyne	SIGMAR1	64	50
CN1CCN(C2CCN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005129	GD	On-Demand	Anodyne	CCR3	54	47
CN1CCN(C2CCN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005129	GD	On-Demand	Anodyne	CCR5	29	42
CN1CCN(C2CCN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005129	GD	On-Demand	Anodyne	UTS2R	22	41
CN1CCN(C2CCN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005129	GD	On-Demand	Anodyne	SLC18A3	24	41
CN1CCN(C2CCN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005129	GD	On-Demand	Anodyne	MLNR	47	39
CN1CCN(C2CCN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005129	GD	On-Demand	Anodyne	CCR2	25	43
CN1CCN(C2CCN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005129	GD	On-Demand	Anodyne	SLC6A5	25	46
CN1CCN(C2CCN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005129	GD	On-Demand	Anodyne	EPHX2	28	46
CN1CCN(C2CCN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005129	GD	On-Demand	Anodyne	MCHR1	31	51
CN1CCN(C2CCN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005129	GD	On-Demand	Anodyne	CACNA1G	18	40
CN1CCN(C2CCN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005129	GD	On-Demand	Anodyne	BIRC2	43	43
CN1CCN(C2CCN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005129	GD	On-Demand	Anodyne	L3MBTL3	87	44
CN1CCN(C2CCN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005130	GD	On-Demand	Anodyne	CHRM2	36	41
CN1CCN(C2CCN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005130	GD	On-Demand	Anodyne	CHRM1	26	41
CN1CCN(C2CCN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005130	GD	On-Demand	Anodyne	DRD2	26	54
CN1CCN(C2CCN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005130	GD	On-Demand	Anodyne	DRD4	55	54
CN1CCN(C2CCN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005130	GD	On-Demand	Anodyne	ACHE	39	42
CN1CCN(C2CCN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005130	GD	On-Demand	Anodyne	DRD3	18	47
CN1CCN(C2CCN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005130	GD	On-Demand	Anodyne	HTR4	16	41
CN1CCN(C2CCN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005130	GD	On-Demand	Anodyne	CHRM3	33	41
CN1CCN(C2CCN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005130	GD	On-Demand	Anodyne	LTA4H	18	46
CN1CCN(C2CCN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005130	GD	On-Demand	Anodyne	HRH3	25	49
CN1CCN(C2CCN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005130	GD	On-Demand	Anodyne	SIGMAR1	64	50
CN1CCN(C2CCN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005130	GD	On-Demand	Anodyne	CCR3	54	47
CN1CCN(C2CCN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005130	GD	On-Demand	Anodyne	CCR5	29	42
CN1CCN(C2CCN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005130	GD	On-Demand	Anodyne	UTS2R	22	41
CN1CCN(C2CCN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005130	GD	On-Demand	Anodyne	SLC18A3	24	41
CN1CCN(C2CCN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005130	GD	On-Demand	Anodyne	MLNR	47	39
CN1CCN(C2CCN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005130	GD	On-Demand	Anodyne	CCR2	25	43
CN1CCN(C2CCN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005130	GD	On-Demand	Anodyne	SLC6A5	25	46
CN1CCN(C2CCN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005130	GD	On-Demand	Anodyne	EPHX2	28	46
CN1CCN(C2CCN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005130	GD	On-Demand	Anodyne	MCHR1	31	51
CN1CCN(C2CCN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005130	GD	On-Demand	Anodyne	CACNA1G	18	40
CN1CCN(C2CCN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005130	GD	On-Demand	Anodyne	BIRC2	43	43
CN1CCN(C2CCN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)CC2)CC1	ZINC000875005130	GD	On-Demand	Anodyne	L3MBTL3	87	44
CCN1CCC(NC(=O)NC2(C)CC(F)(F)C2)CC1	ZINC000875005133	CD	On-Demand	Anodyne	EPHX2	29	40
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875005134	FF	On-Demand	Anodyne	CHRM2	18	44
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875005134	FF	On-Demand	Anodyne	CHRM1	15	44
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875005134	FF	On-Demand	Anodyne	DRD4	45	56
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875005134	FF	On-Demand	Anodyne	ACHE	38	45
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875005134	FF	On-Demand	Anodyne	CHRM3	25	44
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875005134	FF	On-Demand	Anodyne	SIGMAR1	41	48
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875005134	FF	On-Demand	Anodyne	CCR3	36	47
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875005134	FF	On-Demand	Anodyne	UTS2R	19	40
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875005134	FF	On-Demand	Anodyne	MLNR	41	37
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875005134	FF	On-Demand	Anodyne	CCR2	26	48
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875005134	FF	On-Demand	Anodyne	SLC6A5	24	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875005134	FF	On-Demand	Anodyne	EPHX2	25	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875005134	FF	On-Demand	Anodyne	MCHR1	43	51
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875005134	FF	On-Demand	Anodyne	CACNA1G	21	41
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875005135	FF	On-Demand	Anodyne	CHRM2	18	44
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875005135	FF	On-Demand	Anodyne	CHRM1	15	44
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875005135	FF	On-Demand	Anodyne	DRD4	45	56
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875005135	FF	On-Demand	Anodyne	ACHE	38	45
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875005135	FF	On-Demand	Anodyne	CHRM3	25	44
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875005135	FF	On-Demand	Anodyne	SIGMAR1	41	48
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875005135	FF	On-Demand	Anodyne	CCR3	36	47
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875005135	FF	On-Demand	Anodyne	UTS2R	19	40
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875005135	FF	On-Demand	Anodyne	MLNR	41	37
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875005135	FF	On-Demand	Anodyne	CCR2	26	48
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875005135	FF	On-Demand	Anodyne	SLC6A5	24	43
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875005135	FF	On-Demand	Anodyne	EPHX2	25	41
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875005135	FF	On-Demand	Anodyne	MCHR1	43	51
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875005135	FF	On-Demand	Anodyne	CACNA1G	21	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875005136	FF	On-Demand	Anodyne	CHRM2	18	44
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875005136	FF	On-Demand	Anodyne	CHRM1	15	44
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875005136	FF	On-Demand	Anodyne	DRD4	45	56
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875005136	FF	On-Demand	Anodyne	ACHE	38	45
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875005136	FF	On-Demand	Anodyne	CHRM3	25	44
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875005136	FF	On-Demand	Anodyne	SIGMAR1	41	48
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875005136	FF	On-Demand	Anodyne	CCR3	36	47
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875005136	FF	On-Demand	Anodyne	UTS2R	19	40
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875005136	FF	On-Demand	Anodyne	MLNR	41	37
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875005136	FF	On-Demand	Anodyne	CCR2	26	48
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875005136	FF	On-Demand	Anodyne	SLC6A5	24	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875005136	FF	On-Demand	Anodyne	EPHX2	25	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875005136	FF	On-Demand	Anodyne	MCHR1	43	51
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875005136	FF	On-Demand	Anodyne	CACNA1G	21	41
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875005137	FF	On-Demand	Anodyne	CHRM2	18	44
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875005137	FF	On-Demand	Anodyne	CHRM1	15	44
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875005137	FF	On-Demand	Anodyne	DRD4	45	56
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875005137	FF	On-Demand	Anodyne	ACHE	38	45
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875005137	FF	On-Demand	Anodyne	CHRM3	25	44
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875005137	FF	On-Demand	Anodyne	SIGMAR1	41	48
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875005137	FF	On-Demand	Anodyne	CCR3	36	47
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875005137	FF	On-Demand	Anodyne	UTS2R	19	40
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875005137	FF	On-Demand	Anodyne	MLNR	41	37
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875005137	FF	On-Demand	Anodyne	CCR2	26	48
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875005137	FF	On-Demand	Anodyne	SLC6A5	24	43
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875005137	FF	On-Demand	Anodyne	EPHX2	25	41
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875005137	FF	On-Demand	Anodyne	MCHR1	43	51
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875005137	FF	On-Demand	Anodyne	CACNA1G	21	41
CCN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875005142	DE	On-Demand	Anodyne	CHRM1	30	42
CCN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875005142	DE	On-Demand	Anodyne	DRD2	17	56
CCN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875005142	DE	On-Demand	Anodyne	DRD4	29	56
CCN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875005142	DE	On-Demand	Anodyne	DRD3	15	43
CCN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875005142	DE	On-Demand	Anodyne	CHRM3	24	40
CCN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875005142	DE	On-Demand	Anodyne	LTA4H	24	43
CCN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875005142	DE	On-Demand	Anodyne	FGFR1	19	40
CCN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875005142	DE	On-Demand	Anodyne	SIGMAR1	29	48
CCN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875005142	DE	On-Demand	Anodyne	CCR3	35	40
CCN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875005142	DE	On-Demand	Anodyne	EPHX2	52	47
CCN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875005142	DE	On-Demand	Anodyne	PDGFRA	23	40
CCN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875005142	DE	On-Demand	Anodyne	CXCR3	20	41
CCN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875005142	DE	On-Demand	Anodyne	MCHR1	20	41
CC[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1ccc(C)cc1	ZINC000875005164	EF	On-Demand	Anodyne	CACNA1H	34	44
CC[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1ccc(C)cc1	ZINC000875005164	EF	On-Demand	Anodyne	GHRHR	52	31
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875005170	GD	On-Demand	Anodyne	CHRM2	19	44
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875005170	GD	On-Demand	Anodyne	CHRM1	17	44
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875005170	GD	On-Demand	Anodyne	DRD2	15	53
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875005170	GD	On-Demand	Anodyne	DRD4	43	54
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875005170	GD	On-Demand	Anodyne	ACHE	42	43
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875005170	GD	On-Demand	Anodyne	HTR4	21	40
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875005170	GD	On-Demand	Anodyne	CHRM3	27	44
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875005170	GD	On-Demand	Anodyne	SIGMAR1	42	48
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875005170	GD	On-Demand	Anodyne	CCR3	46	48
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875005170	GD	On-Demand	Anodyne	CCR2	27	51
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875005170	GD	On-Demand	Anodyne	SLC6A5	16	41
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875005170	GD	On-Demand	Anodyne	MCHR1	36	49
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875005170	GD	On-Demand	Anodyne	CACNA1G	30	41
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875005170	GD	On-Demand	Anodyne	CACNA1I	54	42
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875005171	GD	On-Demand	Anodyne	CHRM2	19	44
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875005171	GD	On-Demand	Anodyne	CHRM1	17	44
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875005171	GD	On-Demand	Anodyne	DRD2	15	53
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875005171	GD	On-Demand	Anodyne	DRD4	43	54
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875005171	GD	On-Demand	Anodyne	ACHE	42	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875005171	GD	On-Demand	Anodyne	HTR4	21	40
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875005171	GD	On-Demand	Anodyne	CHRM3	27	44
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875005171	GD	On-Demand	Anodyne	SIGMAR1	42	48
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875005171	GD	On-Demand	Anodyne	CCR3	46	48
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875005171	GD	On-Demand	Anodyne	CCR2	27	51
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875005171	GD	On-Demand	Anodyne	SLC6A5	16	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875005171	GD	On-Demand	Anodyne	MCHR1	36	49
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875005171	GD	On-Demand	Anodyne	CACNA1G	30	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875005171	GD	On-Demand	Anodyne	CACNA1I	54	42
NC(=O)Cc1cccc2c1CCN(C(=O)N[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000875005185	GE	On-Demand	Anodyne	DRD4	33	52
NC(=O)Cc1cccc2c1CCN(C(=O)N[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000875005185	GE	On-Demand	Anodyne	ACHE	25	41
NC(=O)Cc1cccc2c1CCN(C(=O)N[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000875005185	GE	On-Demand	Anodyne	SIGMAR1	36	49
NC(=O)Cc1cccc2c1CCN(C(=O)N[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000875005185	GE	On-Demand	Anodyne	CCR3	34	44
NC(=O)Cc1cccc2c1CCN(C(=O)N[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000875005185	GE	On-Demand	Anodyne	UTS2R	19	41
NC(=O)Cc1cccc2c1CCN(C(=O)N[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000875005185	GE	On-Demand	Anodyne	CCR2	17	45
NC(=O)Cc1cccc2c1CCN(C(=O)N[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000875005185	GE	On-Demand	Anodyne	MCHR1	25	48
NC(=O)Cc1cccc2c1CCN(C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000875005186	GE	On-Demand	Anodyne	DRD4	33	52
NC(=O)Cc1cccc2c1CCN(C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000875005186	GE	On-Demand	Anodyne	ACHE	25	41
NC(=O)Cc1cccc2c1CCN(C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000875005186	GE	On-Demand	Anodyne	SIGMAR1	36	49
NC(=O)Cc1cccc2c1CCN(C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000875005186	GE	On-Demand	Anodyne	CCR3	34	44
NC(=O)Cc1cccc2c1CCN(C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000875005186	GE	On-Demand	Anodyne	UTS2R	19	41
NC(=O)Cc1cccc2c1CCN(C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000875005186	GE	On-Demand	Anodyne	CCR2	17	45
NC(=O)Cc1cccc2c1CCN(C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000875005186	GE	On-Demand	Anodyne	MCHR1	25	48
CCN1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875005190	FE	On-Demand	Mild	SIGMAR1	18	45
CCN1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875005190	FE	On-Demand	Mild	SSTR5	40	37
CCN1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875005190	FE	On-Demand	Mild	CCR3	36	43
CCN1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875005190	FE	On-Demand	Mild	ITK	18	49
CCN1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875005190	FE	On-Demand	Mild	MLNR	30	41
CCN1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875005190	FE	On-Demand	Mild	EPHX2	32	42
CCN1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875005190	FE	On-Demand	Mild	MCHR1	30	47
CCN1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875005190	FE	On-Demand	Mild	PANC	55	39
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005193	FD	On-Demand	Anodyne	CHRM2	21	42
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005193	FD	On-Demand	Anodyne	CHRM1	22	42
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005193	FD	On-Demand	Anodyne	DRD2	24	55
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005193	FD	On-Demand	Anodyne	DRD4	55	55
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005193	FD	On-Demand	Anodyne	ACHE	37	42
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005193	FD	On-Demand	Anodyne	DRD3	17	48
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005193	FD	On-Demand	Anodyne	HTR4	17	42
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005193	FD	On-Demand	Anodyne	CHRM3	27	42
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005193	FD	On-Demand	Anodyne	LTA4H	19	42
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005193	FD	On-Demand	Anodyne	SIGMAR1	53	51
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005193	FD	On-Demand	Anodyne	CCR3	40	50
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005193	FD	On-Demand	Anodyne	UTS2R	19	40
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005193	FD	On-Demand	Anodyne	MLNR	46	38
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005193	FD	On-Demand	Anodyne	CCR2	20	44
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005193	FD	On-Demand	Anodyne	EPHX2	28	45
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005193	FD	On-Demand	Anodyne	MCHR1	33	52
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005193	FD	On-Demand	Anodyne	CACNA1G	15	41
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005193	FD	On-Demand	Anodyne	BIRC2	30	43
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005195	FD	On-Demand	Anodyne	CHRM2	21	42
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005195	FD	On-Demand	Anodyne	CHRM1	22	42
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005195	FD	On-Demand	Anodyne	DRD2	24	55
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005195	FD	On-Demand	Anodyne	DRD4	55	55
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005195	FD	On-Demand	Anodyne	ACHE	37	42
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005195	FD	On-Demand	Anodyne	DRD3	17	48
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005195	FD	On-Demand	Anodyne	HTR4	17	42
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005195	FD	On-Demand	Anodyne	CHRM3	27	42
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005195	FD	On-Demand	Anodyne	LTA4H	19	42
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005195	FD	On-Demand	Anodyne	SIGMAR1	53	51
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005195	FD	On-Demand	Anodyne	CCR3	40	50
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005195	FD	On-Demand	Anodyne	UTS2R	19	40
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005195	FD	On-Demand	Anodyne	MLNR	46	38
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005195	FD	On-Demand	Anodyne	CCR2	20	44
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005195	FD	On-Demand	Anodyne	EPHX2	28	45
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005195	FD	On-Demand	Anodyne	MCHR1	33	52
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005195	FD	On-Demand	Anodyne	CACNA1G	15	41
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005195	FD	On-Demand	Anodyne	BIRC2	30	43
CONC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005196	FD	On-Demand	Anodyne	CHRM2	21	42
CONC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005196	FD	On-Demand	Anodyne	CHRM1	22	41
CONC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005196	FD	On-Demand	Anodyne	DRD2	24	53
CONC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005196	FD	On-Demand	Anodyne	DRD4	55	53
CONC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005196	FD	On-Demand	Anodyne	ACHE	42	47
CONC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005196	FD	On-Demand	Anodyne	DRD3	21	53
CONC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005196	FD	On-Demand	Anodyne	CHRM3	29	42
CONC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005196	FD	On-Demand	Anodyne	LTA4H	24	43
CONC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005196	FD	On-Demand	Anodyne	HRH3	16	42
CONC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005196	FD	On-Demand	Anodyne	SIGMAR1	54	53
CONC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005196	FD	On-Demand	Anodyne	CCR3	42	46
CONC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005196	FD	On-Demand	Anodyne	UTS2R	21	41
CONC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005196	FD	On-Demand	Anodyne	SLC18A3	21	43
CONC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005196	FD	On-Demand	Anodyne	MLNR	50	36
CONC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005196	FD	On-Demand	Anodyne	CCR2	21	45
CONC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005196	FD	On-Demand	Anodyne	EPHX2	35	41
CONC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005196	FD	On-Demand	Anodyne	MCHR1	35	50
CONC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005196	FD	On-Demand	Anodyne	CACNA1G	44	44
CONC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005196	FD	On-Demand	Anodyne	BIRC2	28	44
CONC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005197	FD	On-Demand	Anodyne	CHRM2	21	42
CONC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005197	FD	On-Demand	Anodyne	CHRM1	22	41
CONC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005197	FD	On-Demand	Anodyne	DRD2	24	53
CONC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005197	FD	On-Demand	Anodyne	DRD4	55	53
CONC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005197	FD	On-Demand	Anodyne	ACHE	42	47
CONC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005197	FD	On-Demand	Anodyne	DRD3	21	53
CONC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005197	FD	On-Demand	Anodyne	CHRM3	29	42
CONC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005197	FD	On-Demand	Anodyne	LTA4H	24	43
CONC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005197	FD	On-Demand	Anodyne	HRH3	16	42
CONC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005197	FD	On-Demand	Anodyne	SIGMAR1	54	53
CONC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005197	FD	On-Demand	Anodyne	CCR3	42	46
CONC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005197	FD	On-Demand	Anodyne	UTS2R	21	41
CONC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005197	FD	On-Demand	Anodyne	SLC18A3	21	43
CONC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005197	FD	On-Demand	Anodyne	MLNR	50	36
CONC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005197	FD	On-Demand	Anodyne	CCR2	21	45
CONC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005197	FD	On-Demand	Anodyne	EPHX2	35	41
CONC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005197	FD	On-Demand	Anodyne	MCHR1	35	50
CONC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005197	FD	On-Demand	Anodyne	CACNA1G	44	44
CONC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005197	FD	On-Demand	Anodyne	BIRC2	28	44
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005200	DE	On-Demand	Anodyne	CHRM2	19	45
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005200	DE	On-Demand	Anodyne	CHRM1	20	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005200	DE	On-Demand	Anodyne	DRD2	18	52
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005200	DE	On-Demand	Anodyne	DRD4	46	52
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005200	DE	On-Demand	Anodyne	ACHE	32	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005200	DE	On-Demand	Anodyne	CHRM3	25	45
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005200	DE	On-Demand	Anodyne	SIGMAR1	43	51
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005200	DE	On-Demand	Anodyne	CCR3	32	48
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005200	DE	On-Demand	Anodyne	CCR2	15	42
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005200	DE	On-Demand	Anodyne	EPHX2	17	45
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005200	DE	On-Demand	Anodyne	MCHR1	28	52
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005200	DE	On-Demand	Anodyne	BIRC2	49	48
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005201	DE	On-Demand	Anodyne	CHRM2	19	45
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005201	DE	On-Demand	Anodyne	CHRM1	20	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005201	DE	On-Demand	Anodyne	DRD2	18	52
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005201	DE	On-Demand	Anodyne	DRD4	46	52
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005201	DE	On-Demand	Anodyne	ACHE	32	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005201	DE	On-Demand	Anodyne	CHRM3	25	45
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005201	DE	On-Demand	Anodyne	SIGMAR1	43	51
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005201	DE	On-Demand	Anodyne	CCR3	32	48
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005201	DE	On-Demand	Anodyne	CCR2	15	42
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005201	DE	On-Demand	Anodyne	EPHX2	17	45
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005201	DE	On-Demand	Anodyne	MCHR1	28	52
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005201	DE	On-Demand	Anodyne	BIRC2	49	48
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875005202	GF	On-Demand	Anodyne	DRD2	15	50
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875005202	GF	On-Demand	Anodyne	DRD4	41	50
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875005202	GF	On-Demand	Anodyne	ACHE	31	46
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875005202	GF	On-Demand	Anodyne	CHRM3	19	44
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875005202	GF	On-Demand	Anodyne	SIGMAR1	39	48
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875005202	GF	On-Demand	Anodyne	CCR3	50	44
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875005202	GF	On-Demand	Anodyne	UTS2R	22	41
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875005202	GF	On-Demand	Anodyne	CCR2	29	47
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875005202	GF	On-Demand	Anodyne	MCHR1	45	50
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875005202	GF	On-Demand	Anodyne	NOD2	45	38
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875005203	GF	On-Demand	Anodyne	DRD2	15	50
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875005203	GF	On-Demand	Anodyne	DRD4	41	50
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875005203	GF	On-Demand	Anodyne	ACHE	31	46
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875005203	GF	On-Demand	Anodyne	CHRM3	19	44
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875005203	GF	On-Demand	Anodyne	SIGMAR1	39	48
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875005203	GF	On-Demand	Anodyne	CCR3	50	44
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875005203	GF	On-Demand	Anodyne	UTS2R	22	41
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875005203	GF	On-Demand	Anodyne	CCR2	29	47
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875005203	GF	On-Demand	Anodyne	MCHR1	45	50
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@H]1CCN(Cc3ccccc3)C1)CC2	ZINC000875005203	GF	On-Demand	Anodyne	NOD2	45	38
CCN1CCC(NC(=O)NNc2cccc(C)n2)CC1	ZINC000875005220	CD	On-Demand	Reactive	DRD4	15	42
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875005221	GE	On-Demand	Anodyne	DRD4	37	45
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875005221	GE	On-Demand	Anodyne	SIGMAR1	23	42
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875005221	GE	On-Demand	Anodyne	CCR3	27	42
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875005221	GE	On-Demand	Anodyne	MCHR1	15	48
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875005221	GE	On-Demand	Anodyne	SMO	38	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875005221	GE	On-Demand	Anodyne	ETHR	53	36
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875005222	GE	On-Demand	Anodyne	DRD4	37	45
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875005222	GE	On-Demand	Anodyne	SIGMAR1	23	42
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875005222	GE	On-Demand	Anodyne	CCR3	27	42
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875005222	GE	On-Demand	Anodyne	MCHR1	15	48
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875005222	GE	On-Demand	Anodyne	SMO	38	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875005222	GE	On-Demand	Anodyne	ETHR	53	36
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875005223	GE	On-Demand	Anodyne	DRD4	37	45
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875005223	GE	On-Demand	Anodyne	SIGMAR1	23	42
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875005223	GE	On-Demand	Anodyne	CCR3	27	42
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875005223	GE	On-Demand	Anodyne	MCHR1	15	48
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875005223	GE	On-Demand	Anodyne	SMO	38	41
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875005223	GE	On-Demand	Anodyne	ETHR	53	36
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875005224	GE	On-Demand	Anodyne	DRD4	37	45
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875005224	GE	On-Demand	Anodyne	SIGMAR1	23	42
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875005224	GE	On-Demand	Anodyne	CCR3	27	42
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875005224	GE	On-Demand	Anodyne	MCHR1	15	48
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875005224	GE	On-Demand	Anodyne	SMO	38	41
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875005224	GE	On-Demand	Anodyne	ETHR	53	36
CCN1CCC(NC(=O)N[C@@H]2CC(C)(C)CC[C@H]2O)CC1	ZINC000875005228	CD	On-Demand	Anodyne	EPHX2	23	50
CC[C@@H](NC(=O)NN(C)C(=O)OC)c1ccc(C)cc1	ZINC000875005242	CE	On-Demand	Reactive	UTS2	54	40
C[C@@H](NC(=O)N1CCC[C@@](O)(c2ccccc2)C1)c1cccs1	ZINC000875005245	EH	On-Demand	Anodyne	OPRL1	15	45
C[C@@H](NC(=O)N1CCC[C@](O)(c2ccccc2)C1)c1cccs1	ZINC000875005247	EH	On-Demand	Anodyne	OPRL1	15	45
CCN1CCC(NC(=O)NNc2cccc(F)c2Cl)CC1	ZINC000875005250	DF	On-Demand	Reactive	DRD4	17	40
CCN1CCC(NC(=O)NNc2cccc(F)c2Cl)CC1	ZINC000875005250	DF	On-Demand	Reactive	SIGMAR1	18	45
CCN1CCC(NC(=O)NNc2cccc(F)c2Cl)CC1	ZINC000875005250	DF	On-Demand	Reactive	EPHX2	32	40
CCN1CCC(NC(=O)N2CCOC[C@@H]2c2ccc(OC)cc2)CC1	ZINC000875005255	EE	On-Demand	Anodyne	PDK1	40	34
CCN1CCC(NC(=O)N2CCOC[C@@H]2c2ccc(OC)cc2)CC1	ZINC000875005255	EE	On-Demand	Anodyne	MCHR1	15	40
CCN1CCC(NC(=O)N2CCOC[C@H]2c2ccc(OC)cc2)CC1	ZINC000875005256	EE	On-Demand	Anodyne	PDK1	40	34
CCN1CCC(NC(=O)N2CCOC[C@H]2c2ccc(OC)cc2)CC1	ZINC000875005256	EE	On-Demand	Anodyne	MCHR1	15	40
CCN1CCC(NC(=O)N2CCC(c3nccc(-c4cccnc4)n3)CC2)CC1	ZINC000875005257	GF	On-Demand	Anodyne	C3AR1	40	36
CCN1CCC(NC(=O)N2CCC(c3nccc(-c4cccnc4)n3)CC2)CC1	ZINC000875005257	GF	On-Demand	Anodyne	EPHX2	18	42
CCN1CCC(NC(=O)N2CCC(c3nccc(-c4cccnc4)n3)CC2)CC1	ZINC000875005257	GF	On-Demand	Anodyne	HPGDS	41	37
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005264	DD	On-Demand	Anodyne	CHRM2	21	43
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005264	DD	On-Demand	Anodyne	CHRM1	18	43
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005264	DD	On-Demand	Anodyne	DRD2	21	56
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005264	DD	On-Demand	Anodyne	DRD4	50	56
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005264	DD	On-Demand	Anodyne	ACHE	42	46
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005264	DD	On-Demand	Anodyne	DRD3	18	54
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005264	DD	On-Demand	Anodyne	HTR4	24	40
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005264	DD	On-Demand	Anodyne	CHRM3	28	43
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005264	DD	On-Demand	Anodyne	LTA4H	20	41
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005264	DD	On-Demand	Anodyne	SIGMAR1	53	52
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005264	DD	On-Demand	Anodyne	CCR3	52	48
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005264	DD	On-Demand	Anodyne	UTS2R	21	41
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005264	DD	On-Demand	Anodyne	SLC18A3	24	40
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005264	DD	On-Demand	Anodyne	CCR2	20	47
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005264	DD	On-Demand	Anodyne	EPHX2	22	52
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005264	DD	On-Demand	Anodyne	MCHR1	34	53
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005264	DD	On-Demand	Anodyne	CACNA1G	17	42
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875005264	DD	On-Demand	Anodyne	BIRC2	20	42
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005265	DD	On-Demand	Anodyne	CHRM2	21	43
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005265	DD	On-Demand	Anodyne	CHRM1	18	43
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005265	DD	On-Demand	Anodyne	DRD2	21	56
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005265	DD	On-Demand	Anodyne	DRD4	50	56
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005265	DD	On-Demand	Anodyne	ACHE	42	46
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005265	DD	On-Demand	Anodyne	DRD3	18	54
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005265	DD	On-Demand	Anodyne	HTR4	24	40
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005265	DD	On-Demand	Anodyne	CHRM3	28	43
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005265	DD	On-Demand	Anodyne	LTA4H	20	41
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005265	DD	On-Demand	Anodyne	SIGMAR1	53	52
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005265	DD	On-Demand	Anodyne	CCR3	52	48
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005265	DD	On-Demand	Anodyne	UTS2R	21	41
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005265	DD	On-Demand	Anodyne	SLC18A3	24	40
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005265	DD	On-Demand	Anodyne	CCR2	20	47
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005265	DD	On-Demand	Anodyne	EPHX2	22	52
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005265	DD	On-Demand	Anodyne	MCHR1	34	53
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005265	DD	On-Demand	Anodyne	CACNA1G	17	42
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875005265	DD	On-Demand	Anodyne	BIRC2	20	42
CCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(Br)cc2)CC1	ZINC000875005273	GF	On-Demand	Anodyne	EPHX2	25	44
CCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(Br)cc2)CC1	ZINC000875005274	GF	On-Demand	Anodyne	EPHX2	25	44
CC[C@@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccc(C)cc1	ZINC000875005308	FF	On-Demand	Anodyne	UTS2	51	40
CC[C@]1(C(=O)Nc2nc(-c3ccc(F)cc3)cs2)CCNC1=O	ZINC000875005311	EF	On-Demand	Anodyne	MAOB	18	42
CC[C@]1(C(=O)Nc2nc(-c3ccc(F)cc3)cs2)CCNC1=O	ZINC000875005311	EF	On-Demand	Anodyne	ROCK1	22	52
CC[C@]1(C(=O)Nc2nc(-c3ccc(F)cc3)cs2)CCNC1=O	ZINC000875005311	EF	On-Demand	Anodyne	ROCK2	15	52
CCN1CCC(NC(=O)N(CC)[C@H](C)[C@@H](O)c2ccccc2)CC1	ZINC000875005340	EF	On-Demand	Anodyne	CHRM3	27	40
CCN1CCC(NC(=O)N(CC)[C@H](C)[C@@H](O)c2ccccc2)CC1	ZINC000875005340	EF	On-Demand	Anodyne	SIGMAR1	18	40
CCN1CCC(NC(=O)N(CC)[C@H](C)[C@@H](O)c2ccccc2)CC1	ZINC000875005340	EF	On-Demand	Anodyne	CCR5	39	41
CCN1CCC(NC(=O)N(CC)[C@H](C)[C@@H](O)c2ccccc2)CC1	ZINC000875005340	EF	On-Demand	Anodyne	NPY5R	21	40
CCN1CCC(NC(=O)N(CC)[C@@H](C)[C@@H](O)c2ccccc2)CC1	ZINC000875005341	EF	On-Demand	Anodyne	CHRM3	27	40
CCN1CCC(NC(=O)N(CC)[C@@H](C)[C@@H](O)c2ccccc2)CC1	ZINC000875005341	EF	On-Demand	Anodyne	SIGMAR1	18	40
CCN1CCC(NC(=O)N(CC)[C@@H](C)[C@@H](O)c2ccccc2)CC1	ZINC000875005341	EF	On-Demand	Anodyne	CCR5	39	41
CCN1CCC(NC(=O)N(CC)[C@@H](C)[C@@H](O)c2ccccc2)CC1	ZINC000875005341	EF	On-Demand	Anodyne	NPY5R	21	40
CCN1CCC(NC(=O)N(CC)[C@H](C)[C@H](O)c2ccccc2)CC1	ZINC000875005342	EF	On-Demand	Anodyne	CHRM3	27	40
CCN1CCC(NC(=O)N(CC)[C@H](C)[C@H](O)c2ccccc2)CC1	ZINC000875005342	EF	On-Demand	Anodyne	SIGMAR1	18	40
CCN1CCC(NC(=O)N(CC)[C@H](C)[C@H](O)c2ccccc2)CC1	ZINC000875005342	EF	On-Demand	Anodyne	CCR5	39	41
CCN1CCC(NC(=O)N(CC)[C@H](C)[C@H](O)c2ccccc2)CC1	ZINC000875005342	EF	On-Demand	Anodyne	NPY5R	21	40
CCN1CCC(NC(=O)N(CC)[C@@H](C)[C@H](O)c2ccccc2)CC1	ZINC000875005343	EF	On-Demand	Anodyne	CHRM3	27	40
CCN1CCC(NC(=O)N(CC)[C@@H](C)[C@H](O)c2ccccc2)CC1	ZINC000875005343	EF	On-Demand	Anodyne	SIGMAR1	18	40
CCN1CCC(NC(=O)N(CC)[C@@H](C)[C@H](O)c2ccccc2)CC1	ZINC000875005343	EF	On-Demand	Anodyne	CCR5	39	41
CCN1CCC(NC(=O)N(CC)[C@@H](C)[C@H](O)c2ccccc2)CC1	ZINC000875005343	EF	On-Demand	Anodyne	NPY5R	21	40
CCN1CCC(NC(=O)N2CCCSC[C@@H]2c2ccccc2OC)CC1	ZINC000875005346	GG	On-Demand	Anodyne	DRD2	17	41
CCN1CCC(NC(=O)N2CCCSC[C@@H]2c2ccccc2OC)CC1	ZINC000875005346	GG	On-Demand	Anodyne	DRD4	17	41
CCN1CCC(NC(=O)N2CCCSC[C@@H]2c2ccccc2OC)CC1	ZINC000875005346	GG	On-Demand	Anodyne	HTR4	15	40
CCN1CCC(NC(=O)N2CCCSC[C@H]2c2ccccc2OC)CC1	ZINC000875005347	GG	On-Demand	Anodyne	DRD2	17	41
CCN1CCC(NC(=O)N2CCCSC[C@H]2c2ccccc2OC)CC1	ZINC000875005347	GG	On-Demand	Anodyne	DRD4	17	41
CCN1CCC(NC(=O)N2CCCSC[C@H]2c2ccccc2OC)CC1	ZINC000875005347	GG	On-Demand	Anodyne	HTR4	15	40
CCN1CCC(NC(=O)NC[C@H]2CN(Cc3ccccc3C)CCO2)CC1	ZINC000875005348	FD	On-Demand	Anodyne	DRD4	27	48
CCN1CCC(NC(=O)NC[C@H]2CN(Cc3ccccc3C)CCO2)CC1	ZINC000875005348	FD	On-Demand	Anodyne	SIGMAR1	15	40
CCN1CCC(NC(=O)NC[C@@H]2CN(Cc3ccccc3C)CCO2)CC1	ZINC000875005349	FD	On-Demand	Anodyne	DRD4	27	48
CCN1CCC(NC(=O)NC[C@@H]2CN(Cc3ccccc3C)CCO2)CC1	ZINC000875005349	FD	On-Demand	Anodyne	SIGMAR1	15	40
C[C@@H](NC(=O)N1CC2(CCN(C(=O)OC(C)(C)C)CC2)C1)c1cccs1	ZINC000875005351	GH	On-Demand	Anodyne	GPR119	23	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875005352	GD	On-Demand	Anodyne	CHRM2	23	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875005352	GD	On-Demand	Anodyne	CHRM1	18	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875005352	GD	On-Demand	Anodyne	DRD2	19	56
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875005352	GD	On-Demand	Anodyne	DRD4	46	56
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875005352	GD	On-Demand	Anodyne	ACHE	43	44
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875005352	GD	On-Demand	Anodyne	CHRM3	28	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875005352	GD	On-Demand	Anodyne	LTA4H	21	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875005352	GD	On-Demand	Anodyne	SIGMAR1	54	52
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875005352	GD	On-Demand	Anodyne	CCR3	48	48
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875005352	GD	On-Demand	Anodyne	UTS2R	21	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875005352	GD	On-Demand	Anodyne	MLNR	42	38
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875005352	GD	On-Demand	Anodyne	CCR2	22	47
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875005352	GD	On-Demand	Anodyne	EPHX2	23	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875005352	GD	On-Demand	Anodyne	MCHR1	29	53
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875005352	GD	On-Demand	Anodyne	BIRC2	23	42
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875005353	GD	On-Demand	Anodyne	CHRM2	23	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875005353	GD	On-Demand	Anodyne	CHRM1	18	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875005353	GD	On-Demand	Anodyne	DRD2	19	56
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875005353	GD	On-Demand	Anodyne	DRD4	46	56
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875005353	GD	On-Demand	Anodyne	ACHE	43	44
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875005353	GD	On-Demand	Anodyne	CHRM3	28	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875005353	GD	On-Demand	Anodyne	LTA4H	21	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875005353	GD	On-Demand	Anodyne	SIGMAR1	54	52
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875005353	GD	On-Demand	Anodyne	CCR3	48	48
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875005353	GD	On-Demand	Anodyne	UTS2R	21	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875005353	GD	On-Demand	Anodyne	MLNR	42	38
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875005353	GD	On-Demand	Anodyne	CCR2	22	47
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875005353	GD	On-Demand	Anodyne	EPHX2	23	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875005353	GD	On-Demand	Anodyne	MCHR1	29	53
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875005353	GD	On-Demand	Anodyne	BIRC2	23	42
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875005354	GD	On-Demand	Anodyne	CHRM2	23	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875005354	GD	On-Demand	Anodyne	CHRM1	18	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875005354	GD	On-Demand	Anodyne	DRD2	19	56
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875005354	GD	On-Demand	Anodyne	DRD4	46	56
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875005354	GD	On-Demand	Anodyne	ACHE	43	44
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875005354	GD	On-Demand	Anodyne	CHRM3	28	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875005354	GD	On-Demand	Anodyne	LTA4H	21	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875005354	GD	On-Demand	Anodyne	SIGMAR1	54	52
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875005354	GD	On-Demand	Anodyne	CCR3	48	48
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875005354	GD	On-Demand	Anodyne	UTS2R	21	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875005354	GD	On-Demand	Anodyne	MLNR	42	38
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875005354	GD	On-Demand	Anodyne	CCR2	22	47
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875005354	GD	On-Demand	Anodyne	EPHX2	23	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875005354	GD	On-Demand	Anodyne	MCHR1	29	53
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875005354	GD	On-Demand	Anodyne	BIRC2	23	42
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875005355	GD	On-Demand	Anodyne	CHRM2	23	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875005355	GD	On-Demand	Anodyne	CHRM1	18	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875005355	GD	On-Demand	Anodyne	DRD2	19	56
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875005355	GD	On-Demand	Anodyne	DRD4	46	56
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875005355	GD	On-Demand	Anodyne	ACHE	43	44
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875005355	GD	On-Demand	Anodyne	CHRM3	28	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875005355	GD	On-Demand	Anodyne	LTA4H	21	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875005355	GD	On-Demand	Anodyne	SIGMAR1	54	52
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875005355	GD	On-Demand	Anodyne	CCR3	48	48
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875005355	GD	On-Demand	Anodyne	UTS2R	21	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875005355	GD	On-Demand	Anodyne	MLNR	42	38
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875005355	GD	On-Demand	Anodyne	CCR2	22	47
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875005355	GD	On-Demand	Anodyne	EPHX2	23	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875005355	GD	On-Demand	Anodyne	MCHR1	29	53
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875005355	GD	On-Demand	Anodyne	BIRC2	23	42
O=C(Oc1ccc(Oc2ccccn2)cc1)C1(S(=O)(=O)c2ccc(Cl)cc2)CCCC1	ZINC000875005370	JK	On-Demand	Anodyne	MMP13	33	44
O=C(Oc1ccc(Oc2ccccn2)cc1)C1(S(=O)(=O)c2ccc(Cl)cc2)CCCC1	ZINC000875005370	JK	On-Demand	Anodyne	MMP2	40	44
O=C(Oc1ccc(Oc2ccccn2)cc1)C1(S(=O)(=O)c2ccc(Cl)cc2)CCCC1	ZINC000875005370	JK	On-Demand	Anodyne	MMP3	15	44
O=C(Oc1ccc(Oc2ccccn2)cc1)C1(S(=O)(=O)c2ccc(Cl)cc2)CCCC1	ZINC000875005370	JK	On-Demand	Anodyne	MMP8	18	44
O=C(Oc1ccc(Oc2ccccn2)cc1)C1(S(=O)(=O)c2ccc(Cl)cc2)CCCC1	ZINC000875005370	JK	On-Demand	Anodyne	MMP14	37	44
O=C(Oc1ccc(Oc2ccccn2)cc1)C1(S(=O)(=O)c2ccc(Cl)cc2)CCCC1	ZINC000875005370	JK	On-Demand	Anodyne	MMP10	70	34
CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccc(C)cc1	ZINC000875005380	EG	On-Demand	Anodyne	SLC6A4	29	43
CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccc(C)cc1	ZINC000875005380	EG	On-Demand	Anodyne	SLC6A3	62	45
CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccc(C)cc1	ZINC000875005381	EG	On-Demand	Anodyne	SLC6A4	29	43
CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccc(C)cc1	ZINC000875005381	EG	On-Demand	Anodyne	SLC6A3	62	45
COCCN(CC1CCN(C)CC1)C(=O)NCCc1ccccc1OC	ZINC000875005385	FE	On-Demand	Anodyne	HTR1A	20	40
COCCN(CC1CCN(C)CC1)C(=O)NCCc1ccccc1OC	ZINC000875005385	FE	On-Demand	Anodyne	DRD2	32	40
COCCN(CC1CCN(C)CC1)C(=O)NCCc1ccccc1OC	ZINC000875005385	FE	On-Demand	Anodyne	MBTPS1	56	38
COCCN(CC1CCN(C)CC1)C(=O)NCCc1ccccc1OC	ZINC000875005385	FE	On-Demand	Anodyne	ACKR3	71	35
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005394	EC	On-Demand	Anodyne	CHRM2	27	41
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005394	EC	On-Demand	Anodyne	CHRM1	22	41
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005394	EC	On-Demand	Anodyne	DRD2	23	54
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005394	EC	On-Demand	Anodyne	DRD4	56	54
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005394	EC	On-Demand	Anodyne	ACHE	40	45
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005394	EC	On-Demand	Anodyne	DRD3	20	54
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005394	EC	On-Demand	Anodyne	HTR4	20	45
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005394	EC	On-Demand	Anodyne	CHRM3	37	41
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005394	EC	On-Demand	Anodyne	LTA4H	25	46
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005394	EC	On-Demand	Anodyne	SIGMAR1	66	54
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005394	EC	On-Demand	Anodyne	SSTR5	49	37
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005394	EC	On-Demand	Anodyne	CCR3	44	47
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005394	EC	On-Demand	Anodyne	UTS2R	23	43
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005394	EC	On-Demand	Anodyne	SLC18A3	22	40
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005394	EC	On-Demand	Anodyne	MLNR	45	35
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005394	EC	On-Demand	Anodyne	CCR2	18	43
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005394	EC	On-Demand	Anodyne	SLC6A5	22	42
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005394	EC	On-Demand	Anodyne	EPHX2	19	44
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005394	EC	On-Demand	Anodyne	MCHR1	35	51
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005394	EC	On-Demand	Anodyne	CACNA1G	20	42
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005394	EC	On-Demand	Anodyne	CCR8	23	42
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005394	EC	On-Demand	Anodyne	BIRC2	26	43
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005395	EC	On-Demand	Anodyne	CHRM2	27	41
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005395	EC	On-Demand	Anodyne	CHRM1	22	41
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005395	EC	On-Demand	Anodyne	DRD2	23	54
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005395	EC	On-Demand	Anodyne	DRD4	56	54
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005395	EC	On-Demand	Anodyne	ACHE	40	45
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005395	EC	On-Demand	Anodyne	DRD3	20	54
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005395	EC	On-Demand	Anodyne	HTR4	20	45
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005395	EC	On-Demand	Anodyne	CHRM3	37	41
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005395	EC	On-Demand	Anodyne	LTA4H	25	46
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005395	EC	On-Demand	Anodyne	SIGMAR1	66	54
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005395	EC	On-Demand	Anodyne	SSTR5	49	37
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005395	EC	On-Demand	Anodyne	CCR3	44	47
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005395	EC	On-Demand	Anodyne	UTS2R	23	43
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005395	EC	On-Demand	Anodyne	SLC18A3	22	40
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005395	EC	On-Demand	Anodyne	MLNR	45	35
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005395	EC	On-Demand	Anodyne	CCR2	18	43
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005395	EC	On-Demand	Anodyne	SLC6A5	22	42
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005395	EC	On-Demand	Anodyne	EPHX2	19	44
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005395	EC	On-Demand	Anodyne	MCHR1	35	51
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005395	EC	On-Demand	Anodyne	CACNA1G	20	42
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005395	EC	On-Demand	Anodyne	CCR8	23	42
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005395	EC	On-Demand	Anodyne	BIRC2	26	43
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005396	EE	On-Demand	Anodyne	CHRM2	23	45
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005396	EE	On-Demand	Anodyne	CHRM1	24	45
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005396	EE	On-Demand	Anodyne	DRD2	28	56
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005396	EE	On-Demand	Anodyne	DRD4	56	56
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005396	EE	On-Demand	Anodyne	ACHE	42	45
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005396	EE	On-Demand	Anodyne	SLC6A1	116	36
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005396	EE	On-Demand	Anodyne	DRD3	22	51
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005396	EE	On-Demand	Anodyne	HTR4	23	45
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005396	EE	On-Demand	Anodyne	CHRM3	31	45
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005396	EE	On-Demand	Anodyne	LTA4H	22	45
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005396	EE	On-Demand	Anodyne	HRH3	26	41
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005396	EE	On-Demand	Anodyne	SIGMAR1	57	53
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005396	EE	On-Demand	Anodyne	CCR3	52	51
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005396	EE	On-Demand	Anodyne	CCR5	44	37
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005396	EE	On-Demand	Anodyne	UTS2R	21	41
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005396	EE	On-Demand	Anodyne	MLNR	44	36
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005396	EE	On-Demand	Anodyne	CCR2	22	45
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005396	EE	On-Demand	Anodyne	EPHX2	24	44
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005396	EE	On-Demand	Anodyne	DPP7	48	37
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005396	EE	On-Demand	Anodyne	MCHR1	34	53
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005396	EE	On-Demand	Anodyne	CACNA1G	33	46
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005396	EE	On-Demand	Anodyne	BIRC2	45	51
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005397	EE	On-Demand	Anodyne	CHRM2	23	45
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005397	EE	On-Demand	Anodyne	CHRM1	24	45
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005397	EE	On-Demand	Anodyne	DRD2	28	56
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005397	EE	On-Demand	Anodyne	DRD4	56	56
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005397	EE	On-Demand	Anodyne	ACHE	42	45
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005397	EE	On-Demand	Anodyne	SLC6A1	116	36
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005397	EE	On-Demand	Anodyne	DRD3	22	51
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005397	EE	On-Demand	Anodyne	HTR4	23	45
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005397	EE	On-Demand	Anodyne	CHRM3	31	45
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005397	EE	On-Demand	Anodyne	LTA4H	22	45
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005397	EE	On-Demand	Anodyne	HRH3	26	41
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005397	EE	On-Demand	Anodyne	SIGMAR1	57	53
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005397	EE	On-Demand	Anodyne	CCR3	52	51
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005397	EE	On-Demand	Anodyne	CCR5	44	37
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005397	EE	On-Demand	Anodyne	UTS2R	21	41
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005397	EE	On-Demand	Anodyne	MLNR	44	36
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005397	EE	On-Demand	Anodyne	CCR2	22	45
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005397	EE	On-Demand	Anodyne	EPHX2	24	44
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005397	EE	On-Demand	Anodyne	DPP7	48	37
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005397	EE	On-Demand	Anodyne	MCHR1	34	53
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005397	EE	On-Demand	Anodyne	CACNA1G	33	46
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005397	EE	On-Demand	Anodyne	BIRC2	45	51
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005398	EE	On-Demand	Anodyne	CHRM2	23	45
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005398	EE	On-Demand	Anodyne	CHRM1	24	45
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005398	EE	On-Demand	Anodyne	DRD2	28	56
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005398	EE	On-Demand	Anodyne	DRD4	56	56
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005398	EE	On-Demand	Anodyne	ACHE	42	45
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005398	EE	On-Demand	Anodyne	SLC6A1	116	36
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005398	EE	On-Demand	Anodyne	DRD3	22	51
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005398	EE	On-Demand	Anodyne	HTR4	23	45
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005398	EE	On-Demand	Anodyne	CHRM3	31	45
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005398	EE	On-Demand	Anodyne	LTA4H	22	45
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005398	EE	On-Demand	Anodyne	HRH3	26	41
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005398	EE	On-Demand	Anodyne	SIGMAR1	57	53
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005398	EE	On-Demand	Anodyne	CCR3	52	51
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005398	EE	On-Demand	Anodyne	CCR5	44	37
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005398	EE	On-Demand	Anodyne	UTS2R	21	41
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005398	EE	On-Demand	Anodyne	MLNR	44	36
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005398	EE	On-Demand	Anodyne	CCR2	22	45
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005398	EE	On-Demand	Anodyne	EPHX2	24	44
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005398	EE	On-Demand	Anodyne	DPP7	48	37
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005398	EE	On-Demand	Anodyne	MCHR1	34	53
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005398	EE	On-Demand	Anodyne	CACNA1G	33	46
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005398	EE	On-Demand	Anodyne	BIRC2	45	51
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005399	EE	On-Demand	Anodyne	CHRM2	23	45
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005399	EE	On-Demand	Anodyne	CHRM1	24	45
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005399	EE	On-Demand	Anodyne	DRD2	28	56
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005399	EE	On-Demand	Anodyne	DRD4	56	56
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005399	EE	On-Demand	Anodyne	ACHE	42	45
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005399	EE	On-Demand	Anodyne	SLC6A1	116	36
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005399	EE	On-Demand	Anodyne	DRD3	22	51
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005399	EE	On-Demand	Anodyne	HTR4	23	45
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005399	EE	On-Demand	Anodyne	CHRM3	31	45
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005399	EE	On-Demand	Anodyne	LTA4H	22	45
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005399	EE	On-Demand	Anodyne	HRH3	26	41
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005399	EE	On-Demand	Anodyne	SIGMAR1	57	53
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005399	EE	On-Demand	Anodyne	CCR3	52	51
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005399	EE	On-Demand	Anodyne	CCR5	44	37
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005399	EE	On-Demand	Anodyne	UTS2R	21	41
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005399	EE	On-Demand	Anodyne	MLNR	44	36
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005399	EE	On-Demand	Anodyne	CCR2	22	45
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005399	EE	On-Demand	Anodyne	EPHX2	24	44
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005399	EE	On-Demand	Anodyne	DPP7	48	37
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005399	EE	On-Demand	Anodyne	MCHR1	34	53
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005399	EE	On-Demand	Anodyne	CACNA1G	33	46
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005399	EE	On-Demand	Anodyne	BIRC2	45	51
O=C(COc1cc(Cl)ccc1Cl)Oc1ccc(Oc2ccccn2)cc1	ZINC000875005400	GK	On-Demand	Anodyne	GPBAR1	19	40
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875005420	EF	On-Demand	Anodyne	CHRM2	22	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875005420	EF	On-Demand	Anodyne	CHRM1	20	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875005420	EF	On-Demand	Anodyne	DRD2	18	56
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875005420	EF	On-Demand	Anodyne	DRD4	46	56
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875005420	EF	On-Demand	Anodyne	ACHE	34	44
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875005420	EF	On-Demand	Anodyne	DRD3	15	51
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875005420	EF	On-Demand	Anodyne	CHRM3	27	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875005420	EF	On-Demand	Anodyne	LTA4H	19	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875005420	EF	On-Demand	Anodyne	SIGMAR1	51	52
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875005420	EF	On-Demand	Anodyne	CCR3	40	48
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875005420	EF	On-Demand	Anodyne	UTS2R	20	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875005420	EF	On-Demand	Anodyne	MLNR	42	38
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875005420	EF	On-Demand	Anodyne	CCR2	19	45
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875005420	EF	On-Demand	Anodyne	EPHX2	24	46
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875005420	EF	On-Demand	Anodyne	MCHR1	30	53
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875005420	EF	On-Demand	Anodyne	BIRC2	33	44
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875005421	EF	On-Demand	Anodyne	CHRM2	22	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875005421	EF	On-Demand	Anodyne	CHRM1	20	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875005421	EF	On-Demand	Anodyne	DRD2	18	56
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875005421	EF	On-Demand	Anodyne	DRD4	46	56
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875005421	EF	On-Demand	Anodyne	ACHE	34	44
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875005421	EF	On-Demand	Anodyne	DRD3	15	51
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875005421	EF	On-Demand	Anodyne	CHRM3	27	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875005421	EF	On-Demand	Anodyne	LTA4H	19	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875005421	EF	On-Demand	Anodyne	SIGMAR1	51	52
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875005421	EF	On-Demand	Anodyne	CCR3	40	48
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875005421	EF	On-Demand	Anodyne	UTS2R	20	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875005421	EF	On-Demand	Anodyne	MLNR	42	38
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875005421	EF	On-Demand	Anodyne	CCR2	19	45
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875005421	EF	On-Demand	Anodyne	EPHX2	24	46
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875005421	EF	On-Demand	Anodyne	MCHR1	30	53
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875005421	EF	On-Demand	Anodyne	BIRC2	33	44
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875005422	EF	On-Demand	Anodyne	CHRM2	22	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875005422	EF	On-Demand	Anodyne	CHRM1	20	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875005422	EF	On-Demand	Anodyne	DRD2	18	56
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875005422	EF	On-Demand	Anodyne	DRD4	46	56
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875005422	EF	On-Demand	Anodyne	ACHE	34	44
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875005422	EF	On-Demand	Anodyne	DRD3	15	51
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875005422	EF	On-Demand	Anodyne	CHRM3	27	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875005422	EF	On-Demand	Anodyne	LTA4H	19	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875005422	EF	On-Demand	Anodyne	SIGMAR1	51	52
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875005422	EF	On-Demand	Anodyne	CCR3	40	48
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875005422	EF	On-Demand	Anodyne	UTS2R	20	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875005422	EF	On-Demand	Anodyne	MLNR	42	38
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875005422	EF	On-Demand	Anodyne	CCR2	19	45
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875005422	EF	On-Demand	Anodyne	EPHX2	24	46
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875005422	EF	On-Demand	Anodyne	MCHR1	30	53
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875005422	EF	On-Demand	Anodyne	BIRC2	33	44
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875005423	EF	On-Demand	Anodyne	CHRM2	22	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875005423	EF	On-Demand	Anodyne	CHRM1	20	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875005423	EF	On-Demand	Anodyne	DRD2	18	56
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875005423	EF	On-Demand	Anodyne	DRD4	46	56
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875005423	EF	On-Demand	Anodyne	ACHE	34	44
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875005423	EF	On-Demand	Anodyne	DRD3	15	51
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875005423	EF	On-Demand	Anodyne	CHRM3	27	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875005423	EF	On-Demand	Anodyne	LTA4H	19	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875005423	EF	On-Demand	Anodyne	SIGMAR1	51	52
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875005423	EF	On-Demand	Anodyne	CCR3	40	48
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875005423	EF	On-Demand	Anodyne	UTS2R	20	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875005423	EF	On-Demand	Anodyne	MLNR	42	38
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875005423	EF	On-Demand	Anodyne	CCR2	19	45
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875005423	EF	On-Demand	Anodyne	EPHX2	24	46
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875005423	EF	On-Demand	Anodyne	MCHR1	30	53
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875005423	EF	On-Demand	Anodyne	BIRC2	33	44
CCN1CCC(NC(=O)NCC[C@H](O)C2CCCC2)CC1	ZINC000875005428	CD	On-Demand	Anodyne	EPHX2	22	45
CCN1CCC(NC(=O)NCC[C@@H](O)C2CCCC2)CC1	ZINC000875005429	CD	On-Demand	Anodyne	EPHX2	22	45
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005440	FC	On-Demand	Anodyne	CHRM2	15	41
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005440	FC	On-Demand	Anodyne	CHRM1	15	41
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005440	FC	On-Demand	Anodyne	DRD4	41	55
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005440	FC	On-Demand	Anodyne	ACHE	33	42
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005440	FC	On-Demand	Anodyne	CHRM3	22	41
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005440	FC	On-Demand	Anodyne	SIGMAR1	43	59
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005440	FC	On-Demand	Anodyne	CCR3	37	46
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005440	FC	On-Demand	Anodyne	UTS2R	20	41
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005440	FC	On-Demand	Anodyne	MLNR	44	36
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005440	FC	On-Demand	Anodyne	CCR2	20	45
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005440	FC	On-Demand	Anodyne	EPHX2	31	41
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005440	FC	On-Demand	Anodyne	MCHR1	27	50
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005440	FC	On-Demand	Anodyne	CACNA1G	42	46
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005440	FC	On-Demand	Anodyne	BIRC2	19	42
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005441	FC	On-Demand	Anodyne	CHRM2	15	41
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005441	FC	On-Demand	Anodyne	CHRM1	15	41
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005441	FC	On-Demand	Anodyne	DRD4	41	55
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005441	FC	On-Demand	Anodyne	ACHE	33	42
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005441	FC	On-Demand	Anodyne	CHRM3	22	41
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005441	FC	On-Demand	Anodyne	SIGMAR1	43	59
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005441	FC	On-Demand	Anodyne	CCR3	37	46
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005441	FC	On-Demand	Anodyne	UTS2R	20	41
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005441	FC	On-Demand	Anodyne	MLNR	44	36
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005441	FC	On-Demand	Anodyne	CCR2	20	45
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005441	FC	On-Demand	Anodyne	EPHX2	31	41
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005441	FC	On-Demand	Anodyne	MCHR1	27	50
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005441	FC	On-Demand	Anodyne	CACNA1G	42	46
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005441	FC	On-Demand	Anodyne	BIRC2	19	42
CCN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875005455	EE	On-Demand	Anodyne	DRD4	24	46
CCN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875005455	EE	On-Demand	Anodyne	SIGMAR1	21	52
CCN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875005455	EE	On-Demand	Anodyne	CCR3	31	40
CCN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875005455	EE	On-Demand	Anodyne	EPHX2	35	48
CCN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875005455	EE	On-Demand	Anodyne	CXCR3	17	43
CCN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875005455	EE	On-Demand	Anodyne	MCHR1	31	42
CCN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875005456	EE	On-Demand	Anodyne	DRD4	24	46
CCN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875005456	EE	On-Demand	Anodyne	SIGMAR1	21	52
CCN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875005456	EE	On-Demand	Anodyne	CCR3	31	40
CCN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875005456	EE	On-Demand	Anodyne	EPHX2	35	48
CCN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875005456	EE	On-Demand	Anodyne	CXCR3	17	43
CCN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875005456	EE	On-Demand	Anodyne	MCHR1	31	42
CCN1CCC(NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)CC1	ZINC000875005462	FF	On-Demand	Anodyne	DRD4	19	42
CCN1CCC(NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)CC1	ZINC000875005462	FF	On-Demand	Anodyne	OPRL1	19	44
CCN1CCC(NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)CC1	ZINC000875005462	FF	On-Demand	Anodyne	SIGMAR1	22	41
CN1C(=O)CN(CC(=O)N2CCCSC2=Nc2ccccc2)C1=O	ZINC000875005472	ED	On-Demand	Mild	CYSK1	47	31
CCN1CCC(NC(=O)NC(C)(C)[C@@H]2CCCCO2)CC1	ZINC000875005475	CE	On-Demand	Anodyne	EPHX2	16	42
CCN1CCC(NC(=O)NC(C)(C)[C@H]2CCCCO2)CC1	ZINC000875005476	CE	On-Demand	Anodyne	EPHX2	16	42
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875005481	DC	On-Demand	Anodyne	CHRM2	18	42
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875005481	DC	On-Demand	Anodyne	CHRM1	15	42
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875005481	DC	On-Demand	Anodyne	DRD2	15	55
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875005481	DC	On-Demand	Anodyne	DRD4	49	55
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875005481	DC	On-Demand	Anodyne	ACHE	33	44
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875005481	DC	On-Demand	Anodyne	CHRM3	23	42
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875005481	DC	On-Demand	Anodyne	LTA4H	17	40
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875005481	DC	On-Demand	Anodyne	SIGMAR1	50	51
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875005481	DC	On-Demand	Anodyne	CCR3	36	48
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875005481	DC	On-Demand	Anodyne	UTS2R	17	40
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875005481	DC	On-Demand	Anodyne	CCR2	18	44
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875005481	DC	On-Demand	Anodyne	MCHR1	32	54
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875005481	DC	On-Demand	Anodyne	BIRC2	20	41
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005483	FD	On-Demand	Anodyne	CHRM2	22	42
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005483	FD	On-Demand	Anodyne	CHRM1	19	40
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005483	FD	On-Demand	Anodyne	DRD2	21	52
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005483	FD	On-Demand	Anodyne	DRD4	53	52
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005483	FD	On-Demand	Anodyne	ACHE	36	44
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005483	FD	On-Demand	Anodyne	DRD3	19	52
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005483	FD	On-Demand	Anodyne	CHRM3	33	42
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005483	FD	On-Demand	Anodyne	LTA4H	25	45
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005483	FD	On-Demand	Anodyne	SIGMAR1	64	52
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005483	FD	On-Demand	Anodyne	CCR3	36	45
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005483	FD	On-Demand	Anodyne	UTS2R	23	42
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005483	FD	On-Demand	Anodyne	CCR2	16	42
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005483	FD	On-Demand	Anodyne	SLC6A5	30	43
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005483	FD	On-Demand	Anodyne	EPHX2	23	53
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005483	FD	On-Demand	Anodyne	MCHR1	30	49
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005483	FD	On-Demand	Anodyne	CACNA1G	25	41
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005483	FD	On-Demand	Anodyne	BIRC2	27	41
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005484	FD	On-Demand	Anodyne	CHRM2	22	42
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005484	FD	On-Demand	Anodyne	CHRM1	19	40
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005484	FD	On-Demand	Anodyne	DRD2	21	52
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005484	FD	On-Demand	Anodyne	DRD4	53	52
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005484	FD	On-Demand	Anodyne	ACHE	36	44
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005484	FD	On-Demand	Anodyne	DRD3	19	52
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005484	FD	On-Demand	Anodyne	CHRM3	33	42
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005484	FD	On-Demand	Anodyne	LTA4H	25	45
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005484	FD	On-Demand	Anodyne	SIGMAR1	64	52
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005484	FD	On-Demand	Anodyne	CCR3	36	45
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005484	FD	On-Demand	Anodyne	UTS2R	23	42
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005484	FD	On-Demand	Anodyne	CCR2	16	42
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005484	FD	On-Demand	Anodyne	SLC6A5	30	43
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005484	FD	On-Demand	Anodyne	EPHX2	23	53
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005484	FD	On-Demand	Anodyne	MCHR1	30	49
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005484	FD	On-Demand	Anodyne	CACNA1G	25	41
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875005484	FD	On-Demand	Anodyne	BIRC2	27	41
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005495	EE	On-Demand	Anodyne	CHRM2	21	42
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005495	EE	On-Demand	Anodyne	CHRM1	21	41
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005495	EE	On-Demand	Anodyne	DRD2	27	53
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005495	EE	On-Demand	Anodyne	DRD4	64	53
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005495	EE	On-Demand	Anodyne	ACHE	40	45
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005495	EE	On-Demand	Anodyne	DRD3	20	51
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005495	EE	On-Demand	Anodyne	CHRM3	32	42
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005495	EE	On-Demand	Anodyne	LTA4H	22	45
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005495	EE	On-Demand	Anodyne	SIGMAR1	64	51
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005495	EE	On-Demand	Anodyne	SSTR5	68	37
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005495	EE	On-Demand	Anodyne	CCR3	39	46
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005495	EE	On-Demand	Anodyne	UTS2R	23	43
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005495	EE	On-Demand	Anodyne	MLNR	50	36
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005495	EE	On-Demand	Anodyne	CCR2	15	43
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005495	EE	On-Demand	Anodyne	SLC6A5	18	42
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005495	EE	On-Demand	Anodyne	MCHR1	33	50
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005495	EE	On-Demand	Anodyne	CACNA1G	27	40
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005495	EE	On-Demand	Anodyne	CCR8	15	41
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005495	EE	On-Demand	Anodyne	BIRC2	25	42
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005497	EE	On-Demand	Anodyne	CHRM2	21	42
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005497	EE	On-Demand	Anodyne	CHRM1	21	41
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005497	EE	On-Demand	Anodyne	DRD2	27	53
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005497	EE	On-Demand	Anodyne	DRD4	64	53
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005497	EE	On-Demand	Anodyne	ACHE	40	45
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005497	EE	On-Demand	Anodyne	DRD3	20	51
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005497	EE	On-Demand	Anodyne	CHRM3	32	42
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005497	EE	On-Demand	Anodyne	LTA4H	22	45
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005497	EE	On-Demand	Anodyne	SIGMAR1	64	51
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005497	EE	On-Demand	Anodyne	SSTR5	68	37
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005497	EE	On-Demand	Anodyne	CCR3	39	46
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005497	EE	On-Demand	Anodyne	UTS2R	23	43
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005497	EE	On-Demand	Anodyne	MLNR	50	36
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005497	EE	On-Demand	Anodyne	CCR2	15	43
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005497	EE	On-Demand	Anodyne	SLC6A5	18	42
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005497	EE	On-Demand	Anodyne	MCHR1	33	50
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005497	EE	On-Demand	Anodyne	CACNA1G	27	40
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005497	EE	On-Demand	Anodyne	CCR8	15	41
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005497	EE	On-Demand	Anodyne	BIRC2	25	42
O=C(CCn1cnc2sc3c(c2c1=O)CCCC3)Oc1ccc(Oc2ccccn2)cc1	ZINC000875005499	IJ	On-Demand	Anodyne	HTR1B	18	41
CC[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(C)cc1	ZINC000875005502	DE	On-Demand	Anodyne	CACNA1H	28	42
CC(=O)N1CCC[C@@H]1C(=O)N1CCCSC1=Nc1ccccc1	ZINC000875005508	EF	On-Demand	Mild	PREP	91	37
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005522	EE	On-Demand	Anodyne	CHRM2	25	44
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005522	EE	On-Demand	Anodyne	CHRM1	24	44
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005522	EE	On-Demand	Anodyne	DRD2	27	58
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005522	EE	On-Demand	Anodyne	DRD4	61	58
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005522	EE	On-Demand	Anodyne	ACHE	45	44
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005522	EE	On-Demand	Anodyne	DRD3	21	50
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005522	EE	On-Demand	Anodyne	HTR4	23	44
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005522	EE	On-Demand	Anodyne	CHRM3	34	44
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005522	EE	On-Demand	Anodyne	LTA4H	23	47
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005522	EE	On-Demand	Anodyne	HRH3	21	45
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005522	EE	On-Demand	Anodyne	SIGMAR1	64	54
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005522	EE	On-Demand	Anodyne	CCR3	50	50
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005522	EE	On-Demand	Anodyne	CCR5	39	41
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005522	EE	On-Demand	Anodyne	UTS2R	22	42
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005522	EE	On-Demand	Anodyne	SLC18A3	26	42
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005522	EE	On-Demand	Anodyne	MLNR	54	39
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005522	EE	On-Demand	Anodyne	CCR2	22	46
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005522	EE	On-Demand	Anodyne	EPHX2	40	45
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005522	EE	On-Demand	Anodyne	MCHR1	38	55
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005522	EE	On-Demand	Anodyne	CACNA1G	36	43
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005522	EE	On-Demand	Anodyne	BIRC2	34	48
CC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005523	EE	On-Demand	Anodyne	CHRM2	25	44
CC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005523	EE	On-Demand	Anodyne	CHRM1	24	44
CC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005523	EE	On-Demand	Anodyne	DRD2	27	58
CC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005523	EE	On-Demand	Anodyne	DRD4	61	58
CC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005523	EE	On-Demand	Anodyne	ACHE	45	44
CC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005523	EE	On-Demand	Anodyne	DRD3	21	50
CC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005523	EE	On-Demand	Anodyne	HTR4	23	44
CC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005523	EE	On-Demand	Anodyne	CHRM3	34	44
CC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005523	EE	On-Demand	Anodyne	LTA4H	23	47
CC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005523	EE	On-Demand	Anodyne	HRH3	21	45
CC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005523	EE	On-Demand	Anodyne	SIGMAR1	64	54
CC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005523	EE	On-Demand	Anodyne	CCR3	50	50
CC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005523	EE	On-Demand	Anodyne	CCR5	39	41
CC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005523	EE	On-Demand	Anodyne	UTS2R	22	42
CC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005523	EE	On-Demand	Anodyne	SLC18A3	26	42
CC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005523	EE	On-Demand	Anodyne	MLNR	54	39
CC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005523	EE	On-Demand	Anodyne	CCR2	22	46
CC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005523	EE	On-Demand	Anodyne	EPHX2	40	45
CC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005523	EE	On-Demand	Anodyne	MCHR1	38	55
CC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005523	EE	On-Demand	Anodyne	CACNA1G	36	43
CC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005523	EE	On-Demand	Anodyne	BIRC2	34	48
COC(=O)C1=NO[C@@]2(CCN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)C2)C1	ZINC000875005531	GD	On-Demand	Anodyne	DRD4	32	46
COC(=O)C1=NO[C@@]2(CCN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)C2)C1	ZINC000875005531	GD	On-Demand	Anodyne	SIGMAR1	36	43
COC(=O)C1=NO[C@@]2(CCN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)C2)C1	ZINC000875005531	GD	On-Demand	Anodyne	MCHR1	17	44
COC(=O)C1=NO[C@]2(CCN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)C2)C1	ZINC000875005532	GD	On-Demand	Anodyne	DRD4	32	46
COC(=O)C1=NO[C@]2(CCN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)C2)C1	ZINC000875005532	GD	On-Demand	Anodyne	SIGMAR1	36	43
COC(=O)C1=NO[C@]2(CCN(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)C2)C1	ZINC000875005532	GD	On-Demand	Anodyne	MCHR1	17	44
COC(=O)C1=NO[C@]2(CCN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)C2)C1	ZINC000875005533	GD	On-Demand	Anodyne	DRD4	32	46
COC(=O)C1=NO[C@]2(CCN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)C2)C1	ZINC000875005533	GD	On-Demand	Anodyne	SIGMAR1	36	43
COC(=O)C1=NO[C@]2(CCN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)C2)C1	ZINC000875005533	GD	On-Demand	Anodyne	MCHR1	17	44
COC(=O)C1=NO[C@@]2(CCN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)C2)C1	ZINC000875005534	GD	On-Demand	Anodyne	DRD4	32	46
COC(=O)C1=NO[C@@]2(CCN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)C2)C1	ZINC000875005534	GD	On-Demand	Anodyne	SIGMAR1	36	43
COC(=O)C1=NO[C@@]2(CCN(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)C2)C1	ZINC000875005534	GD	On-Demand	Anodyne	MCHR1	17	44
CCN1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)CC1	ZINC000875005538	CD	On-Demand	Anodyne	EPHX2	18	40
CCN1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)CC1	ZINC000875005539	CD	On-Demand	Anodyne	EPHX2	18	40
CCN1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)CC1	ZINC000875005540	CD	On-Demand	Anodyne	EPHX2	18	40
CCN1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)CC1	ZINC000875005541	CD	On-Demand	Anodyne	EPHX2	18	40
Cn1nnnc1C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005578	FD	On-Demand	Anodyne	DRD2	15	49
Cn1nnnc1C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005578	FD	On-Demand	Anodyne	DRD4	50	49
Cn1nnnc1C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005578	FD	On-Demand	Anodyne	LTA4H	15	43
Cn1nnnc1C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005578	FD	On-Demand	Anodyne	SIGMAR1	35	46
Cn1nnnc1C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005578	FD	On-Demand	Anodyne	CCR3	41	44
Cn1nnnc1C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005578	FD	On-Demand	Anodyne	MLNR	43	36
Cn1nnnc1C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005578	FD	On-Demand	Anodyne	CCR2	21	41
Cn1nnnc1C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005578	FD	On-Demand	Anodyne	EPHX2	20	40
Cn1nnnc1C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005578	FD	On-Demand	Anodyne	MCHR1	28	49
Cn1nnnc1C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005578	FD	On-Demand	Anodyne	BIRC2	25	40
Cn1nnnc1C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005579	FD	On-Demand	Anodyne	DRD2	15	49
Cn1nnnc1C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005579	FD	On-Demand	Anodyne	DRD4	50	49
Cn1nnnc1C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005579	FD	On-Demand	Anodyne	LTA4H	15	43
Cn1nnnc1C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005579	FD	On-Demand	Anodyne	SIGMAR1	35	46
Cn1nnnc1C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005579	FD	On-Demand	Anodyne	CCR3	41	44
Cn1nnnc1C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005579	FD	On-Demand	Anodyne	MLNR	43	36
Cn1nnnc1C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005579	FD	On-Demand	Anodyne	CCR2	21	41
Cn1nnnc1C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005579	FD	On-Demand	Anodyne	EPHX2	20	40
Cn1nnnc1C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005579	FD	On-Demand	Anodyne	MCHR1	28	49
Cn1nnnc1C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005579	FD	On-Demand	Anodyne	BIRC2	25	40
COc1ccc2c(C)c(CCC(=O)Oc3ccc(Oc4ccccn4)cc3)c(=O)oc2c1	ZINC000875005591	IJ	On-Demand	Anodyne	MAOB	50	45
COc1ccc2c(C)c(CCC(=O)Oc3ccc(Oc4ccccn4)cc3)c(=O)oc2c1	ZINC000875005591	IJ	On-Demand	Anodyne	RAF1	18	50
COc1ccc2c(C)c(CCC(=O)Oc3ccc(Oc4ccccn4)cc3)c(=O)oc2c1	ZINC000875005591	IJ	On-Demand	Anodyne	NQO1	40	44
O=CN1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005596	ED	On-Demand	Anodyne	CHRM2	18	45
O=CN1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005596	ED	On-Demand	Anodyne	CHRM1	18	45
O=CN1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005596	ED	On-Demand	Anodyne	DRD2	18	56
O=CN1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005596	ED	On-Demand	Anodyne	DRD4	47	56
O=CN1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005596	ED	On-Demand	Anodyne	ACHE	35	44
O=CN1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005596	ED	On-Demand	Anodyne	SLC6A1	43	32
O=CN1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005596	ED	On-Demand	Anodyne	CHRM3	25	45
O=CN1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005596	ED	On-Demand	Anodyne	LTA4H	18	41
O=CN1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005596	ED	On-Demand	Anodyne	SIGMAR1	52	52
O=CN1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005596	ED	On-Demand	Anodyne	CCR3	41	58
O=CN1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005596	ED	On-Demand	Anodyne	UTS2R	19	41
O=CN1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005596	ED	On-Demand	Anodyne	MLNR	42	38
O=CN1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005596	ED	On-Demand	Anodyne	FAAH	16	40
O=CN1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005596	ED	On-Demand	Anodyne	CCR2	22	45
O=CN1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005596	ED	On-Demand	Anodyne	EPHX2	18	43
O=CN1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005596	ED	On-Demand	Anodyne	MCHR1	29	53
O=CN1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005596	ED	On-Demand	Anodyne	CACNA1G	18	44
O=CN1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005596	ED	On-Demand	Anodyne	BIRC2	27	44
O=CN1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005597	ED	On-Demand	Anodyne	CHRM2	18	45
O=CN1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005597	ED	On-Demand	Anodyne	CHRM1	18	45
O=CN1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005597	ED	On-Demand	Anodyne	DRD2	18	56
O=CN1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005597	ED	On-Demand	Anodyne	DRD4	47	56
O=CN1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005597	ED	On-Demand	Anodyne	ACHE	35	44
O=CN1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005597	ED	On-Demand	Anodyne	SLC6A1	43	32
O=CN1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005597	ED	On-Demand	Anodyne	CHRM3	25	45
O=CN1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005597	ED	On-Demand	Anodyne	LTA4H	18	41
O=CN1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005597	ED	On-Demand	Anodyne	SIGMAR1	52	52
O=CN1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005597	ED	On-Demand	Anodyne	CCR3	41	58
O=CN1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005597	ED	On-Demand	Anodyne	UTS2R	19	41
O=CN1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005597	ED	On-Demand	Anodyne	MLNR	42	38
O=CN1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005597	ED	On-Demand	Anodyne	FAAH	16	40
O=CN1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005597	ED	On-Demand	Anodyne	CCR2	22	45
O=CN1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005597	ED	On-Demand	Anodyne	EPHX2	18	43
O=CN1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005597	ED	On-Demand	Anodyne	MCHR1	29	53
O=CN1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005597	ED	On-Demand	Anodyne	CACNA1G	18	44
O=CN1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875005597	ED	On-Demand	Anodyne	BIRC2	27	44
C[C@@H](CNC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1ccccc1	ZINC000875005613	EG	On-Demand	Anodyne	RBP4	42	34
C[C@@H](CNC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1ccccc1	ZINC000875005613	EG	On-Demand	Anodyne	SFRP1	53	33
C[C@@H](CNC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1ccccc1	ZINC000875005614	EG	On-Demand	Anodyne	RBP4	42	34
C[C@@H](CNC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1ccccc1	ZINC000875005614	EG	On-Demand	Anodyne	SFRP1	53	33
COc1cccc([C@H](CNC(=O)NCc2ncc(Cl)s2)N2CCCC2)c1	ZINC000875005617	GG	On-Demand	Anodyne	DRD4	43	34
CCOC1CC2(C1)C[C@H]2NC(=O)NC[C@H](c1ccccc1Cl)N(C)C	ZINC000875005619	FG	On-Demand	Anodyne	TIMP3	65	33
CCOC1CC2(C1)C[C@@H]2NC(=O)NC[C@H](c1ccccc1Cl)N(C)C	ZINC000875005620	FG	On-Demand	Anodyne	TIMP3	65	33
CCOC1CC2(C1)C[C@@H]2NC(=O)NC[C@@H](c1ccccc1Cl)N(C)C	ZINC000875005621	FG	On-Demand	Anodyne	TIMP3	65	33
CCOC1CC2(C1)C[C@H]2NC(=O)NC[C@@H](c1ccccc1Cl)N(C)C	ZINC000875005622	FG	On-Demand	Anodyne	TIMP3	65	33
COC(=O)C1(O)CN(C(=O)NCCc2ccccc2OC)C1	ZINC000875005671	DC	On-Demand	Anodyne	MBTPS1	49	32
O=C(Oc1ccc(Oc2ccccn2)cc1)C1CCN(c2nc3ccccc3o2)CC1	ZINC000875005692	HJ	On-Demand	Anodyne	FAAH	18	41
O=C(Oc1ccc(Oc2ccccn2)cc1)C1CCN(c2nc3ccccc3o2)CC1	ZINC000875005692	HJ	On-Demand	Anodyne	PTGES	30	42
CCn1c(CNC(=O)C(=O)N[C@@H]2CCO[C@H]2c2ccccc2)nc2ccccc21	ZINC000875005734	GE	On-Demand	Anodyne	PDE6D	46	34
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875005781	FF	On-Demand	Anodyne	CHRM2	19	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875005781	FF	On-Demand	Anodyne	CHRM1	18	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875005781	FF	On-Demand	Anodyne	DRD2	18	54
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875005781	FF	On-Demand	Anodyne	DRD4	48	54
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875005781	FF	On-Demand	Anodyne	ACHE	44	42
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875005781	FF	On-Demand	Anodyne	DRD3	16	47
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875005781	FF	On-Demand	Anodyne	CHRM3	26	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875005781	FF	On-Demand	Anodyne	LTA4H	26	42
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875005781	FF	On-Demand	Anodyne	SIGMAR1	52	50
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875005781	FF	On-Demand	Anodyne	CCR3	50	47
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875005781	FF	On-Demand	Anodyne	UTS2R	20	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875005781	FF	On-Demand	Anodyne	CCR2	17	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875005781	FF	On-Demand	Anodyne	MCHR1	21	51
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875005781	FF	On-Demand	Anodyne	BIRC2	26	45
O=C1CCCCCN1CCCNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875005782	GE	On-Demand	Anodyne	TYRO3	19	42
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875005784	FF	On-Demand	Anodyne	CHRM2	19	41
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875005784	FF	On-Demand	Anodyne	CHRM1	18	41
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875005784	FF	On-Demand	Anodyne	DRD2	18	54
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875005784	FF	On-Demand	Anodyne	DRD4	48	54
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875005784	FF	On-Demand	Anodyne	ACHE	44	42
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875005784	FF	On-Demand	Anodyne	DRD3	16	47
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875005784	FF	On-Demand	Anodyne	CHRM3	26	41
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875005784	FF	On-Demand	Anodyne	LTA4H	26	42
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875005784	FF	On-Demand	Anodyne	SIGMAR1	52	50
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875005784	FF	On-Demand	Anodyne	CCR3	50	47
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875005784	FF	On-Demand	Anodyne	UTS2R	20	41
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875005784	FF	On-Demand	Anodyne	CCR2	17	43
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875005784	FF	On-Demand	Anodyne	MCHR1	21	51
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875005784	FF	On-Demand	Anodyne	BIRC2	26	45
CCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875005798	ED	On-Demand	Anodyne	DRD4	15	45
CCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875005798	ED	On-Demand	Anodyne	SIGMAR1	20	48
CCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875005798	ED	On-Demand	Anodyne	SLC6A5	33	48
CCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875005798	ED	On-Demand	Anodyne	PDK1	41	36
CCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875005798	ED	On-Demand	Anodyne	MCHR1	22	45
CCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875005800	ED	On-Demand	Anodyne	DRD4	15	45
CCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875005800	ED	On-Demand	Anodyne	SIGMAR1	20	48
CCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875005800	ED	On-Demand	Anodyne	SLC6A5	33	48
CCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875005800	ED	On-Demand	Anodyne	PDK1	41	36
CCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875005800	ED	On-Demand	Anodyne	MCHR1	22	45
CC[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccc(C)cc1	ZINC000875005824	FF	On-Demand	Anodyne	L3MBTL3	66	42
O=C(NCCNC(=O)N1Cc2cccc(O)c2C1)C1CC1	ZINC000875005836	CC	On-Demand	Clean	MTNR1A	23	43
O=C(NCCNC(=O)N1Cc2cccc(O)c2C1)C1CC1	ZINC000875005836	CC	On-Demand	Clean	MTNR1B	21	43
CCN1CCC(NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CC1	ZINC000875005847	DC	On-Demand	Anodyne	EPHX2	24	41
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCC2(CCNC2=O)CC1	ZINC000875005854	FD	On-Demand	Anodyne	CHRM2	21	41
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCC2(CCNC2=O)CC1	ZINC000875005854	FD	On-Demand	Anodyne	DRD4	40	51
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCC2(CCNC2=O)CC1	ZINC000875005854	FD	On-Demand	Anodyne	ACHE	35	42
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCC2(CCNC2=O)CC1	ZINC000875005854	FD	On-Demand	Anodyne	GHRHR	57	34
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCC2(CCNC2=O)CC1	ZINC000875005854	FD	On-Demand	Anodyne	CHRM3	27	41
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCC2(CCNC2=O)CC1	ZINC000875005854	FD	On-Demand	Anodyne	SIGMAR1	51	47
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCC2(CCNC2=O)CC1	ZINC000875005854	FD	On-Demand	Anodyne	CCR3	32	45
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCC2(CCNC2=O)CC1	ZINC000875005854	FD	On-Demand	Anodyne	MLNR	43	35
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCC2(CCNC2=O)CC1	ZINC000875005854	FD	On-Demand	Anodyne	CCR2	17	44
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCC2(CCNC2=O)CC1	ZINC000875005854	FD	On-Demand	Anodyne	EPHX2	17	44
O=C(N[C@H]1CCN(Cc2ccccc2)C1)N1CCC2(CCNC2=O)CC1	ZINC000875005854	FD	On-Demand	Anodyne	MCHR1	24	48
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCC2(CCNC2=O)CC1	ZINC000875005855	FD	On-Demand	Anodyne	CHRM2	21	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCC2(CCNC2=O)CC1	ZINC000875005855	FD	On-Demand	Anodyne	DRD4	40	51
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCC2(CCNC2=O)CC1	ZINC000875005855	FD	On-Demand	Anodyne	ACHE	35	42
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCC2(CCNC2=O)CC1	ZINC000875005855	FD	On-Demand	Anodyne	GHRHR	57	34
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCC2(CCNC2=O)CC1	ZINC000875005855	FD	On-Demand	Anodyne	CHRM3	27	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCC2(CCNC2=O)CC1	ZINC000875005855	FD	On-Demand	Anodyne	SIGMAR1	51	47
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCC2(CCNC2=O)CC1	ZINC000875005855	FD	On-Demand	Anodyne	CCR3	32	45
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCC2(CCNC2=O)CC1	ZINC000875005855	FD	On-Demand	Anodyne	MLNR	43	35
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCC2(CCNC2=O)CC1	ZINC000875005855	FD	On-Demand	Anodyne	CCR2	17	44
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCC2(CCNC2=O)CC1	ZINC000875005855	FD	On-Demand	Anodyne	EPHX2	17	44
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N1CCC2(CCNC2=O)CC1	ZINC000875005855	FD	On-Demand	Anodyne	MCHR1	24	48
CC[C@@H](NC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)c1ccc(C)cc1	ZINC000875005857	FG	On-Demand	Anodyne	ETHR	57	36
CC[C@@H](NC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)c1ccc(C)cc1	ZINC000875005859	FG	On-Demand	Anodyne	ETHR	57	36
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCn2cnc3ccccc32)C1	ZINC000875005863	FD	On-Demand	Anodyne	HPGD	18	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCn2cnc3ccccc32)C1	ZINC000875005864	FD	On-Demand	Anodyne	HPGD	18	43
CCN1CCC(NC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875005865	EF	On-Demand	Anodyne	SIGMAR1	19	41
CCN1CCC(NC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875005866	EF	On-Demand	Anodyne	SIGMAR1	19	41
CCN1CCC(NC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875005867	EF	On-Demand	Anodyne	SIGMAR1	19	41
CCN1CCC(NC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875005868	EF	On-Demand	Anodyne	SIGMAR1	19	41
CCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(Cl)cc2)CC1	ZINC000875005877	FE	On-Demand	Anodyne	DRD4	18	41
CCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(Cl)cc2)CC1	ZINC000875005877	FE	On-Demand	Anodyne	SIGMAR1	18	46
CCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(Cl)cc2)CC1	ZINC000875005877	FE	On-Demand	Anodyne	SLC6A5	27	42
CCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(Cl)cc2)CC1	ZINC000875005877	FE	On-Demand	Anodyne	EPHX2	25	44
CCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(Cl)cc2)CC1	ZINC000875005877	FE	On-Demand	Anodyne	MCHR1	24	43
CCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(Cl)cc2)CC1	ZINC000875005878	FE	On-Demand	Anodyne	DRD4	18	41
CCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(Cl)cc2)CC1	ZINC000875005878	FE	On-Demand	Anodyne	SIGMAR1	18	46
CCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(Cl)cc2)CC1	ZINC000875005878	FE	On-Demand	Anodyne	SLC6A5	27	42
CCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(Cl)cc2)CC1	ZINC000875005878	FE	On-Demand	Anodyne	EPHX2	25	44
CCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(Cl)cc2)CC1	ZINC000875005878	FE	On-Demand	Anodyne	MCHR1	24	43
CCN1CCC(NC(=O)N2CCC[C@H](c3ccccc3OC)CC2)CC1	ZINC000875005896	FG	On-Demand	Anodyne	HTR1A	22	41
CCN1CCC(NC(=O)N2CCC[C@H](c3ccccc3OC)CC2)CC1	ZINC000875005896	FG	On-Demand	Anodyne	DRD2	31	52
CCN1CCC(NC(=O)N2CCC[C@H](c3ccccc3OC)CC2)CC1	ZINC000875005896	FG	On-Demand	Anodyne	DRD4	25	48
CCN1CCC(NC(=O)N2CCC[C@H](c3ccccc3OC)CC2)CC1	ZINC000875005896	FG	On-Demand	Anodyne	HTR4	29	42
CCN1CCC(NC(=O)N2CCC[C@H](c3ccccc3OC)CC2)CC1	ZINC000875005896	FG	On-Demand	Anodyne	SIGMAR1	21	41
CCN1CCC(NC(=O)N2CCC[C@H](c3ccccc3OC)CC2)CC1	ZINC000875005896	FG	On-Demand	Anodyne	SSTR5	43	39
CCN1CCC(NC(=O)N2CCC[C@H](c3ccccc3OC)CC2)CC1	ZINC000875005896	FG	On-Demand	Anodyne	CCR3	22	41
CCN1CCC(NC(=O)N2CCC[C@H](c3ccccc3OC)CC2)CC1	ZINC000875005896	FG	On-Demand	Anodyne	RBP4	31	42
CCN1CCC(NC(=O)N2CCC[C@H](c3ccccc3OC)CC2)CC1	ZINC000875005896	FG	On-Demand	Anodyne	MCHR1	16	42
CCN1CCC(NC(=O)N2CCC[C@@H](c3ccccc3OC)CC2)CC1	ZINC000875005897	FG	On-Demand	Anodyne	HTR1A	22	41
CCN1CCC(NC(=O)N2CCC[C@@H](c3ccccc3OC)CC2)CC1	ZINC000875005897	FG	On-Demand	Anodyne	DRD2	31	52
CCN1CCC(NC(=O)N2CCC[C@@H](c3ccccc3OC)CC2)CC1	ZINC000875005897	FG	On-Demand	Anodyne	DRD4	25	48
CCN1CCC(NC(=O)N2CCC[C@@H](c3ccccc3OC)CC2)CC1	ZINC000875005897	FG	On-Demand	Anodyne	HTR4	29	42
CCN1CCC(NC(=O)N2CCC[C@@H](c3ccccc3OC)CC2)CC1	ZINC000875005897	FG	On-Demand	Anodyne	SIGMAR1	21	41
CCN1CCC(NC(=O)N2CCC[C@@H](c3ccccc3OC)CC2)CC1	ZINC000875005897	FG	On-Demand	Anodyne	SSTR5	43	39
CCN1CCC(NC(=O)N2CCC[C@@H](c3ccccc3OC)CC2)CC1	ZINC000875005897	FG	On-Demand	Anodyne	CCR3	22	41
CCN1CCC(NC(=O)N2CCC[C@@H](c3ccccc3OC)CC2)CC1	ZINC000875005897	FG	On-Demand	Anodyne	RBP4	31	42
CCN1CCC(NC(=O)N2CCC[C@@H](c3ccccc3OC)CC2)CC1	ZINC000875005897	FG	On-Demand	Anodyne	MCHR1	16	42
CCN1CCC(NC(=O)NNc2ccc(OC)cc2Br)CC1	ZINC000875005912	FF	On-Demand	Reactive	HTR4	20	42
CCN1CCC(NC(=O)NNc2ccc(OC)cc2Br)CC1	ZINC000875005912	FF	On-Demand	Reactive	SIGMAR1	22	40
CCN1CCC(NC(=O)NNc2ccc(OC)cc2Br)CC1	ZINC000875005912	FF	On-Demand	Reactive	SLC6A5	32	47
CCN1CCC(NC(=O)NNc2ccc(OC)cc2Br)CC1	ZINC000875005912	FF	On-Demand	Reactive	EPHX2	33	45
CCN1CCC(NC(=O)NNc2ccc(OC)cc2Br)CC1	ZINC000875005912	FF	On-Demand	Reactive	PDK1	42	35
CCN1CCC(NC(=O)NNc2ccc(OC)cc2Br)CC1	ZINC000875005912	FF	On-Demand	Reactive	MCHR1	18	45
CCN1CCC(NC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875005913	FF	On-Demand	Mild	MCHR1	49	49
CCN1CCC(NC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875005914	FF	On-Demand	Mild	MCHR1	49	49
O=C(CCc1cccc(Cl)c1)Oc1ccc(Oc2ccccn2)cc1	ZINC000875005917	FK	On-Demand	Anodyne	FAAH	18	42
CN(C)[C@@H](CNC(=O)N1CCC2(CCNC2=O)CC1)c1ccccc1Cl	ZINC000875005954	GE	On-Demand	Anodyne	CACNA1H	44	35
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)c1ccccc1	ZINC000875005957	DF	On-Demand	Anodyne	SLC6A4	31	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)c1ccccc1	ZINC000875005957	DF	On-Demand	Anodyne	SLC6A3	76	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)c1ccccc1	ZINC000875005958	DF	On-Demand	Anodyne	SLC6A4	31	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)c1ccccc1	ZINC000875005958	DF	On-Demand	Anodyne	SLC6A3	76	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)c1ccccc1	ZINC000875005959	DF	On-Demand	Anodyne	SLC6A4	31	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)c1ccccc1	ZINC000875005959	DF	On-Demand	Anodyne	SLC6A3	76	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)c1ccccc1	ZINC000875005960	DF	On-Demand	Anodyne	SLC6A4	31	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)c1ccccc1	ZINC000875005960	DF	On-Demand	Anodyne	SLC6A3	76	45
O=CN1CCCN(C(=O)N[C@H](c2ccccc2)c2ccccn2)CC1	ZINC000875005970	EE	On-Demand	Anodyne	PTAFR	23	46
O=CN1CCCN(C(=O)N[C@@H](c2ccccc2)c2ccccn2)CC1	ZINC000875005971	EE	On-Demand	Anodyne	PTAFR	23	46
COc1cccc([C@H](CNC(=O)N[C@H]2CC23CCC3)N2CCCC2)c1	ZINC000875005974	EG	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@H](CNC(=O)N[C@@H]2CC23CCC3)N2CCCC2)c1	ZINC000875005975	EG	On-Demand	Anodyne	DRD4	41	32
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005979	FE	On-Demand	Anodyne	CHRM2	24	49
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005979	FE	On-Demand	Anodyne	CHRM1	31	44
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005979	FE	On-Demand	Anodyne	ACE	38	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005979	FE	On-Demand	Anodyne	DRD2	25	52
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005979	FE	On-Demand	Anodyne	DRD4	54	52
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005979	FE	On-Demand	Anodyne	ACHE	36	44
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005979	FE	On-Demand	Anodyne	DRD3	16	50
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005979	FE	On-Demand	Anodyne	HTR4	27	44
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005979	FE	On-Demand	Anodyne	CHRM3	33	49
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005979	FE	On-Demand	Anodyne	LTA4H	20	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005979	FE	On-Demand	Anodyne	SIGMAR1	47	48
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005979	FE	On-Demand	Anodyne	SSTR5	59	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005979	FE	On-Demand	Anodyne	CCR3	39	45
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005979	FE	On-Demand	Anodyne	CCR5	54	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005979	FE	On-Demand	Anodyne	UTS2R	22	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005979	FE	On-Demand	Anodyne	CCR2	19	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005979	FE	On-Demand	Anodyne	EPHX2	20	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005979	FE	On-Demand	Anodyne	MCHR1	38	49
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005979	FE	On-Demand	Anodyne	BIRC2	46	48
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005981	FE	On-Demand	Anodyne	CHRM2	24	49
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005981	FE	On-Demand	Anodyne	CHRM1	31	44
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005981	FE	On-Demand	Anodyne	ACE	38	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005981	FE	On-Demand	Anodyne	DRD2	25	52
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005981	FE	On-Demand	Anodyne	DRD4	54	52
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005981	FE	On-Demand	Anodyne	ACHE	36	44
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005981	FE	On-Demand	Anodyne	DRD3	16	50
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005981	FE	On-Demand	Anodyne	HTR4	27	44
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005981	FE	On-Demand	Anodyne	CHRM3	33	49
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005981	FE	On-Demand	Anodyne	LTA4H	20	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005981	FE	On-Demand	Anodyne	SIGMAR1	47	48
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005981	FE	On-Demand	Anodyne	SSTR5	59	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005981	FE	On-Demand	Anodyne	CCR3	39	45
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005981	FE	On-Demand	Anodyne	CCR5	54	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005981	FE	On-Demand	Anodyne	UTS2R	22	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005981	FE	On-Demand	Anodyne	CCR2	19	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005981	FE	On-Demand	Anodyne	EPHX2	20	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005981	FE	On-Demand	Anodyne	MCHR1	38	49
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875005981	FE	On-Demand	Anodyne	BIRC2	46	48
CCCCCCCNC(=O)C(=O)NCc1ccc(N(C)C)cc1	ZINC000875006000	DE	On-Demand	Mild	S1PR2	61	41
CCCCCCCNC(=O)C(=O)NCc1ccc(N(C)C)cc1	ZINC000875006000	DE	On-Demand	Mild	ASAH1	92	37
COc1cccc([C@H](CNC(=O)N2CCCN(C=O)CC2)N2CCCC2)c1	ZINC000875006003	FD	On-Demand	Anodyne	DRD4	42	34
N#Cc1cccc([C@H](NC(=O)NCCCN2CCCCCC2=O)C(F)(F)F)c1	ZINC000875006012	GG	On-Demand	Mild	CCR3	24	43
N#Cc1cccc([C@H](NC(=O)NCCCN2CCCCCC2=O)C(F)(F)F)c1	ZINC000875006012	GG	On-Demand	Mild	MCHR1	21	40
N#Cc1cccc([C@@H](NC(=O)NCCCN2CCCCCC2=O)C(F)(F)F)c1	ZINC000875006013	GG	On-Demand	Mild	CCR3	24	43
N#Cc1cccc([C@@H](NC(=O)NCCCN2CCCCCC2=O)C(F)(F)F)c1	ZINC000875006013	GG	On-Demand	Mild	MCHR1	21	40
COCC1CC(NC(=O)NC[C@H](c2cccc(OC)c2)N2CCCC2)C1	ZINC000875006018	FF	On-Demand	Anodyne	DRD4	41	32
COCC1CC(NC(=O)NC[C@H](c2cccc(OC)c2)N2CCCC2)C1	ZINC000875006018	FF	On-Demand	Anodyne	MTNR1A	44	39
COCC1CC(NC(=O)NC[C@H](c2cccc(OC)c2)N2CCCC2)C1	ZINC000875006018	FF	On-Demand	Anodyne	MTNR1B	43	39
COCC1CC(NC(=O)NC[C@@H](c2cccc(OC)c2)N2CCCC2)C1	ZINC000875006020	FF	On-Demand	Anodyne	DRD4	41	32
COCC1CC(NC(=O)NC[C@@H](c2cccc(OC)c2)N2CCCC2)C1	ZINC000875006020	FF	On-Demand	Anodyne	MTNR1A	44	39
COCC1CC(NC(=O)NC[C@@H](c2cccc(OC)c2)N2CCCC2)C1	ZINC000875006020	FF	On-Demand	Anodyne	MTNR1B	43	39
COc1cccc([C@H](CNC(=O)NNc2nnc(C)n2C)N2CCCC2)c1	ZINC000875006038	FD	On-Demand	Reactive	DRD4	42	32
CCn1c(CNC(=O)C(=O)N2CC[C@H]3CSC[C@@H]3C2)nc2ccccc21	ZINC000875006042	FD	On-Demand	Anodyne	PDE6D	50	33
CCn1c(CNC(=O)C(=O)N2CC[C@@H]3CSC[C@@H]3C2)nc2ccccc21	ZINC000875006043	FD	On-Demand	Anodyne	PDE6D	50	33
CCn1c(CNC(=O)C(=O)N2CC[C@H]3CSC[C@H]3C2)nc2ccccc21	ZINC000875006044	FD	On-Demand	Anodyne	PDE6D	50	33
CCn1c(CNC(=O)C(=O)N2CC[C@@H]3CSC[C@H]3C2)nc2ccccc21	ZINC000875006047	FD	On-Demand	Anodyne	PDE6D	50	33
O=C(NCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)C1CC1	ZINC000875006081	ED	On-Demand	Anodyne	FKBP1A	25	42
O=C(NCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)C1CC1	ZINC000875006081	ED	On-Demand	Anodyne	TRY1_BOVIN	40	36
O=C(NCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)C1CC1	ZINC000875006082	ED	On-Demand	Anodyne	FKBP1A	25	42
O=C(NCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)C1CC1	ZINC000875006082	ED	On-Demand	Anodyne	TRY1_BOVIN	40	36
O=C(NCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)C1CC1	ZINC000875006083	ED	On-Demand	Anodyne	FKBP1A	25	42
O=C(NCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)C1CC1	ZINC000875006083	ED	On-Demand	Anodyne	TRY1_BOVIN	40	36
O=C(NCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)C1CC1	ZINC000875006084	ED	On-Demand	Anodyne	FKBP1A	25	42
O=C(NCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)C1CC1	ZINC000875006084	ED	On-Demand	Anodyne	TRY1_BOVIN	40	36
CCn1c(CNC(=O)C(=O)NC[C@@H]2CCN2C2CCCC2)nc2ccccc21	ZINC000875006088	GD	On-Demand	Anodyne	PDE6D	55	35
CCn1c(CNC(=O)C(=O)NC[C@@H]2CCN2C2CCCC2)nc2ccccc21	ZINC000875006088	GD	On-Demand	Anodyne	SMO	34	41
CCn1c(CNC(=O)C(=O)NC[C@H]2CCN2C2CCCC2)nc2ccccc21	ZINC000875006089	GD	On-Demand	Anodyne	PDE6D	55	35
CCn1c(CNC(=O)C(=O)NC[C@H]2CCN2C2CCCC2)nc2ccccc21	ZINC000875006089	GD	On-Demand	Anodyne	SMO	34	41
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1ccc(CN2CCOCC2)cc1	ZINC000875006098	GC	On-Demand	Mild	DPOL_VZVD	23	40
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1ccc(CN2CCOCC2)cc1	ZINC000875006099	GC	On-Demand	Mild	DPOL_VZVD	23	40
CCOC1CC2(C1)C[C@H]2C(=O)N1CCSC1=Nc1ccccc1OC	ZINC000875006114	FG	On-Demand	Mild	TIMP3	54	31
O=C(NCCCN1CCCCCC1=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875006117	GE	On-Demand	Anodyne	HRH2	29	45
O=C(NCCCN1CCCCCC1=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875006117	GE	On-Demand	Anodyne	PTGER4	23	43
O=C(NCCCN1CCCCCC1=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875006117	GE	On-Demand	Anodyne	DPP7	15	42
O=C(NCCCN1CCCCCC1=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875006117	GE	On-Demand	Anodyne	TYRO3	20	48
O=C(NCCCN1CCCCCC1=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875006118	GE	On-Demand	Anodyne	HRH2	29	45
O=C(NCCCN1CCCCCC1=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875006118	GE	On-Demand	Anodyne	PTGER4	23	43
O=C(NCCCN1CCCCCC1=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875006118	GE	On-Demand	Anodyne	DPP7	15	42
O=C(NCCCN1CCCCCC1=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875006118	GE	On-Demand	Anodyne	TYRO3	20	48
Cc1ccnn1CC(=O)Nc1sc2c(c1C(N)=O)CCCCC2	ZINC000875006119	EE	On-Demand	Anodyne	VIPR1	25	41
COc1ccccc1[C@H]1CCCN(C(=O)NCCNC(=O)C2CC2)CC1	ZINC000875006132	FF	On-Demand	Anodyne	HTR1A	23	48
COc1ccccc1[C@H]1CCCN(C(=O)NCCNC(=O)C2CC2)CC1	ZINC000875006132	FF	On-Demand	Anodyne	DRD2	25	47
COc1ccccc1[C@H]1CCCN(C(=O)NCCNC(=O)C2CC2)CC1	ZINC000875006132	FF	On-Demand	Anodyne	DRD4	17	45
COc1ccccc1[C@H]1CCCN(C(=O)NCCNC(=O)C2CC2)CC1	ZINC000875006132	FF	On-Demand	Anodyne	DRD3	24	45
COc1ccccc1[C@H]1CCCN(C(=O)NCCNC(=O)C2CC2)CC1	ZINC000875006132	FF	On-Demand	Anodyne	MTNR1A	27	41
COc1ccccc1[C@H]1CCCN(C(=O)NCCNC(=O)C2CC2)CC1	ZINC000875006132	FF	On-Demand	Anodyne	MTNR1B	34	41
COc1ccccc1[C@H]1CCCN(C(=O)NCCNC(=O)C2CC2)CC1	ZINC000875006132	FF	On-Demand	Anodyne	EPHX2	20	41
COc1ccccc1[C@H]1CCCN(C(=O)NCCNC(=O)C2CC2)CC1	ZINC000875006132	FF	On-Demand	Anodyne	RBP4	34	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCCNC(=O)C2CC2)CC1	ZINC000875006133	FF	On-Demand	Anodyne	HTR1A	23	48
COc1ccccc1[C@@H]1CCCN(C(=O)NCCNC(=O)C2CC2)CC1	ZINC000875006133	FF	On-Demand	Anodyne	DRD2	25	47
COc1ccccc1[C@@H]1CCCN(C(=O)NCCNC(=O)C2CC2)CC1	ZINC000875006133	FF	On-Demand	Anodyne	DRD4	17	45
COc1ccccc1[C@@H]1CCCN(C(=O)NCCNC(=O)C2CC2)CC1	ZINC000875006133	FF	On-Demand	Anodyne	DRD3	24	45
COc1ccccc1[C@@H]1CCCN(C(=O)NCCNC(=O)C2CC2)CC1	ZINC000875006133	FF	On-Demand	Anodyne	MTNR1A	27	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCCNC(=O)C2CC2)CC1	ZINC000875006133	FF	On-Demand	Anodyne	MTNR1B	34	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCCNC(=O)C2CC2)CC1	ZINC000875006133	FF	On-Demand	Anodyne	EPHX2	20	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCCNC(=O)C2CC2)CC1	ZINC000875006133	FF	On-Demand	Anodyne	RBP4	34	41
CCn1c(CNC(=O)C(=O)NC[C@H]2CCCN2CC(F)F)nc2ccccc21	ZINC000875006137	GD	On-Demand	Anodyne	SMO	31	47
CCn1c(CNC(=O)C(=O)NC[C@@H]2CCCN2CC(F)F)nc2ccccc21	ZINC000875006138	GD	On-Demand	Anodyne	SMO	31	47
CONC(=O)C1CCN(C(=O)NC[C@@H](c2ccccc2Cl)N(C)C)CC1	ZINC000875006148	GE	On-Demand	Anodyne	OPRL1	28	42
CONC(=O)C1CCN(C(=O)NC[C@@H](c2ccccc2Cl)N(C)C)CC1	ZINC000875006148	GE	On-Demand	Anodyne	AMY2	44	30
CONC(=O)C1CCN(C(=O)NC[C@@H](c2ccccc2Cl)N(C)C)CC1	ZINC000875006148	GE	On-Demand	Anodyne	EPHX2	25	42
CONC(=O)C1CCN(C(=O)NC[C@H](c2ccccc2Cl)N(C)C)CC1	ZINC000875006149	GE	On-Demand	Anodyne	OPRL1	28	42
CONC(=O)C1CCN(C(=O)NC[C@H](c2ccccc2Cl)N(C)C)CC1	ZINC000875006149	GE	On-Demand	Anodyne	AMY2	44	30
CONC(=O)C1CCN(C(=O)NC[C@H](c2ccccc2Cl)N(C)C)CC1	ZINC000875006149	GE	On-Demand	Anodyne	EPHX2	25	42
O=C(N[C@H](c1ccccc1)c1ccccn1)N1CCC(CO)(CO)CC1	ZINC000875006150	FD	On-Demand	Anodyne	PTAFR	18	44
O=C(N[C@@H](c1ccccc1)c1ccccn1)N1CCC(CO)(CO)CC1	ZINC000875006151	FD	On-Demand	Anodyne	PTAFR	18	44
COC(=O)C1(O)CN(C(=O)NC[C@@H](c2cccc(OC)c2)N2CCCC2)C1	ZINC000875006154	GC	On-Demand	Anodyne	DRD4	42	32
COC(=O)C1(O)CN(C(=O)NC[C@H](c2cccc(OC)c2)N2CCCC2)C1	ZINC000875006155	GC	On-Demand	Anodyne	DRD4	42	32
COc1cccc([C@H](CNC(=O)N[C@H](C)c2ccnn2C)N2CCCC2)c1	ZINC000875006156	FF	On-Demand	Anodyne	DRD4	42	32
COc1cccc([C@H](CNC(=O)N[C@@H](C)c2ccnn2C)N2CCCC2)c1	ZINC000875006159	FF	On-Demand	Anodyne	DRD4	42	32
C[C@@H](CNC(=O)N[C@H]1CCN(CC(C)(C)O)C1)c1ccccc1	ZINC000875006160	DD	On-Demand	Anodyne	CCR5	18	41
C[C@@H](CNC(=O)N[C@H]1CCN(CC(C)(C)O)C1)c1ccccc1	ZINC000875006160	DD	On-Demand	Anodyne	BIRC2	44	38
COc1cccc([C@H](CNC(=O)NC2CC(C(N)=O)C2)N2CCCC2)c1	ZINC000875006165	FD	On-Demand	Anodyne	DRD4	42	32
COc1cccc([C@H](CNC(=O)NC2CC(C(N)=O)C2)N2CCCC2)c1	ZINC000875006165	FD	On-Demand	Anodyne	MTNR1A	50	40
COc1cccc([C@H](CNC(=O)NC2CC(C(N)=O)C2)N2CCCC2)c1	ZINC000875006165	FD	On-Demand	Anodyne	MTNR1B	53	40
O=C(NCCO)C1CCN(C(=O)N[C@@H](c2ccccc2)c2ccccn2)CC1	ZINC000875006174	GD	On-Demand	Anodyne	EPHX2	18	40
O=C(NCCO)C1CCN(C(=O)N[C@H](c2ccccc2)c2ccccn2)CC1	ZINC000875006175	GD	On-Demand	Anodyne	EPHX2	18	40
COc1cccc([C@H](CNC(=O)N2CC[C@H]3[C@H](CCN3C)C2)N2CCCC2)c1	ZINC000875006184	GF	On-Demand	Anodyne	DRD4	45	36
COc1cccc([C@H](CNC(=O)N2CC[C@H]3[C@@H](CCN3C)C2)N2CCCC2)c1	ZINC000875006185	GF	On-Demand	Anodyne	DRD4	45	36
COc1cccc([C@H](CNC(=O)N2CC[C@@H]3[C@H](CCN3C)C2)N2CCCC2)c1	ZINC000875006186	GF	On-Demand	Anodyne	DRD4	45	36
COc1cccc([C@H](CNC(=O)N2CC[C@@H]3[C@@H](CCN3C)C2)N2CCCC2)c1	ZINC000875006187	GF	On-Demand	Anodyne	DRD4	45	36
COc1cccc([C@H](CNC(=O)NC2(C)CC(F)(F)C2)N2CCCC2)c1	ZINC000875006204	FG	On-Demand	Anodyne	DRD4	44	34
COc1cccc([C@H](CNC(=O)NC2(C)CC(F)(F)C2)N2CCCC2)c1	ZINC000875006204	FG	On-Demand	Anodyne	MTNR1A	33	41
COc1cccc([C@H](CNC(=O)NC2(C)CC(F)(F)C2)N2CCCC2)c1	ZINC000875006204	FG	On-Demand	Anodyne	MTNR1B	33	41
CN(C)[C@@H](CNC(=O)N1CCC(c2nnnn2C)CC1)c1ccccc1Cl	ZINC000875006212	GE	On-Demand	Anodyne	IL2RA	41	37
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2ccccc2OC)C1	ZINC000875006216	EE	On-Demand	Anodyne	MBTPS1	53	34
CC[C@@H](NC(=O)NCCNC(=O)C1CC1)[C@@H](O)c1ccccc1	ZINC000875006226	DD	On-Demand	Anodyne	CCR5	18	40
CC[C@@H](NC(=O)NCCNC(=O)C1CC1)[C@@H](O)c1ccccc1	ZINC000875006226	DD	On-Demand	Anodyne	XIAP	46	35
CC[C@@H](NC(=O)NCCNC(=O)C1CC1)[C@H](O)c1ccccc1	ZINC000875006230	DD	On-Demand	Anodyne	CCR5	18	40
CC[C@@H](NC(=O)NCCNC(=O)C1CC1)[C@H](O)c1ccccc1	ZINC000875006230	DD	On-Demand	Anodyne	XIAP	46	35
CCn1c(CNC(=O)C(=O)N2CC[C@H](c3nc(C)cs3)C2)nc2ccccc21	ZINC000875006238	GE	On-Demand	Anodyne	PDE6D	50	33
CCn1c(CNC(=O)C(=O)N2CC[C@@H](c3nc(C)cs3)C2)nc2ccccc21	ZINC000875006239	GE	On-Demand	Anodyne	PDE6D	50	33
CC[C@@H]1COCCN1CCNC(=O)NCCc1ccccc1OC	ZINC000875006244	ED	On-Demand	Anodyne	DRD2	29	42
CC[C@@H]1COCCN1CCNC(=O)NCCc1ccccc1OC	ZINC000875006244	ED	On-Demand	Anodyne	MBTPS1	49	32
O=C1CCCCCN1CCCNC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875006271	FE	On-Demand	Anodyne	TYRO3	19	42
CCn1c(CNC(=O)C(=O)NC[C@@H]2COCCN2C)nc2ccccc21	ZINC000875006277	FC	On-Demand	Anodyne	SMO	23	44
CCn1c(CNC(=O)C(=O)NC[C@H]2COCCN2C)nc2ccccc21	ZINC000875006279	FC	On-Demand	Anodyne	SMO	23	44
NC(=O)c1cccc(NC(=O)N2C[C@@H]3C[C@H]2CN3c2ccccc2)c1	ZINC000875006297	EE	On-Demand	Anodyne	KCNK3	46	34
O=C(NCCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1)C1CC1	ZINC000875006298	ED	On-Demand	Anodyne	FKBP1A	34	44
O=C(NCCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1)C1CC1	ZINC000875006299	ED	On-Demand	Anodyne	FKBP1A	34	44
O=C(NCCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1)C1CC1	ZINC000875006300	ED	On-Demand	Anodyne	FKBP1A	34	44
O=C(NCCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1)C1CC1	ZINC000875006301	ED	On-Demand	Anodyne	FKBP1A	34	44
O=C(NCCNC(=O)C1CC1)NC1CC(Nc2ccccc2)C1	ZINC000875006302	DD	On-Demand	Anodyne	EPHX2	19	45
O=C(NCCNC(=O)N1CCC[C@@](O)(c2ccccc2)C1)C1CC1	ZINC000875006313	ED	On-Demand	Anodyne	EPHX2	20	47
COC(=O)c1ccc(OC)c2c1CCN(C(=O)NCCNC(=O)C1CC1)C2	ZINC000875006322	GD	On-Demand	Anodyne	MTNR1A	26	47
COC(=O)c1ccc(OC)c2c1CCN(C(=O)NCCNC(=O)C1CC1)C2	ZINC000875006322	GD	On-Demand	Anodyne	MTNR1B	24	47
N#Cc1ccc(-c2csc(NC(=O)C3(F)CCOCC3)n2)cc1	ZINC000875006330	EG	On-Demand	Mild	MAOB	17	51
COc1cccc([C@H](CNC(=O)NC[C@H]2C[C@H](O)C2)N2CCCC2)c1	ZINC000875006345	ED	On-Demand	Anodyne	DRD4	43	33
COc1cccc([C@H](CNC(=O)NC[C@H]2C[C@H](O)C2)N2CCCC2)c1	ZINC000875006345	ED	On-Demand	Anodyne	CCR3	16	41
COc1cccc([C@H](CNC(=O)NC[C@H]2C[C@H](O)C2)N2CCCC2)c1	ZINC000875006345	ED	On-Demand	Anodyne	MTNR1A	39	40
COc1cccc([C@H](CNC(=O)NC[C@H]2C[C@H](O)C2)N2CCCC2)c1	ZINC000875006345	ED	On-Demand	Anodyne	MTNR1B	38	40
COc1ccc([C@@H]2CN(C(=O)C(=O)NCc3ccc(N(C)C)cc3)CCO2)cc1	ZINC000875006349	GD	On-Demand	Clean	NOS2	42	35
CN1CCN(C2CCN(C(=O)C(=O)NCc3ccc(N(C)C)cc3)CC2)CC1	ZINC000875006358	GC	On-Demand	Clean	L3MBTL3	72	41
O=C(N[C@H](c1ccccc1)c1ccccn1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875006374	GI	On-Demand	Anodyne	EPHX2	19	42
O=C(N[C@@H](c1ccccc1)c1ccccn1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875006375	GI	On-Demand	Anodyne	EPHX2	19	42
O=C(N[C@H](c1ccccc1)c1ccccn1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875006376	GI	On-Demand	Anodyne	EPHX2	19	42
O=C(N[C@@H](c1ccccc1)c1ccccn1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875006377	GI	On-Demand	Anodyne	EPHX2	19	42
COc1cccc([C@H](CNC(=O)NCCC[C@@H]2CCOC2=O)N2CCCC2)c1	ZINC000875006397	GE	On-Demand	Anodyne	DRD4	40	31
COc1cccc([C@H](CNC(=O)NCCC[C@H]2CCOC2=O)N2CCCC2)c1	ZINC000875006398	GE	On-Demand	Anodyne	DRD4	40	31
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)c1ccccn1	ZINC000875006420	FF	On-Demand	Anodyne	SLC6A4	19	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)c1ccccn1	ZINC000875006420	FF	On-Demand	Anodyne	SLC6A3	45	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)c1ccccn1	ZINC000875006421	FF	On-Demand	Anodyne	SLC6A4	19	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)c1ccccn1	ZINC000875006421	FF	On-Demand	Anodyne	SLC6A3	45	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)c1ccccn1	ZINC000875006422	FF	On-Demand	Anodyne	SLC6A4	19	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)c1ccccn1	ZINC000875006422	FF	On-Demand	Anodyne	SLC6A3	45	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)c1ccccn1	ZINC000875006423	FF	On-Demand	Anodyne	SLC6A4	19	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)c1ccccn1	ZINC000875006423	FF	On-Demand	Anodyne	SLC6A3	45	44
CCn1c(CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)nc2ccccc21	ZINC000875006429	FD	On-Demand	Anodyne	PIK3CD	16	43
CCn1c(CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)nc2ccccc21	ZINC000875006434	FD	On-Demand	Anodyne	PIK3CD	16	43
COc1cc(CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc(OC)c1OC	ZINC000875006454	GD	On-Demand	Anodyne	DRD2	40	37
COc1cc(CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc(OC)c1OC	ZINC000875006454	GD	On-Demand	Anodyne	ACKR3	42	36
COc1cccc([C@H](CNC(=O)NCc2ccnc(F)c2)N2CCCC2)c1	ZINC000875006455	FF	On-Demand	Anodyne	ROCK2	28	40
COc1cc(CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc(OC)c1OC	ZINC000875006456	GD	On-Demand	Anodyne	DRD2	40	37
COc1cc(CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc(OC)c1OC	ZINC000875006456	GD	On-Demand	Anodyne	ACKR3	42	36
COc1cc(CNC(=O)C(=O)N2CCC(C(C)=O)CC2)cc(OC)c1OC	ZINC000875006464	GD	On-Demand	Anodyne	ACKR3	40	34
O=C(NCCNC(=O)C1CC1)NNc1ccc(OCc2ccccc2)cc1	ZINC000875006479	FE	On-Demand	Reactive	LTA4H	40	47
O=C(NCCNC(=O)C1CC1)NNc1ccc(OCc2ccccc2)cc1	ZINC000875006479	FE	On-Demand	Reactive	SCN2A	16	42
O=C(NCCNC(=O)C1CC1)NNc1ccc(OCc2ccccc2)cc1	ZINC000875006479	FE	On-Demand	Reactive	ADAM17	28	50
O=C(NCCNC(=O)C1CC1)NNc1ccc(OCc2ccccc2)cc1	ZINC000875006479	FE	On-Demand	Reactive	FFAR1	25	41
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NCCNC(=O)C1CC1	ZINC000875006490	FE	On-Demand	Anodyne	SIGMAR1	25	48
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NCCNC(=O)C1CC1	ZINC000875006490	FE	On-Demand	Anodyne	CACNA1G	36	43
O=C(Oc1ccc(Oc2ccccn2)cc1)c1ccc(Cn2cccn2)cc1	ZINC000875006497	FI	On-Demand	Anodyne	ACR	43	33
CCn1c(CNC(=O)C(=O)N2CC[C@]3(C(=O)OC)CCC[C@H]23)nc2ccccc21	ZINC000875006499	GD	On-Demand	Anodyne	PDE6D	55	34
CC(=O)N1CCC[C@@H]1C(=O)Nc1sc2c(c1C(N)=O)CCCCC2	ZINC000875006502	EE	On-Demand	Anodyne	LGMN	43	35
O=C(NCCCN1CCCCCC1=O)NCC[C@H](O)C1CCCC1	ZINC000875006512	EE	On-Demand	Anodyne	TYRO3	20	40
O=C(NCCCN1CCCCCC1=O)NCC[C@@H](O)C1CCCC1	ZINC000875006513	EE	On-Demand	Anodyne	TYRO3	20	40
CCn1c(CNC(=O)C(=O)NC[C@@H]2CCN2C2CCCCC2)nc2ccccc21	ZINC000875006542	GE	On-Demand	Anodyne	PDE6D	58	35
CCn1c(CNC(=O)C(=O)NC[C@@H]2CCN2C2CCCCC2)nc2ccccc21	ZINC000875006542	GE	On-Demand	Anodyne	SMO	34	40
CCn1c(CNC(=O)C(=O)NC[C@H]2CCN2C2CCCCC2)nc2ccccc21	ZINC000875006543	GE	On-Demand	Anodyne	PDE6D	58	35
CCn1c(CNC(=O)C(=O)NC[C@H]2CCN2C2CCCCC2)nc2ccccc21	ZINC000875006543	GE	On-Demand	Anodyne	SMO	34	40
COc1cccc([C@H](CNC(=O)N2CC[C@H](C(C)(C)O)C2)N2CCCC2)c1	ZINC000875006549	GF	On-Demand	Anodyne	DRD4	43	33
COc1cccc([C@H](CNC(=O)N2CC[C@H](C(C)(C)O)C2)N2CCCC2)c1	ZINC000875006549	GF	On-Demand	Anodyne	CCR3	15	40
COc1cccc([C@H](CNC(=O)N2CC[C@H](C(C)(C)O)C2)N2CCCC2)c1	ZINC000875006549	GF	On-Demand	Anodyne	MTNR1A	36	41
COc1cccc([C@H](CNC(=O)N2CC[C@H](C(C)(C)O)C2)N2CCCC2)c1	ZINC000875006549	GF	On-Demand	Anodyne	MTNR1B	38	41
COc1cccc([C@H](CNC(=O)N2CC[C@@H](C(C)(C)O)C2)N2CCCC2)c1	ZINC000875006551	GF	On-Demand	Anodyne	DRD4	43	33
COc1cccc([C@H](CNC(=O)N2CC[C@@H](C(C)(C)O)C2)N2CCCC2)c1	ZINC000875006551	GF	On-Demand	Anodyne	CCR3	15	40
COc1cccc([C@H](CNC(=O)N2CC[C@@H](C(C)(C)O)C2)N2CCCC2)c1	ZINC000875006551	GF	On-Demand	Anodyne	MTNR1A	36	41
COc1cccc([C@H](CNC(=O)N2CC[C@@H](C(C)(C)O)C2)N2CCCC2)c1	ZINC000875006551	GF	On-Demand	Anodyne	MTNR1B	38	41
CC(=O)C1CCN(C(=O)NC[C@@H](c2ccccc2Cl)N2CCCC2)CC1	ZINC000875006593	GG	On-Demand	Anodyne	EPHX2	18	40
CC(=O)C1CCN(C(=O)NC[C@@H](c2ccccc2Cl)N2CCCC2)CC1	ZINC000875006593	GG	On-Demand	Anodyne	SMO	15	42
CC(=O)C1CCN(C(=O)NC[C@H](c2ccccc2Cl)N2CCCC2)CC1	ZINC000875006594	GG	On-Demand	Anodyne	EPHX2	18	40
CC(=O)C1CCN(C(=O)NC[C@H](c2ccccc2Cl)N2CCCC2)CC1	ZINC000875006594	GG	On-Demand	Anodyne	SMO	15	42
O=C1CCCCCN1CCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875006626	FF	On-Demand	Anodyne	TRY1_BOVIN	42	34
O=C1CCCCCN1CCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875006626	FF	On-Demand	Anodyne	TYRO3	19	41
O=C1CCCCCN1CCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875006628	FF	On-Demand	Anodyne	TRY1_BOVIN	42	34
O=C1CCCCCN1CCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875006628	FF	On-Demand	Anodyne	TYRO3	19	41
O=C1CCCCCN1CCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875006630	FF	On-Demand	Anodyne	TRY1_BOVIN	42	34
O=C1CCCCCN1CCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875006630	FF	On-Demand	Anodyne	TYRO3	19	41
O=C1CCCCCN1CCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875006632	FF	On-Demand	Anodyne	TRY1_BOVIN	42	34
O=C1CCCCCN1CCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875006632	FF	On-Demand	Anodyne	TYRO3	19	41
C[C@@H]1Oc2ccccc2O[C@H]1C(=O)Oc1ccc(Oc2ccccn2)cc1	ZINC000875006633	FI	On-Demand	Anodyne	LIPE	18	40
C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)Oc1ccc(Oc2ccccn2)cc1	ZINC000875006636	FI	On-Demand	Anodyne	LIPE	18	40
CC(=O)N[C@@H](CC(=O)Oc1ccc(Oc2ccccn2)cc1)c1cccs1	ZINC000875006678	GI	On-Demand	Anodyne	ACACB	39	48
CC(=O)N[C@H](CC(=O)Oc1ccc(Oc2ccccn2)cc1)c1cccs1	ZINC000875006679	GI	On-Demand	Anodyne	ACACB	39	48
CCn1c(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)nc2ccccc21	ZINC000875006684	GE	On-Demand	Anodyne	HTR4	21	40
CCn1c(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)nc2ccccc21	ZINC000875006684	GE	On-Demand	Anodyne	SIRT3	43	32
CCn1c(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)nc2ccccc21	ZINC000875006684	GE	On-Demand	Anodyne	SIRT2	45	32
CCn1c(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)nc2ccccc21	ZINC000875006684	GE	On-Demand	Anodyne	SIRT1	45	33
CCCCCCCNC(=O)C(=O)NCc1nc2ccccc2n1CC	ZINC000875006692	EF	On-Demand	Mild	ASAH1	92	37
O=C(NCCNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)C1CC1	ZINC000875006696	FD	On-Demand	Anodyne	OPRL1	16	47
O=C1CCCCCN1CCCNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875006708	GG	On-Demand	Anodyne	TYRO3	19	41
O=C(NCCNC(=O)C1CC1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875006716	ED	On-Demand	Anodyne	ADRB1	23	42
O=C(NCCNC(=O)C1CC1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875006717	ED	On-Demand	Anodyne	ADRB1	23	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1	ZINC000875006760	ED	On-Demand	Clean	DPP7	40	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N(C)C)cc2)C1	ZINC000875006761	ED	On-Demand	Clean	DPP7	40	33
C[C@@H](CNC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1ccccc1	ZINC000875006769	DG	On-Demand	Anodyne	SLC6A3	16	43
CN1CCN(C2CCN(C(=O)N[C@H](c3ccccc3)c3ccccn3)CC2)CC1	ZINC000875006770	GF	On-Demand	Anodyne	CALCRL	44	38
CN1CCN(C2CCN(C(=O)N[C@H](c3ccccc3)c3ccccn3)CC2)CC1	ZINC000875006770	GF	On-Demand	Anodyne	BIRC8	46	34
CN1CCN(C2CCN(C(=O)N[C@H](c3ccccc3)c3ccccn3)CC2)CC1	ZINC000875006770	GF	On-Demand	Anodyne	L3MBTL3	60	39
CN1CCN(C2CCN(C(=O)N[C@@H](c3ccccc3)c3ccccn3)CC2)CC1	ZINC000875006771	GF	On-Demand	Anodyne	CALCRL	44	38
CN1CCN(C2CCN(C(=O)N[C@@H](c3ccccc3)c3ccccn3)CC2)CC1	ZINC000875006771	GF	On-Demand	Anodyne	BIRC8	46	34
CN1CCN(C2CCN(C(=O)N[C@@H](c3ccccc3)c3ccccn3)CC2)CC1	ZINC000875006771	GF	On-Demand	Anodyne	L3MBTL3	60	39
C[C@@H](CNC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875006793	CF	On-Demand	Anodyne	GRIN2B	16	41
C[C@@H](CNC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875006793	CF	On-Demand	Anodyne	SFRP1	58	36
C[C@@H](CNC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875006793	CF	On-Demand	Anodyne	SCD	15	41
C[C@@H](CNC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875006796	CF	On-Demand	Anodyne	GRIN2B	16	41
C[C@@H](CNC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875006796	CF	On-Demand	Anodyne	SFRP1	58	36
C[C@@H](CNC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875006796	CF	On-Demand	Anodyne	SCD	15	41
COCCN(CC1CCN(C)CC1)C(=O)NC[C@H](C)c1ccccc1	ZINC000875006801	EF	On-Demand	Anodyne	AMY2	42	29
COCCN(CC1CCN(C)CC1)C(=O)NC[C@@H](C)c1ccccc1	ZINC000875006802	EF	On-Demand	Anodyne	AMY2	42	29
CC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)c2ccccn2)CC1	ZINC000875006830	EG	On-Demand	Anodyne	PTAFR	22	46
CC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)c2ccccn2)CC1	ZINC000875006832	EG	On-Demand	Anodyne	PTAFR	22	46
CCn1c(CNC(=O)C(=O)N[C@@H](CF)c2ccc(F)cc2)nc2ccccc21	ZINC000875006837	GF	On-Demand	Anodyne	TACR3	33	41
CCn1c(CNC(=O)C(=O)N[C@H](CF)c2ccc(F)cc2)nc2ccccc21	ZINC000875006839	GF	On-Demand	Anodyne	TACR3	33	41
CC[C@@H](NC(=O)NCCc1ccccc1OC)[C@H](O)c1ccccc1	ZINC000875006840	EG	On-Demand	Anodyne	MTNR1A	43	38
CC[C@@H](NC(=O)NCCc1ccccc1OC)[C@H](O)c1ccccc1	ZINC000875006840	EG	On-Demand	Anodyne	MTNR1B	34	40
CC[C@@H](NC(=O)NCCc1ccccc1OC)[C@H](O)c1ccccc1	ZINC000875006840	EG	On-Demand	Anodyne	MBTPS1	41	34
CC[C@@H](NC(=O)NCCc1ccccc1OC)[C@@H](O)c1ccccc1	ZINC000875006841	EG	On-Demand	Anodyne	MTNR1A	43	38
CC[C@@H](NC(=O)NCCc1ccccc1OC)[C@@H](O)c1ccccc1	ZINC000875006841	EG	On-Demand	Anodyne	MTNR1B	34	40
CC[C@@H](NC(=O)NCCc1ccccc1OC)[C@@H](O)c1ccccc1	ZINC000875006841	EG	On-Demand	Anodyne	MBTPS1	41	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCSc2ccccc2)C1	ZINC000875006854	ED	On-Demand	Anodyne	SLC6A1	55	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCSc2ccccc2)C1	ZINC000875006857	ED	On-Demand	Anodyne	SLC6A1	55	34
COc1cccc([C@H](CNC(=O)N(C)OCC(F)(F)F)N2CCCC2)c1	ZINC000875006866	GF	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@H](CNC(=O)N(C)OCC(F)(F)F)N2CCCC2)c1	ZINC000875006866	GF	On-Demand	Anodyne	TACR1	17	56
CC(C)(C)NS(=O)(=O)c1ccc(C(=O)Oc2ccc(Oc3ccccn3)cc2)cc1	ZINC000875006906	II	On-Demand	Anodyne	PRTN3	59	37
CC(C)(C)NS(=O)(=O)c1ccc(C(=O)Oc2ccc(Oc3ccccn3)cc2)cc1	ZINC000875006906	II	On-Demand	Anodyne	ACR	49	33
O=C1CCCCCN1CCCNC(=O)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875006915	GE	On-Demand	Anodyne	TYRO3	19	41
COc1ccccc1[C@H]1CCCN(C(=O)NCCNC(=O)C(C)C)CC1	ZINC000875006938	FF	On-Demand	Anodyne	HTR1A	24	40
COc1ccccc1[C@H]1CCCN(C(=O)NCCNC(=O)C(C)C)CC1	ZINC000875006938	FF	On-Demand	Anodyne	DRD2	28	45
COc1ccccc1[C@H]1CCCN(C(=O)NCCNC(=O)C(C)C)CC1	ZINC000875006938	FF	On-Demand	Anodyne	DRD4	16	45
COc1ccccc1[C@H]1CCCN(C(=O)NCCNC(=O)C(C)C)CC1	ZINC000875006938	FF	On-Demand	Anodyne	TACR1	16	42
COc1ccccc1[C@H]1CCCN(C(=O)NCCNC(=O)C(C)C)CC1	ZINC000875006938	FF	On-Demand	Anodyne	EPHX2	18	45
COc1ccccc1[C@H]1CCCN(C(=O)NCCNC(=O)C(C)C)CC1	ZINC000875006938	FF	On-Demand	Anodyne	RBP4	40	43
COc1ccccc1[C@H]1CCCN(C(=O)NCCNC(=O)C(C)C)CC1	ZINC000875006938	FF	On-Demand	Anodyne	MBTPS1	45	35
COc1ccccc1[C@@H]1CCCN(C(=O)NCCNC(=O)C(C)C)CC1	ZINC000875006939	FF	On-Demand	Anodyne	HTR1A	24	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCCNC(=O)C(C)C)CC1	ZINC000875006939	FF	On-Demand	Anodyne	DRD2	28	45
COc1ccccc1[C@@H]1CCCN(C(=O)NCCNC(=O)C(C)C)CC1	ZINC000875006939	FF	On-Demand	Anodyne	DRD4	16	45
COc1ccccc1[C@@H]1CCCN(C(=O)NCCNC(=O)C(C)C)CC1	ZINC000875006939	FF	On-Demand	Anodyne	TACR1	16	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCCNC(=O)C(C)C)CC1	ZINC000875006939	FF	On-Demand	Anodyne	EPHX2	18	45
COc1ccccc1[C@@H]1CCCN(C(=O)NCCNC(=O)C(C)C)CC1	ZINC000875006939	FF	On-Demand	Anodyne	RBP4	40	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCCNC(=O)C(C)C)CC1	ZINC000875006939	FF	On-Demand	Anodyne	MBTPS1	45	35
CC[C@@H](NC(=O)NCCNC(=O)C(C)C)[C@@H](O)c1ccccc1	ZINC000875006944	DD	On-Demand	Anodyne	ANPEP	28	40
CC[C@@H](NC(=O)NCCNC(=O)C(C)C)[C@@H](O)c1ccccc1	ZINC000875006944	DD	On-Demand	Anodyne	CAPN2	48	37
CC[C@@H](NC(=O)NCCNC(=O)C(C)C)[C@@H](O)c1ccccc1	ZINC000875006944	DD	On-Demand	Anodyne	ACE2	40	33
CC[C@@H](NC(=O)NCCNC(=O)C(C)C)[C@H](O)c1ccccc1	ZINC000875006946	DD	On-Demand	Anodyne	ANPEP	28	40
CC[C@@H](NC(=O)NCCNC(=O)C(C)C)[C@H](O)c1ccccc1	ZINC000875006946	DD	On-Demand	Anodyne	CAPN2	48	37
CC[C@@H](NC(=O)NCCNC(=O)C(C)C)[C@H](O)c1ccccc1	ZINC000875006946	DD	On-Demand	Anodyne	ACE2	40	33
N#Cc1c(NC(=O)[C@H]2OCCO[C@H]2C(F)(F)F)sc2c1CCC2	ZINC000875006948	EE	On-Demand	Mild	VIPR1	27	44
C[C@H]1CC(=O)N[C@@H](C(=O)Nc2sc3c(c2C#N)CCC3)C1	ZINC000875006976	DD	On-Demand	Mild	VIPR1	29	45
CCn1ncnc1-c1ccc(C(=O)Nc2sc3c(c2C#N)CCC3)cc1	ZINC000875006982	FH	On-Demand	Mild	VIPR1	30	51
CN(C)[C@@H](CNC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1Cl	ZINC000875007034	GD	On-Demand	Anodyne	EPHX2	26	44
COc1cccc([C@H](CNC(=O)N[C@H](C)c2nccnc2C)N2CCCC2)c1	ZINC000875007047	GF	On-Demand	Anodyne	DRD4	40	31
COc1cccc([C@H](CNC(=O)N[C@@H](C)c2nccnc2C)N2CCCC2)c1	ZINC000875007049	GF	On-Demand	Anodyne	DRD4	40	31
N#Cc1c(NC(=O)Cc2csc(C3CC3)n2)sc2c1CCC2	ZINC000875007053	EH	On-Demand	Mild	VIPR1	31	50
CCn1c(CNC(=O)C(=O)N2CCC(C(C)=O)CC2)nc2ccccc21	ZINC000875007076	FD	On-Demand	Anodyne	PDE6D	61	36
N#Cc1c(NC(=O)[C@@H]2COC(=O)N2)sc2c1CCC2	ZINC000875007085	CD	On-Demand	Mild	VIPR1	29	47
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H](C)c2ccccc2)C1	ZINC000875007088	DF	On-Demand	Anodyne	ACE	21	40
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H](C)c2ccccc2)C1	ZINC000875007088	DF	On-Demand	Anodyne	CAPN2	46	40
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H](C)c2ccccc2)C1	ZINC000875007090	DF	On-Demand	Anodyne	ACE	21	40
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H](C)c2ccccc2)C1	ZINC000875007090	DF	On-Demand	Anodyne	CAPN2	46	40
COC(=O)N(C)NC(=O)NC[C@@H](c1cccc(OC)c1)N1CCCC1	ZINC000875007092	FD	On-Demand	Reactive	DRD4	43	33
COC(=O)N(C)NC(=O)NC[C@@H](c1cccc(OC)c1)N1CCCC1	ZINC000875007092	FD	On-Demand	Reactive	OPRD1	15	43
COC(=O)N(C)NC(=O)NC[C@@H](c1cccc(OC)c1)N1CCCC1	ZINC000875007092	FD	On-Demand	Reactive	CCR3	15	42
COC(=O)N(C)NC(=O)NC[C@@H](c1cccc(OC)c1)N1CCCC1	ZINC000875007092	FD	On-Demand	Reactive	MTNR1A	60	39
COC(=O)N(C)NC(=O)NC[C@@H](c1cccc(OC)c1)N1CCCC1	ZINC000875007092	FD	On-Demand	Reactive	MTNR1B	53	39
COC(=O)N(C)NC(=O)NC[C@H](c1cccc(OC)c1)N1CCCC1	ZINC000875007094	FD	On-Demand	Reactive	DRD4	43	33
COC(=O)N(C)NC(=O)NC[C@H](c1cccc(OC)c1)N1CCCC1	ZINC000875007094	FD	On-Demand	Reactive	OPRD1	15	43
COC(=O)N(C)NC(=O)NC[C@H](c1cccc(OC)c1)N1CCCC1	ZINC000875007094	FD	On-Demand	Reactive	CCR3	15	42
COC(=O)N(C)NC(=O)NC[C@H](c1cccc(OC)c1)N1CCCC1	ZINC000875007094	FD	On-Demand	Reactive	MTNR1A	60	39
COC(=O)N(C)NC(=O)NC[C@H](c1cccc(OC)c1)N1CCCC1	ZINC000875007094	FD	On-Demand	Reactive	MTNR1B	53	39
N#CCc1ccsc1C(=O)Nc1sc2c(c1C(N)=O)CCCCC2	ZINC000875007095	FG	On-Demand	Mild	VIPR1	26	42
N#CCc1ccsc1C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000875007105	DG	On-Demand	Mild	VIPR1	34	53
CCn1ncc(CNC(=O)NC[C@@H](c2ccccc2Cl)N2CCCC2)n1	ZINC000875007107	GF	On-Demand	Anodyne	OPRL1	17	41
CCn1ncc(CNC(=O)NC[C@H](c2ccccc2Cl)N2CCCC2)n1	ZINC000875007109	GF	On-Demand	Anodyne	OPRL1	17	41
CCn1c(CNC(=O)C(=O)NCC2CC=CC2)nc2ccccc21	ZINC000875007138	ED	On-Demand	Anodyne	PDE6D	55	34
Cc1ccnn1CC(=O)Nc1sc2c(c1C#N)CCCCC2	ZINC000875007157	DG	On-Demand	Mild	VIPR1	37	59
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccco1	ZINC000875007173	CD	On-Demand	Anodyne	SLC6A4	22	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccco1	ZINC000875007173	CD	On-Demand	Anodyne	SLC6A3	42	40
O=C(Oc1ccc(Oc2ccccn2)cc1)C1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000875007174	JK	On-Demand	Anodyne	LIPE	24	49
O=C(Oc1ccc(Oc2ccccn2)cc1)C1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000875007174	JK	On-Demand	Anodyne	L3MBTL3	58	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccco1	ZINC000875007175	CD	On-Demand	Anodyne	SLC6A4	22	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccco1	ZINC000875007175	CD	On-Demand	Anodyne	SLC6A3	42	40
C[C@H]1CCc2c(sc(NC(=O)COCc3ccnc(O)c3)c2C#N)C1	ZINC000875007179	FG	On-Demand	Mild	VIPR1	27	41
O=C(NCCNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)C1CC1	ZINC000875007199	ED	On-Demand	Anodyne	ACHE	23	40
O=C(NCCNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)C1CC1	ZINC000875007199	ED	On-Demand	Anodyne	SIGMAR1	34	52
O=C(NCCNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)C1CC1	ZINC000875007199	ED	On-Demand	Anodyne	CACNA1G	36	43
CC(=O)N[C@@H](CC(=O)Oc1ccc(Oc2ccccn2)cc1)c1ccc(Cl)cc1	ZINC000875007203	HJ	On-Demand	Anodyne	ACACA	24	40
CC(=O)N[C@@H](CC(=O)Oc1ccc(Oc2ccccn2)cc1)c1ccc(Cl)cc1	ZINC000875007203	HJ	On-Demand	Anodyne	ACACB	29	44
CC(=O)N[C@@H](CC(=O)Oc1ccc(Oc2ccccn2)cc1)c1ccc(Cl)cc1	ZINC000875007203	HJ	On-Demand	Anodyne	UTS2	42	32
CC(=O)N[C@H](CC(=O)Oc1ccc(Oc2ccccn2)cc1)c1ccc(Cl)cc1	ZINC000875007204	HJ	On-Demand	Anodyne	ACACA	24	40
CC(=O)N[C@H](CC(=O)Oc1ccc(Oc2ccccn2)cc1)c1ccc(Cl)cc1	ZINC000875007204	HJ	On-Demand	Anodyne	ACACB	29	44
CC(=O)N[C@H](CC(=O)Oc1ccc(Oc2ccccn2)cc1)c1ccc(Cl)cc1	ZINC000875007204	HJ	On-Demand	Anodyne	UTS2	42	32
CCn1c(CNC(=O)C(=O)NCC[C@@H]2CCSC2)nc2ccccc21	ZINC000875007207	FD	On-Demand	Anodyne	PDE6D	55	35
CCn1c(CNC(=O)C(=O)NCC[C@H]2CCSC2)nc2ccccc21	ZINC000875007208	FD	On-Demand	Anodyne	PDE6D	55	35
COc1ccc([C@H](CC(=O)Oc2ccc(Oc3ccccn3)cc2)NC(C)=O)cc1	ZINC000875007218	HI	On-Demand	Anodyne	ACACA	28	41
COc1ccc([C@H](CC(=O)Oc2ccc(Oc3ccccn3)cc2)NC(C)=O)cc1	ZINC000875007218	HI	On-Demand	Anodyne	ACACB	36	45
COc1ccc([C@@H](CC(=O)Oc2ccc(Oc3ccccn3)cc2)NC(C)=O)cc1	ZINC000875007219	HI	On-Demand	Anodyne	ACACA	28	41
COc1ccc([C@@H](CC(=O)Oc2ccc(Oc3ccccn3)cc2)NC(C)=O)cc1	ZINC000875007219	HI	On-Demand	Anodyne	ACACB	36	45
COc1ccccc1N=C1SCCN1C(=O)c1cc(S(C)(=O)=O)oc1C	ZINC000875007223	GF	On-Demand	Mild	LPL	48	32
COc1ccccc1N=C1SCCN1C(=O)[C@H]1CCCN1C(C)=O	ZINC000875007230	EE	On-Demand	Mild	PREP	59	35
O=C(NCCn1ccnc1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875007231	GE	On-Demand	Anodyne	ABL1	15	46
O=C(NCCn1ccnc1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875007239	DD	On-Demand	Anodyne	TBXAS1	48	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](c2ccccc2)c2ccccn2)C1	ZINC000875007292	FG	On-Demand	Anodyne	P2RY12	34	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](c2ccccc2)c2ccccn2)C1	ZINC000875007293	FG	On-Demand	Anodyne	P2RY12	34	42
C#CC[C@@H](COC)NC(=O)NC[C@@H](c1cccc(OC)c1)N1CCCC1	ZINC000875007296	FE	On-Demand	Mild	DRD4	40	31
C#CC[C@H](COC)NC(=O)NC[C@H](c1cccc(OC)c1)N1CCCC1	ZINC000875007297	FE	On-Demand	Mild	DRD4	40	31
C#CC[C@H](COC)NC(=O)NC[C@@H](c1cccc(OC)c1)N1CCCC1	ZINC000875007298	FE	On-Demand	Mild	DRD4	40	31
C#CC[C@@H](COC)NC(=O)NC[C@H](c1cccc(OC)c1)N1CCCC1	ZINC000875007299	FE	On-Demand	Mild	DRD4	40	31
COc1cccc([C@H](CNC(=O)N[C@H](C)C(=O)N(C)OC)N2CCCC2)c1	ZINC000875007302	GD	On-Demand	Anodyne	DRD4	43	33
COc1cccc([C@H](CNC(=O)N[C@@H](C)C(=O)N(C)OC)N2CCCC2)c1	ZINC000875007305	GD	On-Demand	Anodyne	DRD4	43	33
COc1cccc([C@H](CNC(=O)N2Cc3cccc(O)c3C2)N2CCCC2)c1	ZINC000875007325	GG	On-Demand	Clean	DRD4	46	35
C[C@@H](CNC(=O)N(C)CCN1CC2(CCOCC2)C1)c1ccccc1	ZINC000875007339	EF	On-Demand	Anodyne	CASR	50	40
C[C@H](CNC(=O)N(C)CCN1CC2(CCOCC2)C1)c1ccccc1	ZINC000875007340	EF	On-Demand	Anodyne	CASR	50	40
COc1cccc([C@H](CNC(=O)N[C@H](C)c2ccns2)N2CCCC2)c1	ZINC000875007343	FG	On-Demand	Anodyne	DRD4	40	31
COc1cccc([C@H](CNC(=O)N[C@@H](C)c2ccns2)N2CCCC2)c1	ZINC000875007347	FG	On-Demand	Anodyne	DRD4	40	31
C[C@@H](CNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000875007349	EH	On-Demand	Anodyne	EPHX2	28	41
C[C@@H](CNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000875007349	EH	On-Demand	Anodyne	SCD1	18	41
C[C@@H](CNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000875007351	EH	On-Demand	Anodyne	EPHX2	28	41
C[C@@H](CNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000875007351	EH	On-Demand	Anodyne	SCD1	18	41
CC(=O)C1CCN(C(=O)NC[C@@H](c2ccccc2Cl)N(C)C)CC1	ZINC000875007358	FF	On-Demand	Anodyne	OPRL1	39	42
CC(=O)C1CCN(C(=O)NC[C@@H](c2ccccc2Cl)N(C)C)CC1	ZINC000875007358	FF	On-Demand	Anodyne	EPHX2	21	42
CC(=O)C1CCN(C(=O)NC[C@H](c2ccccc2Cl)N(C)C)CC1	ZINC000875007359	FF	On-Demand	Anodyne	OPRL1	39	42
CC(=O)C1CCN(C(=O)NC[C@H](c2ccccc2Cl)N(C)C)CC1	ZINC000875007359	FF	On-Demand	Anodyne	EPHX2	21	42
COC(=O)[C@@H]1CO[C@H](CCC(=O)Nc2sc3c(c2C#N)CC[C@@H](C)C3)C1	ZINC000875007393	GG	On-Demand	Mild	VIPR1	27	44
COC(=O)[C@@H]1CO[C@H](CCC(=O)Nc2sc3c(c2C#N)CC[C@H](C)C3)C1	ZINC000875007394	GG	On-Demand	Mild	VIPR1	27	44
CCO[C@@H](C(=O)Nc1sc2c(c1C#N)CCC2)[C@H]1CCOC1	ZINC000875007409	DE	On-Demand	Mild	VIPR1	27	42
CCO[C@@H](C(=O)Nc1sc2c(c1C#N)CCC2)[C@@H]1CCOC1	ZINC000875007410	DE	On-Demand	Mild	VIPR1	27	42
Cc1csc2nc(CC(=O)Nc3sc4c(c3C#N)CCC4)cn12	ZINC000875007422	EG	On-Demand	Mild	VIPR1	32	51
N#Cc1c(NC(=O)COCc2ccnc(O)c2)sc2c1CCCCC2	ZINC000875007432	FG	On-Demand	Mild	VIPR1	35	54
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2c(C)nn(-c3ccccc3)c2C)C1	ZINC000875007439	GD	On-Demand	Anodyne	P2RX7	15	53
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2c(C)nn(-c3ccccc3)c2C)C1	ZINC000875007440	GD	On-Demand	Anodyne	P2RX7	15	53
N#Cc1c(NC(=O)c2ccc(CNC(=O)C(F)(F)F)o2)sc2c1CCC2	ZINC000875007446	GG	On-Demand	Mild	VIPR1	31	50
C[C@H]1CCc2c(sc(NC(=O)Cc3ccc(Cl)cn3)c2C#N)C1	ZINC000875007447	EH	On-Demand	Mild	VIPR1	27	42
COC(=O)c1cc(C(=O)Nc2sc3c(c2C#N)CCC3)ccc1C	ZINC000875007452	EG	On-Demand	Mild	VIPR1	33	51
CCCCCCCNC(=O)C(=O)NC1CCN(C(C)=O)CC1	ZINC000875007455	DD	On-Demand	Mild	EPHX2	31	61
CCCCCCCNC(=O)C(=O)NC1CCN(C(C)=O)CC1	ZINC000875007455	DD	On-Demand	Mild	ASAH1	75	34
O=C(NCCO)C1CCN(C(=O)NCc2cn3ccccc3n2)CC1	ZINC000875007456	EC	On-Demand	Anodyne	EPHX2	17	41
N#Cc1c(NC(=O)c2cc(C(F)(F)F)ncn2)sc2c1CCC2	ZINC000875007459	EG	On-Demand	Mild	VIPR1	28	45
C[C@@H](CNC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875007489	DF	On-Demand	Anodyne	CHRM2	17	42
C[C@@H](CNC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875007489	DF	On-Demand	Anodyne	CHRM3	25	42
C[C@@H](CNC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875007489	DF	On-Demand	Anodyne	AMY2	46	32
C[C@@H](CNC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875007489	DF	On-Demand	Anodyne	REN	15	42
C[C@@H](CNC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875007489	DF	On-Demand	Anodyne	BIRC2	41	36
C[C@@H](CNC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875007489	DF	On-Demand	Anodyne	SFRP1	60	33
C[C@@H](CNC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875007489	DF	On-Demand	Anodyne	WNT3	54	33
C[C@@H](CNC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875007490	DF	On-Demand	Anodyne	CHRM2	17	42
C[C@@H](CNC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875007490	DF	On-Demand	Anodyne	CHRM3	25	42
C[C@@H](CNC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875007490	DF	On-Demand	Anodyne	AMY2	46	32
C[C@@H](CNC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875007490	DF	On-Demand	Anodyne	REN	15	42
C[C@@H](CNC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875007490	DF	On-Demand	Anodyne	BIRC2	41	36
C[C@@H](CNC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875007490	DF	On-Demand	Anodyne	SFRP1	60	33
C[C@@H](CNC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875007490	DF	On-Demand	Anodyne	WNT3	54	33
CN(C)[C@@H](CNC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1ccccc1Cl	ZINC000875007492	GG	On-Demand	Anodyne	OPRL1	41	43
C#CC[C@@H](CCOC)NC(=O)NC[C@H](c1cccc(OC)c1)N1CCCC1	ZINC000875007512	FF	On-Demand	Mild	DRD4	42	32
C#CC[C@@H](CCOC)NC(=O)NC[C@@H](c1cccc(OC)c1)N1CCCC1	ZINC000875007513	FF	On-Demand	Mild	DRD4	42	32
C#CC[C@H](CCOC)NC(=O)NC[C@@H](c1cccc(OC)c1)N1CCCC1	ZINC000875007514	FF	On-Demand	Mild	DRD4	42	32
C#CC[C@H](CCOC)NC(=O)NC[C@H](c1cccc(OC)c1)N1CCCC1	ZINC000875007515	FF	On-Demand	Mild	DRD4	42	32
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](C)c1ccccc1	ZINC000875007517	CF	On-Demand	Anodyne	CAPN2	39	42
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](C)c1ccccc1	ZINC000875007519	CF	On-Demand	Anodyne	CAPN2	39	42
C[C@@H](CNC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1	ZINC000875007524	ED	On-Demand	Anodyne	EPHX2	21	43
C[C@H](CNC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1	ZINC000875007525	ED	On-Demand	Anodyne	EPHX2	21	43
COc1cccc([C@H](CNC(=O)N2CCC(C(C)=O)CC2)N2CCCC2)c1	ZINC000875007539	FF	On-Demand	Anodyne	DRD4	43	33
COc1cccc([C@H](CNC(=O)N2CCC(C(C)=O)CC2)N2CCCC2)c1	ZINC000875007539	FF	On-Demand	Anodyne	OPRD1	15	45
COc1cccc([C@H](CNC(=O)N2CCC(C(C)=O)CC2)N2CCCC2)c1	ZINC000875007539	FF	On-Demand	Anodyne	CCR3	17	41
COc1cccc([C@H](CNC(=O)N2CCC(C(C)=O)CC2)N2CCCC2)c1	ZINC000875007539	FF	On-Demand	Anodyne	MTNR1A	58	43
COc1cccc([C@H](CNC(=O)N2CCC(C(C)=O)CC2)N2CCCC2)c1	ZINC000875007539	FF	On-Demand	Anodyne	MTNR1B	61	43
CCOC1CC2(C1)C[C@H]2C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000875007556	DG	On-Demand	Mild	VIPR1	29	45
CONC(=O)C1CCN(C(=O)NCC(c2ccccc2)c2ccccc2)CC1	ZINC000875007559	GF	On-Demand	Anodyne	SLC6A3	16	47
CONC(=O)C1CCN(C(=O)NCC(c2ccccc2)c2ccccc2)CC1	ZINC000875007559	GF	On-Demand	Anodyne	AMY2	46	32
CONC(=O)C1CCN(C(=O)NCC(c2ccccc2)c2ccccc2)CC1	ZINC000875007559	GF	On-Demand	Anodyne	EPHX2	32	40
CONC(=O)C1CCN(C(=O)NCC(c2ccccc2)c2ccccc2)CC1	ZINC000875007559	GF	On-Demand	Anodyne	XIAP	23	40
COc1ccc(O[C@@H](C)C(=O)Oc2ccc(Oc3ccccn3)cc2)cc1	ZINC000875007560	FI	On-Demand	Anodyne	ACACB	25	44
COc1ccc(O[C@H](C)C(=O)Oc2ccc(Oc3ccccn3)cc2)cc1	ZINC000875007561	FI	On-Demand	Anodyne	ACACB	25	44
CCO[C@@H](C(=O)Nc1sc2c(c1C#N)CCC2)C1CCOCC1	ZINC000875007563	EF	On-Demand	Mild	VIPR1	28	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccccc1OC	ZINC000875007577	ED	On-Demand	Anodyne	SLC6A4	23	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccccc1OC	ZINC000875007577	ED	On-Demand	Anodyne	SLC6A3	46	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccccc1OC	ZINC000875007577	ED	On-Demand	Anodyne	MBTPS1	54	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccccc1OC	ZINC000875007578	ED	On-Demand	Anodyne	SLC6A4	23	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccccc1OC	ZINC000875007578	ED	On-Demand	Anodyne	SLC6A3	46	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccccc1OC	ZINC000875007578	ED	On-Demand	Anodyne	MBTPS1	54	38
CC[C@H](C[C@H](C)O)NC(=O)NCCc1ccccc1OC	ZINC000875007579	CE	On-Demand	Anodyne	ANPEP	17	49
CC[C@H](C[C@H](C)O)NC(=O)NCCc1ccccc1OC	ZINC000875007579	CE	On-Demand	Anodyne	MBTPS1	45	34
Cc1ccnn1CC(=O)Nc1sc2c(c1C#N)CC[C@H](C)C2	ZINC000875007595	DF	On-Demand	Mild	VIPR1	27	44
Cc1ccnn1CC(=O)Nc1sc2c(c1C#N)CC[C@@H](C)C2	ZINC000875007596	DF	On-Demand	Mild	VIPR1	27	44
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCn3c(C)nc4ccccc43)C[C@@H]1C2	ZINC000875007620	FE	On-Demand	Anodyne	PDE6D	37	41
N#Cc1c(NC(=O)[C@@H]2COC(=O)N2)sc2c1CCCCC2	ZINC000875007626	DD	On-Demand	Mild	VIPR1	30	48
Cc1ccn(C[C@H](C)C(=O)Nc2sc3c(c2C#N)CCC3)n1	ZINC000875007633	DF	On-Demand	Mild	VIPR1	31	50
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2c(C)nn(-c3ccccc3)c2C)C1	ZINC000875007643	GE	On-Demand	Anodyne	P2RX7	15	48
N#Cc1c(NC(=O)Cc2ccc(Cl)cn2)sc2c1CCC2	ZINC000875007651	DG	On-Demand	Mild	VIPR1	34	55
O=CN1CCCN(C(=O)NCC(c2ccccc2)c2ccccc2)CC1	ZINC000875007657	FF	On-Demand	Anodyne	PTAFR	19	42
COc1cccc([C@H](CNC(=O)N2CCC[C@H](C(C)=O)C2)N2CCCC2)c1	ZINC000875007674	FF	On-Demand	Anodyne	DRD4	42	32
COc1cccc([C@H](CNC(=O)N2CCC[C@H](C(C)=O)C2)N2CCCC2)c1	ZINC000875007674	FF	On-Demand	Anodyne	CCR3	17	41
COc1cccc([C@H](CNC(=O)N2CCC[C@H](C(C)=O)C2)N2CCCC2)c1	ZINC000875007674	FF	On-Demand	Anodyne	MTNR1A	50	42
COc1cccc([C@H](CNC(=O)N2CCC[C@H](C(C)=O)C2)N2CCCC2)c1	ZINC000875007674	FF	On-Demand	Anodyne	MTNR1B	52	42
COc1cccc([C@H](CNC(=O)N2CCC[C@H](C(C)=O)C2)N2CCCC2)c1	ZINC000875007674	FF	On-Demand	Anodyne	DPP7	20	43
COc1cccc([C@H](CNC(=O)N2CCC[C@@H](C(C)=O)C2)N2CCCC2)c1	ZINC000875007675	FF	On-Demand	Anodyne	DRD4	42	32
COc1cccc([C@H](CNC(=O)N2CCC[C@@H](C(C)=O)C2)N2CCCC2)c1	ZINC000875007675	FF	On-Demand	Anodyne	CCR3	17	41
COc1cccc([C@H](CNC(=O)N2CCC[C@@H](C(C)=O)C2)N2CCCC2)c1	ZINC000875007675	FF	On-Demand	Anodyne	MTNR1A	50	42
COc1cccc([C@H](CNC(=O)N2CCC[C@@H](C(C)=O)C2)N2CCCC2)c1	ZINC000875007675	FF	On-Demand	Anodyne	MTNR1B	52	42
COc1cccc([C@H](CNC(=O)N2CCC[C@@H](C(C)=O)C2)N2CCCC2)c1	ZINC000875007675	FF	On-Demand	Anodyne	DPP7	20	43
CN1CCN(C2CCN(C(=O)C(=O)NCCSc3ccccc3)CC2)CC1	ZINC000875007686	GD	On-Demand	Anodyne	L3MBTL3	68	40
CN(C)[C@@H](CNC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1Cl	ZINC000875007724	FF	On-Demand	Anodyne	OPRL1	30	40
CN(C)[C@@H](CNC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1Cl	ZINC000875007724	FF	On-Demand	Anodyne	TACR2	15	45
CN(C)[C@@H](CNC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1Cl	ZINC000875007725	FF	On-Demand	Anodyne	OPRL1	30	40
CN(C)[C@@H](CNC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1Cl	ZINC000875007725	FF	On-Demand	Anodyne	TACR2	15	45
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875007775	GD	On-Demand	Anodyne	P2RX7	17	49
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875007776	GD	On-Demand	Anodyne	P2RX7	17	49
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCn2c(C)nc3ccccc32)C1	ZINC000875007778	FF	On-Demand	Anodyne	HRH1	16	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCn2c(C)nc3ccccc32)C1	ZINC000875007778	FF	On-Demand	Anodyne	PDE6D	55	43
CC(C)n1ncc(C(=O)Nc2sc3c(c2C#N)CCC3)c1Br	ZINC000875007797	GH	On-Demand	Mild	VIPR1	28	45
CC(C)n1ncc(C(=O)Nc2sc3c(c2C#N)CCCCC3)c1Cl	ZINC000875007826	FJ	On-Demand	Mild	VIPR1	29	46
CC(C)(C)OC(=O)N[C@@H]1CC=C(C(=O)Nc2sc3c(c2C#N)CCC3)C1	ZINC000875007832	FH	On-Demand	Mild	VIPR1	28	43
Cn1nc(Cl)c(C(=O)Nc2sc3c(c2C#N)CCC3)c1Cl	ZINC000875007844	EG	On-Demand	Mild	VIPR1	28	44
CCO[C@@H](C(=O)Nc1sc2c(c1C#N)CCC2)C1CCCC1	ZINC000875007859	DH	On-Demand	Mild	VIPR1	30	48
N#Cc1c(NC(=O)CCCOC2CCOCC2)sc2c1CCC2	ZINC000875007861	EG	On-Demand	Mild	VIPR1	32	51
Cn1nc(Cl)c(C(=O)Nc2sc3c(c2C#N)CCCCC3)c1Cl	ZINC000875007873	FI	On-Demand	Mild	VIPR1	29	46
COc1ccc(OC)c([C@H](C)NC(=O)C(=O)NC[C@@H]2c3ccccc3CN2C)c1	ZINC000875007894	GE	On-Demand	Anodyne	MTNR1B	46	38
COc1ccc(OC)c([C@H](C)NC(=O)C(=O)NC[C@H]2c3ccccc3CN2C)c1	ZINC000875007896	GE	On-Demand	Anodyne	MTNR1B	46	38
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1c(C)nn(-c2ccccc2)c1C	ZINC000875007912	GD	On-Demand	Mild	P2RX7	17	49
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1c(C)nn(-c2ccccc2)c1C	ZINC000875007913	GD	On-Demand	Mild	P2RX7	17	49
CCO[C@H]1COCC[C@H]1CC(=O)Nc1sc2c(c1C#N)CCC2	ZINC000875007948	EF	On-Demand	Mild	VIPR1	29	46
CCO[C@H]1COCC[C@@H]1CC(=O)Nc1sc2c(c1C#N)CCC2	ZINC000875007949	EF	On-Demand	Mild	VIPR1	29	46
COC(=O)[C@@H]1CO[C@H](CCC(=O)Nc2sc3c(c2C#N)CCC3)C1	ZINC000875007951	EE	On-Demand	Mild	VIPR1	34	54
N#Cc1c(NC(=O)[C@@H]2[C@H]3CC[C@]4(COC(=O)[C@H]24)O3)sc2c1CCC2	ZINC000875007954	ED	On-Demand	Mild	VIPR1	25	40
C[C@H]1CCc2c(sc(NC(=O)CCCOC3CCOCC3)c2C#N)C1	ZINC000875007956	FH	On-Demand	Mild	VIPR1	26	40
C#CC[C@@H](COC)NC(=O)C(=O)NCc1c(C)nn(-c2ccccc2)c1C	ZINC000875007961	FD	On-Demand	Mild	P2RX7	15	48
C#CC[C@H](COC)NC(=O)C(=O)NCc1c(C)nn(-c2ccccc2)c1C	ZINC000875007962	FD	On-Demand	Mild	P2RX7	15	48
COC(=O)[C@@H]1CO[C@H](CCC(=O)Nc2sc3c(c2C#N)CCCCC3)C1	ZINC000875007965	GG	On-Demand	Mild	VIPR1	35	56
O=C(Oc1ccc(Oc2ccccn2)cc1)c1ccc(C(F)(F)F)cn1	ZINC000875007981	FJ	On-Demand	Anodyne	LIPE	28	54
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875007991	GD	On-Demand	Anodyne	P2RX7	15	50
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875007992	GD	On-Demand	Anodyne	P2RX7	15	50
N#Cc1c(NC(=O)C[C@H]2Cc3ccccc3O2)sc2c1CCC2	ZINC000875007995	DG	On-Demand	Mild	VIPR1	34	58
N#Cc1c(NC(=O)C[C@@H]2Cc3ccccc3O2)sc2c1CCC2	ZINC000875007996	DG	On-Demand	Mild	VIPR1	34	58
C[C@H]1CCc2c(sc(NC(=O)Cn3ncc4cccnc43)c2C#N)C1	ZINC000875008021	FG	On-Demand	Mild	VIPR1	25	40
C[C@H]1CCc2c(sc(NC(=O)CN3CCCCC(=O)C3=O)c2C#N)C1	ZINC000875008025	FE	On-Demand	Mild	VIPR1	27	42
N#Cc1c(NC(=O)[C@H]2CCC(=O)O2)sc2c1CCC2	ZINC000875008033	CD	On-Demand	Mild	VIPR1	29	47
N#Cc1c(NC(=O)[C@@H]2[C@H]3CC[C@]4(COC(=O)[C@H]24)O3)sc2c1CCCCC2	ZINC000875008041	FF	On-Demand	Mild	VIPR1	26	41
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)C(=O)N1CC[C@@H]2[C@@H](CCN2C)C1	ZINC000875008042	GD	On-Demand	Anodyne	P2RX7	15	48
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)C(=O)N1CC[C@H]2[C@@H](CCN2C)C1	ZINC000875008043	GD	On-Demand	Anodyne	P2RX7	15	48
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)C(=O)N1CC[C@H]2[C@H](CCN2C)C1	ZINC000875008044	GD	On-Demand	Anodyne	P2RX7	15	48
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)C(=O)N1CC[C@@H]2[C@H](CCN2C)C1	ZINC000875008045	GD	On-Demand	Anodyne	P2RX7	15	48
CC(C)n1ncc(C(=O)Nc2sc3c(c2C#N)CCC3)c1Cl	ZINC000875008066	EH	On-Demand	Mild	VIPR1	28	45
N#Cc1c(NC(=O)Cc2csc(COc3ccccc3)n2)sc2c1CCC2	ZINC000875008073	GI	On-Demand	Mild	VIPR1	32	54
CC(=O)C1CCN(C(=O)NCC(c2ccccc2)c2ccccc2)CC1	ZINC000875008082	FH	On-Demand	Anodyne	EPHX2	33	40
CC(=O)C1CCN(C(=O)NCC(c2ccccc2)c2ccccc2)CC1	ZINC000875008082	FH	On-Demand	Anodyne	SMO	19	43
Cc1ccnn1CC(=O)Nc1sc2c(c1C#N)CCC2	ZINC000875008083	CE	On-Demand	Mild	VIPR1	36	58
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875008100	FE	On-Demand	Anodyne	P2RX7	15	52
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875008101	FE	On-Demand	Anodyne	P2RX7	15	52
Cc1cc(C(F)(F)F)nc(C(=O)Nc2sc3c(c2C#N)CCC3)n1	ZINC000875008107	FG	On-Demand	Mild	VIPR1	32	50
N#Cc1c(NC(=O)Cn2ncc3cccnc32)sc2c1CCC2	ZINC000875008113	DE	On-Demand	Mild	VIPR1	32	52
N#Cc1c(NC(=O)c2sccc2C(F)F)sc2c1CCC2	ZINC000875008131	DI	On-Demand	Mild	VIPR1	33	52
Cn1nnnc1C1CCN(C(=O)NCC(c2ccccc2)c2ccccc2)CC1	ZINC000875008148	GF	On-Demand	Anodyne	IL2RA	40	34
Cn1nnnc1C1CCN(C(=O)NCC(c2ccccc2)c2ccccc2)CC1	ZINC000875008148	GF	On-Demand	Anodyne	SMO	28	40
COCC(C)(C)CCNC(=O)C(=O)NCc1c(C)nn(-c2ccccc2)c1C	ZINC000875008152	GE	On-Demand	Anodyne	P2RX7	21	52
COC(=O)C1(O)CN(C(=O)NCCCn2c(C)nc3ccccc32)C1	ZINC000875008153	EC	On-Demand	Anodyne	PDE6D	22	41
C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000875008154	CG	On-Demand	Mild	VIPR1	31	51
C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000875008155	CG	On-Demand	Mild	VIPR1	31	51
C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000875008156	CG	On-Demand	Mild	VIPR1	31	51
N#Cc1c(NC(=O)[C@H]2OCCO[C@H]2C(F)(F)F)sc2c1CCCCC2	ZINC000875008170	FG	On-Demand	Mild	VIPR1	28	46
CC(=O)C1CCN(C(=O)C(=O)NCc2c(C)nn(-c3ccccc3)c2C)CC1	ZINC000875008175	GD	On-Demand	Anodyne	P2RX7	18	52
N#Cc1c(NC(=O)c2cccn(C3CC3)c2=O)sc2c1CCC2	ZINC000875008199	EF	On-Demand	Mild	VIPR1	29	48
N#Cc1c(NC(=O)[C@H]2CCC(=O)O2)sc2c1CCCCC2	ZINC000875008205	DF	On-Demand	Mild	VIPR1	30	49
CN1CC[C@@H](C(=O)Nc2sc3c(c2C#N)CCC3)[C@@H](c2cnn(C)c2)C1	ZINC000875008207	FF	On-Demand	Mild	VIPR1	26	40
CN1CC[C@@H](C(=O)Nc2sc3c(c2C#N)CCC3)[C@H](c2cnn(C)c2)C1	ZINC000875008210	FF	On-Demand	Mild	VIPR1	26	40
COc1ccc(OC)c([C@H](C)NC(=O)C(=O)NCCCCC2CC2)c1	ZINC000875008218	EF	On-Demand	Anodyne	MTNR1A	50	38
COc1ccc(OC)c([C@H](C)NC(=O)C(=O)NCCCCC2CC2)c1	ZINC000875008218	EF	On-Demand	Anodyne	MTNR1B	46	41
C[C@@]1(Br)C[C@@H]1C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000875008223	EG	On-Demand	Mild	VIPR1	32	51
C[C@@]1(Br)C[C@H]1C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000875008225	EG	On-Demand	Mild	VIPR1	32	51
N#Cc1c(NC(=O)Cc2ccc(Cl)cn2)sc2c1CCCCC2	ZINC000875008227	EI	On-Demand	Mild	VIPR1	35	57
O=C(NCCO)C1CCN(C(=O)NCC(c2ccccc2)c2ccccc2)CC1	ZINC000875008234	GE	On-Demand	Anodyne	EPHX2	28	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCn1c(C)nc2ccccc21	ZINC000875008247	FE	On-Demand	Anodyne	PDE6D	41	46
N#Cc1c(NC(=O)Cn2ccc(Br)cc2=O)sc2c1CCC2	ZINC000875008248	GF	On-Demand	Mild	VIPR1	33	52
Cn1nc(I)cc1C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000875008249	GF	On-Demand	Mild	VIPR1	30	47
N#Cc1c(NC(=O)CC(F)(F)C(F)(F)F)sc2c1CCC2	ZINC000875008253	DH	On-Demand	Mild	VIPR1	35	57
CO[C@H](C(=O)Nc1sc2c(c1C#N)CCC2)C(=O)OC(C)(C)C	ZINC000875008258	EE	On-Demand	Mild	VIPR1	31	49
C[C@H]1CCc2c(sc(NC(=O)c3sccc3CC#N)c2C#N)C1	ZINC000875008261	EI	On-Demand	Mild	VIPR1	27	41
COC(=O)CC[C@@H]1CC[C@H](C(=O)Nc2sc3c(c2C#N)CCC3)O1	ZINC000875008275	EF	On-Demand	Mild	VIPR1	32	51
N#Cc1c(NC(=O)COCc2ccnc(O)c2)sc2c1CCC2	ZINC000875008278	EE	On-Demand	Mild	VIPR1	34	52
N#Cc1c(NC(=O)CN2CCCCC(=O)C2=O)sc2c1CCC2	ZINC000875008280	ED	On-Demand	Mild	VIPR1	33	53
COc1ccccc1[C@H]1CCCN(C(=O)NCCc2ccco2)CC1	ZINC000875008283	EH	On-Demand	Anodyne	RBP4	29	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCCc2ccco2)CC1	ZINC000875008284	EH	On-Demand	Anodyne	RBP4	29	40
CN1CC[C@H]2CN(C(=O)C(=O)NCCc3ccc4c(c3)OCO4)CC[C@@H]21	ZINC000875008300	FC	On-Demand	Anodyne	NOS2	93	39
CN1CC[C@H]2CN(C(=O)C(=O)NCCc3ccc4c(c3)OCO4)CC[C@H]21	ZINC000875008302	FC	On-Demand	Anodyne	NOS2	93	39
COCC(C)(C)CCNC(=O)C(=O)NCCn1c(C)nc2ccccc21	ZINC000875008304	FD	On-Demand	Anodyne	PDE6D	38	43
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCCN1CCCCC1	ZINC000875008313	FD	On-Demand	Anodyne	HTR1A	45	40
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCCN1CCCCC1	ZINC000875008313	FD	On-Demand	Anodyne	DRD2	50	42
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCCN1CCCCC1	ZINC000875008313	FD	On-Demand	Anodyne	DRD4	24	40
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCCN1CCCCC1	ZINC000875008313	FD	On-Demand	Anodyne	ADRA1D	45	37
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCCN1CCCCC1	ZINC000875008313	FD	On-Demand	Anodyne	ADRA1A	67	36
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCCN1CCCCC1	ZINC000875008313	FD	On-Demand	Anodyne	ADRA1B	46	37
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCCN1CCCCC1	ZINC000875008313	FD	On-Demand	Anodyne	DRD3	80	42
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCCN1CCCCC1	ZINC000875008313	FD	On-Demand	Anodyne	CHRNA7	20	46
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCCN1CCCCC1	ZINC000875008314	FD	On-Demand	Anodyne	HTR1A	45	40
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCCN1CCCCC1	ZINC000875008314	FD	On-Demand	Anodyne	DRD2	50	42
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCCN1CCCCC1	ZINC000875008314	FD	On-Demand	Anodyne	DRD4	24	40
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCCN1CCCCC1	ZINC000875008314	FD	On-Demand	Anodyne	ADRA1D	45	37
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCCN1CCCCC1	ZINC000875008314	FD	On-Demand	Anodyne	ADRA1A	67	36
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCCN1CCCCC1	ZINC000875008314	FD	On-Demand	Anodyne	ADRA1B	46	37
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCCN1CCCCC1	ZINC000875008314	FD	On-Demand	Anodyne	DRD3	80	42
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCCN1CCCCC1	ZINC000875008314	FD	On-Demand	Anodyne	CHRNA7	20	46
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)c1ccc2c(c1)OCCO2	ZINC000875008320	DE	On-Demand	Anodyne	KCNQ2	22	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)c1ccc2c(c1)OCCO2	ZINC000875008321	DE	On-Demand	Anodyne	KCNQ2	22	40
O=C(NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O)NC1C2CC3CC(C2)CC1C3	ZINC000875008326	FE	On-Demand	Anodyne	HSD11B1	47	38
C[C@H](NC(=O)C(=O)NCCc1ccc2c(c1)OCO2)c1ccnn1C	ZINC000875008337	EC	On-Demand	Anodyne	NOS2	95	40
COC(=O)C1(O)CN(C(=O)NC2C3CC4CC(C3)CC2C4)C1	ZINC000875008340	DC	On-Demand	Anodyne	HSD11B1	46	36
O=C(NCCc1ccc2c(c1)OCO2)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875008355	GD	On-Demand	Anodyne	NOS2	89	43
O=C(NCCc1ccc2c(c1)OCO2)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875008355	GD	On-Demand	Anodyne	MCHR1	16	42
O=C(NCCc1ccc2c(c1)OCO2)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875008356	GD	On-Demand	Anodyne	NOS2	89	43
O=C(NCCc1ccc2c(c1)OCO2)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875008356	GD	On-Demand	Anodyne	MCHR1	16	42
O=C(NCCc1ccc2c(c1)OCO2)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875008357	GD	On-Demand	Anodyne	NOS2	89	43
O=C(NCCc1ccc2c(c1)OCO2)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875008357	GD	On-Demand	Anodyne	MCHR1	16	42
O=C(NCCc1ccc2c(c1)OCO2)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875008358	GD	On-Demand	Anodyne	NOS2	89	43
O=C(NCCc1ccc2c(c1)OCO2)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875008358	GD	On-Demand	Anodyne	MCHR1	16	42
O=C(NCCc1ccccc1F)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875008360	EF	On-Demand	Anodyne	CACNA1G	16	40
O=C(NCCc1ccccc1F)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875008361	EF	On-Demand	Anodyne	CACNA1G	16	40
C[C@@H](NC(=O)N1Cc2cccc(O)c2C1)c1ccc2c(c1)OCCO2	ZINC000875008362	EF	On-Demand	Clean	KCNQ2	21	40
C[C@H](NC(=O)N1Cc2cccc(O)c2C1)c1ccc2c(c1)OCCO2	ZINC000875008363	EF	On-Demand	Clean	KCNQ2	21	40
O=C1CCN(C(=O)C(=O)NCCc2ccc3c(c2)OCO3)CCCCCCN1	ZINC000875008372	GC	On-Demand	Anodyne	NOS2	79	40
O=C(NC1C2CC3CC(C2)CC1C3)N1CCC(CO)(CO)CC1	ZINC000875008373	DD	On-Demand	Anodyne	HSD11B1	49	40
COC(=O)N(C)NC(=O)N[C@H](C)c1ccc2c(c1)OCCO2	ZINC000875008378	DD	On-Demand	Reactive	KCNQ2	21	42
COC(=O)N(C)NC(=O)N[C@@H](C)c1ccc2c(c1)OCCO2	ZINC000875008379	DD	On-Demand	Reactive	KCNQ2	21	42
O=C(NCCO)C1CCN(C(=O)NC2C3CC4CC(C3)CC2C4)CC1	ZINC000875008383	ED	On-Demand	Anodyne	HSD11B1	50	39
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NCCCN2CCCCC2)CCO1	ZINC000875008388	GD	On-Demand	Anodyne	HTR1A	51	44
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NCCCN2CCCCC2)CCO1	ZINC000875008388	GD	On-Demand	Anodyne	DRD2	46	43
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NCCCN2CCCCC2)CCO1	ZINC000875008388	GD	On-Demand	Anodyne	DRD4	33	41
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NCCCN2CCCCC2)CCO1	ZINC000875008388	GD	On-Demand	Anodyne	ADRA1D	42	39
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NCCCN2CCCCC2)CCO1	ZINC000875008388	GD	On-Demand	Anodyne	HTR2A	24	40
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NCCCN2CCCCC2)CCO1	ZINC000875008388	GD	On-Demand	Anodyne	ADRA1A	51	44
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NCCCN2CCCCC2)CCO1	ZINC000875008388	GD	On-Demand	Anodyne	DRD3	62	41
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NCCCN2CCCCC2)CCO1	ZINC000875008388	GD	On-Demand	Anodyne	HTR4	26	43
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NCCCN2CCCCC2)CCO1	ZINC000875008388	GD	On-Demand	Anodyne	SIGMAR1	15	43
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NCCCN2CCCCC2)CCO1	ZINC000875008388	GD	On-Demand	Anodyne	CCR3	21	40
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NCCCN2CCCCC2)CCO1	ZINC000875008388	GD	On-Demand	Anodyne	CHRNA7	19	49
COc1ccccc1[C@H]1CN(C(=O)C(=O)NCCCN2CCCCC2)CCO1	ZINC000875008389	GD	On-Demand	Anodyne	HTR1A	51	44
COc1ccccc1[C@H]1CN(C(=O)C(=O)NCCCN2CCCCC2)CCO1	ZINC000875008389	GD	On-Demand	Anodyne	DRD2	46	43
COc1ccccc1[C@H]1CN(C(=O)C(=O)NCCCN2CCCCC2)CCO1	ZINC000875008389	GD	On-Demand	Anodyne	DRD4	33	41
COc1ccccc1[C@H]1CN(C(=O)C(=O)NCCCN2CCCCC2)CCO1	ZINC000875008389	GD	On-Demand	Anodyne	ADRA1D	42	39
COc1ccccc1[C@H]1CN(C(=O)C(=O)NCCCN2CCCCC2)CCO1	ZINC000875008389	GD	On-Demand	Anodyne	HTR2A	24	40
COc1ccccc1[C@H]1CN(C(=O)C(=O)NCCCN2CCCCC2)CCO1	ZINC000875008389	GD	On-Demand	Anodyne	ADRA1A	51	44
COc1ccccc1[C@H]1CN(C(=O)C(=O)NCCCN2CCCCC2)CCO1	ZINC000875008389	GD	On-Demand	Anodyne	DRD3	62	41
COc1ccccc1[C@H]1CN(C(=O)C(=O)NCCCN2CCCCC2)CCO1	ZINC000875008389	GD	On-Demand	Anodyne	HTR4	26	43
COc1ccccc1[C@H]1CN(C(=O)C(=O)NCCCN2CCCCC2)CCO1	ZINC000875008389	GD	On-Demand	Anodyne	SIGMAR1	15	43
COc1ccccc1[C@H]1CN(C(=O)C(=O)NCCCN2CCCCC2)CCO1	ZINC000875008389	GD	On-Demand	Anodyne	CCR3	21	40
COc1ccccc1[C@H]1CN(C(=O)C(=O)NCCCN2CCCCC2)CCO1	ZINC000875008389	GD	On-Demand	Anodyne	CHRNA7	19	49
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1cc[n+]([O-])cc1	ZINC000875008392	GH	On-Demand	Anodyne	SCD1	44	50
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1cc[n+]([O-])cc1	ZINC000875008392	GH	On-Demand	Anodyne	SCD	42	50
O=C(NCCc1ccccc1F)N1CCC(CO)(CO)CC1	ZINC000875008393	DD	On-Demand	Anodyne	EPHX2	19	42
CCC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccccc1	ZINC000875008398	EG	On-Demand	Anodyne	SLC6A4	29	44
CCC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccccc1	ZINC000875008398	EG	On-Demand	Anodyne	SLC6A3	68	44
CCC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccccc1	ZINC000875008398	EG	On-Demand	Anodyne	CCR5	35	40
CCC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccccc1	ZINC000875008399	EG	On-Demand	Anodyne	SLC6A4	29	44
CCC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccccc1	ZINC000875008399	EG	On-Demand	Anodyne	SLC6A3	68	44
CCC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccccc1	ZINC000875008399	EG	On-Demand	Anodyne	CCR5	35	40
Cn1nccc1C(NC(=O)C(=O)NCCCN1CCCCC1)c1ccnn1C	ZINC000875008408	GC	On-Demand	Anodyne	HTR1A	23	40
Cn1nccc1C(NC(=O)C(=O)NCCCN1CCCCC1)c1ccnn1C	ZINC000875008408	GC	On-Demand	Anodyne	DRD3	46	38
Cn1nccc1C(NC(=O)C(=O)NCCCN1CCCCC1)c1ccnn1C	ZINC000875008408	GC	On-Demand	Anodyne	CHRNA7	21	45
Cn1nccc1C(NC(=O)C(=O)NCCCN1CCCCC1)c1ccnn1C	ZINC000875008408	GC	On-Demand	Anodyne	HNMT	62	35
Cn1nccc1C(NC(=O)C(=O)NCCCN1CCCCC1)c1ccnn1C	ZINC000875008408	GC	On-Demand	Anodyne	CAPN2	15	40
O=C(NCCCN1CCCCC1)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875008409	GD	On-Demand	Anodyne	CHRNA7	17	42
O=C(NCCCN1CCCCC1)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875008409	GD	On-Demand	Anodyne	ROCK1	25	50
O=C(NCCCN1CCCCC1)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875008409	GD	On-Demand	Anodyne	ROCK2	18	50
O=C(NCCCN1CCCCC1)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875008409	GD	On-Demand	Anodyne	HNMT	47	32
O=C(N[C@@H](c1ccccc1)c1ccc(Cl)cc1)N[C@@H]1CCOC[C@H]1O	ZINC000875008440	FF	On-Demand	Anodyne	PRCP	30	43
COCC(C)(C)CCNC(=O)C(=O)NCCc1ccc2c(c1)OCO2	ZINC000875008458	FD	On-Demand	Anodyne	BMP1	55	36
COCC(C)(C)CCNC(=O)C(=O)NCCc1ccc2c(c1)OCO2	ZINC000875008458	FD	On-Demand	Anodyne	NOS2	67	37
C[C@H](NC(=O)C(=O)NCCCN1CCCCC1)c1ccnn1C	ZINC000875008466	DC	On-Demand	Anodyne	CHRNA7	21	41
C[C@H](NC(=O)C(=O)NCCCN1CCCCC1)c1ccnn1C	ZINC000875008466	DC	On-Demand	Anodyne	HNMT	61	34
C[C@H](NC(=O)C(=O)NCCCN1CCCCC1)c1ccnn1C	ZINC000875008466	DC	On-Demand	Anodyne	CAPN2	17	42
O=C(NCCc1ccc2c(c1)OCO2)C(=O)N[C@H]1CC12CCC2	ZINC000875008467	DD	On-Demand	Anodyne	NOS2	77	38
O=C(NCCc1ccc2c(c1)OCO2)C(=O)N[C@@H]1CC12CCC2	ZINC000875008468	DD	On-Demand	Anodyne	NOS2	77	38
C[C@@H](NC(=O)N1CCCCCCNC(=O)CC1)c1ccc2c(c1)OCCO2	ZINC000875008472	GF	On-Demand	Anodyne	KCNQ2	21	40
O=C(NC1C2CC3CC(C2)CC1C3)N1CCC2(CCNC2=O)CC1	ZINC000875008473	EE	On-Demand	Anodyne	HSD11B1	42	33
O=Cc1ccccc1OCC(=O)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000875008491	HJ	On-Demand	Anodyne	SCD1	40	45
O=Cc1ccccc1OCC(=O)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000875008491	HJ	On-Demand	Anodyne	SCD	38	45
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccc2c(c1)OCCO2	ZINC000875008499	ED	On-Demand	Anodyne	KCNQ2	23	43
CC(=O)C1CCN(C(=O)C(=O)NCCc2ccc3c(c2)OCO3)CC1	ZINC000875008501	EC	On-Demand	Anodyne	NOS2	96	42
CC(=O)C1CCN(C(=O)C(=O)NCCc2ccc3c(c2)OCO3)CC1	ZINC000875008501	EC	On-Demand	Anodyne	MCHR1	22	41
COC(=O)N(C)NC(=O)NCCc1ccccc1F	ZINC000875008502	CD	On-Demand	Reactive	NQO2	40	44
COC(=O)N(C)NC(=O)NCCc1ccccc1F	ZINC000875008502	CD	On-Demand	Reactive	MTNR1A	67	45
COC(=O)N(C)NC(=O)NCCc1ccccc1F	ZINC000875008502	CD	On-Demand	Reactive	MTNR1B	39	42
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1ccc(Cl)nc1	ZINC000875008509	GK	On-Demand	Anodyne	SCD1	48	51
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1ccc(Cl)nc1	ZINC000875008509	GK	On-Demand	Anodyne	SCD	44	51
Cc1ccccc1CNC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875008513	DH	On-Demand	Anodyne	P2RX7	20	43
Cc1ccccc1CNC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875008513	DH	On-Demand	Anodyne	EPHX2	37	48
Cc1ccccc1CNC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875008513	DH	On-Demand	Anodyne	CCR8	45	36
CCC[C@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875008514	DG	On-Demand	Anodyne	GRIN2B	19	43
CCC[C@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875008514	DG	On-Demand	Anodyne	CCR5	53	40
CCC[C@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875008514	DG	On-Demand	Anodyne	AMY2	44	30
CCC[C@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875008515	DG	On-Demand	Anodyne	GRIN2B	19	43
CCC[C@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875008515	DG	On-Demand	Anodyne	CCR5	53	40
CCC[C@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875008515	DG	On-Demand	Anodyne	AMY2	44	30
Cc1ccccc1CNC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875008520	DH	On-Demand	Anodyne	P2RX7	20	43
Cc1ccccc1CNC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875008520	DH	On-Demand	Anodyne	EPHX2	37	48
Cc1ccccc1CNC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875008520	DH	On-Demand	Anodyne	CCR8	45	36
CCC[C@H](NC(=O)NNc1nnc(C)n1C)c1ccccc1	ZINC000875008524	DE	On-Demand	Reactive	CCR5	22	40
CCC[C@H](NC(=O)NNc1nnc(C)n1C)c1ccccc1	ZINC000875008524	DE	On-Demand	Reactive	TACR3	32	40
Cc1ccccc1CNC(=O)N1CCC(C)(N2CCCCC2)CC1	ZINC000875008525	EH	On-Demand	Anodyne	CCR5	43	46
Cc1ccccc1CNC(=O)N1CCC(C)(N2CCCCC2)CC1	ZINC000875008525	EH	On-Demand	Anodyne	EPHX2	15	41
Cc1ccccc1CNC(=O)N1CCC(C)(N2CCCCC2)CC1	ZINC000875008525	EH	On-Demand	Anodyne	HCN1	59	36
Cc1ccccc1CNC(=O)N1CCC(C)(N2CCCCC2)CC1	ZINC000875008525	EH	On-Demand	Anodyne	HCN4	50	32
COc1cc(CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)ccc1OC(F)F	ZINC000875008546	GD	On-Demand	Anodyne	MT-ND1	18	40
COc1cc(CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)ccc1OC(F)F	ZINC000875008548	GD	On-Demand	Anodyne	MT-ND1	18	40
CNC(=O)CNC(=O)NCC1(c2ccccc2)CCN(C)CC1	ZINC000875008568	DC	On-Demand	Anodyne	KCNA3	49	42
CNC(=O)CNC(=O)NCC1(c2ccccc2)CCN(C)CC1	ZINC000875008568	DC	On-Demand	Anodyne	SOAT1	17	45
CNC(=O)CNC(=O)NCC1(c2ccccc2)CCN(C)CC1	ZINC000875008568	DC	On-Demand	Anodyne	NPFFR1	42	53
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cccc(Cl)c1	ZINC000875008575	EF	On-Demand	Anodyne	SLC6A4	33	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cccc(Cl)c1	ZINC000875008575	EF	On-Demand	Anodyne	SLC6A3	57	45
COc1ccccc1[C@@H]1CN(C(=O)NCc2ccccc2C)CCO1	ZINC000875008581	EG	On-Demand	Anodyne	DRD4	18	41
COc1ccccc1[C@H]1CN(C(=O)NCc2ccccc2C)CCO1	ZINC000875008583	EG	On-Demand	Anodyne	DRD4	18	41
COc1ccccc1[C@H]1CCCN(C(=O)NCC(=O)N(C)C)CC1	ZINC000875008585	EE	On-Demand	Anodyne	DRD2	16	45
COc1ccccc1[C@H]1CCCN(C(=O)NCC(=O)N(C)C)CC1	ZINC000875008585	EE	On-Demand	Anodyne	RBP4	35	41
COc1ccccc1[C@H]1CCCN(C(=O)NCC(=O)N(C)C)CC1	ZINC000875008585	EE	On-Demand	Anodyne	MBTPS1	45	35
COc1ccccc1[C@@H]1CCCN(C(=O)NCC(=O)N(C)C)CC1	ZINC000875008587	EE	On-Demand	Anodyne	DRD2	16	45
COc1ccccc1[C@@H]1CCCN(C(=O)NCC(=O)N(C)C)CC1	ZINC000875008587	EE	On-Demand	Anodyne	RBP4	35	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCC(=O)N(C)C)CC1	ZINC000875008587	EE	On-Demand	Anodyne	MBTPS1	45	35
O=C(NC[C@H]1C[C@H](O)C1)NC1C2CC3CC(C2)CC1C3	ZINC000875008604	CD	On-Demand	Anodyne	HSD11B1	45	38
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1C	ZINC000875008613	CE	On-Demand	Anodyne	ANPEP	31	61
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1C	ZINC000875008613	CE	On-Demand	Anodyne	AMP1_PLAFQ	24	43
O=C(NCCCN1CCCCC1)C(=O)NCc1ncc(Br)s1	ZINC000875008640	GD	On-Demand	Anodyne	HNMT	45	33
O=C(NCCCN1CCCCC1)C(=O)NCc1cccc2ncccc12	ZINC000875008650	FD	On-Demand	Anodyne	HTR1A	47	47
O=C(NCCCN1CCCCC1)C(=O)NCc1cccc2ncccc12	ZINC000875008650	FD	On-Demand	Anodyne	DRD2	42	47
O=C(NCCCN1CCCCC1)C(=O)NCc1cccc2ncccc12	ZINC000875008650	FD	On-Demand	Anodyne	DRD4	20	47
O=C(NCCCN1CCCCC1)C(=O)NCc1cccc2ncccc12	ZINC000875008650	FD	On-Demand	Anodyne	ACHE	18	40
O=C(NCCCN1CCCCC1)C(=O)NCc1cccc2ncccc12	ZINC000875008650	FD	On-Demand	Anodyne	ADRA1D	21	40
O=C(NCCCN1CCCCC1)C(=O)NCc1cccc2ncccc12	ZINC000875008650	FD	On-Demand	Anodyne	HTR2A	44	42
O=C(NCCCN1CCCCC1)C(=O)NCc1cccc2ncccc12	ZINC000875008650	FD	On-Demand	Anodyne	ADRA1A	28	40
O=C(NCCCN1CCCCC1)C(=O)NCc1cccc2ncccc12	ZINC000875008650	FD	On-Demand	Anodyne	DRD3	50	47
O=C(NCCCN1CCCCC1)C(=O)NCc1cccc2ncccc12	ZINC000875008650	FD	On-Demand	Anodyne	HRP1_PLAFA	55	42
O=C(NCCCN1CCCCC1)C(=O)NCc1cccc2ncccc12	ZINC000875008650	FD	On-Demand	Anodyne	HTR7	57	37
O=C(NCCCN1CCCCC1)C(=O)NCc1cccc2ncccc12	ZINC000875008650	FD	On-Demand	Anodyne	HRH3	29	53
O=C(NCCCN1CCCCC1)C(=O)NCc1cccc2ncccc12	ZINC000875008650	FD	On-Demand	Anodyne	CHRNA7	18	44
O=C(NCCCN1CCCCC1)C(=O)NCc1cccc2ncccc12	ZINC000875008650	FD	On-Demand	Anodyne	HNMT	125	53
CC(=O)N1CCC[C@@H](C(=O)NNC(=O)NC2C3CC4CC(C3)CC2C4)[C@H]1C	ZINC000875008651	GD	On-Demand	Reactive	HSD11B1	50	40
Cc1ccccc1CNC(=O)N1CCC[C@@H](C(=O)N[C@H]2CCC[C@@H](O)C2)C1	ZINC000875008653	FE	On-Demand	Anodyne	EPHX2	38	42
Cc1ccccc1CNC(=O)N1CCC[C@@H](C(=O)N[C@@H]2CCC[C@@H](O)C2)C1	ZINC000875008654	FE	On-Demand	Anodyne	EPHX2	38	42
Cc1ccccc1CNC(=O)N1CCC[C@@H](C(=O)N[C@@H]2CCC[C@H](O)C2)C1	ZINC000875008655	FE	On-Demand	Anodyne	EPHX2	38	42
Cc1ccccc1CNC(=O)N1CCC[C@@H](C(=O)N[C@H]2CCC[C@H](O)C2)C1	ZINC000875008656	FE	On-Demand	Anodyne	EPHX2	38	42
Cc1ccccc1CNC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875008661	DG	On-Demand	Anodyne	P2RX7	19	44
Cc1ccccc1CNC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875008661	DG	On-Demand	Anodyne	EPHX2	22	44
Nc1ccc(C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)cc1[N+](=O)[O-]	ZINC000875008662	HI	On-Demand	Bother	SCD1	45	50
Nc1ccc(C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)cc1[N+](=O)[O-]	ZINC000875008662	HI	On-Demand	Bother	SCD	42	50
N#Cc1c(NC(=O)c2cc(C(F)(F)F)ncn2)sc2c1CCCCC2	ZINC000875008673	FH	On-Demand	Mild	VIPR1	30	47
CC(=O)[C@H]1CCCN(C(=O)NCc2ccccc2C)C1	ZINC000875008678	CF	On-Demand	Anodyne	SLC6A1	96	39
CC(=O)[C@H]1CCCN(C(=O)NCc2ccccc2C)C1	ZINC000875008678	CF	On-Demand	Anodyne	P2RX7	28	45
CC(=O)[C@H]1CCCN(C(=O)NCc2ccccc2C)C1	ZINC000875008678	CF	On-Demand	Anodyne	EPHX2	28	45
CC(=O)[C@H]1CCCN(C(=O)NCc2ccccc2C)C1	ZINC000875008678	CF	On-Demand	Anodyne	DPP7	44	37
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccccc2C)C1	ZINC000875008679	CF	On-Demand	Anodyne	SLC6A1	96	39
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccccc2C)C1	ZINC000875008679	CF	On-Demand	Anodyne	P2RX7	28	45
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccccc2C)C1	ZINC000875008679	CF	On-Demand	Anodyne	EPHX2	28	45
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccccc2C)C1	ZINC000875008679	CF	On-Demand	Anodyne	DPP7	44	37
CNC(=O)CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875008703	DD	On-Demand	Mild	CTSF	70	35
CNC(=O)CNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875008704	DD	On-Demand	Mild	CTSF	70	35
CONC(=O)C1CCN(C(=O)NC2C3CC4CC(C3)CC2C4)CC1	ZINC000875008706	ED	On-Demand	Anodyne	HSD11B1	49	42
COC(=O)N(C)NC(=O)NCCc1cccc(Cl)c1	ZINC000875008721	CD	On-Demand	Reactive	MTNR1A	39	42
COC(=O)N(C)NC(=O)NCCc1cccc(Cl)c1	ZINC000875008721	CD	On-Demand	Reactive	MTNR1B	26	42
O=C(N[C@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2ccccc2F)C1	ZINC000875008730	GE	On-Demand	Anodyne	EPHX2	19	42
O=C(N[C@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2ccccc2F)C1	ZINC000875008730	GE	On-Demand	Anodyne	BIRC2	22	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cn2ccccc2n1	ZINC000875008731	ED	On-Demand	Anodyne	SLC6A3	47	37
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2ccccc2F)C1	ZINC000875008732	GE	On-Demand	Anodyne	EPHX2	19	42
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2ccccc2F)C1	ZINC000875008732	GE	On-Demand	Anodyne	BIRC2	22	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cn2ccccc2n1	ZINC000875008733	ED	On-Demand	Anodyne	SLC6A3	47	37
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2ccccc2F)C1	ZINC000875008734	GE	On-Demand	Anodyne	EPHX2	19	42
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2ccccc2F)C1	ZINC000875008734	GE	On-Demand	Anodyne	BIRC2	22	43
O=C(N[C@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2ccccc2F)C1	ZINC000875008736	GE	On-Demand	Anodyne	EPHX2	19	42
O=C(N[C@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2ccccc2F)C1	ZINC000875008736	GE	On-Demand	Anodyne	BIRC2	22	43
N#Cc1c(NC(=O)Cn2ncc3cccnc32)sc2c1CCCCC2	ZINC000875008739	FG	On-Demand	Mild	VIPR1	33	54
Cn1nnnc1C1CCN(C(=O)NC2C3CC4CC(C3)CC2C4)CC1	ZINC000875008753	ED	On-Demand	Anodyne	HSD11B1	44	36
CCCCCCCCCNC(=O)C(=O)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875008765	DE	On-Demand	Mild	ASAH1	63	33
CCCCCCCCCNC(=O)C(=O)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875008766	DE	On-Demand	Mild	ASAH1	63	33
CCC[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccccc1	ZINC000875008768	CF	On-Demand	Anodyne	TACR3	29	40
CC(=O)C1CCN(C(=O)NC2C3CC4CC(C3)CC2C4)CC1	ZINC000875008769	DF	On-Demand	Anodyne	HSD11B1	49	40
CC(=O)C1CCN(C(=O)NC2C3CC4CC(C3)CC2C4)CC1	ZINC000875008769	DF	On-Demand	Anodyne	EPHX2	17	41
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1cnc(Cl)c(Cl)c1	ZINC000875008776	IK	On-Demand	Anodyne	SCD1	47	50
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1cnc(Cl)c(Cl)c1	ZINC000875008776	IK	On-Demand	Anodyne	SCD	43	50
Cc1ccccc1CNC(=O)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875008781	GH	On-Demand	Anodyne	ABL1	15	44
Cc1ccccc1CNC(=O)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875008781	GH	On-Demand	Anodyne	EPHX2	24	42
O=C(NCCc1cccc(Cl)c1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875008782	FG	On-Demand	Anodyne	EPHX2	17	42
O=C(NCCc1cccc(Cl)c1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875008783	FG	On-Demand	Anodyne	EPHX2	17	42
Cc1ccccc1CNC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875008790	ED	On-Demand	Anodyne	CHRM2	33	42
Cc1ccccc1CNC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875008790	ED	On-Demand	Anodyne	P2RX7	24	45
Cc1ccccc1CNC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875008790	ED	On-Demand	Anodyne	EPHX2	30	43
Cc1ccccc1CNC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875008790	ED	On-Demand	Anodyne	CCR8	58	39
Cc1ccccc1CNC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875008790	ED	On-Demand	Anodyne	L3MBTL3	85	44
O=C(Cc1cccs1)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000875008793	GJ	On-Demand	Anodyne	CSNK1D	33	42
O=C(Cc1cccs1)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000875008793	GJ	On-Demand	Anodyne	CA5B	37	46
O=C(Cc1cccs1)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000875008793	GJ	On-Demand	Anodyne	CA5A	37	46
O=C(Cc1cccs1)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000875008793	GJ	On-Demand	Anodyne	CDK5	32	40
O=C(Cc1cccs1)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000875008793	GJ	On-Demand	Anodyne	SCD1	37	42
O=C(Cc1cccs1)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000875008793	GJ	On-Demand	Anodyne	SCD	36	44
O=C(NCCc1ccc2c(c1)OCO2)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875008818	GE	On-Demand	Anodyne	NOS2	87	43
O=C(NCCc1ccc2c(c1)OCO2)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875008818	GE	On-Demand	Anodyne	MCHR1	21	40
O=C(NCCc1ccc2c(c1)OCO2)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875008819	GE	On-Demand	Anodyne	NOS2	87	43
O=C(NCCc1ccc2c(c1)OCO2)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875008819	GE	On-Demand	Anodyne	MCHR1	21	40
N#Cc1c(NC(=O)CN2CCCCC(=O)C2=O)sc2c1CCCCC2	ZINC000875008822	FE	On-Demand	Mild	VIPR1	33	53
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCCCN2CCCCC2)c1	ZINC000875008830	FE	On-Demand	Anodyne	HNMT	41	36
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCCCN2CCCCC2)c1	ZINC000875008835	FE	On-Demand	Anodyne	HNMT	41	36
Cc1ccccc1CNC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875008836	DD	On-Demand	Anodyne	CACNA1H	46	31
Cc1ccccc1CNC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875008847	DF	On-Demand	Anodyne	P2RX7	24	41
Cc1ccccc1CNC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875008847	DF	On-Demand	Anodyne	EPHX2	27	44
Cc1ccccc1CNC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875008848	DF	On-Demand	Anodyne	P2RX7	24	41
Cc1ccccc1CNC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875008848	DF	On-Demand	Anodyne	EPHX2	27	44
CCC[C@H](NC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1ccccc1	ZINC000875008856	EH	On-Demand	Anodyne	CCR5	35	42
CCC[C@H](NC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1ccccc1	ZINC000875008856	EH	On-Demand	Anodyne	RBP4	46	36
Cc1ccccc1CNC(=O)N1CC[C@H]2[C@H](CCN2C)C1	ZINC000875008861	CE	On-Demand	Anodyne	P2RX7	24	43
Cc1ccccc1CNC(=O)N1CC[C@H]2[C@H](CCN2C)C1	ZINC000875008861	CE	On-Demand	Anodyne	CCR8	58	38
Cc1ccccc1CNC(=O)N1CC[C@H]2[C@@H](CCN2C)C1	ZINC000875008862	CE	On-Demand	Anodyne	P2RX7	24	43
Cc1ccccc1CNC(=O)N1CC[C@H]2[C@@H](CCN2C)C1	ZINC000875008862	CE	On-Demand	Anodyne	CCR8	58	38
Cc1ccccc1CNC(=O)N1CC[C@@H]2[C@H](CCN2C)C1	ZINC000875008863	CE	On-Demand	Anodyne	P2RX7	24	43
Cc1ccccc1CNC(=O)N1CC[C@@H]2[C@H](CCN2C)C1	ZINC000875008863	CE	On-Demand	Anodyne	CCR8	58	38
Cc1ccccc1CNC(=O)N1CC[C@@H]2[C@@H](CCN2C)C1	ZINC000875008864	CE	On-Demand	Anodyne	P2RX7	24	43
Cc1ccccc1CNC(=O)N1CC[C@@H]2[C@@H](CCN2C)C1	ZINC000875008864	CE	On-Demand	Anodyne	CCR8	58	38
Cc1ccccc1CNC(=O)N(C)OCC(F)(F)F	ZINC000875008876	CF	On-Demand	Anodyne	SCN10A	15	40
CCC[C@H](NC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1ccccc1	ZINC000875008887	EH	On-Demand	Anodyne	CCR5	35	42
CCC[C@H](NC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1ccccc1	ZINC000875008887	EH	On-Demand	Anodyne	RBP4	46	36
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCn2c(C)nc3ccccc32)C1	ZINC000875008888	FD	On-Demand	Anodyne	CCR5	15	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCn2c(C)nc3ccccc32)C1	ZINC000875008888	FD	On-Demand	Anodyne	PDE6D	38	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCn2c(C)nc3ccccc32)C1	ZINC000875008889	FD	On-Demand	Anodyne	CCR5	15	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCn2c(C)nc3ccccc32)C1	ZINC000875008889	FD	On-Demand	Anodyne	PDE6D	38	43
CC(=O)N(C)c1ccc(CNC(=O)NCc2ccccc2C)cc1	ZINC000875008903	EF	On-Demand	Anodyne	AMP1_PLAFQ	20	43
Cc1ccccc1CNC(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875008913	DF	On-Demand	Anodyne	AVPR2	22	41
Cc1ccccc1CNC(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875008913	DF	On-Demand	Anodyne	P2RX7	28	49
Cc1ccccc1CNC(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875008913	DF	On-Demand	Anodyne	PREP	28	40
O=C(NCCCN1CCCCC1)C(=O)NCc1cn(C(F)F)c2ccccc12	ZINC000875008943	GF	On-Demand	Anodyne	CHRNA7	15	41
O=C(NCCCN1CCCCC1)C(=O)NCc1cn(C(F)F)c2ccccc12	ZINC000875008943	GF	On-Demand	Anodyne	HNMT	77	36
COCC1CC(NC(=O)NC2C3CC4CC(C3)CC2C4)C1	ZINC000875008944	CF	On-Demand	Anodyne	HSD11B1	44	35
Cc1ccn(C[C@H](C)C(=O)Nc2sc3c(c2C#N)CCCCC3)n1	ZINC000875008949	EH	On-Demand	Mild	VIPR1	32	52
Cc1ccccc1CNC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O	ZINC000875008963	FE	On-Demand	Anodyne	CCR8	62	35
Cc1ccccc1CNC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O	ZINC000875008963	FE	On-Demand	Anodyne	GPR119	38	48
Cc1ccccc1CNC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O	ZINC000875008964	FE	On-Demand	Anodyne	CCR8	62	35
Cc1ccccc1CNC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O	ZINC000875008964	FE	On-Demand	Anodyne	GPR119	38	48
Cc1ccccc1CNC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O	ZINC000875008965	FE	On-Demand	Anodyne	CCR8	62	35
Cc1ccccc1CNC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O	ZINC000875008965	FE	On-Demand	Anodyne	GPR119	38	48
Cc1ccccc1CNC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O	ZINC000875008966	FE	On-Demand	Anodyne	CCR8	62	35
Cc1ccccc1CNC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O	ZINC000875008966	FE	On-Demand	Anodyne	GPR119	38	48
Cc1ccccc1CNC(=O)N1CC[C@H](C(F)(F)F)O[C@@H](C)C1	ZINC000875008972	EG	On-Demand	Anodyne	EPHX2	20	43
Cc1ccccc1CNC(=O)N1CC[C@@H](C(F)(F)F)O[C@@H](C)C1	ZINC000875008973	EG	On-Demand	Anodyne	EPHX2	20	43
Cc1ccccc1CNC(=O)N1CC[C@@H](C(F)(F)F)O[C@H](C)C1	ZINC000875008975	EG	On-Demand	Anodyne	EPHX2	20	43
O=C(NCCCN1CCCCC1)C(=O)NCc1ccc(Br)cn1	ZINC000875008976	GD	On-Demand	Anodyne	HRH3	29	40
O=C(NCCCN1CCCCC1)C(=O)NCc1ccc(Br)cn1	ZINC000875008976	GD	On-Demand	Anodyne	CHRNA7	17	41
O=C(NCCCN1CCCCC1)C(=O)NCc1ccc(Br)cn1	ZINC000875008976	GD	On-Demand	Anodyne	HNMT	65	37
Cc1ccccc1CNC(=O)N1CC[C@H](C(F)(F)F)O[C@H](C)C1	ZINC000875008977	EG	On-Demand	Anodyne	EPHX2	20	43
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1cc(Cl)ccc1[N+](=O)[O-]	ZINC000875008980	IK	On-Demand	Bother	SCD1	41	42
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1cc(Cl)ccc1[N+](=O)[O-]	ZINC000875008980	IK	On-Demand	Bother	SCD	37	42
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1cc([N+](=O)[O-])ccc1Cl	ZINC000875008981	IK	On-Demand	Bother	SCD1	40	43
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1cc([N+](=O)[O-])ccc1Cl	ZINC000875008981	IK	On-Demand	Bother	SCD	37	43
CNC(=O)CNC(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875008984	DD	On-Demand	Anodyne	C3AR1	40	40
CNC(=O)CNC(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875008986	DD	On-Demand	Anodyne	C3AR1	40	40
C[C@H]1CC(=O)N[C@@H](C(=O)Nc2sc3c(c2C#N)CCCCC3)C1	ZINC000875008987	EF	On-Demand	Mild	VIPR1	30	46
CNC(=O)CNC(=O)NCCc1c[nH]c2cc(F)c(C)cc12	ZINC000875008995	DD	On-Demand	Anodyne	MPO	64	45
Cc1ccccc1CNC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875008996	DF	On-Demand	Anodyne	P2RX7	27	46
O=C(NCCc1ccc2c(c1)OCO2)C(=O)NCC[C@@H]1CCSC1	ZINC000875009000	FD	On-Demand	Anodyne	NOS2	72	40
O=C(NCCc1ccc2c(c1)OCO2)C(=O)NCC[C@H]1CCSC1	ZINC000875009002	FD	On-Demand	Anodyne	NOS2	72	40
Cc1ccccc1CNC(=O)N[C@@H](C)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875009015	EG	On-Demand	Anodyne	GPR119	15	47
Cc1ccccc1CNC(=O)N[C@H](C)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875009017	EG	On-Demand	Anodyne	GPR119	15	47
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCCc2ccc3c(c2)OCO3)c1	ZINC000875009024	GE	On-Demand	Anodyne	NOS2	99	46
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCCc2ccc3c(c2)OCO3)c1	ZINC000875009026	GE	On-Demand	Anodyne	NOS2	99	46
C#CC[C@@H](COC)NC(=O)C(=O)NCCn1c(C)nc2ccccc21	ZINC000875009048	EC	On-Demand	Mild	PDE6D	44	43
C#CC[C@H](COC)NC(=O)C(=O)NCCn1c(C)nc2ccccc21	ZINC000875009052	EC	On-Demand	Mild	PDE6D	44	43
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccccc2C)C1	ZINC000875009065	DE	On-Demand	Anodyne	ACE	22	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccccc2C)C1	ZINC000875009065	DE	On-Demand	Anodyne	AMP1_PLAFQ	31	44
Cc1ccccc1CNC(=O)N(C)C[C@@H]1CN(c2ccccc2)C(=O)O1	ZINC000875009079	FG	On-Demand	Anodyne	P2RX7	17	40
Cc1ccccc1CNC(=O)N(C)C[C@H]1CN(c2ccccc2)C(=O)O1	ZINC000875009080	FG	On-Demand	Anodyne	P2RX7	17	40
Cc1ccccc1CNC(=O)N1CC2(CC(=O)N2Cc2ccccc2)C1	ZINC000875009082	EF	On-Demand	Anodyne	P2RX7	23	42
Cc1ccccc1CNC(=O)N1CC2(CC(=O)N2Cc2ccccc2)C1	ZINC000875009082	EF	On-Demand	Anodyne	AMP1_PLAFQ	19	43
O=C(NCc1cn2ccccc2n1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875009086	GG	On-Demand	Anodyne	SMO	42	48
O=C(NCc1cn2ccccc2n1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875009086	GG	On-Demand	Anodyne	ETHR	65	45
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCn2c(C)nc3ccccc32)C1	ZINC000875009096	FD	On-Demand	Anodyne	PDE6D	23	43
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCCc2ccccc2F)[C@@H](O)C1	ZINC000875009106	GE	On-Demand	Anodyne	GPR119	42	55
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NCCc2ccccc2F)[C@@H](O)C1	ZINC000875009107	GE	On-Demand	Anodyne	GPR119	42	55
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCCc2ccccc2F)[C@H](O)C1	ZINC000875009108	GE	On-Demand	Anodyne	GPR119	42	55
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NCCc2ccccc2F)[C@H](O)C1	ZINC000875009109	GE	On-Demand	Anodyne	GPR119	42	55
O=C(N[C@@H](c1ccccc1)c1ccc(Cl)cc1)N1CCC(CO)(CO)CC1	ZINC000875009111	GG	On-Demand	Anodyne	CACNA1H	58	42
O=C(N[C@@H](c1ccccc1)c1ccc(Cl)cc1)N1CCC(CO)(CO)CC1	ZINC000875009111	GG	On-Demand	Anodyne	PRCP	30	45
O=C(N[C@@H](c1ccccc1)c1ccc(Cl)cc1)N1CCC(CO)(CO)CC1	ZINC000875009111	GG	On-Demand	Anodyne	CCR1	57	40
O=C(N[C@@H](c1ccccc1)c1ccc(Cl)cc1)N1CCC(CO)(CO)CC1	ZINC000875009111	GG	On-Demand	Anodyne	EPHX2	16	42
O=C(N[C@H](c1ccccc1)c1ccc(Cl)cc1)N1CCC(CO)(CO)CC1	ZINC000875009113	GG	On-Demand	Anodyne	CACNA1H	58	42
O=C(N[C@H](c1ccccc1)c1ccc(Cl)cc1)N1CCC(CO)(CO)CC1	ZINC000875009113	GG	On-Demand	Anodyne	PRCP	30	45
O=C(N[C@H](c1ccccc1)c1ccc(Cl)cc1)N1CCC(CO)(CO)CC1	ZINC000875009113	GG	On-Demand	Anodyne	CCR1	57	40
O=C(N[C@H](c1ccccc1)c1ccc(Cl)cc1)N1CCC(CO)(CO)CC1	ZINC000875009113	GG	On-Demand	Anodyne	EPHX2	16	42
CN1CCN(C2CCN(C(=O)NC3C4CC5CC(C4)CC3C5)CC2)CC1	ZINC000875009118	FE	On-Demand	Anodyne	HSD11B1	45	37
CN1CCN(C2CCN(C(=O)NC3C4CC5CC(C4)CC3C5)CC2)CC1	ZINC000875009118	FE	On-Demand	Anodyne	L3MBTL3	46	40
CCC[C@H](NC(=O)N(C)OCC(F)(F)F)c1ccccc1	ZINC000875009125	DH	On-Demand	Anodyne	UTS2	53	38
O=C1CC[C@H](C(=O)NNC(=O)NC2C3CC4CC(C3)CC2C4)N1	ZINC000875009141	DC	On-Demand	Reactive	HSD11B1	42	33
O=C1CC[C@@H](C(=O)NNC(=O)NC2C3CC4CC(C3)CC2C4)N1	ZINC000875009143	DC	On-Demand	Reactive	HSD11B1	42	33
CC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1	ZINC000875009144	FI	On-Demand	Anodyne	CACNA1H	43	39
CC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1	ZINC000875009144	FI	On-Demand	Anodyne	CNR1	17	53
CC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1	ZINC000875009144	FI	On-Demand	Anodyne	SLC6A3	26	46
CC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1	ZINC000875009144	FI	On-Demand	Anodyne	PRCP	43	47
CC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1	ZINC000875009144	FI	On-Demand	Anodyne	CCR1	60	42
CC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1	ZINC000875009144	FI	On-Demand	Anodyne	CCR5	20	40
CC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1	ZINC000875009144	FI	On-Demand	Anodyne	EPHX2	30	42
CC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1	ZINC000875009144	FI	On-Demand	Anodyne	BIRC8	57	37
CC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)c2ccc(Cl)cc2)CC1	ZINC000875009151	FI	On-Demand	Anodyne	CACNA1H	43	39
CC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)c2ccc(Cl)cc2)CC1	ZINC000875009151	FI	On-Demand	Anodyne	CNR1	17	53
CC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)c2ccc(Cl)cc2)CC1	ZINC000875009151	FI	On-Demand	Anodyne	SLC6A3	26	46
CC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)c2ccc(Cl)cc2)CC1	ZINC000875009151	FI	On-Demand	Anodyne	PRCP	43	47
CC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)c2ccc(Cl)cc2)CC1	ZINC000875009151	FI	On-Demand	Anodyne	CCR1	60	42
CC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)c2ccc(Cl)cc2)CC1	ZINC000875009151	FI	On-Demand	Anodyne	CCR5	20	40
CC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)c2ccc(Cl)cc2)CC1	ZINC000875009151	FI	On-Demand	Anodyne	EPHX2	30	42
CC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)c2ccc(Cl)cc2)CC1	ZINC000875009151	FI	On-Demand	Anodyne	BIRC8	57	37
CCCCCCCCCNC(=O)C(=O)N1[C@H]2CC[C@H]1[C@@H](C)[C@H](O)C2	ZINC000875009163	EF	On-Demand	Mild	ASAH1	74	34
CCCCCCCCCNC(=O)C(=O)N1[C@H]2CC[C@H]1[C@H](C)[C@H](O)C2	ZINC000875009165	EF	On-Demand	Mild	ASAH1	74	34
CCCCCCCCCNC(=O)C(=O)N1[C@H]2CC[C@H]1[C@H](C)[C@@H](O)C2	ZINC000875009167	EF	On-Demand	Mild	ASAH1	74	34
CCCCCCCCCNC(=O)C(=O)N1[C@H]2CC[C@H]1[C@@H](C)[C@@H](O)C2	ZINC000875009170	EF	On-Demand	Mild	ASAH1	74	34
CC[C@H](C[C@H](C)O)NC(=O)NCCc1cccc(Cl)c1	ZINC000875009172	CF	On-Demand	Anodyne	PDS	70	39
O=C(NCc1cn2ccccc2n1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875009174	FG	On-Demand	Anodyne	CPT1A	79	37
O=C(NCc1cn2ccccc2n1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875009175	FG	On-Demand	Anodyne	CPT1A	79	37
O=C(NCc1cn2ccccc2n1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875009176	FG	On-Demand	Anodyne	CPT1A	79	37
CCC[C@H](NC(=O)NN(C)C(=O)OC)c1ccccc1	ZINC000875009203	CE	On-Demand	Reactive	TACR3	40	41
CCC[C@H](NC(=O)NN(C)C(=O)OC)c1ccccc1	ZINC000875009203	CE	On-Demand	Reactive	UTS2	72	42
CCC[C@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1	ZINC000875009205	EE	On-Demand	Anodyne	CCR5	42	43
CCC[C@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1	ZINC000875009205	EE	On-Demand	Anodyne	EPHX2	16	45
Cc1ccccc1CNC(=O)N1CCC(CO)(CO)CC1	ZINC000875009247	CD	On-Demand	Anodyne	P2RX7	16	44
Cc1ccccc1CNC(=O)N1CCC(CO)(CO)CC1	ZINC000875009247	CD	On-Demand	Anodyne	EPHX2	21	46
Cc1ccccc1CNC(=O)NCC[C@H](O)C1CCCC1	ZINC000875009251	CF	On-Demand	Anodyne	P2RX7	15	42
Cc1ccccc1CNC(=O)NCC[C@@H](O)C1CCCC1	ZINC000875009253	CF	On-Demand	Anodyne	P2RX7	15	42
Cc1ccccc1CNC(=O)N(C)C[C@H](C)NC(=O)OC(C)(C)C	ZINC000875009254	EG	On-Demand	Anodyne	FPR1	47	38
Cc1ccccc1CNC(=O)N(C)C[C@@H](C)NC(=O)OC(C)(C)C	ZINC000875009256	EG	On-Demand	Anodyne	FPR1	47	38
N#Cc1c(NC(=O)c2cccn(C3CC3)c2=O)sc2c1CCCCC2	ZINC000875009258	FH	On-Demand	Mild	VIPR1	30	49
NC(=O)CCOC(=O)Cn1c(=O)ccn(Cc2ccccc2)c1=O	ZINC000875009260	EB	On-Demand	Anodyne	PLA2G2A	50	39
Cc1ccccc1CNC(=O)N1CCN(c2ccc(C#N)nc2)CC1	ZINC000875009278	EE	On-Demand	Mild	P2RY12	16	51
CCO[C@@H](C(=O)Nc1sc2c(c1C#N)CCCCC2)C1CCOCC1	ZINC000875009298	FH	On-Demand	Mild	VIPR1	29	47
Cc1ccccc1CNC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875009301	DD	On-Demand	Anodyne	P2RX7	27	46
Cc1ccccc1CNC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875009301	DD	On-Demand	Anodyne	EPHX2	43	51
CCCCCCCNC(=O)C(=O)NCCc1ccc2c(c1)OCO2	ZINC000875009302	EE	On-Demand	Mild	INHA	51	33
CCCCCCCNC(=O)C(=O)NCCc1ccc2c(c1)OCO2	ZINC000875009302	EE	On-Demand	Mild	EDNRA	42	39
CCCCCCCNC(=O)C(=O)NCCc1ccc2c(c1)OCO2	ZINC000875009302	EE	On-Demand	Mild	CNR2	24	40
CCCCCCCNC(=O)C(=O)NCCc1ccc2c(c1)OCO2	ZINC000875009302	EE	On-Demand	Mild	BMP1	44	40
CCCCCCCNC(=O)C(=O)NCCc1ccc2c(c1)OCO2	ZINC000875009302	EE	On-Demand	Mild	NOS2	66	39
CCCCCCCNC(=O)C(=O)NCCc1ccc2c(c1)OCO2	ZINC000875009302	EE	On-Demand	Mild	PLM2_PLAFA	23	48
CCCCCCCNC(=O)C(=O)NCCc1ccc2c(c1)OCO2	ZINC000875009302	EE	On-Demand	Mild	ASAH1	83	34
O=C(NCCc1cccc(Cl)c1)N1CCC(CO)(CO)CC1	ZINC000875009307	ED	On-Demand	Anodyne	FAAH	15	46
O=C(NCCc1cccc(Cl)c1)N1CCC(CO)(CO)CC1	ZINC000875009307	ED	On-Demand	Anodyne	EPHX2	21	47
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCc1cn3ccccc3n1)CC2	ZINC000875009308	GG	On-Demand	Anodyne	HCRTR1	15	45
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCc1cn3ccccc3n1)CC2	ZINC000875009308	GG	On-Demand	Anodyne	MTNR1B	16	47
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCc1cn3ccccc3n1)CC2	ZINC000875009309	GG	On-Demand	Anodyne	HCRTR1	15	45
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCc1cn3ccccc3n1)CC2	ZINC000875009309	GG	On-Demand	Anodyne	MTNR1B	16	47
Cc1cncc([C@H]2CCCN2C(=O)NCc2ccccc2C)c1	ZINC000875009310	DH	On-Demand	Anodyne	AVPR2	20	41
Cc1cncc([C@H]2CCCN2C(=O)NCc2ccccc2C)c1	ZINC000875009310	DH	On-Demand	Anodyne	P2RX7	21	43
Cc1cncc([C@H]2CCCN2C(=O)NCc2ccccc2C)c1	ZINC000875009310	DH	On-Demand	Anodyne	SCN2A	19	43
Cc1cncc([C@H]2CCCN2C(=O)NCc2ccccc2C)c1	ZINC000875009310	DH	On-Demand	Anodyne	PREP	43	39
Cc1cncc([C@H]2CCCN2C(=O)NCc2ccccc2C)c1	ZINC000875009310	DH	On-Demand	Anodyne	SCN10A	29	43
O=C(NCCc1ccc2c(c1)OCO2)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875009312	ED	On-Demand	Anodyne	NOS2	94	39
Cc1cncc([C@@H]2CCCN2C(=O)NCc2ccccc2C)c1	ZINC000875009318	DH	On-Demand	Anodyne	AVPR2	20	41
Cc1cncc([C@@H]2CCCN2C(=O)NCc2ccccc2C)c1	ZINC000875009318	DH	On-Demand	Anodyne	P2RX7	21	43
Cc1cncc([C@@H]2CCCN2C(=O)NCc2ccccc2C)c1	ZINC000875009318	DH	On-Demand	Anodyne	SCN2A	19	43
Cc1cncc([C@@H]2CCCN2C(=O)NCc2ccccc2C)c1	ZINC000875009318	DH	On-Demand	Anodyne	PREP	43	39
Cc1cncc([C@@H]2CCCN2C(=O)NCc2ccccc2C)c1	ZINC000875009318	DH	On-Demand	Anodyne	SCN10A	29	43
O=C(NCCCCC1CC1)C(=O)NCCCN1CCCCC1	ZINC000875009326	DD	On-Demand	Anodyne	DRD3	31	40
O=C(NCCCCC1CC1)C(=O)NCCCN1CCCCC1	ZINC000875009326	DD	On-Demand	Anodyne	HNMT	40	31
O=C(NCc1cn2ccccc2n1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875009345	FD	On-Demand	Anodyne	ETHR	54	34
O=C(NCc1cn2ccccc2n1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875009347	FD	On-Demand	Anodyne	ETHR	54	34
N#CCc1ccsc1C(=O)Nc1sc2c(c1C#N)CCCCC2	ZINC000875009352	EI	On-Demand	Mild	VIPR1	35	55
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875009355	FD	On-Demand	Anodyne	FKBP1A	23	41
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875009355	FD	On-Demand	Anodyne	HTR2A	19	42
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875009355	FD	On-Demand	Anodyne	SLC6A1	61	39
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875009355	FD	On-Demand	Anodyne	ADRA1A	24	44
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875009355	FD	On-Demand	Anodyne	ADRA1B	17	41
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875009355	FD	On-Demand	Anodyne	DRD3	25	48
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875009355	FD	On-Demand	Anodyne	HRH3	27	41
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875009355	FD	On-Demand	Anodyne	CHRNA7	16	44
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875009355	FD	On-Demand	Anodyne	HNMT	62	36
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875009356	FD	On-Demand	Anodyne	FKBP1A	23	41
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875009356	FD	On-Demand	Anodyne	HTR2A	19	42
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875009356	FD	On-Demand	Anodyne	SLC6A1	61	39
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875009356	FD	On-Demand	Anodyne	ADRA1A	24	44
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875009356	FD	On-Demand	Anodyne	ADRA1B	17	41
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875009356	FD	On-Demand	Anodyne	DRD3	25	48
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875009356	FD	On-Demand	Anodyne	HRH3	27	41
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875009356	FD	On-Demand	Anodyne	CHRNA7	16	44
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875009356	FD	On-Demand	Anodyne	HNMT	62	36
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875009357	FD	On-Demand	Anodyne	FKBP1A	23	41
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875009357	FD	On-Demand	Anodyne	HTR2A	19	42
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875009357	FD	On-Demand	Anodyne	SLC6A1	61	39
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875009357	FD	On-Demand	Anodyne	ADRA1A	24	44
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875009357	FD	On-Demand	Anodyne	ADRA1B	17	41
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875009357	FD	On-Demand	Anodyne	DRD3	25	48
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875009357	FD	On-Demand	Anodyne	HRH3	27	41
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875009357	FD	On-Demand	Anodyne	CHRNA7	16	44
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875009357	FD	On-Demand	Anodyne	HNMT	62	36
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875009358	FD	On-Demand	Anodyne	FKBP1A	23	41
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875009358	FD	On-Demand	Anodyne	HTR2A	19	42
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875009358	FD	On-Demand	Anodyne	SLC6A1	61	39
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875009358	FD	On-Demand	Anodyne	ADRA1A	24	44
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875009358	FD	On-Demand	Anodyne	ADRA1B	17	41
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875009358	FD	On-Demand	Anodyne	DRD3	25	48
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875009358	FD	On-Demand	Anodyne	HRH3	27	41
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875009358	FD	On-Demand	Anodyne	CHRNA7	16	44
O=C(NCCCN1CCCCC1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875009358	FD	On-Demand	Anodyne	HNMT	62	36
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCc1ccccc1C)CC2	ZINC000875009398	EG	On-Demand	Anodyne	P2RY14	45	35
O=C(NC1C2CC3CC(C2)CC1C3)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875009399	FD	On-Demand	Anodyne	HSD11B1	45	35
C#CC[C@H](COC)NC(=O)C(=O)NCCc1ccc2c(c1)OCO2	ZINC000875009400	EC	On-Demand	Mild	BMP1	51	42
C#CC[C@@H](COC)NC(=O)C(=O)NCCc1ccc2c(c1)OCO2	ZINC000875009401	EC	On-Demand	Mild	BMP1	51	42
O=C(NC1C2CC3CC(C2)CC1C3)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875009402	FD	On-Demand	Anodyne	HSD11B1	45	35
O=C(NC1C2CC3CC(C2)CC1C3)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875009404	FD	On-Demand	Anodyne	HSD11B1	45	35
O=C(NC1C2CC3CC(C2)CC1C3)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875009406	FD	On-Demand	Anodyne	HSD11B1	45	35
O=C(NCCCN1CCCCC1)C(=O)NCc1ncc(Cl)s1	ZINC000875009408	ED	On-Demand	Anodyne	HRH3	23	42
O=C(NCCCN1CCCCC1)C(=O)NCc1ncc(Cl)s1	ZINC000875009408	ED	On-Demand	Anodyne	HNMT	48	35
CN1CCN(C2CCN(C(=O)C(=O)NCCCN3CCCCC3)CC2)CC1	ZINC000875009409	GC	On-Demand	Anodyne	L3MBTL3	73	53
CCC[C@H](NC(=O)N1CCCC[C@H]1CNC(=O)NC)c1ccccc1	ZINC000875009426	EG	On-Demand	Anodyne	FKBP1A	26	40
CCC[C@H](NC(=O)N1CCCC[C@H]1CNC(=O)NC)c1ccccc1	ZINC000875009426	EG	On-Demand	Anodyne	HCRTR1	16	43
CCC[C@H](NC(=O)N1CCCC[C@@H]1CNC(=O)NC)c1ccccc1	ZINC000875009427	EG	On-Demand	Anodyne	FKBP1A	26	40
CCC[C@H](NC(=O)N1CCCC[C@@H]1CNC(=O)NC)c1ccccc1	ZINC000875009427	EG	On-Demand	Anodyne	HCRTR1	16	43
CCC[C@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1ccccc1	ZINC000875009429	EI	On-Demand	Anodyne	CACNA1H	18	41
CCC[C@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1ccccc1	ZINC000875009429	EI	On-Demand	Anodyne	CCR5	33	41
CCC[C@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccccc1	ZINC000875009433	FF	On-Demand	Anodyne	CCR5	40	38
CCC[C@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccccc1	ZINC000875009433	FF	On-Demand	Anodyne	UTS2	67	38
N#Cc1c(NC(=O)c2cnc3nccn3c2)sc2c1CCCCC2	ZINC000875009454	EG	On-Demand	Mild	VIPR1	28	45
COc1ccc([C@@H]2CN(C(=O)C(=O)NCCCN3CCCCC3)CCO2)cc1	ZINC000875009462	GD	On-Demand	Anodyne	HRH3	35	44
O=C(NCCO)C1CCN(C(=O)NCCc2ccccc2F)CC1	ZINC000875009470	EC	On-Demand	Anodyne	MTNR1A	19	41
O=C(NCCO)C1CCN(C(=O)NCCc2ccccc2F)CC1	ZINC000875009470	EC	On-Demand	Anodyne	EPHX2	28	44
O=C(NCCO)C1CCN(C(=O)NCCc2ccccc2F)CC1	ZINC000875009470	EC	On-Demand	Anodyne	CACNA1G	34	48
CO[C@@H]1CC[C@@H](C)N(C(=O)NCc2ccccc2C)C1	ZINC000875009480	CF	On-Demand	Anodyne	AVPR2	15	42
CO[C@@H]1CC[C@@H](C)N(C(=O)NCc2ccccc2C)C1	ZINC000875009480	CF	On-Demand	Anodyne	P2RX7	38	51
COCCN(CC1CCN(C)CC1)C(=O)NCCc1ccccc1F	ZINC000875009483	FE	On-Demand	Anodyne	ACKR3	64	35
Cc1ccccc1CNC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1	ZINC000875009521	ED	On-Demand	Anodyne	P2RX7	17	44
Cc1ccccc1CNC(=O)N1CCN(C)c2ncccc2C1	ZINC000875009522	DF	On-Demand	Anodyne	NAMPT	15	42
CC(=O)C1CCN(C(=O)C(=O)NCCn2c(C)nc3ccccc32)CC1	ZINC000875009525	FD	On-Demand	Anodyne	PDE6D	66	48
CCC[C@H](NC(=O)N(CCOC)C1CCOCC1)c1ccccc1	ZINC000875009531	EG	On-Demand	Anodyne	AMY2	45	31
CCC[C@H](NC(=O)N(CCOC)C1CCOCC1)c1ccccc1	ZINC000875009531	EG	On-Demand	Anodyne	UTS2	47	36
CCCCCCCCCNC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875009562	DF	On-Demand	Mild	ASAH1	75	34
COc1ccc(N2CCN(C(=O)NCc3cn4ccccc4n3)CC2)c(OC)c1	ZINC000875009568	GE	On-Demand	Clean	HTR1A	57	42
COc1ccc(N2CCN(C(=O)NCc3cn4ccccc4n3)CC2)c(OC)c1	ZINC000875009568	GE	On-Demand	Clean	DRD2	49	52
COc1ccc(N2CCN(C(=O)NCc3cn4ccccc4n3)CC2)c(OC)c1	ZINC000875009568	GE	On-Demand	Clean	DRD4	42	34
COc1ccc(N2CCN(C(=O)NCc3cn4ccccc4n3)CC2)c(OC)c1	ZINC000875009568	GE	On-Demand	Clean	HTR1B	17	42
COc1ccc(N2CCN(C(=O)NCc3cn4ccccc4n3)CC2)c(OC)c1	ZINC000875009568	GE	On-Demand	Clean	DRD3	68	49
COc1ccc(N2CCN(C(=O)NCc3cn4ccccc4n3)CC2)c(OC)c1	ZINC000875009568	GE	On-Demand	Clean	PDGFRB	43	40
COc1ccc(N2CCN(C(=O)NCc3cn4ccccc4n3)CC2)c(OC)c1	ZINC000875009568	GE	On-Demand	Clean	HTR7	48	40
O=C(NCCCN1CCCCC1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875009573	GE	On-Demand	Anodyne	DRD3	17	41
O=C(NCCCN1CCCCC1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875009573	GE	On-Demand	Anodyne	CHRNA7	54	46
O=C(NCCCN1CCCCC1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875009573	GE	On-Demand	Anodyne	C3AR1	43	44
O=C(NCCCN1CCCCC1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875009573	GE	On-Demand	Anodyne	NAMPT	38	42
O=C(NCCCN1CCCCC1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875009574	GE	On-Demand	Anodyne	DRD3	17	41
O=C(NCCCN1CCCCC1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875009574	GE	On-Demand	Anodyne	CHRNA7	54	46
O=C(NCCCN1CCCCC1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875009574	GE	On-Demand	Anodyne	C3AR1	43	44
O=C(NCCCN1CCCCC1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875009574	GE	On-Demand	Anodyne	NAMPT	38	42
CCCCCCCCCNC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875009575	GE	On-Demand	Mild	ASAH1	49	32
Cc1ccccc1CNC(=O)N1CCn2c(nnc2-c2cn(C)cn2)C1	ZINC000875009585	FD	On-Demand	Anodyne	P2RX7	28	42
O=C(NCCc1ccc2c(c1)OCO2)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875009588	FD	On-Demand	Anodyne	NOS2	92	40
O=C(NCCc1ccc2c(c1)OCO2)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875009590	FD	On-Demand	Anodyne	NOS2	92	40
O=C(NCCc1ccc2c(c1)OCO2)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875009593	FD	On-Demand	Anodyne	NOS2	92	40
O=C(NCCc1ccc2c(c1)OCO2)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875009595	FD	On-Demand	Anodyne	NOS2	92	40
O=CN1CCCN(C(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1	ZINC000875009599	FG	On-Demand	Anodyne	PRCP	27	42
O=CN1CCCN(C(=O)N[C@H](c2ccccc2)c2ccc(Cl)cc2)CC1	ZINC000875009601	FG	On-Demand	Anodyne	PRCP	27	42
O=C(NCCc1ccccc1F)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875009602	EG	On-Demand	Anodyne	DPP4	21	41
O=C(NCCc1ccccc1F)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875009603	EG	On-Demand	Anodyne	DPP4	21	41
O=C(NCCc1ccccc1F)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875009604	EG	On-Demand	Anodyne	DPP4	21	41
O=C(NCCc1ccccc1F)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875009605	EG	On-Demand	Anodyne	DPP4	21	41
CC[C@@H](NC(=O)C(=O)NCCCN1CCCCC1)c1cccc(OC)c1OC	ZINC000875009611	GE	On-Demand	Anodyne	HTR1A	67	44
CC[C@@H](NC(=O)C(=O)NCCCN1CCCCC1)c1cccc(OC)c1OC	ZINC000875009611	GE	On-Demand	Anodyne	DRD2	57	49
CC[C@@H](NC(=O)C(=O)NCCCN1CCCCC1)c1cccc(OC)c1OC	ZINC000875009611	GE	On-Demand	Anodyne	DRD4	41	32
CC[C@@H](NC(=O)C(=O)NCCCN1CCCCC1)c1cccc(OC)c1OC	ZINC000875009611	GE	On-Demand	Anodyne	ADRA1D	39	41
CC[C@@H](NC(=O)C(=O)NCCCN1CCCCC1)c1cccc(OC)c1OC	ZINC000875009611	GE	On-Demand	Anodyne	HTR2A	38	43
CC[C@@H](NC(=O)C(=O)NCCCN1CCCCC1)c1cccc(OC)c1OC	ZINC000875009611	GE	On-Demand	Anodyne	HTR2C	28	43
CC[C@@H](NC(=O)C(=O)NCCCN1CCCCC1)c1cccc(OC)c1OC	ZINC000875009611	GE	On-Demand	Anodyne	ADRA1A	48	42
CC[C@@H](NC(=O)C(=O)NCCCN1CCCCC1)c1cccc(OC)c1OC	ZINC000875009611	GE	On-Demand	Anodyne	ADRA1B	34	41
CC[C@@H](NC(=O)C(=O)NCCCN1CCCCC1)c1cccc(OC)c1OC	ZINC000875009611	GE	On-Demand	Anodyne	DRD3	76	49
CC[C@@H](NC(=O)C(=O)NCCCN1CCCCC1)c1cccc(OC)c1OC	ZINC000875009611	GE	On-Demand	Anodyne	HTR4	28	43
CC[C@@H](NC(=O)C(=O)NCCCN1CCCCC1)c1cccc(OC)c1OC	ZINC000875009611	GE	On-Demand	Anodyne	HTR7	49	38
CC[C@@H](NC(=O)C(=O)NCCCN1CCCCC1)c1cccc(OC)c1OC	ZINC000875009611	GE	On-Demand	Anodyne	SIGMAR1	15	41
N#Cc1c(NC(=O)CCCOC2CCOCC2)sc2c1CCCCC2	ZINC000875009616	FH	On-Demand	Mild	VIPR1	33	52
COCCN(CC1CCN(C)CC1)C(=O)NCCc1cccc(Cl)c1	ZINC000875009620	FF	On-Demand	Anodyne	ACHE	19	40
COCCN(CC1CCN(C)CC1)C(=O)NCCc1cccc(Cl)c1	ZINC000875009620	FF	On-Demand	Anodyne	CACNA1I	61	43
N#Cc1cc(C(=O)Nc2sc3c(c2C#N)CCCCC3)co1	ZINC000875009622	DH	On-Demand	Mild	VIPR1	33	52
O=C(NCCC[C@H]1CCOC1=O)NC1C2CC3CC(C2)CC1C3	ZINC000875009636	DE	On-Demand	Anodyne	LASR	42	32
O=C(NCCC[C@@H]1CCOC1=O)NC1C2CC3CC(C2)CC1C3	ZINC000875009638	DE	On-Demand	Anodyne	LASR	42	32
CN1CC[C@@H](C(=O)Nc2sc3c(c2C#N)CCCCC3)[C@H](c2cnn(C)c2)C1	ZINC000875009642	GG	On-Demand	Mild	VIPR1	26	42
CN1CC[C@@H](C(=O)Nc2sc3c(c2C#N)CCCCC3)[C@@H](c2cnn(C)c2)C1	ZINC000875009650	GG	On-Demand	Mild	VIPR1	26	42
CN(C[C@H](O)CN(C)C(=O)OC(C)(C)C)C(=O)NCCc1ccccc1F	ZINC000875009651	GE	On-Demand	Anodyne	PAPA1_CARPA	15	41
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCc1ccc2c(c1)OCO2	ZINC000875009655	GD	On-Demand	Anodyne	NOS2	90	38
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCc1ccc2c(c1)OCO2	ZINC000875009655	GD	On-Demand	Anodyne	MCHR1	15	40
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCc1ccc2c(c1)OCO2	ZINC000875009657	GD	On-Demand	Anodyne	NOS2	90	38
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCc1ccc2c(c1)OCO2	ZINC000875009657	GD	On-Demand	Anodyne	MCHR1	15	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1C	ZINC000875009669	DE	On-Demand	Anodyne	SLC6A4	32	50
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1C	ZINC000875009669	DE	On-Demand	Anodyne	SLC6A3	66	50
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1C	ZINC000875009669	DE	On-Demand	Anodyne	P2RX7	19	44
C[C@H](NC(=O)C(=O)NCCCN1CCCCC1)c1cc2cnccc2o1	ZINC000875009671	FD	On-Demand	Anodyne	CHRNA7	22	41
C[C@H](NC(=O)C(=O)NCCCN1CCCCC1)c1cc2cnccc2o1	ZINC000875009671	FD	On-Demand	Anodyne	HNMT	40	31
C[C@H](NC(=O)C(=O)NCCCN1CCCCC1)c1cc2cnccc2o1	ZINC000875009671	FD	On-Demand	Anodyne	NAMPT	21	42
C[C@H](NC(=O)NC1(C)CC(F)(F)C1)c1ccc2c(c1)OCCO2	ZINC000875009675	EG	On-Demand	Anodyne	KCNQ2	23	43
C[C@@H](NC(=O)NC1(C)CC(F)(F)C1)c1ccc2c(c1)OCCO2	ZINC000875009676	EG	On-Demand	Anodyne	KCNQ2	23	43
CNC(=O)CNC(=O)N[C@H](c1nc2ccccc2[nH]1)C1CCCCC1	ZINC000875009680	EE	On-Demand	Anodyne	MMP7	15	41
CNC(=O)CNC(=O)N[C@@H](c1nc2ccccc2[nH]1)C1CCCCC1	ZINC000875009681	EE	On-Demand	Anodyne	MMP7	15	41
CONC(=O)C1CCN(C(=O)N[C@@H](CC(C)C)c2ccccc2)CC1	ZINC000875009689	EF	On-Demand	Anodyne	CACNA1B	20	40
CONC(=O)C1CCN(C(=O)N[C@@H](CC(C)C)c2ccccc2)CC1	ZINC000875009689	EF	On-Demand	Anodyne	CCR5	30	45
CONC(=O)C1CCN(C(=O)N[C@@H](CC(C)C)c2ccccc2)CC1	ZINC000875009689	EF	On-Demand	Anodyne	CAPN1	42	38
CONC(=O)C1CCN(C(=O)N[C@@H](CC(C)C)c2ccccc2)CC1	ZINC000875009689	EF	On-Demand	Anodyne	CAPN2	51	35
CONC(=O)C1CCN(C(=O)N[C@@H](CC(C)C)c2ccccc2)CC1	ZINC000875009689	EF	On-Demand	Anodyne	Q6PRC7_IXORI	47	33
CONC(=O)C1CCN(C(=O)N[C@H](CC(C)C)c2ccccc2)CC1	ZINC000875009690	EF	On-Demand	Anodyne	CACNA1B	20	40
CONC(=O)C1CCN(C(=O)N[C@H](CC(C)C)c2ccccc2)CC1	ZINC000875009690	EF	On-Demand	Anodyne	CCR5	30	45
CONC(=O)C1CCN(C(=O)N[C@H](CC(C)C)c2ccccc2)CC1	ZINC000875009690	EF	On-Demand	Anodyne	CAPN1	42	38
CONC(=O)C1CCN(C(=O)N[C@H](CC(C)C)c2ccccc2)CC1	ZINC000875009690	EF	On-Demand	Anodyne	CAPN2	51	35
CONC(=O)C1CCN(C(=O)N[C@H](CC(C)C)c2ccccc2)CC1	ZINC000875009690	EF	On-Demand	Anodyne	Q6PRC7_IXORI	47	33
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1C	ZINC000875009705	DE	On-Demand	Anodyne	SLC6A4	32	50
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1C	ZINC000875009705	DE	On-Demand	Anodyne	SLC6A3	66	50
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1C	ZINC000875009705	DE	On-Demand	Anodyne	P2RX7	19	44
Cc1ccccc1CNC(=O)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875009723	DD	On-Demand	Anodyne	P2RX7	19	44
Cc1ccccc1CNC(=O)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875009723	DD	On-Demand	Anodyne	EPHX2	26	40
Cc1ccccc1CNC(=O)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875009724	DD	On-Demand	Anodyne	P2RX7	19	44
Cc1ccccc1CNC(=O)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875009724	DD	On-Demand	Anodyne	EPHX2	26	40
Cc1ccccc1CNC(=O)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875009726	DD	On-Demand	Anodyne	P2RX7	19	44
Cc1ccccc1CNC(=O)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875009726	DD	On-Demand	Anodyne	EPHX2	26	40
CC[C@]1(C(=O)Nc2nc(-c3ccc(F)c(F)c3)cs2)CCNC1=O	ZINC000875009733	FF	On-Demand	Anodyne	MPL	25	50
CC[C@]1(C(=O)Nc2nc(-c3ccc(F)c(F)c3)cs2)CCNC1=O	ZINC000875009733	FF	On-Demand	Anodyne	ROCK1	20	42
CC[C@]1(C(=O)Nc2nc(-c3ccc(F)c(F)c3)cs2)CCNC1=O	ZINC000875009733	FF	On-Demand	Anodyne	ROCK2	15	42
Cc1ccccc1CNC(=O)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875009734	DD	On-Demand	Anodyne	P2RX7	19	44
Cc1ccccc1CNC(=O)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875009734	DD	On-Demand	Anodyne	EPHX2	26	40
Cn1cnc(-c2nnc3n2CCN(C(=O)C(=O)NCCc2cccc(F)c2)C3)c1	ZINC000875009747	GC	On-Demand	Anodyne	P2RX7	28	43
CC[C@@H](NC(=O)N1CC[C@](C)(NC(=O)C(F)(F)F)C1)c1ccc(OC)cc1	ZINC000875009752	GF	On-Demand	Anodyne	EPHX2	18	40
CC[C@@H](NC(=O)N1CC[C@@](C)(NC(=O)C(F)(F)F)C1)c1ccc(OC)cc1	ZINC000875009753	GF	On-Demand	Anodyne	EPHX2	18	40
CNC(=O)CNC(=O)NCc1ccc(O)c(Cl)c1	ZINC000875009772	CC	On-Demand	Anodyne	NCE103	18	53
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2ccc3c(c2)OCO3)C1	ZINC000875009773	EC	On-Demand	Anodyne	NOS2	96	44
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2ccc3c(c2)OCO3)C1	ZINC000875009773	EC	On-Demand	Anodyne	MCHR1	20	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2ccc3c(c2)OCO3)C1	ZINC000875009775	EC	On-Demand	Anodyne	NOS2	96	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2ccc3c(c2)OCO3)C1	ZINC000875009775	EC	On-Demand	Anodyne	MCHR1	20	42
COC(=O)N(C)NC(=O)N[C@@H](c1ccc(Cl)cc1)C1CC1	ZINC000875009787	DF	On-Demand	Reactive	UTS2	43	33
COC(=O)N(C)NC(=O)N[C@H](c1ccc(Cl)cc1)C1CC1	ZINC000875009789	DF	On-Demand	Reactive	UTS2	43	33
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCc2ccc3c(c2)OCO3)C1	ZINC000875009793	ED	On-Demand	Anodyne	BMP1	51	35
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCc2ccc3c(c2)OCO3)C1	ZINC000875009793	ED	On-Demand	Anodyne	NOS2	75	38
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCc2ccc3c(c2)OCO3)C1	ZINC000875009793	ED	On-Demand	Anodyne	MCHR1	19	40
O=C(NCCC[C@H]1C=CCC1)C(=O)NCCc1ccc2c(c1)OCO2	ZINC000875009798	ED	On-Demand	Anodyne	NOS2	47	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(C)o1	ZINC000875009799	DE	On-Demand	Anodyne	SLC6A3	44	38
O=C(NCCC[C@@H]1C=CCC1)C(=O)NCCc1ccc2c(c1)OCO2	ZINC000875009801	ED	On-Demand	Anodyne	NOS2	47	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(C)o1	ZINC000875009802	DE	On-Demand	Anodyne	SLC6A3	44	38
Cc1ccccc1CNC(=O)N1C[C@H]2C(=O)N(C)C(=O)[C@H]2C1	ZINC000875009803	DC	On-Demand	Anodyne	P2RX7	46	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(C)o1	ZINC000875009805	DE	On-Demand	Anodyne	SLC6A3	44	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(C)o1	ZINC000875009806	DE	On-Demand	Anodyne	SLC6A3	44	38
O=C(NCCc1cccc(Cl)c1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875009815	FE	On-Demand	Anodyne	CACNA1I	42	39
Cc1ccccc1CNC(=O)N1CCN([S@](C)(=N)=O)CC1	ZINC000875009817	DD	On-Demand	Anodyne	TGM2	16	42
Cc1ccccc1CNC(=O)N1CCN([S@](C)(=N)=O)CC1	ZINC000875009817	DD	On-Demand	Anodyne	F13A1	16	42
Cc1ccccc1CNC(=O)N1CCN([S@](C)(=N)=O)CC1	ZINC000875009817	DD	On-Demand	Anodyne	CCR8	45	37
CC[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccc(OC)cc1	ZINC000875009820	FF	On-Demand	Anodyne	CHRM2	59	41
CC[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccc(OC)cc1	ZINC000875009820	FF	On-Demand	Anodyne	L3MBTL3	51	40
Cc1ccccc1CNC(=O)N1CCN([S@@](C)(=N)=O)CC1	ZINC000875009822	DD	On-Demand	Anodyne	TGM2	16	42
Cc1ccccc1CNC(=O)N1CCN([S@@](C)(=N)=O)CC1	ZINC000875009822	DD	On-Demand	Anodyne	F13A1	16	42
Cc1ccccc1CNC(=O)N1CCN([S@@](C)(=N)=O)CC1	ZINC000875009822	DD	On-Demand	Anodyne	CCR8	45	37
CN1CCN(C2CCN(C(=O)NCc3cn4ccccc4n3)CC2)CC1	ZINC000875009837	FD	On-Demand	Anodyne	L3MBTL3	57	39
CONC(=O)C1CCN(C(=O)NCc2ccccc2C)CC1	ZINC000875009842	DD	On-Demand	Anodyne	P2RX7	23	46
CONC(=O)C1CCN(C(=O)NCc2ccccc2C)CC1	ZINC000875009842	DD	On-Demand	Anodyne	EPHX2	48	48
CONC(=O)C1CCN(C(=O)NCc2ccccc2C)CC1	ZINC000875009842	DD	On-Demand	Anodyne	CCR8	48	36
Cc1ccccc1CNC(=O)N1CCC(c2nnnn2C)CC1	ZINC000875009847	DD	On-Demand	Anodyne	EPHX2	24	41
COC(=O)C1(O)CN(C(=O)N[C@@H](C)c2ccc3c(c2)OCCO3)C1	ZINC000875009849	EC	On-Demand	Anodyne	KCNQ2	21	40
COC(=O)C1(O)CN(C(=O)N[C@H](C)c2ccc3c(c2)OCCO3)C1	ZINC000875009851	EC	On-Demand	Anodyne	KCNQ2	21	40
CCCCCCCCCNC(=O)C(=O)N[C@H]1CCCn2nccc21	ZINC000875009862	EF	On-Demand	Mild	ASAH1	77	35
CCCCCCCCCNC(=O)C(=O)N[C@H]1CCCn2nccc21	ZINC000875009862	EF	On-Demand	Mild	LASR	44	32
CCCCCCCCCNC(=O)C(=O)N[C@@H]1CCCn2nccc21	ZINC000875009864	EF	On-Demand	Mild	ASAH1	77	35
CCCCCCCCCNC(=O)C(=O)N[C@@H]1CCCn2nccc21	ZINC000875009864	EF	On-Demand	Mild	LASR	44	32
CCC[C@H](NC(=O)N(C)CCN1CC2(CCOCC2)C1)c1ccccc1	ZINC000875009880	FG	On-Demand	Anodyne	CASR	52	39
O=C(NCCc1ccccc1F)N1CCC[C@H](OC2CCC2)CC1	ZINC000875009892	EH	On-Demand	Anodyne	EPHX2	28	43
O=C(NCCc1ccccc1F)N1CCC[C@H](OC2CCC2)CC1	ZINC000875009892	EH	On-Demand	Anodyne	SCD1	15	40
O=C(NCCc1ccccc1F)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875009893	EH	On-Demand	Anodyne	EPHX2	28	43
O=C(NCCc1ccccc1F)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875009893	EH	On-Demand	Anodyne	SCD1	15	40
CCC[C@H](NC(=O)N[C@H]1CCN(CC(C)(C)O)C1)c1ccccc1	ZINC000875009897	EF	On-Demand	Anodyne	CCR5	48	41
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc2c(c1)OCCO2	ZINC000875009898	DD	On-Demand	Anodyne	KCNQ2	22	40
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc2c(c1)OCCO2	ZINC000875009899	DD	On-Demand	Anodyne	KCNQ2	22	40
CNC(=O)CNC(=O)N[C@H](C)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875009902	ED	On-Demand	Anodyne	GPR119	30	44
CNC(=O)CNC(=O)N[C@@H](C)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875009904	ED	On-Demand	Anodyne	GPR119	30	44
Cc1ccccc1CNC(=O)NC1(C)CC(F)(F)C1	ZINC000875009910	CF	On-Demand	Anodyne	P2RX7	17	43
CCC[C@H](NC(=O)NC1(C)CC(F)(F)C1)c1ccccc1	ZINC000875009912	CI	On-Demand	Anodyne	TACR3	30	40
Cc1ccccc1CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875009920	DG	On-Demand	Anodyne	F2	39	42
Cc1ccccc1CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875009920	DG	On-Demand	Anodyne	ACE	38	43
Cc1ccccc1CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875009920	DG	On-Demand	Anodyne	AVPR2	20	44
Cc1ccccc1CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875009920	DG	On-Demand	Anodyne	MME	16	43
Cc1ccccc1CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875009920	DG	On-Demand	Anodyne	P2RX7	22	44
Cc1ccccc1CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875009920	DG	On-Demand	Anodyne	PREP	31	40
Cc1ccccc1CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875009924	DG	On-Demand	Anodyne	F2	39	42
Cc1ccccc1CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875009924	DG	On-Demand	Anodyne	ACE	38	43
Cc1ccccc1CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875009924	DG	On-Demand	Anodyne	AVPR2	20	44
Cc1ccccc1CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875009924	DG	On-Demand	Anodyne	MME	16	43
Cc1ccccc1CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875009924	DG	On-Demand	Anodyne	P2RX7	22	44
Cc1ccccc1CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875009924	DG	On-Demand	Anodyne	PREP	31	40
Cc1ccccc1CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875009925	DG	On-Demand	Anodyne	F2	39	42
Cc1ccccc1CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875009925	DG	On-Demand	Anodyne	ACE	38	43
Cc1ccccc1CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875009925	DG	On-Demand	Anodyne	AVPR2	20	44
Cc1ccccc1CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875009925	DG	On-Demand	Anodyne	MME	16	43
Cc1ccccc1CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875009925	DG	On-Demand	Anodyne	P2RX7	22	44
Cc1ccccc1CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875009925	DG	On-Demand	Anodyne	PREP	31	40
Cc1ccccc1CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875009927	DG	On-Demand	Anodyne	F2	39	42
Cc1ccccc1CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875009927	DG	On-Demand	Anodyne	ACE	38	43
Cc1ccccc1CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875009927	DG	On-Demand	Anodyne	AVPR2	20	44
Cc1ccccc1CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875009927	DG	On-Demand	Anodyne	MME	16	43
Cc1ccccc1CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875009927	DG	On-Demand	Anodyne	P2RX7	22	44
Cc1ccccc1CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875009927	DG	On-Demand	Anodyne	PREP	31	40
O=C(NCCO)C1CCN(C(=O)NCCc2cccc(Cl)c2)CC1	ZINC000875009929	FD	On-Demand	Anodyne	EPHX2	25	58
O=C(NCCO)C1CCN(C(=O)NCCc2cccc(Cl)c2)CC1	ZINC000875009929	FD	On-Demand	Anodyne	GPBAR1	16	41
O=C(NC[C@H]1C[C@H](O)C1)N[C@H](c1ccccc1)c1ccc(Cl)cc1	ZINC000875009930	EG	On-Demand	Anodyne	PRCP	25	42
Cc1ccccc1CNC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875009931	CF	On-Demand	Anodyne	SLC6A1	46	34
Cc1ccccc1CNC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875009931	CF	On-Demand	Anodyne	P2RX7	24	44
Cc1ccccc1CNC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875009931	CF	On-Demand	Anodyne	EPHX2	25	44
Cc1ccccc1CNC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875009931	CF	On-Demand	Anodyne	CCR8	40	34
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H](c1ccccc1)c1ccc(Cl)cc1	ZINC000875009932	EG	On-Demand	Anodyne	PRCP	25	42
Cc1ccccc1CNC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875009933	CF	On-Demand	Anodyne	SLC6A1	46	34
Cc1ccccc1CNC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875009933	CF	On-Demand	Anodyne	P2RX7	24	44
Cc1ccccc1CNC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875009933	CF	On-Demand	Anodyne	EPHX2	25	44
Cc1ccccc1CNC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875009933	CF	On-Demand	Anodyne	CCR8	40	34
O=C(NCCCCC1CC1)C(=O)NCCc1ccc2c(c1)OCO2	ZINC000875009937	ED	On-Demand	Anodyne	NOS2	72	41
O=C(N[C@@H](c1ccccc1)c1ccc(Cl)cc1)N1CCC2(CCNC2=O)CC1	ZINC000875009940	GH	On-Demand	Anodyne	CACNA1H	71	46
O=C(N[C@H](c1ccccc1)c1ccc(Cl)cc1)N1CCC2(CCNC2=O)CC1	ZINC000875009941	GH	On-Demand	Anodyne	CACNA1H	71	46
CCC[C@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875009950	DH	On-Demand	Anodyne	CTSK	32	41
CCC[C@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875009950	DH	On-Demand	Anodyne	CCR5	46	41
CCC[C@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875009950	DH	On-Demand	Anodyne	AMY2	47	33
CCC[C@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875009950	DH	On-Demand	Anodyne	REN	16	43
CCC[C@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875009952	DH	On-Demand	Anodyne	CTSK	32	41
CCC[C@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875009952	DH	On-Demand	Anodyne	CCR5	46	41
CCC[C@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875009952	DH	On-Demand	Anodyne	AMY2	47	33
CCC[C@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875009952	DH	On-Demand	Anodyne	REN	16	43
CCC[C@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccccc1	ZINC000875009968	DE	On-Demand	Anodyne	CACNA1H	24	42
CCC[C@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccccc1	ZINC000875009968	DE	On-Demand	Anodyne	GHRHR	49	34
CCC[C@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccccc1	ZINC000875009968	DE	On-Demand	Anodyne	TACR3	18	40
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000875009976	JJ	On-Demand	Bother	SCD1	44	50
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000875009976	JJ	On-Demand	Bother	SCD	42	50
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccccc1F	ZINC000875009989	DE	On-Demand	Anodyne	SLC6A3	51	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccccc1F	ZINC000875009990	DE	On-Demand	Anodyne	SLC6A3	51	39
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCn1c(C)nc2ccccc21	ZINC000875009996	FD	On-Demand	Mild	HRH1	17	40
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCn1c(C)nc2ccccc21	ZINC000875009996	FD	On-Demand	Mild	PDE6D	41	44
C#CC[C@H](CCOC)NC(=O)C(=O)NCCn1c(C)nc2ccccc21	ZINC000875009997	FD	On-Demand	Mild	HRH1	17	40
C#CC[C@H](CCOC)NC(=O)C(=O)NCCn1c(C)nc2ccccc21	ZINC000875009997	FD	On-Demand	Mild	PDE6D	41	44
C[C@H](NC(=O)C(=O)NCCCN1CCCCC1)c1ccc(C(F)(F)F)nc1	ZINC000875009999	GE	On-Demand	Anodyne	TRPV1	54	44
C[C@H](NC(=O)C(=O)NCCCN1CCCCC1)c1ccc(C(F)(F)F)nc1	ZINC000875009999	GE	On-Demand	Anodyne	CHRNA7	15	40
C[C@H](NC(=O)C(=O)NCCCN1CCCCC1)c1ccc(C(F)(F)F)nc1	ZINC000875009999	GE	On-Demand	Anodyne	HNMT	40	33
O=C(NCCCN1CCCCC1)C(=O)NCc1ccc(OC(F)F)cc1F	ZINC000875010002	GE	On-Demand	Anodyne	ADRA1A	43	36
O=C(NCCCN1CCCCC1)C(=O)NCc1ccc(OC(F)F)cc1F	ZINC000875010002	GE	On-Demand	Anodyne	HRH3	52	39
O=C(NCCCN1CCCCC1)C(=O)NCc1ccc(OC(F)F)cc1F	ZINC000875010002	GE	On-Demand	Anodyne	CHRNA7	17	40
O=C(NCCCN1CCCCC1)C(=O)NCc1ccc(OC(F)F)cc1F	ZINC000875010002	GE	On-Demand	Anodyne	HNMT	40	30
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1cc2ccccc2oc1=O	ZINC000875010005	IK	On-Demand	Anodyne	SCD1	39	43
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1cc2ccccc2oc1=O	ZINC000875010005	IK	On-Demand	Anodyne	SCD	38	47
O=C(NC[C@@]12COCCN1C(=O)OC2)NC1C2CC3CC(C2)CC1C3	ZINC000875010008	ED	On-Demand	Anodyne	HSD11B1	41	33
O=C(NC[C@]12COCCN1C(=O)OC2)NC1C2CC3CC(C2)CC1C3	ZINC000875010009	ED	On-Demand	Anodyne	HSD11B1	41	33
O=C(NCCc1ccc2c(c1)OCO2)C(=O)NCc1ncc(Cl)s1	ZINC000875010010	FD	On-Demand	Anodyne	NOS2	94	41
CC[C@@H](NC(=O)NCc1cc(C)ccc1O)c1ccc(OC)cc1	ZINC000875010033	EH	On-Demand	Clean	UTS2	16	40
CC(=O)C1CCN(C(=O)N[C@H](CC(C)C)c2ccccc2)CC1	ZINC000875010038	DH	On-Demand	Anodyne	ANPEP	18	41
CC(=O)C1CCN(C(=O)N[C@H](CC(C)C)c2ccccc2)CC1	ZINC000875010038	DH	On-Demand	Anodyne	PTGER3	42	37
CC(=O)C1CCN(C(=O)N[C@H](CC(C)C)c2ccccc2)CC1	ZINC000875010038	DH	On-Demand	Anodyne	CACNA1B	20	45
CC(=O)C1CCN(C(=O)N[C@H](CC(C)C)c2ccccc2)CC1	ZINC000875010038	DH	On-Demand	Anodyne	CCR1	20	40
CC(=O)C1CCN(C(=O)N[C@H](CC(C)C)c2ccccc2)CC1	ZINC000875010038	DH	On-Demand	Anodyne	CCR5	34	50
CC(=O)C1CCN(C(=O)N[C@H](CC(C)C)c2ccccc2)CC1	ZINC000875010038	DH	On-Demand	Anodyne	AMP1_PLAFQ	17	41
CC(=O)C1CCN(C(=O)N[C@H](CC(C)C)c2ccccc2)CC1	ZINC000875010038	DH	On-Demand	Anodyne	Q9N6S8_PLAFA	24	41
CC(=O)C1CCN(C(=O)N[C@@H](CC(C)C)c2ccccc2)CC1	ZINC000875010039	DH	On-Demand	Anodyne	ANPEP	18	41
CC(=O)C1CCN(C(=O)N[C@@H](CC(C)C)c2ccccc2)CC1	ZINC000875010039	DH	On-Demand	Anodyne	PTGER3	42	37
CC(=O)C1CCN(C(=O)N[C@@H](CC(C)C)c2ccccc2)CC1	ZINC000875010039	DH	On-Demand	Anodyne	CACNA1B	20	45
CC(=O)C1CCN(C(=O)N[C@@H](CC(C)C)c2ccccc2)CC1	ZINC000875010039	DH	On-Demand	Anodyne	CCR1	20	40
CC(=O)C1CCN(C(=O)N[C@@H](CC(C)C)c2ccccc2)CC1	ZINC000875010039	DH	On-Demand	Anodyne	CCR5	34	50
CC(=O)C1CCN(C(=O)N[C@@H](CC(C)C)c2ccccc2)CC1	ZINC000875010039	DH	On-Demand	Anodyne	AMP1_PLAFQ	17	41
CC(=O)C1CCN(C(=O)N[C@@H](CC(C)C)c2ccccc2)CC1	ZINC000875010039	DH	On-Demand	Anodyne	Q9N6S8_PLAFA	24	41
C#CC[C@H](COC)NC(=O)C(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000875010053	FD	On-Demand	Mild	HRH3	17	42
C#CC[C@@H](COC)NC(=O)C(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000875010054	FD	On-Demand	Mild	HRH3	17	42
CC[C@@H](NC(=O)N1CCc2ccc(NC(C)=O)cc2C1)c1ccc(OC)cc1	ZINC000875010061	GH	On-Demand	Anodyne	MAPK1	47	44
CC[C@@H](NC(=O)N1CCc2ccc(NC(C)=O)cc2C1)c1ccc(OC)cc1	ZINC000875010061	GH	On-Demand	Anodyne	MTNR1A	15	40
CC[C@@H](NC(=O)N1CCc2ccc(NC(C)=O)cc2C1)c1ccc(OC)cc1	ZINC000875010061	GH	On-Demand	Anodyne	MTNR1B	22	40
CC[C@@H](NC(=O)N1CCc2ccc(NC(C)=O)cc2C1)c1ccc(OC)cc1	ZINC000875010061	GH	On-Demand	Anodyne	TRPC6	15	40
CC[C@@H](NC(=O)N[C@H](C)c1ccccc1O)c1ccc(OC)cc1	ZINC000875010103	EH	On-Demand	Clean	TACR3	44	41
CC[C@@H](NC(=O)N[C@H](C)c1ccccc1O)c1ccc(OC)cc1	ZINC000875010103	EH	On-Demand	Clean	SOAT1	24	43
CC[C@@H](NC(=O)N[C@H](C)c1ccccc1O)c1ccc(OC)cc1	ZINC000875010103	EH	On-Demand	Clean	ACE2	41	35
CC[C@@H](NC(=O)N[C@@H](C)c1ccccc1O)c1ccc(OC)cc1	ZINC000875010106	EH	On-Demand	Clean	TACR3	44	41
CC[C@@H](NC(=O)N[C@@H](C)c1ccccc1O)c1ccc(OC)cc1	ZINC000875010106	EH	On-Demand	Clean	SOAT1	24	43
CC[C@@H](NC(=O)N[C@@H](C)c1ccccc1O)c1ccc(OC)cc1	ZINC000875010106	EH	On-Demand	Clean	ACE2	41	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCCOCC1CC1)CC2	ZINC000875010107	GE	On-Demand	Anodyne	SLC18A2	47	35
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCCOCC1CC1)CC2	ZINC000875010108	GE	On-Demand	Anodyne	SLC18A2	47	35
C[C@H](NC(=O)C(=O)NCCc1cccc(F)c1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875010112	GD	On-Demand	Anodyne	GPR119	16	54
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCN(C)Cc2ccccc2)C1	ZINC000875010114	FD	On-Demand	Anodyne	DPP7	38	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCN(C)Cc2ccccc2)C1	ZINC000875010115	FD	On-Demand	Anodyne	DPP7	38	40
O=C(NC[C@@H]1CC1(Cl)Cl)N[C@@H]1Cc2ccccc2NC1=O	ZINC000875010131	EE	On-Demand	Anodyne	PYGL	17	47
O=C(NC[C@@H]1CC1(Cl)Cl)N[C@@H]1Cc2ccccc2NC1=O	ZINC000875010131	EE	On-Demand	Anodyne	PYGM	21	47
O=C(NC[C@H]1CC1(Cl)Cl)N[C@H]1Cc2ccccc2NC1=O	ZINC000875010132	EE	On-Demand	Anodyne	PYGL	17	47
O=C(NC[C@H]1CC1(Cl)Cl)N[C@H]1Cc2ccccc2NC1=O	ZINC000875010132	EE	On-Demand	Anodyne	PYGM	21	47
O=C(NC[C@H]1CC1(Cl)Cl)N[C@@H]1Cc2ccccc2NC1=O	ZINC000875010133	EE	On-Demand	Anodyne	PYGL	17	47
O=C(NC[C@H]1CC1(Cl)Cl)N[C@@H]1Cc2ccccc2NC1=O	ZINC000875010133	EE	On-Demand	Anodyne	PYGM	21	47
O=C(NC[C@@H]1CC1(Cl)Cl)N[C@H]1Cc2ccccc2NC1=O	ZINC000875010134	EE	On-Demand	Anodyne	PYGL	17	47
O=C(NC[C@@H]1CC1(Cl)Cl)N[C@H]1Cc2ccccc2NC1=O	ZINC000875010134	EE	On-Demand	Anodyne	PYGM	21	47
CCO[C@@H](C(=O)Nc1sc2c(c1C#N)CCCCC2)[C@H]1CCOC1	ZINC000875010135	EG	On-Demand	Mild	VIPR1	28	44
CCO[C@@H](C(=O)Nc1sc2c(c1C#N)CCCCC2)[C@@H]1CCOC1	ZINC000875010137	EG	On-Demand	Mild	VIPR1	28	44
CCOC1CC2(C1)C[C@H]2C(=O)Nc1sc2c(c1C#N)CCCCC2	ZINC000875010150	EI	On-Demand	Mild	VIPR1	30	47
Cc1ccccc1CNC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875010163	FH	On-Demand	Anodyne	EPHX2	24	48
Cc1ccccc1CNC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875010163	FH	On-Demand	Anodyne	SMO	48	48
Cc1ccccc1CNC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875010163	FH	On-Demand	Anodyne	ETHR	66	47
CC(C)(C)OC(=O)N1C[C@@H]2CN(C(=O)NCc3cn4ccccc4n3)C[C@]2(C)C1	ZINC000875010164	GF	On-Demand	Anodyne	MAP3K5	47	34
CC(=O)C1CCN(C(=O)NCc2ccccc2C)CC1	ZINC000875010169	CF	On-Demand	Anodyne	P2RX7	30	47
CC(=O)C1CCN(C(=O)NCc2ccccc2C)CC1	ZINC000875010169	CF	On-Demand	Anodyne	EPHX2	47	50
CC(=O)C1CCN(C(=O)NCc2ccccc2C)CC1	ZINC000875010169	CF	On-Demand	Anodyne	CCR8	55	38
O=C(NC[C@@H]1CC1(Cl)Cl)N(Cc1cccc(O)c1)[C@@H]1CC[C@@H](O)CC1	ZINC000875010180	GG	On-Demand	Anodyne	HSD17B2	19	40
O=C(NC[C@H]1CC1(Cl)Cl)N(Cc1cccc(O)c1)[C@@H]1CC[C@@H](O)CC1	ZINC000875010181	GG	On-Demand	Anodyne	HSD17B2	19	40
CN1CCC(CNC(=O)NCc2cn3ccccc3n2)(c2ccccc2)CC1	ZINC000875010208	GF	On-Demand	Anodyne	KCNA3	41	35
Cc1ccccc1CNC(=O)N(C)CCS(N)(=O)=O	ZINC000875010211	CC	On-Demand	Anodyne	CA9	22	40
Cc1ccccc1CNC(=O)N1CC[C@](C)(C(F)(F)F)C1	ZINC000875010216	DG	On-Demand	Anodyne	EPHX2	29	42
Cc1ccccc1CNC(=O)N1CC[C@@](C)(C(F)(F)F)C1	ZINC000875010217	DG	On-Demand	Anodyne	EPHX2	29	42
O=C(NCc1ccc(CN2CCCC2)cc1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875010240	GE	On-Demand	Anodyne	HRH3	18	41
O=C(NCc1ccc(CN2CCCC2)cc1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875010240	GE	On-Demand	Anodyne	SIGMAR1	16	43
O=C(NCc1ccc(CN2CCCC2)cc1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875010241	GE	On-Demand	Anodyne	HRH3	18	41
O=C(NCc1ccc(CN2CCCC2)cc1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875010241	GE	On-Demand	Anodyne	SIGMAR1	16	43
O=C(NCc1ccc(CN2CCCC2)cc1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875010242	GE	On-Demand	Anodyne	HRH3	18	41
O=C(NCc1ccc(CN2CCCC2)cc1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875010242	GE	On-Demand	Anodyne	SIGMAR1	16	43
O=C(NCc1ccc(CN2CCCC2)cc1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875010243	GE	On-Demand	Anodyne	HRH3	18	41
O=C(NCc1ccc(CN2CCCC2)cc1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875010243	GE	On-Demand	Anodyne	SIGMAR1	16	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000875010248	FD	On-Demand	Anodyne	HRH3	33	47
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000875010248	FD	On-Demand	Anodyne	SIGMAR1	23	45
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000875010248	FD	On-Demand	Anodyne	CCR3	17	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000875010248	FD	On-Demand	Anodyne	DPP7	51	36
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000875010249	FD	On-Demand	Anodyne	HRH3	33	47
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000875010249	FD	On-Demand	Anodyne	SIGMAR1	23	45
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000875010249	FD	On-Demand	Anodyne	CCR3	17	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000875010249	FD	On-Demand	Anodyne	DPP7	51	36
CC[C@@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccc(OC)cc1	ZINC000875010265	GF	On-Demand	Anodyne	UTS2	55	43
CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccc(OC)cc1	ZINC000875010282	EF	On-Demand	Anodyne	SLC6A4	27	44
CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccc(OC)cc1	ZINC000875010282	EF	On-Demand	Anodyne	SLC6A3	54	44
CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccc(OC)cc1	ZINC000875010284	EF	On-Demand	Anodyne	SLC6A4	27	44
CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccc(OC)cc1	ZINC000875010284	EF	On-Demand	Anodyne	SLC6A3	54	44
CC[C@@H](NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1)c1ccc(OC)cc1	ZINC000875010288	GI	On-Demand	Anodyne	SMO	40	43
CC[C@@H](NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1)c1ccc(OC)cc1	ZINC000875010288	GI	On-Demand	Anodyne	ETHR	63	45
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(CN4CCCC4)cc3)CC[C@@H]21	ZINC000875010306	GD	On-Demand	Anodyne	HRH3	24	40
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(CN4CCCC4)cc3)CC[C@@H]21	ZINC000875010306	GD	On-Demand	Anodyne	SIGMAR1	18	42
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(CN4CCCC4)cc3)CC[C@@H]21	ZINC000875010306	GD	On-Demand	Anodyne	MLNR	42	35
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(CN4CCCC4)cc3)CC[C@@H]21	ZINC000875010306	GD	On-Demand	Anodyne	L3MBTL3	15	40
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(CN4CCCC4)cc3)CC[C@H]21	ZINC000875010308	GD	On-Demand	Anodyne	HRH3	24	40
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(CN4CCCC4)cc3)CC[C@H]21	ZINC000875010308	GD	On-Demand	Anodyne	SIGMAR1	18	42
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(CN4CCCC4)cc3)CC[C@H]21	ZINC000875010308	GD	On-Demand	Anodyne	MLNR	42	35
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(CN4CCCC4)cc3)CC[C@H]21	ZINC000875010308	GD	On-Demand	Anodyne	L3MBTL3	15	40
Cc1ccccc1CNC(=O)N1CCCN(C(=O)CC(C)C)CC1	ZINC000875010324	EF	On-Demand	Anodyne	AMP1_PLAFQ	15	40
O=C(NCc1cn2ccccc2n1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875010367	EF	On-Demand	Anodyne	EPHX2	22	40
O=C(NCc1cn2ccccc2n1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875010368	EF	On-Demand	Anodyne	EPHX2	22	40
O=C(NCc1cn2ccccc2n1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875010398	FF	On-Demand	Anodyne	EPHX2	25	49
Cc1ccccc1CNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875010419	DD	On-Demand	Anodyne	DRD4	21	48
Cc1ccccc1CNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875010419	DD	On-Demand	Anodyne	CHRM3	15	47
Cc1ccccc1CNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875010419	DD	On-Demand	Anodyne	CCR2	18	47
Cc1ccccc1CNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875010419	DD	On-Demand	Anodyne	EPHX2	28	41
Cc1ccccc1CNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875010419	DD	On-Demand	Anodyne	CCR8	56	34
CCO[C@H](C(=O)N(c1ccccc1)c1nc(C)cs1)C1CCOCC1	ZINC000875010446	FH	On-Demand	Anodyne	SLC12A5	22	41
CCO[C@@H](C(=O)N(c1ccccc1)c1nc(C)cs1)C1CCOCC1	ZINC000875010447	FH	On-Demand	Anodyne	SLC12A5	22	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2cccc(F)c2)C1	ZINC000875010455	DD	On-Demand	Anodyne	CACNA1G	26	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2cccc(F)c2)C1	ZINC000875010456	DD	On-Demand	Anodyne	CACNA1G	26	42
O=C(NCc1ccc(OC(F)F)cc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875010466	FH	On-Demand	Anodyne	EPHX2	22	43
O=C(NCc1ccc(OC(F)F)cc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875010467	FH	On-Demand	Anodyne	EPHX2	22	43
COC(=O)c1ccc(CC(=O)Nc2sc(C)c(C)c2C#N)cn1	ZINC000875010486	EF	On-Demand	Mild	MAPK9	22	40
COC(=O)c1ccc(CC(=O)Nc2sc(C)c(C)c2C#N)cn1	ZINC000875010486	EF	On-Demand	Mild	MAPK8	25	40
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1sc(C)c(C)c1C#N	ZINC000875010499	EH	On-Demand	Mild	VIPR1	19	40
COC(=O)N(C)NC(=O)N[C@H](CC(C)C)c1ccccc1	ZINC000875010518	CF	On-Demand	Reactive	ANPEP	44	36
COC(=O)N(C)NC(=O)N[C@H](CC(C)C)c1ccccc1	ZINC000875010518	CF	On-Demand	Reactive	PTGER3	62	39
COC(=O)N(C)NC(=O)N[C@H](CC(C)C)c1ccccc1	ZINC000875010518	CF	On-Demand	Reactive	CAPNS1	58	34
COC(=O)N(C)NC(=O)N[C@H](CC(C)C)c1ccccc1	ZINC000875010518	CF	On-Demand	Reactive	CAPN1	50	40
COC(=O)N(C)NC(=O)N[C@H](CC(C)C)c1ccccc1	ZINC000875010518	CF	On-Demand	Reactive	CAPN2	67	36
COC(=O)N(C)NC(=O)N[C@H](CC(C)C)c1ccccc1	ZINC000875010518	CF	On-Demand	Reactive	FPR1	52	36
COC(=O)N(C)NC(=O)N[C@H](CC(C)C)c1ccccc1	ZINC000875010518	CF	On-Demand	Reactive	NPR	58	35
COC(=O)N(C)NC(=O)N[C@H](CC(C)C)c1ccccc1	ZINC000875010518	CF	On-Demand	Reactive	UTS2	42	37
COC(=O)N(C)NC(=O)N[C@@H](CC(C)C)c1ccccc1	ZINC000875010519	CF	On-Demand	Reactive	ANPEP	44	36
COC(=O)N(C)NC(=O)N[C@@H](CC(C)C)c1ccccc1	ZINC000875010519	CF	On-Demand	Reactive	PTGER3	62	39
COC(=O)N(C)NC(=O)N[C@@H](CC(C)C)c1ccccc1	ZINC000875010519	CF	On-Demand	Reactive	CAPNS1	58	34
COC(=O)N(C)NC(=O)N[C@@H](CC(C)C)c1ccccc1	ZINC000875010519	CF	On-Demand	Reactive	CAPN1	50	40
COC(=O)N(C)NC(=O)N[C@@H](CC(C)C)c1ccccc1	ZINC000875010519	CF	On-Demand	Reactive	CAPN2	67	36
COC(=O)N(C)NC(=O)N[C@@H](CC(C)C)c1ccccc1	ZINC000875010519	CF	On-Demand	Reactive	FPR1	52	36
COC(=O)N(C)NC(=O)N[C@@H](CC(C)C)c1ccccc1	ZINC000875010519	CF	On-Demand	Reactive	NPR	58	35
COC(=O)N(C)NC(=O)N[C@@H](CC(C)C)c1ccccc1	ZINC000875010519	CF	On-Demand	Reactive	UTS2	42	37
O=C(NCCCOCC1CC1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875010530	GD	On-Demand	Anodyne	ETHR	53	46
O=C(CCCOC1CCOCC1)Nc1nc(-c2ccc(F)c(F)c2)cs1	ZINC000875010573	GI	On-Demand	Anodyne	MPL	27	45
O=C(CCCOC1CCOCC1)Nc1nc(-c2ccc(F)c(F)c2)cs1	ZINC000875010573	GI	On-Demand	Anodyne	HDAC9	17	54
O=C(NCc1ccc(CN2CCCC2)cc1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875010575	FE	On-Demand	Anodyne	HRH3	22	42
O=C(NCc1ccc(CN2CCCC2)cc1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875010575	FE	On-Demand	Anodyne	SIGMAR1	16	44
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(CN3CCCC3)cc2)CC1	ZINC000875010611	FD	On-Demand	Anodyne	HRH3	35	47
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(CN3CCCC3)cc2)CC1	ZINC000875010611	FD	On-Demand	Anodyne	SIGMAR1	25	50
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(CN3CCCC3)cc2)CC1	ZINC000875010611	FD	On-Demand	Anodyne	MCHR1	17	41
COC(=O)[C@@]12C[C@@H](NC(=O)NCCOc3cccc(C)c3)C[C@@H]1C2	ZINC000875010638	EE	On-Demand	Anodyne	HRH2	33	44
O=C(NCCO)C1CCN(C(=O)NCc2ccc(OC(F)F)cc2)CC1	ZINC000875010647	FD	On-Demand	Anodyne	EPHX2	19	44
COc1ccc([C@@H]2CN(C(=O)NCc3ccccc3C)CCO2)cc1	ZINC000875010668	EG	On-Demand	Anodyne	MMP13	17	41
COc1ccc([C@@H]2CN(C(=O)NCc3ccccc3C)CCO2)cc1	ZINC000875010668	EG	On-Demand	Anodyne	MMP3	15	41
COc1ccc([C@@H]2CN(C(=O)NCc3ccccc3C)CCO2)cc1	ZINC000875010668	EG	On-Demand	Anodyne	MMP9	15	41
COc1ccc([C@@H]2CN(C(=O)NCc3ccccc3C)CCO2)cc1	ZINC000875010668	EG	On-Demand	Anodyne	MMP1	17	41
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCc1ccc2c(c1)OCO2	ZINC000875010672	EC	On-Demand	Mild	BMP1	56	41
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCc1ccc2c(c1)OCO2	ZINC000875010672	EC	On-Demand	Mild	NOS2	49	36
C#CC[C@H](CCOC)NC(=O)C(=O)NCCc1ccc2c(c1)OCO2	ZINC000875010677	EC	On-Demand	Mild	BMP1	56	41
C#CC[C@H](CCOC)NC(=O)C(=O)NCCc1ccc2c(c1)OCO2	ZINC000875010677	EC	On-Demand	Mild	NOS2	49	36
CC(=O)Nc1cccc2c1CN(C(=O)NCc1ccccc1C)CC2	ZINC000875010682	EG	On-Demand	Anodyne	P2RY14	45	35
Cc1ccccc1CNC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875010691	EF	On-Demand	Anodyne	SMO	39	40
Cc1ccccc1CNC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875010691	EF	On-Demand	Anodyne	ETHR	59	35
Cc1ccccc1CNC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875010693	EF	On-Demand	Anodyne	SMO	39	40
Cc1ccccc1CNC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875010693	EF	On-Demand	Anodyne	ETHR	59	35
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OC(F)F)cc1	ZINC000875010703	DF	On-Demand	Anodyne	ANPEP	18	45
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OC(F)F)cc1	ZINC000875010703	DF	On-Demand	Anodyne	PDS	48	34
CCO[C@H](C(=O)N(c1ccccc1)c1nc(C)cs1)C1CCCC1	ZINC000875010716	EJ	On-Demand	Anodyne	AMY2	46	32
CCO[C@H](C(=O)N(c1ccccc1)c1nc(C)cs1)C1CCCC1	ZINC000875010716	EJ	On-Demand	Anodyne	SLC12A5	24	44
Cc1nnc(NNC(=O)N[C@@H](CC(C)C)c2ccccc2)n1C	ZINC000875010717	DF	On-Demand	Reactive	PTGER3	50	36
Cc1nnc(NNC(=O)N[C@@H](CC(C)C)c2ccccc2)n1C	ZINC000875010717	DF	On-Demand	Reactive	CCR5	18	40
Cc1nnc(NNC(=O)N[C@H](CC(C)C)c2ccccc2)n1C	ZINC000875010718	DF	On-Demand	Reactive	PTGER3	50	36
Cc1nnc(NNC(=O)N[C@H](CC(C)C)c2ccccc2)n1C	ZINC000875010718	DF	On-Demand	Reactive	CCR5	18	40
N#Cc1ccc(Cn2cc(NC(=O)NC[C@H]3CC3(Cl)Cl)cn2)cc1	ZINC000875010719	FG	On-Demand	Mild	ITK	17	52
N#Cc1ccc(Cn2cc(NC(=O)NC[C@H]3CC3(Cl)Cl)cn2)cc1	ZINC000875010719	FG	On-Demand	Mild	PANC	41	35
N#Cc1ccc(Cn2cc(NC(=O)NC[C@@H]3CC3(Cl)Cl)cn2)cc1	ZINC000875010726	FG	On-Demand	Mild	ITK	17	52
N#Cc1ccc(Cn2cc(NC(=O)NC[C@@H]3CC3(Cl)Cl)cn2)cc1	ZINC000875010726	FG	On-Demand	Mild	PANC	41	35
CCO[C@@H](C(=O)N(c1ccccc1)c1nc(C)cs1)C1CCCC1	ZINC000875010735	EJ	On-Demand	Anodyne	AMY2	46	32
CCO[C@@H](C(=O)N(c1ccccc1)c1nc(C)cs1)C1CCCC1	ZINC000875010735	EJ	On-Demand	Anodyne	SLC12A5	24	44
Cc1ccccc1CNC(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875010745	CF	On-Demand	Anodyne	P2RX7	17	44
Cc1ccccc1CNC(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875010745	CF	On-Demand	Anodyne	EPHX2	24	40
Cc1ccccc1CNC(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875010747	CF	On-Demand	Anodyne	P2RX7	17	44
Cc1ccccc1CNC(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875010747	CF	On-Demand	Anodyne	EPHX2	24	40
Cc1ccccc1CNC(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875010750	CF	On-Demand	Anodyne	P2RX7	17	44
Cc1ccccc1CNC(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875010750	CF	On-Demand	Anodyne	EPHX2	24	40
Cc1ccccc1CNC(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875010754	CF	On-Demand	Anodyne	P2RX7	17	44
Cc1ccccc1CNC(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875010754	CF	On-Demand	Anodyne	EPHX2	24	40
Cc1ccccc1CNC(=O)N1C[C@H]2C(=O)OC[C@H]2C1	ZINC000875010780	CD	On-Demand	Anodyne	P2RX7	15	42
Cc1ccccc1CNC(=O)N1CCc2c(CC(N)=O)cccc2C1	ZINC000875010798	EE	On-Demand	Anodyne	P2RY14	43	33
Cc1ccccc1CNC(=O)N1CC[C@](C)(NC(=O)C(F)(F)F)C1	ZINC000875010799	EE	On-Demand	Anodyne	EPHX2	28	40
Cc1ccccc1CNC(=O)N1CC[C@@](C)(NC(=O)C(F)(F)F)C1	ZINC000875010800	EE	On-Demand	Anodyne	EPHX2	28	40
COCC(C)(C)CCNC(=O)C(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000875010812	GE	On-Demand	Anodyne	HRH3	20	40
O=C(NCc1ccc(OC(F)F)cc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875010821	FG	On-Demand	Anodyne	EPHX2	17	40
O=C(NCc1ccc(OC(F)F)cc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875010824	FG	On-Demand	Anodyne	EPHX2	17	40
Cc1ccccc1CNC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875010867	CE	On-Demand	Anodyne	P2RX7	27	45
Cc1ccccc1CNC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875010867	CE	On-Demand	Anodyne	EPHX2	29	46
Cc1ccccc1CNC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875010867	CE	On-Demand	Anodyne	CCR8	60	37
Cc1ccccc1CNC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875010868	CE	On-Demand	Anodyne	P2RX7	27	45
Cc1ccccc1CNC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875010868	CE	On-Demand	Anodyne	EPHX2	29	46
Cc1ccccc1CNC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875010868	CE	On-Demand	Anodyne	CCR8	60	37
Cn1nc(C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)c2ccccc2c1=O	ZINC000875010872	II	On-Demand	Anodyne	SCD1	38	42
Cn1nc(C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)c2ccccc2c1=O	ZINC000875010872	II	On-Demand	Anodyne	SCD	37	44
CONC(=O)C1CCN(C(=O)NCc2cn3ccccc3n2)CC1	ZINC000875010880	EC	On-Demand	Anodyne	EPHX2	24	40
CC[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccc(OC)cc1	ZINC000875010881	FD	On-Demand	Anodyne	MTNR1A	26	40
C[C@@H](CN(C)C(=O)C(=O)NCCc1cccc(F)c1)NC(=O)OC(C)(C)C	ZINC000875010911	GD	On-Demand	Anodyne	PAPA1_CARPA	28	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)CCc1ccco1	ZINC000875010924	DE	On-Demand	Anodyne	SLC6A4	23	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)CCc1ccco1	ZINC000875010924	DE	On-Demand	Anodyne	SLC6A3	48	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)CCc1ccco1	ZINC000875010926	DE	On-Demand	Anodyne	SLC6A4	23	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)CCc1ccco1	ZINC000875010926	DE	On-Demand	Anodyne	SLC6A3	48	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)CCc1ccco1	ZINC000875010928	DE	On-Demand	Anodyne	SLC6A4	23	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)CCc1ccco1	ZINC000875010928	DE	On-Demand	Anodyne	SLC6A3	48	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)CCc1ccco1	ZINC000875010929	DE	On-Demand	Anodyne	SLC6A4	23	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)CCc1ccco1	ZINC000875010929	DE	On-Demand	Anodyne	SLC6A3	48	41
CC[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(OC)cc1	ZINC000875010937	ED	On-Demand	Anodyne	CACNA1H	21	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CC(C)C)c1ccccc1	ZINC000875010949	EH	On-Demand	Anodyne	SLC6A4	29	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CC(C)C)c1ccccc1	ZINC000875010949	EH	On-Demand	Anodyne	SLC6A3	71	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CC(C)C)c1ccccc1	ZINC000875010949	EH	On-Demand	Anodyne	CCR5	25	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CC(C)C)c1ccccc1	ZINC000875010951	EH	On-Demand	Anodyne	SLC6A4	29	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CC(C)C)c1ccccc1	ZINC000875010951	EH	On-Demand	Anodyne	SLC6A3	71	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CC(C)C)c1ccccc1	ZINC000875010951	EH	On-Demand	Anodyne	CCR5	25	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CC(C)C)c1ccccc1	ZINC000875010953	EH	On-Demand	Anodyne	SLC6A4	29	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CC(C)C)c1ccccc1	ZINC000875010953	EH	On-Demand	Anodyne	SLC6A3	71	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CC(C)C)c1ccccc1	ZINC000875010953	EH	On-Demand	Anodyne	CCR5	25	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CC(C)C)c1ccccc1	ZINC000875010955	EH	On-Demand	Anodyne	SLC6A4	29	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CC(C)C)c1ccccc1	ZINC000875010955	EH	On-Demand	Anodyne	SLC6A3	71	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CC(C)C)c1ccccc1	ZINC000875010955	EH	On-Demand	Anodyne	CCR5	25	41
O=C(NCc1ccc(OC(F)F)cc1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875010956	GF	On-Demand	Anodyne	ETHR	57	35
O=C(NCc1ccc(OC(F)F)cc1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875010958	GF	On-Demand	Anodyne	ETHR	57	35
O=C(NCc1nnc2n1CCCCC2)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875011007	GE	On-Demand	Anodyne	DPP7	26	42
O=C(NCc1nnc2n1CCCCC2)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875011009	GE	On-Demand	Anodyne	DPP7	26	42
CC[C@@H](NC(=O)N1CCC[C@H](C(C)=O)C1)c1ccc(OC)cc1	ZINC000875011018	DG	On-Demand	Anodyne	MMP13	21	44
CC[C@@H](NC(=O)N1CCC[C@H](C(C)=O)C1)c1ccc(OC)cc1	ZINC000875011018	DG	On-Demand	Anodyne	CCR5	15	44
CC[C@@H](NC(=O)N1CCC[C@H](C(C)=O)C1)c1ccc(OC)cc1	ZINC000875011018	DG	On-Demand	Anodyne	DPP7	22	41
CC[C@@H](NC(=O)N1CCC[C@H](C(C)=O)C1)c1ccc(OC)cc1	ZINC000875011018	DG	On-Demand	Anodyne	MMP1	21	44
CC[C@@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)c1ccc(OC)cc1	ZINC000875011019	DG	On-Demand	Anodyne	MMP13	21	44
CC[C@@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)c1ccc(OC)cc1	ZINC000875011019	DG	On-Demand	Anodyne	CCR5	15	44
CC[C@@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)c1ccc(OC)cc1	ZINC000875011019	DG	On-Demand	Anodyne	DPP7	22	41
CC[C@@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)c1ccc(OC)cc1	ZINC000875011019	DG	On-Demand	Anodyne	MMP1	21	44
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCCc2cccc(F)c2)c1	ZINC000875011026	FF	On-Demand	Anodyne	FKBP1A	23	40
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCCc2cccc(F)c2)c1	ZINC000875011028	FF	On-Demand	Anodyne	FKBP1A	23	40
CCNC(=O)CNC(=O)N[C@H](c1nc2ccccc2[nH]1)C1CCCCC1	ZINC000875011045	FF	On-Demand	Anodyne	MMP7	15	41
CCNC(=O)CNC(=O)N[C@@H](c1nc2ccccc2[nH]1)C1CCCCC1	ZINC000875011046	FF	On-Demand	Anodyne	MMP7	15	41
CC[C@@H](NC(C)=O)C(=O)N1/C(=N/Cc2ccccc2)SCC1(C)C	ZINC000875011087	EF	On-Demand	Mild	GAG-PRO	69	34
CC[C@@H](NC(C)=O)C(=O)N1/C(=N\Cc2ccccc2)SCC1(C)C	ZINC000875011089	EF	On-Demand	Mild	GAG-PRO	69	34
O=C(NCCOc1ccc(Cl)cc1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875011119	GE	On-Demand	Anodyne	CACNA1I	41	32
C[C@@H](NC(=O)NC1CC(C(N)=O)C1)c1cccnc1	ZINC000875011120	CC	On-Demand	Anodyne	KCNA5	22	45
C[C@H](NC(=O)NC1CC(C(N)=O)C1)c1cccnc1	ZINC000875011121	CC	On-Demand	Anodyne	KCNA5	22	45
COC[C@@H](NC(=O)N[C@@H](C)c1cccnc1)c1cccc(Br)c1	ZINC000875011136	GH	On-Demand	Anodyne	KCNA5	22	54
COC[C@H](NC(=O)N[C@@H](C)c1cccnc1)c1cccc(Br)c1	ZINC000875011137	GH	On-Demand	Anodyne	KCNA5	22	54
COC[C@@H](NC(=O)N[C@H](C)c1cccnc1)c1cccc(Br)c1	ZINC000875011138	GH	On-Demand	Anodyne	KCNA5	22	54
COC[C@H](NC(=O)N[C@H](C)c1cccnc1)c1cccc(Br)c1	ZINC000875011139	GH	On-Demand	Anodyne	KCNA5	22	54
C[C@@H](NC(=O)NCCC[C@H]1CCOC1=O)c1cccnc1	ZINC000875011140	CD	On-Demand	Anodyne	KCNA5	19	45
C[C@H](NC(=O)NCCC[C@@H]1CCOC1=O)c1cccnc1	ZINC000875011141	CD	On-Demand	Anodyne	KCNA5	19	45
C[C@H](NC(=O)NCCC[C@H]1CCOC1=O)c1cccnc1	ZINC000875011142	CD	On-Demand	Anodyne	KCNA5	19	45
C[C@@H](NC(=O)NCCC[C@@H]1CCOC1=O)c1cccnc1	ZINC000875011143	CD	On-Demand	Anodyne	KCNA5	19	45
O=C(NCCOc1ccc(Cl)cc1)N1CCC(CO)(CO)CC1	ZINC000875011144	ED	On-Demand	Anodyne	EPHX2	23	42
C[C@@H](OCCCNC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875011150	FD	On-Demand	Anodyne	AMY2	47	33
C[C@@H](OCCCNC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875011152	FD	On-Demand	Anodyne	AMY2	47	33
C[C@@H](NC(=O)N1CCC[C@H](OC2CCC2)CC1)c1cccnc1	ZINC000875011153	DG	On-Demand	Anodyne	PTAFR	16	44
C[C@@H](NC(=O)N1CCC[C@H](OC2CCC2)CC1)c1cccnc1	ZINC000875011153	DG	On-Demand	Anodyne	EPHX2	16	43
C[C@@H](NC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1cccnc1	ZINC000875011154	DG	On-Demand	Anodyne	PTAFR	16	44
C[C@@H](NC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1cccnc1	ZINC000875011154	DG	On-Demand	Anodyne	EPHX2	16	43
C#CC[C@H](CCOC)NC(=O)N[C@@H](C)c1cccnc1	ZINC000875011157	CD	On-Demand	Mild	KCNA5	22	41
C#CC[C@@H](CCOC)NC(=O)N[C@@H](C)c1cccnc1	ZINC000875011158	CD	On-Demand	Mild	KCNA5	22	41
C#CC[C@@H](CCOC)NC(=O)N[C@H](C)c1cccnc1	ZINC000875011159	CD	On-Demand	Mild	KCNA5	22	41
C#CC[C@H](CCOC)NC(=O)N[C@H](C)c1cccnc1	ZINC000875011160	CD	On-Demand	Mild	KCNA5	22	41
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875011173	GD	On-Demand	Mild	DRD4	40	45
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875011173	GD	On-Demand	Mild	SIGMAR1	28	49
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875011173	GD	On-Demand	Mild	SSTR5	46	36
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875011173	GD	On-Demand	Mild	MCHR1	45	46
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875011174	GD	On-Demand	Mild	DRD4	40	45
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875011174	GD	On-Demand	Mild	SIGMAR1	28	49
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875011174	GD	On-Demand	Mild	SSTR5	46	36
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875011174	GD	On-Demand	Mild	MCHR1	45	46
CCN(CCNC(=O)OC(C)(C)C)C(=O)N[C@H](C)c1cccnc1	ZINC000875011177	EF	On-Demand	Anodyne	KCNA5	20	40
CCN(CCNC(=O)OC(C)(C)C)C(=O)N[C@@H](C)c1cccnc1	ZINC000875011178	EF	On-Demand	Anodyne	KCNA5	20	40
C[C@@H](NC(=O)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1)c1cccnc1	ZINC000875011186	DH	On-Demand	Anodyne	PTAFR	21	43
C[C@@H](NC(=O)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1)c1cccnc1	ZINC000875011186	DH	On-Demand	Anodyne	KCNA5	22	40
C[C@H](NC(=O)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1)c1cccnc1	ZINC000875011187	DH	On-Demand	Anodyne	PTAFR	21	43
C[C@H](NC(=O)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1)c1cccnc1	ZINC000875011187	DH	On-Demand	Anodyne	KCNA5	22	40
COc1cccc([C@H](O)C2CCN(C(=O)N[C@H](C)c3cccnc3)CC2)c1	ZINC000875011188	FG	On-Demand	Anodyne	PTAFR	28	41
COc1cccc([C@H](O)C2CCN(C(=O)N[C@H](C)c3cccnc3)CC2)c1	ZINC000875011188	FG	On-Demand	Anodyne	C3AR1	35	40
COc1cccc([C@H](O)C2CCN(C(=O)N[C@@H](C)c3cccnc3)CC2)c1	ZINC000875011189	FG	On-Demand	Anodyne	PTAFR	28	41
COc1cccc([C@H](O)C2CCN(C(=O)N[C@@H](C)c3cccnc3)CC2)c1	ZINC000875011189	FG	On-Demand	Anodyne	C3AR1	35	40
C[C@@H](NC(=O)N1CCN(c2ccc(C#N)cc2)CC1)c1cccnc1	ZINC000875011209	EF	On-Demand	Mild	PTAFR	35	53
C[C@@H](NC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1cccnc1	ZINC000875011213	DF	On-Demand	Anodyne	PTAFR	15	42
C[C@@H](NC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1cccnc1	ZINC000875011214	DF	On-Demand	Anodyne	PTAFR	15	42
C[C@@H](NC(=O)NC[C@@H]1c2ccccc2CN1C)c1cccnc1	ZINC000875011215	DF	On-Demand	Anodyne	KCNA5	23	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC(F)F)cc1	ZINC000875011238	FF	On-Demand	Anodyne	SLC6A4	35	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC(F)F)cc1	ZINC000875011238	FF	On-Demand	Anodyne	SLC6A3	73	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC(F)F)cc1	ZINC000875011239	FF	On-Demand	Anodyne	SLC6A4	35	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC(F)F)cc1	ZINC000875011239	FF	On-Demand	Anodyne	SLC6A3	73	43
NC(=O)[C@@H]1CC[C@H](CCC(=O)Nc2nc(-c3ccc(F)c(F)c3)cs2)O1	ZINC000875011271	GF	On-Demand	Anodyne	MPL	15	43
NC(=O)[C@@H]1CC[C@H](CCC(=O)Nc2nc(-c3ccc(F)c(F)c3)cs2)O1	ZINC000875011271	GF	On-Demand	Anodyne	HDAC9	15	50
C[C@H]1CC(=O)N[C@@H](C(=O)Nc2nc(-c3ccc(F)c(F)c3)cs2)C1	ZINC000875011277	FF	On-Demand	Anodyne	MAOB	17	42
C[C@H]1CC(=O)N[C@@H](C(=O)Nc2nc(-c3ccc(F)c(F)c3)cs2)C1	ZINC000875011277	FF	On-Demand	Anodyne	MPL	31	49
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000875011303	FD	On-Demand	Mild	HRH3	17	41
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000875011304	FD	On-Demand	Mild	HRH3	17	41
O=C(NCCCCC1CC1)C(=O)NCCc1cccc(F)c1	ZINC000875011305	DE	On-Demand	Anodyne	CCR3	24	41
CN1CCN(C(=O)NCc2ccc(OC(F)F)cc2)Cc2cccnc21	ZINC000875011321	FF	On-Demand	Anodyne	NAMPT	25	45
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1nc(Cl)ccc1Cl	ZINC000875011329	IK	On-Demand	Anodyne	CSNK1D	24	40
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1nc(Cl)ccc1Cl	ZINC000875011329	IK	On-Demand	Anodyne	SCD1	41	44
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1nc(Cl)ccc1Cl	ZINC000875011329	IK	On-Demand	Anodyne	SCD	38	48
O=C(NCC[C@@H]1CCSC1)C(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000875011341	GE	On-Demand	Anodyne	ACHE	21	43
O=C(NCC[C@@H]1CCSC1)C(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000875011341	GE	On-Demand	Anodyne	HRH3	16	42
O=C(NCC[C@@H]1CCSC1)C(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000875011341	GE	On-Demand	Anodyne	SIGMAR1	16	44
O=C(NCC[C@H]1CCSC1)C(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000875011342	GE	On-Demand	Anodyne	ACHE	21	43
O=C(NCC[C@H]1CCSC1)C(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000875011342	GE	On-Demand	Anodyne	HRH3	16	42
O=C(NCC[C@H]1CCSC1)C(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000875011342	GE	On-Demand	Anodyne	SIGMAR1	16	44
COc1ccc([C@@H](NC(=O)C(=O)NCc2cccc3ncccc23)C(C)C)cc1	ZINC000875011347	GG	On-Demand	Anodyne	NQO2	16	43
COc1ccc([C@@H](NC(=O)C(=O)NCc2cccc3ncccc23)C(C)C)cc1	ZINC000875011347	GG	On-Demand	Anodyne	MTNR1A	34	43
COc1ccc([C@H](NC(=O)C(=O)NCc2cccc3ncccc23)C(C)C)cc1	ZINC000875011350	GG	On-Demand	Anodyne	NQO2	16	43
COc1ccc([C@H](NC(=O)C(=O)NCc2cccc3ncccc23)C(C)C)cc1	ZINC000875011350	GG	On-Demand	Anodyne	MTNR1A	34	43
C[C@@H](NC(=O)NC[C@H]1c2ccccc2CN1C)c1cccnc1	ZINC000875011368	DF	On-Demand	Anodyne	KCNA5	23	48
C[C@H](NC(=O)NC[C@H]1c2ccccc2CN1C)c1cccnc1	ZINC000875011369	DF	On-Demand	Anodyne	KCNA5	23	48
C[C@H](NC(=O)NC[C@@H]1c2ccccc2CN1C)c1cccnc1	ZINC000875011370	DF	On-Demand	Anodyne	KCNA5	23	48
C[C@@H](NC(=O)NC1CCC(C)(N(C)C)CC1)c1cccnc1	ZINC000875011395	DF	On-Demand	Anodyne	KCNA5	21	44
C[C@@H](NC(=O)NC1CCC(C)(N(C)C)CC1)c1cccnc1	ZINC000875011395	DF	On-Demand	Anodyne	C3AR1	37	40
O=C(NCc1ccc(Cl)o1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875011400	EG	On-Demand	Anodyne	F2	28	40
C[C@H](NC(=O)NC1CCC(C)(N(C)C)CC1)c1cccnc1	ZINC000875011401	DF	On-Demand	Anodyne	KCNA5	21	44
C[C@H](NC(=O)NC1CCC(C)(N(C)C)CC1)c1cccnc1	ZINC000875011401	DF	On-Demand	Anodyne	C3AR1	37	40
O=C(NCc1ccc(Cl)o1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875011403	EG	On-Demand	Anodyne	F2	28	40
O=C(NCc1ccc(Cl)o1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875011406	EG	On-Demand	Anodyne	F2	28	40
O=C(NCc1ccc(Cl)o1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875011409	EG	On-Demand	Anodyne	F2	28	40
CC[C@@H](NC(=O)NNc1cccc(C)n1)c1ccc(OC)cc1	ZINC000875011418	DG	On-Demand	Reactive	TACR3	41	39
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1cccnc1	ZINC000875011422	CE	On-Demand	Anodyne	KCNA5	23	44
NC(=O)CCOC(=O)c1ccccc1-c1ncc(-c2ccccc2)o1	ZINC000875011427	EG	On-Demand	Anodyne	FAAH	35	41
C[C@@H](NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)c1cccnc1	ZINC000875011439	EF	On-Demand	Anodyne	PTAFR	42	47
C[C@@H](NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)c1cccnc1	ZINC000875011439	EF	On-Demand	Anodyne	KCNA5	24	42
C[C@@H](NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)c1cccnc1	ZINC000875011439	EF	On-Demand	Anodyne	CTSK	20	41
C[C@@H](NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)c1cccnc1	ZINC000875011439	EF	On-Demand	Anodyne	FAAH	22	49
C[C@@H](NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)c1cccnc1	ZINC000875011439	EF	On-Demand	Anodyne	NAMPT	23	44
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1cc([N+](=O)[O-])ccc1N1CCOCC1	ZINC000875011471	JJ	On-Demand	Bother	SCD	31	40
C[C@@H](NC(=O)N1CC2(CC(=O)N2Cc2ccccc2)C1)c1cccnc1	ZINC000875011493	FE	On-Demand	Anodyne	PTAFR	31	42
C[C@@H](NC(=O)N1CC2(CC(=O)N2Cc2ccccc2)C1)c1cccnc1	ZINC000875011493	FE	On-Demand	Anodyne	NAMPT	30	43
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1cccnc1	ZINC000875011504	CE	On-Demand	Anodyne	PTAFR	18	43
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1cccnc1	ZINC000875011504	CE	On-Demand	Anodyne	CTSK	19	40
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1cccnc1	ZINC000875011505	CE	On-Demand	Anodyne	PTAFR	18	43
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1cccnc1	ZINC000875011505	CE	On-Demand	Anodyne	CTSK	19	40
C[C@@H](NC(=O)N1CCC[C@@](F)(c2ccccc2)C1)c1cccnc1	ZINC000875011506	EH	On-Demand	Anodyne	PTAFR	22	45
C[C@@H](NC(=O)N1CCC[C@@](F)(c2ccccc2)C1)c1cccnc1	ZINC000875011506	EH	On-Demand	Anodyne	KCNA5	23	40
C[C@@H](NC(=O)N1CCC[C@](F)(c2ccccc2)C1)c1cccnc1	ZINC000875011507	EH	On-Demand	Anodyne	PTAFR	22	45
C[C@@H](NC(=O)N1CCC[C@](F)(c2ccccc2)C1)c1cccnc1	ZINC000875011507	EH	On-Demand	Anodyne	KCNA5	23	40
COc1cccc(C(C)(C)C(=O)Nc2sc(C)c(C)c2C#N)c1	ZINC000875011574	EI	On-Demand	Mild	VIPR1	18	42
Cc1ccc([C@H](C)NC(=O)N2CC3(CCN(C(=O)OC(C)(C)C)CC3)C2)o1	ZINC000875011593	GH	On-Demand	Anodyne	GPR119	25	41
CC[C@@H](NC(=O)NN(C)C(=O)OC)c1ccc(OC)cc1	ZINC000875011640	CE	On-Demand	Reactive	TACR3	37	41
CC[C@@H](NC(=O)NN(C)C(=O)OC)c1ccc(OC)cc1	ZINC000875011640	CE	On-Demand	Reactive	UTS2	45	42
CC[C@@H](NC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)c1ccc(OC)cc1	ZINC000875011673	GG	On-Demand	Anodyne	ETHR	47	37
CC[C@@H](NC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)c1ccc(OC)cc1	ZINC000875011675	GG	On-Demand	Anodyne	ETHR	47	37
O=C(CN1CCCCC(=O)C1=O)Nc1nc(-c2ccc(F)c(F)c2)cs1	ZINC000875011676	GF	On-Demand	Anodyne	MPL	31	46
O=C(CN1CCCCC(=O)C1=O)Nc1nc(-c2ccc(F)c(F)c2)cs1	ZINC000875011676	GF	On-Demand	Anodyne	TRPA1	15	41
CC[C@@H](NC(=O)N1CCc2cccc(NC(C)=O)c2C1)c1ccc(OC)cc1	ZINC000875011681	GH	On-Demand	Anodyne	MAPK1	41	42
O=C(NCc1ccc(CN2CCCC2)cc1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875011703	GC	On-Demand	Anodyne	HRH3	20	42
O=C(NCc1ccc(CN2CCCC2)cc1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875011703	GC	On-Demand	Anodyne	SIGMAR1	22	45
O=C(NCc1ccc(CN2CCCC2)cc1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875011703	GC	On-Demand	Anodyne	NPFFR2	30	40
O=C(NCc1ccc(CN2CCCC2)cc1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875011703	GC	On-Demand	Anodyne	NPFFR1	45	40
COC(=O)C1(O)CN(C(=O)N[C@H](C)c2cccnc2)C1	ZINC000875011713	CC	On-Demand	Anodyne	PTAFR	27	43
COC(=O)C1(O)CN(C(=O)N[C@@H](C)c2cccnc2)C1	ZINC000875011715	CC	On-Demand	Anodyne	PTAFR	27	43
C[C@@H](NC(=O)NC[C@@]12COCCN1C(=O)OC2)c1cccnc1	ZINC000875011724	DC	On-Demand	Anodyne	KCNA5	18	41
C[C@@H](NC(=O)NC[C@]12COCCN1C(=O)OC2)c1cccnc1	ZINC000875011725	DC	On-Demand	Anodyne	KCNA5	18	41
C[C@H](NC(=O)NC[C@@]12COCCN1C(=O)OC2)c1cccnc1	ZINC000875011726	DC	On-Demand	Anodyne	KCNA5	18	41
C[C@@H](NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1)c1cccnc1	ZINC000875011734	FG	On-Demand	Anodyne	SMO	41	41
C[C@@H](NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1)c1cccnc1	ZINC000875011734	FG	On-Demand	Anodyne	ETHR	63	43
C[C@@H](NC(=O)NCc1cc(F)cc(NC(=O)OC(C)(C)C)c1)c1cccnc1	ZINC000875011746	GI	On-Demand	Anodyne	KCNA5	17	42
CC(=O)C1CCN(C(=O)N[C@H](C)c2cccnc2)CC1	ZINC000875011749	CE	On-Demand	Anodyne	PTAFR	30	51
CC(=O)C1CCN(C(=O)N[C@H](C)c2cccnc2)CC1	ZINC000875011749	CE	On-Demand	Anodyne	KCNA5	23	40
CC(=O)C1CCN(C(=O)N[C@H](C)c2cccnc2)CC1	ZINC000875011749	CE	On-Demand	Anodyne	C3AR1	40	37
CC(=O)C1CCN(C(=O)N[C@@H](C)c2cccnc2)CC1	ZINC000875011750	CE	On-Demand	Anodyne	PTAFR	30	51
CC(=O)C1CCN(C(=O)N[C@@H](C)c2cccnc2)CC1	ZINC000875011750	CE	On-Demand	Anodyne	KCNA5	23	40
CC(=O)C1CCN(C(=O)N[C@@H](C)c2cccnc2)CC1	ZINC000875011750	CE	On-Demand	Anodyne	C3AR1	40	37
C[C@@H](NC(=O)NCc1cc(C(F)(F)F)cc(Cl)n1)c1cccnc1	ZINC000875011751	FH	On-Demand	Anodyne	KCNA5	18	45
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)c2cccnc2)C1	ZINC000875011755	CE	On-Demand	Anodyne	PTAFR	27	46
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)c2cccnc2)C1	ZINC000875011755	CE	On-Demand	Anodyne	KCNA5	22	40
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)c2cccnc2)C1	ZINC000875011756	CE	On-Demand	Anodyne	PTAFR	27	46
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)c2cccnc2)C1	ZINC000875011756	CE	On-Demand	Anodyne	KCNA5	22	40
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)c2cccnc2)C1	ZINC000875011757	CE	On-Demand	Anodyne	PTAFR	27	46
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)c2cccnc2)C1	ZINC000875011757	CE	On-Demand	Anodyne	KCNA5	22	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)c2cccnc2)C1	ZINC000875011758	CE	On-Demand	Anodyne	PTAFR	27	46
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)c2cccnc2)C1	ZINC000875011758	CE	On-Demand	Anodyne	KCNA5	22	40
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)c1cccnc1	ZINC000875011759	FG	On-Demand	Anodyne	OPRL1	18	49
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)c1cccnc1	ZINC000875011759	FG	On-Demand	Anodyne	KCNA5	22	41
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)c1cccnc1	ZINC000875011760	FG	On-Demand	Anodyne	OPRL1	18	49
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)c1cccnc1	ZINC000875011760	FG	On-Demand	Anodyne	KCNA5	22	41
C#C[C@@H]1CC[C@@H](NC(=O)N[C@H](C)c2cccnc2)CC1	ZINC000875011761	CF	On-Demand	Mild	KCNA5	20	43
C#C[C@@H]1CC[C@@H](NC(=O)N[C@@H](C)c2cccnc2)CC1	ZINC000875011762	CF	On-Demand	Mild	KCNA5	20	43
C[C@@H](NC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C)c1cccnc1	ZINC000875011767	FF	On-Demand	Anodyne	GPR119	26	41
C[C@H](NC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C)c1cccnc1	ZINC000875011768	FF	On-Demand	Anodyne	GPR119	26	41
O=C(NCCO)C1CCN(C(=O)N[C@@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875011771	GF	On-Demand	Anodyne	CCR5	23	42
O=C(NCCO)C1CCN(C(=O)N[C@@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875011771	GF	On-Demand	Anodyne	F11	46	44
O=C(NCCO)C1CCN(C(=O)N[C@@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875011771	GF	On-Demand	Anodyne	CAPN1	24	45
O=C(NCCO)C1CCN(C(=O)N[C@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875011772	GF	On-Demand	Anodyne	CCR5	23	42
O=C(NCCO)C1CCN(C(=O)N[C@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875011772	GF	On-Demand	Anodyne	F11	46	44
O=C(NCCO)C1CCN(C(=O)N[C@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875011772	GF	On-Demand	Anodyne	CAPN1	24	45
C[C@@H](NC(=O)N(C)C[C@H]1CN(c2ccccc2)C(=O)O1)c1cccnc1	ZINC000875011797	FF	On-Demand	Anodyne	KCNA5	22	44
C[C@@H](NC(=O)N(C)C[C@@H]1CN(c2ccccc2)C(=O)O1)c1cccnc1	ZINC000875011798	FF	On-Demand	Anodyne	KCNA5	22	44
O=C(N[C@@H](Cc1ccccc1)c1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875011801	FF	On-Demand	Anodyne	GHRHR	49	34
O=C(N[C@@H](Cc1ccccc1)c1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875011801	FF	On-Demand	Anodyne	MME	52	39
O=C(N[C@H](Cc1ccccc1)c1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875011802	FF	On-Demand	Anodyne	GHRHR	49	34
O=C(N[C@H](Cc1ccccc1)c1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875011802	FF	On-Demand	Anodyne	MME	52	39
C[C@@H](NC(=O)NCCSCCC(F)(F)F)c1cccnc1	ZINC000875011804	DG	On-Demand	Anodyne	KCNA5	20	46
C=CC(C)(C)CCCNC(=O)N[C@H](C)c1cccnc1	ZINC000875011807	CG	On-Demand	Mild	KCNA5	22	48
C=CC(C)(C)CCCNC(=O)N[C@@H](C)c1cccnc1	ZINC000875011808	CG	On-Demand	Mild	KCNA5	22	48
C[C@@H](NC(=O)N1CC[C@]2(CCc3ccccc32)C1)c1cccnc1	ZINC000875011849	DG	On-Demand	Anodyne	OXTR	44	42
C[C@@H](NC(=O)N1CC[C@]2(CCc3ccccc32)C1)c1cccnc1	ZINC000875011849	DG	On-Demand	Anodyne	GHRHR	17	41
C[C@@H](NC(=O)N1CC[C@]2(CCc3ccccc32)C1)c1cccnc1	ZINC000875011849	DG	On-Demand	Anodyne	PTAFR	16	42
C[C@@H](NC(=O)N1CC[C@]2(CCc3ccccc32)C1)c1cccnc1	ZINC000875011849	DG	On-Demand	Anodyne	KCNA5	20	40
C[C@@H](NC(=O)N1CC[C@]2(CCc3ccccc32)C1)c1cccnc1	ZINC000875011849	DG	On-Demand	Anodyne	NPY5R	24	42
C[C@@H](NC(=O)N1CC[C@@]2(CCc3ccccc32)C1)c1cccnc1	ZINC000875011851	DG	On-Demand	Anodyne	OXTR	44	42
C[C@@H](NC(=O)N1CC[C@@]2(CCc3ccccc32)C1)c1cccnc1	ZINC000875011851	DG	On-Demand	Anodyne	GHRHR	17	41
C[C@@H](NC(=O)N1CC[C@@]2(CCc3ccccc32)C1)c1cccnc1	ZINC000875011851	DG	On-Demand	Anodyne	PTAFR	16	42
C[C@@H](NC(=O)N1CC[C@@]2(CCc3ccccc32)C1)c1cccnc1	ZINC000875011851	DG	On-Demand	Anodyne	KCNA5	20	40
C[C@@H](NC(=O)N1CC[C@@]2(CCc3ccccc32)C1)c1cccnc1	ZINC000875011851	DG	On-Demand	Anodyne	NPY5R	24	42
C[C@@H](NC(=O)N1CCN(C)C(C)(C)CC1)c1cccnc1	ZINC000875011853	CE	On-Demand	Anodyne	PTAFR	22	48
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1cccnc1	ZINC000875011855	BD	On-Demand	Anodyne	KCNA5	23	52
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1cccnc1	ZINC000875011856	BD	On-Demand	Anodyne	KCNA5	23	52
C[C@@H](NC(=O)N1CC[C@](C)(C(F)(F)F)C1)c1cccnc1	ZINC000875011861	DG	On-Demand	Anodyne	PTAFR	17	42
C[C@@H](NC(=O)N1CC[C@@](C)(C(F)(F)F)C1)c1cccnc1	ZINC000875011862	DG	On-Demand	Anodyne	PTAFR	17	42
O=C(NC[C@H]1C[C@H](O)C1)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000875011863	DG	On-Demand	Anodyne	MME	59	39
O=C(NC[C@H]1C[C@H](O)C1)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000875011863	DG	On-Demand	Anodyne	F11	38	42
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000875011864	DG	On-Demand	Anodyne	MME	59	39
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000875011864	DG	On-Demand	Anodyne	F11	38	42
C[C@@H](NC(=O)N1CCN(c2ccc(C#N)nc2)CC1)c1cccnc1	ZINC000875011868	ED	On-Demand	Mild	PTAFR	37	51
CONC(=O)C1CCN(C(=O)NCc2ccc(OC(F)F)cc2)CC1	ZINC000875011889	FD	On-Demand	Anodyne	EPHX2	18	41
C[C@@H](NC(=O)N1C[C@H]2C(=O)N(C)C(=O)[C@H]2C1)c1cccnc1	ZINC000875011903	DC	On-Demand	Anodyne	PTAFR	22	43
C[C@@H](NC(=O)N1C[C@H]2C(=O)N(C)C(=O)[C@H]2C1)c1cccnc1	ZINC000875011903	DC	On-Demand	Anodyne	KCNA5	22	40
C[C@H](NC(=O)N1C[C@H]2C(=O)N(C)C(=O)[C@H]2C1)c1cccnc1	ZINC000875011905	DC	On-Demand	Anodyne	PTAFR	22	43
C[C@H](NC(=O)N1C[C@H]2C(=O)N(C)C(=O)[C@H]2C1)c1cccnc1	ZINC000875011905	DC	On-Demand	Anodyne	KCNA5	22	40
CC[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1ccc(OC)cc1	ZINC000875011906	EE	On-Demand	Anodyne	CACNA1H	34	42
C[C@@H](NC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)c1cccnc1	ZINC000875011911	EE	On-Demand	Anodyne	ETHR	47	36
C[C@@H](NC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)c1cccnc1	ZINC000875011917	EE	On-Demand	Anodyne	ETHR	47	36
C[C@H](NC(=O)NC[C@H](O)Cc1cccc(Cl)c1)c1cccnc1	ZINC000875011921	EF	On-Demand	Anodyne	ADRB3	45	39
C[C@H](NC(=O)NC[C@H](O)Cc1cccc(Cl)c1)c1cccnc1	ZINC000875011921	EF	On-Demand	Anodyne	KCNA5	20	48
C[C@H](NC(=O)NC[C@H](O)Cc1cccc(Cl)c1)c1cccnc1	ZINC000875011921	EF	On-Demand	Anodyne	NAMPT	18	44
C[C@@H](NC(=O)NC[C@H](O)Cc1cccc(Cl)c1)c1cccnc1	ZINC000875011924	EF	On-Demand	Anodyne	ADRB3	45	39
C[C@@H](NC(=O)NC[C@H](O)Cc1cccc(Cl)c1)c1cccnc1	ZINC000875011924	EF	On-Demand	Anodyne	KCNA5	20	48
C[C@@H](NC(=O)NC[C@H](O)Cc1cccc(Cl)c1)c1cccnc1	ZINC000875011924	EF	On-Demand	Anodyne	NAMPT	18	44
C[C@@H](NC(=O)NC[C@@H](O)Cc1cccc(Cl)c1)c1cccnc1	ZINC000875011926	EF	On-Demand	Anodyne	ADRB3	45	39
C[C@@H](NC(=O)NC[C@@H](O)Cc1cccc(Cl)c1)c1cccnc1	ZINC000875011926	EF	On-Demand	Anodyne	KCNA5	20	48
C[C@@H](NC(=O)NC[C@@H](O)Cc1cccc(Cl)c1)c1cccnc1	ZINC000875011926	EF	On-Demand	Anodyne	NAMPT	18	44
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H](C)c2cccnc2)CC1	ZINC000875011940	FI	On-Demand	Anodyne	PTAFR	19	42
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H](C)c2cccnc2)CC1	ZINC000875011940	FI	On-Demand	Anodyne	RBP4	42	38
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H](C)c2cccnc2)CC1	ZINC000875011943	FI	On-Demand	Anodyne	PTAFR	19	42
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H](C)c2cccnc2)CC1	ZINC000875011943	FI	On-Demand	Anodyne	RBP4	42	38
COc1ccccc1[C@H]1CCCN(C(=O)N[C@@H](C)c2cccnc2)CC1	ZINC000875011946	FI	On-Demand	Anodyne	PTAFR	19	42
COc1ccccc1[C@H]1CCCN(C(=O)N[C@@H](C)c2cccnc2)CC1	ZINC000875011946	FI	On-Demand	Anodyne	RBP4	42	38
COc1ccccc1[C@H]1CCCN(C(=O)N[C@H](C)c2cccnc2)CC1	ZINC000875011949	FI	On-Demand	Anodyne	PTAFR	19	42
COc1ccccc1[C@H]1CCCN(C(=O)N[C@H](C)c2cccnc2)CC1	ZINC000875011949	FI	On-Demand	Anodyne	RBP4	42	38
C[C@@H](NC(=O)N1C[C@@H]2CN(Cc3ccccc3)C[C@]2(C)C1)c1cccnc1	ZINC000875011953	FG	On-Demand	Anodyne	PTAFR	28	44
C[C@@H](NC(=O)N1C[C@@H]2CN(Cc3ccccc3)C[C@]2(C)C1)c1cccnc1	ZINC000875011953	FG	On-Demand	Anodyne	CTSK	23	44
C[C@H](NC(=O)N1C[C@@H]2CN(Cc3ccccc3)C[C@]2(C)C1)c1cccnc1	ZINC000875011955	FG	On-Demand	Anodyne	PTAFR	28	44
C[C@H](NC(=O)N1C[C@@H]2CN(Cc3ccccc3)C[C@]2(C)C1)c1cccnc1	ZINC000875011955	FG	On-Demand	Anodyne	CTSK	23	44
CC[C@@H](NC(=O)N1CC[C@@](C)(C(F)(F)F)C1)c1ccc(OC)cc1	ZINC000875011956	EI	On-Demand	Anodyne	EPHX2	23	41
CC[C@@H](NC(=O)N1CC[C@](C)(C(F)(F)F)C1)c1ccc(OC)cc1	ZINC000875011961	EI	On-Demand	Anodyne	EPHX2	23	41
O=C(N[C@@H](Cc1ccccc1)c1ccccc1)N1CCC2(CCNC2=O)CC1	ZINC000875011962	GG	On-Demand	Anodyne	CACNA1H	30	42
O=C(N[C@@H](Cc1ccccc1)c1ccccc1)N1CCC2(CCNC2=O)CC1	ZINC000875011962	GG	On-Demand	Anodyne	GHRHR	65	36
O=C(N[C@H](Cc1ccccc1)c1ccccc1)N1CCC2(CCNC2=O)CC1	ZINC000875011964	GG	On-Demand	Anodyne	CACNA1H	30	42
O=C(N[C@H](Cc1ccccc1)c1ccccc1)N1CCC2(CCNC2=O)CC1	ZINC000875011964	GG	On-Demand	Anodyne	GHRHR	65	36
O=C(C[C@@H]1OC(=O)c2ccccc21)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000875011967	IJ	On-Demand	Anodyne	SCD	31	41
CC[C@@H](NC(=O)N1CCc2c(CC(N)=O)cccc2C1)c1ccc(OC)cc1	ZINC000875011968	GF	On-Demand	Anodyne	MAPK1	29	40
O=C(C[C@H]1OC(=O)c2ccccc21)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000875011969	IJ	On-Demand	Anodyne	SCD	31	41
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000875011974	FD	On-Demand	Anodyne	HRH3	22	42
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000875011974	FD	On-Demand	Anodyne	SIGMAR1	18	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875011996	EH	On-Demand	Anodyne	ACE	25	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875011996	EH	On-Demand	Anodyne	PTGER3	65	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875011996	EH	On-Demand	Anodyne	KLK3	40	30
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875011996	EH	On-Demand	Anodyne	CTSK	46	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875011996	EH	On-Demand	Anodyne	CCR5	28	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875011996	EH	On-Demand	Anodyne	CAPNS1	49	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875011996	EH	On-Demand	Anodyne	HLA-DRB1	50	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875011996	EH	On-Demand	Anodyne	CAPN1	70	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875011996	EH	On-Demand	Anodyne	CAPN2	107	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875011996	EH	On-Demand	Anodyne	NPR	56	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875012001	EH	On-Demand	Anodyne	ACE	25	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875012001	EH	On-Demand	Anodyne	PTGER3	65	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875012001	EH	On-Demand	Anodyne	KLK3	40	30
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875012001	EH	On-Demand	Anodyne	CTSK	46	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875012001	EH	On-Demand	Anodyne	CCR5	28	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875012001	EH	On-Demand	Anodyne	CAPNS1	49	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875012001	EH	On-Demand	Anodyne	HLA-DRB1	50	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875012001	EH	On-Demand	Anodyne	CAPN1	70	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875012001	EH	On-Demand	Anodyne	CAPN2	107	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875012001	EH	On-Demand	Anodyne	NPR	56	34
CC[C@@H](NC(=O)N[C@H]1CCN(CC(C)(C)O)C1)c1ccc(OC)cc1	ZINC000875012021	EE	On-Demand	Anodyne	BIRC2	21	41
C[C@H](NC(=O)C(=O)NCCc1cccc(F)c1)c1ccc(C(F)(F)F)nc1	ZINC000875012024	GF	On-Demand	Anodyne	TRPV1	68	41
Cc1ccc([C@H](C)NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)o1	ZINC000875012025	EH	On-Demand	Anodyne	ACE	27	40
Cc1ccc([C@H](C)NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)o1	ZINC000875012025	EH	On-Demand	Anodyne	PREP	42	36
Cc1ccc([C@H](C)NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)o1	ZINC000875012027	EH	On-Demand	Anodyne	ACE	27	40
Cc1ccc([C@H](C)NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)o1	ZINC000875012027	EH	On-Demand	Anodyne	PREP	42	36
Cc1ccc([C@H](C)NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)o1	ZINC000875012029	EH	On-Demand	Anodyne	ACE	27	40
Cc1ccc([C@H](C)NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)o1	ZINC000875012029	EH	On-Demand	Anodyne	PREP	42	36
Cc1ccc([C@H](C)NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)o1	ZINC000875012031	EH	On-Demand	Anodyne	ACE	27	40
Cc1ccc([C@H](C)NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)o1	ZINC000875012031	EH	On-Demand	Anodyne	PREP	42	36
CCOc1cccc2cc([C@H](C)NC(=O)C(=O)N[C@@H]3CC34CCC4)oc12	ZINC000875012042	FG	On-Demand	Anodyne	HCN1	43	33
CCOc1cccc2cc([C@H](C)NC(=O)C(=O)N[C@@H]3CC34CCC4)oc12	ZINC000875012042	FG	On-Demand	Anodyne	HCN4	40	33
C[C@@H](NC(=O)N1CC(CNC(=O)C(F)(F)F)C1)c1cccnc1	ZINC000875012043	ED	On-Demand	Anodyne	KCNA5	18	40
COC(=O)N(C)NC(=O)N[C@H](C)c1cccnc1	ZINC000875012049	CD	On-Demand	Reactive	KCNA5	25	47
COC(=O)N(C)NC(=O)N[C@@H](C)c1cccnc1	ZINC000875012051	CD	On-Demand	Reactive	KCNA5	25	47
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCO[C@H](C)c2ccccc2)C1	ZINC000875012053	FE	On-Demand	Anodyne	SLC6A1	40	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCO[C@@H](C)c2ccccc2)C1	ZINC000875012056	FE	On-Demand	Anodyne	SLC6A1	40	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCO[C@H](C)c2ccccc2)C1	ZINC000875012057	FE	On-Demand	Anodyne	SLC6A1	40	37
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCO[C@@H](C)c2ccccc2)C1	ZINC000875012059	FE	On-Demand	Anodyne	SLC6A1	40	37
CN1CCN(C2CCN(C(=O)C(=O)NCCc3cccc(F)c3)CC2)CC1	ZINC000875012065	GC	On-Demand	Anodyne	L3MBTL3	63	38
CCOc1cccc2cc([C@H](C)NC(=O)C(=O)N[C@H]3CC34CCC4)oc12	ZINC000875012066	FG	On-Demand	Anodyne	HCN1	43	33
CCOc1cccc2cc([C@H](C)NC(=O)C(=O)N[C@H]3CC34CCC4)oc12	ZINC000875012066	FG	On-Demand	Anodyne	HCN4	40	33
CCOc1cccc2cc([C@@H](C)NC(=O)C(=O)N[C@@H]3CC34CCC4)oc12	ZINC000875012069	FG	On-Demand	Anodyne	HCN1	43	33
CCOc1cccc2cc([C@@H](C)NC(=O)C(=O)N[C@@H]3CC34CCC4)oc12	ZINC000875012069	FG	On-Demand	Anodyne	HCN4	40	33
CCOc1cccc2cc([C@@H](C)NC(=O)C(=O)N[C@H]3CC34CCC4)oc12	ZINC000875012073	FG	On-Demand	Anodyne	HCN1	43	33
CCOc1cccc2cc([C@@H](C)NC(=O)C(=O)N[C@H]3CC34CCC4)oc12	ZINC000875012073	FG	On-Demand	Anodyne	HCN4	40	33
C[C@H](NC(=O)NC[C@H]1CC(=O)c2ccccc2O1)c1cccnc1	ZINC000875012078	EE	On-Demand	Anodyne	KCNA5	21	49
C[C@@H](NC(=O)NC[C@@H]1CC(=O)c2ccccc2O1)c1cccnc1	ZINC000875012084	EE	On-Demand	Anodyne	KCNA5	21	49
C[C@@H](NC(=O)NC[C@H]1CC(=O)c2ccccc2O1)c1cccnc1	ZINC000875012087	EE	On-Demand	Anodyne	KCNA5	21	49
C[C@@H](NC(=O)NCCOCCN(C)C(=O)OC(C)(C)C)c1cccnc1	ZINC000875012098	FE	On-Demand	Anodyne	KCNA5	20	43
CCNC(=O)CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875012103	ED	On-Demand	Mild	CTSF	49	32
CCNC(=O)CNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875012104	ED	On-Demand	Mild	CTSF	49	32
COc1ccc([C@@H]2CN(C(=O)C(=O)NCCc3cccc(F)c3)CCO2)cc1	ZINC000875012127	GE	On-Demand	Anodyne	MTNR1A	29	40
COc1ccc([C@@H]2CN(C(=O)C(=O)NCCc3cccc(F)c3)CCO2)cc1	ZINC000875012127	GE	On-Demand	Anodyne	MTNR1B	32	40
COC(=O)C1(O)CN(C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875012185	DD	On-Demand	Anodyne	PTGER3	67	41
COC(=O)C1(O)CN(C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875012186	DD	On-Demand	Anodyne	PTGER3	67	41
Cc1sc(NC(=O)C2(NC(=O)OCc3ccccc3)CC2)c(C#N)c1C	ZINC000875012192	FH	On-Demand	Mild	CTSK	17	54
Cc1sc(NC(=O)C2(NC(=O)OCc3ccccc3)CC2)c(C#N)c1C	ZINC000875012192	FH	On-Demand	Mild	SLC12A5	45	35
Cc1csc([C@H]2CCN(C(=O)N[C@H](C)c3cccnc3)C2)n1	ZINC000875012198	DG	On-Demand	Anodyne	PTAFR	15	40
CC(=O)C1CCN(C(=O)C(=O)NCCc2cccc(F)c2)CC1	ZINC000875012211	DD	On-Demand	Anodyne	CACNA1G	30	44
O=C(NCCO)C1CCN(C(=O)NCCOc2ccc(Cl)cc2)CC1	ZINC000875012234	FD	On-Demand	Anodyne	EPHX2	24	54
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@@H](C)c1cccnc1)CC2	ZINC000875012236	FG	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@@H](C)c1cccnc1)CC2	ZINC000875012236	FG	On-Demand	Anodyne	HCRTR1	17	49
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@@H](C)c1cccnc1)CC2	ZINC000875012236	FG	On-Demand	Anodyne	MTNR1B	15	52
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@@H](C)c1cccnc1)CC2	ZINC000875012236	FG	On-Demand	Anodyne	HCRTR2	15	45
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@H](C)c1cccnc1)CC2	ZINC000875012239	FG	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@H](C)c1cccnc1)CC2	ZINC000875012239	FG	On-Demand	Anodyne	HCRTR1	17	49
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@H](C)c1cccnc1)CC2	ZINC000875012239	FG	On-Demand	Anodyne	MTNR1B	15	52
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@H](C)c1cccnc1)CC2	ZINC000875012239	FG	On-Demand	Anodyne	HCRTR2	15	45
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)N[C@@H](C)c1cccnc1)CC2	ZINC000875012242	FG	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)N[C@@H](C)c1cccnc1)CC2	ZINC000875012242	FG	On-Demand	Anodyne	HCRTR1	17	49
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)N[C@@H](C)c1cccnc1)CC2	ZINC000875012242	FG	On-Demand	Anodyne	MTNR1B	15	52
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)N[C@@H](C)c1cccnc1)CC2	ZINC000875012242	FG	On-Demand	Anodyne	HCRTR2	15	45
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)N[C@H](C)c1cccnc1)CC2	ZINC000875012244	FG	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)N[C@H](C)c1cccnc1)CC2	ZINC000875012244	FG	On-Demand	Anodyne	HCRTR1	17	49
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)N[C@H](C)c1cccnc1)CC2	ZINC000875012244	FG	On-Demand	Anodyne	MTNR1B	15	52
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)N[C@H](C)c1cccnc1)CC2	ZINC000875012244	FG	On-Demand	Anodyne	HCRTR2	15	45
C[C@@H](NC(=O)NCc1cc2c(nc1O)CCCC2)c1cccnc1	ZINC000875012246	EF	On-Demand	Anodyne	KCNA5	17	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2cccnc2)C1	ZINC000875012250	DD	On-Demand	Anodyne	PTAFR	35	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2cccnc2)C1	ZINC000875012250	DD	On-Demand	Anodyne	CTSK	36	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2cccnc2)C1	ZINC000875012255	DD	On-Demand	Anodyne	PTAFR	35	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2cccnc2)C1	ZINC000875012255	DD	On-Demand	Anodyne	CTSK	36	41
O=C(NCc1ccc(CN2CCCC2)cc1)C(=O)N[C@H]1CC12CCC2	ZINC000875012259	ED	On-Demand	Anodyne	HRH3	18	42
O=C(NCc1ccc(CN2CCCC2)cc1)C(=O)N[C@H]1CC12CCC2	ZINC000875012259	ED	On-Demand	Anodyne	SIGMAR1	19	43
O=C(NCc1ccc(CN2CCCC2)cc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875012260	ED	On-Demand	Anodyne	HRH3	18	42
O=C(NCc1ccc(CN2CCCC2)cc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875012260	ED	On-Demand	Anodyne	SIGMAR1	19	43
C[C@@H](NC(=O)NCc1c(I)cnn1C)c1cccnc1	ZINC000875012273	GD	On-Demand	Anodyne	KCNA5	20	48
CC[C@H](C[C@H](C)O)NC(=O)NCCOc1ccc(Cl)cc1	ZINC000875012292	DF	On-Demand	Anodyne	ADRB1	18	41
C[C@@H](NC(=O)N1Cc2cccnc2N2CCC[C@H]2C1)c1cccnc1	ZINC000875012303	EF	On-Demand	Anodyne	PTAFR	25	40
C[C@H](NC(=O)N1Cc2cccnc2N2CCC[C@H]2C1)c1cccnc1	ZINC000875012306	EF	On-Demand	Anodyne	PTAFR	25	40
C[C@@H](NC(=O)NC[C@H]1CC(C)(C)CO1)c1cccnc1	ZINC000875012313	CE	On-Demand	Anodyne	KCNA5	21	49
C[C@H](NC(=O)NC[C@H]1CC(C)(C)CO1)c1cccnc1	ZINC000875012316	CE	On-Demand	Anodyne	KCNA5	21	49
C[C@@H](NC(=O)NC[C@@H]1CC(C)(C)CO1)c1cccnc1	ZINC000875012319	CE	On-Demand	Anodyne	KCNA5	21	49
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1cccnc1	ZINC000875012324	CD	On-Demand	Anodyne	PTAFR	21	44
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1cccnc1	ZINC000875012328	CD	On-Demand	Anodyne	PTAFR	21	44
C[C@@H](NC(=O)N1CCN(c2ccc(F)cc2F)CC1)c1cccnc1	ZINC000875012339	EF	On-Demand	Anodyne	CACNA1H	23	41
C[C@@H](NC(=O)N1CCN(c2ccc(F)cc2F)CC1)c1cccnc1	ZINC000875012339	EF	On-Demand	Anodyne	PTAFR	19	45
C[C@@H](NC(=O)N1CCN(c2ccc(F)cc2F)CC1)c1cccnc1	ZINC000875012339	EF	On-Demand	Anodyne	KCNQ2	46	38
C[C@@H](NC(=O)N1CCN(c2ccc(F)cc2F)CC1)c1cccnc1	ZINC000875012339	EF	On-Demand	Anodyne	NPY2R	106	46
O=C(Nc1nc(-c2ccc(F)c(F)c2)cs1)C1(F)CCOCC1	ZINC000875012340	EH	On-Demand	Anodyne	MPL	27	51
O=C(Nc1nc(-c2ccc(F)c(F)c2)cs1)C1(F)CCOCC1	ZINC000875012340	EH	On-Demand	Anodyne	ROCK1	19	40
O=C(Nc1nc(-c2ccc(F)c(F)c2)cs1)C1(F)CCOCC1	ZINC000875012340	EH	On-Demand	Anodyne	HDAC9	15	42
C[C@@H](NC(=O)NC[C@H]1CC(C(F)(F)F)=NO1)c1cccnc1	ZINC000875012343	DE	On-Demand	Anodyne	KCNA5	19	45
C[C@@H](NC(=O)NC[C@@H]1CC(C(F)(F)F)=NO1)c1cccnc1	ZINC000875012346	DE	On-Demand	Anodyne	KCNA5	19	45
C[C@H](NC(=O)NC[C@H]1CC(C(F)(F)F)=NO1)c1cccnc1	ZINC000875012348	DE	On-Demand	Anodyne	KCNA5	19	45
COc1ccc([C@H](NC(=O)C(=O)N2CCC(C(C)=O)CC2)C(C)C)cc1	ZINC000875012352	FE	On-Demand	Anodyne	CHRM2	47	38
COc1ccc([C@@H](NC(=O)C(=O)N2CCC(C(C)=O)CC2)C(C)C)cc1	ZINC000875012354	FE	On-Demand	Anodyne	CHRM2	47	38
O=C(NCCc1cccc(F)c1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875012357	GF	On-Demand	Anodyne	CHRNA7	30	40
O=C(NCCc1cccc(F)c1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875012357	GF	On-Demand	Anodyne	C3AR1	41	41
O=C(NCCc1cccc(F)c1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875012359	GF	On-Demand	Anodyne	CHRNA7	30	40
O=C(NCCc1cccc(F)c1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875012359	GF	On-Demand	Anodyne	C3AR1	41	41
O=C(NCc1ccc(CN2CCCC2)cc1)C(=O)NCc1ncc(Cl)s1	ZINC000875012369	GE	On-Demand	Anodyne	HRH3	25	44
O=C(NCc1ccc(CN2CCCC2)cc1)C(=O)NCc1ncc(Cl)s1	ZINC000875012369	GE	On-Demand	Anodyne	SIGMAR1	16	45
C[C@H](NC(=O)N1Cc2ccccc2[C@@H](C)C1)c1cccnc1	ZINC000875012371	CG	On-Demand	Anodyne	PTAFR	19	44
C[C@@H]1CN(C(=O)N[C@@H](C)c2cccnc2)Cc2ccccc21	ZINC000875012373	CG	On-Demand	Anodyne	PTAFR	19	44
C[C@H]1CN(C(=O)N[C@H](C)c2cccnc2)Cc2ccccc21	ZINC000875012375	CG	On-Demand	Anodyne	PTAFR	19	44
C[C@@H]1CN(C(=O)N[C@H](C)c2cccnc2)Cc2ccccc21	ZINC000875012377	CG	On-Demand	Anodyne	PTAFR	19	44
Cc1ccc(CN2CCO[C@H](CNC(=O)N[C@@H](C)c3cccnc3)C2)cc1	ZINC000875012379	FF	On-Demand	Anodyne	KCNA5	18	42
Cc1ccc(CN2CCO[C@H](CNC(=O)N[C@H](C)c3cccnc3)C2)cc1	ZINC000875012385	FF	On-Demand	Anodyne	KCNA5	18	42
O=C(NCc1ccc(OC(F)F)cc1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875012388	GG	On-Demand	Anodyne	NAMPT	23	41
C[C@@H](NC(=O)NC[C@@H]1CC=CC[C@H]1C(F)(F)F)c1cccnc1	ZINC000875012390	EH	On-Demand	Anodyne	KCNA5	20	47
CCC(CC)(CNC(=O)N[C@H](C)c1cccnc1)C(F)(F)F	ZINC000875012392	DH	On-Demand	Anodyne	KCNA5	23	49
CCC(CC)(CNC(=O)N[C@@H](C)c1cccnc1)C(F)(F)F	ZINC000875012394	DH	On-Demand	Anodyne	KCNA5	23	49
C[C@@H](NC(=O)N1CCC(C)(N2CCCCC2)CC1)c1cccnc1	ZINC000875012398	EG	On-Demand	Anodyne	PTAFR	17	45
C[C@@H](NC(=O)N1CCC(C)(N2CCCCC2)CC1)c1cccnc1	ZINC000875012398	EG	On-Demand	Anodyne	CCR5	22	41
C[C@H](NC(=O)C(=O)NCCCOCC1CC1)c1ccc(C(F)(F)F)nc1	ZINC000875012416	FE	On-Demand	Anodyne	TRPV1	44	37
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875012427	DH	On-Demand	Anodyne	SLC6A1	78	39
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875012427	DH	On-Demand	Anodyne	EDNRA	15	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875012427	DH	On-Demand	Anodyne	CACNA1B	27	46
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875012427	DH	On-Demand	Anodyne	CCR5	37	48
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875012427	DH	On-Demand	Anodyne	DPP7	58	38
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875012427	DH	On-Demand	Anodyne	BIRC2	34	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875012427	DH	On-Demand	Anodyne	BIRC8	44	33
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875012427	DH	On-Demand	Anodyne	Q9N6S8_PLAFA	23	43
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875012428	DH	On-Demand	Anodyne	SLC6A1	78	39
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875012428	DH	On-Demand	Anodyne	EDNRA	15	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875012428	DH	On-Demand	Anodyne	CACNA1B	27	46
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875012428	DH	On-Demand	Anodyne	CCR5	37	48
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875012428	DH	On-Demand	Anodyne	DPP7	58	38
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875012428	DH	On-Demand	Anodyne	BIRC2	34	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875012428	DH	On-Demand	Anodyne	BIRC8	44	33
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875012428	DH	On-Demand	Anodyne	Q9N6S8_PLAFA	23	43
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875012429	DH	On-Demand	Anodyne	SLC6A1	78	39
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875012429	DH	On-Demand	Anodyne	EDNRA	15	40
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875012429	DH	On-Demand	Anodyne	CACNA1B	27	46
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875012429	DH	On-Demand	Anodyne	CCR5	37	48
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875012429	DH	On-Demand	Anodyne	DPP7	58	38
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875012429	DH	On-Demand	Anodyne	BIRC2	34	40
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875012429	DH	On-Demand	Anodyne	BIRC8	44	33
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](CC(C)C)c2ccccc2)C1	ZINC000875012429	DH	On-Demand	Anodyne	Q9N6S8_PLAFA	23	43
CC(=O)[C@H]1CCCN(C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875012430	DH	On-Demand	Anodyne	SLC6A1	78	39
CC(=O)[C@H]1CCCN(C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875012430	DH	On-Demand	Anodyne	EDNRA	15	40
CC(=O)[C@H]1CCCN(C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875012430	DH	On-Demand	Anodyne	CACNA1B	27	46
CC(=O)[C@H]1CCCN(C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875012430	DH	On-Demand	Anodyne	CCR5	37	48
CC(=O)[C@H]1CCCN(C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875012430	DH	On-Demand	Anodyne	DPP7	58	38
CC(=O)[C@H]1CCCN(C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875012430	DH	On-Demand	Anodyne	BIRC2	34	40
CC(=O)[C@H]1CCCN(C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875012430	DH	On-Demand	Anodyne	BIRC8	44	33
CC(=O)[C@H]1CCCN(C(=O)N[C@H](CC(C)C)c2ccccc2)C1	ZINC000875012430	DH	On-Demand	Anodyne	Q9N6S8_PLAFA	23	43
CC[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1ccc(OC)cc1	ZINC000875012433	FH	On-Demand	Anodyne	MMP10	26	42
O=C(NCc1ccc(Cl)o1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875012498	EG	On-Demand	Anodyne	EPHX2	15	51
O=C(NCc1ccc(Cl)o1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875012499	EG	On-Demand	Anodyne	EPHX2	15	51
O=C(N[C@@H](Cc1ccccc1)c1ccccc1)N[C@@H]1CCOC[C@H]1O	ZINC000875012527	EE	On-Demand	Anodyne	F11	29	40
C[C@@H](NC(=O)NC1(C)CC(F)(F)C1)c1cccnc1	ZINC000875012529	CF	On-Demand	Anodyne	KCNA5	22	43
C[C@H](NC(=O)NC1(C)CC(F)(F)C1)c1cccnc1	ZINC000875012530	CF	On-Demand	Anodyne	KCNA5	22	43
C[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1cccnc1	ZINC000875012560	ED	On-Demand	Anodyne	PTAFR	17	45
C[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1cccnc1	ZINC000875012560	ED	On-Demand	Anodyne	CALCRL	43	36
C[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1cccnc1	ZINC000875012560	ED	On-Demand	Anodyne	L3MBTL3	67	43
CN1CCN(C2CCN(C(=O)NCc3ccc(OC(F)F)cc3)CC2)CC1	ZINC000875012561	GE	On-Demand	Anodyne	SLC6A5	19	40
CN1CCN(C2CCN(C(=O)NCc3ccc(OC(F)F)cc3)CC2)CC1	ZINC000875012561	GE	On-Demand	Anodyne	L3MBTL3	73	40
CN1CCN(C2CCN(C(=O)NCc3ccc(OC(F)F)cc3)CC2)CC1	ZINC000875012561	GE	On-Demand	Anodyne	NAMPT	20	40
C[C@@H](NC(=O)NCCc1cn(C)c2ncccc12)c1cccnc1	ZINC000875012562	DF	On-Demand	Anodyne	KCNA5	20	43
C[C@@H](NC(=O)N(C)CCN1CC2(CCOCC2)C1)c1cccnc1	ZINC000875012571	ED	On-Demand	Anodyne	CASR	45	44
C[C@H](NC(=O)NC[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C)c1cccnc1	ZINC000875012580	GH	On-Demand	Anodyne	KCNA5	18	42
C[C@@H](NC(=O)NC[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C)c1cccnc1	ZINC000875012582	GH	On-Demand	Anodyne	KCNA5	18	42
COCC(C)(C)CCNC(=O)N[C@H](C)c1cccnc1	ZINC000875012584	CF	On-Demand	Anodyne	KCNA5	22	47
COCC(C)(C)CCNC(=O)N[C@@H](C)c1cccnc1	ZINC000875012586	CF	On-Demand	Anodyne	KCNA5	22	47
C[C@@H](NC(=O)N1CCC(c2nccc(-c3cccnc3)n2)CC1)c1cccnc1	ZINC000875012595	GH	On-Demand	Anodyne	PTAFR	15	42
C[C@H](NC(=O)NC[C@@H]1COCCN1C(=O)OC(C)(C)C)c1cccnc1	ZINC000875012597	FE	On-Demand	Anodyne	KCNA5	18	41
C[C@@H](NC(=O)NC[C@H]1COCCN1C(=O)OC(C)(C)C)c1cccnc1	ZINC000875012600	FE	On-Demand	Anodyne	KCNA5	18	41
C[C@@H](NC(=O)NC[C@@H]1COCCN1C(=O)OC(C)(C)C)c1cccnc1	ZINC000875012601	FE	On-Demand	Anodyne	KCNA5	18	41
C[C@H](NC(=O)NC[C@H]1COCCN1C(=O)OC(C)(C)C)c1cccnc1	ZINC000875012602	FE	On-Demand	Anodyne	KCNA5	18	41
C[C@@H](NC(=O)NC[C@@H]1CCCO[C@H]1c1nccn1C)c1cccnc1	ZINC000875012604	EE	On-Demand	Anodyne	KCNA5	17	42
CC(=O)Nc1cccc2c1CN(C(=O)N[C@H](C)c1cccnc1)CC2	ZINC000875012605	EF	On-Demand	Anodyne	MAPK1	42	38
CC(=O)Nc1cccc2c1CN(C(=O)N[C@H](C)c1cccnc1)CC2	ZINC000875012605	EF	On-Demand	Anodyne	P2RY14	27	40
CC(=O)Nc1cccc2c1CN(C(=O)N[C@@H](C)c1cccnc1)CC2	ZINC000875012606	EF	On-Demand	Anodyne	MAPK1	42	38
CC(=O)Nc1cccc2c1CN(C(=O)N[C@@H](C)c1cccnc1)CC2	ZINC000875012606	EF	On-Demand	Anodyne	P2RY14	27	40
C[C@@H](NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1)c1cccnc1	ZINC000875012611	DF	On-Demand	Anodyne	KCNA5	22	41
C[C@H](NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1)c1cccnc1	ZINC000875012612	DF	On-Demand	Anodyne	KCNA5	22	41
C[C@@H](NC(=O)NC1CC(C(=O)OC(C)(C)C)C1)c1cccnc1	ZINC000875012627	DF	On-Demand	Anodyne	KCNA5	19	42
C[C@H](NC(=O)NC1CC(C(=O)OC(C)(C)C)C1)c1cccnc1	ZINC000875012630	DF	On-Demand	Anodyne	KCNA5	19	42
C[C@@H](NC(=O)NCC1CCC2(CC1)CC2)c1cccnc1	ZINC000875012631	CG	On-Demand	Anodyne	KCNA5	23	49
C[C@H](NC(=O)NCC1CCC2(CC1)CC2)c1cccnc1	ZINC000875012632	CG	On-Demand	Anodyne	KCNA5	23	49
O=C(N[C@H](Cc1ccccc1)c1ccccc1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875012639	GG	On-Demand	Anodyne	F11	32	40
O=C(N[C@H](Cc1ccccc1)c1ccccc1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875012640	GG	On-Demand	Anodyne	F11	32	40
O=C(N[C@H](Cc1ccccc1)c1ccccc1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875012641	GG	On-Demand	Anodyne	F11	32	40
O=C(N[C@H](Cc1ccccc1)c1ccccc1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875012642	GG	On-Demand	Anodyne	F11	32	40
CONC(=O)C1CCN(C(=O)N[C@H](C)c2cccnc2)CC1	ZINC000875012643	DD	On-Demand	Anodyne	PTAFR	19	44
CONC(=O)C1CCN(C(=O)N[C@@H](C)c2cccnc2)CC1	ZINC000875012644	DD	On-Demand	Anodyne	PTAFR	19	44
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(OC(F)F)cc2)C1	ZINC000875012691	EF	On-Demand	Anodyne	DPP7	63	41
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(OC(F)F)cc2)C1	ZINC000875012692	EF	On-Demand	Anodyne	DPP7	63	41
CCC[C@H](CC)C(=O)N(c1ccccc1)c1nc(C)cs1	ZINC000875012699	DJ	On-Demand	Anodyne	SLC12A5	22	43
C[C@@H](NC(=O)NCCOC(F)(F)C(F)(F)F)c1cccnc1	ZINC000875012705	EF	On-Demand	Anodyne	KCNA5	23	47
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@H](C)c1cccnc1	ZINC000875012716	CE	On-Demand	Anodyne	KCNA5	19	42
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@@H](C)c1cccnc1	ZINC000875012718	CE	On-Demand	Anodyne	KCNA5	19	42
CCOC1CC2(C1)C[C@H]2NC(=O)N[C@@H](C)c1cccnc1	ZINC000875012720	CE	On-Demand	Anodyne	KCNA5	19	42
C[C@H](NC(=O)NC[C@@]12COCCN1C(=O)COC2)c1cccnc1	ZINC000875012750	EC	On-Demand	Anodyne	KCNA5	18	41
C[C@@H](NC(=O)NC[C@]12COCCN1C(=O)COC2)c1cccnc1	ZINC000875012751	EC	On-Demand	Anodyne	KCNA5	18	41
C[C@@H](NC(=O)NC[C@@]12COCCN1C(=O)COC2)c1cccnc1	ZINC000875012753	EC	On-Demand	Anodyne	KCNA5	18	41
C[C@H](NC(=O)NC1CC(Nc2ccccc2)C1)c1cccnc1	ZINC000875012755	DG	On-Demand	Anodyne	PTAFR	17	44
C[C@H](NC(=O)NC1CC(Nc2ccccc2)C1)c1cccnc1	ZINC000875012755	DG	On-Demand	Anodyne	KCNA5	25	48
C[C@@H](NC(=O)NC1CC(Nc2ccccc2)C1)c1cccnc1	ZINC000875012758	DG	On-Demand	Anodyne	PTAFR	17	44
C[C@@H](NC(=O)NC1CC(Nc2ccccc2)C1)c1cccnc1	ZINC000875012758	DG	On-Demand	Anodyne	KCNA5	25	48
C[C@H](NC(=O)N1C[C@@]2(C)CS(=O)(=O)C[C@@]2(C)C1)c1cccnc1	ZINC000875012776	ED	On-Demand	Anodyne	PTAFR	22	43
C[C@@H](NC(=O)N1C[C@@]2(C)CS(=O)(=O)C[C@@]2(C)C1)c1cccnc1	ZINC000875012779	ED	On-Demand	Anodyne	PTAFR	22	43
C[C@H](NC(=O)NCC(C)(C)C(C)(F)F)c1cccnc1	ZINC000875012809	CG	On-Demand	Anodyne	KCNA5	23	50
C[C@@H](NC(=O)NCC(C)(C)C(C)(F)F)c1cccnc1	ZINC000875012810	CG	On-Demand	Anodyne	KCNA5	23	50
CCOC(=O)C1=CC[C@@H](NC(=O)N[C@H](C)c2cccnc2)C1	ZINC000875012817	DE	On-Demand	Anodyne	KCNA5	19	43
CCOC(=O)C1=CC[C@@H](NC(=O)N[C@H](C)c2cccnc2)C1	ZINC000875012817	DE	On-Demand	Anodyne	CAPN2	48	38
CCOC(=O)C1=CC[C@H](NC(=O)N[C@@H](C)c2cccnc2)C1	ZINC000875012818	DE	On-Demand	Anodyne	KCNA5	19	43
CCOC(=O)C1=CC[C@H](NC(=O)N[C@@H](C)c2cccnc2)C1	ZINC000875012818	DE	On-Demand	Anodyne	CAPN2	48	38
CCOC(=O)C1=CC[C@H](NC(=O)N[C@H](C)c2cccnc2)C1	ZINC000875012819	DE	On-Demand	Anodyne	KCNA5	19	43
CCOC(=O)C1=CC[C@H](NC(=O)N[C@H](C)c2cccnc2)C1	ZINC000875012819	DE	On-Demand	Anodyne	CAPN2	48	38
CCOC(=O)C1=CC[C@@H](NC(=O)N[C@@H](C)c2cccnc2)C1	ZINC000875012820	DE	On-Demand	Anodyne	KCNA5	19	43
CCOC(=O)C1=CC[C@@H](NC(=O)N[C@@H](C)c2cccnc2)C1	ZINC000875012820	DE	On-Demand	Anodyne	CAPN2	48	38
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1cccnc1	ZINC000875012822	DF	On-Demand	Anodyne	PTAFR	18	47
CCn1ncc(CNC(=O)N[C@@H](C)c2cccnc2)n1	ZINC000875012849	CD	On-Demand	Anodyne	KCNA5	21	47
CCn1ncc(CNC(=O)N[C@@H](C)c2cccnc2)n1	ZINC000875012849	CD	On-Demand	Anodyne	NAMPT	23	44
CCn1ncc(CNC(=O)N[C@H](C)c2cccnc2)n1	ZINC000875012850	CD	On-Demand	Anodyne	KCNA5	21	47
CCn1ncc(CNC(=O)N[C@H](C)c2cccnc2)n1	ZINC000875012850	CD	On-Demand	Anodyne	NAMPT	23	44
C[C@H](NC(=O)NC[C@H]1CCC12CCOCC2)c1cccnc1	ZINC000875012852	DF	On-Demand	Anodyne	KCNA5	21	46
C[C@@H](NC(=O)NC[C@@H]1CCC12CCOCC2)c1cccnc1	ZINC000875012854	DF	On-Demand	Anodyne	KCNA5	21	46
C[C@@H](NC(=O)NC[C@H]1CCC12CCOCC2)c1cccnc1	ZINC000875012866	DF	On-Demand	Anodyne	KCNA5	21	46
COc1ccccc1[C@H]1CN(C(=O)N[C@@H](C)c2cccnc2)CCO1	ZINC000875012868	EF	On-Demand	Anodyne	PTAFR	27	40
COc1ccccc1[C@@H]1CN(C(=O)N[C@H](C)c2cccnc2)CCO1	ZINC000875012869	EF	On-Demand	Anodyne	PTAFR	27	40
COc1ccccc1[C@@H]1CN(C(=O)N[C@@H](C)c2cccnc2)CCO1	ZINC000875012870	EF	On-Demand	Anodyne	PTAFR	27	40
COc1ccccc1[C@H]1CN(C(=O)N[C@H](C)c2cccnc2)CCO1	ZINC000875012871	EF	On-Demand	Anodyne	PTAFR	27	40
C#CC[C@@H](COC)NC(=O)N[C@@H](C)c1cccnc1	ZINC000875012887	CD	On-Demand	Mild	KCNA5	21	42
C#CC[C@H](COC)NC(=O)N[C@H](C)c1cccnc1	ZINC000875012888	CD	On-Demand	Mild	KCNA5	21	42
C#CC[C@H](COC)NC(=O)N[C@@H](C)c1cccnc1	ZINC000875012889	CD	On-Demand	Mild	KCNA5	21	42
C#CC[C@@H](COC)NC(=O)N[C@H](C)c1cccnc1	ZINC000875012890	CD	On-Demand	Mild	KCNA5	21	42
COc1ccc(N2CCN(C(=O)N[C@@H](C)c3cccnc3)CC2)c(OC)c1	ZINC000875012891	FF	On-Demand	Clean	HTR1A	30	43
COc1ccc(N2CCN(C(=O)N[C@@H](C)c3cccnc3)CC2)c(OC)c1	ZINC000875012891	FF	On-Demand	Clean	DRD2	22	41
COc1ccc(N2CCN(C(=O)N[C@@H](C)c3cccnc3)CC2)c(OC)c1	ZINC000875012891	FF	On-Demand	Clean	DRD4	40	32
COc1ccc(N2CCN(C(=O)N[C@@H](C)c3cccnc3)CC2)c(OC)c1	ZINC000875012891	FF	On-Demand	Clean	PDGFRB	45	44
COc1ccc(N2CCN(C(=O)N[C@@H](C)c3cccnc3)CC2)c(OC)c1	ZINC000875012891	FF	On-Demand	Clean	PTAFR	34	43
COc1ccc(N2CCN(C(=O)N[C@H](C)c3cccnc3)CC2)c(OC)c1	ZINC000875012892	FF	On-Demand	Clean	HTR1A	30	43
COc1ccc(N2CCN(C(=O)N[C@H](C)c3cccnc3)CC2)c(OC)c1	ZINC000875012892	FF	On-Demand	Clean	DRD2	22	41
COc1ccc(N2CCN(C(=O)N[C@H](C)c3cccnc3)CC2)c(OC)c1	ZINC000875012892	FF	On-Demand	Clean	DRD4	40	32
COc1ccc(N2CCN(C(=O)N[C@H](C)c3cccnc3)CC2)c(OC)c1	ZINC000875012892	FF	On-Demand	Clean	PDGFRB	45	44
COc1ccc(N2CCN(C(=O)N[C@H](C)c3cccnc3)CC2)c(OC)c1	ZINC000875012892	FF	On-Demand	Clean	PTAFR	34	43
C[C@@H](NC(=O)N(C)CCc1cccc(C#N)c1)c1cccnc1	ZINC000875012897	DF	On-Demand	Mild	PTAFR	20	40
C[C@@H](NC(=O)N(C)CCc1cccc(C#N)c1)c1cccnc1	ZINC000875012897	DF	On-Demand	Mild	KCNA5	19	48
C[C@@H](NC(=O)N(C)CCc1cccc(C#N)c1)c1cccnc1	ZINC000875012897	DF	On-Demand	Mild	PTGES	22	42
C[C@H](NC(=O)C(=O)NCCCO[C@@H](C)c1ccccc1)c1ccnn1C	ZINC000875012899	FD	On-Demand	Anodyne	C3AR1	42	34
C[C@H](NC(=O)C(=O)NCCCO[C@H](C)c1ccccc1)c1ccnn1C	ZINC000875012901	FD	On-Demand	Anodyne	C3AR1	42	34
C[C@@H](NC(=O)NCCCCC1CC1)c1cccnc1	ZINC000875012908	CG	On-Demand	Anodyne	KCNA5	24	50
C[C@@H](NC(=O)NCCCCC1CC1)c1cccnc1	ZINC000875012908	CG	On-Demand	Anodyne	NAMPT	18	43
C[C@H](NC(=O)NCCCCC1CC1)c1cccnc1	ZINC000875012909	CG	On-Demand	Anodyne	KCNA5	24	50
C[C@H](NC(=O)NCCCCC1CC1)c1cccnc1	ZINC000875012909	CG	On-Demand	Anodyne	NAMPT	18	43
Cc1cccc(CN2CCO[C@H](CNC(=O)N[C@@H](C)c3cccnc3)C2)c1	ZINC000875012910	FF	On-Demand	Anodyne	KCNA5	18	44
Cc1cccc(CN2CCO[C@@H](CNC(=O)N[C@@H](C)c3cccnc3)C2)c1	ZINC000875012911	FF	On-Demand	Anodyne	KCNA5	18	44
Cc1cccc(CN2CCO[C@@H](CNC(=O)N[C@H](C)c3cccnc3)C2)c1	ZINC000875012912	FF	On-Demand	Anodyne	KCNA5	18	44
Cc1cccc(CN2CCO[C@H](CNC(=O)N[C@H](C)c3cccnc3)C2)c1	ZINC000875012913	FF	On-Demand	Anodyne	KCNA5	18	44
C[C@@H](NC(=O)N1Cc2cccc(O)c2C1)c1cccnc1	ZINC000875012916	CF	On-Demand	Clean	PTAFR	18	42
C[C@H](NC(=O)N1Cc2cccc(O)c2C1)c1cccnc1	ZINC000875012917	CF	On-Demand	Clean	PTAFR	18	42
C[C@@H](NC(=O)NC(c1ccnn1C)c1ccnn1C)c1cccnc1	ZINC000875012923	ED	On-Demand	Anodyne	KCNA5	24	45
C[C@H](NC(=O)NC(c1ccnn1C)c1ccnn1C)c1cccnc1	ZINC000875012924	ED	On-Demand	Anodyne	KCNA5	24	45
CS[C@@H]1C[C@@H](NC(=O)N[C@@H](C)c2cccnc2)C1	ZINC000875012929	CE	On-Demand	Anodyne	KCNA5	20	44
CS[C@@H]1C[C@@H](NC(=O)N[C@H](C)c2cccnc2)C1	ZINC000875012930	CE	On-Demand	Anodyne	KCNA5	20	44
O=CN1CCCN(C(=O)N[C@@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875012940	FF	On-Demand	Anodyne	ACE	23	41
O=CN1CCCN(C(=O)N[C@@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875012940	FF	On-Demand	Anodyne	MME	41	41
O=CN1CCCN(C(=O)N[C@@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875012940	FF	On-Demand	Anodyne	CAPN1	49	37
O=CN1CCCN(C(=O)N[C@@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875012940	FF	On-Demand	Anodyne	CAPN2	43	30
O=CN1CCCN(C(=O)N[C@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875012941	FF	On-Demand	Anodyne	ACE	23	41
O=CN1CCCN(C(=O)N[C@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875012941	FF	On-Demand	Anodyne	MME	41	41
O=CN1CCCN(C(=O)N[C@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875012941	FF	On-Demand	Anodyne	CAPN1	49	37
O=CN1CCCN(C(=O)N[C@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875012941	FF	On-Demand	Anodyne	CAPN2	43	30
C[C@@H](NC(=O)NCC1CC(NC(=O)OC(C)(C)C)C1)c1cccnc1	ZINC000875012956	EF	On-Demand	Anodyne	KCNA5	19	44
C[C@H](NC(=O)NC[C@@H]1C[C@H](NC(=O)OC(C)(C)C)C1)c1cccnc1	ZINC000875012957	EF	On-Demand	Anodyne	KCNA5	19	44
C[C@@H](NC(=O)NC[C@@H]1C[C@H](NC(=O)OC(C)(C)C)C1)c1cccnc1	ZINC000875012958	EF	On-Demand	Anodyne	KCNA5	19	44
C[C@H](NC(=O)NCC1CC(NC(=O)OC(C)(C)C)C1)c1cccnc1	ZINC000875012959	EF	On-Demand	Anodyne	KCNA5	19	44
C[C@@H](NC(=O)NC[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)c1cccnc1	ZINC000875012960	EF	On-Demand	Anodyne	KCNA5	19	44
C[C@H](NC(=O)NC[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)c1cccnc1	ZINC000875012961	EF	On-Demand	Anodyne	KCNA5	19	44
C[C@@H](NC(=O)NC1CCC(OC(C)(C)C)CC1)c1cccnc1	ZINC000875012969	DH	On-Demand	Anodyne	KCNA5	18	42
C[C@H](NC(=O)NC1CCC(OC(C)(C)C)CC1)c1cccnc1	ZINC000875012970	DH	On-Demand	Anodyne	KCNA5	18	42
C[C@@H](NC(=O)N1CCC(c2nnnn2C)CC1)c1cccnc1	ZINC000875012986	DD	On-Demand	Anodyne	PTAFR	16	43
C[C@@H](NC(=O)NC[C@@H]1C[C@H]1C1CCOCC1)c1cccnc1	ZINC000875012996	DF	On-Demand	Anodyne	KCNA5	19	45
C[C@H](NC(=O)NC[C@@H]1C[C@H]1C1CCOCC1)c1cccnc1	ZINC000875012997	DF	On-Demand	Anodyne	KCNA5	19	45
C[C@H](NC(=O)NC1CCN(CC(=O)OC(C)(C)C)CC1)c1cccnc1	ZINC000875012998	FE	On-Demand	Anodyne	C3AR1	40	37
C[C@@H](NC(=O)NC1CCN(CC(=O)OC(C)(C)C)CC1)c1cccnc1	ZINC000875012999	FE	On-Demand	Anodyne	C3AR1	40	37
Cc1nccnc1[C@@H](C)NC(=O)N[C@@H](C)c1cccnc1	ZINC000875013000	CE	On-Demand	Anodyne	KCNA5	22	47
Cc1nccnc1[C@H](C)NC(=O)N[C@@H](C)c1cccnc1	ZINC000875013001	CE	On-Demand	Anodyne	KCNA5	22	47
Cc1nccnc1[C@H](C)NC(=O)N[C@H](C)c1cccnc1	ZINC000875013002	CE	On-Demand	Anodyne	KCNA5	22	47
Cc1nccnc1[C@@H](C)NC(=O)N[C@H](C)c1cccnc1	ZINC000875013003	CE	On-Demand	Anodyne	KCNA5	22	47
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccnc1	ZINC000875013019	GG	On-Demand	Anodyne	ACE	15	41
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccnc1	ZINC000875013019	GG	On-Demand	Anodyne	GRIN2B	25	48
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccnc1	ZINC000875013019	GG	On-Demand	Anodyne	ELANE	29	40
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccnc1	ZINC000875013019	GG	On-Demand	Anodyne	PTAFR	37	45
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccnc1	ZINC000875013019	GG	On-Demand	Anodyne	KLK3	64	34
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccnc1	ZINC000875013019	GG	On-Demand	Anodyne	CTSB	63	48
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccnc1	ZINC000875013019	GG	On-Demand	Anodyne	PAPA1_CARPA	45	35
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccnc1	ZINC000875013019	GG	On-Demand	Anodyne	CYSP_TRYCR	60	41
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccnc1	ZINC000875013019	GG	On-Demand	Anodyne	CTSK	58	48
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccnc1	ZINC000875013019	GG	On-Demand	Anodyne	CTSL	46	48
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccnc1	ZINC000875013019	GG	On-Demand	Anodyne	CHRNA7	49	41
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccnc1	ZINC000875013019	GG	On-Demand	Anodyne	C3AR1	52	51
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccnc1	ZINC000875013019	GG	On-Demand	Anodyne	PREP	26	42
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccnc1	ZINC000875013019	GG	On-Demand	Anodyne	CAPNS1	64	36
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccnc1	ZINC000875013019	GG	On-Demand	Anodyne	CTSS	27	45
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccnc1	ZINC000875013019	GG	On-Demand	Anodyne	CAPN1	84	38
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccnc1	ZINC000875013019	GG	On-Demand	Anodyne	CASP1	24	41
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccnc1	ZINC000875013019	GG	On-Demand	Anodyne	CAPN2	141	44
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccnc1	ZINC000875013019	GG	On-Demand	Anodyne	TGM2	42	43
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccnc1	ZINC000875013019	GG	On-Demand	Anodyne	NPR	55	32
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccnc1	ZINC000875013019	GG	On-Demand	Anodyne	F13A1	25	43
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccnc1	ZINC000875013019	GG	On-Demand	Anodyne	BIRC2	29	43
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccnc1	ZINC000875013019	GG	On-Demand	Anodyne	BIRC8	40	32
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccnc1	ZINC000875013019	GG	On-Demand	Anodyne	ACHP_LYMST	22	41
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccnc1	ZINC000875013019	GG	On-Demand	Anodyne	Q6PRC7_IXORI	53	36
C[C@@H](NC(=O)NCC[C@H]1CCSC1)c1cccnc1	ZINC000875013020	CF	On-Demand	Anodyne	KCNA5	22	49
C[C@@H](NC(=O)NCC[C@@H]1CCSC1)c1cccnc1	ZINC000875013023	CF	On-Demand	Anodyne	KCNA5	22	49
C[C@H](NC(=O)NC[C@@H]1CCO[C@H]1c1cn[nH]c1)c1cccnc1	ZINC000875013026	DD	On-Demand	Anodyne	KCNA5	18	44
C[C@@H](NC(=O)NC[C@@H]1CCO[C@H]1c1cn[nH]c1)c1cccnc1	ZINC000875013027	DD	On-Demand	Anodyne	KCNA5	18	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cccnc1	ZINC000875013039	DD	On-Demand	Anodyne	SLC6A4	23	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cccnc1	ZINC000875013039	DD	On-Demand	Anodyne	SLC6A3	47	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cccnc1	ZINC000875013040	DD	On-Demand	Anodyne	SLC6A4	23	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cccnc1	ZINC000875013040	DD	On-Demand	Anodyne	SLC6A3	47	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cccnc1	ZINC000875013041	DD	On-Demand	Anodyne	SLC6A4	23	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cccnc1	ZINC000875013041	DD	On-Demand	Anodyne	SLC6A3	47	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cccnc1	ZINC000875013042	DD	On-Demand	Anodyne	SLC6A4	23	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cccnc1	ZINC000875013042	DD	On-Demand	Anodyne	SLC6A3	47	45
CONC(=O)C1CCN(C(=O)N[C@@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875013050	GG	On-Demand	Anodyne	SLC6A3	15	44
CONC(=O)C1CCN(C(=O)N[C@@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875013050	GG	On-Demand	Anodyne	CCR5	31	42
CONC(=O)C1CCN(C(=O)N[C@@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875013050	GG	On-Demand	Anodyne	F11	50	46
CONC(=O)C1CCN(C(=O)N[C@@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875013050	GG	On-Demand	Anodyne	CAPN1	46	48
CONC(=O)C1CCN(C(=O)N[C@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875013051	GG	On-Demand	Anodyne	SLC6A3	15	44
CONC(=O)C1CCN(C(=O)N[C@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875013051	GG	On-Demand	Anodyne	CCR5	31	42
CONC(=O)C1CCN(C(=O)N[C@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875013051	GG	On-Demand	Anodyne	F11	50	46
CONC(=O)C1CCN(C(=O)N[C@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875013051	GG	On-Demand	Anodyne	CAPN1	46	48
Cc1cncc([C@@H]2CCCN2C(=O)N[C@H](C)c2cccnc2)c1	ZINC000875013055	DG	On-Demand	Anodyne	CHRNA7	33	41
Cc1cncc([C@@H]2CCCN2C(=O)N[C@H](C)c2cccnc2)c1	ZINC000875013055	DG	On-Demand	Anodyne	ADAM17	17	40
Cc1cncc([C@@H]2CCCN2C(=O)N[C@H](C)c2cccnc2)c1	ZINC000875013055	DG	On-Demand	Anodyne	PREP	20	42
Cc1cncc([C@H]2CCCN2C(=O)N[C@H](C)c2cccnc2)c1	ZINC000875013056	DG	On-Demand	Anodyne	CHRNA7	33	41
Cc1cncc([C@H]2CCCN2C(=O)N[C@H](C)c2cccnc2)c1	ZINC000875013056	DG	On-Demand	Anodyne	ADAM17	17	40
Cc1cncc([C@H]2CCCN2C(=O)N[C@H](C)c2cccnc2)c1	ZINC000875013056	DG	On-Demand	Anodyne	PREP	20	42
Cc1cncc([C@H]2CCCN2C(=O)N[C@@H](C)c2cccnc2)c1	ZINC000875013057	DG	On-Demand	Anodyne	CHRNA7	33	41
Cc1cncc([C@H]2CCCN2C(=O)N[C@@H](C)c2cccnc2)c1	ZINC000875013057	DG	On-Demand	Anodyne	ADAM17	17	40
Cc1cncc([C@H]2CCCN2C(=O)N[C@@H](C)c2cccnc2)c1	ZINC000875013057	DG	On-Demand	Anodyne	PREP	20	42
Cc1cncc([C@@H]2CCCN2C(=O)N[C@@H](C)c2cccnc2)c1	ZINC000875013058	DG	On-Demand	Anodyne	CHRNA7	33	41
Cc1cncc([C@@H]2CCCN2C(=O)N[C@@H](C)c2cccnc2)c1	ZINC000875013058	DG	On-Demand	Anodyne	ADAM17	17	40
Cc1cncc([C@@H]2CCCN2C(=O)N[C@@H](C)c2cccnc2)c1	ZINC000875013058	DG	On-Demand	Anodyne	PREP	20	42
O=C(COc1ccc2ccc(=O)oc2c1)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000875013059	JJ	On-Demand	Anodyne	MAOA	41	39
O=C(COc1ccc2ccc(=O)oc2c1)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000875013059	JJ	On-Demand	Anodyne	MAOB	15	40
O=C(COc1ccc2ccc(=O)oc2c1)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000875013059	JJ	On-Demand	Anodyne	SCD1	35	40
O=C(COc1ccc2ccc(=O)oc2c1)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000875013059	JJ	On-Demand	Anodyne	SCD	33	47
CC(=O)N(C)c1ccc(CNC(=O)N[C@H](C)c2cccnc2)cc1	ZINC000875013062	EF	On-Demand	Anodyne	KCNA5	22	48
CC(=O)N(C)c1ccc(CNC(=O)N[C@H](C)c2cccnc2)cc1	ZINC000875013062	EF	On-Demand	Anodyne	NAMPT	53	44
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H](C)c2cccnc2)cc1	ZINC000875013063	EF	On-Demand	Anodyne	KCNA5	22	48
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H](C)c2cccnc2)cc1	ZINC000875013063	EF	On-Demand	Anodyne	NAMPT	53	44
C[C@@H](NC(=O)N1CCN(C)c2ncccc2C1)c1cccnc1	ZINC000875013064	DE	On-Demand	Anodyne	PTAFR	29	44
C[C@@H](NC(=O)N1CCC[C@@](O)(c2ccccc2)C1)c1cccnc1	ZINC000875013066	EF	On-Demand	Anodyne	OPRL1	17	49
C[C@@H](NC(=O)N1CCC[C@@](O)(c2ccccc2)C1)c1cccnc1	ZINC000875013066	EF	On-Demand	Anodyne	PTAFR	24	48
C[C@@H](NC(=O)N1CCC[C@](O)(c2ccccc2)C1)c1cccnc1	ZINC000875013067	EF	On-Demand	Anodyne	OPRL1	17	49
C[C@@H](NC(=O)N1CCC[C@](O)(c2ccccc2)C1)c1cccnc1	ZINC000875013067	EF	On-Demand	Anodyne	PTAFR	24	48
CC[C@@H](NC(=O)N[C@H](C)c1cccnc1)c1cccc(OC)c1OC	ZINC000875013072	EH	On-Demand	Anodyne	KCNA5	19	41
CC[C@@H](NC(=O)N[C@H](C)c1cccnc1)c1cccc(OC)c1OC	ZINC000875013072	EH	On-Demand	Anodyne	TACR3	35	41
CC[C@@H](NC(=O)N[C@@H](C)c1cccnc1)c1cccc(OC)c1OC	ZINC000875013073	EH	On-Demand	Anodyne	KCNA5	19	41
CC[C@@H](NC(=O)N[C@@H](C)c1cccnc1)c1cccc(OC)c1OC	ZINC000875013073	EH	On-Demand	Anodyne	TACR3	35	41
C[C@H](NC(=O)NC1([C@H]2CCCCO2)CCC1)c1cccnc1	ZINC000875013074	DF	On-Demand	Anodyne	KCNA5	20	44
C[C@@H](NC(=O)NC1([C@@H]2CCCCO2)CCC1)c1cccnc1	ZINC000875013075	DF	On-Demand	Anodyne	KCNA5	20	44
C[C@@H](NC(=O)NC1([C@H]2CCCCO2)CCC1)c1cccnc1	ZINC000875013076	DF	On-Demand	Anodyne	KCNA5	20	44
C[C@H](NC(=O)NC1([C@@H]2CCCCO2)CCC1)c1cccnc1	ZINC000875013077	DF	On-Demand	Anodyne	KCNA5	20	44
CN1CCC(CNC(=O)NCCNc2ccccn2)(c2ccccc2)CC1	ZINC000875013083	FE	On-Demand	Anodyne	KCNA3	42	38
CN1CCC(CNC(=O)NCCNc2ccccn2)(c2ccccc2)CC1	ZINC000875013083	FE	On-Demand	Anodyne	SOAT1	15	40
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H](C)c3cccnc3)C[C@@H]1C2	ZINC000875013103	DD	On-Demand	Anodyne	KCNA5	21	43
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H](C)c3cccnc3)C[C@@H]1C2	ZINC000875013104	DD	On-Demand	Anodyne	KCNA5	21	43
C[C@H](NC(=O)NC[C@@H]1C[C@@H]2CCC[C@@H]2O1)c1cccnc1	ZINC000875013111	CE	On-Demand	Anodyne	KCNA5	18	45
C[C@H](NC(=O)NC[C@@H]1C[C@H]2CCC[C@H]2O1)c1cccnc1	ZINC000875013112	CE	On-Demand	Anodyne	KCNA5	18	45
C[C@H](NC(=O)NC[C@@H]1C[C@H]2CCC[C@@H]2O1)c1cccnc1	ZINC000875013113	CE	On-Demand	Anodyne	KCNA5	18	45
C[C@H](NC(=O)NC[C@@H]1C[C@@H]2CCC[C@H]2O1)c1cccnc1	ZINC000875013114	CE	On-Demand	Anodyne	KCNA5	18	45
C[C@H](NC(=O)NCCC[C@H]1C=CCC1)c1cccnc1	ZINC000875013115	CG	On-Demand	Anodyne	KCNA5	20	46
C[C@@H](NC(=O)NCCC[C@H]1C=CCC1)c1cccnc1	ZINC000875013116	CG	On-Demand	Anodyne	KCNA5	20	46
C[C@H](NC(=O)NCCC[C@@H]1C=CCC1)c1cccnc1	ZINC000875013117	CG	On-Demand	Anodyne	KCNA5	20	46
C[C@@H](NC(=O)NCCC[C@@H]1C=CCC1)c1cccnc1	ZINC000875013118	CG	On-Demand	Anodyne	KCNA5	20	46
C[C@@H](NC(=O)N1CCCCCCNC(=O)CC1)c1cccnc1	ZINC000875013140	DE	On-Demand	Anodyne	PTAFR	15	44
CC(=O)C1CCN(C(=O)N[C@@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875013159	FH	On-Demand	Anodyne	ACE	54	41
CC(=O)C1CCN(C(=O)N[C@@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875013159	FH	On-Demand	Anodyne	MME	75	41
CC(=O)C1CCN(C(=O)N[C@@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875013159	FH	On-Demand	Anodyne	CCR5	43	43
CC(=O)C1CCN(C(=O)N[C@@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875013159	FH	On-Demand	Anodyne	F11	43	43
CC(=O)C1CCN(C(=O)N[C@@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875013159	FH	On-Demand	Anodyne	CAPN1	37	44
CC(=O)C1CCN(C(=O)N[C@@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875013159	FH	On-Demand	Anodyne	ACE2	49	35
CC(=O)C1CCN(C(=O)N[C@@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875013159	FH	On-Demand	Anodyne	AMP1_PLAFQ	26	40
CC(=O)C1CCN(C(=O)N[C@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875013160	FH	On-Demand	Anodyne	ACE	54	41
CC(=O)C1CCN(C(=O)N[C@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875013160	FH	On-Demand	Anodyne	MME	75	41
CC(=O)C1CCN(C(=O)N[C@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875013160	FH	On-Demand	Anodyne	CCR5	43	43
CC(=O)C1CCN(C(=O)N[C@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875013160	FH	On-Demand	Anodyne	F11	43	43
CC(=O)C1CCN(C(=O)N[C@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875013160	FH	On-Demand	Anodyne	CAPN1	37	44
CC(=O)C1CCN(C(=O)N[C@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875013160	FH	On-Demand	Anodyne	ACE2	49	35
CC(=O)C1CCN(C(=O)N[C@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875013160	FH	On-Demand	Anodyne	AMP1_PLAFQ	26	40
C[C@@H](NC(=O)NCC[C@H](O)C1CCCC1)c1cccnc1	ZINC000875013161	CE	On-Demand	Anodyne	KCNA5	22	48
C[C@@H](NC(=O)NCC[C@@H](O)C1CCCC1)c1cccnc1	ZINC000875013162	CE	On-Demand	Anodyne	KCNA5	22	48
C[C@@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1cccnc1	ZINC000875013165	ED	On-Demand	Anodyne	PTAFR	24	42
C[C@@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1cccnc1	ZINC000875013165	ED	On-Demand	Anodyne	KCNA5	23	44
C[C@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1cccnc1	ZINC000875013166	ED	On-Demand	Anodyne	PTAFR	24	42
C[C@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1cccnc1	ZINC000875013166	ED	On-Demand	Anodyne	KCNA5	23	44
C[C@H](NC(=O)NC[C@H]1CC2(CCOCC2)CO1)c1cccnc1	ZINC000875013169	DE	On-Demand	Anodyne	KCNA5	19	43
C[C@@H](NC(=O)NC[C@@H]1CC2(CCOCC2)CO1)c1cccnc1	ZINC000875013170	DE	On-Demand	Anodyne	KCNA5	19	43
C[C@@H](NC(=O)NC[C@H]1CC2(CCOCC2)CO1)c1cccnc1	ZINC000875013171	DE	On-Demand	Anodyne	KCNA5	19	43
C[C@H](NC(=O)NC1CCN(c2ccccc2C#N)CC1)c1cccnc1	ZINC000875013177	EF	On-Demand	Mild	PTAFR	22	41
C[C@H](NC(=O)NC1CCN(c2ccccc2C#N)CC1)c1cccnc1	ZINC000875013177	EF	On-Demand	Mild	KCNA5	21	42
C[C@@H](NC(=O)NC1CCN(c2ccccc2C#N)CC1)c1cccnc1	ZINC000875013178	EF	On-Demand	Mild	PTAFR	22	41
C[C@@H](NC(=O)NC1CCN(c2ccccc2C#N)CC1)c1cccnc1	ZINC000875013178	EF	On-Demand	Mild	KCNA5	21	42
C[C@H](NC(=O)N1C[C@H](N(C)C)[C@H](n2ccnn2)C1)c1cccnc1	ZINC000875013179	EC	On-Demand	Anodyne	KCNA5	18	42
C[C@@H](NC(=O)N1C[C@H](N(C)C)[C@H](n2ccnn2)C1)c1cccnc1	ZINC000875013180	EC	On-Demand	Anodyne	KCNA5	18	42
C[C@H](NC(=O)NC(C)(C)[C@H]1CCCCO1)c1cccnc1	ZINC000875013183	CF	On-Demand	Anodyne	KCNA5	20	45
C[C@H](NC(=O)NC(C)(C)[C@@H]1CCCCO1)c1cccnc1	ZINC000875013184	CF	On-Demand	Anodyne	KCNA5	20	45
C[C@@H](NC(=O)NC(C)(C)[C@@H]1CCCCO1)c1cccnc1	ZINC000875013185	CF	On-Demand	Anodyne	KCNA5	20	45
C[C@@H](NC(=O)NC(C)(C)[C@H]1CCCCO1)c1cccnc1	ZINC000875013186	CF	On-Demand	Anodyne	KCNA5	20	45
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)c1cccnc1	ZINC000875013197	CD	On-Demand	Anodyne	KCNA5	22	46
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)c1cccnc1	ZINC000875013198	CD	On-Demand	Anodyne	KCNA5	22	46
O=CN1CCCN(C(=O)NCCOc2ccc(Cl)cc2)CC1	ZINC000875013207	ED	On-Demand	Anodyne	EPHX2	15	40
C[C@H](NC(=O)NC[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12)c1cccnc1	ZINC000875013209	CF	On-Demand	Anodyne	KCNA5	20	48
C[C@H](NC(=O)NC[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21)c1cccnc1	ZINC000875013210	CF	On-Demand	Anodyne	KCNA5	20	48
C[C@H](NC(=O)NC[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12)c1cccnc1	ZINC000875013211	CF	On-Demand	Anodyne	KCNA5	20	48
C[C@H](NC(=O)NC[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21)c1cccnc1	ZINC000875013212	CF	On-Demand	Anodyne	KCNA5	20	48
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875013217	GE	On-Demand	Anodyne	CHRM2	15	40
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875013217	GE	On-Demand	Anodyne	DRD4	45	50
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875013217	GE	On-Demand	Anodyne	CHRM3	18	40
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875013217	GE	On-Demand	Anodyne	SIGMAR1	32	56
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875013217	GE	On-Demand	Anodyne	CCR1	16	43
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875013217	GE	On-Demand	Anodyne	CCR3	17	43
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875013217	GE	On-Demand	Anodyne	CXCR3	46	53
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875013217	GE	On-Demand	Anodyne	MCHR1	48	48
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875013217	GE	On-Demand	Anodyne	CACNA1G	21	42
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875013218	GE	On-Demand	Anodyne	CHRM2	15	40
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875013218	GE	On-Demand	Anodyne	DRD4	45	50
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875013218	GE	On-Demand	Anodyne	CHRM3	18	40
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875013218	GE	On-Demand	Anodyne	SIGMAR1	32	56
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875013218	GE	On-Demand	Anodyne	CCR1	16	43
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875013218	GE	On-Demand	Anodyne	CCR3	17	43
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875013218	GE	On-Demand	Anodyne	CXCR3	46	53
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875013218	GE	On-Demand	Anodyne	MCHR1	48	48
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875013218	GE	On-Demand	Anodyne	CACNA1G	21	42
C[C@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)c1cccnc1	ZINC000875013230	FG	On-Demand	Anodyne	PTAFR	21	41
C[C@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)c1cccnc1	ZINC000875013230	FG	On-Demand	Anodyne	KCNA5	25	48
C[C@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)c1cccnc1	ZINC000875013230	FG	On-Demand	Anodyne	KCNA3	41	36
C[C@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)c1cccnc1	ZINC000875013230	FG	On-Demand	Anodyne	SLC6A9	16	40
C[C@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)c1cccnc1	ZINC000875013230	FG	On-Demand	Anodyne	SOAT1	18	44
C[C@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)c1cccnc1	ZINC000875013230	FG	On-Demand	Anodyne	NAMPT	19	46
C[C@@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)c1cccnc1	ZINC000875013231	FG	On-Demand	Anodyne	PTAFR	21	41
C[C@@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)c1cccnc1	ZINC000875013231	FG	On-Demand	Anodyne	KCNA5	25	48
C[C@@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)c1cccnc1	ZINC000875013231	FG	On-Demand	Anodyne	KCNA3	41	36
C[C@@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)c1cccnc1	ZINC000875013231	FG	On-Demand	Anodyne	SLC6A9	16	40
C[C@@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)c1cccnc1	ZINC000875013231	FG	On-Demand	Anodyne	SOAT1	18	44
C[C@@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)c1cccnc1	ZINC000875013231	FG	On-Demand	Anodyne	NAMPT	19	46
C[C@H]1CC[C@@H](C(=O)NNC(=O)N[C@@H](C)c2cccnc2)O1	ZINC000875013232	CD	On-Demand	Reactive	KCNA5	18	42
C[C@H]1CC[C@@H](C(=O)NNC(=O)N[C@H](C)c2cccnc2)O1	ZINC000875013233	CD	On-Demand	Reactive	KCNA5	18	42
Cc1nnc(NNC(=O)N[C@H](C)c2cccnc2)n1C	ZINC000875013236	CC	On-Demand	Reactive	KCNA5	19	41
Cc1nnc(NNC(=O)N[C@@H](C)c2cccnc2)n1C	ZINC000875013237	CC	On-Demand	Reactive	KCNA5	19	41
Cn1nnnc1C1CCN(C(=O)N[C@@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875013239	GG	On-Demand	Anodyne	CCR5	24	40
Cn1nnnc1C1CCN(C(=O)N[C@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000875013240	GG	On-Demand	Anodyne	CCR5	24	40
COCC1CC(NC(=O)N[C@H](C)c2cccnc2)C1	ZINC000875013246	CD	On-Demand	Anodyne	KCNA5	23	45
COCC1CC(NC(=O)N[C@@H](C)c2cccnc2)C1	ZINC000875013247	CD	On-Demand	Anodyne	KCNA5	23	45
COC(=O)N(C)NC(=O)NCC1(N(C)C)CCCCCC1	ZINC000875013252	DD	On-Demand	Reactive	SLC6A5	15	43
C[C@H](NC(=O)NCC(F)(F)c1ccc(F)cc1F)c1cccnc1	ZINC000875013268	EH	On-Demand	Anodyne	KCNA5	19	44
C[C@@H](NC(=O)NCC(F)(F)c1ccc(F)cc1F)c1cccnc1	ZINC000875013269	EH	On-Demand	Anodyne	KCNA5	19	44
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@H](C)c1cccnc1)CC2	ZINC000875013273	EF	On-Demand	Anodyne	PTAFR	15	40
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@H](C)c1cccnc1)CC2	ZINC000875013273	EF	On-Demand	Anodyne	MAPK1	51	43
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@H](C)c1cccnc1)CC2	ZINC000875013273	EF	On-Demand	Anodyne	P2RY14	27	40
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@@H](C)c1cccnc1)CC2	ZINC000875013274	EF	On-Demand	Anodyne	PTAFR	15	40
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@@H](C)c1cccnc1)CC2	ZINC000875013274	EF	On-Demand	Anodyne	MAPK1	51	43
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@@H](C)c1cccnc1)CC2	ZINC000875013274	EF	On-Demand	Anodyne	P2RY14	27	40
C[C@@H](NC(=O)N1CC2(CCN(C(=O)OC(C)(C)C)CC2)C1)c1cccnc1	ZINC000875013279	FG	On-Demand	Anodyne	PTAFR	18	40
C[C@@H](NC(=O)N1CC2(CCN(C(=O)OC(C)(C)C)CC2)C1)c1cccnc1	ZINC000875013279	FG	On-Demand	Anodyne	GPR119	24	40
C[C@@H](NC(=O)N1C[C@@]2(C)CN(C(=O)OC(C)(C)C)C[C@@]2(C)C1)c1cccnc1	ZINC000875013280	GG	On-Demand	Anodyne	PTAFR	22	41
C[C@H](NC(=O)N1C[C@@]2(C)CN(C(=O)OC(C)(C)C)C[C@@]2(C)C1)c1cccnc1	ZINC000875013281	GG	On-Demand	Anodyne	PTAFR	22	41
C[C@@H](NC(=O)NC[C@H]1CCN1C1CCCCCC1)c1cccnc1	ZINC000875013282	EG	On-Demand	Anodyne	KCNA5	21	45
C[C@@H](NC(=O)NC[C@H]1CCN1C1CCCCCC1)c1cccnc1	ZINC000875013282	EG	On-Demand	Anodyne	NAMPT	15	41
C[C@H](NC(=O)NC[C@H]1CCN1C1CCCCCC1)c1cccnc1	ZINC000875013283	EG	On-Demand	Anodyne	KCNA5	21	45
C[C@H](NC(=O)NC[C@H]1CCN1C1CCCCCC1)c1cccnc1	ZINC000875013283	EG	On-Demand	Anodyne	NAMPT	15	41
C[C@@H](NC(=O)NC[C@@H]1CCN1C1CCCCCC1)c1cccnc1	ZINC000875013284	EG	On-Demand	Anodyne	KCNA5	21	45
C[C@@H](NC(=O)NC[C@@H]1CCN1C1CCCCCC1)c1cccnc1	ZINC000875013284	EG	On-Demand	Anodyne	NAMPT	15	41
C[C@H](NC(=O)NC[C@@H]1CCN1C1CCCCCC1)c1cccnc1	ZINC000875013285	EG	On-Demand	Anodyne	KCNA5	21	45
C[C@H](NC(=O)NC[C@@H]1CCN1C1CCCCCC1)c1cccnc1	ZINC000875013285	EG	On-Demand	Anodyne	NAMPT	15	41
C[C@@H](NC(=O)NCC[C@H]1CCCS1)c1cccnc1	ZINC000875013292	CF	On-Demand	Anodyne	KCNA5	22	47
C[C@@H](NC(=O)NCC[C@@H]1CCCS1)c1cccnc1	ZINC000875013294	CF	On-Demand	Anodyne	KCNA5	22	47
C[C@@H](NC(=O)N1CCN(c2ccc(F)cc2C#N)CC1)c1cccnc1	ZINC000875013299	FF	On-Demand	Mild	PTAFR	32	49
C[C@@H](NC(=O)N1CCN(c2ccc(F)cc2C#N)CC1)c1cccnc1	ZINC000875013299	FF	On-Demand	Mild	NPY2R	66	47
C[C@@H](NC(=O)NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O)c1cccnc1	ZINC000875013306	ED	On-Demand	Anodyne	KCNA5	21	48
C[C@H](NC(=O)NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O)c1cccnc1	ZINC000875013307	ED	On-Demand	Anodyne	KCNA5	21	48
C[C@@H](NC(=O)N1CCN([S@](C)(=N)=O)CC1)c1cccnc1	ZINC000875013308	DD	On-Demand	Anodyne	PTAFR	28	49
C[C@@H](NC(=O)N1CCN([S@@](C)(=N)=O)CC1)c1cccnc1	ZINC000875013311	DD	On-Demand	Anodyne	PTAFR	28	49
CC(=O)C1CCN(C(=O)NCCOc2ccc(C(C)(C)C)cc2)CC1	ZINC000875013327	EG	On-Demand	Anodyne	HRH2	26	41
CC(=O)C1CCN(C(=O)NCCOc2ccc(C(C)(C)C)cc2)CC1	ZINC000875013327	EG	On-Demand	Anodyne	HRH3	17	42
CC(=O)C1CCN(C(=O)NCCOc2ccc(C(C)(C)C)cc2)CC1	ZINC000875013327	EG	On-Demand	Anodyne	SLC6A5	27	40
CC[C@@H](CNC(=O)N[C@H]1CCN(CC(C)(C)O)C1)c1ccccc1	ZINC000875013328	EE	On-Demand	Anodyne	CCR5	25	43
CC(=O)C1CCN(C(=O)C(=O)NCc2ccccc2CN2CCCCC2)CC1	ZINC000875013343	GE	On-Demand	Anodyne	HRH3	15	40
CC(=O)C1CCN(C(=O)C(=O)NCc2ccccc2CN2CCCCC2)CC1	ZINC000875013343	GE	On-Demand	Anodyne	SIGMAR1	17	40
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H](CC)c2ccccc2)C1	ZINC000875013344	EG	On-Demand	Anodyne	CAPN2	54	38
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H](CC)c2ccccc2)C1	ZINC000875013346	EG	On-Demand	Anodyne	CAPN2	54	38
COc1ccc(OCCNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875013371	ED	On-Demand	Anodyne	DPP7	18	41
COc1ccc(OCCNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875013372	ED	On-Demand	Anodyne	DPP7	18	41
O=C(CCCOC1CCOCC1)Nc1nc2ccc(Br)cc2s1	ZINC000875013374	GH	On-Demand	Anodyne	LCK	17	40
O=C(CCCOC1CCOCC1)Nc1nc2ccc(Br)cc2s1	ZINC000875013374	GH	On-Demand	Anodyne	CSNK1D	46	49
C[C@H]1CC(=O)N[C@@H](C(=O)Nc2nc3ccc(Br)cc3s2)C1	ZINC000875013401	FF	On-Demand	Anodyne	LCK	17	41
C[C@H]1CC(=O)N[C@@H](C(=O)Nc2nc3ccc(Br)cc3s2)C1	ZINC000875013401	FF	On-Demand	Anodyne	CSNK1D	42	45
COCC(C)(C)CCNC(=O)C(=O)NCc1ccc(CN2CCCCC2)cc1	ZINC000875013434	GE	On-Demand	Anodyne	HRH2	26	40
COCC(C)(C)CCNC(=O)C(=O)NCc1ccc(CN2CCCCC2)cc1	ZINC000875013434	GE	On-Demand	Anodyne	HRH3	22	42
COCC(C)(C)CCNC(=O)C(=O)N[C@H](CN1CCOCC1)c1ccccc1	ZINC000875013435	GD	On-Demand	Anodyne	CASR	48	38
COCC(C)(C)CCNC(=O)C(=O)N[C@@H](CN1CCOCC1)c1ccccc1	ZINC000875013436	GD	On-Demand	Anodyne	CASR	48	38
COc1ccc(OCCNC(=O)C(=O)N2CCC[C@H]2c2cncc(C)c2)cc1	ZINC000875013441	GE	On-Demand	Anodyne	CPT1A	46	35
COc1ccc(OCCNC(=O)C(=O)N2CCC[C@@H]2c2cncc(C)c2)cc1	ZINC000875013442	GE	On-Demand	Anodyne	CPT1A	46	35
O=C(NCc1ccccc1CN1CCCC1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875013454	GC	On-Demand	Anodyne	NPFFR1	41	37
COc1ccc(OCCNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)cc1	ZINC000875013466	GD	On-Demand	Anodyne	HRH3	24	43
COc1ccc(OCCNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)cc1	ZINC000875013466	GD	On-Demand	Anodyne	SIRT3	41	31
COc1ccc(OCCNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)cc1	ZINC000875013466	GD	On-Demand	Anodyne	SIRT2	45	32
COc1ccc(OCCNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)cc1	ZINC000875013466	GD	On-Demand	Anodyne	SIRT1	41	32
O=C(Nc1nc2ccc(Br)cc2s1)C1(F)CCOCC1	ZINC000875013497	FH	On-Demand	Anodyne	LCK	23	41
O=C(Nc1nc2ccc(Br)cc2s1)C1(F)CCOCC1	ZINC000875013497	FH	On-Demand	Anodyne	CSNK1D	44	45
N#Cc1ccsc1NC(=O)CCc1ccc(N2CCCS2(=O)=O)cc1	ZINC000875013506	GF	On-Demand	Mild	VIPR1	27	44
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](CN2CCOCC2)c2ccccc2)CC1	ZINC000875013529	GD	On-Demand	Anodyne	CASR	46	37
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](CN2CCOCC2)c2ccccc2)CC1	ZINC000875013529	GD	On-Demand	Anodyne	CCR5	25	43
CC(=O)C1CCN(C(=O)C(=O)N[C@H](CN2CCOCC2)c2ccccc2)CC1	ZINC000875013530	GD	On-Demand	Anodyne	CASR	46	37
CC(=O)C1CCN(C(=O)C(=O)N[C@H](CN2CCOCC2)c2ccccc2)CC1	ZINC000875013530	GD	On-Demand	Anodyne	CCR5	25	43
O=C(NCC[C@H]1CCSC1)C(=O)NCc1ccc(CN2CCCCC2)cc1	ZINC000875013539	GF	On-Demand	Anodyne	ACHE	19	42
O=C(NCC[C@H]1CCSC1)C(=O)NCc1ccc(CN2CCCCC2)cc1	ZINC000875013539	GF	On-Demand	Anodyne	HRH3	21	44
O=C(NCC[C@H]1CCSC1)C(=O)NCc1ccc(CN2CCCCC2)cc1	ZINC000875013539	GF	On-Demand	Anodyne	SIGMAR1	17	43
O=C(NCC[C@@H]1CCSC1)C(=O)NCc1ccc(CN2CCCCC2)cc1	ZINC000875013540	GF	On-Demand	Anodyne	ACHE	19	42
O=C(NCC[C@@H]1CCSC1)C(=O)NCc1ccc(CN2CCCCC2)cc1	ZINC000875013540	GF	On-Demand	Anodyne	HRH3	21	44
O=C(NCC[C@@H]1CCSC1)C(=O)NCc1ccc(CN2CCCCC2)cc1	ZINC000875013540	GF	On-Demand	Anodyne	SIGMAR1	17	43
CC(=O)C1CCN(C(=O)C(=O)NCc2c(C)nn(Cc3ccccc3)c2C)CC1	ZINC000875013546	GD	On-Demand	Anodyne	P2RX7	15	44
CC(=O)C1CCN(C(=O)C(=O)NCc2ccccc2CN2CCCC2)CC1	ZINC000875013557	FD	On-Demand	Anodyne	SIGMAR1	19	41
CC[C@@H](CNC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1	ZINC000875013558	ED	On-Demand	Anodyne	EPHX2	16	42
CC[C@]1(C(=O)Nc2nc3ccc(Br)cc3s2)CCNC1=O	ZINC000875013563	FF	On-Demand	Anodyne	CSNK1D	42	45
CCCCCCCNC(=O)C(=O)NCc1c(C)cc(C)nc1O	ZINC000875013575	DE	On-Demand	Mild	ASAH1	83	40
CC(C)(C)OC(=O)N1CC[C@@H]([C@H](F)C(=O)Nc2sccc2C#N)C1	ZINC000875013584	FG	On-Demand	Mild	GPR119	38	41
CC(C)(C)OC(=O)N1CC[C@H]([C@@H](F)C(=O)Nc2sccc2C#N)C1	ZINC000875013585	FG	On-Demand	Mild	GPR119	38	41
CC(C)(C)OC(=O)N1CC[C@H]([C@H](F)C(=O)Nc2sccc2C#N)C1	ZINC000875013586	FG	On-Demand	Mild	GPR119	38	41
CC(C)(C)OC(=O)N1CC[C@@H]([C@@H](F)C(=O)Nc2sccc2C#N)C1	ZINC000875013587	FG	On-Demand	Mild	GPR119	38	41
O=C(N[C@H](CN1CCOCC1)c1ccccc1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875013589	GD	On-Demand	Anodyne	CASR	50	39
O=C(N[C@@H](CN1CCOCC1)c1ccccc1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875013590	GD	On-Demand	Anodyne	CASR	50	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(OC)c(OC)cc1OC	ZINC000875013597	GD	On-Demand	Anodyne	SLC6A4	24	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(OC)c(OC)cc1OC	ZINC000875013597	GD	On-Demand	Anodyne	SLC6A3	44	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(OC)c(OC)cc1OC	ZINC000875013598	GD	On-Demand	Anodyne	SLC6A4	24	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(OC)c(OC)cc1OC	ZINC000875013598	GD	On-Demand	Anodyne	SLC6A3	44	38
O=C(NCC[C@@H]1CCSC1)C(=O)N[C@@H](CN1CCOCC1)c1ccccc1	ZINC000875013612	GD	On-Demand	Anodyne	CASR	45	35
O=C(NCC[C@H]1CCSC1)C(=O)N[C@H](CN1CCOCC1)c1ccccc1	ZINC000875013613	GD	On-Demand	Anodyne	CASR	45	35
O=C(NCC[C@@H]1CCSC1)C(=O)N[C@H](CN1CCOCC1)c1ccccc1	ZINC000875013614	GD	On-Demand	Anodyne	CASR	45	35
O=C(NCC[C@H]1CCSC1)C(=O)N[C@@H](CN1CCOCC1)c1ccccc1	ZINC000875013615	GD	On-Demand	Anodyne	CASR	45	35
CC[C@@H](CNC(=O)N(C)CCN1CC2(CCOCC2)C1)c1ccccc1	ZINC000875013637	FF	On-Demand	Anodyne	CASR	50	41
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](CN1CCOCC1)c1ccccc1	ZINC000875013649	GC	On-Demand	Mild	CASR	48	38
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H](CN1CCOCC1)c1ccccc1	ZINC000875013650	GC	On-Demand	Mild	CASR	48	38
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H](CN1CCOCC1)c1ccccc1	ZINC000875013651	GC	On-Demand	Mild	CASR	48	38
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](CN1CCOCC1)c1ccccc1	ZINC000875013652	GC	On-Demand	Mild	CASR	48	38
CONC(=O)C1CCN(C(=O)N[C@H](C)c2nc3ccccc3[nH]2)CC1	ZINC000875013660	ED	On-Demand	Anodyne	OPRD1	17	41
CONC(=O)C1CCN(C(=O)N[C@H](C)c2nc3ccccc3[nH]2)CC1	ZINC000875013660	ED	On-Demand	Anodyne	PRCP	22	40
N#C[C@@]1(C(=O)Nc2nc3ccc(Br)cc3s2)CCCOC1	ZINC000875013661	FG	On-Demand	Mild	CSNK1D	36	41
CONC(=O)C1CCN(C(=O)N[C@@H](C)c2nc3ccccc3[nH]2)CC1	ZINC000875013662	ED	On-Demand	Anodyne	OPRD1	17	41
CONC(=O)C1CCN(C(=O)N[C@@H](C)c2nc3ccccc3[nH]2)CC1	ZINC000875013662	ED	On-Demand	Anodyne	PRCP	22	40
N#C[C@]1(C(=O)Nc2nc3ccc(Br)cc3s2)CCCOC1	ZINC000875013668	FG	On-Demand	Mild	CSNK1D	36	41
CC[C@@H](CNC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccccc1	ZINC000875013670	EF	On-Demand	Anodyne	SLC6A4	28	44
CC[C@@H](CNC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccccc1	ZINC000875013670	EF	On-Demand	Anodyne	SLC6A3	66	44
CC[C@@H](CNC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccccc1	ZINC000875013674	EF	On-Demand	Anodyne	SLC6A4	28	44
CC[C@@H](CNC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccccc1	ZINC000875013674	EF	On-Demand	Anodyne	SLC6A3	66	44
CN(C)S(=O)(=O)c1ccc(NC(=O)c2noc3c2CC(C)(C)CC3)cc1	ZINC000875013690	GF	On-Demand	Anodyne	PANC	53	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCOc2ccccc2)C1	ZINC000875013692	ED	On-Demand	Anodyne	HRH2	48	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCOc2ccccc2)C1	ZINC000875013692	ED	On-Demand	Anodyne	SLC6A1	76	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCOc2ccccc2)C1	ZINC000875013692	ED	On-Demand	Anodyne	CYSLTR2	48	36
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCOc2ccccc2)C1	ZINC000875013692	ED	On-Demand	Anodyne	HRH3	47	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCOc2ccccc2)C1	ZINC000875013692	ED	On-Demand	Anodyne	CPT1A	49	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCOc2ccccc2)C1	ZINC000875013694	ED	On-Demand	Anodyne	HRH2	48	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCOc2ccccc2)C1	ZINC000875013694	ED	On-Demand	Anodyne	SLC6A1	76	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCOc2ccccc2)C1	ZINC000875013694	ED	On-Demand	Anodyne	CYSLTR2	48	36
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCOc2ccccc2)C1	ZINC000875013694	ED	On-Demand	Anodyne	HRH3	47	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCOc2ccccc2)C1	ZINC000875013694	ED	On-Demand	Anodyne	CPT1A	49	35
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)N[C@H](CN2CCOCC2)c2ccccc2)C1	ZINC000875013715	GD	On-Demand	Anodyne	CASR	47	37
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)N[C@@H](CN2CCOCC2)c2ccccc2)C1	ZINC000875013717	GD	On-Demand	Anodyne	CASR	47	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](CN2CCOCC2)c2ccccc2)C1	ZINC000875013728	GD	On-Demand	Anodyne	CASR	46	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](CN2CCOCC2)c2ccccc2)C1	ZINC000875013728	GD	On-Demand	Anodyne	CCR5	28	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](CN2CCOCC2)c2ccccc2)C1	ZINC000875013728	GD	On-Demand	Anodyne	DPP7	42	35
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2C[C@H](C)O[C@H](C)C2)cc1	ZINC000875013729	GD	On-Demand	Anodyne	TGM2	60	40
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2C[C@H](C)O[C@H](C)C2)cc1	ZINC000875013729	GD	On-Demand	Anodyne	F13A1	79	40
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2C[C@H](C)O[C@H](C)C2)cc1	ZINC000875013729	GD	On-Demand	Anodyne	NAMPT	45	54
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](CN2CCOCC2)c2ccccc2)C1	ZINC000875013730	GD	On-Demand	Anodyne	CASR	46	37
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](CN2CCOCC2)c2ccccc2)C1	ZINC000875013730	GD	On-Demand	Anodyne	CCR5	28	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](CN2CCOCC2)c2ccccc2)C1	ZINC000875013730	GD	On-Demand	Anodyne	DPP7	42	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](CN2CCOCC2)c2ccccc2)C1	ZINC000875013731	GD	On-Demand	Anodyne	CASR	46	37
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](CN2CCOCC2)c2ccccc2)C1	ZINC000875013731	GD	On-Demand	Anodyne	CCR5	28	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](CN2CCOCC2)c2ccccc2)C1	ZINC000875013731	GD	On-Demand	Anodyne	DPP7	42	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](CN2CCOCC2)c2ccccc2)C1	ZINC000875013732	GD	On-Demand	Anodyne	CASR	46	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](CN2CCOCC2)c2ccccc2)C1	ZINC000875013732	GD	On-Demand	Anodyne	CCR5	28	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](CN2CCOCC2)c2ccccc2)C1	ZINC000875013732	GD	On-Demand	Anodyne	DPP7	42	35
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2C[C@H](C)O[C@@H](C)C2)cc1	ZINC000875013743	GD	On-Demand	Anodyne	TGM2	60	40
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2C[C@H](C)O[C@@H](C)C2)cc1	ZINC000875013743	GD	On-Demand	Anodyne	F13A1	79	40
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2C[C@H](C)O[C@@H](C)C2)cc1	ZINC000875013743	GD	On-Demand	Anodyne	NAMPT	45	54
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)cc1	ZINC000875013745	GD	On-Demand	Anodyne	TGM2	60	40
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)cc1	ZINC000875013745	GD	On-Demand	Anodyne	F13A1	79	40
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)cc1	ZINC000875013745	GD	On-Demand	Anodyne	NAMPT	45	54
CN(C)S(=O)(=O)c1ccc(NC(=O)c2cc(Cl)nc(C(C)(C)C)c2)cc1	ZINC000875013747	GH	On-Demand	Anodyne	CA2	18	47
CN(C)S(=O)(=O)c1ccc(NC(=O)c2cc(Cl)nc(C(C)(C)C)c2)cc1	ZINC000875013747	GH	On-Demand	Anodyne	CA12	19	44
CN(C)S(=O)(=O)c1ccc(NC(=O)c2cc(Cl)nc(C(C)(C)C)c2)cc1	ZINC000875013747	GH	On-Demand	Anodyne	CYNT	29	47
CCn1ncc(CNC(=O)NCc2ccc(OCc3ccccc3)c(OC)c2)n1	ZINC000875013750	GF	On-Demand	Anodyne	DRTS_PLAFK	23	42
CCn1ncc(CNC(=O)NCc2ccc(OCc3ccccc3)c(OC)c2)n1	ZINC000875013750	GF	On-Demand	Anodyne	PTGER1	58	36
CCn1ncc(CNC(=O)NCc2ccc(OCc3ccccc3)c(OC)c2)n1	ZINC000875013750	GF	On-Demand	Anodyne	ROCK2	26	42
O=C(NCCCCC1CC1)C(=O)NCc1ccccc1CN1CCCC1	ZINC000875013762	FF	On-Demand	Anodyne	ACHE	28	41
O=C(NCCC[C@@H]1C=CCC1)C(=O)NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000875013788	GF	On-Demand	Anodyne	L3MBTL3	67	39
O=C(NCCC[C@H]1C=CCC1)C(=O)NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000875013789	GF	On-Demand	Anodyne	L3MBTL3	67	39
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1nc2ccccc2[nH]1	ZINC000875013796	DE	On-Demand	Anodyne	PRCP	28	40
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1nc2ccccc2[nH]1	ZINC000875013799	DE	On-Demand	Anodyne	PRCP	28	40
COc1ccc([C@@H]2CN(C(=O)N[C@H](C)c3nc4ccccc4[nH]3)CCO2)cc1	ZINC000875013806	GG	On-Demand	Anodyne	NPBWR1	31	40
COc1ccc([C@@H]2CN(C(=O)N[C@@H](C)c3nc4ccccc4[nH]3)CCO2)cc1	ZINC000875013807	GG	On-Demand	Anodyne	NPBWR1	31	40
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCOc2ccccc2)C1	ZINC000875013809	ED	On-Demand	Anodyne	CYSLTR2	48	33
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](CC)c1ccccc1	ZINC000875013840	CG	On-Demand	Anodyne	SOAT1	23	41
CC(=O)N1CCC[C@@H]1C(=O)Nn1cnc2sc(C)c(-c3ccccc3)c2c1=O	ZINC000875013852	GF	On-Demand	Anodyne	TRY1_BOVIN	54	37
COc1ccc(OCCNC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)cc1	ZINC000875013867	ED	On-Demand	Anodyne	MTNR1A	23	40
COc1ccc(OCCNC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)cc1	ZINC000875013867	ED	On-Demand	Anodyne	MTNR1B	17	40
CN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)C(F)(F)F)cc1	ZINC000875013876	FE	On-Demand	Anodyne	CA2	23	48
CN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)C(F)(F)F)cc1	ZINC000875013876	FE	On-Demand	Anodyne	CA4	24	48
CN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)C(F)(F)F)cc1	ZINC000875013876	FE	On-Demand	Anodyne	CA12	15	42
CN(C)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)C(F)(F)F)cc1	ZINC000875013876	FE	On-Demand	Anodyne	CA9	16	42
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2CCC(C)CC2)cc1	ZINC000875013896	GE	On-Demand	Anodyne	EPHX2	26	41
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2CCC(C)CC2)cc1	ZINC000875013896	GE	On-Demand	Anodyne	TGM2	83	43
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2CCC(C)CC2)cc1	ZINC000875013896	GE	On-Demand	Anodyne	F13A1	93	43
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2CCC(C)CC2)cc1	ZINC000875013896	GE	On-Demand	Anodyne	NAMPT	64	53
O=C1CC[C@H](C(=O)Nc2nc3ccc(Br)cc3s2)O1	ZINC000875013906	EF	On-Demand	Anodyne	LCK	17	41
O=C1CC[C@H](C(=O)Nc2nc3ccc(Br)cc3s2)O1	ZINC000875013906	EF	On-Demand	Anodyne	CSNK1D	42	45
CN(C)S(=O)(=O)c1ccc(NC(=O)Cc2csc(C3CC3)n2)cc1	ZINC000875013924	FE	On-Demand	Anodyne	AVPR1B	15	40
C[C@H](CC(=O)Nc1sccc1C#N)NC(=O)OC(C)(C)C	ZINC000875013925	DF	On-Demand	Mild	PAPA1_CARPA	37	42
COC(=O)N(C)NC(=O)NCCOc1ccc(C(C)(C)C)cc1	ZINC000875013948	DE	On-Demand	Reactive	MT-ND1	28	43
C[C@H](NC(=O)N1Cc2ccccc2[C@@H](C)C1)c1nc2ccccc2[nH]1	ZINC000875013992	EH	On-Demand	Anodyne	OPRD1	18	44
C[C@@H]1CN(C(=O)N[C@@H](C)c2nc3ccccc3[nH]2)Cc2ccccc21	ZINC000875013993	EH	On-Demand	Anodyne	OPRD1	18	44
C[C@H]1CN(C(=O)N[C@H](C)c2nc3ccccc3[nH]2)Cc2ccccc21	ZINC000875013994	EH	On-Demand	Anodyne	OPRD1	18	44
C[C@@H]1CN(C(=O)N[C@H](C)c2nc3ccccc3[nH]2)Cc2ccccc21	ZINC000875013995	EH	On-Demand	Anodyne	OPRD1	18	44
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(CN4CCCCC4)cc3)CC[C@H]21	ZINC000875014046	GD	On-Demand	Anodyne	HRH3	27	41
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(CN4CCCCC4)cc3)CC[C@H]21	ZINC000875014046	GD	On-Demand	Anodyne	SIGMAR1	17	41
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(CN4CCCCC4)cc3)CC[C@@H]21	ZINC000875014049	GD	On-Demand	Anodyne	HRH3	27	41
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(CN4CCCCC4)cc3)CC[C@@H]21	ZINC000875014049	GD	On-Demand	Anodyne	SIGMAR1	17	41
Cc1csc([C@H]2CCN(C(=O)N[C@H](C)c3nc4ccccc4[nH]3)C2)n1	ZINC000875014069	FH	On-Demand	Anodyne	PRCP	20	44
CC(=O)N1CCC[C@@H]1C(=O)Nc1nc2ccc(Br)cc2s1	ZINC000875014089	FG	On-Demand	Anodyne	LCK	20	41
CC(=O)N1CCC[C@@H]1C(=O)Nc1nc2ccc(Br)cc2s1	ZINC000875014089	FG	On-Demand	Anodyne	CSNK1D	41	45
CC(=O)N1CCC[C@@H]1C(=O)Nc1nc2ccc(Br)cc2s1	ZINC000875014089	FG	On-Demand	Anodyne	TRY1_BOVIN	48	44
CC(=O)N1CCC[C@@H]1C(=O)Nc1nc2ccc(Br)cc2s1	ZINC000875014089	FG	On-Demand	Anodyne	PIK3CA	23	43
O=C(NCCCOc1ccccc1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875014097	FC	On-Demand	Anodyne	HRH2	28	43
CC[C@@H](CNC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)c1ccccc1	ZINC000875014105	FG	On-Demand	Anodyne	SMO	40	45
CC[C@@H](CNC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)c1ccccc1	ZINC000875014105	FG	On-Demand	Anodyne	ETHR	58	36
CC[C@@H](CNC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)c1ccccc1	ZINC000875014107	FG	On-Demand	Anodyne	SMO	40	45
CC[C@@H](CNC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)c1ccccc1	ZINC000875014107	FG	On-Demand	Anodyne	ETHR	58	36
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@H](C)c1nc3ccccc3[nH]1)CC2	ZINC000875014130	GG	On-Demand	Anodyne	OPRD1	15	41
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@H](C)c1nc3ccccc3[nH]1)CC2	ZINC000875014130	GG	On-Demand	Anodyne	MAPK1	42	36
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@@H](C)c1nc3ccccc3[nH]1)CC2	ZINC000875014132	GG	On-Demand	Anodyne	OPRD1	15	41
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@@H](C)c1nc3ccccc3[nH]1)CC2	ZINC000875014132	GG	On-Demand	Anodyne	MAPK1	42	36
CC[C@@H](CNC(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccccc1	ZINC000875014139	FF	On-Demand	Anodyne	CCR5	28	40
CC[C@@H](CNC(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccccc1	ZINC000875014139	FF	On-Demand	Anodyne	L3MBTL3	76	42
C[C@@H](NC(=O)N(C)CCN1CC2(CCOCC2)C1)c1nc2ccccc2[nH]1	ZINC000875014151	FE	On-Demand	Anodyne	CASR	32	40
CN(C)S(=O)(=O)c1ccc(NC(=O)c2coc(C(C)(C)C)n2)cc1	ZINC000875014156	FE	On-Demand	Anodyne	GRM4	15	40
C[C@@H](CN(C)C(=O)N[C@H](C)c1nc2ccccc2[nH]1)NC(=O)OC(C)(C)C	ZINC000875014202	GG	On-Demand	Anodyne	PRCP	17	41
C[C@@H](CN(C)C(=O)N[C@H](C)c1nc2ccccc2[nH]1)NC(=O)OC(C)(C)C	ZINC000875014202	GG	On-Demand	Anodyne	FPR1	41	34
C[C@@H](CN(C)C(=O)N[C@@H](C)c1nc2ccccc2[nH]1)NC(=O)OC(C)(C)C	ZINC000875014203	GG	On-Demand	Anodyne	PRCP	17	41
C[C@@H](CN(C)C(=O)N[C@@H](C)c1nc2ccccc2[nH]1)NC(=O)OC(C)(C)C	ZINC000875014203	GG	On-Demand	Anodyne	FPR1	41	34
Cc1cncc([C@H]2CCCN2C(=O)N[C@@H](C)c2nc3ccccc3[nH]2)c1	ZINC000875014206	EH	On-Demand	Anodyne	OPRD1	18	44
Cc1cncc([C@H]2CCCN2C(=O)N[C@@H](C)c2nc3ccccc3[nH]2)c1	ZINC000875014206	EH	On-Demand	Anodyne	PRCP	43	41
Cc1cncc([C@@H]2CCCN2C(=O)N[C@H](C)c2nc3ccccc3[nH]2)c1	ZINC000875014207	EH	On-Demand	Anodyne	OPRD1	18	44
Cc1cncc([C@@H]2CCCN2C(=O)N[C@H](C)c2nc3ccccc3[nH]2)c1	ZINC000875014207	EH	On-Demand	Anodyne	PRCP	43	41
Cc1cncc([C@@H]2CCCN2C(=O)N[C@@H](C)c2nc3ccccc3[nH]2)c1	ZINC000875014208	EH	On-Demand	Anodyne	OPRD1	18	44
Cc1cncc([C@@H]2CCCN2C(=O)N[C@@H](C)c2nc3ccccc3[nH]2)c1	ZINC000875014208	EH	On-Demand	Anodyne	PRCP	43	41
Cc1cncc([C@H]2CCCN2C(=O)N[C@H](C)c2nc3ccccc3[nH]2)c1	ZINC000875014209	EH	On-Demand	Anodyne	OPRD1	18	44
Cc1cncc([C@H]2CCCN2C(=O)N[C@H](C)c2nc3ccccc3[nH]2)c1	ZINC000875014209	EH	On-Demand	Anodyne	PRCP	43	41
CCCCCCCNC(=O)C(=O)NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000875014213	GG	On-Demand	Mild	ASAH1	86	35
CCCCCCCNC(=O)C(=O)NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000875014213	GG	On-Demand	Mild	L3MBTL3	59	39
CCCCCCCNC(=O)C(=O)NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000875014213	GG	On-Demand	Mild	HPGD	29	42
COc1ccc(OCCNC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875014229	ED	On-Demand	Anodyne	CHRM2	41	38
COc1ccc(OCCNC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875014229	ED	On-Demand	Anodyne	MTNR1A	47	42
COc1ccc(OCCNC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875014229	ED	On-Demand	Anodyne	MTNR1B	43	42
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(CN3CCCCC3)cc2)CC1	ZINC000875014270	GE	On-Demand	Anodyne	HRH3	38	49
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(CN3CCCCC3)cc2)CC1	ZINC000875014270	GE	On-Demand	Anodyne	SIGMAR1	24	49
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(CN3CCCCC3)cc2)CC1	ZINC000875014270	GE	On-Demand	Anodyne	MCHR1	15	40
C[C@@H](NC(=O)N1CCC(c2nccc(-c3cccnc3)n2)CC1)C1CC1	ZINC000875014298	FG	On-Demand	Anodyne	ABL1	15	46
C[C@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)C1CC1	ZINC000875014301	DF	On-Demand	Mild	ITK	21	53
C[C@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)C1CC1	ZINC000875014301	DF	On-Demand	Mild	PANC	59	40
O=C(N[C@@H](CN1CCOCC1)c1ccccc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875014311	FD	On-Demand	Anodyne	CASR	41	35
O=C(N[C@H](CN1CCOCC1)c1ccccc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875014312	FD	On-Demand	Anodyne	CASR	41	35
O=C(N[C@H]1CC12CCC2)C(=O)N[C@@H](CN1CCOCC1)c1ccccc1	ZINC000875014313	FD	On-Demand	Anodyne	CASR	41	35
O=C(N[C@H](CN1CCOCC1)c1ccccc1)C(=O)N[C@H]1CC12CCC2	ZINC000875014315	FD	On-Demand	Anodyne	CASR	41	35
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCn1cnc2ccccc21	ZINC000875014329	FE	On-Demand	Anodyne	SLC6A3	41	38
COc1ccc(OCCNC(=O)C(=O)NC[C@H]2c3ccccc3CN2C)cc1	ZINC000875014354	GD	On-Demand	Anodyne	DRD4	40	32
COc1ccc(OCCNC(=O)C(=O)NC[C@@H]2c3ccccc3CN2C)cc1	ZINC000875014355	GD	On-Demand	Anodyne	DRD4	40	32
C[C@H](NC(=O)NCCCN1CCCC[C@H]1C)c1cc2cnccc2o1	ZINC000875014356	EG	On-Demand	Anodyne	HRH3	62	38
C[C@@H]1C[C@]1(C(=O)Nc1cc(S(C)(=O)=O)ccc1Cl)C(=O)OC(C)(C)C	ZINC000875014357	GG	On-Demand	Anodyne	GPR119	19	41
C[C@H](NC(=O)NCCCN1CCCC[C@@H]1C)c1cc2cnccc2o1	ZINC000875014358	EG	On-Demand	Anodyne	HRH3	62	38
C[C@@H](NC(=O)NCCCN1CCCC[C@H]1C)c1cc2cnccc2o1	ZINC000875014360	EG	On-Demand	Anodyne	HRH3	62	38
C[C@H]1CCCCN1CCCNC(=O)N[C@H](C)c1cc2cnccc2o1	ZINC000875014361	EG	On-Demand	Anodyne	HRH3	62	38
N#Cc1ccsc1NC(=O)[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875014363	EI	On-Demand	Mild	C3AR1	39	41
NC(=O)c1cc(-c2ccccc2)sc1NC(=O)CCCOC1CCOCC1	ZINC000875014365	GG	On-Demand	Anodyne	CHEK1	20	45
N#Cc1ccsc1NC(=O)[C@H](Cc1cccnc1)C1CCCC1	ZINC000875014368	EI	On-Demand	Mild	C3AR1	39	41
CC[C@@H](CNC(=O)N1CCC[C@@H](C(C)=O)C1)c1ccccc1	ZINC000875014372	DG	On-Demand	Anodyne	SLC6A1	57	39
CC[C@@H](CNC(=O)N1CCC[C@@H](C(C)=O)C1)c1ccccc1	ZINC000875014372	DG	On-Demand	Anodyne	KCNQ2	44	36
CC[C@@H](CNC(=O)N1CCC[C@@H](C(C)=O)C1)c1ccccc1	ZINC000875014372	DG	On-Demand	Anodyne	DPP7	40	38
O=C(NCc1ccc(C(F)(F)F)cc1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875014376	FC	On-Demand	Anodyne	MTTP	26	41
O=C(NCc1ccc(C(F)(F)F)cc1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875014376	FC	On-Demand	Anodyne	CCR2	40	36
CC[C@@H](CNC(=O)N1CCC[C@H](C(C)=O)C1)c1ccccc1	ZINC000875014377	DG	On-Demand	Anodyne	SLC6A1	57	39
CC[C@@H](CNC(=O)N1CCC[C@H](C(C)=O)C1)c1ccccc1	ZINC000875014377	DG	On-Demand	Anodyne	KCNQ2	44	36
CC[C@@H](CNC(=O)N1CCC[C@H](C(C)=O)C1)c1ccccc1	ZINC000875014377	DG	On-Demand	Anodyne	DPP7	40	38
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3CC[C@H]4CCCC[C@H]4C3)CC2)CC1	ZINC000875014395	GD	On-Demand	Anodyne	L3MBTL3	68	42
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3CC[C@@H]4CCCC[C@H]4C3)CC2)CC1	ZINC000875014398	GD	On-Demand	Anodyne	L3MBTL3	68	42
CC[C@@H](CNC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875014400	DF	On-Demand	Anodyne	NPY2R	40	37
CC[C@@H](CNC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875014400	DF	On-Demand	Anodyne	AMY2	43	30
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3CC[C@H]4CCCC[C@@H]4C3)CC2)CC1	ZINC000875014401	GD	On-Demand	Anodyne	L3MBTL3	68	42
CC[C@@H](CNC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875014402	DF	On-Demand	Anodyne	NPY2R	40	37
CC[C@@H](CNC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875014402	DF	On-Demand	Anodyne	AMY2	43	30
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3CC[C@@H]4CCCC[C@@H]4C3)CC2)CC1	ZINC000875014404	GD	On-Demand	Anodyne	L3MBTL3	68	42
C[C@@H](NC(=O)NC[C@@H]1CC(C(F)(F)F)=NO1)c1nc2ccccc2[nH]1	ZINC000875014455	FF	On-Demand	Anodyne	OPRD1	15	40
C[C@H](NC(=O)NC[C@H]1CC(C(F)(F)F)=NO1)c1nc2ccccc2[nH]1	ZINC000875014456	FF	On-Demand	Anodyne	OPRD1	15	40
C[C@@H](NC(=O)NC[C@H]1CC(C(F)(F)F)=NO1)c1nc2ccccc2[nH]1	ZINC000875014458	FF	On-Demand	Anodyne	OPRD1	15	40
C[C@@H](NC(=O)N1CC2(CC(=O)N2Cc2ccccc2)C1)c1nc2ccccc2[nH]1	ZINC000875014474	GF	On-Demand	Anodyne	PRCP	18	42
C[C@H](NC(=O)N1Cc2cccnc2N2C[C@H](O)C[C@H]2C1)c1nc2ccccc2[nH]1	ZINC000875014483	GE	On-Demand	Anodyne	OPRD1	15	40
C[C@@H](NC(=O)N1Cc2cccnc2N2C[C@H](O)C[C@H]2C1)c1nc2ccccc2[nH]1	ZINC000875014484	GE	On-Demand	Anodyne	OPRD1	15	40
C[C@@H](NC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1nc2ccccc2[nH]1	ZINC000875014486	FH	On-Demand	Anodyne	SMO	40	36
C[C@@H](NC(=O)N1CCC[C@H](OC2CCC2)CC1)c1nc2ccccc2[nH]1	ZINC000875014489	FH	On-Demand	Anodyne	SMO	40	36
C[C@H](NC(=O)C(=O)NCCCOc1ccccc1)c1ccc(C(F)(F)F)nc1	ZINC000875014493	GF	On-Demand	Anodyne	TRPV1	31	43
COCC1CC(NC(=O)NCc2ccc(OCc3ccccc3)c(OC)c2)C1	ZINC000875014514	GG	On-Demand	Anodyne	DRTS_PLAFK	17	41
COCC1CC(NC(=O)NCc2ccc(OCc3ccccc3)c(OC)c2)C1	ZINC000875014514	GG	On-Demand	Anodyne	PTGER1	43	34
COCC1CC(NC(=O)NCc2ccc(OCc3ccccc3)c(OC)c2)C1	ZINC000875014514	GG	On-Demand	Anodyne	HCRTR1	21	42
COCC1CC(NC(=O)NCc2ccc(OCc3ccccc3)c(OC)c2)C1	ZINC000875014514	GG	On-Demand	Anodyne	MTNR1B	20	54
Cc1cc(C(F)(F)F)nc(C(=O)Nc2ccc(S(=O)(=O)N(C)C)cc2)n1	ZINC000875014522	GE	On-Demand	Anodyne	SHH	23	41
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(Oc3ccc(F)cc3)cc2)CC1	ZINC000875014523	GG	On-Demand	Anodyne	MMP13	15	46
CONC(=O)C1CCN(C(=O)NCCOc2ccc(C(C)(C)C)cc2)CC1	ZINC000875014542	GE	On-Demand	Anodyne	EPHX2	15	43
CC[C@@H](CNC(=O)N1CCC2(CCNC2=O)CC1)c1ccccc1	ZINC000875014557	EE	On-Demand	Anodyne	GHRHR	56	31
O=C(NCCO)C1CCN(C(=O)NCCSc2ccc(Cl)cc2)CC1	ZINC000875014561	GD	On-Demand	Anodyne	EPHX2	18	49
O=C(NCc1ccc(CN2CCCCC2)cc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875014576	FE	On-Demand	Anodyne	HRH3	20	43
O=C(NCc1ccc(CN2CCCCC2)cc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875014576	FE	On-Demand	Anodyne	SIGMAR1	16	43
CCO[C@@H](C(=O)Nc1sc(-c2ccccc2)cc1C(N)=O)[C@@H]1CCOC1	ZINC000875014578	FF	On-Demand	Anodyne	CHEK1	19	43
O=C(NCc1ccc(CN2CCCCC2)cc1)C(=O)N[C@H]1CC12CCC2	ZINC000875014579	FE	On-Demand	Anodyne	HRH3	20	43
O=C(NCc1ccc(CN2CCCCC2)cc1)C(=O)N[C@H]1CC12CCC2	ZINC000875014579	FE	On-Demand	Anodyne	SIGMAR1	16	43
CCO[C@@H](C(=O)Nc1sc(-c2ccccc2)cc1C(N)=O)[C@H]1CCOC1	ZINC000875014580	FF	On-Demand	Anodyne	CHEK1	19	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCOc2ccc(F)cc2)C1	ZINC000875014593	FD	On-Demand	Anodyne	HRH3	40	39
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCOc2ccc(F)cc2)C1	ZINC000875014595	FD	On-Demand	Anodyne	HRH3	40	39
O=C(NCCc1ccc(OC(F)F)cc1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875014602	FG	On-Demand	Anodyne	SLC18A2	15	48
CC[C@@H](CNC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875014606	DG	On-Demand	Anodyne	AMY2	47	33
CC[C@@H](CNC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875014608	DG	On-Demand	Anodyne	AMY2	47	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccc(OC(F)F)cc1	ZINC000875014641	FF	On-Demand	Anodyne	SLC6A4	25	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccc(OC(F)F)cc1	ZINC000875014641	FF	On-Demand	Anodyne	SLC6A3	57	42
CCCCCCCNC(=O)C(=O)NCc1cn2ccsc2n1	ZINC000875014680	DE	On-Demand	Mild	ASAH1	96	39
CN1CC[C@H]2CN(C(=O)C(=O)NCCCOc3ccccc3)CC[C@H]21	ZINC000875014684	ED	On-Demand	Anodyne	CYSLTR2	63	35
CN1CC[C@H]2CN(C(=O)C(=O)NCCCOc3ccccc3)CC[C@@H]21	ZINC000875014690	ED	On-Demand	Anodyne	CYSLTR2	63	35
CN1CCN(C2CCN(C(=O)C(=O)NCCCOc3ccccc3)CC2)CC1	ZINC000875014695	GC	On-Demand	Anodyne	AVPR1A	16	45
CN1CCN(C2CCN(C(=O)C(=O)NCCCOc3ccccc3)CC2)CC1	ZINC000875014695	GC	On-Demand	Anodyne	HRH3	31	43
CN1CCN(C2CCN(C(=O)C(=O)NCCCOc3ccccc3)CC2)CC1	ZINC000875014695	GC	On-Demand	Anodyne	SLC6A5	18	45
CN1CCN(C2CCN(C(=O)C(=O)NCCCOc3ccccc3)CC2)CC1	ZINC000875014695	GC	On-Demand	Anodyne	L3MBTL3	64	40
CCC[C@@H](CC)C(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1	ZINC000875014701	DF	On-Demand	Anodyne	CA2	20	71
CCC[C@@H](CC)C(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1	ZINC000875014701	DF	On-Demand	Anodyne	CA1	20	61
CCC[C@@H](CC)C(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1	ZINC000875014701	DF	On-Demand	Anodyne	CA7	18	71
CCC[C@@H](CC)C(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1	ZINC000875014701	DF	On-Demand	Anodyne	CA4	20	63
CCC[C@@H](CC)C(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1	ZINC000875014701	DF	On-Demand	Anodyne	CA14	20	71
CCC[C@@H](CC)C(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1	ZINC000875014701	DF	On-Demand	Anodyne	CA12	16	48
CCC[C@@H](CC)C(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1	ZINC000875014701	DF	On-Demand	Anodyne	CA9	15	48
CCC[C@@H](CC)C(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1	ZINC000875014701	DF	On-Demand	Anodyne	P96878_MYCTU	40	36
CCC[C@H](CC)C(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1	ZINC000875014705	DF	On-Demand	Anodyne	CA2	20	71
CCC[C@H](CC)C(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1	ZINC000875014705	DF	On-Demand	Anodyne	CA1	20	61
CCC[C@H](CC)C(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1	ZINC000875014705	DF	On-Demand	Anodyne	CA7	18	71
CCC[C@H](CC)C(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1	ZINC000875014705	DF	On-Demand	Anodyne	CA4	20	63
CCC[C@H](CC)C(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1	ZINC000875014705	DF	On-Demand	Anodyne	CA14	20	71
CCC[C@H](CC)C(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1	ZINC000875014705	DF	On-Demand	Anodyne	CA12	16	48
CCC[C@H](CC)C(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1	ZINC000875014705	DF	On-Demand	Anodyne	CA9	15	48
CCC[C@H](CC)C(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1	ZINC000875014705	DF	On-Demand	Anodyne	P96878_MYCTU	40	36
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccccc2CN2CCCC2)C1	ZINC000875014738	FD	On-Demand	Anodyne	SLC6A1	90	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccccc2CN2CCCC2)C1	ZINC000875014740	FD	On-Demand	Anodyne	SLC6A1	90	35
CCn1c(CNC(=O)N2CCO[C@H](C(F)F)CC2)nc2ccccc21	ZINC000875014755	FF	On-Demand	Anodyne	SMO	42	40
CCn1c(CNC(=O)N2CCO[C@@H](C(F)F)CC2)nc2ccccc21	ZINC000875014757	FF	On-Demand	Anodyne	SMO	42	40
CCn1c(CNC(=O)N[C@H]2CCOC[C@H]2O)nc2ccccc21	ZINC000875014759	DD	On-Demand	Anodyne	ADAM17	21	43
CCn1c(CNC(=O)N[C@H]2CCOC[C@@H]2O)nc2ccccc21	ZINC000875014762	DD	On-Demand	Anodyne	ADAM17	21	43
CC[C@@H](CNC(=O)N1CCC[C@@H](CCC(=O)OC)C1)c1ccccc1	ZINC000875014763	EH	On-Demand	Anodyne	REN	17	41
CCn1c(CNC(=O)N[C@@H]2CCOC[C@@H]2O)nc2ccccc21	ZINC000875014765	DD	On-Demand	Anodyne	ADAM17	21	43
CC[C@@H](CNC(=O)N1CCC[C@H](CCC(=O)OC)C1)c1ccccc1	ZINC000875014766	EH	On-Demand	Anodyne	REN	17	41
CCn1c(CNC(=O)N[C@@H]2CCOC[C@H]2O)nc2ccccc21	ZINC000875014768	DD	On-Demand	Anodyne	ADAM17	21	43
CC(=O)Nc1cccc2c1CN(C(=O)NCc1nc3ccccc3n1C)CC2	ZINC000875014770	GF	On-Demand	Anodyne	P2RY14	42	32
CCn1c(CNC(=O)N(C)[C@H]2C[C@@H](C(N)=O)C2)nc2ccccc21	ZINC000875014778	ED	On-Demand	Anodyne	PDE6D	42	33
O=C(NCCCOc1ccccc1)C(=O)NCC[C@H]1CCSC1	ZINC000875014784	ED	On-Demand	Anodyne	GRIN2B	17	41
O=C(NCCCOc1ccccc1)C(=O)NCC[C@@H]1CCSC1	ZINC000875014787	ED	On-Demand	Anodyne	GRIN2B	17	41
CCn1c(CNC(=O)N(CCO)CCOCCO)nc2ccccc21	ZINC000875014793	FC	On-Demand	Anodyne	HRH1	16	44
CCOC(=O)[C@H](C)C1CN(C(=O)NCCSc2ccccc2)C1	ZINC000875014798	EF	On-Demand	Anodyne	ACE	19	40
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000875014834	GE	On-Demand	Anodyne	NAMPT	73	53
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875014849	GD	On-Demand	Anodyne	TGM2	66	38
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875014849	GD	On-Demand	Anodyne	F13A1	67	39
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875014849	GD	On-Demand	Anodyne	NAMPT	90	60
CCn1c(CNC(=O)N2CC[C@H](c3ccc(O)cc3)C2)nc2ccccc21	ZINC000875014850	FG	On-Demand	Anodyne	PDE6D	44	33
CCn1c(CNC(=O)N2CC[C@H](c3ccc(O)cc3)C2)nc2ccccc21	ZINC000875014850	FG	On-Demand	Anodyne	SMO	41	41
CCn1c(CNC(=O)N2CC[C@@H](c3ccc(O)cc3)C2)nc2ccccc21	ZINC000875014851	FG	On-Demand	Anodyne	PDE6D	44	33
CCn1c(CNC(=O)N2CC[C@@H](c3ccc(O)cc3)C2)nc2ccccc21	ZINC000875014851	FG	On-Demand	Anodyne	SMO	41	41
COC(=O)N(C)NC(=O)NCc1ccc(CN2CCOCC2)cc1	ZINC000875014855	EC	On-Demand	Reactive	DPOL_VZVD	24	43
C[C@@H](NC(=O)NCC[C@@H](O)C1CCCC1)c1nc2ccccc2[nH]1	ZINC000875014867	EF	On-Demand	Anodyne	MMP7	15	41
C[C@@H](NC(=O)NCC[C@H](O)C1CCCC1)c1nc2ccccc2[nH]1	ZINC000875014868	EF	On-Demand	Anodyne	MMP7	15	41
C[C@@H](NC(=O)N(C)CCc1cccc(C#N)c1)c1nc2ccccc2[nH]1	ZINC000875014880	EG	On-Demand	Mild	PRCP	15	52
CCn1c(CNC(=O)N2CCC(CO)(CO)CC2)nc2ccccc21	ZINC000875014883	ED	On-Demand	Anodyne	SMO	35	42
CC(=O)C1CCN(C(=O)N[C@H](C)c2nc3ccccc3[nH]2)CC1	ZINC000875014890	DF	On-Demand	Anodyne	PRCP	21	41
CC(=O)C1CCN(C(=O)N[C@@H](C)c2nc3ccccc3[nH]2)CC1	ZINC000875014892	DF	On-Demand	Anodyne	PRCP	21	41
CCn1c(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)nc2ccccc21	ZINC000875014899	EF	On-Demand	Anodyne	SMO	32	40
CCn1c(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)nc2ccccc21	ZINC000875014900	EF	On-Demand	Anodyne	SMO	32	40
C[C@@H](NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1)c1nc2ccccc2[nH]1	ZINC000875014903	GH	On-Demand	Anodyne	SMO	52	44
C[C@@H](NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1)c1nc2ccccc2[nH]1	ZINC000875014903	GH	On-Demand	Anodyne	ETHR	54	41
CCn1c(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)nc2ccccc21	ZINC000875014917	FH	On-Demand	Anodyne	PDE6D	48	33
CCn1c(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)nc2ccccc21	ZINC000875014917	FH	On-Demand	Anodyne	EPHX2	24	41
CCn1c(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)nc2ccccc21	ZINC000875014917	FH	On-Demand	Anodyne	SMO	43	44
CCn1c(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)nc2ccccc21	ZINC000875014918	FH	On-Demand	Anodyne	PDE6D	48	33
CCn1c(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)nc2ccccc21	ZINC000875014918	FH	On-Demand	Anodyne	EPHX2	24	41
CCn1c(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)nc2ccccc21	ZINC000875014918	FH	On-Demand	Anodyne	SMO	43	44
C[C@@H]1CCCCN1CCCNC(=O)NCc1noc2cc(F)ccc12	ZINC000875014924	EG	On-Demand	Anodyne	HTR2A	24	40
C[C@@H]1CCCCN1CCCNC(=O)NCc1noc2cc(F)ccc12	ZINC000875014924	EG	On-Demand	Anodyne	HTR7	23	40
C[C@H]1CCCCN1CCCNC(=O)NCc1noc2cc(F)ccc12	ZINC000875014925	EG	On-Demand	Anodyne	HTR2A	24	40
C[C@H]1CCCCN1CCCNC(=O)NCc1noc2cc(F)ccc12	ZINC000875014925	EG	On-Demand	Anodyne	HTR7	23	40
COc1ccc(OCCNC(=O)C(=O)N2CCCCCCNC(=O)CC2)cc1	ZINC000875014949	GD	On-Demand	Anodyne	HRH2	25	41
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1ccc(CN2CCCCC2)cc1	ZINC000875014961	GD	On-Demand	Mild	HRH3	21	43
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1ccc(CN2CCCCC2)cc1	ZINC000875014963	GD	On-Demand	Mild	HRH3	21	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccccc2CN2CCCCC2)C1	ZINC000875014982	GE	On-Demand	Anodyne	SLC6A1	90	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccccc2CN2CCCCC2)C1	ZINC000875014983	GE	On-Demand	Anodyne	SLC6A1	90	35
COCC(C)(C)CCNC(=O)C(=O)NCc1ccc(C(F)(F)F)cc1	ZINC000875014996	FF	On-Demand	Anodyne	PPARA	19	40
C#CC[C@@H](COC)NC(=O)C(=O)NCc1ccc(CN2CCCCC2)cc1	ZINC000875015004	FD	On-Demand	Mild	HRH3	21	43
C#CC[C@H](COC)NC(=O)C(=O)NCc1ccc(CN2CCCCC2)cc1	ZINC000875015005	FD	On-Demand	Mild	HRH3	21	43
CCO[C@@H](C(=O)Nc1nc2ccc(Br)cc2s1)[C@@H]1CCOC1	ZINC000875015034	GG	On-Demand	Anodyne	CSNK1D	42	47
CCO[C@@H](C(=O)Nc1nc2ccc(Br)cc2s1)[C@H]1CCOC1	ZINC000875015038	GG	On-Demand	Anodyne	CSNK1D	42	47
COc1ccc(OCCNC(=O)C(=O)NCc2ncc(Cl)s2)cc1	ZINC000875015041	FD	On-Demand	Anodyne	SCNN1A	25	41
O=C(NCc1ccc(C(F)(F)F)cc1)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875015053	GF	On-Demand	Anodyne	CCR2	22	40
O=C(NCc1ccc(C(F)(F)F)cc1)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875015055	GF	On-Demand	Anodyne	CCR2	22	40
O=C(NCc1ccc(C(F)(F)F)cc1)C(=O)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875015057	GF	On-Demand	Anodyne	CCR2	22	40
O=C(NCc1ccc(C(F)(F)F)cc1)C(=O)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875015059	GF	On-Demand	Anodyne	CCR2	22	40
CCCCCCCNC(=O)C(=O)N[C@@H](c1cccc(F)c1)c1nccn1C	ZINC000875015072	FF	On-Demand	Mild	SOAT1	26	43
CCCCCCCNC(=O)C(=O)N[C@@H](c1cccc(F)c1)c1nccn1C	ZINC000875015072	FF	On-Demand	Mild	ASAH1	58	35
CCCCCCCNC(=O)C(=O)N[C@H](c1cccc(F)c1)c1nccn1C	ZINC000875015074	FF	On-Demand	Mild	SOAT1	26	43
CCCCCCCNC(=O)C(=O)N[C@H](c1cccc(F)c1)c1nccn1C	ZINC000875015074	FF	On-Demand	Mild	ASAH1	58	35
CON=Cc1ccc(C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)cc1	ZINC000875015078	HJ	On-Demand	Mild	SCD1	48	54
CON=Cc1ccc(C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)cc1	ZINC000875015078	HJ	On-Demand	Mild	SCD	45	54
CC[C@@H](NC(C)=O)C(=O)Nc1nc2ccc(Br)cc2s1	ZINC000875015080	FF	On-Demand	Anodyne	LCK	27	42
CC[C@@H](NC(C)=O)C(=O)Nc1nc2ccc(Br)cc2s1	ZINC000875015080	FF	On-Demand	Anodyne	CSNK1D	47	53
CC[C@@H](NC(C)=O)C(=O)Nc1nc2ccc(Br)cc2s1	ZINC000875015080	FF	On-Demand	Anodyne	PIK3CA	20	43
CC[C@@H](NC(C)=O)C(=O)Nc1nc2ccc(Br)cc2s1	ZINC000875015080	FF	On-Demand	Anodyne	PIK3CG	16	41
CC[C@@H](CNC(=O)N1CCCC[C@@H]1CNC(=O)NC)c1ccccc1	ZINC000875015082	EF	On-Demand	Anodyne	HCRTR1	16	43
CC[C@@H](CNC(=O)N1CCCC[C@H]1CNC(=O)NC)c1ccccc1	ZINC000875015084	EF	On-Demand	Anodyne	HCRTR1	16	43
COc1ccc(OC(=O)[C@H]2CCCN2C(C)=O)c(C(C)(C)C)c1	ZINC000875015098	DF	On-Demand	Anodyne	FKBP1A	57	47
CCCCCCCNC(=O)C(=O)N[C@@H](c1ccccc1F)c1nccn1C	ZINC000875015100	FF	On-Demand	Mild	ASAH1	69	37
CCCCCCCNC(=O)C(=O)N[C@H](c1ccccc1F)c1nccn1C	ZINC000875015102	FF	On-Demand	Mild	ASAH1	69	37
NC(=O)[C@@H]1CC[C@H](CCC(=O)Nc2nc3ccc(Br)cc3s2)O1	ZINC000875015110	GF	On-Demand	Anodyne	LCK	15	40
NC(=O)[C@@H]1CC[C@H](CCC(=O)Nc2nc3ccc(Br)cc3s2)O1	ZINC000875015110	GF	On-Demand	Anodyne	CSNK1D	44	47
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@@H](C)c2nc3ccccc3[nH]2)C1	ZINC000875015133	DF	On-Demand	Anodyne	OPRD1	15	42
N#CCSc1ccccc1C(=O)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000875015134	IK	On-Demand	Mild	MTTP	56	37
N#CCSc1ccccc1C(=O)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000875015134	IK	On-Demand	Mild	SCD1	38	42
N#CCSc1ccccc1C(=O)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000875015134	IK	On-Demand	Mild	SCD	36	43
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@H](C)c2nc3ccccc3[nH]2)C1	ZINC000875015135	DF	On-Demand	Anodyne	OPRD1	15	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000875015143	GE	On-Demand	Anodyne	HRH3	33	47
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000875015143	GE	On-Demand	Anodyne	SIGMAR1	23	45
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000875015143	GE	On-Demand	Anodyne	CCR3	17	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000875015143	GE	On-Demand	Anodyne	DPP7	51	36
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000875015144	GE	On-Demand	Anodyne	HRH3	33	47
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000875015144	GE	On-Demand	Anodyne	SIGMAR1	23	45
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000875015144	GE	On-Demand	Anodyne	CCR3	17	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000875015144	GE	On-Demand	Anodyne	DPP7	51	36
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1	ZINC000875015164	FF	On-Demand	Anodyne	KCNA5	19	40
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1	ZINC000875015164	FF	On-Demand	Anodyne	CA14	25	40
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1	ZINC000875015164	FF	On-Demand	Anodyne	MTNR1A	19	45
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1	ZINC000875015164	FF	On-Demand	Anodyne	MTNR1B	23	45
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1	ZINC000875015164	FF	On-Demand	Anodyne	MMP3	36	40
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1	ZINC000875015164	FF	On-Demand	Anodyne	MMP8	29	40
O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)C(=O)N[C@H]1CC12CCC2	ZINC000875015179	FD	On-Demand	Anodyne	L3MBTL3	65	38
O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875015181	FD	On-Demand	Anodyne	L3MBTL3	65	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(C(=O)N3CCCCC3)cc2)C1	ZINC000875015197	GD	On-Demand	Anodyne	DPP7	40	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(C(=O)N3CCCCC3)cc2)C1	ZINC000875015197	GD	On-Demand	Anodyne	L3MBTL3	86	42
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](CN1CCOCC1)c1ccccc1	ZINC000875015202	FC	On-Demand	Mild	CASR	46	37
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](CN1CCOCC1)c1ccccc1	ZINC000875015209	FC	On-Demand	Mild	CASR	46	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(C(=O)N3CCCCC3)cc2)C1	ZINC000875015210	GD	On-Demand	Anodyne	DPP7	40	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(C(=O)N3CCCCC3)cc2)C1	ZINC000875015210	GD	On-Demand	Anodyne	L3MBTL3	86	42
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](CN1CCOCC1)c1ccccc1	ZINC000875015211	FC	On-Demand	Mild	CASR	46	37
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](CN1CCOCC1)c1ccccc1	ZINC000875015212	FC	On-Demand	Mild	CASR	46	37
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2nc3ccccc3n2CC)C1	ZINC000875015241	FE	On-Demand	Anodyne	PDE6D	62	35
CN(C)S(=O)(=O)c1ccc(NC(=O)c2cccn(C3CC3)c2=O)cc1	ZINC000875015242	FD	On-Demand	Anodyne	AVPR2	45	36
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1nc2ccccc2[nH]1	ZINC000875015256	CD	On-Demand	Anodyne	OPRD1	17	42
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1nc2ccccc2[nH]1	ZINC000875015258	CD	On-Demand	Anodyne	OPRD1	17	42
C[C@H](NC(=O)N1Cc2cccnc2N2CCC[C@H]2C1)c1nc2ccccc2[nH]1	ZINC000875015273	GG	On-Demand	Anodyne	OPRD1	15	40
CC[C@@H](NC(=O)NCc1nc2ccccc2n1C)c1cccc(OC)c1OC	ZINC000875015274	GH	On-Demand	Anodyne	TACR3	45	40
C[C@@H](NC(=O)N1Cc2cccnc2N2CCC[C@H]2C1)c1nc2ccccc2[nH]1	ZINC000875015276	GG	On-Demand	Anodyne	OPRD1	15	40
O=C1O[C@H](C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)Cc2ccccc21	ZINC000875015279	II	On-Demand	Anodyne	SCD	31	41
O=C1O[C@@H](C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)Cc2ccccc21	ZINC000875015281	II	On-Demand	Anodyne	SCD	31	41
O=C(NCCO)C1CCN(C(=O)NCCSCc2ccccc2F)CC1	ZINC000875015286	GD	On-Demand	Anodyne	EPHX2	17	41
O=C(NCCO)C1CCN(C(=O)NCCSCc2ccccc2F)CC1	ZINC000875015286	GD	On-Demand	Anodyne	CACNA1G	26	40
CCn1c(CNC(=O)NCCN2CC[C@@H](O)C2)nc2ccccc21	ZINC000875015293	EC	On-Demand	Anodyne	PLD1	41	36
CCn1c(CNC(=O)NCCN2CC[C@@H](O)C2)nc2ccccc21	ZINC000875015293	EC	On-Demand	Anodyne	PLD2	50	36
CCn1c(CNC(=O)NCCN2CC[C@@H](O)C2)nc2ccccc21	ZINC000875015293	EC	On-Demand	Anodyne	MCHR1	17	40
CCn1c(CNC(=O)NCCN2CC[C@H](O)C2)nc2ccccc21	ZINC000875015294	EC	On-Demand	Anodyne	PLD1	41	36
CCn1c(CNC(=O)NCCN2CC[C@H](O)C2)nc2ccccc21	ZINC000875015294	EC	On-Demand	Anodyne	PLD2	50	36
CCn1c(CNC(=O)NCCN2CC[C@H](O)C2)nc2ccccc21	ZINC000875015294	EC	On-Demand	Anodyne	MCHR1	17	40
CCn1c(CNC(=O)NCCc2ccc(OC)c(O)c2)nc2ccccc21	ZINC000875015295	FF	On-Demand	Anodyne	INHA	64	33
COc1cc(CNC(=O)N2CCCN(C=O)CC2)ccc1OCc1ccccc1	ZINC000875015304	GF	On-Demand	Anodyne	PDGFRB	34	43
COc1cc(CNC(=O)N2CCCN(C=O)CC2)ccc1OCc1ccccc1	ZINC000875015304	GF	On-Demand	Anodyne	PTGER1	53	36
COc1cc(CNC(=O)N2CCCN(C=O)CC2)ccc1OCc1ccccc1	ZINC000875015304	GF	On-Demand	Anodyne	HCRTR1	15	42
COc1cc(CNC(=O)N2CCCN(C=O)CC2)ccc1OCc1ccccc1	ZINC000875015304	GF	On-Demand	Anodyne	MTNR1B	17	49
COc1cc(CNC(=O)N2CCCN(C=O)CC2)ccc1OCc1ccccc1	ZINC000875015304	GF	On-Demand	Anodyne	HCRTR2	20	40
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)C1CCN(C(=O)/C=C/c2ccccc2)CC1	ZINC000875015315	JK	On-Demand	Anodyne	ITGAL	52	33
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)C1CCN(C(=O)/C=C/c2ccccc2)CC1	ZINC000875015315	JK	On-Demand	Anodyne	SCD1	29	46
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)C1CCN(C(=O)/C=C/c2ccccc2)CC1	ZINC000875015315	JK	On-Demand	Anodyne	SCD	27	46
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)C1CCN(C(=O)/C=C\c2ccccc2)CC1	ZINC000875015316	JK	On-Demand	Anodyne	ITGAL	52	33
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)C1CCN(C(=O)/C=C\c2ccccc2)CC1	ZINC000875015316	JK	On-Demand	Anodyne	SCD1	29	46
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)C1CCN(C(=O)/C=C\c2ccccc2)CC1	ZINC000875015316	JK	On-Demand	Anodyne	SCD	27	46
CN1CCN(C(=O)NCc2nc3ccccc3n2C)CCC1(C)C	ZINC000875015320	EE	On-Demand	Anodyne	SMO	36	42
CCCOc1ccc(OC(=O)COCc2ccnc(O)c2)cc1	ZINC000875015341	DF	On-Demand	Anodyne	PLA2G4B	71	41
C[C@@H]1CCCCN1CCCNC(=O)NCc1ccnc(F)c1	ZINC000875015342	DE	On-Demand	Anodyne	HRH3	57	39
C[C@H]1CCCCN1CCCNC(=O)NCc1ccnc(F)c1	ZINC000875015343	DE	On-Demand	Anodyne	HRH3	57	39
CCOC(=O)C1=CC[C@H](NC(=O)NCCCN2CCCC[C@@H]2C)C1	ZINC000875015359	EE	On-Demand	Anodyne	HRH3	24	40
CCOC(=O)C1=CC[C@H](NC(=O)NCCCN2CCCC[C@H]2C)C1	ZINC000875015360	EE	On-Demand	Anodyne	HRH3	24	40
CCCOc1ccc(OC(=O)COCc2ccc(OC)nc2)cc1	ZINC000875015376	EG	On-Demand	Anodyne	PLA2G4B	60	40
COC1CC(C(=O)Nc2sc(-c3ccccc3)cc2C(N)=O)C1	ZINC000875015378	EF	On-Demand	Anodyne	IKBKB	16	62
COC1CC(C(=O)Nc2sc(-c3ccccc3)cc2C(N)=O)C1	ZINC000875015378	EF	On-Demand	Anodyne	CHEK1	26	51
O=C(NCCCCC1CC1)C(=O)NCc1ccc(C(F)(F)F)cc1	ZINC000875015422	EG	On-Demand	Anodyne	TRPV1	21	40
O=C(NCCCCC1CC1)C(=O)NCc1ccc(C(F)(F)F)cc1	ZINC000875015422	EG	On-Demand	Anodyne	MTTP	22	41
O=C(NCCCCC1CC1)C(=O)NCc1ccc(C(F)(F)F)cc1	ZINC000875015422	EG	On-Demand	Anodyne	LIPG	15	40
CC[C@]1(C(=O)Nc2nc(-c3ccc(C(=O)OC)cc3)cs2)CCNC1=O	ZINC000875015432	FE	On-Demand	Anodyne	ROCK1	20	40
CC[C@]1(C(=O)Nc2nc(-c3ccc(C(=O)OC)cc3)cs2)CCNC1=O	ZINC000875015432	FE	On-Demand	Anodyne	ROCK2	15	40
COc1cccc(C(C)(C)C(=O)Nc2ccc(S(=O)(=O)N(C)C)cc2)c1	ZINC000875015448	GF	On-Demand	Anodyne	MTNR1A	19	44
COc1cccc(C(C)(C)C(=O)Nc2ccc(S(=O)(=O)N(C)C)cc2)c1	ZINC000875015448	GF	On-Demand	Anodyne	MTNR1B	24	44
COc1cccc(C(C)(C)C(=O)Nc2ccc(S(=O)(=O)N(C)C)cc2)c1	ZINC000875015448	GF	On-Demand	Anodyne	IMDH_CRYPV	22	40
O=C1CCN(C(=O)C(=O)NCCCOc2ccccc2)CCCCCCN1	ZINC000875015457	GD	On-Demand	Anodyne	HRH2	44	44
CN(C)S(=O)(=O)c1ccc(NC(=O)C2(F)CCOCC2)cc1	ZINC000875015478	ED	On-Demand	Anodyne	MMP13	26	41
COC(=O)N(C)NC(=O)NCc1ccc(OCc2ccccc2)c(OC)c1	ZINC000875015486	FF	On-Demand	Reactive	DRTS_PLAFK	19	43
COC(=O)N(C)NC(=O)NCc1ccc(OCc2ccccc2)c(OC)c1	ZINC000875015486	FF	On-Demand	Reactive	PTGER1	47	33
COC(=O)N(C)NC(=O)NCc1ccc(OCc2ccccc2)c(OC)c1	ZINC000875015486	FF	On-Demand	Reactive	HCRTR1	17	40
COC(=O)N(C)NC(=O)NCc1ccc(OCc2ccccc2)c(OC)c1	ZINC000875015486	FF	On-Demand	Reactive	ROCK2	17	42
COC(=O)N(C)NC(=O)NCc1ccc(OCc2ccccc2)c(OC)c1	ZINC000875015486	FF	On-Demand	Reactive	MT-ND1	19	40
COC(=O)N(C)NC(=O)NCc1ccc(OCc2ccccc2)c(OC)c1	ZINC000875015486	FF	On-Demand	Reactive	HCRTR2	22	40
C[C@@H](NC(=O)N1CCN(c2ccc(C#N)cc2)CC1)c1nc2ccccc2[nH]1	ZINC000875015523	FG	On-Demand	Mild	FASN	29	40
CCn1c(CNC(=O)N(CCOC)C2CCOCC2)nc2ccccc21	ZINC000875015546	FE	On-Demand	Anodyne	HRH1	18	40
CN(C[C@@H]1CN(c2ccccc2)C(=O)O1)C(=O)NCc1nc2ccccc2n1C	ZINC000875015567	GF	On-Demand	Anodyne	GRM2	21	42
CCn1c(CNC(=O)N(C2CC2)C2CC2)nc2ccccc21	ZINC000875015592	CF	On-Demand	Anodyne	PDE6D	41	33
C[C@@H]1CN(C(=O)NCc2nc3ccccc3n2C)CC[C@H](C(F)(F)F)O1	ZINC000875015594	FF	On-Demand	Anodyne	GRM2	22	43
C[C@@H]1CN(C(=O)NCc2nc3ccccc3n2C)CC[C@H](C(F)(F)F)O1	ZINC000875015594	FF	On-Demand	Anodyne	SMO	34	40
C[C@@H]1CN(C(=O)NCc2nc3ccccc3n2C)CC[C@@H](C(F)(F)F)O1	ZINC000875015596	FF	On-Demand	Anodyne	GRM2	22	43
C[C@@H]1CN(C(=O)NCc2nc3ccccc3n2C)CC[C@@H](C(F)(F)F)O1	ZINC000875015596	FF	On-Demand	Anodyne	SMO	34	40
CCn1c(CNC(=O)NC2CC(C(=O)OC)C2)nc2ccccc21	ZINC000875015600	ED	On-Demand	Anodyne	PDE6D	51	36
CCn1c(CNC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)nc2ccccc21	ZINC000875015612	FE	On-Demand	Anodyne	SLC6A3	50	38
CCn1c(CNC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)nc2ccccc21	ZINC000875015613	FE	On-Demand	Anodyne	SLC6A3	50	38
CCO[C@@H](C(=O)Nc1sc(-c2ccccc2)cc1C(N)=O)C1CC1	ZINC000875015635	EG	On-Demand	Anodyne	IKBKB	16	56
CCO[C@@H](C(=O)Nc1sc(-c2ccccc2)cc1C(N)=O)C1CC1	ZINC000875015635	EG	On-Demand	Anodyne	CHEK1	25	48
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCN(C)c2ccccc2)C1	ZINC000875015641	ED	On-Demand	Anodyne	SLC6A1	54	38
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCN(C)c2ccccc2)C1	ZINC000875015642	ED	On-Demand	Anodyne	SLC6A1	54	38
C[C@@H]1O[C@H](C)C[C@@H]1C(=O)Nc1sc(-c2ccccc2)cc1C(N)=O	ZINC000875015649	EG	On-Demand	Anodyne	IKBKB	17	63
C[C@@H]1O[C@H](C)C[C@@H]1C(=O)Nc1sc(-c2ccccc2)cc1C(N)=O	ZINC000875015649	EG	On-Demand	Anodyne	CHEK1	25	52
C[C@@H]1C[C@@H](C(=O)Nc2sc(-c3ccccc3)cc2C(N)=O)[C@@H](C)O1	ZINC000875015650	EG	On-Demand	Anodyne	IKBKB	17	63
C[C@@H]1C[C@@H](C(=O)Nc2sc(-c3ccccc3)cc2C(N)=O)[C@@H](C)O1	ZINC000875015650	EG	On-Demand	Anodyne	CHEK1	25	52
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(C(F)(F)F)cc2)C1	ZINC000875015677	FE	On-Demand	Anodyne	MTTP	19	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(C(F)(F)F)cc2)C1	ZINC000875015677	FE	On-Demand	Anodyne	CCR2	60	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(C(F)(F)F)cc2)C1	ZINC000875015677	FE	On-Demand	Anodyne	DPP7	55	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(C(F)(F)F)cc2)C1	ZINC000875015677	FE	On-Demand	Anodyne	MCHR1	23	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(C(F)(F)F)cc2)C1	ZINC000875015678	FE	On-Demand	Anodyne	MTTP	19	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(C(F)(F)F)cc2)C1	ZINC000875015678	FE	On-Demand	Anodyne	CCR2	60	37
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(C(F)(F)F)cc2)C1	ZINC000875015678	FE	On-Demand	Anodyne	DPP7	55	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(C(F)(F)F)cc2)C1	ZINC000875015678	FE	On-Demand	Anodyne	MCHR1	23	41
O=C(NCc1ccc(C(F)(F)F)cc1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875015680	FF	On-Demand	Anodyne	CCR2	50	35
O=C(NCc1ccc(C(F)(F)F)cc1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875015681	FF	On-Demand	Anodyne	CCR2	50	35
O=C(NCc1ccc(C(F)(F)F)cc1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875015682	FF	On-Demand	Anodyne	CCR2	50	35
O=C(NCc1ccc(C(F)(F)F)cc1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875015683	FF	On-Demand	Anodyne	CCR2	50	35
C[C@H]1CCCCN1CCCNC(=O)NCCc1cn(C)c2ncccc12	ZINC000875015724	FF	On-Demand	Anodyne	HRH3	43	40
C[C@@H]1CCCCN1CCCNC(=O)NCCc1cn(C)c2ncccc12	ZINC000875015725	FF	On-Demand	Anodyne	HRH3	43	40
Cc1cc(OCC(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)no1	ZINC000875015736	GI	On-Demand	Anodyne	PPARD	42	36
Cc1cc(OCC(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)no1	ZINC000875015736	GI	On-Demand	Anodyne	SCD1	38	43
Cc1cc(OCC(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)no1	ZINC000875015736	GI	On-Demand	Anodyne	SCD	37	45
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccccc2OC(F)(F)F)C1	ZINC000875015742	FE	On-Demand	Anodyne	EPHX2	20	49
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccccc2OC(F)(F)F)C1	ZINC000875015743	FE	On-Demand	Anodyne	EPHX2	20	49
CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)(C)c2ccc(C#N)cc2)cc1	ZINC000875015756	FF	On-Demand	Mild	MTCA1	28	48
CN(C)S(=O)(=O)c1ccc(NC(=O)C(C)(C)c2ccc(C#N)cc2)cc1	ZINC000875015756	FF	On-Demand	Mild	P96878_MYCTU	26	48
O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875015778	GE	On-Demand	Anodyne	L3MBTL3	74	40
CCn1c(CNC(=O)N[C@@H]2COCC[C@H]2O)nc2ccccc21	ZINC000875015806	DD	On-Demand	Anodyne	ADAM17	21	43
CCn1c(CNC(=O)N2CCC(C(=O)NCCO)CC2)nc2ccccc21	ZINC000875015811	FD	On-Demand	Anodyne	PDE6D	54	35
CCn1c(CNC(=O)N2CCC(C(=O)NCCO)CC2)nc2ccccc21	ZINC000875015811	FD	On-Demand	Anodyne	EPHX2	18	40
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3c(C)nn(-c4ccccc4)c3C)C[C@@H]1C2	ZINC000875015820	GF	On-Demand	Anodyne	P2RX7	15	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nc2ccccc2n1C	ZINC000875015833	ED	On-Demand	Anodyne	SLC6A4	32	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nc2ccccc2n1C	ZINC000875015833	ED	On-Demand	Anodyne	SLC6A3	69	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nc2ccccc2n1C	ZINC000875015835	ED	On-Demand	Anodyne	SLC6A4	32	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nc2ccccc2n1C	ZINC000875015835	ED	On-Demand	Anodyne	SLC6A3	69	42
O=C(NCCCCc1ccccc1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875015842	EC	On-Demand	Anodyne	FKBP1A	19	42
O=C(NCCCCc1ccccc1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875015842	EC	On-Demand	Anodyne	GHRHR	41	34
O=C(NCCCCc1ccccc1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875015842	EC	On-Demand	Anodyne	SIGMAR1	25	40
O=C(NCCCCc1ccccc1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875015842	EC	On-Demand	Anodyne	FAAH	25	45
O=C(NCCCCc1ccccc1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875015842	EC	On-Demand	Anodyne	AMP1_PLAFQ	22	49
CC(=O)[C@@H]1CCCN(C(=O)Nc2ccccc2SCC(N)=O)C1	ZINC000875015850	EE	On-Demand	Anodyne	KCNQ2	53	34
CC(=O)[C@@H]1CCCN(C(=O)Nc2ccccc2SCC(N)=O)C1	ZINC000875015850	EE	On-Demand	Anodyne	DPP7	54	34
CC(=O)[C@H]1CCCN(C(=O)Nc2ccccc2SCC(N)=O)C1	ZINC000875015852	EE	On-Demand	Anodyne	KCNQ2	53	34
CC(=O)[C@H]1CCCN(C(=O)Nc2ccccc2SCC(N)=O)C1	ZINC000875015852	EE	On-Demand	Anodyne	DPP7	54	34
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1cccnc1SC(F)F	ZINC000875015881	IK	On-Demand	Anodyne	SCD1	37	42
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1cccnc1SC(F)F	ZINC000875015881	IK	On-Demand	Anodyne	SCD	36	45
CC(C)n1ncc(C(=O)Nc2ccc(S(=O)(=O)N(C)C)cc2)c1Cl	ZINC000875015885	FF	On-Demand	Anodyne	GRM4	15	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCSc1ccc(C)cc1	ZINC000875015888	EF	On-Demand	Anodyne	SLC6A4	25	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCSc1ccc(C)cc1	ZINC000875015888	EF	On-Demand	Anodyne	SLC6A3	49	42
C[C@@]1(Br)C[C@@H]1C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000875015901	DG	On-Demand	Mild	AR	24	42
C[C@@]1(Br)C[C@H]1C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000875015904	DG	On-Demand	Mild	AR	24	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCSc1ccccc1	ZINC000875015923	EF	On-Demand	Anodyne	SLC6A4	26	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCSc1ccccc1	ZINC000875015923	EF	On-Demand	Anodyne	SLC6A3	55	43
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)NC1(C)CC(F)(F)C1	ZINC000875015946	EG	On-Demand	Anodyne	P2RX7	24	53
CCOC1CC2(C1)C[C@H]2C(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1	ZINC000875015962	FE	On-Demand	Anodyne	TIMP3	47	33
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875015971	GG	On-Demand	Anodyne	P2RX7	15	48
CCn1c(CNC(=O)Nc2cnn(C3CCN(C)CC3)c2)nc2ccccc21	ZINC000875015983	GF	On-Demand	Anodyne	HRH1	18	41
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1nc2ccccc2[nH]1	ZINC000875015991	DF	On-Demand	Anodyne	PRCP	15	40
CC(=O)N(C)c1ccc(CNC(=O)NCCCN2CCCC[C@@H]2C)cc1	ZINC000875016041	FF	On-Demand	Anodyne	HRH3	47	43
CC(=O)N(C)c1ccc(CNC(=O)NCCCN2CCCC[C@@H]2C)cc1	ZINC000875016041	FF	On-Demand	Anodyne	CCR3	18	41
CC(=O)N(C)c1ccc(CNC(=O)NCCCN2CCCC[C@H]2C)cc1	ZINC000875016042	FF	On-Demand	Anodyne	HRH3	47	43
CC(=O)N(C)c1ccc(CNC(=O)NCCCN2CCCC[C@H]2C)cc1	ZINC000875016042	FF	On-Demand	Anodyne	CCR3	18	41
NC(=O)c1cc(-c2ccccc2)sc1NC(=O)Cc1cnn2c1CCCC2	ZINC000875016043	GG	On-Demand	Anodyne	CHEK1	26	51
CCCCCCCNC(=O)C(=O)NCc1nnc2ccc(C(F)(F)F)cn12	ZINC000875016044	GE	On-Demand	Mild	ASAH1	92	38
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875016045	JK	On-Demand	Anodyne	SCD1	44	49
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875016045	JK	On-Demand	Anodyne	SCD	41	49
C[C@@H]1CCCCN1CCCNC(=O)NCc1ccc(Br)cn1	ZINC000875016055	FF	On-Demand	Anodyne	HRH3	43	37
C[C@H]1CCCCN1CCCNC(=O)NCc1ccc(Br)cn1	ZINC000875016056	FF	On-Demand	Anodyne	HRH3	43	37
O=C(NCc1ccc(C(F)(F)F)cc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875016073	GG	On-Demand	Anodyne	EPHX2	21	41
O=C(NCc1ccc(C(F)(F)F)cc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875016073	GG	On-Demand	Anodyne	LIPG	44	34
O=C(NCc1ccc(C(F)(F)F)cc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875016074	GG	On-Demand	Anodyne	EPHX2	21	41
O=C(NCc1ccc(C(F)(F)F)cc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875016074	GG	On-Demand	Anodyne	LIPG	44	34
CCO[C@H]1COCC[C@H]1CC(=O)Nc1sc(-c2ccccc2)cc1C(N)=O	ZINC000875016094	GG	On-Demand	Anodyne	CHEK1	23	43
CCO[C@H]1COCC[C@@H]1CC(=O)Nc1sc(-c2ccccc2)cc1C(N)=O	ZINC000875016095	GG	On-Demand	Anodyne	CHEK1	23	43
C[C@@H]1CCCCN1CCCNC(=O)NCc1ccc2oc(O)nc2c1	ZINC000875016106	EF	On-Demand	Anodyne	HRH3	65	41
C[C@H]1CCCCN1CCCNC(=O)NCc1ccc2oc(O)nc2c1	ZINC000875016107	EF	On-Demand	Anodyne	HRH3	65	41
CCCOc1ccc(OC(=O)COCc2ccnc(OC)c2)cc1	ZINC000875016111	EG	On-Demand	Anodyne	PLA2G4B	57	40
CCCOc1ccc(OC(=O)c2ccc(NS(C)(=O)=O)nc2)cc1	ZINC000875016118	FE	On-Demand	Anodyne	ACR	59	45
NC(=O)c1cc(-c2ccccc2)sc1NC(=O)[C@@H]1C[C@H]1C1CCOCC1	ZINC000875016121	FH	On-Demand	Anodyne	CHEK1	22	48
NC(=O)c1cc(-c2ccccc2)sc1NC(=O)C12CC(C1)C2	ZINC000875016132	DG	On-Demand	Anodyne	IKBKB	19	67
NC(=O)c1cc(-c2ccccc2)sc1NC(=O)C12CC(C1)C2	ZINC000875016132	DG	On-Demand	Anodyne	CHEK1	28	53
CN(C)S(=O)(=O)c1ccc(NC(=O)Cc2csc(C3CCCC3)n2)cc1	ZINC000875016158	GG	On-Demand	Anodyne	AVPR1B	15	41
Cc1nnc(NNC(=O)NCc2ccc(CN3CCOCC3)cc2)n1C	ZINC000875016164	FC	On-Demand	Reactive	DPOL_VZVD	24	42
C[C@H](NC(=O)C(=O)NCCCCc1ccccc1)c1ccc(C(F)(F)F)nc1	ZINC000875016169	GG	On-Demand	Anodyne	SCN2A	16	40
C[C@H](NC(=O)C(=O)NCCCCc1ccccc1)c1ccc(C(F)(F)F)nc1	ZINC000875016169	GG	On-Demand	Anodyne	FAAH	38	40
C[C@H](NC(=O)C(=O)NCCCCc1ccccc1)c1ccc(C(F)(F)F)nc1	ZINC000875016169	GG	On-Demand	Anodyne	CES1	29	40
C[C@H](NC(=O)C(=O)NCCCCc1ccccc1)c1ccc(C(F)(F)F)nc1	ZINC000875016169	GG	On-Demand	Anodyne	CAPN2	48	37
C[C@H](NC(=O)C(=O)NCCCCc1ccccc1)c1ccc(C(F)(F)F)nc1	ZINC000875016169	GG	On-Demand	Anodyne	AMP1_PLAFQ	22	42
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCCc2ccccc2)C1	ZINC000875016179	EE	On-Demand	Anodyne	ACE	39	41
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCCc2ccccc2)C1	ZINC000875016179	EE	On-Demand	Anodyne	FKBP1A	60	42
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCCc2ccccc2)C1	ZINC000875016179	EE	On-Demand	Anodyne	CYSLTR2	44	32
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCCc2ccccc2)C1	ZINC000875016179	EE	On-Demand	Anodyne	SIGMAR1	16	42
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCCc2ccccc2)C1	ZINC000875016179	EE	On-Demand	Anodyne	KCNA3	15	40
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCCc2ccccc2)C1	ZINC000875016179	EE	On-Demand	Anodyne	FAAH	41	41
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCCc2ccccc2)C1	ZINC000875016179	EE	On-Demand	Anodyne	CES1	47	35
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCCc2ccccc2)C1	ZINC000875016179	EE	On-Demand	Anodyne	AMP1_PLAFQ	21	40
CC[C@H](C[C@H](C)O)NC(=O)NCc1c(C)nn(-c2ccccc2)c1C	ZINC000875016208	EF	On-Demand	Anodyne	P2RX7	19	51
CC(=O)C1CCN(C(=O)NCc2c(C)nn(-c3ccccc3)c2C)CC1	ZINC000875016210	FF	On-Demand	Anodyne	P2RX7	20	53
CC(=O)C1CCN(C(=O)NCc2nc3ccccc3n2C)CC1	ZINC000875016211	DE	On-Demand	Anodyne	PDE6D	61	36
CC(=O)C1CCN(C(=O)NCc2nc3ccccc3n2C)CC1	ZINC000875016211	DE	On-Demand	Anodyne	GRM2	16	46
CC(=O)C1CCN(C(=O)NCc2nc3ccccc3n2C)CC1	ZINC000875016211	DE	On-Demand	Anodyne	SMO	43	45
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875016212	FF	On-Demand	Anodyne	P2RX7	17	53
CCn1c(CNC(=O)N2OC3CCC2CC3)nc2ccccc21	ZINC000875016232	DF	On-Demand	Anodyne	PDE6D	45	34
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875016240	FF	On-Demand	Anodyne	P2RX7	17	53
Cn1cc(/C=C\C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)cn1	ZINC000875016241	GI	On-Demand	Anodyne	SCD1	35	40
Cn1cc(/C=C\C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)cn1	ZINC000875016241	GI	On-Demand	Anodyne	SCD	33	57
Cn1cc(/C=C/C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)cn1	ZINC000875016242	GI	On-Demand	Anodyne	SCD1	35	40
Cn1cc(/C=C/C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)cn1	ZINC000875016242	GI	On-Demand	Anodyne	SCD	33	57
Cc1nccnc1[C@@H](C)NC(=O)NCCCN1CCCC[C@@H]1C	ZINC000875016260	DE	On-Demand	Anodyne	HRH3	43	37
Cc1nccnc1[C@H](C)NC(=O)NCCCN1CCCC[C@H]1C	ZINC000875016263	DE	On-Demand	Anodyne	HRH3	43	37
Cc1nccnc1[C@@H](C)NC(=O)NCCCN1CCCC[C@H]1C	ZINC000875016266	DE	On-Demand	Anodyne	HRH3	43	37
Cc1nccnc1[C@H](C)NC(=O)NCCCN1CCCC[C@@H]1C	ZINC000875016270	DE	On-Demand	Anodyne	HRH3	43	37
CCn1c(CNC(=O)N2CC=CC2)nc2ccccc21	ZINC000875016271	CE	On-Demand	Anodyne	PYGM	18	40
CCn1c(CNC(=O)N2CCCC[C@@H]2[C@@H]2CCCC[C@@H]2O)nc2ccccc21	ZINC000875016275	GH	On-Demand	Anodyne	PDE6D	44	33
CCn1c(CNC(=O)N2CCCC[C@@H]2[C@@H]2CCCC[C@H]2O)nc2ccccc21	ZINC000875016279	GH	On-Demand	Anodyne	PDE6D	44	33
CCn1c(CNC(=O)N2CCCC[C@@H]2[C@H]2CCCC[C@@H]2O)nc2ccccc21	ZINC000875016283	GH	On-Demand	Anodyne	PDE6D	44	33
CCn1c(CNC(=O)N2CCCC[C@@H]2[C@H]2CCCC[C@H]2O)nc2ccccc21	ZINC000875016286	GH	On-Demand	Anodyne	PDE6D	44	33
C[C@H]1CCCCN1CCCNC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875016287	FG	On-Demand	Anodyne	HRH3	50	41
C[C@H]1CCCCN1CCCNC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875016287	FG	On-Demand	Anodyne	ROCK1	23	40
C[C@H]1CCCCN1CCCNC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875016287	FG	On-Demand	Anodyne	ROCK2	16	40
C[C@@H]1CCCCN1CCCNC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875016291	FG	On-Demand	Anodyne	HRH3	50	41
C[C@@H]1CCCCN1CCCNC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875016291	FG	On-Demand	Anodyne	ROCK1	23	40
C[C@@H]1CCCCN1CCCNC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875016291	FG	On-Demand	Anodyne	ROCK2	16	40
CCOC(=O)c1cc(CNC(=O)NCCCN2CCCC[C@H]2C)on1	ZINC000875016293	FD	On-Demand	Anodyne	HRH3	28	47
CCOC(=O)c1cc(CNC(=O)NCCCN2CCCC[C@@H]2C)on1	ZINC000875016296	FD	On-Demand	Anodyne	HRH3	28	47
O=C(NCCCOc1ccccc1)C(=O)NCc1ncc(Cl)s1	ZINC000875016307	FD	On-Demand	Anodyne	DRD4	15	40
CCn1c(CNC(=O)N2CCCC[C@H]2CNC(C)=O)nc2ccccc21	ZINC000875016343	FE	On-Demand	Anodyne	SMO	29	42
CCn1c(CNC(=O)N2CCCC[C@@H]2CNC(C)=O)nc2ccccc21	ZINC000875016347	FE	On-Demand	Anodyne	SMO	29	42
C#C[C@@H]1CC[C@@H](NC(=O)NCc2nc3ccccc3n2C)CC1	ZINC000875016350	DF	On-Demand	Mild	FASN	22	42
CN1CCN(C2CCN(C(=O)Nc3ccccc3SCC(N)=O)CC2)CC1	ZINC000875016359	GD	On-Demand	Anodyne	L3MBTL3	61	40
CN1CC[C@H]2CN(C(=O)NCc3nc4ccccc4n3C)CC[C@H]21	ZINC000875016379	ED	On-Demand	Anodyne	SMO	37	40
CN1CC[C@H]2CN(C(=O)NCc3nc4ccccc4n3C)CC[C@@H]21	ZINC000875016384	ED	On-Demand	Anodyne	SMO	37	40
C[C@H]1CCCCN1CCCNC(=O)NCc1ccc(CN2CCNC2=O)cc1	ZINC000875016391	GE	On-Demand	Anodyne	HRH3	50	39
C[C@H]1CCCCN1CCCNC(=O)NCc1ccc(CN2CCNC2=O)cc1	ZINC000875016391	GE	On-Demand	Anodyne	CCR3	20	42
C[C@@H]1CCCCN1CCCNC(=O)NCc1ccc(CN2CCNC2=O)cc1	ZINC000875016393	GE	On-Demand	Anodyne	HRH3	50	39
C[C@@H]1CCCCN1CCCNC(=O)NCc1ccc(CN2CCNC2=O)cc1	ZINC000875016393	GE	On-Demand	Anodyne	CCR3	20	42
CC(C)c1cc([C@@H]2CCCN(C(=O)N[C@H](C)c3nc4ccccc4[nH]3)C2)n[nH]1	ZINC000875016396	GI	On-Demand	Anodyne	PRCP	22	40
CC(C)c1cc([C@@H]2CCCN(C(=O)N[C@@H](C)c3nc4ccccc4[nH]3)C2)n[nH]1	ZINC000875016398	GI	On-Demand	Anodyne	PRCP	22	40
COc1cc(CNC(=O)N2CCC(C(C)=O)CC2)ccc1OCc1ccccc1	ZINC000875016401	GH	On-Demand	Anodyne	DRTS_PLAFK	16	40
COc1cc(CNC(=O)N2CCC(C(C)=O)CC2)ccc1OCc1ccccc1	ZINC000875016401	GH	On-Demand	Anodyne	TSHR	56	34
COc1cc(CNC(=O)N2CCC(C(C)=O)CC2)ccc1OCc1ccccc1	ZINC000875016401	GH	On-Demand	Anodyne	ACHE	21	42
COc1cc(CNC(=O)N2CCC(C(C)=O)CC2)ccc1OCc1ccccc1	ZINC000875016401	GH	On-Demand	Anodyne	PDGFRB	23	42
COc1cc(CNC(=O)N2CCC(C(C)=O)CC2)ccc1OCc1ccccc1	ZINC000875016401	GH	On-Demand	Anodyne	GRIN2B	31	40
COc1cc(CNC(=O)N2CCC(C(C)=O)CC2)ccc1OCc1ccccc1	ZINC000875016401	GH	On-Demand	Anodyne	PTGER1	53	35
COc1cc(CNC(=O)N2CCC(C(C)=O)CC2)ccc1OCc1ccccc1	ZINC000875016401	GH	On-Demand	Anodyne	HCRTR1	22	45
COc1cc(CNC(=O)N2CCC(C(C)=O)CC2)ccc1OCc1ccccc1	ZINC000875016401	GH	On-Demand	Anodyne	BCHE	26	42
COc1cc(CNC(=O)N2CCC(C(C)=O)CC2)ccc1OCc1ccccc1	ZINC000875016401	GH	On-Demand	Anodyne	MTNR1B	27	52
COc1cc(CNC(=O)N2CCC(C(C)=O)CC2)ccc1OCc1ccccc1	ZINC000875016401	GH	On-Demand	Anodyne	HCRTR2	29	42
COc1cc(CNC(=O)N2CCC(C(C)=O)CC2)ccc1OCc1ccccc1	ZINC000875016401	GH	On-Demand	Anodyne	ACKR3	43	33
C[C@@H]1CCCCN1CCCNC(=O)NCc1nc(O)c2c(n1)CCOC2	ZINC000875016408	FD	On-Demand	Anodyne	WNT3A	45	32
C[C@H]1CCCCN1CCCNC(=O)NCc1nc(O)c2c(n1)CCOC2	ZINC000875016411	FD	On-Demand	Anodyne	WNT3A	45	32
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(C(=O)N3CCCCC3)cc2)CC1	ZINC000875016422	GD	On-Demand	Anodyne	L3MBTL3	96	45
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(C(=O)N3CCCCC3)cc2)CC1	ZINC000875016422	GD	On-Demand	Anodyne	NAMPT	22	42
COc1cc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc(OC)c1OC	ZINC000875016432	FE	On-Demand	Anodyne	DRD2	38	40
COc1cc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc(OC)c1OC	ZINC000875016432	FE	On-Demand	Anodyne	FKBP1A	33	43
COC(=O)N(C)NC(=O)NCc1c(C)nn(-c2ccccc2)c1C	ZINC000875016437	ED	On-Demand	Reactive	P2RX7	22	54
O=C(NCCCCC1CC1)C(=O)NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000875016441	GF	On-Demand	Anodyne	L3MBTL3	82	43
CC[C@]1(C(=O)Nc2ccc(S(=O)(=O)N3CCC(C)CC3)cc2)CCNC1=O	ZINC000875016443	GD	On-Demand	Anodyne	TGM2	65	38
CC[C@]1(C(=O)Nc2ccc(S(=O)(=O)N3CCC(C)CC3)cc2)CCNC1=O	ZINC000875016443	GD	On-Demand	Anodyne	F13A1	79	38
CC[C@]1(C(=O)Nc2ccc(S(=O)(=O)N3CCC(C)CC3)cc2)CCNC1=O	ZINC000875016443	GD	On-Demand	Anodyne	NAMPT	43	50
CCc1ccc(Cl)c(CC)c1NC(=O)c1coc(C#N)c1	ZINC000875016460	DI	On-Demand	Mild	S1PR4	19	41
CC[C@H](C[C@H](C)O)NC(=O)NCCSCc1ccccc1C#N	ZINC000875016472	EF	On-Demand	Mild	ADRB1	41	32
C[C@H](NC(=O)C(=O)NCCCCc1ccccc1)c1cc2cnccc2o1	ZINC000875016491	FG	On-Demand	Anodyne	PTAFR	27	44
C[C@H](NC(=O)C(=O)NCCCCc1ccccc1)c1cc2cnccc2o1	ZINC000875016491	FG	On-Demand	Anodyne	MTNR1A	27	43
C[C@H](NC(=O)C(=O)NCCCCc1ccccc1)c1cc2cnccc2o1	ZINC000875016491	FG	On-Demand	Anodyne	MTNR1B	30	43
C[C@H](NC(=O)C(=O)NCCCCc1ccccc1)c1cc2cnccc2o1	ZINC000875016491	FG	On-Demand	Anodyne	FAAH	60	39
C[C@H](NC(=O)C(=O)NCCCCc1ccccc1)c1cc2cnccc2o1	ZINC000875016491	FG	On-Demand	Anodyne	CES1	56	34
C[C@H](NC(=O)C(=O)NCCCCc1ccccc1)c1cc2cnccc2o1	ZINC000875016491	FG	On-Demand	Anodyne	AMP1_PLAFQ	22	41
C[C@H](NC(=O)C(=O)NCCCCc1ccccc1)c1cc2cnccc2o1	ZINC000875016491	FG	On-Demand	Anodyne	CES1D	44	32
C[C@H](NC(=O)NCCCN1CCCC[C@@H]1C)c1ccnn1C	ZINC000875016505	DE	On-Demand	Anodyne	HRH3	47	37
C[C@H](NC(=O)NCCCN1CCCC[C@H]1C)c1ccnn1C	ZINC000875016506	DE	On-Demand	Anodyne	HRH3	47	37
C[C@H]1CCCCN1CCCNC(=O)N[C@H](C)c1ccnn1C	ZINC000875016507	DE	On-Demand	Anodyne	HRH3	47	37
C[C@@H](NC(=O)NCCCN1CCCC[C@H]1C)c1ccnn1C	ZINC000875016508	DE	On-Demand	Anodyne	HRH3	47	37
C[C@@H]1CCCCN1CCCNC(=O)NCc1ccc(O)c(Cl)c1	ZINC000875016514	EG	On-Demand	Anodyne	HRH3	54	41
C[C@H]1CCCCN1CCCNC(=O)NCc1ccc(O)c(Cl)c1	ZINC000875016515	EG	On-Demand	Anodyne	HRH3	54	41
CCc1ccc(Cl)c(CC)c1NC(=O)[C@H]1COC(=O)N1C	ZINC000875016520	DF	On-Demand	Anodyne	P2RX7	64	50
CCc1ccc(Cl)c(CC)c1NC(=O)[C@@H]1COC(=O)N1C	ZINC000875016521	DF	On-Demand	Anodyne	P2RX7	64	50
CN1CCN(C2CCN(C(=O)C(=O)NCCN(C)c3ccccc3)CC2)CC1	ZINC000875016539	GC	On-Demand	Anodyne	L3MBTL3	60	40
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NCc2ccc(C(F)(F)F)cc2)CC1	ZINC000875016554	GD	On-Demand	Anodyne	EPHX2	15	40
C[C@@H](NC(=O)NCCCN1CCCC[C@H]1C)c1ccns1	ZINC000875016558	DF	On-Demand	Anodyne	HRH3	42	36
C[C@H](NC(=O)NCCCN1CCCC[C@H]1C)c1ccns1	ZINC000875016560	DF	On-Demand	Anodyne	HRH3	42	36
C[C@H]1CCCCN1CCCNC(=O)N[C@H](C)c1ccns1	ZINC000875016561	DF	On-Demand	Anodyne	HRH3	42	36
C[C@H](NC(=O)NCCCN1CCCC[C@@H]1C)c1ccns1	ZINC000875016563	DF	On-Demand	Anodyne	HRH3	42	36
O=C(NCc1ccccc1CN1CCOCC1)NC[C@H]1C[C@H](O)C1	ZINC000875016564	ED	On-Demand	Anodyne	EPHX2	19	40
CCn1c(CNC(=O)N2CCCC[C@H]2CNC(=O)NC)nc2ccccc21	ZINC000875016567	FE	On-Demand	Anodyne	SMO	24	41
CCn1c(CNC(=O)N2CCCC[C@@H]2CNC(=O)NC)nc2ccccc21	ZINC000875016568	FE	On-Demand	Anodyne	SMO	24	41
CCn1c(CNC(=O)N2C[C@@H]3CCC[C@]3(CO)C2)nc2ccccc21	ZINC000875016580	EE	On-Demand	Anodyne	SMO	31	40
CCc1ccc(Cl)c(CC)c1NC(=O)[C@@H]1CCC(=O)N1C(C)C	ZINC000875016581	EH	On-Demand	Anodyne	P2RX7	48	57
C[C@H]1CC(=O)N[C@@H](C(=O)Nc2ccc(C#N)c(Cl)c2)C1	ZINC000875016582	CE	On-Demand	Mild	PFKFB3	65	36
NC(=O)CSc1ccccc1NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875016594	GF	On-Demand	Anodyne	FAAH	15	44
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N1CCCN(C=O)CC1	ZINC000875016597	FD	On-Demand	Anodyne	P2RX7	16	51
CCOC1CC2(C1)C[C@@H]2NC(=O)Nc1ccccc1SCC(N)=O	ZINC000875016622	EE	On-Demand	Anodyne	TIMP3	64	33
C[C@H]1CCCCN1CCCNC(=O)NC(c1ccnn1C)c1ccnn1C	ZINC000875016638	FD	On-Demand	Anodyne	HRH3	49	38
C[C@@H]1CCCCN1CCCNC(=O)NC(c1ccnn1C)c1ccnn1C	ZINC000875016642	FD	On-Demand	Anodyne	HRH3	49	38
CC(=O)C1CCN(C(=O)C(=O)NCCCOc2ccccc2)CC1	ZINC000875016645	ED	On-Demand	Anodyne	HRH2	45	41
CC(=O)C1CCN(C(=O)C(=O)NCCCOc2ccccc2)CC1	ZINC000875016645	ED	On-Demand	Anodyne	LTA4H	32	41
CC(=O)C1CCN(C(=O)C(=O)NCCCOc2ccccc2)CC1	ZINC000875016645	ED	On-Demand	Anodyne	HRH3	27	41
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(C(F)(F)F)cc3)CC[C@H]21	ZINC000875016661	FD	On-Demand	Anodyne	CCR2	63	37
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(C(F)(F)F)cc3)CC[C@@H]21	ZINC000875016666	FD	On-Demand	Anodyne	CCR2	63	37
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1	ZINC000875016667	DD	On-Demand	Anodyne	CA2	20	41
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1	ZINC000875016667	DD	On-Demand	Anodyne	CA1	21	41
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1	ZINC000875016667	DD	On-Demand	Anodyne	CA4	22	41
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(C(F)(F)F)cc2)CC1	ZINC000875016677	FE	On-Demand	Anodyne	MTTP	20	42
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(C(F)(F)F)cc2)CC1	ZINC000875016677	FE	On-Demand	Anodyne	CCR2	64	38
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(C(F)(F)F)cc2)CC1	ZINC000875016677	FE	On-Demand	Anodyne	EPHX2	28	43
CC[C@@H](NC(=O)NCc1nc2ccccc2n1C)[C@@H](O)c1ccccc1	ZINC000875016686	FF	On-Demand	Anodyne	TACR3	47	36
CC[C@@H](NC(=O)NCc1nc2ccccc2n1C)[C@H](O)c1ccccc1	ZINC000875016690	FF	On-Demand	Anodyne	TACR3	47	36
O=C(NCCCOc1ccccc1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875016694	ED	On-Demand	Anodyne	CYSLTR2	48	34
Cc1nc(CNC(=O)C(=O)N2CCN(c3ccc(F)cc3F)CC2)cs1	ZINC000875016706	GD	On-Demand	Anodyne	NPY2R	40	34
C[C@H]1CCC[C@@H](C2CN(C(=O)Nc3ccccc3SCC(N)=O)C2)C1	ZINC000875016722	FH	On-Demand	Anodyne	RBP4	52	34
CCCOc1ccc(OC(=O)C2CCN(C(C)C)CC2)cc1	ZINC000875016729	DH	On-Demand	Anodyne	HRH3	41	42
CCCOc1ccc(OC(=O)C2CCN(C(C)C)CC2)cc1	ZINC000875016729	DH	On-Demand	Anodyne	PLA2G4B	55	33
NC(=O)CSc1ccccc1NC(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875016745	GH	On-Demand	Anodyne	C3AR1	42	42
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCc1ccc(C(F)(F)F)cc1	ZINC000875016746	GF	On-Demand	Anodyne	CCR2	40	36
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCc1ccc(C(F)(F)F)cc1	ZINC000875016746	GF	On-Demand	Anodyne	TRPM8	46	43
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCc1ccc(C(F)(F)F)cc1	ZINC000875016749	GF	On-Demand	Anodyne	CCR2	40	36
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCc1ccc(C(F)(F)F)cc1	ZINC000875016749	GF	On-Demand	Anodyne	TRPM8	46	43
N#Cc1ccc(NC(=O)Cc2csc(C3CC3)n2)cc1Cl	ZINC000875016753	DH	On-Demand	Mild	IMDH_CRYPV	15	46
NC(=O)CSc1ccccc1NC(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875016755	GH	On-Demand	Anodyne	C3AR1	42	42
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875016790	GE	On-Demand	Anodyne	P2RX7	16	49
O=C(NCCCCc1ccccc1)C(=O)N[C@H]1CC12CCC2	ZINC000875016792	DE	On-Demand	Anodyne	SIGMAR1	19	41
O=C(NCCCCc1ccccc1)C(=O)N[C@H]1CC12CCC2	ZINC000875016792	DE	On-Demand	Anodyne	AMP1_PLAFQ	22	44
O=C(NCCCCc1ccccc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875016793	DE	On-Demand	Anodyne	SIGMAR1	19	41
O=C(NCCCCc1ccccc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875016793	DE	On-Demand	Anodyne	AMP1_PLAFQ	22	44
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N1C[C@H]2C(=O)N(C)C(=O)[C@H]2C1	ZINC000875016794	GD	On-Demand	Anodyne	P2RX7	19	51
CN(C)C[C@@H]1CN(C(=O)C(=O)NCCCOc2ccccc2)C[C@H]1CN(C)C	ZINC000875016802	GC	On-Demand	Anodyne	CYSLTR2	43	32
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2nc3ccccc3[nH]2)C1	ZINC000875016803	EE	On-Demand	Anodyne	OPRD1	17	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2nc3ccccc3[nH]2)C1	ZINC000875016806	EE	On-Demand	Anodyne	OPRD1	17	43
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875016816	FG	On-Demand	Anodyne	P2RX7	15	49
CCCCCCCNC(=O)C(=O)N[C@@H](c1ccccc1)c1nccn1C	ZINC000875016819	FF	On-Demand	Mild	SOAT1	48	45
CCCCCCCNC(=O)C(=O)N[C@@H](c1ccccc1)c1nccn1C	ZINC000875016819	FF	On-Demand	Mild	ASAH1	65	39
CCCCCCCNC(=O)C(=O)N[C@H](c1ccccc1)c1nccn1C	ZINC000875016820	FF	On-Demand	Mild	SOAT1	48	45
CCCCCCCNC(=O)C(=O)N[C@H](c1ccccc1)c1nccn1C	ZINC000875016820	FF	On-Demand	Mild	ASAH1	65	39
CCn1c(CNC(=O)N(CCOC)CC2CCN(C)CC2)nc2ccccc21	ZINC000875016826	GF	On-Demand	Anodyne	HRH1	25	42
CCCCCCCNC(=O)C(=O)N[C@@H](c1ccc(F)cc1)c1nccn1C	ZINC000875016834	FF	On-Demand	Mild	SOAT1	16	41
CCCCCCCNC(=O)C(=O)N[C@@H](c1ccc(F)cc1)c1nccn1C	ZINC000875016834	FF	On-Demand	Mild	ASAH1	90	38
CCCCCCCNC(=O)C(=O)N[C@H](c1ccc(F)cc1)c1nccn1C	ZINC000875016836	FF	On-Demand	Mild	SOAT1	16	41
CCCCCCCNC(=O)C(=O)N[C@H](c1ccc(F)cc1)c1nccn1C	ZINC000875016836	FF	On-Demand	Mild	ASAH1	90	38
C[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1nc2ccccc2[nH]1	ZINC000875016845	FE	On-Demand	Anodyne	PRCP	18	41
C[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1nc2ccccc2[nH]1	ZINC000875016845	FE	On-Demand	Anodyne	CALCRL	44	43
C[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1nc2ccccc2[nH]1	ZINC000875016845	FE	On-Demand	Anodyne	L3MBTL3	50	39
C[C@H](NC(=O)N1C[C@H](NC(=O)OC(C)(C)C)C[C@H]1C)c1nc2ccccc2[nH]1	ZINC000875016846	GG	On-Demand	Anodyne	PRCP	19	41
C[C@H](NC(=O)N1C[C@@H](NC(=O)OC(C)(C)C)C[C@@H]1C)c1nc2ccccc2[nH]1	ZINC000875016848	GG	On-Demand	Anodyne	PRCP	19	41
C[C@H](NC(=O)N1C[C@H](NC(=O)OC(C)(C)C)C[C@@H]1C)c1nc2ccccc2[nH]1	ZINC000875016849	GG	On-Demand	Anodyne	PRCP	19	41
C[C@H](NC(=O)N1C[C@@H](NC(=O)OC(C)(C)C)C[C@H]1C)c1nc2ccccc2[nH]1	ZINC000875016850	GG	On-Demand	Anodyne	PRCP	19	41
O=C(/C=C\c1cnc2ccccc2n1)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000875016852	IK	On-Demand	Anodyne	SCD	32	55
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875016854	FG	On-Demand	Anodyne	P2RX7	15	49
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875016855	FG	On-Demand	Anodyne	P2RX7	15	49
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875016858	FG	On-Demand	Anodyne	P2RX7	15	49
O=C(/C=C/c1cnc2ccccc2n1)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000875016860	IK	On-Demand	Anodyne	SCD	32	55
CC(=O)N(C)c1ccc(CNC(=O)NCc2nc3ccccc3n2C)cc1	ZINC000875016865	FF	On-Demand	Anodyne	FASN	15	41
CC(=O)[C@H]1CCCN(C(=O)NCc2c(C)nn(-c3ccccc3)c2C)C1	ZINC000875016866	FF	On-Demand	Anodyne	P2RX7	18	53
CCn1c(CNC(=O)N[C@@H]2C[C@H]3C[C@@]3(C(=O)OC)C2)nc2ccccc21	ZINC000875016867	FE	On-Demand	Anodyne	PDE6D	44	33
CC(=O)[C@@H]1CCCN(C(=O)NCc2c(C)nn(-c3ccccc3)c2C)C1	ZINC000875016868	FF	On-Demand	Anodyne	P2RX7	18	53
O=C(NCc1ccccc1OC(F)(F)F)C(=O)N1CCC(CO)(CO)CC1	ZINC000875016882	GC	On-Demand	Anodyne	EPHX2	21	42
CCn1c(CNC(=O)N2CCCC(F)(F)CC2)nc2ccccc21	ZINC000875016884	EG	On-Demand	Anodyne	SMO	36	42
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875016902	GH	On-Demand	Anodyne	P2RX7	19	52
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875016905	FG	On-Demand	Anodyne	P2RX7	16	51
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875016908	FG	On-Demand	Anodyne	P2RX7	16	51
NC(=O)CSc1ccccc1NC(=O)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875016927	FF	On-Demand	Anodyne	RBP4	41	38
NC(=O)CSc1ccccc1NC(=O)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875016928	FF	On-Demand	Anodyne	RBP4	41	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1c(C)nn(-c2ccccc2)c1C	ZINC000875016929	GF	On-Demand	Anodyne	SLC6A3	41	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1c(C)nn(-c2ccccc2)c1C	ZINC000875016930	GF	On-Demand	Anodyne	SLC6A3	41	38
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875016938	GF	On-Demand	Anodyne	P2RX7	22	48
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875016940	GF	On-Demand	Anodyne	P2RX7	22	48
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875016941	GG	On-Demand	Anodyne	P2RX7	15	45
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875016942	GG	On-Demand	Anodyne	P2RX7	15	45
NC(=O)c1cc(-c2ccccc2)sc1NC(=O)c1ccn(C2CCOCC2)n1	ZINC000875016945	GG	On-Demand	Anodyne	CHEK1	28	47
CC(=O)Nc1nc(COC(=O)[C@H](CCS(C)(=O)=O)NC(=O)c2ccc(Cl)cc2)cs1	ZINC000875016946	JE	On-Demand	Anodyne	UTS2	42	32
CC(=O)Nc1nc(COC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)c2ccc(Cl)cc2)cs1	ZINC000875016947	JE	On-Demand	Anodyne	UTS2	42	32
C[C@H]1CCCCN1CCCNC(=O)NCc1cccc2ncccc12	ZINC000875016955	EG	On-Demand	Anodyne	HRH3	40	41
C[C@H]1CCCCN1CCCNC(=O)NCc1cccc2ncccc12	ZINC000875016955	EG	On-Demand	Anodyne	HNMT	46	36
C[C@@H]1CCCCN1CCCNC(=O)NCc1cccc2ncccc12	ZINC000875016956	EG	On-Demand	Anodyne	HRH3	40	41
C[C@@H]1CCCCN1CCCNC(=O)NCc1cccc2ncccc12	ZINC000875016956	EG	On-Demand	Anodyne	HNMT	46	36
CC[C@@H](NC(C)=O)C(=O)Oc1ccc(OC)cc1C(C)(C)C	ZINC000875016958	DF	On-Demand	Anodyne	MTNR1A	58	39
CC[C@@H](NC(C)=O)C(=O)Oc1ccc(OC)cc1C(C)(C)C	ZINC000875016958	DF	On-Demand	Anodyne	MTNR1B	54	39
CCc1ccc(Cl)c(CC)c1NC(=O)c1ncc(OC)cc1F	ZINC000875016967	EI	On-Demand	Anodyne	F10	40	30
CN(CCNC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875017017	EC	On-Demand	Anodyne	NPY2R	27	40
CN(CCNC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875017018	EC	On-Demand	Anodyne	NPY2R	27	40
O=C(NCCSc1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875017019	EH	On-Demand	Anodyne	EPHX2	26	41
O=C(NCCSc1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875017020	EH	On-Demand	Anodyne	EPHX2	26	41
C[C@@H]1CCCCN1CCCNC(=O)N[C@H]1Cc2ccc(C#N)cc2C1	ZINC000875017023	EF	On-Demand	Mild	HRH3	35	42
C[C@@H]1CCCCN1CCCNC(=O)N[C@@H]1Cc2ccc(C#N)cc2C1	ZINC000875017024	EF	On-Demand	Mild	HRH3	35	42
C[C@H]1CCCCN1CCCNC(=O)N[C@@H]1Cc2ccc(C#N)cc2C1	ZINC000875017025	EF	On-Demand	Mild	HRH3	35	42
C[C@H]1CCCCN1CCCNC(=O)N[C@H]1Cc2ccc(C#N)cc2C1	ZINC000875017026	EF	On-Demand	Mild	HRH3	35	42
CCn1c(CNC(=O)N2CCC[C@@H](CCC(=O)OC)C2)nc2ccccc21	ZINC000875017063	FF	On-Demand	Anodyne	PDE6D	54	33
CCn1c(CNC(=O)N2CCC[C@H](CCC(=O)OC)C2)nc2ccccc21	ZINC000875017065	FF	On-Demand	Anodyne	PDE6D	54	33
CCn1c(CNC(=O)N2CC[C@]3(C(=O)OC)CCC[C@H]23)nc2ccccc21	ZINC000875017067	FF	On-Demand	Anodyne	PDE6D	67	34
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)[C@H]1CC1(Cl)Cl	ZINC000875017070	GJ	On-Demand	Anodyne	SCD1	37	42
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)[C@H]1CC1(Cl)Cl	ZINC000875017070	GJ	On-Demand	Anodyne	SCD	34	44
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)[C@@H]1CC1(Cl)Cl	ZINC000875017072	GJ	On-Demand	Anodyne	SCD1	37	42
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)[C@@H]1CC1(Cl)Cl	ZINC000875017072	GJ	On-Demand	Anodyne	SCD	34	44
CCOC1CC2(C1)C[C@H]2C(=O)Nc1sc(-c2ccccc2)cc1C(N)=O	ZINC000875017087	FH	On-Demand	Anodyne	TIMP3	56	32
CCOC1CC2(C1)C[C@H]2C(=O)Nc1sc(-c2ccccc2)cc1C(N)=O	ZINC000875017087	FH	On-Demand	Anodyne	CHEK1	20	45
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)c1	ZINC000875017090	JI	On-Demand	Anodyne	SCD1	40	44
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)c1	ZINC000875017090	JI	On-Demand	Anodyne	SCD	37	44
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)c1	ZINC000875017090	JI	On-Demand	Anodyne	TRPM8	45	36
CCO[C@@H](C(=O)Nc1sc(-c2ccccc2)cc1C(N)=O)C1CCOCC1	ZINC000875017091	GG	On-Demand	Anodyne	CHEK1	21	44
CONC(=O)C1CCN(C(=O)NCc2nc3ccccc3n2C)CC1	ZINC000875017098	ED	On-Demand	Anodyne	PDE6D	61	37
CONC(=O)C1CCN(C(=O)NCc2nc3ccccc3n2C)CC1	ZINC000875017098	ED	On-Demand	Anodyne	SMO	39	43
Cc1nc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)cs1	ZINC000875017105	FD	On-Demand	Anodyne	SIRT3	50	32
Cc1nc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)cs1	ZINC000875017105	FD	On-Demand	Anodyne	SIRT2	51	33
Cc1nc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)cs1	ZINC000875017105	FD	On-Demand	Anodyne	SIRT1	50	32
C[C@H]1CN(C(=O)Nc2ccccc2SCC(N)=O)CC[C@@H](C(F)(F)F)O1	ZINC000875017118	GF	On-Demand	Anodyne	RBP4	51	36
C[C@H]1CN(C(=O)Nc2ccccc2SCC(N)=O)CC[C@H](C(F)(F)F)O1	ZINC000875017120	GF	On-Demand	Anodyne	RBP4	51	36
C[C@@H]1CN(C(=O)Nc2ccccc2SCC(N)=O)CC[C@@H](C(F)(F)F)O1	ZINC000875017123	GF	On-Demand	Anodyne	RBP4	51	36
C[C@@H]1CN(C(=O)Nc2ccccc2SCC(N)=O)CC[C@H](C(F)(F)F)O1	ZINC000875017124	GF	On-Demand	Anodyne	RBP4	51	36
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875017132	GH	On-Demand	Anodyne	ACE	19	44
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875017132	GH	On-Demand	Anodyne	SSTR2	26	44
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875017132	GH	On-Demand	Anodyne	GHRHR	28	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875017132	GH	On-Demand	Anodyne	MME	26	45
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875017132	GH	On-Demand	Anodyne	EDNRB	53	36
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875017132	GH	On-Demand	Anodyne	EDNRA	29	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875017132	GH	On-Demand	Anodyne	TACR1	35	58
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875017132	GH	On-Demand	Anodyne	CCKAR	117	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875017132	GH	On-Demand	Anodyne	CTSL	23	45
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875017132	GH	On-Demand	Anodyne	BRS3	27	44
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875017132	GH	On-Demand	Anodyne	NMBR	43	44
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875017132	GH	On-Demand	Anodyne	MC3R	57	35
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875017132	GH	On-Demand	Anodyne	MC5R	55	35
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875017132	GH	On-Demand	Anodyne	MMP2	27	46
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875017132	GH	On-Demand	Anodyne	GRPR	65	33
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875017132	GH	On-Demand	Anodyne	ECE1	63	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875017132	GH	On-Demand	Anodyne	SSTR3	21	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875017132	GH	On-Demand	Anodyne	MMP11	85	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875017132	GH	On-Demand	Anodyne	CCKBR	79	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875017132	GH	On-Demand	Anodyne	GHSR	65	46
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875017132	GH	On-Demand	Anodyne	MMP9	25	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875017132	GH	On-Demand	Anodyne	MC1R	81	39
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875017132	GH	On-Demand	Anodyne	MMP1	20	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875017132	GH	On-Demand	Anodyne	NPR	28	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875017132	GH	On-Demand	Anodyne	KISS1R	74	35
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875017132	GH	On-Demand	Anodyne	ERAP2	44	39
COCCN(CC1CCN(C)CC1)C(=O)NCc1nc2ccccc2n1C	ZINC000875017154	FE	On-Demand	Anodyne	GRM2	15	41
O=CN1CCCN(C(=O)NCc2ccc(CN3CCOCC3)cc2)CC1	ZINC000875017155	FC	On-Demand	Anodyne	DPOL_VZVD	23	40
CCn1c(CNC(=O)NC[C@@H]2CCO[C@@H]2C(=O)OC)nc2ccccc21	ZINC000875017157	FD	On-Demand	Anodyne	PDE6D	46	34
CCCCCCCNC(=O)C(=O)NCc1csc(C)n1	ZINC000875017169	CE	On-Demand	Mild	ASAH1	86	37
O=C1CCN(C(=O)C(=O)NCCCCc2ccccc2)CCCCCCN1	ZINC000875017173	FE	On-Demand	Anodyne	FKBP1A	24	42
O=C1CCN(C(=O)C(=O)NCCCCc2ccccc2)CCCCCCN1	ZINC000875017173	FE	On-Demand	Anodyne	PREP	28	40
O=C1CCN(C(=O)C(=O)NCCCCc2ccccc2)CCCCCCN1	ZINC000875017173	FE	On-Demand	Anodyne	DPP7	31	42
O=C1CCN(C(=O)C(=O)NCCCCc2ccccc2)CCCCCCN1	ZINC000875017173	FE	On-Demand	Anodyne	AMP1_PLAFQ	15	42
CCn1c(CNC(=O)N2CCC3(CCN(C)CC3)CC2)nc2ccccc21	ZINC000875017174	FG	On-Demand	Anodyne	HRH1	22	42
NC(=O)CSc1ccccc1NC(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875017177	EF	On-Demand	Anodyne	RBP4	60	36
COc1ccc(OC)c([C@H](C)NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875017208	FD	On-Demand	Anodyne	BIRC2	28	40
NC(=O)CSc1ccccc1NC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875017241	GE	On-Demand	Anodyne	RBP4	42	41
NC(=O)CSc1ccccc1NC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875017242	GE	On-Demand	Anodyne	RBP4	42	41
O=C(NCCCCc1ccccc1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875017243	EF	On-Demand	Anodyne	FKBP1A	21	42
O=C(NCCCCc1ccccc1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875017243	EF	On-Demand	Anodyne	FAAH	24	44
O=C(NCCCCc1ccccc1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875017243	EF	On-Demand	Anodyne	AMP1_PLAFQ	22	48
O=C(NCCCCc1ccccc1)C(=O)NCC[C@H]1CCSC1	ZINC000875017246	EE	On-Demand	Anodyne	FAAH	16	41
O=C(NCCCCc1ccccc1)C(=O)NCC[C@H]1CCSC1	ZINC000875017246	EE	On-Demand	Anodyne	AMP1_PLAFQ	22	44
O=C(NCCCCc1ccccc1)C(=O)NCC[C@@H]1CCSC1	ZINC000875017247	EE	On-Demand	Anodyne	FAAH	16	41
O=C(NCCCCc1ccccc1)C(=O)NCC[C@@H]1CCSC1	ZINC000875017247	EE	On-Demand	Anodyne	AMP1_PLAFQ	22	44
CCOC(=O)N1CCC(C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)CC1	ZINC000875017249	IJ	On-Demand	Anodyne	SCD1	36	41
CCOC(=O)N1CCC(C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)CC1	ZINC000875017249	IJ	On-Demand	Anodyne	SCD	36	42
O=C(NCCCCc1ccccc1)C(=O)NCc1ccc(Br)cn1	ZINC000875017250	GF	On-Demand	Anodyne	FAAH	62	39
O=C(NCCCCc1ccccc1)C(=O)NCc1ccc(Br)cn1	ZINC000875017250	GF	On-Demand	Anodyne	CES1	63	39
O=C(NCCCCc1ccccc1)C(=O)NCc1ccc(Br)cn1	ZINC000875017250	GF	On-Demand	Anodyne	AMP1_PLAFQ	40	50
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCc1nc3ccccc3n1C)CC2	ZINC000875017258	GF	On-Demand	Anodyne	MCHR1	15	41
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCc1nc3ccccc3n1C)CC2	ZINC000875017258	GF	On-Demand	Anodyne	P2RY14	42	32
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCc1nc3ccccc3n1C)CC2	ZINC000875017258	GF	On-Demand	Anodyne	NOD1	22	41
CCOC1CC2(C1)C[C@H]2C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000875017263	DG	On-Demand	Mild	PFKFB3	41	32
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N1CCN([S@@](C)(=N)=O)CC1	ZINC000875017275	GD	On-Demand	Anodyne	P2RX7	15	50
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N1CCN([S@](C)(=N)=O)CC1	ZINC000875017276	GD	On-Demand	Anodyne	P2RX7	15	50
Cc1cncc([C@@H]2CCCN2C(=O)NCc2nc3ccccc3n2C)c1	ZINC000875017281	EG	On-Demand	Anodyne	HCRTR2	17	42
Cc1cncc([C@H]2CCCN2C(=O)NCc2nc3ccccc3n2C)c1	ZINC000875017282	EG	On-Demand	Anodyne	HCRTR2	17	42
Cn1ccnc1[C@@H]1OCCC[C@H]1CNC(=O)NCc1nc2ccccc2n1C	ZINC000875017289	GE	On-Demand	Anodyne	SMO	33	41
COC(=O)CC[C@@H]1CC[C@H](C(=O)Nc2ccc(C#N)c(Cl)c2)O1	ZINC000875017299	EF	On-Demand	Mild	PFKFB3	47	33
CCn1c(CNC(=O)N2CC(Cc3cccs3)C2)nc2ccccc21	ZINC000875017307	FH	On-Demand	Anodyne	PYGM	23	47
CCn1c(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)nc2ccccc21	ZINC000875017324	GG	On-Demand	Anodyne	TRY1_BOVIN	41	33
CCn1c(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)nc2ccccc21	ZINC000875017324	GG	On-Demand	Anodyne	PDE6D	56	36
CCn1c(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)nc2ccccc21	ZINC000875017325	GG	On-Demand	Anodyne	TRY1_BOVIN	41	33
CCn1c(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)nc2ccccc21	ZINC000875017325	GG	On-Demand	Anodyne	PDE6D	56	36
CCn1c(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)nc2ccccc21	ZINC000875017326	GG	On-Demand	Anodyne	TRY1_BOVIN	41	33
CCn1c(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)nc2ccccc21	ZINC000875017326	GG	On-Demand	Anodyne	PDE6D	56	36
CCn1c(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)nc2ccccc21	ZINC000875017327	GG	On-Demand	Anodyne	TRY1_BOVIN	41	33
CCn1c(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)nc2ccccc21	ZINC000875017327	GG	On-Demand	Anodyne	PDE6D	56	36
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1CN1CCOCC1	ZINC000875017352	GD	On-Demand	Anodyne	SLC6A3	41	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1CN1CCOCC1	ZINC000875017353	GD	On-Demand	Anodyne	SLC6A3	41	39
CCn1c(CNC(=O)N[C@H]2CCC[C@@H]2O)nc2ccccc21	ZINC000875017354	DD	On-Demand	Anodyne	PDE6D	42	33
COC(=O)C1(O)CN(C(=O)NCc2c(C)nn(-c3ccccc3)c2C)C1	ZINC000875017371	FC	On-Demand	Anodyne	P2RX7	18	51
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N1CC[C@@H]2[C@@H](CCN2C)C1	ZINC000875017372	FF	On-Demand	Anodyne	P2RX7	19	50
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N1CC[C@H]2[C@@H](CCN2C)C1	ZINC000875017373	FF	On-Demand	Anodyne	P2RX7	19	50
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N1CC[C@H]2[C@H](CCN2C)C1	ZINC000875017374	FF	On-Demand	Anodyne	P2RX7	19	50
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N1CC[C@@H]2[C@H](CCN2C)C1	ZINC000875017375	FF	On-Demand	Anodyne	P2RX7	19	50
CCC1(CC)CCCN1C(=O)Nc1ccccc1SCC(N)=O	ZINC000875017380	EG	On-Demand	Anodyne	KCNQ2	45	33
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N1CCN(C)c2ncccc2C1	ZINC000875017383	GG	On-Demand	Anodyne	P2RX7	15	46
CC(=O)C1CCN(C(=O)C(=O)NCCCCc2ccccc2)CC1	ZINC000875017397	ED	On-Demand	Anodyne	ACE	22	40
CC(=O)C1CCN(C(=O)C(=O)NCCCCc2ccccc2)CC1	ZINC000875017397	ED	On-Demand	Anodyne	FKBP1A	48	47
CC(=O)C1CCN(C(=O)C(=O)NCCCCc2ccccc2)CC1	ZINC000875017397	ED	On-Demand	Anodyne	SIGMAR1	34	40
CC(=O)C1CCN(C(=O)C(=O)NCCCCc2ccccc2)CC1	ZINC000875017397	ED	On-Demand	Anodyne	SCN2A	20	41
CC(=O)C1CCN(C(=O)C(=O)NCCCCc2ccccc2)CC1	ZINC000875017397	ED	On-Demand	Anodyne	PREP	49	40
CC(=O)C1CCN(C(=O)C(=O)NCCCCc2ccccc2)CC1	ZINC000875017397	ED	On-Demand	Anodyne	FAAH	25	43
CC(=O)C1CCN(C(=O)C(=O)NCCCCc2ccccc2)CC1	ZINC000875017397	ED	On-Demand	Anodyne	AMP1_PLAFQ	30	46
CC(=O)C1CCN(C(=O)C(=O)NCCCCc2ccccc2)CC1	ZINC000875017397	ED	On-Demand	Anodyne	CACNA1G	16	40
O=C(NCCCCc1ccccc1)C(=O)NCc1ncc(Cl)s1	ZINC000875017398	FF	On-Demand	Anodyne	SCNN1A	68	40
O=C(NCCCCc1ccccc1)C(=O)NCc1ncc(Cl)s1	ZINC000875017398	FF	On-Demand	Anodyne	FAAH	59	39
O=C(NCCCCc1ccccc1)C(=O)NCc1ncc(Cl)s1	ZINC000875017398	FF	On-Demand	Anodyne	CES1	60	35
O=C(NCCCCc1ccccc1)C(=O)NCc1ncc(Cl)s1	ZINC000875017398	FF	On-Demand	Anodyne	AMP1_PLAFQ	26	44
CC[C@@H](NC(=O)NCc1cc(OC)c(OC)c(OC)c1)[C@@H](O)c1ccccc1	ZINC000875017418	GG	On-Demand	Anodyne	TACR3	42	38
CC[C@@H](NC(=O)NCc1cc(OC)c(OC)c(OC)c1)[C@@H](O)c1ccccc1	ZINC000875017418	GG	On-Demand	Anodyne	PDS	46	35
CC[C@@H](NC(=O)NCc1cc(OC)c(OC)c(OC)c1)[C@H](O)c1ccccc1	ZINC000875017421	GG	On-Demand	Anodyne	TACR3	42	38
CC[C@@H](NC(=O)NCc1cc(OC)c(OC)c(OC)c1)[C@H](O)c1ccccc1	ZINC000875017421	GG	On-Demand	Anodyne	PDS	46	35
Cn1nccc1C(NC(=O)C(=O)NCCCCc1ccccc1)c1ccnn1C	ZINC000875017431	GD	On-Demand	Anodyne	MTNR1A	25	41
Cn1nccc1C(NC(=O)C(=O)NCCCCc1ccccc1)c1ccnn1C	ZINC000875017431	GD	On-Demand	Anodyne	MTNR1B	27	41
Cn1nccc1C(NC(=O)C(=O)NCCCCc1ccccc1)c1ccnn1C	ZINC000875017431	GD	On-Demand	Anodyne	FAAH	69	37
Cn1nccc1C(NC(=O)C(=O)NCCCCc1ccccc1)c1ccnn1C	ZINC000875017431	GD	On-Demand	Anodyne	CES1	66	34
Cn1nccc1C(NC(=O)C(=O)NCCCCc1ccccc1)c1ccnn1C	ZINC000875017431	GD	On-Demand	Anodyne	AMP1_PLAFQ	26	47
Cn1nccc1C(NC(=O)C(=O)NCCCCc1ccccc1)c1ccnn1C	ZINC000875017431	GD	On-Demand	Anodyne	CES1D	55	34
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NCCCCc2ccccc2)CC1	ZINC000875017432	FC	On-Demand	Anodyne	FKBP1A	23	44
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NCCCCc2ccccc2)CC1	ZINC000875017432	FC	On-Demand	Anodyne	SIGMAR1	15	40
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NCCCCc2ccccc2)CC1	ZINC000875017432	FC	On-Demand	Anodyne	FAAH	16	43
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NCCCCc2ccccc2)CC1	ZINC000875017432	FC	On-Demand	Anodyne	AMP1_PLAFQ	22	45
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccccc3OC(F)(F)F)CC[C@@H]21	ZINC000875017451	GD	On-Demand	Anodyne	EPHX2	19	43
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccccc3OC(F)(F)F)CC[C@H]21	ZINC000875017453	GD	On-Demand	Anodyne	EPHX2	19	43
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cc(OC)c(OC)c(OC)c2)C1	ZINC000875017458	GE	On-Demand	Anodyne	PTAFR	15	40
CN(C)C[C@@H]1CN(C(=O)C(=O)NCCCCc2ccccc2)C[C@H]1CN(C)C	ZINC000875017460	GD	On-Demand	Anodyne	FKBP1A	21	40
CN(C)C[C@@H]1CN(C(=O)C(=O)NCCCCc2ccccc2)C[C@H]1CN(C)C	ZINC000875017460	GD	On-Demand	Anodyne	FAAH	19	42
CN(C)C[C@@H]1CN(C(=O)C(=O)NCCCCc2ccccc2)C[C@H]1CN(C)C	ZINC000875017460	GD	On-Demand	Anodyne	AMP1_PLAFQ	26	45
CN1CC[C@H]2CN(C(=O)C(=O)NCCCCc3ccccc3)CC[C@@H]21	ZINC000875017463	ED	On-Demand	Anodyne	FKBP1A	29	43
CN1CC[C@H]2CN(C(=O)C(=O)NCCCCc3ccccc3)CC[C@@H]21	ZINC000875017463	ED	On-Demand	Anodyne	CYSLTR2	48	32
CN1CC[C@H]2CN(C(=O)C(=O)NCCCCc3ccccc3)CC[C@@H]21	ZINC000875017463	ED	On-Demand	Anodyne	AMP1_PLAFQ	28	42
CN1CC[C@H]2CN(C(=O)C(=O)NCCCCc3ccccc3)CC[C@H]21	ZINC000875017464	ED	On-Demand	Anodyne	FKBP1A	29	43
CN1CC[C@H]2CN(C(=O)C(=O)NCCCCc3ccccc3)CC[C@H]21	ZINC000875017464	ED	On-Demand	Anodyne	CYSLTR2	48	32
CN1CC[C@H]2CN(C(=O)C(=O)NCCCCc3ccccc3)CC[C@H]21	ZINC000875017464	ED	On-Demand	Anodyne	AMP1_PLAFQ	28	42
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N1CCCCCCNC(=O)CC1	ZINC000875017505	GG	On-Demand	Anodyne	P2RX7	17	50
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875017519	GE	On-Demand	Anodyne	P2RX7	15	48
NC(=O)Cc1cccc2c1CCN(C(=O)C(=O)NCCCCc1ccccc1)C2	ZINC000875017522	GD	On-Demand	Anodyne	SLC6A5	23	41
NC(=O)Cc1cccc2c1CCN(C(=O)C(=O)NCCCCc1ccccc1)C2	ZINC000875017522	GD	On-Demand	Anodyne	AMP1_PLAFQ	21	40
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875017532	GI	On-Demand	Anodyne	EPHX2	22	40
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875017533	GI	On-Demand	Anodyne	EPHX2	22	40
Cc1nc(CNC(=O)C(=O)NCCCCCCc2ccccc2)cs1	ZINC000875017545	FF	On-Demand	Anodyne	SCNN1A	40	39
Cc1nc(CNC(=O)C(=O)NCCCCCCc2ccccc2)cs1	ZINC000875017545	FF	On-Demand	Anodyne	FAAH	72	42
Cc1nc(CNC(=O)C(=O)NCCCCCCc2ccccc2)cs1	ZINC000875017545	FF	On-Demand	Anodyne	CES1	70	40
Cc1nc(CNC(=O)C(=O)NCCCCCCc2ccccc2)cs1	ZINC000875017545	FF	On-Demand	Anodyne	AMP1_PLAFQ	28	45
Cc1nc(CNC(=O)C(=O)NCCCCCCc2ccccc2)cs1	ZINC000875017545	FF	On-Demand	Anodyne	CES1D	44	33
NC(=O)CSc1ccccc1NC(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875017549	FE	On-Demand	Anodyne	RBP4	45	33
NC(=O)CSc1ccccc1NC(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875017550	FE	On-Demand	Anodyne	RBP4	45	33
NC(=O)CSc1ccccc1NC(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875017551	FE	On-Demand	Anodyne	RBP4	45	33
NC(=O)CSc1ccccc1NC(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875017552	FE	On-Demand	Anodyne	RBP4	45	33
C#CC[C@@H](COC)NC(=O)C(=O)NCCCCc1ccccc1	ZINC000875017562	DD	On-Demand	Mild	SCN2A	16	40
C#CC[C@@H](COC)NC(=O)C(=O)NCCCCc1ccccc1	ZINC000875017562	DD	On-Demand	Mild	AMP1_PLAFQ	24	45
C#CC[C@H](COC)NC(=O)C(=O)NCCCCc1ccccc1	ZINC000875017563	DD	On-Demand	Mild	SCN2A	16	40
C#CC[C@H](COC)NC(=O)C(=O)NCCCCc1ccccc1	ZINC000875017563	DD	On-Demand	Mild	AMP1_PLAFQ	24	45
COc1ccc(OC)c([C@H](C)NC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875017565	DD	On-Demand	Anodyne	MTNR1A	42	37
O=C(NCCCCc1ccccc1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875017570	EE	On-Demand	Anodyne	FKBP1A	25	42
O=C(NCCCCc1ccccc1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875017570	EE	On-Demand	Anodyne	AMP1_PLAFQ	20	43
O=C(NCCCCc1ccccc1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875017571	EE	On-Demand	Anodyne	FKBP1A	25	42
O=C(NCCCCc1ccccc1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875017571	EE	On-Demand	Anodyne	AMP1_PLAFQ	20	43
O=C(NCCCCc1ccccc1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875017572	EE	On-Demand	Anodyne	FKBP1A	25	42
O=C(NCCCCc1ccccc1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875017572	EE	On-Demand	Anodyne	AMP1_PLAFQ	20	43
O=C(NCCCCc1ccccc1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875017573	EE	On-Demand	Anodyne	FKBP1A	25	42
O=C(NCCCCc1ccccc1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875017573	EE	On-Demand	Anodyne	AMP1_PLAFQ	20	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cc(OC)ccc1OC	ZINC000875017580	FF	On-Demand	Anodyne	SLC6A4	19	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cc(OC)ccc1OC	ZINC000875017580	FF	On-Demand	Anodyne	SLC6A3	37	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cc(OC)ccc1OC	ZINC000875017581	FF	On-Demand	Anodyne	SLC6A4	19	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cc(OC)ccc1OC	ZINC000875017581	FF	On-Demand	Anodyne	SLC6A3	37	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cc(OC)ccc1OC	ZINC000875017582	FF	On-Demand	Anodyne	SLC6A4	19	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cc(OC)ccc1OC	ZINC000875017582	FF	On-Demand	Anodyne	SLC6A3	37	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cc(OC)ccc1OC	ZINC000875017583	FF	On-Demand	Anodyne	SLC6A4	19	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cc(OC)ccc1OC	ZINC000875017583	FF	On-Demand	Anodyne	SLC6A3	37	41
CN1CC[C@H]2CN(C(=O)Nc3ccccc3SCC(N)=O)CC[C@H]21	ZINC000875017597	ED	On-Demand	Anodyne	RBP4	50	32
CN1CC[C@H]2CN(C(=O)Nc3ccccc3SCC(N)=O)CC[C@@H]21	ZINC000875017598	ED	On-Demand	Anodyne	RBP4	50	32
CC(=O)C1CCN(C(=O)Nc2ccccc2SCC(N)=O)CC1	ZINC000875017612	EE	On-Demand	Anodyne	KCNQ2	44	32
CN1CCN(C2CCN(C(=O)C(=O)NCCCCc3ccccc3)CC2)CC1	ZINC000875017617	GD	On-Demand	Anodyne	FKBP1A	27	42
CN1CCN(C2CCN(C(=O)C(=O)NCCCCc3ccccc3)CC2)CC1	ZINC000875017617	GD	On-Demand	Anodyne	SIGMAR1	32	46
CN1CCN(C2CCN(C(=O)C(=O)NCCCCc3ccccc3)CC2)CC1	ZINC000875017617	GD	On-Demand	Anodyne	PREP	40	38
CN1CCN(C2CCN(C(=O)C(=O)NCCCCc3ccccc3)CC2)CC1	ZINC000875017617	GD	On-Demand	Anodyne	FAAH	16	47
CN1CCN(C2CCN(C(=O)C(=O)NCCCCc3ccccc3)CC2)CC1	ZINC000875017617	GD	On-Demand	Anodyne	AMP1_PLAFQ	31	43
CN1CCN(C2CCN(C(=O)C(=O)NCCCCc3ccccc3)CC2)CC1	ZINC000875017617	GD	On-Demand	Anodyne	L3MBTL3	82	40
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N1CCC(CO)(CO)CC1	ZINC000875017619	FD	On-Demand	Anodyne	P2RX7	18	53
O=C(NCCCCc1ccccc1)C(=O)NCc1ncc(Br)s1	ZINC000875017621	GF	On-Demand	Anodyne	FAAH	60	39
O=C(NCCCCc1ccccc1)C(=O)NCc1ncc(Br)s1	ZINC000875017621	GF	On-Demand	Anodyne	CES1	60	39
O=C(NCCCCc1ccccc1)C(=O)NCc1ncc(Br)s1	ZINC000875017621	GF	On-Demand	Anodyne	AMP1_PLAFQ	28	46
CONC(=O)C1CCN(C(=O)NCc2c(C)nn(-c3ccccc3)c2C)CC1	ZINC000875017622	GE	On-Demand	Anodyne	P2RX7	15	49
NC(=O)CSc1ccccc1NC(=O)N[C@@H]1CCCC[C@@H]1F	ZINC000875017651	EF	On-Demand	Anodyne	CCR3	26	41
O=C(NCCCCc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875017655	FG	On-Demand	Anodyne	ACE	26	40
O=C(NCCCCc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875017655	FG	On-Demand	Anodyne	FKBP1A	39	44
O=C(NCCCCc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875017655	FG	On-Demand	Anodyne	PREP	67	43
O=C(NCCCCc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875017655	FG	On-Demand	Anodyne	FAAH	21	42
O=C(NCCCCc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875017655	FG	On-Demand	Anodyne	AMP1_PLAFQ	23	43
O=C(NCCCCc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875017656	FG	On-Demand	Anodyne	ACE	26	40
O=C(NCCCCc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875017656	FG	On-Demand	Anodyne	FKBP1A	39	44
O=C(NCCCCc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875017656	FG	On-Demand	Anodyne	PREP	67	43
O=C(NCCCCc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875017656	FG	On-Demand	Anodyne	FAAH	21	42
O=C(NCCCCc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875017656	FG	On-Demand	Anodyne	AMP1_PLAFQ	23	43
O=C(NCCCCc1ccccc1)C(=O)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875017660	FE	On-Demand	Anodyne	AMP1_PLAFQ	21	43
O=C(NCCCCc1ccccc1)C(=O)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875017661	FE	On-Demand	Anodyne	AMP1_PLAFQ	21	43
O=C(NCCCCc1ccccc1)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875017662	FE	On-Demand	Anodyne	AMP1_PLAFQ	21	43
O=C(NCCCCc1ccccc1)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875017663	FE	On-Demand	Anodyne	AMP1_PLAFQ	21	43
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875017667	GD	On-Demand	Anodyne	P2RX7	16	49
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875017667	GD	On-Demand	Anodyne	EPHX2	20	40
COc1ccc(OC)c([C@H](C)NC(=O)N2CC(CNC(=O)C(F)(F)F)C2)c1	ZINC000875017671	GE	On-Demand	Anodyne	NQO2	15	45
CC(=O)C1CCN(C(=O)C(=O)NCc2ccccc2OC(F)(F)F)CC1	ZINC000875017700	FE	On-Demand	Anodyne	EPHX2	27	55
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875017701	GG	On-Demand	Anodyne	P2RX7	15	48
NC(=O)CSc1ccccc1NC(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875017716	GG	On-Demand	Anodyne	NPY5R	33	43
NC(=O)CSc1ccccc1NC(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875017717	GG	On-Demand	Anodyne	NPY5R	33	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCc2ccccc2)C1	ZINC000875017718	ED	On-Demand	Anodyne	ACE	39	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCc2ccccc2)C1	ZINC000875017718	ED	On-Demand	Anodyne	FKBP1A	60	47
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCc2ccccc2)C1	ZINC000875017718	ED	On-Demand	Anodyne	SLC6A1	45	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCc2ccccc2)C1	ZINC000875017718	ED	On-Demand	Anodyne	SIGMAR1	24	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCc2ccccc2)C1	ZINC000875017718	ED	On-Demand	Anodyne	NPFFR2	45	31
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCc2ccccc2)C1	ZINC000875017718	ED	On-Demand	Anodyne	PREP	73	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCc2ccccc2)C1	ZINC000875017718	ED	On-Demand	Anodyne	MMP3	20	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCc2ccccc2)C1	ZINC000875017718	ED	On-Demand	Anodyne	FAAH	16	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCc2ccccc2)C1	ZINC000875017718	ED	On-Demand	Anodyne	TGM2	25	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCc2ccccc2)C1	ZINC000875017718	ED	On-Demand	Anodyne	DPP7	50	45
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCc2ccccc2)C1	ZINC000875017718	ED	On-Demand	Anodyne	AMP1_PLAFQ	25	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCc2ccccc2)C1	ZINC000875017719	ED	On-Demand	Anodyne	ACE	39	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCc2ccccc2)C1	ZINC000875017719	ED	On-Demand	Anodyne	FKBP1A	60	47
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCc2ccccc2)C1	ZINC000875017719	ED	On-Demand	Anodyne	SLC6A1	45	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCc2ccccc2)C1	ZINC000875017719	ED	On-Demand	Anodyne	SIGMAR1	24	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCc2ccccc2)C1	ZINC000875017719	ED	On-Demand	Anodyne	NPFFR2	45	31
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCc2ccccc2)C1	ZINC000875017719	ED	On-Demand	Anodyne	PREP	73	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCc2ccccc2)C1	ZINC000875017719	ED	On-Demand	Anodyne	MMP3	20	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCc2ccccc2)C1	ZINC000875017719	ED	On-Demand	Anodyne	FAAH	16	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCc2ccccc2)C1	ZINC000875017719	ED	On-Demand	Anodyne	TGM2	25	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCc2ccccc2)C1	ZINC000875017719	ED	On-Demand	Anodyne	DPP7	50	45
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCc2ccccc2)C1	ZINC000875017719	ED	On-Demand	Anodyne	AMP1_PLAFQ	25	43
CCOc1ccc(C(=O)N2CCC(NC(=O)C(=O)N[C@@H]3CC34CCC4)CC2)cc1	ZINC000875017740	GD	On-Demand	Anodyne	EPHX2	34	44
CCOc1ccc(C(=O)N2CCC(NC(=O)C(=O)N[C@@H]3CC34CCC4)CC2)cc1	ZINC000875017740	GD	On-Demand	Anodyne	L3MBTL3	61	35
CCOc1ccc(C(=O)N2CCC(NC(=O)C(=O)N[C@H]3CC34CCC4)CC2)cc1	ZINC000875017741	GD	On-Demand	Anodyne	EPHX2	34	44
CCOc1ccc(C(=O)N2CCC(NC(=O)C(=O)N[C@H]3CC34CCC4)CC2)cc1	ZINC000875017741	GD	On-Demand	Anodyne	L3MBTL3	61	35
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875017744	EE	On-Demand	Anodyne	P2RX7	20	53
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N(C)OCC(F)(F)F	ZINC000875017747	FG	On-Demand	Anodyne	P2RX7	22	51
NC(=O)CSc1ccccc1NC(=O)NCCCCC1CC1	ZINC000875017754	DF	On-Demand	Anodyne	CCR3	29	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(OC)c(OC)c(OC)c1	ZINC000875017762	GD	On-Demand	Anodyne	SLC6A3	41	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(OC)c(OC)c(OC)c1	ZINC000875017763	GD	On-Demand	Anodyne	SLC6A3	41	39
C[C@H](NC(=O)C(=O)NCCCCc1ccccc1)c1ccnn1C	ZINC000875017767	ED	On-Demand	Anodyne	HRH2	17	41
C[C@H](NC(=O)C(=O)NCCCCc1ccccc1)c1ccnn1C	ZINC000875017767	ED	On-Demand	Anodyne	SCNN1A	52	38
C[C@H](NC(=O)C(=O)NCCCCc1ccccc1)c1ccnn1C	ZINC000875017767	ED	On-Demand	Anodyne	SCN2A	18	42
C[C@H](NC(=O)C(=O)NCCCCc1ccccc1)c1ccnn1C	ZINC000875017767	ED	On-Demand	Anodyne	MTNR1A	22	43
C[C@H](NC(=O)C(=O)NCCCCc1ccccc1)c1ccnn1C	ZINC000875017767	ED	On-Demand	Anodyne	MTNR1B	24	43
C[C@H](NC(=O)C(=O)NCCCCc1ccccc1)c1ccnn1C	ZINC000875017767	ED	On-Demand	Anodyne	FAAH	68	40
C[C@H](NC(=O)C(=O)NCCCCc1ccccc1)c1ccnn1C	ZINC000875017767	ED	On-Demand	Anodyne	CES1	65	34
C[C@H](NC(=O)C(=O)NCCCCc1ccccc1)c1ccnn1C	ZINC000875017767	ED	On-Demand	Anodyne	CAPN2	52	38
C[C@H](NC(=O)C(=O)NCCCCc1ccccc1)c1ccnn1C	ZINC000875017767	ED	On-Demand	Anodyne	AMP1_PLAFQ	26	46
C[C@H](NC(=O)C(=O)NCCCCc1ccccc1)c1ccnn1C	ZINC000875017767	ED	On-Demand	Anodyne	DAGLA	19	40
C[C@H](NC(=O)C(=O)NCCCCc1ccccc1)c1ccnn1C	ZINC000875017767	ED	On-Demand	Anodyne	NPFFR1	48	31
C[C@H](NC(=O)C(=O)NCCCCc1ccccc1)c1ccnn1C	ZINC000875017767	ED	On-Demand	Anodyne	CES1D	46	34
O=C(NCCc1ccc2c(c1)OCO2)N1Cc2cccc(O)c2C1	ZINC000875017778	EE	On-Demand	Clean	BMP1	51	35
O=C(NCCc1ccc2c(c1)OCO2)N1Cc2cccc(O)c2C1	ZINC000875017778	EE	On-Demand	Clean	NOS2	82	40
CCOc1ccc([C@H](C)NC(=O)C(=O)NCC2(OC(C)C)CCC2)cc1	ZINC000875017782	FF	On-Demand	Anodyne	ACACB	24	46
CCOc1ccc([C@@H](C)NC(=O)C(=O)NCC2(OC(C)C)CCC2)cc1	ZINC000875017783	FF	On-Demand	Anodyne	ACACB	24	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCn1c(C)nc2ccccc21	ZINC000875017785	FE	On-Demand	Anodyne	SLC6A3	42	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCn1c(C)nc2ccccc21	ZINC000875017785	FE	On-Demand	Anodyne	PDE6D	42	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCn1c(C)nc2ccccc21	ZINC000875017786	FE	On-Demand	Anodyne	SLC6A3	42	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCn1c(C)nc2ccccc21	ZINC000875017786	FE	On-Demand	Anodyne	PDE6D	42	47
COc1cc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)ccc1OC(F)F	ZINC000875017790	FF	On-Demand	Anodyne	MT-ND1	23	40
CCOc1ccc([C@@H](C)NC(=O)C(=O)NCCC[C@H]2C=CCC2)cc1	ZINC000875017792	EG	On-Demand	Anodyne	ACACB	19	43
CCOc1ccc([C@H](C)NC(=O)C(=O)NCCC[C@H]2C=CCC2)cc1	ZINC000875017793	EG	On-Demand	Anodyne	ACACB	19	43
CCOc1ccc([C@@H](C)NC(=O)C(=O)NCCC[C@@H]2C=CCC2)cc1	ZINC000875017794	EG	On-Demand	Anodyne	ACACB	19	43
CCOc1ccc([C@H](C)NC(=O)C(=O)NCCC[C@@H]2C=CCC2)cc1	ZINC000875017795	EG	On-Demand	Anodyne	ACACB	19	43
CCOc1ccc([C@H](C)NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)cc1	ZINC000875017800	EF	On-Demand	Anodyne	ACACA	22	40
CCOc1ccc([C@H](C)NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)cc1	ZINC000875017800	EF	On-Demand	Anodyne	ACACB	24	48
CCOc1ccc([C@@H](C)NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)cc1	ZINC000875017801	EF	On-Demand	Anodyne	ACACA	22	40
CCOc1ccc([C@@H](C)NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)cc1	ZINC000875017801	EF	On-Demand	Anodyne	ACACB	24	48
C[C@H](NC(=O)C(=O)NCC1(c2ccccc2)CCCC1)c1ccnn1C	ZINC000875017808	FE	On-Demand	Anodyne	KCNA3	45	40
C[C@H](NC(=O)C(=O)NCC1(c2ccccc2)CCCC1)c1ccnn1C	ZINC000875017808	FE	On-Demand	Anodyne	SOAT1	15	50
C[C@H](NC(=O)C(=O)NCC1(c2ccccc2)CCCC1)c1ccnn1C	ZINC000875017808	FE	On-Demand	Anodyne	HCN1	57	34
C[C@H](NC(=O)C(=O)NCC1(c2ccccc2)CCCC1)c1ccnn1C	ZINC000875017808	FE	On-Demand	Anodyne	HCN4	48	34
O=C(NCCc1ccc2c(c1)OCO2)NC1([C@@H]2CCCCO2)CCC1	ZINC000875017810	EF	On-Demand	Anodyne	NOS2	45	39
O=C(NCCc1ccc2c(c1)OCO2)NC1([C@H]2CCCCO2)CCC1	ZINC000875017811	EF	On-Demand	Anodyne	NOS2	45	39
O=C(CN1CCSC1=O)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000875017812	HH	On-Demand	Anodyne	SCD	31	40
CC[C@@H](NC(=O)C(=O)NCc1ccc(F)c(C)c1)c1cccc(OC)c1OC	ZINC000875017821	GG	On-Demand	Anodyne	PDS	46	35
COC(=O)N(C)NC(=O)NCCc1ccc2c(c1)OCO2	ZINC000875017825	CC	On-Demand	Reactive	EDNRB	43	35
COC(=O)N(C)NC(=O)NCCc1ccc2c(c1)OCO2	ZINC000875017825	CC	On-Demand	Reactive	EDNRA	46	37
COC(=O)N(C)NC(=O)NCCc1ccc2c(c1)OCO2	ZINC000875017825	CC	On-Demand	Reactive	BMP1	65	41
COC(=O)N(C)NC(=O)NCCc1ccc2c(c1)OCO2	ZINC000875017825	CC	On-Demand	Reactive	NOS2	62	38
COC(=O)N(C)NC(=O)NCCc1ccc2c(c1)OCO2	ZINC000875017825	CC	On-Demand	Reactive	MCHR1	15	40
O=C(NCCc1ccc2c(c1)OCO2)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875017827	GG	On-Demand	Anodyne	EDNRA	19	40
O=C(NCCc1ccc2c(c1)OCO2)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875017827	GG	On-Demand	Anodyne	BMP1	49	37
O=C(NCCc1ccc2c(c1)OCO2)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875017827	GG	On-Demand	Anodyne	NOS2	88	40
O=C(NCCc1ccc2c(c1)OCO2)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875017827	GG	On-Demand	Anodyne	MCHR1	16	41
O=C(NCCc1ccc2c(c1)OCO2)NC[C@H]1C[C@H](O)C1	ZINC000875017828	CD	On-Demand	Anodyne	NOS2	68	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccc2c(c1)OCO2	ZINC000875017862	ED	On-Demand	Anodyne	BMP1	60	36
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccc2c(c1)OCO2	ZINC000875017862	ED	On-Demand	Anodyne	NOS2	89	40
COC(=O)C1(O)CN(C(=O)NCCn2c(C)nc3ccccc32)C1	ZINC000875017865	EC	On-Demand	Anodyne	PDE6D	26	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2ccc3c(c2)OCO3)C1	ZINC000875017881	ED	On-Demand	Anodyne	EDNRB	44	35
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2ccc3c(c2)OCO3)C1	ZINC000875017881	ED	On-Demand	Anodyne	EDNRA	51	38
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2ccc3c(c2)OCO3)C1	ZINC000875017881	ED	On-Demand	Anodyne	BMP1	66	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2ccc3c(c2)OCO3)C1	ZINC000875017881	ED	On-Demand	Anodyne	NOS2	88	39
COC(=O)C1(O)CN(C(=O)NCCc2ccc3c(c2)OCO3)C1	ZINC000875017888	DB	On-Demand	Anodyne	BMP1	68	39
COC(=O)C1(O)CN(C(=O)NCCc2ccc3c(c2)OCO3)C1	ZINC000875017888	DB	On-Demand	Anodyne	NOS2	77	38
COC(=O)C1(O)CN(C(=O)NCCc2ccc3c(c2)OCO3)C1	ZINC000875017888	DB	On-Demand	Anodyne	MCHR1	15	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC(F)F)c(OC)c1	ZINC000875017901	GF	On-Demand	Anodyne	SLC6A4	28	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC(F)F)c(OC)c1	ZINC000875017901	GF	On-Demand	Anodyne	SLC6A3	61	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC(F)F)c(OC)c1	ZINC000875017902	GF	On-Demand	Anodyne	SLC6A4	28	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC(F)F)c(OC)c1	ZINC000875017902	GF	On-Demand	Anodyne	SLC6A3	61	43
COC(=O)C1=NO[C@@]2(CCN(C(=O)NCCn3c(C)nc4ccccc43)C2)C1	ZINC000875017910	GD	On-Demand	Anodyne	PTAFR	15	40
COC(=O)C1=NO[C@]2(CCN(C(=O)NCCn3c(C)nc4ccccc43)C2)C1	ZINC000875017911	GD	On-Demand	Anodyne	PTAFR	15	40
CCOc1ccc([C@H](C)NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875017912	EE	On-Demand	Anodyne	ACACA	21	42
CCOc1ccc([C@H](C)NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875017912	EE	On-Demand	Anodyne	CTSK	27	40
CCOc1ccc([C@H](C)NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875017912	EE	On-Demand	Anodyne	ACACB	23	47
CCOc1ccc([C@@H](C)NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875017913	EE	On-Demand	Anodyne	ACACA	21	42
CCOc1ccc([C@@H](C)NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875017913	EE	On-Demand	Anodyne	CTSK	27	40
CCOc1ccc([C@@H](C)NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875017913	EE	On-Demand	Anodyne	ACACB	23	47
CCOc1ccc([C@@H](C)NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875017914	EE	On-Demand	Anodyne	ACACA	21	42
CCOc1ccc([C@@H](C)NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875017914	EE	On-Demand	Anodyne	CTSK	27	40
CCOc1ccc([C@@H](C)NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875017914	EE	On-Demand	Anodyne	ACACB	23	47
CCOc1ccc([C@H](C)NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875017915	EE	On-Demand	Anodyne	ACACA	21	42
CCOc1ccc([C@H](C)NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875017915	EE	On-Demand	Anodyne	CTSK	27	40
CCOc1ccc([C@H](C)NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875017915	EE	On-Demand	Anodyne	ACACB	23	47
CN(C)C[C@@H]1CN(C(=O)NCCc2ccc3c(c2)OCO3)C[C@H]1CN(C)C	ZINC000875017959	GD	On-Demand	Anodyne	BMP1	60	36
CN(C)C[C@@H]1CN(C(=O)NCCc2ccc3c(c2)OCO3)C[C@H]1CN(C)C	ZINC000875017959	GD	On-Demand	Anodyne	NOS2	96	40
CN(C)C[C@@H]1CN(C(=O)NCCc2ccc3c(c2)OCO3)C[C@H]1CN(C)C	ZINC000875017959	GD	On-Demand	Anodyne	MCHR1	18	41
C[C@H](NC(=O)C(=O)NCC1(c2ccccc2)CC1)c1ccnn1C	ZINC000875017978	ED	On-Demand	Anodyne	KCNA3	47	41
C[C@H](NC(=O)C(=O)NCC1(c2ccccc2)CC1)c1ccnn1C	ZINC000875017978	ED	On-Demand	Anodyne	SOAT1	16	44
CCCCCCCCCNC(=O)N1CCCN(C(=O)CNC(C)=O)CC1	ZINC000875017980	FE	On-Demand	Mild	ASAH1	94	36
O=C(NCC1(c2ccccc2)CCC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875017985	EF	On-Demand	Anodyne	KCNA3	47	38
CN1CC[C@H]2CN(C(=O)C(=O)NCC3(c4ccccc4)CCC3)CC[C@H]21	ZINC000875017991	FD	On-Demand	Anodyne	KCNA3	49	41
CN1CC[C@H]2CN(C(=O)C(=O)NCC3(c4ccccc4)CCC3)CC[C@@H]21	ZINC000875017993	FD	On-Demand	Anodyne	KCNA3	49	41
O=C(NCCCN1CCCCC1)NCc1ccnc(-n2cncn2)c1	ZINC000875017994	ED	On-Demand	Anodyne	HRH2	24	41
O=C(NCCCN1CCCCC1)NCc1ccnc(-n2cncn2)c1	ZINC000875017994	ED	On-Demand	Anodyne	HNMT	73	36
O=C(NCCCN1CCCCC1)N[C@H]1CCCC[C@H]1F	ZINC000875018011	CE	On-Demand	Anodyne	CCR3	34	48
O=C(NCc1ncc(Cl)s1)C(=O)NCC1(c2ccccc2)CC1	ZINC000875018019	EE	On-Demand	Anodyne	KCNA3	44	36
CCCCCCCCCNC(=O)N1C[C@@](C)(CO)[C@@](C)(CO)C1	ZINC000875018020	EF	On-Demand	Mild	ASAH1	111	43
CCCCCCCCCNC(=O)N(C)C[C@@H]1C[C@H](O)C1	ZINC000875018022	CG	On-Demand	Mild	EPHX2	15	44
CCCCCCCCCNC(=O)N(C)C[C@@H]1C[C@H](O)C1	ZINC000875018022	CG	On-Demand	Mild	ASAH1	49	33
CC(=O)N(C)c1ccc(CNC(=O)NCC(=O)NC2CC2)cc1	ZINC000875018035	DC	On-Demand	Anodyne	FASN	33	41
CCCCCCCCCNC(=O)N(C)Cc1ncc[nH]1	ZINC000875018038	CG	On-Demand	Mild	ASAH1	84	36
CCCCCCCCCNC(=O)N1CC[C@H]2CC[C@@H](C1)S2(=O)=O	ZINC000875018044	EG	On-Demand	Mild	ASAH1	101	40
O=C(NCC1(c2ccccc2)CC1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875018050	EE	On-Demand	Anodyne	KCNA3	46	36
O=C(NCC1(c2ccccc2)CC1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875018051	EE	On-Demand	Anodyne	KCNA3	46	36
O=C(NCC1(c2ccccc2)CC1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875018052	EE	On-Demand	Anodyne	KCNA3	46	36
O=C(NCC1(c2ccccc2)CC1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875018053	EE	On-Demand	Anodyne	KCNA3	46	36
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)c2nc3ccccc3n2C(F)F)CC1	ZINC000875018054	GE	On-Demand	Anodyne	PDE6D	58	36
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)c2nc3ccccc3n2C(F)F)CC1	ZINC000875018055	GE	On-Demand	Anodyne	PDE6D	58	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(OC)c(F)c1	ZINC000875018062	FF	On-Demand	Anodyne	SLC6A4	19	50
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(OC)c(F)c1	ZINC000875018062	FF	On-Demand	Anodyne	SLC6A3	41	50
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(OC)c(F)c1	ZINC000875018063	FF	On-Demand	Anodyne	SLC6A4	19	50
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(OC)c(F)c1	ZINC000875018063	FF	On-Demand	Anodyne	SLC6A3	41	50
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(OC)c(F)c1	ZINC000875018064	FF	On-Demand	Anodyne	SLC6A4	19	50
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(OC)c(F)c1	ZINC000875018064	FF	On-Demand	Anodyne	SLC6A3	41	50
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(OC)c(F)c1	ZINC000875018065	FF	On-Demand	Anodyne	SLC6A4	19	50
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(OC)c(F)c1	ZINC000875018065	FF	On-Demand	Anodyne	SLC6A3	41	50
O=C(CCCOC1CCOCC1)Nc1nc(-c2cc(F)ccc2F)cs1	ZINC000875018066	GI	On-Demand	Anodyne	MPL	49	37
O=C(CCCOC1CCOCC1)Nc1nc(-c2cc(F)ccc2F)cs1	ZINC000875018066	GI	On-Demand	Anodyne	HDAC9	15	46
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2(c3ccccc3)CC2)C1	ZINC000875018071	ED	On-Demand	Anodyne	KCNA3	49	39
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2(c3ccccc3)CC2)C1	ZINC000875018071	ED	On-Demand	Anodyne	HCN1	41	31
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2(c3ccccc3)CC2)C1	ZINC000875018071	ED	On-Demand	Anodyne	HCN4	41	31
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2(c3ccccc3)CC2)C1	ZINC000875018072	ED	On-Demand	Anodyne	KCNA3	49	39
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2(c3ccccc3)CC2)C1	ZINC000875018072	ED	On-Demand	Anodyne	HCN1	41	31
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2(c3ccccc3)CC2)C1	ZINC000875018072	ED	On-Demand	Anodyne	HCN4	41	31
COCC(C)(C)CCNC(=O)C(=O)NCc1ccc(F)c(C)c1	ZINC000875018075	DD	On-Demand	Anodyne	LEF	52	41
CCOc1ccc([C@H](C)NC(=O)C(=O)N2CC[C@H]3CSC[C@@H]3C2)cc1	ZINC000875018082	FE	On-Demand	Anodyne	ACACB	19	43
CCOc1ccc([C@H](C)NC(=O)C(=O)N2CC[C@H]3CSC[C@H]3C2)cc1	ZINC000875018083	FE	On-Demand	Anodyne	ACACB	19	43
CCOc1ccc([C@H](C)NC(=O)C(=O)N2CC[C@@H]3CSC[C@@H]3C2)cc1	ZINC000875018084	FE	On-Demand	Anodyne	ACACB	19	43
CCOc1ccc([C@H](C)NC(=O)C(=O)N2CC[C@@H]3CSC[C@H]3C2)cc1	ZINC000875018085	FE	On-Demand	Anodyne	ACACB	19	43
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C3(F)CCOCC3)cc2)C1	ZINC000875018093	GF	On-Demand	Anodyne	TGM2	57	41
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C3(F)CCOCC3)cc2)C1	ZINC000875018093	GF	On-Demand	Anodyne	F13A1	77	41
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)C3(F)CCOCC3)cc2)C1	ZINC000875018093	GF	On-Demand	Anodyne	NAMPT	32	41
COC(=O)[C@@]12C[C@@H](NC(=O)NCCn3c(C)nc4ccccc43)C[C@@H]1C2	ZINC000875018098	FD	On-Demand	Anodyne	PDE6D	40	42
O=C(NCCc1ccc2c(c1)OCO2)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875018103	GF	On-Demand	Anodyne	BMP1	41	34
O=C(NCCc1ccc2c(c1)OCO2)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875018103	GF	On-Demand	Anodyne	NOS2	104	47
O=C(NCCc1ccc2c(c1)OCO2)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875018103	GF	On-Demand	Anodyne	MCHR1	15	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(OC(F)(F)F)cc2)C1	ZINC000875018123	FE	On-Demand	Anodyne	GCGR	20	46
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(OC(F)(F)F)cc2)C1	ZINC000875018123	FE	On-Demand	Anodyne	EPHX2	44	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(OC(F)(F)F)cc2)C1	ZINC000875018124	FE	On-Demand	Anodyne	GCGR	20	46
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(OC(F)(F)F)cc2)C1	ZINC000875018124	FE	On-Demand	Anodyne	EPHX2	44	41
CCOc1ccc([C@@H](C)NC(=O)C(=O)NC[C@@H]2c3ccccc3CN2C)cc1	ZINC000875018157	GF	On-Demand	Anodyne	ACACB	20	42
CCOc1ccc([C@H](C)NC(=O)C(=O)NC[C@@H]2c3ccccc3CN2C)cc1	ZINC000875018158	GF	On-Demand	Anodyne	ACACB	20	42
CCOc1ccc([C@@H](C)NC(=O)C(=O)NC[C@H]2c3ccccc3CN2C)cc1	ZINC000875018159	GF	On-Demand	Anodyne	ACACB	20	42
COC(=O)N(C)NC(=O)NCCn1c(C)nc2ccccc21	ZINC000875018162	DD	On-Demand	Reactive	PTAFR	27	40
COC(=O)N(C)NC(=O)NCCn1c(C)nc2ccccc21	ZINC000875018162	DD	On-Demand	Reactive	PDE6D	16	40
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H](C)c1ccc(OC)c(F)c1	ZINC000875018164	GF	On-Demand	Anodyne	ACKR3	63	33
COCCN(CC1CCN(C)CC1)C(=O)N[C@H](C)c1ccc(OC)c(F)c1	ZINC000875018165	GF	On-Demand	Anodyne	ACKR3	63	33
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)N[C@H](c1cccs1)C1CC1	ZINC000875018171	GG	On-Demand	Anodyne	ROCK1	23	41
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)N[C@H](c1cccs1)C1CC1	ZINC000875018171	GG	On-Demand	Anodyne	ROCK2	15	41
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)N[C@@H](c1cccs1)C1CC1	ZINC000875018172	GG	On-Demand	Anodyne	ROCK1	23	41
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)N[C@@H](c1cccs1)C1CC1	ZINC000875018172	GG	On-Demand	Anodyne	ROCK2	15	41
CN1CCC(CNC(=O)NCC(=O)NC2CC2)(c2ccccc2)CC1	ZINC000875018173	ED	On-Demand	Anodyne	KCNA3	54	50
CN1CCC(CNC(=O)NCC(=O)NC2CC2)(c2ccccc2)CC1	ZINC000875018173	ED	On-Demand	Anodyne	SOAT1	15	45
CN1CCC(CNC(=O)NCC(=O)NC2CC2)(c2ccccc2)CC1	ZINC000875018173	ED	On-Demand	Anodyne	EPHX2	20	40
CN1CCC(CNC(=O)NCC(=O)NC2CC2)(c2ccccc2)CC1	ZINC000875018173	ED	On-Demand	Anodyne	NPFFR1	34	47
O=C(NCC1(c2ccccc2)CC1)C(=O)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875018174	FE	On-Demand	Anodyne	KCNA3	45	38
O=C(NCC1(c2ccccc2)CC1)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875018175	FE	On-Demand	Anodyne	KCNA3	45	38
O=C(NCC1(c2ccccc2)CC1)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875018176	FE	On-Demand	Anodyne	KCNA3	45	38
O=C(NCC1(c2ccccc2)CC1)C(=O)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875018177	FE	On-Demand	Anodyne	KCNA3	45	38
Cn1nccc1C(NC(=O)NCCCN1CCCCC1)c1ccnn1C	ZINC000875018181	FD	On-Demand	Anodyne	HRH2	23	41
Cn1nccc1C(NC(=O)NCCCN1CCCCC1)c1ccnn1C	ZINC000875018181	FD	On-Demand	Anodyne	HRH3	23	40
Cn1nccc1C(NC(=O)NCCCN1CCCCC1)c1ccnn1C	ZINC000875018181	FD	On-Demand	Anodyne	CHRNA7	22	46
Cn1nccc1C(NC(=O)NCCCN1CCCCC1)c1ccnn1C	ZINC000875018181	FD	On-Demand	Anodyne	HNMT	60	35
COc1ccc2cc(CNC(=O)C(=O)NC[C@H]3COCCN3C)ccc2c1	ZINC000875018192	FC	On-Demand	Anodyne	DRD4	41	33
COc1ccc2cc(CNC(=O)C(=O)NC[C@H]3COCCN3C)ccc2c1	ZINC000875018192	FC	On-Demand	Anodyne	MTNR1A	40	36
COc1ccc2cc(CNC(=O)C(=O)NC[C@@H]3COCCN3C)ccc2c1	ZINC000875018193	FC	On-Demand	Anodyne	DRD4	41	33
COc1ccc2cc(CNC(=O)C(=O)NC[C@@H]3COCCN3C)ccc2c1	ZINC000875018193	FC	On-Demand	Anodyne	MTNR1A	40	36
CC(=O)Nc1cccc2c1CN(C(=O)NCCCN1CCCCC1)CC2	ZINC000875018202	FF	On-Demand	Anodyne	HRH3	16	44
CC(=O)Nc1cccc2c1CN(C(=O)NCCCN1CCCCC1)CC2	ZINC000875018202	FF	On-Demand	Anodyne	CHRNA7	20	41
CCCCCCCCCNC(=O)N1CCO[C@@H](CC(N)=O)C1	ZINC000875018206	DE	On-Demand	Mild	ASAH1	99	40
CCCCCCCCCNC(=O)N1CCO[C@H](CC(N)=O)C1	ZINC000875018207	DE	On-Demand	Mild	ASAH1	99	40
O=C(NCCCCC1CC1)C(=O)NCc1ccc(N2CCOCC2)nc1	ZINC000875018208	FD	On-Demand	Anodyne	NAMPT	21	42
O=C(NCCCN1CCCCC1)N1Cc2cccc(O)c2C1	ZINC000875018209	DE	On-Demand	Clean	HTR1A	23	40
O=C(NCCCN1CCCCC1)N1Cc2cccc(O)c2C1	ZINC000875018209	DE	On-Demand	Clean	DRD2	25	41
O=C(NCCCN1CCCCC1)N1Cc2cccc(O)c2C1	ZINC000875018209	DE	On-Demand	Clean	DRD3	47	41
O=C(NCCCN1CCCCC1)N1Cc2cccc(O)c2C1	ZINC000875018209	DE	On-Demand	Clean	HTR4	15	40
O=C(NCCCN1CCCCC1)N1Cc2cccc(O)c2C1	ZINC000875018209	DE	On-Demand	Clean	HRH3	29	42
O=C(NCCCN1CCCCC1)N1Cc2cccc(O)c2C1	ZINC000875018209	DE	On-Demand	Clean	CHRNA7	17	46
O=C(NCCCN1CCCCC1)N1Cc2cccc(O)c2C1	ZINC000875018209	DE	On-Demand	Clean	HNMT	50	33
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)nc2)CC1	ZINC000875018210	FC	On-Demand	Anodyne	NAMPT	26	47
CCCCCCCCCNC(=O)N[C@@H]1COC[C@@H]1O	ZINC000875018214	CD	On-Demand	Mild	EPHX2	27	54
CCCCCCCCCNC(=O)N[C@@H]1COC[C@@H]1O	ZINC000875018214	CD	On-Demand	Mild	ASAH1	82	34
CCCCCCCCCNC(=O)N1C[C@H]2C(=O)N(C)C(=O)[C@H]2C1	ZINC000875018216	DD	On-Demand	Mild	ASAH1	112	46
CCCCCCCCCNC(=O)N1C[C@H]2C(=O)N(C)C(=O)[C@H]2C1	ZINC000875018216	DD	On-Demand	Mild	LASR	50	32
CCCCCCCCCNC(=O)N1CCC(C(C)=O)CC1	ZINC000875018217	CH	On-Demand	Mild	EPHX2	15	50
CCCCCCCCCNC(=O)N1CCC(C(C)=O)CC1	ZINC000875018217	CH	On-Demand	Mild	ASAH1	101	41
CCn1nncc1CNC(=O)C(=O)NCc1ccc2cc(OC)ccc2c1	ZINC000875018234	FD	On-Demand	Anodyne	MTNR1A	41	35
O=C(NCC[C@H]1CCSC1)C(=O)NCC1(c2ccccc2)CC1	ZINC000875018236	EE	On-Demand	Anodyne	KCNA3	47	38
O=C(NCC[C@@H]1CCSC1)C(=O)NCC1(c2ccccc2)CC1	ZINC000875018237	EE	On-Demand	Anodyne	KCNA3	47	38
CCCCCCCCCNC(=O)NN(C)C(=O)OC	ZINC000875018254	CF	On-Demand	Reactive	EPHX2	21	43
CCCCCCCCCNC(=O)NN(C)C(=O)OC	ZINC000875018254	CF	On-Demand	Reactive	ASAH1	80	34
CCCCCCCCCNC(=O)N1CCO[C@@H](CNC(=O)NC)C1	ZINC000875018257	EE	On-Demand	Mild	ASAH1	92	37
CCCCCCCCCNC(=O)N1CCO[C@H](CNC(=O)NC)C1	ZINC000875018258	EE	On-Demand	Mild	ASAH1	92	37
CN1CCN(C2CCN(C(=O)C(=O)NCC3(c4ccccc4)CC3)CC2)CC1	ZINC000875018259	GD	On-Demand	Anodyne	OPRL1	26	41
CN1CCN(C2CCN(C(=O)C(=O)NCC3(c4ccccc4)CC3)CC2)CC1	ZINC000875018259	GD	On-Demand	Anodyne	KCNA3	49	39
CN1CCN(C2CCN(C(=O)C(=O)NCC3(c4ccccc4)CC3)CC2)CC1	ZINC000875018259	GD	On-Demand	Anodyne	L3MBTL3	76	41
COCC(C)(C)CCNC(=O)C(=O)NCC1(c2ccccc2)CC1	ZINC000875018260	EE	On-Demand	Anodyne	KCNA3	52	42
COCC(C)(C)CCNC(=O)C(=O)NCC1(c2ccccc2)CC1	ZINC000875018260	EE	On-Demand	Anodyne	ICMT	43	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cc(C)ccc1OC	ZINC000875018265	EF	On-Demand	Anodyne	SLC6A4	19	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cc(C)ccc1OC	ZINC000875018265	EF	On-Demand	Anodyne	SLC6A3	41	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cc(C)ccc1OC	ZINC000875018266	EF	On-Demand	Anodyne	SLC6A4	19	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cc(C)ccc1OC	ZINC000875018266	EF	On-Demand	Anodyne	SLC6A3	41	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cc(C)ccc1OC	ZINC000875018267	EF	On-Demand	Anodyne	SLC6A4	19	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cc(C)ccc1OC	ZINC000875018267	EF	On-Demand	Anodyne	SLC6A3	41	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cc(C)ccc1OC	ZINC000875018268	EF	On-Demand	Anodyne	SLC6A4	19	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cc(C)ccc1OC	ZINC000875018268	EF	On-Demand	Anodyne	SLC6A3	41	40
CCCCCCCCCNC(=O)N[C@@H]1CCO[C@H]1c1cc[nH]n1	ZINC000875018270	DG	On-Demand	Mild	EPHX2	18	43
CCCCCCCCCNC(=O)N[C@@H]1CCO[C@H]1c1cc[nH]n1	ZINC000875018270	DG	On-Demand	Mild	ASAH1	59	33
O=C(NCC1(c2ccccc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875018271	DE	On-Demand	Anodyne	KCNA3	47	40
CCOc1ccc([C@H](C)NC(=O)C(=O)NCC[C@H]2CCSC2)cc1	ZINC000875018280	FF	On-Demand	Anodyne	ACACB	22	44
CCOc1ccc([C@@H](C)NC(=O)C(=O)NCC[C@H]2CCSC2)cc1	ZINC000875018281	FF	On-Demand	Anodyne	ACACB	22	44
CCOc1ccc([C@H](C)NC(=O)C(=O)NCC[C@@H]2CCSC2)cc1	ZINC000875018282	FF	On-Demand	Anodyne	ACACB	22	44
CCOc1ccc([C@@H](C)NC(=O)C(=O)NCC[C@@H]2CCSC2)cc1	ZINC000875018283	FF	On-Demand	Anodyne	ACACB	22	44
CCCCCCCNC(=O)C(=O)NCc1nc(C)cs1	ZINC000875018290	CE	On-Demand	Mild	ASAH1	82	39
CC(C)(C)OC(=O)NCCCC(=O)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000875018292	IJ	On-Demand	Anodyne	SCD1	37	42
CC(C)(C)OC(=O)NCCCC(=O)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000875018292	IJ	On-Demand	Anodyne	SCD	34	45
O=C(NCCc1ccc2c(c1)OCO2)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875018293	FD	On-Demand	Anodyne	NOS2	90	38
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(OC(F)(F)F)cc2)CC1	ZINC000875018303	FE	On-Demand	Anodyne	EPHX2	53	43
CCOc1ccc([C@H](C)NC(=O)C(=O)N2CC[C@H]3[C@H](CCN3C)C2)cc1	ZINC000875018305	FD	On-Demand	Anodyne	ACACB	19	43
CCOc1ccc([C@H](C)NC(=O)C(=O)N2CC[C@@H]3[C@@H](CCN3C)C2)cc1	ZINC000875018306	FD	On-Demand	Anodyne	ACACB	19	43
CCOc1ccc([C@H](C)NC(=O)C(=O)N2CC[C@@H]3[C@H](CCN3C)C2)cc1	ZINC000875018307	FD	On-Demand	Anodyne	ACACB	19	43
CCOc1ccc([C@H](C)NC(=O)C(=O)N2CC[C@H]3[C@@H](CCN3C)C2)cc1	ZINC000875018308	FD	On-Demand	Anodyne	ACACB	19	43
COCC(C)(C)CCNC(=O)C(=O)NCC1(c2ccccc2)CCCC1	ZINC000875018323	FF	On-Demand	Anodyne	KCNA3	53	42
COCC(C)(C)CCNC(=O)C(=O)NCC1(c2ccccc2)CCCC1	ZINC000875018323	FF	On-Demand	Anodyne	NMBR	43	34
O=C(NCCc1ccc2c(c1)OCO2)N1CCC(CO)(CO)CC1	ZINC000875018324	EC	On-Demand	Anodyne	BMP1	55	37
O=C(NCCc1ccc2c(c1)OCO2)N1CCC(CO)(CO)CC1	ZINC000875018324	EC	On-Demand	Anodyne	NOS2	96	41
CCOc1ccc([C@@H](C)NC(=O)C(=O)NCc2cnn(CC)n2)cc1	ZINC000875018326	ED	On-Demand	Anodyne	ACACB	30	48
COc1cc(CNC(=O)N(C)OCC(F)(F)F)ccc1OC(F)F	ZINC000875018330	FF	On-Demand	Anodyne	MT-ND1	24	42
O=C(NCCc1ccc2c(c1)OCO2)N1Cc2cccnc2N2C[C@H](O)C[C@H]2C1	ZINC000875018334	GD	On-Demand	Anodyne	NOS2	95	39
COCCN(CC1CCN(C)CC1)C(=O)NCCn1c(C)nc2ccccc21	ZINC000875018337	GE	On-Demand	Anodyne	HRH1	25	42
COCCN(CC1CCN(C)CC1)C(=O)NCCn1c(C)nc2ccccc21	ZINC000875018337	GE	On-Demand	Anodyne	PDE6D	38	45
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(OC(F)(F)F)cc3)CC[C@H]21	ZINC000875018352	GD	On-Demand	Anodyne	EPHX2	44	41
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(OC(F)(F)F)cc3)CC[C@@H]21	ZINC000875018355	GD	On-Demand	Anodyne	EPHX2	44	41
CCOc1ccc([C@@H](C)NC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875018356	EE	On-Demand	Anodyne	ACACA	26	44
CCOc1ccc([C@@H](C)NC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875018356	EE	On-Demand	Anodyne	ACACB	28	50
CCOc1ccc([C@H](C)NC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875018357	EE	On-Demand	Anodyne	ACACA	26	44
CCOc1ccc([C@H](C)NC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875018357	EE	On-Demand	Anodyne	ACACB	28	50
O=C(NCC1(c2ccccc2)CCCC1)C(=O)N[C@H]1CC12CCC2	ZINC000875018364	EF	On-Demand	Anodyne	KCNA3	48	41
O=C(NCC1(c2ccccc2)CCCC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875018365	EF	On-Demand	Anodyne	KCNA3	48	41
O=C(NCC1(c2ccccc2)CC1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875018378	FF	On-Demand	Anodyne	KCNA3	50	39
O=C(NCC1(c2ccccc2)CC1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875018379	FF	On-Demand	Anodyne	KCNA3	50	39
CCCCCCCCCNC(=O)N1CCCN(C=O)CC1	ZINC000875018393	CF	On-Demand	Mild	ASAH1	98	37
C[C@H](NC(=O)C(=O)NCC1(c2ccccc2)CC1)c1ccc(C(F)(F)F)nc1	ZINC000875018406	GG	On-Demand	Anodyne	KCNA3	40	36
CCCCCCCCCNC(=O)N1C[C@H](C)O[C@H](C(N)=O)C1	ZINC000875018428	DE	On-Demand	Mild	ASAH1	103	40
CCCCCCCCCNC(=O)N1C[C@H](C)O[C@H](C(N)=O)C1	ZINC000875018428	DE	On-Demand	Mild	NOD1	44	36
CCCCCCCCCNC(=O)N1C[C@H](C)O[C@@H](C(N)=O)C1	ZINC000875018429	DE	On-Demand	Mild	ASAH1	103	40
CCCCCCCCCNC(=O)N1C[C@H](C)O[C@@H](C(N)=O)C1	ZINC000875018429	DE	On-Demand	Mild	NOD1	44	36
COc1ccc2cc(CNC(=O)C(=O)NCC3CC=CC3)ccc2c1	ZINC000875018432	EF	On-Demand	Anodyne	MTNR1A	70	43
COc1ccc2cc(CNC(=O)C(=O)NCC3CC=CC3)ccc2c1	ZINC000875018432	EF	On-Demand	Anodyne	MTNR1B	60	37
O=C(NCCCN1CCCCC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875018433	FG	On-Demand	Anodyne	HTR1A	26	44
O=C(NCCCN1CCCCC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875018433	FG	On-Demand	Anodyne	DRD2	27	44
O=C(NCCCN1CCCCC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875018433	FG	On-Demand	Anodyne	DRD4	15	44
O=C(NCCCN1CCCCC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875018433	FG	On-Demand	Anodyne	HTR2A	29	44
O=C(NCCCN1CCCCC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875018433	FG	On-Demand	Anodyne	ADRA1A	63	39
O=C(NCCCN1CCCCC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875018433	FG	On-Demand	Anodyne	ADRA1B	49	40
O=C(NCCCN1CCCCC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875018433	FG	On-Demand	Anodyne	DRD3	41	44
O=C(NCCCN1CCCCC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875018433	FG	On-Demand	Anodyne	OPRL1	23	43
O=C(NCCCN1CCCCC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875018433	FG	On-Demand	Anodyne	HTR4	28	44
O=C(NCCCN1CCCCC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875018433	FG	On-Demand	Anodyne	CCR1	36	42
O=C(NCCCN1CCCCC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875018433	FG	On-Demand	Anodyne	CCR3	19	41
O=C(NCCCN1CCCCC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875018433	FG	On-Demand	Anodyne	CHRNA7	16	46
O=C(NCCCN1CCCCC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875018433	FG	On-Demand	Anodyne	HNMT	42	34
CC(=O)N(C)c1ccc(CNC(=O)NCCCN2CCCCC2)cc1	ZINC000875018434	EE	On-Demand	Anodyne	HRH2	25	44
CC(=O)N(C)c1ccc(CNC(=O)NCCCN2CCCCC2)cc1	ZINC000875018434	EE	On-Demand	Anodyne	HRH3	30	44
CC(=O)N(C)c1ccc(CNC(=O)NCCCN2CCCCC2)cc1	ZINC000875018434	EE	On-Demand	Anodyne	CCR3	30	48
CC(=O)N(C)c1ccc(CNC(=O)NCCCN2CCCCC2)cc1	ZINC000875018434	EE	On-Demand	Anodyne	CHRNA7	15	43
CC(=O)N(C)c1ccc(CNC(=O)NCCCN2CCCCC2)cc1	ZINC000875018434	EE	On-Demand	Anodyne	HNMT	49	32
C#CC[C@@H](COC)NC(=O)C(=O)NCC1(c2ccccc2)CCC1	ZINC000875018439	ED	On-Demand	Mild	KCNA3	48	39
C#CC[C@H](COC)NC(=O)C(=O)NCC1(c2ccccc2)CCC1	ZINC000875018440	ED	On-Demand	Mild	KCNA3	48	39
CCCCCCCCCNC(=O)N1CCC(C(=O)NOC)CC1	ZINC000875018452	EF	On-Demand	Mild	TPP2	20	40
CCCCCCCCCNC(=O)N1CCC(C(=O)NOC)CC1	ZINC000875018452	EF	On-Demand	Mild	ASAH1	95	37
O=C(NCC1(c2ccccc2)CCC1)C(=O)N[C@H]1CC12CCC2	ZINC000875018454	DE	On-Demand	Anodyne	KCNA3	48	42
O=C(NCC1(c2ccccc2)CCC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875018455	DE	On-Demand	Anodyne	KCNA3	48	42
Cn1nc(Cl)c(C(=O)Nc2cc(Cl)ccc2N2CCOCC2)c1Cl	ZINC000875018456	GG	On-Demand	Anodyne	CNR1	52	32
CCCCCCCCCNC(=O)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875018461	EG	On-Demand	Mild	ASAH1	109	45
CCCCCCCCCNC(=O)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875018462	EG	On-Demand	Mild	ASAH1	109	45
Cc1nnc(NNC(=O)NCCCN2CCCCC2)n1C	ZINC000875018463	CC	On-Demand	Reactive	CHRNA7	17	40
O=C(Nc1nc(-c2cc(F)ccc2F)cs1)C1(F)CCOCC1	ZINC000875018472	EH	On-Demand	Anodyne	MPL	39	41
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)c1ccc(OCC)cc1	ZINC000875018479	ED	On-Demand	Mild	ACACA	27	44
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)c1ccc(OCC)cc1	ZINC000875018479	ED	On-Demand	Mild	ACACB	27	51
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](C)c1ccc(OCC)cc1	ZINC000875018480	ED	On-Demand	Mild	ACACA	27	44
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](C)c1ccc(OCC)cc1	ZINC000875018480	ED	On-Demand	Mild	ACACB	27	51
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)c1ccc(OCC)cc1	ZINC000875018481	ED	On-Demand	Mild	ACACA	27	44
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)c1ccc(OCC)cc1	ZINC000875018481	ED	On-Demand	Mild	ACACB	27	51
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](C)c1ccc(OCC)cc1	ZINC000875018482	ED	On-Demand	Mild	ACACA	27	44
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](C)c1ccc(OCC)cc1	ZINC000875018482	ED	On-Demand	Mild	ACACB	27	51
CC(=O)C1CCN(C(=O)C(=O)NCC2(c3ccccc3)CCCC2)CC1	ZINC000875018485	FE	On-Demand	Anodyne	KCNA3	51	42
CC(=O)C1CCN(C(=O)C(=O)NCC2(c3ccccc3)CCCC2)CC1	ZINC000875018485	FE	On-Demand	Anodyne	HCN1	42	32
CC(=O)C1CCN(C(=O)C(=O)NCC2(c3ccccc3)CCCC2)CC1	ZINC000875018485	FE	On-Demand	Anodyne	HCN4	42	32
CCCCCCCCCNC(=O)N1CCc2nc(COC)ncc2C1	ZINC000875018495	EG	On-Demand	Mild	ASAH1	88	38
COCC(C)(C)CCNC(=O)C(=O)NCC1(c2ccccc2)CCC1	ZINC000875018498	EE	On-Demand	Anodyne	KCNA3	51	42
O=C(NCC1(c2ccccc2)CCC1)C(=O)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875018500	FF	On-Demand	Anodyne	KCNA3	45	39
O=C(NCC1(c2ccccc2)CCC1)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875018501	FF	On-Demand	Anodyne	KCNA3	45	39
O=C(NCC1(c2ccccc2)CCC1)C(=O)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875018502	FF	On-Demand	Anodyne	KCNA3	45	39
O=C(NCC1(c2ccccc2)CCC1)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875018503	FF	On-Demand	Anodyne	KCNA3	45	39
CCCCCCCCCNC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875018506	CF	On-Demand	Mild	EPHX2	38	54
CCCCCCCCCNC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875018506	CF	On-Demand	Mild	ASAH1	75	35
CCCCCCCCCNC(=O)NC[C@@H]1C[C@H](O)C1	ZINC000875018507	CF	On-Demand	Mild	EPHX2	38	54
CCCCCCCCCNC(=O)NC[C@@H]1C[C@H](O)C1	ZINC000875018507	CF	On-Demand	Mild	ASAH1	75	35
CCCCCCCCCNC(=O)NCC1CC(O)C1	ZINC000875018508	CF	On-Demand	Mild	EPHX2	38	54
CCCCCCCCCNC(=O)NCC1CC(O)C1	ZINC000875018508	CF	On-Demand	Mild	ASAH1	75	35
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCC2(c3ccccc3)CCC2)C1	ZINC000875018511	EE	On-Demand	Anodyne	KCNA3	58	45
C[C@H](NC(=O)C(=O)NCC1(c2ccccc2)CCC1)c1ccnn1C	ZINC000875018514	ED	On-Demand	Anodyne	KCNA3	45	40
C[C@H](NC(=O)C(=O)NCC1(c2ccccc2)CCC1)c1ccnn1C	ZINC000875018514	ED	On-Demand	Anodyne	SOAT1	15	47
CCCCCCCCCNC(=O)NNC(=O)c1ccc(=O)n(C)c1	ZINC000875018525	EE	On-Demand	Reactive	ASAH1	106	44
O=C(NCc1ncc(Cl)s1)C(=O)NCC1(c2ccccc2)CCC1	ZINC000875018526	FF	On-Demand	Anodyne	KCNA3	44	35
Cn1nccc1C(NC(=O)C(=O)NCC1(c2ccccc2)CC1)c1ccnn1C	ZINC000875018541	GD	On-Demand	Anodyne	KCNA3	49	42
Cn1nccc1C(NC(=O)C(=O)NCC1(c2ccccc2)CC1)c1ccnn1C	ZINC000875018541	GD	On-Demand	Anodyne	SOAT1	15	42
N#Cc1ccccc1N1CCC(NC(=O)NCCCN2CCCCC2)CC1	ZINC000875018544	FF	On-Demand	Mild	HTR1A	66	49
N#Cc1ccccc1N1CCC(NC(=O)NCCCN2CCCCC2)CC1	ZINC000875018544	FF	On-Demand	Mild	DRD2	64	49
N#Cc1ccccc1N1CCC(NC(=O)NCCCN2CCCCC2)CC1	ZINC000875018544	FF	On-Demand	Mild	DRD1	15	40
N#Cc1ccccc1N1CCC(NC(=O)NCCCN2CCCCC2)CC1	ZINC000875018544	FF	On-Demand	Mild	DRD4	43	45
N#Cc1ccccc1N1CCC(NC(=O)NCCCN2CCCCC2)CC1	ZINC000875018544	FF	On-Demand	Mild	HRH2	36	45
N#Cc1ccccc1N1CCC(NC(=O)NCCCN2CCCCC2)CC1	ZINC000875018544	FF	On-Demand	Mild	ADRA1D	54	46
N#Cc1ccccc1N1CCC(NC(=O)NCCCN2CCCCC2)CC1	ZINC000875018544	FF	On-Demand	Mild	HTR2A	44	49
N#Cc1ccccc1N1CCC(NC(=O)NCCCN2CCCCC2)CC1	ZINC000875018544	FF	On-Demand	Mild	HTR2C	34	47
N#Cc1ccccc1N1CCC(NC(=O)NCCCN2CCCCC2)CC1	ZINC000875018544	FF	On-Demand	Mild	ADRA1A	70	46
N#Cc1ccccc1N1CCC(NC(=O)NCCCN2CCCCC2)CC1	ZINC000875018544	FF	On-Demand	Mild	ADRA1B	49	42
N#Cc1ccccc1N1CCC(NC(=O)NCCCN2CCCCC2)CC1	ZINC000875018544	FF	On-Demand	Mild	DRD3	88	42
N#Cc1ccccc1N1CCC(NC(=O)NCCCN2CCCCC2)CC1	ZINC000875018544	FF	On-Demand	Mild	HTR7	52	49
N#Cc1ccccc1N1CCC(NC(=O)NCCCN2CCCCC2)CC1	ZINC000875018544	FF	On-Demand	Mild	HRH3	16	41
N#Cc1ccccc1N1CCC(NC(=O)NCCCN2CCCCC2)CC1	ZINC000875018544	FF	On-Demand	Mild	CCR3	34	48
N#Cc1ccccc1N1CCC(NC(=O)NCCCN2CCCCC2)CC1	ZINC000875018544	FF	On-Demand	Mild	CHRNA7	18	44
N#Cc1ccccc1N1CCC(NC(=O)NCCCN2CCCCC2)CC1	ZINC000875018544	FF	On-Demand	Mild	EPHX2	21	41
O=C(NCc1ncc(Cl)s1)C(=O)NCC1(c2ccccc2)CCCC1	ZINC000875018563	GG	On-Demand	Anodyne	KCNA3	44	35
O=C(NCc1ccc(OC(F)(F)F)cc1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875018572	GC	On-Demand	Anodyne	MMP2	23	41
O=C(NCc1ccc(OC(F)(F)F)cc1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875018572	GC	On-Demand	Anodyne	MMP14	17	41
O=C(NCc1ccc(OC(F)(F)F)cc1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875018572	GC	On-Demand	Anodyne	MMP9	18	41
O=C(NCc1ccc(OC(F)(F)F)cc1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875018572	GC	On-Demand	Anodyne	EPHX2	49	40
O=C(NCCc1ccc2c(c1)OCO2)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875018574	EE	On-Demand	Anodyne	NOS2	62	39
O=C(NCc1ccc(N2CCOCC2)nc1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875018592	FC	On-Demand	Anodyne	NAMPT	15	41
CN(C)C[C@@H]1CN(C(=O)C(=O)NCC2(c3ccccc3)CC2)C[C@H]1CN(C)C	ZINC000875018602	GD	On-Demand	Anodyne	KCNA3	48	40
C[C@@H](NC(=O)NCCc1ccc2c(c1)OCO2)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875018603	GF	On-Demand	Anodyne	BMP1	45	43
C[C@@H](NC(=O)NCCc1ccc2c(c1)OCO2)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875018603	GF	On-Demand	Anodyne	NOS2	85	36
C[C@@H](NC(=O)NCC(=O)NC1CC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875018604	FD	On-Demand	Anodyne	GPR119	31	44
C[C@H](NC(=O)NCC(=O)NC1CC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875018606	FD	On-Demand	Anodyne	GPR119	31	44
C#CC[C@@H](COC)NC(=O)C(=O)NCC1(c2ccccc2)CC1	ZINC000875018608	DC	On-Demand	Mild	KCNA3	48	40
C#CC[C@H](COC)NC(=O)C(=O)NCC1(c2ccccc2)CC1	ZINC000875018609	DC	On-Demand	Mild	KCNA3	48	40
O=C(C[C@H]1C=CS(=O)(=O)C1)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000875018620	HH	On-Demand	Anodyne	SCD	31	40
O=C(NCCc1ccc2c(c1)OCO2)N1CCC[C@H](OC2CCC2)CC1	ZINC000875018623	FG	On-Demand	Anodyne	NOS2	95	44
O=C(NCCc1ccc2c(c1)OCO2)N1CCC[C@H](OC2CCC2)CC1	ZINC000875018623	FG	On-Demand	Anodyne	MCHR1	22	43
O=C(NCCc1ccc2c(c1)OCO2)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875018624	FG	On-Demand	Anodyne	NOS2	95	44
O=C(NCCc1ccc2c(c1)OCO2)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875018624	FG	On-Demand	Anodyne	MCHR1	22	43
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)[C@]3(C)CCC(=O)N3)cc2)C1	ZINC000875018629	GD	On-Demand	Anodyne	TGM2	51	35
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)[C@]3(C)CCC(=O)N3)cc2)C1	ZINC000875018629	GD	On-Demand	Anodyne	F13A1	68	35
O=C(C[C@@H]1C=CS(=O)(=O)C1)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000875018633	HH	On-Demand	Anodyne	SCD	31	40
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)[C@H]3CCC(=O)O3)cc2)C1	ZINC000875018642	GD	On-Demand	Anodyne	TGM2	53	37
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)[C@H]3CCC(=O)O3)cc2)C1	ZINC000875018642	GD	On-Demand	Anodyne	F13A1	73	38
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NC(=O)[C@H]3CCC(=O)O3)cc2)C1	ZINC000875018642	GD	On-Demand	Anodyne	NAMPT	31	46
C[C@@H](CN(C)C(=O)C(=O)NCC1(c2ccccc2)CC1)NC(=O)OC(C)(C)C	ZINC000875018647	GE	On-Demand	Anodyne	KCNA3	48	41
C[C@@H](CN(C)C(=O)C(=O)NCC1(c2ccccc2)CC1)NC(=O)OC(C)(C)C	ZINC000875018647	GE	On-Demand	Anodyne	FPR1	45	36
O=C1CCN(C(=O)C(=O)NCC2(c3ccccc3)CC2)CCCCCCN1	ZINC000875018655	FD	On-Demand	Anodyne	KCNA3	35	44
COc1ccc(C)cc1[C@H](C)NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875018657	FD	On-Demand	Anodyne	EPHX2	19	40
CCOc1ccc([C@H](C)NC(=O)C(=O)N2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000875018670	GG	On-Demand	Anodyne	ACACB	22	44
CCOc1ccc([C@H](C)NC(=O)C(=O)N2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000875018671	GG	On-Demand	Anodyne	ACACB	22	44
CCOc1ccc([C@@H](C)NC(=O)C(=O)N2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000875018672	GG	On-Demand	Anodyne	ACACB	22	44
O=C(NCCCN1CCCCC1)NCc1ccc(CN2C(=O)CNC2=O)cc1	ZINC000875018683	GD	On-Demand	Anodyne	HRH2	24	45
O=C(NCCCN1CCCCC1)NCc1ccc(CN2C(=O)CNC2=O)cc1	ZINC000875018683	GD	On-Demand	Anodyne	HRH3	23	44
O=C(NCCCN1CCCCC1)NCc1ccc(CN2C(=O)CNC2=O)cc1	ZINC000875018683	GD	On-Demand	Anodyne	CCR3	22	48
O=C(NCCCN1CCCCC1)NCc1ccc(CN2C(=O)CNC2=O)cc1	ZINC000875018683	GD	On-Demand	Anodyne	HNMT	61	33
CC[C@@H](NC(=O)NCCCN1CCCCC1)[C@@H](O)c1ccccc1	ZINC000875018687	EF	On-Demand	Anodyne	DRD2	25	46
CC[C@@H](NC(=O)NCCCN1CCCCC1)[C@@H](O)c1ccccc1	ZINC000875018687	EF	On-Demand	Anodyne	HRH2	26	44
CC[C@@H](NC(=O)NCCCN1CCCCC1)[C@@H](O)c1ccccc1	ZINC000875018687	EF	On-Demand	Anodyne	ADRA1D	18	42
CC[C@@H](NC(=O)NCCCN1CCCCC1)[C@@H](O)c1ccccc1	ZINC000875018687	EF	On-Demand	Anodyne	ADRA1A	31	42
CC[C@@H](NC(=O)NCCCN1CCCCC1)[C@@H](O)c1ccccc1	ZINC000875018687	EF	On-Demand	Anodyne	ADRA1B	18	42
CC[C@@H](NC(=O)NCCCN1CCCCC1)[C@@H](O)c1ccccc1	ZINC000875018687	EF	On-Demand	Anodyne	DRD3	49	46
CC[C@@H](NC(=O)NCCCN1CCCCC1)[C@@H](O)c1ccccc1	ZINC000875018687	EF	On-Demand	Anodyne	KCNQ2	43	35
CC[C@@H](NC(=O)NCCCN1CCCCC1)[C@@H](O)c1ccccc1	ZINC000875018687	EF	On-Demand	Anodyne	HRH3	23	40
CC[C@@H](NC(=O)NCCCN1CCCCC1)[C@@H](O)c1ccccc1	ZINC000875018687	EF	On-Demand	Anodyne	CCR3	27	41
CC[C@@H](NC(=O)NCCCN1CCCCC1)[C@@H](O)c1ccccc1	ZINC000875018687	EF	On-Demand	Anodyne	CHRNA7	19	50
CC[C@@H](NC(=O)NCCCN1CCCCC1)[C@@H](O)c1ccccc1	ZINC000875018687	EF	On-Demand	Anodyne	HNMT	47	34
CC[C@@H](NC(=O)NCCCN1CCCCC1)[C@@H](O)c1ccccc1	ZINC000875018687	EF	On-Demand	Anodyne	CAPN2	16	44
CC[C@@H](NC(=O)NCCCN1CCCCC1)[C@H](O)c1ccccc1	ZINC000875018688	EF	On-Demand	Anodyne	DRD2	25	46
CC[C@@H](NC(=O)NCCCN1CCCCC1)[C@H](O)c1ccccc1	ZINC000875018688	EF	On-Demand	Anodyne	HRH2	26	44
CC[C@@H](NC(=O)NCCCN1CCCCC1)[C@H](O)c1ccccc1	ZINC000875018688	EF	On-Demand	Anodyne	ADRA1D	18	42
CC[C@@H](NC(=O)NCCCN1CCCCC1)[C@H](O)c1ccccc1	ZINC000875018688	EF	On-Demand	Anodyne	ADRA1A	31	42
CC[C@@H](NC(=O)NCCCN1CCCCC1)[C@H](O)c1ccccc1	ZINC000875018688	EF	On-Demand	Anodyne	ADRA1B	18	42
CC[C@@H](NC(=O)NCCCN1CCCCC1)[C@H](O)c1ccccc1	ZINC000875018688	EF	On-Demand	Anodyne	DRD3	49	46
CC[C@@H](NC(=O)NCCCN1CCCCC1)[C@H](O)c1ccccc1	ZINC000875018688	EF	On-Demand	Anodyne	KCNQ2	43	35
CC[C@@H](NC(=O)NCCCN1CCCCC1)[C@H](O)c1ccccc1	ZINC000875018688	EF	On-Demand	Anodyne	HRH3	23	40
CC[C@@H](NC(=O)NCCCN1CCCCC1)[C@H](O)c1ccccc1	ZINC000875018688	EF	On-Demand	Anodyne	CCR3	27	41
CC[C@@H](NC(=O)NCCCN1CCCCC1)[C@H](O)c1ccccc1	ZINC000875018688	EF	On-Demand	Anodyne	CHRNA7	19	50
CC[C@@H](NC(=O)NCCCN1CCCCC1)[C@H](O)c1ccccc1	ZINC000875018688	EF	On-Demand	Anodyne	HNMT	47	34
CC[C@@H](NC(=O)NCCCN1CCCCC1)[C@H](O)c1ccccc1	ZINC000875018688	EF	On-Demand	Anodyne	CAPN2	16	44
CCOC(=O)c1cc(CNC(=O)NCCCN2CCC(C)CC2)on1	ZINC000875018691	FD	On-Demand	Anodyne	ADRA1A	47	36
CCOC(=O)c1cc(CNC(=O)NCCCN2CCC(C)CC2)on1	ZINC000875018691	FD	On-Demand	Anodyne	HTR4	54	36
CCOC(=O)c1cc(CNC(=O)NCCCN2CCC(C)CC2)on1	ZINC000875018691	FD	On-Demand	Anodyne	NPY1R	15	40
CCOC(=O)c1cc(CNC(=O)NCCCN2CCC(C)CC2)on1	ZINC000875018691	FD	On-Demand	Anodyne	CCR3	27	40
C[C@@H](NC(=O)NCCCN1CCCCC1)c1ccnn1C	ZINC000875018697	CD	On-Demand	Anodyne	HRH2	23	42
C[C@@H](NC(=O)NCCCN1CCCCC1)c1ccnn1C	ZINC000875018697	CD	On-Demand	Anodyne	DRD3	21	40
C[C@@H](NC(=O)NCCCN1CCCCC1)c1ccnn1C	ZINC000875018697	CD	On-Demand	Anodyne	CHRNA7	23	46
C[C@@H](NC(=O)NCCCN1CCCCC1)c1ccnn1C	ZINC000875018697	CD	On-Demand	Anodyne	HNMT	59	34
C[C@H](NC(=O)NCCCN1CCCCC1)c1ccnn1C	ZINC000875018698	CD	On-Demand	Anodyne	HRH2	23	42
C[C@H](NC(=O)NCCCN1CCCCC1)c1ccnn1C	ZINC000875018698	CD	On-Demand	Anodyne	DRD3	21	40
C[C@H](NC(=O)NCCCN1CCCCC1)c1ccnn1C	ZINC000875018698	CD	On-Demand	Anodyne	CHRNA7	23	46
C[C@H](NC(=O)NCCCN1CCCCC1)c1ccnn1C	ZINC000875018698	CD	On-Demand	Anodyne	HNMT	59	34
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)NC[C@H]1CCN1C1CCCCC1	ZINC000875018714	GD	On-Demand	Anodyne	NOS2	98	40
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)NC[C@@H]1CCN1C1CCCCC1	ZINC000875018715	GD	On-Demand	Anodyne	NOS2	98	40
COc1ccccc1[C@@H]1CN(C(=O)NCCCN2CCCCC2)CCO1	ZINC000875018720	FF	On-Demand	Anodyne	HTR1A	66	46
COc1ccccc1[C@@H]1CN(C(=O)NCCCN2CCCCC2)CCO1	ZINC000875018720	FF	On-Demand	Anodyne	DRD2	58	45
COc1ccccc1[C@@H]1CN(C(=O)NCCCN2CCCCC2)CCO1	ZINC000875018720	FF	On-Demand	Anodyne	DRD4	44	43
COc1ccccc1[C@@H]1CN(C(=O)NCCCN2CCCCC2)CCO1	ZINC000875018720	FF	On-Demand	Anodyne	ADRA1D	69	41
COc1ccccc1[C@@H]1CN(C(=O)NCCCN2CCCCC2)CCO1	ZINC000875018720	FF	On-Demand	Anodyne	HTR2A	35	42
COc1ccccc1[C@@H]1CN(C(=O)NCCCN2CCCCC2)CCO1	ZINC000875018720	FF	On-Demand	Anodyne	HTR2C	26	40
COc1ccccc1[C@@H]1CN(C(=O)NCCCN2CCCCC2)CCO1	ZINC000875018720	FF	On-Demand	Anodyne	ADRA1A	87	38
COc1ccccc1[C@@H]1CN(C(=O)NCCCN2CCCCC2)CCO1	ZINC000875018720	FF	On-Demand	Anodyne	ADRA1B	65	41
COc1ccccc1[C@@H]1CN(C(=O)NCCCN2CCCCC2)CCO1	ZINC000875018720	FF	On-Demand	Anodyne	DRD3	77	43
COc1ccccc1[C@@H]1CN(C(=O)NCCCN2CCCCC2)CCO1	ZINC000875018720	FF	On-Demand	Anodyne	HTR4	37	45
COc1ccccc1[C@@H]1CN(C(=O)NCCCN2CCCCC2)CCO1	ZINC000875018720	FF	On-Demand	Anodyne	HTR7	42	37
COc1ccccc1[C@@H]1CN(C(=O)NCCCN2CCCCC2)CCO1	ZINC000875018720	FF	On-Demand	Anodyne	HRH3	22	41
COc1ccccc1[C@@H]1CN(C(=O)NCCCN2CCCCC2)CCO1	ZINC000875018720	FF	On-Demand	Anodyne	SIGMAR1	24	45
COc1ccccc1[C@@H]1CN(C(=O)NCCCN2CCCCC2)CCO1	ZINC000875018720	FF	On-Demand	Anodyne	CCR3	27	42
COc1ccccc1[C@@H]1CN(C(=O)NCCCN2CCCCC2)CCO1	ZINC000875018720	FF	On-Demand	Anodyne	CHRNA7	23	52
COc1ccccc1[C@@H]1CN(C(=O)NCCCN2CCCCC2)CCO1	ZINC000875018720	FF	On-Demand	Anodyne	EBP	30	40
COc1ccccc1[C@H]1CN(C(=O)NCCCN2CCCCC2)CCO1	ZINC000875018721	FF	On-Demand	Anodyne	HTR1A	66	46
COc1ccccc1[C@H]1CN(C(=O)NCCCN2CCCCC2)CCO1	ZINC000875018721	FF	On-Demand	Anodyne	DRD2	58	45
COc1ccccc1[C@H]1CN(C(=O)NCCCN2CCCCC2)CCO1	ZINC000875018721	FF	On-Demand	Anodyne	DRD4	44	43
COc1ccccc1[C@H]1CN(C(=O)NCCCN2CCCCC2)CCO1	ZINC000875018721	FF	On-Demand	Anodyne	ADRA1D	69	41
COc1ccccc1[C@H]1CN(C(=O)NCCCN2CCCCC2)CCO1	ZINC000875018721	FF	On-Demand	Anodyne	HTR2A	35	42
COc1ccccc1[C@H]1CN(C(=O)NCCCN2CCCCC2)CCO1	ZINC000875018721	FF	On-Demand	Anodyne	HTR2C	26	40
COc1ccccc1[C@H]1CN(C(=O)NCCCN2CCCCC2)CCO1	ZINC000875018721	FF	On-Demand	Anodyne	ADRA1A	87	38
COc1ccccc1[C@H]1CN(C(=O)NCCCN2CCCCC2)CCO1	ZINC000875018721	FF	On-Demand	Anodyne	ADRA1B	65	41
COc1ccccc1[C@H]1CN(C(=O)NCCCN2CCCCC2)CCO1	ZINC000875018721	FF	On-Demand	Anodyne	DRD3	77	43
COc1ccccc1[C@H]1CN(C(=O)NCCCN2CCCCC2)CCO1	ZINC000875018721	FF	On-Demand	Anodyne	HTR4	37	45
COc1ccccc1[C@H]1CN(C(=O)NCCCN2CCCCC2)CCO1	ZINC000875018721	FF	On-Demand	Anodyne	HTR7	42	37
COc1ccccc1[C@H]1CN(C(=O)NCCCN2CCCCC2)CCO1	ZINC000875018721	FF	On-Demand	Anodyne	HRH3	22	41
COc1ccccc1[C@H]1CN(C(=O)NCCCN2CCCCC2)CCO1	ZINC000875018721	FF	On-Demand	Anodyne	SIGMAR1	24	45
COc1ccccc1[C@H]1CN(C(=O)NCCCN2CCCCC2)CCO1	ZINC000875018721	FF	On-Demand	Anodyne	CCR3	27	42
COc1ccccc1[C@H]1CN(C(=O)NCCCN2CCCCC2)CCO1	ZINC000875018721	FF	On-Demand	Anodyne	CHRNA7	23	52
COc1ccccc1[C@H]1CN(C(=O)NCCCN2CCCCC2)CCO1	ZINC000875018721	FF	On-Demand	Anodyne	EBP	30	40
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCCCCCNC(=O)CC1	ZINC000875018732	GD	On-Demand	Anodyne	DPP7	40	33
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCCCCCNC(=O)CC1	ZINC000875018733	GD	On-Demand	Anodyne	DPP7	40	33
O=C(NCCCN1CCCCC1)NCc1noc2ccc(F)cc12	ZINC000875018738	EF	On-Demand	Anodyne	DRD2	22	41
O=C(NCCCN1CCCCC1)NCc1noc2ccc(F)cc12	ZINC000875018738	EF	On-Demand	Anodyne	HTR2A	27	41
O=C(NCCCN1CCCCC1)NCc1noc2ccc(F)cc12	ZINC000875018738	EF	On-Demand	Anodyne	HTR7	31	40
O=C(NCCCN1CCCCC1)NCc1noc2ccc(F)cc12	ZINC000875018738	EF	On-Demand	Anodyne	CCR3	26	43
O=C(NCCCN1CCCCC1)NCc1noc2ccc(F)cc12	ZINC000875018738	EF	On-Demand	Anodyne	CHRNA7	20	48
O=C(NCCCN1CCCCC1)NCc1noc2ccc(F)cc12	ZINC000875018738	EF	On-Demand	Anodyne	HNMT	57	35
COC(=O)c1c(NC(=O)c2sccc2CC#N)sc2c1CCC2	ZINC000875018741	EG	On-Demand	Mild	VIPR1	27	44
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)NCC(C1CCC1)C1CCC1	ZINC000875018748	GE	On-Demand	Anodyne	NOS2	96	38
O=C(NCCCN1CCCCC1)NCc1ccc(O)c(Cl)c1	ZINC000875018749	EF	On-Demand	Anodyne	HRH2	26	45
O=C(NCCCN1CCCCC1)NCc1ccc(O)c(Cl)c1	ZINC000875018749	EF	On-Demand	Anodyne	HRH3	33	50
O=C(NCCCN1CCCCC1)NCc1ccc(O)c(Cl)c1	ZINC000875018749	EF	On-Demand	Anodyne	SIGMAR1	23	41
O=C(NCCCN1CCCCC1)NCc1ccc(O)c(Cl)c1	ZINC000875018749	EF	On-Demand	Anodyne	CCR3	24	46
O=C(NCCCN1CCCCC1)NCc1ccc(O)c(Cl)c1	ZINC000875018749	EF	On-Demand	Anodyne	CHRNA7	17	48
O=C(NCCCN1CCCCC1)NCc1ccc(O)c(Cl)c1	ZINC000875018749	EF	On-Demand	Anodyne	HNMT	63	35
O=C(NCCCN1CCCCC1)NCc1ccc(O)c(Cl)c1	ZINC000875018749	EF	On-Demand	Anodyne	NCE103	15	45
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875018753	GF	On-Demand	Anodyne	ACE	69	48
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875018753	GF	On-Demand	Anodyne	FKBP1A	44	41
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875018753	GF	On-Demand	Anodyne	OPRM1	52	43
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875018753	GF	On-Demand	Anodyne	OPRD1	37	41
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875018753	GF	On-Demand	Anodyne	MME	34	45
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875018753	GF	On-Demand	Anodyne	NTSR1	102	36
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875018753	GF	On-Demand	Anodyne	NTSR2	84	33
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875018753	GF	On-Demand	Anodyne	HLA-A	53	35
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875018753	GF	On-Demand	Anodyne	PREP	40	39
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875018753	GF	On-Demand	Anodyne	SORT1	47	31
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875018753	GF	On-Demand	Anodyne	ACE2	34	43
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875018753	GF	On-Demand	Anodyne	XIAP	59	43
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875018753	GF	On-Demand	Anodyne	BIRC2	48	41
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875018753	GF	On-Demand	Anodyne	Q82323_9DELA	46	30
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875018754	GF	On-Demand	Anodyne	ACE	69	48
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875018754	GF	On-Demand	Anodyne	FKBP1A	44	41
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875018754	GF	On-Demand	Anodyne	OPRM1	52	43
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875018754	GF	On-Demand	Anodyne	OPRD1	37	41
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875018754	GF	On-Demand	Anodyne	MME	34	45
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875018754	GF	On-Demand	Anodyne	NTSR1	102	36
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875018754	GF	On-Demand	Anodyne	NTSR2	84	33
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875018754	GF	On-Demand	Anodyne	HLA-A	53	35
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875018754	GF	On-Demand	Anodyne	PREP	40	39
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875018754	GF	On-Demand	Anodyne	SORT1	47	31
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875018754	GF	On-Demand	Anodyne	ACE2	34	43
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875018754	GF	On-Demand	Anodyne	XIAP	59	43
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875018754	GF	On-Demand	Anodyne	BIRC2	48	41
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875018754	GF	On-Demand	Anodyne	Q82323_9DELA	46	30
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875018755	GF	On-Demand	Anodyne	ACE	69	48
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875018755	GF	On-Demand	Anodyne	FKBP1A	44	41
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875018755	GF	On-Demand	Anodyne	OPRM1	52	43
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875018755	GF	On-Demand	Anodyne	OPRD1	37	41
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875018755	GF	On-Demand	Anodyne	MME	34	45
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875018755	GF	On-Demand	Anodyne	NTSR1	102	36
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875018755	GF	On-Demand	Anodyne	NTSR2	84	33
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875018755	GF	On-Demand	Anodyne	HLA-A	53	35
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875018755	GF	On-Demand	Anodyne	PREP	40	39
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875018755	GF	On-Demand	Anodyne	SORT1	47	31
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875018755	GF	On-Demand	Anodyne	ACE2	34	43
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875018755	GF	On-Demand	Anodyne	XIAP	59	43
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875018755	GF	On-Demand	Anodyne	BIRC2	48	41
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875018755	GF	On-Demand	Anodyne	Q82323_9DELA	46	30
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875018756	GF	On-Demand	Anodyne	ACE	69	48
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875018756	GF	On-Demand	Anodyne	FKBP1A	44	41
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875018756	GF	On-Demand	Anodyne	OPRM1	52	43
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875018756	GF	On-Demand	Anodyne	OPRD1	37	41
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875018756	GF	On-Demand	Anodyne	MME	34	45
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875018756	GF	On-Demand	Anodyne	NTSR1	102	36
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875018756	GF	On-Demand	Anodyne	NTSR2	84	33
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875018756	GF	On-Demand	Anodyne	HLA-A	53	35
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875018756	GF	On-Demand	Anodyne	PREP	40	39
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875018756	GF	On-Demand	Anodyne	SORT1	47	31
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875018756	GF	On-Demand	Anodyne	ACE2	34	43
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875018756	GF	On-Demand	Anodyne	XIAP	59	43
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875018756	GF	On-Demand	Anodyne	BIRC2	48	41
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875018756	GF	On-Demand	Anodyne	Q82323_9DELA	46	30
CCn1c(S)nc2cc(C(=O)Nc3ncc(Cc4ccc(C(F)(F)F)cc4)s3)ccc2c1=O	ZINC000875018762	JK	On-Demand	Anodyne	SCD1	43	48
CCn1c(S)nc2cc(C(=O)Nc3ncc(Cc4ccc(C(F)(F)F)cc4)s3)ccc2c1=O	ZINC000875018762	JK	On-Demand	Anodyne	SCD	40	49
O=C(NCCCN1CCCCC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875018768	EF	On-Demand	Anodyne	HTR1A	29	42
O=C(NCCCN1CCCCC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875018768	EF	On-Demand	Anodyne	DRD2	21	42
O=C(NCCCN1CCCCC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875018768	EF	On-Demand	Anodyne	ADRA1D	31	41
O=C(NCCCN1CCCCC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875018768	EF	On-Demand	Anodyne	ADRA1A	50	38
O=C(NCCCN1CCCCC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875018768	EF	On-Demand	Anodyne	ADRA1B	42	41
O=C(NCCCN1CCCCC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875018768	EF	On-Demand	Anodyne	DRD3	39	42
O=C(NCCCN1CCCCC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875018768	EF	On-Demand	Anodyne	HTR4	24	42
O=C(NCCCN1CCCCC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875018768	EF	On-Demand	Anodyne	HRH3	24	40
O=C(NCCCN1CCCCC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875018768	EF	On-Demand	Anodyne	SIGMAR1	18	41
O=C(NCCCN1CCCCC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875018768	EF	On-Demand	Anodyne	CHRNA7	17	46
COc1ccc(C)cc1[C@@H](C)NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875018773	FD	On-Demand	Anodyne	EPHX2	19	40
CCCCCCCCCNC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875018784	FG	On-Demand	Mild	ASAH1	96	39
CCCCCCCCCNC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875018784	FG	On-Demand	Mild	L3MBTL3	43	40
O=C(NCC1(c2ccccc2)CC1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875018794	EC	On-Demand	Anodyne	KCNA3	47	42
O=C(NCC1(c2ccccc2)CC1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875018794	EC	On-Demand	Anodyne	NPFFR1	18	42
O=C(NCC1(c2ccccc2)CCC1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875018795	FE	On-Demand	Anodyne	KCNA3	45	37
O=C(NCC1(c2ccccc2)CCC1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875018796	FE	On-Demand	Anodyne	KCNA3	45	37
O=C(NCC1(c2ccccc2)CCC1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875018797	FE	On-Demand	Anodyne	KCNA3	45	37
O=C(NCC1(c2ccccc2)CCC1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875018798	FE	On-Demand	Anodyne	KCNA3	45	37
C[C@H](NC(=O)C(=O)NCC[C@@H]1CCSC1)c1nc2ccccc2n1C(F)F	ZINC000875018800	GF	On-Demand	Anodyne	PDE6D	55	35
C[C@H](NC(=O)C(=O)NCC[C@H]1CCSC1)c1nc2ccccc2n1C(F)F	ZINC000875018801	GF	On-Demand	Anodyne	PDE6D	55	35
CCOc1ccc([C@@H](C)NC(=O)C(=O)N2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000875018808	GG	On-Demand	Anodyne	ACACB	22	44
CCOc1ccc([C@@H](C)NC(=O)C(=O)N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)cc1	ZINC000875018821	FE	On-Demand	Anodyne	ACACA	24	40
CCOc1ccc([C@@H](C)NC(=O)C(=O)N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)cc1	ZINC000875018821	FE	On-Demand	Anodyne	ACACB	25	45
CCOc1ccc([C@H](C)NC(=O)C(=O)N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)cc1	ZINC000875018823	FE	On-Demand	Anodyne	ACACA	24	40
CCOc1ccc([C@H](C)NC(=O)C(=O)N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)cc1	ZINC000875018823	FE	On-Demand	Anodyne	ACACB	25	45
CCCCCCCCCNC(=O)N(C)CC1(C)COC1	ZINC000875018836	CG	On-Demand	Mild	ASAH1	59	31
CCOc1ccc([C@H](C)NC(=O)C(=O)NCCCCC2CC2)cc1	ZINC000875018841	EF	On-Demand	Anodyne	ACACA	24	42
CCOc1ccc([C@H](C)NC(=O)C(=O)NCCCCC2CC2)cc1	ZINC000875018841	EF	On-Demand	Anodyne	ACACB	28	47
CCOc1ccc([C@@H](C)NC(=O)C(=O)NCCCCC2CC2)cc1	ZINC000875018843	EF	On-Demand	Anodyne	ACACA	24	42
CCOc1ccc([C@@H](C)NC(=O)C(=O)NCCCCC2CC2)cc1	ZINC000875018843	EF	On-Demand	Anodyne	ACACB	28	47
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2(c3ccccc3)CCC2)C1	ZINC000875018866	EE	On-Demand	Anodyne	KCNA3	49	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2(c3ccccc3)CCC2)C1	ZINC000875018866	EE	On-Demand	Anodyne	HCN1	40	31
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2(c3ccccc3)CCC2)C1	ZINC000875018866	EE	On-Demand	Anodyne	HCN4	40	31
CC[C@H](C[C@H](C)O)NC(=O)NCCc1ccc2c(c1)OCO2	ZINC000875018867	DD	On-Demand	Anodyne	NOS2	40	38
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2(c3ccccc3)CCC2)C1	ZINC000875018869	EE	On-Demand	Anodyne	KCNA3	49	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2(c3ccccc3)CCC2)C1	ZINC000875018869	EE	On-Demand	Anodyne	HCN1	40	31
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2(c3ccccc3)CCC2)C1	ZINC000875018869	EE	On-Demand	Anodyne	HCN4	40	31
O=C(NCCCN1CCCCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875018897	EF	On-Demand	Anodyne	DRD2	20	50
O=C(NCCCN1CCCCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875018897	EF	On-Demand	Anodyne	ADRA1D	35	44
O=C(NCCCN1CCCCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875018897	EF	On-Demand	Anodyne	HTR2A	27	44
O=C(NCCCN1CCCCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875018897	EF	On-Demand	Anodyne	HTR2C	17	41
O=C(NCCCN1CCCCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875018897	EF	On-Demand	Anodyne	SLC6A1	83	43
O=C(NCCCN1CCCCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875018897	EF	On-Demand	Anodyne	ADRA1A	58	44
O=C(NCCCN1CCCCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875018897	EF	On-Demand	Anodyne	ADRA1B	48	46
O=C(NCCCN1CCCCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875018897	EF	On-Demand	Anodyne	DRD3	33	50
O=C(NCCCN1CCCCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875018897	EF	On-Demand	Anodyne	HTR4	29	42
O=C(NCCCN1CCCCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875018897	EF	On-Demand	Anodyne	HRH3	40	47
O=C(NCCCN1CCCCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875018897	EF	On-Demand	Anodyne	TRY1_BOVIN	48	33
O=C(NCCCN1CCCCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875018897	EF	On-Demand	Anodyne	CCR3	25	43
O=C(NCCCN1CCCCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875018897	EF	On-Demand	Anodyne	CHRNA7	16	46
O=C(NCCCN1CCCCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875018897	EF	On-Demand	Anodyne	HNMT	56	35
O=C(NCCCN1CCCCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875018897	EF	On-Demand	Anodyne	CYP2J2	43	30
O=C(NCCCN1CCCCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875018899	EF	On-Demand	Anodyne	DRD2	20	50
O=C(NCCCN1CCCCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875018899	EF	On-Demand	Anodyne	ADRA1D	35	44
O=C(NCCCN1CCCCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875018899	EF	On-Demand	Anodyne	HTR2A	27	44
O=C(NCCCN1CCCCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875018899	EF	On-Demand	Anodyne	HTR2C	17	41
O=C(NCCCN1CCCCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875018899	EF	On-Demand	Anodyne	SLC6A1	83	43
O=C(NCCCN1CCCCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875018899	EF	On-Demand	Anodyne	ADRA1A	58	44
O=C(NCCCN1CCCCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875018899	EF	On-Demand	Anodyne	ADRA1B	48	46
O=C(NCCCN1CCCCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875018899	EF	On-Demand	Anodyne	DRD3	33	50
O=C(NCCCN1CCCCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875018899	EF	On-Demand	Anodyne	HTR4	29	42
O=C(NCCCN1CCCCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875018899	EF	On-Demand	Anodyne	HRH3	40	47
O=C(NCCCN1CCCCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875018899	EF	On-Demand	Anodyne	TRY1_BOVIN	48	33
O=C(NCCCN1CCCCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875018899	EF	On-Demand	Anodyne	CCR3	25	43
O=C(NCCCN1CCCCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875018899	EF	On-Demand	Anodyne	CHRNA7	16	46
O=C(NCCCN1CCCCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875018899	EF	On-Demand	Anodyne	HNMT	56	35
O=C(NCCCN1CCCCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875018899	EF	On-Demand	Anodyne	CYP2J2	43	30
O=C(NCCCN1CCCCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875018901	EF	On-Demand	Anodyne	DRD2	20	50
O=C(NCCCN1CCCCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875018901	EF	On-Demand	Anodyne	ADRA1D	35	44
O=C(NCCCN1CCCCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875018901	EF	On-Demand	Anodyne	HTR2A	27	44
O=C(NCCCN1CCCCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875018901	EF	On-Demand	Anodyne	HTR2C	17	41
O=C(NCCCN1CCCCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875018901	EF	On-Demand	Anodyne	SLC6A1	83	43
O=C(NCCCN1CCCCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875018901	EF	On-Demand	Anodyne	ADRA1A	58	44
O=C(NCCCN1CCCCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875018901	EF	On-Demand	Anodyne	ADRA1B	48	46
O=C(NCCCN1CCCCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875018901	EF	On-Demand	Anodyne	DRD3	33	50
O=C(NCCCN1CCCCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875018901	EF	On-Demand	Anodyne	HTR4	29	42
O=C(NCCCN1CCCCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875018901	EF	On-Demand	Anodyne	HRH3	40	47
O=C(NCCCN1CCCCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875018901	EF	On-Demand	Anodyne	TRY1_BOVIN	48	33
O=C(NCCCN1CCCCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875018901	EF	On-Demand	Anodyne	CCR3	25	43
O=C(NCCCN1CCCCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875018901	EF	On-Demand	Anodyne	CHRNA7	16	46
O=C(NCCCN1CCCCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875018901	EF	On-Demand	Anodyne	HNMT	56	35
O=C(NCCCN1CCCCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875018901	EF	On-Demand	Anodyne	CYP2J2	43	30
CCOc1ccc([C@@H](C)NC(=O)C(=O)NCc2ncc(Cl)s2)cc1	ZINC000875018902	FF	On-Demand	Anodyne	ACACB	34	46
O=C(NCCCN1CCCCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875018903	EF	On-Demand	Anodyne	DRD2	20	50
O=C(NCCCN1CCCCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875018903	EF	On-Demand	Anodyne	ADRA1D	35	44
O=C(NCCCN1CCCCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875018903	EF	On-Demand	Anodyne	HTR2A	27	44
O=C(NCCCN1CCCCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875018903	EF	On-Demand	Anodyne	HTR2C	17	41
O=C(NCCCN1CCCCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875018903	EF	On-Demand	Anodyne	SLC6A1	83	43
O=C(NCCCN1CCCCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875018903	EF	On-Demand	Anodyne	ADRA1A	58	44
O=C(NCCCN1CCCCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875018903	EF	On-Demand	Anodyne	ADRA1B	48	46
O=C(NCCCN1CCCCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875018903	EF	On-Demand	Anodyne	DRD3	33	50
O=C(NCCCN1CCCCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875018903	EF	On-Demand	Anodyne	HTR4	29	42
O=C(NCCCN1CCCCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875018903	EF	On-Demand	Anodyne	HRH3	40	47
O=C(NCCCN1CCCCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875018903	EF	On-Demand	Anodyne	TRY1_BOVIN	48	33
O=C(NCCCN1CCCCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875018903	EF	On-Demand	Anodyne	CCR3	25	43
O=C(NCCCN1CCCCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875018903	EF	On-Demand	Anodyne	CHRNA7	16	46
O=C(NCCCN1CCCCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875018903	EF	On-Demand	Anodyne	HNMT	56	35
O=C(NCCCN1CCCCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875018903	EF	On-Demand	Anodyne	CYP2J2	43	30
CCCCCCCCCNC(=O)N1CCn2c(nnc2-c2cn(C)cn2)C1	ZINC000875018908	FF	On-Demand	Mild	ASAH1	91	35
COc1cccc([C@H](O)C2CCN(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000875018913	GG	On-Demand	Anodyne	HTR1A	30	43
COc1cccc([C@H](O)C2CCN(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000875018913	GG	On-Demand	Anodyne	DRD2	32	42
COc1cccc([C@H](O)C2CCN(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000875018913	GG	On-Demand	Anodyne	DRD4	51	38
COc1cccc([C@H](O)C2CCN(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000875018913	GG	On-Demand	Anodyne	HRH2	32	41
COc1cccc([C@H](O)C2CCN(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000875018913	GG	On-Demand	Anodyne	HTR2A	29	46
COc1cccc([C@H](O)C2CCN(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000875018913	GG	On-Demand	Anodyne	HTR2C	22	40
COc1cccc([C@H](O)C2CCN(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000875018913	GG	On-Demand	Anodyne	SLC6A4	17	42
COc1cccc([C@H](O)C2CCN(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000875018913	GG	On-Demand	Anodyne	ADRA1A	50	38
COc1cccc([C@H](O)C2CCN(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000875018913	GG	On-Demand	Anodyne	DRD3	55	43
COc1cccc([C@H](O)C2CCN(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000875018913	GG	On-Demand	Anodyne	OPRD1	15	45
COc1cccc([C@H](O)C2CCN(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000875018913	GG	On-Demand	Anodyne	HTR4	33	44
COc1cccc([C@H](O)C2CCN(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000875018913	GG	On-Demand	Anodyne	HRH3	35	44
COc1cccc([C@H](O)C2CCN(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000875018913	GG	On-Demand	Anodyne	SIGMAR1	21	41
COc1cccc([C@H](O)C2CCN(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000875018913	GG	On-Demand	Anodyne	NPY1R	19	40
COc1cccc([C@H](O)C2CCN(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000875018913	GG	On-Demand	Anodyne	CCR3	33	46
COc1cccc([C@H](O)C2CCN(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000875018913	GG	On-Demand	Anodyne	CCR5	22	40
COc1cccc([C@H](O)C2CCN(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000875018913	GG	On-Demand	Anodyne	CHRNA7	20	42
COc1cccc([C@H](O)C2CCN(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000875018913	GG	On-Demand	Anodyne	MTNR1A	40	37
COc1cccc([C@H](O)C2CCN(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000875018913	GG	On-Demand	Anodyne	MTNR1B	40	38
COc1cccc([C@H](O)C2CCN(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000875018913	GG	On-Demand	Anodyne	EBP	47	41
COc1cccc([C@H](O)C2CCN(C(=O)NCCCN3CCCCC3)CC2)c1	ZINC000875018913	GG	On-Demand	Anodyne	MCHR1	17	42
CCOc1ccc([C@H](C)NC(=O)C(=O)N2CCCCCCNC(=O)CC2)cc1	ZINC000875018916	GE	On-Demand	Anodyne	ACACB	17	43
CCOc1ccc([C@@H](C)NC(=O)C(=O)N2CCCCCCNC(=O)CC2)cc1	ZINC000875018917	GE	On-Demand	Anodyne	ACACB	17	43
CCOc1ccc([C@@H](C)NC(=O)C(=O)N[C@H](C)c2ccnn2C)cc1	ZINC000875018918	ED	On-Demand	Anodyne	ACACA	23	40
CCOc1ccc([C@@H](C)NC(=O)C(=O)N[C@H](C)c2ccnn2C)cc1	ZINC000875018918	ED	On-Demand	Anodyne	ACACB	25	50
CCOc1ccc([C@@H](C)NC(=O)C(=O)N[C@@H](C)c2ccnn2C)cc1	ZINC000875018919	ED	On-Demand	Anodyne	ACACA	23	40
CCOc1ccc([C@@H](C)NC(=O)C(=O)N[C@@H](C)c2ccnn2C)cc1	ZINC000875018919	ED	On-Demand	Anodyne	ACACB	25	50
CC[C@@H]1COCCN1CCNC(=O)NCCc1ccc2c(c1)OCO2	ZINC000875018926	ED	On-Demand	Anodyne	NOS2	95	42
CCOc1ccc([C@@H](C)NC(=O)C(=O)NC2CCC(C)(N(C)C)CC2)cc1	ZINC000875018937	GF	On-Demand	Anodyne	ACACA	21	41
CCOc1ccc([C@@H](C)NC(=O)C(=O)NC2CCC(C)(N(C)C)CC2)cc1	ZINC000875018937	GF	On-Demand	Anodyne	ACACB	23	46
CCOc1ccc([C@H](C)NC(=O)C(=O)NC2CCC(C)(N(C)C)CC2)cc1	ZINC000875018939	GF	On-Demand	Anodyne	ACACA	21	41
CCOc1ccc([C@H](C)NC(=O)C(=O)NC2CCC(C)(N(C)C)CC2)cc1	ZINC000875018939	GF	On-Demand	Anodyne	ACACB	23	46
O=CN1CCCN(C(=O)NCCc2ccc3c(c2)OCO3)CC1	ZINC000875018948	DC	On-Demand	Anodyne	BMP1	41	34
O=CN1CCCN(C(=O)NCCc2ccc3c(c2)OCO3)CC1	ZINC000875018948	DC	On-Demand	Anodyne	NOS2	98	40
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H](c3cccs3)C3CC3)CC2)CC1	ZINC000875018952	GD	On-Demand	Anodyne	L3MBTL3	59	42
CN1CCN(C2CCN(C(=O)C(=O)N[C@H](c3cccs3)C3CC3)CC2)CC1	ZINC000875018953	GD	On-Demand	Anodyne	L3MBTL3	59	42
O=C(NCC1(c2ccccc2)CCCC1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875018956	FD	On-Demand	Anodyne	KCNA3	46	40
O=C(NCC1(c2ccccc2)CCCC1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875018956	FD	On-Demand	Anodyne	NPFFR1	17	41
O=C(NCCc1ccc2c(c1)OCO2)NCC[C@H](O)C1CCCC1	ZINC000875018971	EE	On-Demand	Anodyne	BMP1	38	40
O=C(NCCc1ccc2c(c1)OCO2)NCC[C@H](O)C1CCCC1	ZINC000875018971	EE	On-Demand	Anodyne	NOS2	79	41
O=C(NCCc1ccc2c(c1)OCO2)NCC[C@H](O)C1CCCC1	ZINC000875018971	EE	On-Demand	Anodyne	MCHR1	19	41
O=C(NCCc1ccc2c(c1)OCO2)NCC[C@@H](O)C1CCCC1	ZINC000875018972	EE	On-Demand	Anodyne	BMP1	38	40
O=C(NCCc1ccc2c(c1)OCO2)NCC[C@@H](O)C1CCCC1	ZINC000875018972	EE	On-Demand	Anodyne	NOS2	79	41
O=C(NCCc1ccc2c(c1)OCO2)NCC[C@@H](O)C1CCCC1	ZINC000875018972	EE	On-Demand	Anodyne	MCHR1	19	41
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1nnc3n1CCC3)CC2	ZINC000875018973	GD	On-Demand	Anodyne	SLC18A2	46	33
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1nnc3n1CCC3)CC2	ZINC000875018974	GD	On-Demand	Anodyne	SLC18A2	46	33
CS[C@@H]1C[C@@H](NC(=O)NCCCN2CCCCC2)C1	ZINC000875018977	CE	On-Demand	Anodyne	CCR3	15	45
NC(=O)C1CC(NC(=O)NCCCN2CCCCC2)C1	ZINC000875018985	CC	On-Demand	Anodyne	CCR3	15	47
O=C(NCCCN1CCCCC1)NCc1ccc(CN2CCNC2=O)cc1	ZINC000875018991	FD	On-Demand	Anodyne	HRH2	25	46
O=C(NCCCN1CCCCC1)NCc1ccc(CN2CCNC2=O)cc1	ZINC000875018991	FD	On-Demand	Anodyne	HRH3	30	46
O=C(NCCCN1CCCCC1)NCc1ccc(CN2CCNC2=O)cc1	ZINC000875018991	FD	On-Demand	Anodyne	CCR3	22	49
O=C(NCCCN1CCCCC1)NCc1ccc(CN2CCNC2=O)cc1	ZINC000875018991	FD	On-Demand	Anodyne	HNMT	64	34
O=C(NCCCN1CCCCC1)NCc1ccc(CN2CCNC2=O)cc1	ZINC000875018991	FD	On-Demand	Anodyne	NAMPT	22	41
CC(C)(C)OC(=O)CN1CCC(NC(=O)NCCCN2CCCCC2)CC1	ZINC000875019001	GD	On-Demand	Anodyne	HRH2	18	43
CC(C)(C)OC(=O)CN1CCC(NC(=O)NCCCN2CCCCC2)CC1	ZINC000875019001	GD	On-Demand	Anodyne	HTR4	17	40
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1ccnc(Cl)c1	ZINC000875019011	GK	On-Demand	Anodyne	SCD1	48	52
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1ccnc(Cl)c1	ZINC000875019011	GK	On-Demand	Anodyne	SCD	44	52
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)CCc2ccc(O)cc2)C1	ZINC000875019015	ED	On-Demand	Anodyne	ACE	20	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)CCc2ccc(O)cc2)C1	ZINC000875019015	ED	On-Demand	Anodyne	OPRM1	30	45
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)CCc2ccc(O)cc2)C1	ZINC000875019015	ED	On-Demand	Anodyne	NTSR1	63	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)CCc2ccc(O)cc2)C1	ZINC000875019015	ED	On-Demand	Anodyne	HLA-A	41	30
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)CCc2ccc(O)cc2)C1	ZINC000875019015	ED	On-Demand	Anodyne	DPP7	59	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)CCc2ccc(O)cc2)C1	ZINC000875019015	ED	On-Demand	Anodyne	BIRC2	34	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)CCc2ccc(O)cc2)C1	ZINC000875019016	ED	On-Demand	Anodyne	ACE	20	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)CCc2ccc(O)cc2)C1	ZINC000875019016	ED	On-Demand	Anodyne	OPRM1	30	45
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)CCc2ccc(O)cc2)C1	ZINC000875019016	ED	On-Demand	Anodyne	NTSR1	63	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)CCc2ccc(O)cc2)C1	ZINC000875019016	ED	On-Demand	Anodyne	HLA-A	41	30
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)CCc2ccc(O)cc2)C1	ZINC000875019016	ED	On-Demand	Anodyne	DPP7	59	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)CCc2ccc(O)cc2)C1	ZINC000875019016	ED	On-Demand	Anodyne	BIRC2	34	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)CCc2ccc(O)cc2)C1	ZINC000875019017	ED	On-Demand	Anodyne	ACE	20	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)CCc2ccc(O)cc2)C1	ZINC000875019017	ED	On-Demand	Anodyne	OPRM1	30	45
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)CCc2ccc(O)cc2)C1	ZINC000875019017	ED	On-Demand	Anodyne	NTSR1	63	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)CCc2ccc(O)cc2)C1	ZINC000875019017	ED	On-Demand	Anodyne	HLA-A	41	30
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)CCc2ccc(O)cc2)C1	ZINC000875019017	ED	On-Demand	Anodyne	DPP7	59	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)CCc2ccc(O)cc2)C1	ZINC000875019017	ED	On-Demand	Anodyne	BIRC2	34	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)CCc2ccc(O)cc2)C1	ZINC000875019018	ED	On-Demand	Anodyne	ACE	20	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)CCc2ccc(O)cc2)C1	ZINC000875019018	ED	On-Demand	Anodyne	OPRM1	30	45
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)CCc2ccc(O)cc2)C1	ZINC000875019018	ED	On-Demand	Anodyne	NTSR1	63	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)CCc2ccc(O)cc2)C1	ZINC000875019018	ED	On-Demand	Anodyne	HLA-A	41	30
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)CCc2ccc(O)cc2)C1	ZINC000875019018	ED	On-Demand	Anodyne	DPP7	59	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)CCc2ccc(O)cc2)C1	ZINC000875019018	ED	On-Demand	Anodyne	BIRC2	34	41
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875019024	GF	On-Demand	Anodyne	ACE	21	42
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875019024	GF	On-Demand	Anodyne	NTSR1	98	35
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875019024	GF	On-Demand	Anodyne	NTSR2	78	34
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875019024	GF	On-Demand	Anodyne	BIRC2	41	41
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875019025	GF	On-Demand	Anodyne	ACE	21	42
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875019025	GF	On-Demand	Anodyne	NTSR1	98	35
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875019025	GF	On-Demand	Anodyne	NTSR2	78	34
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875019025	GF	On-Demand	Anodyne	BIRC2	41	41
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875019026	GF	On-Demand	Anodyne	ACE	21	42
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875019026	GF	On-Demand	Anodyne	NTSR1	98	35
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875019026	GF	On-Demand	Anodyne	NTSR2	78	34
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875019026	GF	On-Demand	Anodyne	BIRC2	41	41
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875019027	GF	On-Demand	Anodyne	ACE	21	42
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875019027	GF	On-Demand	Anodyne	NTSR1	98	35
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875019027	GF	On-Demand	Anodyne	NTSR2	78	34
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875019027	GF	On-Demand	Anodyne	BIRC2	41	41
O=C(NCC[C@@H]1CCCOC1)C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875019032	FC	On-Demand	Anodyne	NOS2	95	38
O=C(NCC[C@H]1CCCOC1)C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875019033	FC	On-Demand	Anodyne	NOS2	95	38
COc1ccc2cc(CNC(=O)C(=O)N3CCC(CO)(CO)CC3)ccc2c1	ZINC000875019034	GD	On-Demand	Anodyne	MTNR1A	43	36
COc1ccc2cc(CNC(=O)C(=O)N[C@H](C)c3cnc(C)s3)ccc2c1	ZINC000875019037	GG	On-Demand	Anodyne	ACACB	44	39
COc1ccc2cc(CNC(=O)C(=O)N[C@@H](C)c3cnc(C)s3)ccc2c1	ZINC000875019038	GG	On-Demand	Anodyne	ACACB	44	39
CC(=O)[C@H]1CCCN(C(=O)NCCCN2CCCCC2)C1	ZINC000875019039	CD	On-Demand	Anodyne	SLC6A1	54	35
CC(=O)[C@H]1CCCN(C(=O)NCCCN2CCCCC2)C1	ZINC000875019039	CD	On-Demand	Anodyne	HTR4	18	41
CC(=O)[C@H]1CCCN(C(=O)NCCCN2CCCCC2)C1	ZINC000875019039	CD	On-Demand	Anodyne	HRH3	18	40
CC(=O)[C@H]1CCCN(C(=O)NCCCN2CCCCC2)C1	ZINC000875019039	CD	On-Demand	Anodyne	CHRNA7	15	40
CC(=O)[C@@H]1CCCN(C(=O)NCCCN2CCCCC2)C1	ZINC000875019040	CD	On-Demand	Anodyne	SLC6A1	54	35
CC(=O)[C@@H]1CCCN(C(=O)NCCCN2CCCCC2)C1	ZINC000875019040	CD	On-Demand	Anodyne	HTR4	18	41
CC(=O)[C@@H]1CCCN(C(=O)NCCCN2CCCCC2)C1	ZINC000875019040	CD	On-Demand	Anodyne	HRH3	18	40
CC(=O)[C@@H]1CCCN(C(=O)NCCCN2CCCCC2)C1	ZINC000875019040	CD	On-Demand	Anodyne	CHRNA7	15	40
O=C(NCCCN1CCCCC1)N1CCC2(CCNC2=O)CC1	ZINC000875019041	DD	On-Demand	Anodyne	HNMT	48	34
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)NCCC[C@H]1C=CCC1	ZINC000875019042	EF	On-Demand	Anodyne	GRIA1	54	37
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)NCCC[C@H]1C=CCC1	ZINC000875019043	EF	On-Demand	Anodyne	GRIA1	54	37
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)NCCC[C@@H]1C=CCC1	ZINC000875019044	EF	On-Demand	Anodyne	GRIA1	54	37
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)NCCC[C@@H]1C=CCC1	ZINC000875019045	EF	On-Demand	Anodyne	GRIA1	54	37
COC(=O)c1c(NC(=O)c2coc(C#N)c2)sc2c1CCC2	ZINC000875019052	DF	On-Demand	Mild	VIPR1	25	40
CCCCCCCCCNC(=O)N1C[C@H]2C(=O)OC[C@H]2C1	ZINC000875019068	CF	On-Demand	Mild	ASAH1	102	41
CCCCCCCCCNC(=O)N1C[C@H]2C(=O)OC[C@H]2C1	ZINC000875019068	CF	On-Demand	Mild	LASR	41	36
O=C(NCCCN1CCCCC1)NCc1ccc(Br)cn1	ZINC000875019077	FF	On-Demand	Anodyne	HRH2	26	41
O=C(NCCCN1CCCCC1)NCc1ccc(Br)cn1	ZINC000875019077	FF	On-Demand	Anodyne	HRH3	30	40
O=C(NCCCN1CCCCC1)NCc1ccc(Br)cn1	ZINC000875019077	FF	On-Demand	Anodyne	CHRNA7	19	46
O=C(NCCCN1CCCCC1)NCc1ccc(Br)cn1	ZINC000875019077	FF	On-Demand	Anodyne	HNMT	65	37
CN1CCN(C2CCN(C(=O)NCCCN3CCCCC3)CC2)CC1	ZINC000875019081	FD	On-Demand	Anodyne	L3MBTL3	95	56
CCCCCCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)nc1	ZINC000875019084	FD	On-Demand	Mild	ASAH1	61	44
CCCCCCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)nc1	ZINC000875019084	FD	On-Demand	Mild	NAMPT	15	43
CCCCCCCCCNC(=O)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875019085	CG	On-Demand	Mild	GBA	17	40
CCCCCCCCCNC(=O)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875019085	CG	On-Demand	Mild	EPHX2	20	44
CCCCCCCCCNC(=O)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875019085	CG	On-Demand	Mild	ASAH1	104	42
CCCCCCCCCNC(=O)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875019086	CG	On-Demand	Mild	GBA	17	40
CCCCCCCCCNC(=O)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875019086	CG	On-Demand	Mild	EPHX2	20	44
CCCCCCCCCNC(=O)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875019086	CG	On-Demand	Mild	ASAH1	104	42
CCCCCCCCCNC(=O)N1CCN(c2nccnn2)CC1	ZINC000875019093	EE	On-Demand	Mild	ASAH1	99	38
CCCCCCCNC(=O)C(=O)NCc1coc(-c2cccs2)n1	ZINC000875019098	EG	On-Demand	Mild	ASAH1	59	35
CCCCCCCCCNC(=O)NNc1nnc(C)n1C	ZINC000875019108	CF	On-Demand	Reactive	ASAH1	103	41
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(N4CCOCC4)nc3)CC[C@H]21	ZINC000875019109	GC	On-Demand	Anodyne	NAMPT	15	40
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(N4CCOCC4)nc3)CC[C@@H]21	ZINC000875019111	GC	On-Demand	Anodyne	NAMPT	15	40
O=C(NCCC[C@H]1C=CCC1)C(=O)NCC1(c2ccccc2)CC1	ZINC000875019117	EF	On-Demand	Anodyne	KCNA3	47	39
O=C(NCCC[C@@H]1C=CCC1)C(=O)NCC1(c2ccccc2)CC1	ZINC000875019118	EF	On-Demand	Anodyne	KCNA3	47	39
O=C(COCc1ccnc(O)c1)Oc1ccc2c3c(c(=O)oc2c1)CCCCC3	ZINC000875019133	GG	On-Demand	Anodyne	MAOB	42	51
O=C(CNC(=O)NCc1ccc(O)c(Cl)c1)NC1CC1	ZINC000875019135	CD	On-Demand	Anodyne	NCE103	16	49
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1ccc(F)c(C)c1	ZINC000875019136	DD	On-Demand	Mild	LEF	42	38
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1ccc(F)c(C)c1	ZINC000875019138	DD	On-Demand	Mild	LEF	42	38
COC(=O)[C@@]12C[C@@H](NC(=O)NCCc3ccc4c(c3)OCO4)C[C@@H]1C2	ZINC000875019140	ED	On-Demand	Anodyne	BMP1	47	38
COC(=O)[C@@]12C[C@@H](NC(=O)NCCc3ccc4c(c3)OCO4)C[C@@H]1C2	ZINC000875019140	ED	On-Demand	Anodyne	NOS2	92	38
COC(=O)[C@@]12C[C@@H](NC(=O)NCCc3ccc4c(c3)OCO4)C[C@@H]1C2	ZINC000875019140	ED	On-Demand	Anodyne	MCHR1	18	49
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCC1(c2ccccc2)CC1	ZINC000875019148	FE	On-Demand	Anodyne	KCNA3	49	39
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCC1(c2ccccc2)CC1	ZINC000875019152	FE	On-Demand	Anodyne	KCNA3	49	39
CCOc1ccc([C@H](C)NC(=O)C(=O)NCCC(C)(C)COC)cc1	ZINC000875019154	FE	On-Demand	Anodyne	ACACA	20	40
CCOc1ccc([C@H](C)NC(=O)C(=O)NCCC(C)(C)COC)cc1	ZINC000875019154	FE	On-Demand	Anodyne	ACACB	21	47
CCOc1ccc([C@@H](C)NC(=O)C(=O)NCCC(C)(C)COC)cc1	ZINC000875019156	FE	On-Demand	Anodyne	ACACA	20	40
CCOc1ccc([C@@H](C)NC(=O)C(=O)NCCC(C)(C)COC)cc1	ZINC000875019156	FE	On-Demand	Anodyne	ACACB	21	47
O=C(NCCCCC1CC1)C(=O)NCC1(c2ccccc2)CC1	ZINC000875019157	DF	On-Demand	Anodyne	KCNA3	51	42
N#CCc1ccsc1C(=O)Nc1cc(Cl)ccc1N1CCOCC1	ZINC000875019159	FH	On-Demand	Mild	CSF1R	17	40
O=C(NCC[C@H]1CCSC1)C(=O)NCC1(c2ccccc2)CCC1	ZINC000875019168	EE	On-Demand	Anodyne	KCNA3	47	39
O=C(NCC[C@@H]1CCSC1)C(=O)NCC1(c2ccccc2)CCC1	ZINC000875019169	EE	On-Demand	Anodyne	KCNA3	47	39
O=C(NCc1ccc(Br)cn1)C(=O)NCC1(c2ccccc2)CC1	ZINC000875019171	GE	On-Demand	Anodyne	KCNA3	41	37
CCCCCCCCCNC(=O)N1CC[C@@H](O)C[C@H]1C	ZINC000875019185	CG	On-Demand	Mild	ASAH1	105	42
CCOc1ccc([C@@H](C)NC(=O)C(=O)N[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000875019188	GG	On-Demand	Anodyne	ACACB	27	47
CCOc1ccc([C@@H](C)NC(=O)C(=O)N[C@H](C)c2cc3cnccc3o2)cc1	ZINC000875019192	GG	On-Demand	Anodyne	ACACB	27	47
CCCCCCCCCNC(=O)N1CCC(CO)(CO)CC1	ZINC000875019242	DF	On-Demand	Mild	ASAH1	102	39
COCCN(CC1CCN(C)CC1)C(=O)NCCc1ccc2c(c1)OCO2	ZINC000875019243	GD	On-Demand	Anodyne	NOS2	86	39
COCCN(CC1CCN(C)CC1)C(=O)NCCc1ccc2c(c1)OCO2	ZINC000875019243	GD	On-Demand	Anodyne	MCHR1	23	44
C[C@@H](NC(=O)NCCCN1CCCCC1)c1ccns1	ZINC000875019248	CE	On-Demand	Anodyne	HRH2	22	42
C[C@@H](NC(=O)NCCCN1CCCCC1)c1ccns1	ZINC000875019248	CE	On-Demand	Anodyne	CHRNA7	19	44
C[C@@H](NC(=O)NCCCN1CCCCC1)c1ccns1	ZINC000875019248	CE	On-Demand	Anodyne	HNMT	58	34
C[C@H](NC(=O)NCCCN1CCCCC1)c1ccns1	ZINC000875019250	CE	On-Demand	Anodyne	HRH2	22	42
C[C@H](NC(=O)NCCCN1CCCCC1)c1ccns1	ZINC000875019250	CE	On-Demand	Anodyne	CHRNA7	19	44
C[C@H](NC(=O)NCCCN1CCCCC1)c1ccns1	ZINC000875019250	CE	On-Demand	Anodyne	HNMT	58	34
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](C)c1ccc(OCC)cc1	ZINC000875019254	ED	On-Demand	Mild	ACACA	26	42
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](C)c1ccc(OCC)cc1	ZINC000875019254	ED	On-Demand	Mild	ACACB	27	49
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](C)c1ccc(OCC)cc1	ZINC000875019255	ED	On-Demand	Mild	ACACA	26	42
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](C)c1ccc(OCC)cc1	ZINC000875019255	ED	On-Demand	Mild	ACACB	27	49
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H](C)c1ccc(OCC)cc1	ZINC000875019256	ED	On-Demand	Mild	ACACA	26	42
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H](C)c1ccc(OCC)cc1	ZINC000875019256	ED	On-Demand	Mild	ACACB	27	49
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H](C)c1ccc(OCC)cc1	ZINC000875019257	ED	On-Demand	Mild	ACACA	26	42
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H](C)c1ccc(OCC)cc1	ZINC000875019257	ED	On-Demand	Mild	ACACB	27	49
CN1CCN(C(=O)NCCc2ccc3c(c2)OCO3)CCC1(C)C	ZINC000875019267	EE	On-Demand	Anodyne	BMP1	43	37
CN1CCN(C(=O)NCCc2ccc3c(c2)OCO3)CCC1(C)C	ZINC000875019267	EE	On-Demand	Anodyne	NOS2	89	38
CCOc1ccc([C@H](C)NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875019268	ED	On-Demand	Anodyne	ACACA	20	40
CCOc1ccc([C@H](C)NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875019268	ED	On-Demand	Anodyne	ACACB	21	45
CCOc1ccc([C@@H](C)NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875019269	ED	On-Demand	Anodyne	ACACA	20	40
CCOc1ccc([C@@H](C)NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875019269	ED	On-Demand	Anodyne	ACACB	21	45
CCOc1ccc([C@@H](C)NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875019270	ED	On-Demand	Anodyne	ACACA	20	40
CCOc1ccc([C@@H](C)NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875019270	ED	On-Demand	Anodyne	ACACB	21	45
CCOc1ccc([C@H](C)NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875019271	ED	On-Demand	Anodyne	ACACA	20	40
CCOc1ccc([C@H](C)NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875019271	ED	On-Demand	Anodyne	ACACB	21	45
CCOc1ccc([C@H](C)NC(=O)C(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875019272	FC	On-Demand	Anodyne	ACACB	26	48
CC[C@@H](NC(=O)C(=O)N1CCC(C(C)=O)CC1)c1ccc(Cl)cc1	ZINC000875019290	FF	On-Demand	Anodyne	CCR1	46	38
CC[C@@H](NC(=O)C(=O)N1CCC(C(C)=O)CC1)c1ccc(Cl)cc1	ZINC000875019290	FF	On-Demand	Anodyne	UTS2	43	35
C[C@H](NC(=O)NCCCN1CCCCC1)c1cc2cnccc2o1	ZINC000875019313	EG	On-Demand	Anodyne	HRH2	25	43
C[C@H](NC(=O)NCCCN1CCCCC1)c1cc2cnccc2o1	ZINC000875019313	EG	On-Demand	Anodyne	CHRNA7	25	46
C[C@H](NC(=O)NCCCN1CCCCC1)c1cc2cnccc2o1	ZINC000875019313	EG	On-Demand	Anodyne	HNMT	44	31
C[C@H](NC(=O)NCCCN1CCCCC1)c1cc2cnccc2o1	ZINC000875019313	EG	On-Demand	Anodyne	NAMPT	24	43
C[C@@H](NC(=O)NCCCN1CCCCC1)c1cc2cnccc2o1	ZINC000875019314	EG	On-Demand	Anodyne	HRH2	25	43
C[C@@H](NC(=O)NCCCN1CCCCC1)c1cc2cnccc2o1	ZINC000875019314	EG	On-Demand	Anodyne	CHRNA7	25	46
C[C@@H](NC(=O)NCCCN1CCCCC1)c1cc2cnccc2o1	ZINC000875019314	EG	On-Demand	Anodyne	HNMT	44	31
C[C@@H](NC(=O)NCCCN1CCCCC1)c1cc2cnccc2o1	ZINC000875019314	EG	On-Demand	Anodyne	NAMPT	24	43
COc1ccc2cc(CNC(=O)C(=O)N3CCC[C@@H](C(C)=O)C3)ccc2c1	ZINC000875019324	FE	On-Demand	Anodyne	MTNR1A	45	38
COc1ccc2cc(CNC(=O)C(=O)N3CCC[C@@H](C(C)=O)C3)ccc2c1	ZINC000875019324	FE	On-Demand	Anodyne	DPP7	19	43
COc1ccc2cc(CNC(=O)C(=O)N3CCC[C@H](C(C)=O)C3)ccc2c1	ZINC000875019325	FE	On-Demand	Anodyne	MTNR1A	45	38
COc1ccc2cc(CNC(=O)C(=O)N3CCC[C@H](C(C)=O)C3)ccc2c1	ZINC000875019325	FE	On-Demand	Anodyne	DPP7	19	43
COc1ccc([C@@H]2CN(C(=O)NCCCN3CCCCC3)CCO2)cc1	ZINC000875019326	FF	On-Demand	Anodyne	DRD4	40	32
COc1ccc([C@@H]2CN(C(=O)NCCCN3CCCCC3)CCO2)cc1	ZINC000875019326	FF	On-Demand	Anodyne	SLC6A4	15	42
COc1ccc([C@@H]2CN(C(=O)NCCCN3CCCCC3)CCO2)cc1	ZINC000875019326	FF	On-Demand	Anodyne	ADRA1A	54	42
COc1ccc([C@@H]2CN(C(=O)NCCCN3CCCCC3)CCO2)cc1	ZINC000875019326	FF	On-Demand	Anodyne	ADRA1B	41	36
COc1ccc([C@@H]2CN(C(=O)NCCCN3CCCCC3)CCO2)cc1	ZINC000875019326	FF	On-Demand	Anodyne	DRD3	44	38
COc1ccc([C@@H]2CN(C(=O)NCCCN3CCCCC3)CCO2)cc1	ZINC000875019326	FF	On-Demand	Anodyne	HRH3	50	47
COc1ccc([C@@H]2CN(C(=O)NCCCN3CCCCC3)CCO2)cc1	ZINC000875019326	FF	On-Demand	Anodyne	MMP13	21	41
COc1ccc([C@@H]2CN(C(=O)NCCCN3CCCCC3)CCO2)cc1	ZINC000875019326	FF	On-Demand	Anodyne	MMP3	20	41
COc1ccc([C@@H]2CN(C(=O)NCCCN3CCCCC3)CCO2)cc1	ZINC000875019326	FF	On-Demand	Anodyne	MMP9	19	41
COc1ccc([C@@H]2CN(C(=O)NCCCN3CCCCC3)CCO2)cc1	ZINC000875019326	FF	On-Demand	Anodyne	MMP7	19	41
COc1ccc([C@@H]2CN(C(=O)NCCCN3CCCCC3)CCO2)cc1	ZINC000875019326	FF	On-Demand	Anodyne	MMP1	24	41
CN(C[C@@H]1CN(c2ccccc2)C(=O)O1)C(=O)NCCCN1CCCCC1	ZINC000875019346	FF	On-Demand	Anodyne	HTR1A	33	42
CN(C[C@@H]1CN(c2ccccc2)C(=O)O1)C(=O)NCCCN1CCCCC1	ZINC000875019346	FF	On-Demand	Anodyne	DRD2	27	40
CN(C[C@@H]1CN(c2ccccc2)C(=O)O1)C(=O)NCCCN1CCCCC1	ZINC000875019346	FF	On-Demand	Anodyne	ADRA1D	33	41
CN(C[C@@H]1CN(c2ccccc2)C(=O)O1)C(=O)NCCCN1CCCCC1	ZINC000875019346	FF	On-Demand	Anodyne	SLC6A1	60	37
CN(C[C@@H]1CN(c2ccccc2)C(=O)O1)C(=O)NCCCN1CCCCC1	ZINC000875019346	FF	On-Demand	Anodyne	ADRA1A	48	38
CN(C[C@@H]1CN(c2ccccc2)C(=O)O1)C(=O)NCCCN1CCCCC1	ZINC000875019346	FF	On-Demand	Anodyne	ADRA1B	33	41
CN(C[C@@H]1CN(c2ccccc2)C(=O)O1)C(=O)NCCCN1CCCCC1	ZINC000875019346	FF	On-Demand	Anodyne	DRD3	46	40
O=C(NCCCN1CCCCC1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875019350	EG	On-Demand	Anodyne	CCR3	15	43
O=C(NCCCN1CCCCC1)NCc1nc(O)c2c(n1)CCOC2	ZINC000875019356	EC	On-Demand	Anodyne	WNT3A	51	34
O=C(NCCCN1CCCCC1)NCC[C@H](O)C1CCCC1	ZINC000875019364	DE	On-Demand	Anodyne	CCR3	21	43
O=C(NCCCN1CCCCC1)NCC[C@@H](O)C1CCCC1	ZINC000875019366	DE	On-Demand	Anodyne	CCR3	21	43
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875019373	FD	On-Demand	Anodyne	NOS2	96	35
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875019376	FD	On-Demand	Anodyne	NOS2	96	35
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875019378	FD	On-Demand	Anodyne	NOS2	96	35
C[C@@H](NC(=O)NCCCN1CCCCC1)c1ccc(C(F)(F)F)nc1	ZINC000875019379	FG	On-Demand	Anodyne	HRH2	23	41
C[C@@H](NC(=O)NCCCN1CCCCC1)c1ccc(C(F)(F)F)nc1	ZINC000875019379	FG	On-Demand	Anodyne	DRD3	17	40
C[C@@H](NC(=O)NCCCN1CCCCC1)c1ccc(C(F)(F)F)nc1	ZINC000875019379	FG	On-Demand	Anodyne	TRPV1	57	45
C[C@@H](NC(=O)NCCCN1CCCCC1)c1ccc(C(F)(F)F)nc1	ZINC000875019379	FG	On-Demand	Anodyne	HRH3	16	40
C[C@@H](NC(=O)NCCCN1CCCCC1)c1ccc(C(F)(F)F)nc1	ZINC000875019379	FG	On-Demand	Anodyne	CHRNA7	16	45
C[C@@H](NC(=O)NCCCN1CCCCC1)c1ccc(C(F)(F)F)nc1	ZINC000875019379	FG	On-Demand	Anodyne	HNMT	41	34
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875019380	FD	On-Demand	Anodyne	NOS2	96	35
C[C@H](NC(=O)NCCCN1CCCCC1)c1ccc(C(F)(F)F)nc1	ZINC000875019381	FG	On-Demand	Anodyne	HRH2	23	41
C[C@H](NC(=O)NCCCN1CCCCC1)c1ccc(C(F)(F)F)nc1	ZINC000875019381	FG	On-Demand	Anodyne	DRD3	17	40
C[C@H](NC(=O)NCCCN1CCCCC1)c1ccc(C(F)(F)F)nc1	ZINC000875019381	FG	On-Demand	Anodyne	TRPV1	57	45
C[C@H](NC(=O)NCCCN1CCCCC1)c1ccc(C(F)(F)F)nc1	ZINC000875019381	FG	On-Demand	Anodyne	HRH3	16	40
C[C@H](NC(=O)NCCCN1CCCCC1)c1ccc(C(F)(F)F)nc1	ZINC000875019381	FG	On-Demand	Anodyne	CHRNA7	16	45
C[C@H](NC(=O)NCCCN1CCCCC1)c1ccc(C(F)(F)F)nc1	ZINC000875019381	FG	On-Demand	Anodyne	HNMT	41	34
COC(=O)N(C)NC(=O)NCCc1cc(C)ccc1OC	ZINC000875019382	CD	On-Demand	Reactive	MTNR1A	53	40
COC(=O)N(C)NC(=O)NCCc1cc(C)ccc1OC	ZINC000875019382	CD	On-Demand	Reactive	MTNR1B	36	41
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875019384	GD	On-Demand	Anodyne	NOS2	86	36
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875019386	GD	On-Demand	Anodyne	NOS2	86	36
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875019388	GD	On-Demand	Anodyne	NOS2	86	36
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875019391	GD	On-Demand	Anodyne	NOS2	86	36
CC[C@@H](NC(=O)C(=O)N[C@@H](C)c1cc2cnccc2o1)c1ccc(Cl)cc1	ZINC000875019396	GH	On-Demand	Anodyne	UTS2	42	32
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)NC[C@@H]1CCCN1CC(F)F	ZINC000875019397	GC	On-Demand	Anodyne	NOS2	100	39
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)NC[C@H]1CCCN1CC(F)F	ZINC000875019399	GC	On-Demand	Anodyne	NOS2	100	39
CC[C@@H](NC(=O)C(=O)N[C@H](C)c1cc2cnccc2o1)c1ccc(Cl)cc1	ZINC000875019400	GH	On-Demand	Anodyne	UTS2	42	32
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)N[C@H]1CO[C@H](C2CC2)C1	ZINC000875019416	FC	On-Demand	Anodyne	NOS2	92	34
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)N[C@H]1CO[C@@H](C2CC2)C1	ZINC000875019422	FC	On-Demand	Anodyne	NOS2	92	34
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)N[C@@H]1CO[C@@H](C2CC2)C1	ZINC000875019425	FC	On-Demand	Anodyne	NOS2	92	34
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)N[C@@H](C1CCC1)[C@H]1CCCO1	ZINC000875019434	GD	On-Demand	Anodyne	NOS2	83	35
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)N[C@H](C1CCC1)[C@@H]1CCCO1	ZINC000875019438	GD	On-Demand	Anodyne	NOS2	83	35
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)N[C@H](C1CCC1)[C@H]1CCCO1	ZINC000875019440	GD	On-Demand	Anodyne	NOS2	83	35
CCOc1ccc([C@@H](C)NC(=O)C(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875019442	FC	On-Demand	Anodyne	ACACB	26	48
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)N[C@@H](C1CCC1)[C@@H]1CCCO1	ZINC000875019443	GD	On-Demand	Anodyne	NOS2	83	35
C#CC[C@@H](COC)NC(=O)C(=O)NCC1(c2ccccc2)CCCC1	ZINC000875019465	ED	On-Demand	Mild	KCNA3	48	39
C#CC[C@H](COC)NC(=O)C(=O)NCC1(c2ccccc2)CCCC1	ZINC000875019469	ED	On-Demand	Mild	KCNA3	48	39
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875019499	FE	On-Demand	Anodyne	YARS	74	36
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875019502	FE	On-Demand	Anodyne	YARS	74	36
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875019505	FE	On-Demand	Anodyne	YARS	74	36
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875019507	FE	On-Demand	Anodyne	YARS	74	36
CCOc1ccc([C@H](C)NC(=O)C(=O)NCCC2CCN(C(C)C)CC2)cc1	ZINC000875019535	GF	On-Demand	Anodyne	ACACB	20	44
CCOc1ccc([C@H](C)NC(=O)C(=O)NCCC2CCN(C(C)C)CC2)cc1	ZINC000875019535	GF	On-Demand	Anodyne	SIRT3	40	31
CCOc1ccc([C@H](C)NC(=O)C(=O)NCCC2CCN(C(C)C)CC2)cc1	ZINC000875019535	GF	On-Demand	Anodyne	SIRT2	44	31
CCOc1ccc([C@H](C)NC(=O)C(=O)NCCC2CCN(C(C)C)CC2)cc1	ZINC000875019535	GF	On-Demand	Anodyne	SIRT1	40	31
CCOc1ccc([C@@H](C)NC(=O)C(=O)NCCC2CCN(C(C)C)CC2)cc1	ZINC000875019537	GF	On-Demand	Anodyne	ACACB	20	44
CCOc1ccc([C@@H](C)NC(=O)C(=O)NCCC2CCN(C(C)C)CC2)cc1	ZINC000875019537	GF	On-Demand	Anodyne	SIRT3	40	31
CCOc1ccc([C@@H](C)NC(=O)C(=O)NCCC2CCN(C(C)C)CC2)cc1	ZINC000875019537	GF	On-Demand	Anodyne	SIRT2	44	31
CCOc1ccc([C@@H](C)NC(=O)C(=O)NCCC2CCN(C(C)C)CC2)cc1	ZINC000875019537	GF	On-Demand	Anodyne	SIRT1	40	31
COc1ccc2cc(CNC(=O)C(=O)NCC[C@@H]3CCCOC3)ccc2c1	ZINC000875019556	FE	On-Demand	Anodyne	MTNR1A	55	41
COc1ccc2cc(CNC(=O)C(=O)NCC[C@@H]3CCCOC3)ccc2c1	ZINC000875019556	FE	On-Demand	Anodyne	MTNR1B	45	37
COc1ccc2cc(CNC(=O)C(=O)NCC[C@H]3CCCOC3)ccc2c1	ZINC000875019558	FE	On-Demand	Anodyne	MTNR1A	55	41
COc1ccc2cc(CNC(=O)C(=O)NCC[C@H]3CCCOC3)ccc2c1	ZINC000875019558	FE	On-Demand	Anodyne	MTNR1B	45	37
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(F)c(C)c2)CC1	ZINC000875019564	DD	On-Demand	Anodyne	EPHX2	15	40
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCC2(c3ccccc3)CC2)C1	ZINC000875019565	ED	On-Demand	Anodyne	KCNA3	58	46
CCOc1ccc([C@H](C)NC(=O)C(=O)N2C[C@H](OC)CC[C@@H]2C)cc1	ZINC000875019575	EE	On-Demand	Anodyne	ACACA	25	40
CCOc1ccc([C@H](C)NC(=O)C(=O)N2C[C@H](OC)CC[C@@H]2C)cc1	ZINC000875019575	EE	On-Demand	Anodyne	ACACB	28	47
CCOc1ccc([C@H](C)NC(=O)C(=O)N2C[C@H](OC)CC[C@H]2C)cc1	ZINC000875019576	EE	On-Demand	Anodyne	ACACA	25	40
CCOc1ccc([C@H](C)NC(=O)C(=O)N2C[C@H](OC)CC[C@H]2C)cc1	ZINC000875019576	EE	On-Demand	Anodyne	ACACB	28	47
CCOc1ccc([C@H](C)NC(=O)C(=O)N2C[C@@H](OC)CC[C@H]2C)cc1	ZINC000875019577	EE	On-Demand	Anodyne	ACACA	25	40
CCOc1ccc([C@H](C)NC(=O)C(=O)N2C[C@@H](OC)CC[C@H]2C)cc1	ZINC000875019577	EE	On-Demand	Anodyne	ACACB	28	47
CCOc1ccc([C@H](C)NC(=O)C(=O)N2C[C@@H](OC)CC[C@@H]2C)cc1	ZINC000875019579	EE	On-Demand	Anodyne	ACACA	25	40
CCOc1ccc([C@H](C)NC(=O)C(=O)N2C[C@@H](OC)CC[C@@H]2C)cc1	ZINC000875019579	EE	On-Demand	Anodyne	ACACB	28	47
CCOc1ccc([C@@H](C)NC(=O)C(=O)N[C@H]2CC23CCC3)cc1	ZINC000875019581	DE	On-Demand	Anodyne	ACACA	22	40
CCOc1ccc([C@@H](C)NC(=O)C(=O)N[C@H]2CC23CCC3)cc1	ZINC000875019581	DE	On-Demand	Anodyne	ACACB	24	47
CCOc1ccc([C@@H](C)NC(=O)C(=O)N[C@@H]2CC23CCC3)cc1	ZINC000875019582	DE	On-Demand	Anodyne	ACACA	22	40
CCOc1ccc([C@@H](C)NC(=O)C(=O)N[C@@H]2CC23CCC3)cc1	ZINC000875019582	DE	On-Demand	Anodyne	ACACB	24	47
CC(=O)C1CCN(C(=O)C(=O)NCc2coc(-c3cccs3)n2)CC1	ZINC000875019594	FD	On-Demand	Anodyne	ETHR	48	40
O=C(NCc1coc(-c2cccs2)n1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875019599	GE	On-Demand	Anodyne	ETHR	41	38
O=C(NCc1coc(-c2cccs2)n1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875019602	GE	On-Demand	Anodyne	ETHR	41	38
O=C(NCc1coc(-c2cccs2)n1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875019603	GE	On-Demand	Anodyne	ETHR	41	38
O=C(NCc1coc(-c2cccs2)n1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875019605	GE	On-Demand	Anodyne	ETHR	41	38
CCOC(=O)[C@H](C)C1CN(C(=O)NCCn2c(C)nc3ccccc32)C1	ZINC000875019624	FE	On-Demand	Anodyne	PDE6D	62	44
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NCC2(c3ccccc3)CC2)CC1	ZINC000875019647	FC	On-Demand	Anodyne	KCNA3	45	39
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NCC2(c3ccccc3)CC2)CC1	ZINC000875019647	FC	On-Demand	Anodyne	SLC6A9	27	44
CCCCCCCCCNC(=O)N1CCC(c2nnnn2C)CC1	ZINC000875019651	EF	On-Demand	Mild	ASAH1	94	39
CCCCCCCCCNC(=O)N[C@@H]1COCC[C@H]1O	ZINC000875019652	CE	On-Demand	Mild	EPHX2	31	53
CCCCCCCCCNC(=O)N[C@@H]1COCC[C@H]1O	ZINC000875019652	CE	On-Demand	Mild	ASAH1	69	34
CCCCCCCCCNC(=O)N[C@@H]1COCC[C@H]1O	ZINC000875019652	CE	On-Demand	Mild	LASR	47	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)nc2)C1	ZINC000875019654	FC	On-Demand	Anodyne	NAMPT	19	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)nc2)C1	ZINC000875019655	FC	On-Demand	Anodyne	NAMPT	19	42
O=C1CCN(C(=O)C(=O)NCC2(c3ccccc3)CCC2)CCCCCCN1	ZINC000875019656	GE	On-Demand	Anodyne	KCNA3	31	44
O=C(NCCSCCC(F)(F)F)C(=O)NCC1(c2ccccc2)CC1	ZINC000875019657	FF	On-Demand	Anodyne	KCNA3	42	36
CCOC(=O)C1=CC[C@H](NC(=O)NCCCN2CCCCC2)C1	ZINC000875019663	DD	On-Demand	Anodyne	HRH2	20	42
CCOC(=O)C1=CC[C@H](NC(=O)NCCCN2CCCCC2)C1	ZINC000875019663	DD	On-Demand	Anodyne	CCR3	18	45
C=C1c2ccccc2C(=O)N1[C@@H](C)C(=O)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000875019675	JK	On-Demand	Anodyne	SCD	31	40
C=C1c2ccccc2C(=O)N1[C@H](C)C(=O)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000875019676	JK	On-Demand	Anodyne	SCD	31	40
C/C=C/C[C@H]1CCCN(C(=O)C(=O)NCc2ccc(-n3ccnc3)nc2)C1	ZINC000875019677	FE	On-Demand	Anodyne	NOS2	95	36
C/C=C\C[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(-n3ccnc3)nc2)C1	ZINC000875019678	FE	On-Demand	Anodyne	NOS2	95	36
C/C=C/C[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(-n3ccnc3)nc2)C1	ZINC000875019679	FE	On-Demand	Anodyne	NOS2	95	36
C/C=C\C[C@H]1CCCN(C(=O)C(=O)NCc2ccc(-n3ccnc3)nc2)C1	ZINC000875019680	FE	On-Demand	Anodyne	NOS2	95	36
CC[C@H](C[C@H](C)O)NC(=O)NCCCN(C)Cc1ccccc1	ZINC000875019687	DE	On-Demand	Anodyne	CTSB	43	36
CC[C@H](C[C@H](C)O)NC(=O)NCCCN(C)Cc1ccccc1	ZINC000875019687	DE	On-Demand	Anodyne	PAPA1_CARPA	49	40
CC[C@H](C[C@H](C)O)NC(=O)NCCCN(C)Cc1ccccc1	ZINC000875019687	DE	On-Demand	Anodyne	CAPN2	50	35
CC[C@H](C[C@H](C)O)NC(=O)NCCCN(C)Cc1ccccc1	ZINC000875019687	DE	On-Demand	Anodyne	NPR	41	33
O=C(NCCCN1CCCCC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875019699	FD	On-Demand	Anodyne	ETHR	52	37
O=C(NCCCN1CCCCC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875019700	FD	On-Demand	Anodyne	ETHR	52	37
COc1cc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)ccc1OC(F)F	ZINC000875019705	GH	On-Demand	Anodyne	PDE4A	31	42
COc1cc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)ccc1OC(F)F	ZINC000875019705	GH	On-Demand	Anodyne	PDE4D	22	40
COc1cc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)ccc1OC(F)F	ZINC000875019705	GH	On-Demand	Anodyne	EPHX2	15	40
O=C1CCN(C(=O)NCCc2ccc3c(c2)OCO3)CCCCCCN1	ZINC000875019721	FE	On-Demand	Anodyne	NOS2	83	40
COCC(C)(C)CCNC(=O)C(=O)N[C@@H](C)CCc1ccc(O)cc1	ZINC000875019724	FE	On-Demand	Anodyne	GRIA1	49	35
COCC(C)(C)CCNC(=O)C(=O)N[C@H](C)CCc1ccc(O)cc1	ZINC000875019726	FE	On-Demand	Anodyne	GRIA1	49	35
CC(C)(C)OC(=O)N1CCC(C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)CC1	ZINC000875019743	JK	On-Demand	Anodyne	SCD1	36	41
CC(C)(C)OC(=O)N1CCC(C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)CC1	ZINC000875019743	JK	On-Demand	Anodyne	GPR119	52	39
CC(C)(C)OC(=O)N1CCC(C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)CC1	ZINC000875019743	JK	On-Demand	Anodyne	SCD	34	44
O=C(NCCCN1CCCC1)NNc1cccc(F)c1Cl	ZINC000875019746	DF	On-Demand	Reactive	HTR1A	26	44
O=C(NCCCN1CCCC1)NNc1cccc(F)c1Cl	ZINC000875019746	DF	On-Demand	Reactive	DRD2	36	44
O=C(NCCCN1CCCC1)NNc1cccc(F)c1Cl	ZINC000875019746	DF	On-Demand	Reactive	HTR2A	37	43
O=C(NCCCN1CCCC1)NNc1cccc(F)c1Cl	ZINC000875019746	DF	On-Demand	Reactive	HTR2C	34	43
O=C(NCCCN1CCCC1)NNc1cccc(F)c1Cl	ZINC000875019746	DF	On-Demand	Reactive	SLC6A4	16	43
O=C(NCCCN1CCCC1)NNc1cccc(F)c1Cl	ZINC000875019746	DF	On-Demand	Reactive	DRD3	66	44
O=C(NCCCN1CCCC1)NNc1cccc(F)c1Cl	ZINC000875019746	DF	On-Demand	Reactive	CCR3	27	42
O=C(NCCCN1CCCC1)NNc1cccc(F)c1Cl	ZINC000875019746	DF	On-Demand	Reactive	CHRNA7	20	48
O=C(NCCCN1CCCC1)NNc1cccc(F)c1Cl	ZINC000875019746	DF	On-Demand	Reactive	HNMT	41	34
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccc(-n3ccnc3)nc2)C1	ZINC000875019751	FC	On-Demand	Anodyne	NOS2	92	38
COCC(C)(C)CCNC(=O)C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875019758	FD	On-Demand	Anodyne	NOS2	75	37
COC(=O)C1=NO[C@]2(CCN(C(=O)NCCc3ccc4c(c3)OCO4)C2)C1	ZINC000875019773	GD	On-Demand	Anodyne	BMP1	40	33
COC(=O)C1=NO[C@]2(CCN(C(=O)NCCc3ccc4c(c3)OCO4)C2)C1	ZINC000875019773	GD	On-Demand	Anodyne	NOS2	77	36
COC(=O)C1=NO[C@@]2(CCN(C(=O)NCCc3ccc4c(c3)OCO4)C2)C1	ZINC000875019775	GD	On-Demand	Anodyne	BMP1	40	33
COC(=O)C1=NO[C@@]2(CCN(C(=O)NCCc3ccc4c(c3)OCO4)C2)C1	ZINC000875019775	GD	On-Demand	Anodyne	NOS2	77	36
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875019776	FD	On-Demand	Anodyne	NOS2	97	35
O=C(NCCc1ccc2c(c1)OCO2)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875019783	FE	On-Demand	Anodyne	NOS2	90	41
O=C(NCCc1ccc2c(c1)OCO2)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875019783	FE	On-Demand	Anodyne	MCHR1	21	41
O=C(NCCc1ccc2c(c1)OCO2)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875019783	FE	On-Demand	Anodyne	LUXR	19	42
O=C(NCCc1ccc2c(c1)OCO2)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875019787	FE	On-Demand	Anodyne	NOS2	90	41
O=C(NCCc1ccc2c(c1)OCO2)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875019787	FE	On-Demand	Anodyne	MCHR1	21	41
O=C(NCCc1ccc2c(c1)OCO2)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875019787	FE	On-Demand	Anodyne	LUXR	19	42
O=C(NCCN1CC[C@@H](O)C1)NC[C@H]1COc2ccccc2C1	ZINC000875019797	DC	On-Demand	Anodyne	OPRK1	15	41
O=C(NCCN1CC[C@H](O)C1)NC[C@@H]1COc2ccccc2C1	ZINC000875019798	DC	On-Demand	Anodyne	OPRK1	15	41
O=C(NCCN1CC[C@@H](O)C1)NC[C@@H]1COc2ccccc2C1	ZINC000875019801	DC	On-Demand	Anodyne	OPRK1	15	41
O=C(NCCN1CC[C@H](O)C1)NC[C@H]1COc2ccccc2C1	ZINC000875019805	DC	On-Demand	Anodyne	OPRK1	15	41
COC(=O)N(C)NC(=O)NCc1ccc(OC(F)F)c(OC)c1	ZINC000875019806	ED	On-Demand	Reactive	MT-ND1	24	42
CC(=O)C1CCN(C(=O)C(=O)NCC2(c3ccccc3)CCC2)CC1	ZINC000875019819	EE	On-Demand	Anodyne	KCNA3	51	42
CC(=O)C1CCN(C(=O)C(=O)NCC2(c3ccccc3)CCC2)CC1	ZINC000875019819	EE	On-Demand	Anodyne	CACNA1G	15	48
CC(=O)C1CCN(C(=O)C(=O)NCC2(c3ccccc3)CCC2)CC1	ZINC000875019819	EE	On-Demand	Anodyne	HCN4	40	30
CCOc1ccc([C@@H](C)NC(=O)C(=O)NCc2nn(C)cc2C(F)F)cc1	ZINC000875019824	GE	On-Demand	Anodyne	ACACB	19	43
O=C(NCCCN1CCCCC1)N1Cc2cccnc2N2C[C@H](O)C[C@H]2C1	ZINC000875019829	FD	On-Demand	Anodyne	HNMT	44	33
CCCCCCCCCNC(=O)N[C@H]1CCOC[C@@H]1O	ZINC000875019842	CE	On-Demand	Mild	EPHX2	29	52
CCCCCCCCCNC(=O)N[C@H]1CCOC[C@@H]1O	ZINC000875019842	CE	On-Demand	Mild	ASAH1	82	38
CCCCCCCCCNC(=O)N[C@H]1CCOC[C@@H]1O	ZINC000875019842	CE	On-Demand	Mild	LASR	46	34
COC(=O)N(C)NC(=O)NCCCc1ccc(C)cc1C	ZINC000875019844	CE	On-Demand	Reactive	MTNR1A	26	41
CCCCCCCCCNC(=O)N[C@@H]1CCOC[C@@H]1O	ZINC000875019845	CE	On-Demand	Mild	EPHX2	29	52
CCCCCCCCCNC(=O)N[C@@H]1CCOC[C@@H]1O	ZINC000875019845	CE	On-Demand	Mild	ASAH1	82	38
CCCCCCCCCNC(=O)N[C@@H]1CCOC[C@@H]1O	ZINC000875019845	CE	On-Demand	Mild	LASR	46	34
CN(Cc1ccc2cc[nH]c2c1)C(=O)NCCCN1CCCCC1	ZINC000875019847	EG	On-Demand	Anodyne	ADRA1A	20	42
CN(Cc1ccc2cc[nH]c2c1)C(=O)NCCCN1CCCCC1	ZINC000875019847	EG	On-Demand	Anodyne	ADRA1B	15	42
CN(Cc1ccc2cc[nH]c2c1)C(=O)NCCCN1CCCCC1	ZINC000875019847	EG	On-Demand	Anodyne	HRH3	32	41
CN(Cc1ccc2cc[nH]c2c1)C(=O)NCCCN1CCCCC1	ZINC000875019847	EG	On-Demand	Anodyne	HNMT	50	31
CCCCCCCCCNC(=O)N[C@H]1CCOC[C@H]1O	ZINC000875019848	CE	On-Demand	Mild	EPHX2	29	52
CCCCCCCCCNC(=O)N[C@H]1CCOC[C@H]1O	ZINC000875019848	CE	On-Demand	Mild	ASAH1	82	38
CCCCCCCCCNC(=O)N[C@H]1CCOC[C@H]1O	ZINC000875019848	CE	On-Demand	Mild	LASR	46	34
CCCCCCCCCNC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875019849	CE	On-Demand	Mild	EPHX2	29	52
CCCCCCCCCNC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875019849	CE	On-Demand	Mild	ASAH1	82	38
CCCCCCCCCNC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875019849	CE	On-Demand	Mild	LASR	46	34
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1ccc(N2CCOCC2)nc1	ZINC000875019869	II	On-Demand	Anodyne	ITK	15	42
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1ccc(N2CCOCC2)nc1	ZINC000875019869	II	On-Demand	Anodyne	HDAC1	18	41
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1ccc(N2CCOCC2)nc1	ZINC000875019869	II	On-Demand	Anodyne	SCD1	41	46
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1ccc(N2CCOCC2)nc1	ZINC000875019869	II	On-Demand	Anodyne	SCD	40	48
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1ccc(N2CCOCC2)nc1	ZINC000875019869	II	On-Demand	Anodyne	DGAT1	30	41
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1ccc(N2CCOCC2)nc1	ZINC000875019869	II	On-Demand	Anodyne	HPGDS	19	49
CC(=O)C1CCN(C(=O)C(=O)NCC2(c3ccccc3)CC2)CC1	ZINC000875019871	ED	On-Demand	Anodyne	KCNA3	51	41
O=C(NCC1(c2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875019876	CD	On-Demand	Anodyne	KCNA3	48	41
O=C(NCC1(c2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875019877	CD	On-Demand	Anodyne	KCNA3	48	41
O=C(NCC1(c2ccccc2)CCC1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875019893	FC	On-Demand	Anodyne	KCNA3	46	40
O=C(NCC1(c2ccccc2)CCC1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875019893	FC	On-Demand	Anodyne	NPFFR1	16	41
CCn1nc(C)c(CN(C)C(=O)C(=O)NCc2ccc(-n3ccnc3)nc2)c1C	ZINC000875019903	GD	On-Demand	Anodyne	NOS2	50	31
CC(C)(C)OC(=O)NCCC(=O)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000875019909	IJ	On-Demand	Anodyne	SCD1	38	43
CC(C)(C)OC(=O)NCCC(=O)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000875019909	IJ	On-Demand	Anodyne	SCD	36	45
CCCCCCCCCNC(=O)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875019925	EF	On-Demand	Mild	ASAH1	99	42
CCCCCCCCCNC(=O)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875019928	EF	On-Demand	Mild	ASAH1	99	42
COC(=O)N(C)NC(=O)NCCCN1CCC(C)CC1	ZINC000875019929	CD	On-Demand	Reactive	CCR3	17	40
CCCCCCCCCNC(=O)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875019932	EF	On-Demand	Mild	ASAH1	99	42
CCCCCCCCCNC(=O)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875019936	EF	On-Demand	Mild	ASAH1	99	42
COCC1CC(NC(=O)NCCCN2CCCCC2)C1	ZINC000875019948	CD	On-Demand	Anodyne	HRH2	19	40
COCC1CC(NC(=O)NCCCN2CCCCC2)C1	ZINC000875019948	CD	On-Demand	Anodyne	CCR3	22	47
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1(c2ccccc2)CCC1	ZINC000875019964	ED	On-Demand	Mild	KCNA3	51	41
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1(c2ccccc2)CCC1	ZINC000875019966	ED	On-Demand	Mild	KCNA3	51	41
Cc1cncc([C@@H]2CCCN2C(=O)NCCCN2CCC(C)CC2)c1	ZINC000875019985	EG	On-Demand	Anodyne	ADRA1D	28	40
Cc1cncc([C@@H]2CCCN2C(=O)NCCCN2CCC(C)CC2)c1	ZINC000875019985	EG	On-Demand	Anodyne	ADRA1A	44	37
Cc1cncc([C@@H]2CCCN2C(=O)NCCCN2CCC(C)CC2)c1	ZINC000875019985	EG	On-Demand	Anodyne	ADRA1B	31	40
Cc1cncc([C@H]2CCCN2C(=O)NCCCN2CCC(C)CC2)c1	ZINC000875019988	EG	On-Demand	Anodyne	ADRA1D	28	40
Cc1cncc([C@H]2CCCN2C(=O)NCCCN2CCC(C)CC2)c1	ZINC000875019988	EG	On-Demand	Anodyne	ADRA1A	44	37
Cc1cncc([C@H]2CCCN2C(=O)NCCCN2CCC(C)CC2)c1	ZINC000875019988	EG	On-Demand	Anodyne	ADRA1B	31	40
O=C(NCc1cccc2ncccc12)C(=O)NCC1(c2ccccc2)CCC1	ZINC000875019990	FG	On-Demand	Anodyne	NMBR	66	36
C#CC[C@@H](COC)NC(=O)C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875020006	EC	On-Demand	Mild	NOS2	54	36
CCCCCCCCCNC(=O)N1CCOC[C@@H]1CNC(=O)NC	ZINC000875020009	EE	On-Demand	Mild	EPHX2	21	42
CCCCCCCCCNC(=O)N1CCOC[C@@H]1CNC(=O)NC	ZINC000875020009	EE	On-Demand	Mild	ASAH1	92	41
CCCCCCCCCNC(=O)N1CCOC[C@H]1CNC(=O)NC	ZINC000875020010	EE	On-Demand	Mild	EPHX2	21	42
CCCCCCCCCNC(=O)N1CCOC[C@H]1CNC(=O)NC	ZINC000875020010	EE	On-Demand	Mild	ASAH1	92	41
C#CC[C@H](COC)NC(=O)C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875020016	EC	On-Demand	Mild	NOS2	54	36
O=C(NCCCN1CCCCC1)NCc1ccnc(F)c1	ZINC000875020017	CD	On-Demand	Anodyne	DRD2	15	40
O=C(NCCCN1CCCCC1)NCc1ccnc(F)c1	ZINC000875020017	CD	On-Demand	Anodyne	HRH2	28	47
O=C(NCCCN1CCCCC1)NCc1ccnc(F)c1	ZINC000875020017	CD	On-Demand	Anodyne	ADRA1A	44	36
O=C(NCCCN1CCCCC1)NCc1ccnc(F)c1	ZINC000875020017	CD	On-Demand	Anodyne	DRD3	22	40
O=C(NCCCN1CCCCC1)NCc1ccnc(F)c1	ZINC000875020017	CD	On-Demand	Anodyne	HRP1_PLAFA	55	37
O=C(NCCCN1CCCCC1)NCc1ccnc(F)c1	ZINC000875020017	CD	On-Demand	Anodyne	HRH3	39	42
O=C(NCCCN1CCCCC1)NCc1ccnc(F)c1	ZINC000875020017	CD	On-Demand	Anodyne	CCR3	31	48
O=C(NCCCN1CCCCC1)NCc1ccnc(F)c1	ZINC000875020017	CD	On-Demand	Anodyne	CHRNA7	22	50
O=C(NCCCN1CCCCC1)NCc1ccnc(F)c1	ZINC000875020017	CD	On-Demand	Anodyne	HNMT	99	41
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1(c2ccccc2)CC1	ZINC000875020027	ED	On-Demand	Mild	KCNA3	51	41
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1(c2ccccc2)CC1	ZINC000875020028	ED	On-Demand	Mild	KCNA3	51	41
N#Cc1cccc([C@@H](NC(=O)NCC(=O)NC2CC2)C(F)(F)F)c1	ZINC000875020029	ED	On-Demand	Mild	CCR2	46	43
N#Cc1cccc([C@H](NC(=O)NCC(=O)NC2CC2)C(F)(F)F)c1	ZINC000875020030	ED	On-Demand	Mild	CCR2	46	43
O=C(NCC1(c2ccccc2)CCC1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875020031	GG	On-Demand	Anodyne	KCNA3	50	40
O=C(NCC1(c2ccccc2)CCC1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875020032	GG	On-Demand	Anodyne	KCNA3	50	40
O=C(CNC(=O)N[C@@H](Cc1cccnc1)C1CCCC1)NC1CC1	ZINC000875020042	ED	On-Demand	Anodyne	C3AR1	45	44
O=C(CNC(=O)N[C@H](Cc1cccnc1)C1CCCC1)NC1CC1	ZINC000875020043	ED	On-Demand	Anodyne	C3AR1	45	44
CC[C@@H](NC(=O)NCC(=O)NC1CC1)c1cccc(OC)c1OC	ZINC000875020044	ED	On-Demand	Anodyne	KCNA3	15	41
C[C@H]1CC(=O)N[C@@H](C(=O)Nc2nc(-c3cc(F)ccc3F)cs2)C1	ZINC000875020046	FF	On-Demand	Anodyne	MAOB	15	46
CC[C@@H](NC(=O)C(=O)NCc1cnn(CC)n1)c1ccc(Cl)cc1	ZINC000875020061	ED	On-Demand	Anodyne	UTS2	44	36
CC(=O)N(C)c1ccc(CNC(=O)NCCCN2CCC(C)CC2)cc1	ZINC000875020071	FF	On-Demand	Anodyne	CCR3	36	52
CC(=O)N(C)c1ccc(CNC(=O)NCCCN2CCC(C)CC2)cc1	ZINC000875020071	FF	On-Demand	Anodyne	CYP2J2	46	33
COc1ccc2cc(CNC(=O)C(=O)N3[C@H]4CC[C@H]3[C@@H](C)[C@@H](O)C4)ccc2c1	ZINC000875020085	GE	On-Demand	Anodyne	SLC6A3	26	45
COc1ccc2cc(CNC(=O)C(=O)N3[C@H]4CC[C@H]3[C@@H](C)[C@H](O)C4)ccc2c1	ZINC000875020088	GE	On-Demand	Anodyne	SLC6A3	26	45
COc1ccc2cc(CNC(=O)C(=O)N3[C@H]4CC[C@H]3[C@H](C)[C@@H](O)C4)ccc2c1	ZINC000875020091	GE	On-Demand	Anodyne	SLC6A3	26	45
COc1ccc2cc(CNC(=O)C(=O)N3[C@H]4CC[C@H]3[C@H](C)[C@H](O)C4)ccc2c1	ZINC000875020094	GE	On-Demand	Anodyne	SLC6A3	26	45
COCC(C)(C)CCNC(=O)C(=O)NCc1ccc2cc(OC)ccc2c1	ZINC000875020101	FF	On-Demand	Anodyne	MTNR1A	54	37
COCC(C)(C)CCNC(=O)C(=O)NCc1ccc2cc(OC)ccc2c1	ZINC000875020101	FF	On-Demand	Anodyne	MTNR1B	44	37
COCC(C)(C)CCNC(=O)C(=O)NCc1ccc2cc(OC)ccc2c1	ZINC000875020101	FF	On-Demand	Anodyne	PROKR1	47	31
CN1Cc2ccccc2[C@H]1CNC(=O)NCCCN1CCCCC1	ZINC000875020113	EE	On-Demand	Anodyne	DRD2	39	40
CN1Cc2ccccc2[C@H]1CNC(=O)NCCCN1CCCCC1	ZINC000875020113	EE	On-Demand	Anodyne	ADRA1A	52	36
CN1Cc2ccccc2[C@H]1CNC(=O)NCCCN1CCCCC1	ZINC000875020113	EE	On-Demand	Anodyne	DRD3	66	40
CN1Cc2ccccc2[C@H]1CNC(=O)NCCCN1CCCCC1	ZINC000875020113	EE	On-Demand	Anodyne	CCR3	26	40
CN1Cc2ccccc2[C@H]1CNC(=O)NCCCN1CCCCC1	ZINC000875020113	EE	On-Demand	Anodyne	CHRNA7	21	47
CN1Cc2ccccc2[C@@H]1CNC(=O)NCCCN1CCCCC1	ZINC000875020116	EE	On-Demand	Anodyne	DRD2	39	40
CN1Cc2ccccc2[C@@H]1CNC(=O)NCCCN1CCCCC1	ZINC000875020116	EE	On-Demand	Anodyne	ADRA1A	52	36
CN1Cc2ccccc2[C@@H]1CNC(=O)NCCCN1CCCCC1	ZINC000875020116	EE	On-Demand	Anodyne	DRD3	66	40
CN1Cc2ccccc2[C@@H]1CNC(=O)NCCCN1CCCCC1	ZINC000875020116	EE	On-Demand	Anodyne	CCR3	26	40
CN1Cc2ccccc2[C@@H]1CNC(=O)NCCCN1CCCCC1	ZINC000875020116	EE	On-Demand	Anodyne	CHRNA7	21	47
O=C(NCCCN1CCCCC1)NCc1cccc2ncccc12	ZINC000875020118	EF	On-Demand	Anodyne	HTR1A	33	45
O=C(NCCCN1CCCCC1)NCc1cccc2ncccc12	ZINC000875020118	EF	On-Demand	Anodyne	DRD2	28	45
O=C(NCCCN1CCCCC1)NCc1cccc2ncccc12	ZINC000875020118	EF	On-Demand	Anodyne	ACHE	18	40
O=C(NCCCN1CCCCC1)NCc1cccc2ncccc12	ZINC000875020118	EF	On-Demand	Anodyne	HRH2	28	45
O=C(NCCCN1CCCCC1)NCc1cccc2ncccc12	ZINC000875020118	EF	On-Demand	Anodyne	HTR2A	33	40
O=C(NCCCN1CCCCC1)NCc1cccc2ncccc12	ZINC000875020118	EF	On-Demand	Anodyne	DRD3	32	45
O=C(NCCCN1CCCCC1)NCc1cccc2ncccc12	ZINC000875020118	EF	On-Demand	Anodyne	HRP1_PLAFA	55	42
O=C(NCCCN1CCCCC1)NCc1cccc2ncccc12	ZINC000875020118	EF	On-Demand	Anodyne	HRH3	31	53
O=C(NCCCN1CCCCC1)NCc1cccc2ncccc12	ZINC000875020118	EF	On-Demand	Anodyne	CCR3	20	44
O=C(NCCCN1CCCCC1)NCc1cccc2ncccc12	ZINC000875020118	EF	On-Demand	Anodyne	CHRNA7	19	48
O=C(NCCCN1CCCCC1)NCc1cccc2ncccc12	ZINC000875020118	EF	On-Demand	Anodyne	HNMT	124	53
O=C(NCCCN1CCCCC1)NCc1cccc2ncccc12	ZINC000875020118	EF	On-Demand	Anodyne	NAMPT	20	40
O=C(NCC[C@H]1CC=CCC1)C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875020119	FD	On-Demand	Anodyne	NOS2	79	34
O=C(NCC[C@@H]1CC=CCC1)C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875020120	FD	On-Demand	Anodyne	NOS2	79	34
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCCCN1CCC(C)CC1)CC2	ZINC000875020121	FF	On-Demand	Anodyne	MCHR1	34	42
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875020140	EC	On-Demand	Anodyne	NOS2	95	37
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)N[C@H]1CC12CCC2	ZINC000875020142	EC	On-Demand	Anodyne	NOS2	95	37
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875020145	FC	On-Demand	Mild	NOS2	83	37
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875020147	FC	On-Demand	Mild	NOS2	83	37
O=C(NCCCN1CCCCC1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875020170	FE	On-Demand	Anodyne	HNMT	45	34
C=CC(C)(C)CCNC(=O)C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875020172	ED	On-Demand	Mild	NOS2	52	32
CC[C@@H](NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1)c1ccc(Cl)cc1	ZINC000875020183	GG	On-Demand	Anodyne	UTS2	47	38
N#Cc1ccc(N2CCN(C(=O)NCCCN3CCCCC3)CC2)cn1	ZINC000875020186	FD	On-Demand	Mild	HNMT	41	32
O=C(NCc1ccc(N2CCOCC2)nc1)C(=O)NCc1ncc(Cl)s1	ZINC000875020191	GC	On-Demand	Anodyne	NAMPT	17	46
CN1CC[C@H]2CN(C(=O)C(=O)NCC3(c4ccccc4)CC3)CC[C@H]21	ZINC000875020192	ED	On-Demand	Anodyne	KCNA3	50	40
CN1CC[C@H]2CN(C(=O)C(=O)NCC3(c4ccccc4)CC3)CC[C@@H]21	ZINC000875020194	ED	On-Demand	Anodyne	KCNA3	50	40
CCCCCCCCCNC(=O)N1[C@H]2CC[C@H]1[C@@H](C)[C@H](O)C2	ZINC000875020197	DH	On-Demand	Mild	ASAH1	99	40
CCCCCCCCCNC(=O)N1[C@H]2CC[C@H]1[C@H](C)[C@H](O)C2	ZINC000875020198	DH	On-Demand	Mild	ASAH1	99	40
CCCCCCCCCNC(=O)N1[C@H]2CC[C@H]1[C@H](C)[C@@H](O)C2	ZINC000875020199	DH	On-Demand	Mild	ASAH1	99	40
CCCCCCCCCNC(=O)N1[C@H]2CC[C@H]1[C@@H](C)[C@@H](O)C2	ZINC000875020200	DH	On-Demand	Mild	ASAH1	99	40
CCCCCCCCCNC(=O)N[C@@H]1CCS(=O)(=O)[C@@H]1C	ZINC000875020201	DF	On-Demand	Mild	EPHX2	23	53
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NCC2(c3ccccc3)CCC2)CC1	ZINC000875020206	GC	On-Demand	Anodyne	KCNA3	44	38
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NCC2(c3ccccc3)CCC2)CC1	ZINC000875020206	GC	On-Demand	Anodyne	SLC6A9	26	43
CC[C@@H](NC(=O)C(=O)NCc1ccc(-n2ccnc2)nc1)c1cc(C)ccc1C	ZINC000875020208	GF	On-Demand	Anodyne	NOS2	56	32
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)N[C@@H](C)CCc2ccc(O)cc2)c1	ZINC000875020221	GF	On-Demand	Anodyne	NTSR1	86	33
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)N[C@@H](C)CCc2ccc(O)cc2)c1	ZINC000875020221	GF	On-Demand	Anodyne	NTSR2	66	33
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)N[C@@H](C)CCc2ccc(O)cc2)c1	ZINC000875020221	GF	On-Demand	Anodyne	HLA-A	44	32
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)N[C@@H](C)CCc2ccc(O)cc2)c1	ZINC000875020221	GF	On-Demand	Anodyne	BIRC2	21	41
Cc1cncc([C@H]2CCCN2C(=O)C(=O)N[C@@H](C)CCc2ccc(O)cc2)c1	ZINC000875020222	GF	On-Demand	Anodyne	NTSR1	86	33
Cc1cncc([C@H]2CCCN2C(=O)C(=O)N[C@@H](C)CCc2ccc(O)cc2)c1	ZINC000875020222	GF	On-Demand	Anodyne	NTSR2	66	33
Cc1cncc([C@H]2CCCN2C(=O)C(=O)N[C@@H](C)CCc2ccc(O)cc2)c1	ZINC000875020222	GF	On-Demand	Anodyne	HLA-A	44	32
Cc1cncc([C@H]2CCCN2C(=O)C(=O)N[C@@H](C)CCc2ccc(O)cc2)c1	ZINC000875020222	GF	On-Demand	Anodyne	BIRC2	21	41
Cc1cncc([C@H]2CCCN2C(=O)C(=O)N[C@H](C)CCc2ccc(O)cc2)c1	ZINC000875020223	GF	On-Demand	Anodyne	NTSR1	86	33
Cc1cncc([C@H]2CCCN2C(=O)C(=O)N[C@H](C)CCc2ccc(O)cc2)c1	ZINC000875020223	GF	On-Demand	Anodyne	NTSR2	66	33
Cc1cncc([C@H]2CCCN2C(=O)C(=O)N[C@H](C)CCc2ccc(O)cc2)c1	ZINC000875020223	GF	On-Demand	Anodyne	HLA-A	44	32
Cc1cncc([C@H]2CCCN2C(=O)C(=O)N[C@H](C)CCc2ccc(O)cc2)c1	ZINC000875020223	GF	On-Demand	Anodyne	BIRC2	21	41
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)N[C@H](C)CCc2ccc(O)cc2)c1	ZINC000875020224	GF	On-Demand	Anodyne	NTSR1	86	33
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)N[C@H](C)CCc2ccc(O)cc2)c1	ZINC000875020224	GF	On-Demand	Anodyne	NTSR2	66	33
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)N[C@H](C)CCc2ccc(O)cc2)c1	ZINC000875020224	GF	On-Demand	Anodyne	HLA-A	44	32
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)N[C@H](C)CCc2ccc(O)cc2)c1	ZINC000875020224	GF	On-Demand	Anodyne	BIRC2	21	41
CCCCCCCNC(=O)C(=O)NCCc1nnc2n1CCCCC2	ZINC000875020231	ED	On-Demand	Mild	ASAH1	56	31
CN1CCN(C(=O)NCCCN2CCCCC2)Cc2cccnc21	ZINC000875020233	ED	On-Demand	Anodyne	HRH3	29	42
CN1CCN(C(=O)NCCCN2CCCCC2)Cc2cccnc21	ZINC000875020233	ED	On-Demand	Anodyne	CHRNA7	19	43
CN1CCN(C(=O)NCCCN2CCCCC2)Cc2cccnc21	ZINC000875020233	ED	On-Demand	Anodyne	HNMT	76	37
CCCCCCCCCNC(=O)N1CCn2nnc(CO)c2C1	ZINC000875020287	DE	On-Demand	Mild	ASAH1	92	37
CCC(F)(F)C(C)(C)CNC(=O)C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875020314	GE	On-Demand	Anodyne	NOS2	59	34
CCOC[C@H]1CN(C(=O)C(=O)NCc2ccc(-n3ccnc3)nc2)CCO1	ZINC000875020323	FC	On-Demand	Anodyne	NOS2	103	37
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(-n4ccnc4)nc3)CC[C@@H]21	ZINC000875020331	FC	On-Demand	Anodyne	NOS2	96	36
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(-n4ccnc4)nc3)CC[C@@H]21	ZINC000875020331	FC	On-Demand	Anodyne	NAMPT	19	45
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(-n4ccnc4)nc3)CC[C@H]21	ZINC000875020333	FC	On-Demand	Anodyne	NOS2	96	36
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(-n4ccnc4)nc3)CC[C@H]21	ZINC000875020333	FC	On-Demand	Anodyne	NAMPT	19	45
CC[C@@H](NC(=O)C(=O)NCc1ncc(Cl)s1)c1ccc(Cl)cc1	ZINC000875020353	FG	On-Demand	Anodyne	FFAR2	25	44
CCCCCCCCCNC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875020364	DG	On-Demand	Mild	ASAH1	108	42
CCCCCCCNC(=O)C(=O)NCc1ccc(OC)nc1	ZINC000875020375	DD	On-Demand	Mild	LPAR2	62	39
CCCCCCCNC(=O)C(=O)NCc1ccc(OC)nc1	ZINC000875020375	DD	On-Demand	Mild	S1PR2	67	39
CCCCCCCNC(=O)C(=O)NCc1ccc(OC)nc1	ZINC000875020375	DD	On-Demand	Mild	ASAH1	77	34
CCn1ncc(CNC(=O)NCCCN2CCCCC2)n1	ZINC000875020390	CC	On-Demand	Anodyne	CHRNA7	21	46
CCn1ncc(CNC(=O)NCCCN2CCCCC2)n1	ZINC000875020390	CC	On-Demand	Anodyne	HNMT	53	34
O=C(NCCCCC1CC1)C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875020391	ED	On-Demand	Anodyne	NOS2	94	36
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(-n3ccnc3)nc2)CC1	ZINC000875020392	FC	On-Demand	Anodyne	NOS2	99	40
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(-n3ccnc3)nc2)CC1	ZINC000875020392	FC	On-Demand	Anodyne	NAMPT	31	51
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)NCC1([C@@H]2CCCCO2)CCC1	ZINC000875020395	GD	On-Demand	Anodyne	NOS2	96	37
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)NCC1([C@H]2CCCCO2)CCC1	ZINC000875020396	GD	On-Demand	Anodyne	NOS2	96	37
CCCCCCCCCNC(=O)N[C@@H]1C[C@H](CO)C1	ZINC000875020426	CF	On-Demand	Mild	EPHX2	40	63
CCCCCCCCCNC(=O)N[C@@H]1C[C@H](CO)C1	ZINC000875020426	CF	On-Demand	Mild	ASAH1	68	34
C=CC(C)(C)CCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)nc1	ZINC000875020427	FD	On-Demand	Mild	ADK	23	40
N#Cc1ccc(Cn2cc(NC(=O)NCCCN3CCCCC3)cn2)cc1	ZINC000875020438	FF	On-Demand	Mild	HRH2	36	42
N#Cc1ccc(Cn2cc(NC(=O)NCCCN3CCCCC3)cn2)cc1	ZINC000875020438	FF	On-Demand	Mild	HRH3	26	47
N#Cc1ccc(Cn2cc(NC(=O)NCCCN3CCCCC3)cn2)cc1	ZINC000875020438	FF	On-Demand	Mild	CCR3	46	55
N#Cc1ccc(Cn2cc(NC(=O)NCCCN3CCCCC3)cn2)cc1	ZINC000875020438	FF	On-Demand	Mild	CHRNA7	21	49
N#Cc1ccc(Cn2cc(NC(=O)NCCCN3CCCCC3)cn2)cc1	ZINC000875020438	FF	On-Demand	Mild	ITK	18	52
N#Cc1ccc(Cn2cc(NC(=O)NCCCN3CCCCC3)cn2)cc1	ZINC000875020438	FF	On-Demand	Mild	HNMT	47	30
CN1CCN(C2CCN(C(=O)C(=O)NCC3(c4ccccc4)CCC3)CC2)CC1	ZINC000875020439	GD	On-Demand	Anodyne	KCNA3	48	40
CN1CCN(C2CCN(C(=O)C(=O)NCC3(c4ccccc4)CCC3)CC2)CC1	ZINC000875020439	GD	On-Demand	Anodyne	L3MBTL3	81	42
O=C(NCc1ncc(Br)s1)C(=O)NCC1(c2ccccc2)CC1	ZINC000875020446	GE	On-Demand	Anodyne	KCNA3	44	36
C[C@H](NC(=O)C(=O)NCCCCC1CC1)c1nc2ccccc2n1C(F)F	ZINC000875020452	GG	On-Demand	Anodyne	PDE6D	54	35
CC[C@@H](NC(=O)C(=O)N1CCC(CO)(CO)CC1)c1ccc(Cl)cc1	ZINC000875020471	FD	On-Demand	Anodyne	CACNA1H	39	42
CC[C@@H](NC(=O)C(=O)N1CCC(CO)(CO)CC1)c1ccc(Cl)cc1	ZINC000875020471	FD	On-Demand	Anodyne	CCR1	48	37
CC[C@@H](NC(=O)C(=O)N1CCC(CO)(CO)CC1)c1ccc(Cl)cc1	ZINC000875020471	FD	On-Demand	Anodyne	AKT3	23	42
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)NCC[C@@H]1CCSC1	ZINC000875020488	FE	On-Demand	Anodyne	GRIA1	45	33
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)NCC[C@H]1CCSC1	ZINC000875020491	FE	On-Demand	Anodyne	GRIA1	45	33
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)NCC[C@@H]1CCSC1	ZINC000875020493	FE	On-Demand	Anodyne	GRIA1	45	33
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)NCC[C@H]1CCSC1	ZINC000875020494	FE	On-Demand	Anodyne	GRIA1	45	33
COc1ccc2cc(CNC(=O)C(=O)NCC[C@H]3CCSC3)ccc2c1	ZINC000875020496	FF	On-Demand	Anodyne	MTNR1A	37	40
COc1ccc2cc(CNC(=O)C(=O)NCC[C@@H]3CCSC3)ccc2c1	ZINC000875020499	FF	On-Demand	Anodyne	MTNR1A	37	40
CCCCCCCNC(=O)C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875020512	ED	On-Demand	Mild	NOS2	76	34
CCCCCCCNC(=O)C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875020512	ED	On-Demand	Mild	ASAH1	53	36
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875020514	FD	On-Demand	Anodyne	ACE	22	45
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875020514	FD	On-Demand	Anodyne	FKBP1A	24	42
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875020514	FD	On-Demand	Anodyne	NTSR1	94	34
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875020514	FD	On-Demand	Anodyne	NTSR2	79	32
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875020514	FD	On-Demand	Anodyne	HLA-A	44	31
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875020514	FD	On-Demand	Anodyne	SORT1	42	31
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875020514	FD	On-Demand	Anodyne	BIRC2	27	42
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875020516	FD	On-Demand	Anodyne	ACE	22	45
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875020516	FD	On-Demand	Anodyne	FKBP1A	24	42
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875020516	FD	On-Demand	Anodyne	NTSR1	94	34
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875020516	FD	On-Demand	Anodyne	NTSR2	79	32
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875020516	FD	On-Demand	Anodyne	HLA-A	44	31
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875020516	FD	On-Demand	Anodyne	SORT1	42	31
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875020516	FD	On-Demand	Anodyne	BIRC2	27	42
N#Cc1ccc(Cn2cc(NC(=O)NCCCOCC3CC3)cn2)cc1	ZINC000875020523	FF	On-Demand	Mild	CCR3	36	47
N#Cc1ccc(Cn2cc(NC(=O)NCCCOCC3CC3)cn2)cc1	ZINC000875020523	FF	On-Demand	Mild	ITK	18	51
N#Cc1ccc(Cn2cc(NC(=O)NCCCOCC3CC3)cn2)cc1	ZINC000875020523	FF	On-Demand	Mild	PANC	58	39
O=C(NCCCN1CCCCC1)NCc1ncc(Br)s1	ZINC000875020524	FF	On-Demand	Anodyne	CCR3	20	42
O=C(NCCCN1CCCCC1)NCc1ncc(Br)s1	ZINC000875020524	FF	On-Demand	Anodyne	HNMT	46	34
CC1(C)CCC[C@H]1CCNC(=O)C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875020542	FE	On-Demand	Anodyne	NOS2	98	38
Cc1nnc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)s1	ZINC000875020546	EG	On-Demand	Anodyne	LCK	15	42
Cc1nnc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)s1	ZINC000875020546	EG	On-Demand	Anodyne	KCNK3	43	34
CC[C@@H](NC(=O)C(=O)N[C@H](C)c1ccnn1C)c1ccc(Cl)cc1	ZINC000875020551	EF	On-Demand	Anodyne	UTS2	45	35
CC[C@@H](NC(=O)C(=O)N[C@@H](C)c1ccnn1C)c1ccc(Cl)cc1	ZINC000875020554	EF	On-Demand	Anodyne	UTS2	45	35
O=C(NCCCCCCc1ccccc1)C(=O)NCc1nnc2n1CCC2	ZINC000875020563	FD	On-Demand	Anodyne	ACE	30	42
O=C(NCCCCCCc1ccccc1)C(=O)NCc1nnc2n1CCC2	ZINC000875020563	FD	On-Demand	Anodyne	FKBP1A	24	42
O=C(NCCCCCCc1ccccc1)C(=O)NCc1nnc2n1CCC2	ZINC000875020563	FD	On-Demand	Anodyne	PREP	44	34
O=C(NCCCCCCc1ccccc1)C(=O)NCc1nnc2n1CCC2	ZINC000875020563	FD	On-Demand	Anodyne	FAAH	52	40
O=C(NCCCCCCc1ccccc1)C(=O)NCc1nnc2n1CCC2	ZINC000875020563	FD	On-Demand	Anodyne	CES1	54	34
O=C(NCCCCCCc1ccccc1)C(=O)NCc1nnc2n1CCC2	ZINC000875020563	FD	On-Demand	Anodyne	AMP1_PLAFQ	23	41
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)N1CCCC2(CC1)CC2	ZINC000875020573	FD	On-Demand	Anodyne	NOS2	95	35
O=C(NCCCN1CCCCC1)NCc1nc(-c2ccncc2)cs1	ZINC000875020576	FF	On-Demand	Anodyne	CHRNA7	20	48
O=C(NCCCN1CCCCC1)NCc1nc(-c2ccncc2)cs1	ZINC000875020576	FF	On-Demand	Anodyne	ROCK1	25	48
O=C(NCCCN1CCCCC1)NCc1nc(-c2ccncc2)cs1	ZINC000875020576	FF	On-Demand	Anodyne	ROCK2	18	48
O=C(NCCCN1CCCCC1)NCc1nc(-c2ccncc2)cs1	ZINC000875020576	FF	On-Demand	Anodyne	HNMT	48	33
COc1ccc2cc(CNC(=O)C(=O)N3CC[C@H](C(C)(C)O)C3)ccc2c1	ZINC000875020611	FE	On-Demand	Anodyne	MCHR1	17	42
COc1ccc2cc(CNC(=O)C(=O)N3CC[C@@H](C(C)(C)O)C3)ccc2c1	ZINC000875020612	FE	On-Demand	Anodyne	MCHR1	17	42
C#C[C@@H]1CC[C@@H](NC(=O)NCCCN2CCCCC2)CC1	ZINC000875020614	CE	On-Demand	Mild	CCR3	16	50
Cn1cnc(-c2nnc3n2CCN(C(=O)NCCCN2CCCCC2)C3)c1	ZINC000875020615	FD	On-Demand	Anodyne	P2RX7	21	40
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCCCN1CCCCC1)CC2	ZINC000875020621	FF	On-Demand	Anodyne	HRH3	18	55
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCCCN1CCCCC1)CC2	ZINC000875020621	FF	On-Demand	Anodyne	CHRNA7	22	45
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCCCN1CCCCC1)CC2	ZINC000875020621	FF	On-Demand	Anodyne	MCHR1	26	42
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)NCCCCC1CC1	ZINC000875020622	EF	On-Demand	Anodyne	OPRM1	18	43
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)NCCCCC1CC1	ZINC000875020622	EF	On-Demand	Anodyne	NTSR1	70	34
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)NCCCCC1CC1	ZINC000875020622	EF	On-Demand	Anodyne	NTSR2	69	31
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)NCCCCC1CC1	ZINC000875020622	EF	On-Demand	Anodyne	GRIA1	83	42
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)NCCCCC1CC1	ZINC000875020622	EF	On-Demand	Anodyne	SLC6A5	27	40
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)NCCCCC1CC1	ZINC000875020623	EF	On-Demand	Anodyne	OPRM1	18	43
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)NCCCCC1CC1	ZINC000875020623	EF	On-Demand	Anodyne	NTSR1	70	34
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)NCCCCC1CC1	ZINC000875020623	EF	On-Demand	Anodyne	NTSR2	69	31
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)NCCCCC1CC1	ZINC000875020623	EF	On-Demand	Anodyne	GRIA1	83	42
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)NCCCCC1CC1	ZINC000875020623	EF	On-Demand	Anodyne	SLC6A5	27	40
O=C(NCCCN1CCCCC1)NCc1ncc(Cl)s1	ZINC000875020626	DE	On-Demand	Anodyne	HRH3	27	43
O=C(NCCCN1CCCCC1)NCc1ncc(Cl)s1	ZINC000875020626	DE	On-Demand	Anodyne	CCR3	19	40
O=C(NCCCN1CCCCC1)NCc1ncc(Cl)s1	ZINC000875020626	DE	On-Demand	Anodyne	CHRNA7	16	46
O=C(NCCCN1CCCCC1)NCc1ncc(Cl)s1	ZINC000875020626	DE	On-Demand	Anodyne	HNMT	57	35
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)NC[C@@H]1CC[C@@H]2C[C@@H]2C1	ZINC000875020629	FD	On-Demand	Anodyne	NOS2	100	37
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)NC[C@@H]1CC[C@@H]2C[C@H]2C1	ZINC000875020630	FD	On-Demand	Anodyne	NOS2	100	37
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)NC[C@@H]1CC[C@H]2C[C@@H]2C1	ZINC000875020631	FD	On-Demand	Anodyne	NOS2	100	37
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)NC[C@@H]1CC[C@H]2C[C@H]2C1	ZINC000875020632	FD	On-Demand	Anodyne	NOS2	100	37
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)CCc2ccc(O)cc2)CC1	ZINC000875020634	ED	On-Demand	Anodyne	ACE	17	41
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)CCc2ccc(O)cc2)CC1	ZINC000875020634	ED	On-Demand	Anodyne	OPRM1	29	43
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)CCc2ccc(O)cc2)CC1	ZINC000875020634	ED	On-Demand	Anodyne	YARS	58	37
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)CCc2ccc(O)cc2)CC1	ZINC000875020634	ED	On-Demand	Anodyne	BIRC2	27	40
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)CCc2ccc(O)cc2)CC1	ZINC000875020635	ED	On-Demand	Anodyne	ACE	17	41
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)CCc2ccc(O)cc2)CC1	ZINC000875020635	ED	On-Demand	Anodyne	OPRM1	29	43
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)CCc2ccc(O)cc2)CC1	ZINC000875020635	ED	On-Demand	Anodyne	YARS	58	37
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)CCc2ccc(O)cc2)CC1	ZINC000875020635	ED	On-Demand	Anodyne	BIRC2	27	40
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)NCC1CC=CC1	ZINC000875020652	EC	On-Demand	Anodyne	NOS2	97	37
CONC(=O)C1CCN(C(=O)NCCc2cc(C)ccc2OC)CC1	ZINC000875020686	ED	On-Demand	Anodyne	EPHX2	27	42
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCc2ccc(-n3ccnc3)nc2)c1	ZINC000875020714	GD	On-Demand	Anodyne	NOS2	97	38
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCc2ccc(-n3ccnc3)nc2)c1	ZINC000875020715	GD	On-Demand	Anodyne	NOS2	97	38
CCC1(N(C)C)CCN(C(=O)C(=O)NCc2ccc(-n3ccnc3)nc2)CC1	ZINC000875020720	GD	On-Demand	Anodyne	NOS2	95	35
N#Cc1ccccc1N1CCC(NC(=O)NCCCOCC2CC2)CC1	ZINC000875020721	FF	On-Demand	Mild	DRD2	27	40
N#Cc1ccccc1N1CCC(NC(=O)NCCCOCC2CC2)CC1	ZINC000875020721	FF	On-Demand	Mild	DRD4	20	43
N#Cc1ccccc1N1CCC(NC(=O)NCCCOCC2CC2)CC1	ZINC000875020721	FF	On-Demand	Mild	DRD3	44	37
N#Cc1ccccc1N1CCC(NC(=O)NCCCOCC2CC2)CC1	ZINC000875020721	FF	On-Demand	Mild	NPY1R	15	41
O=C(NCCC[C@H]1C=CCC1)C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875020725	FD	On-Demand	Anodyne	NOS2	79	34
O=C(NCCC[C@@H]1C=CCC1)C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875020726	FD	On-Demand	Anodyne	NOS2	79	34
Cc1nccnc1[C@H](C)NC(=O)NCCCN1CCCCC1	ZINC000875020737	DE	On-Demand	Anodyne	HRH2	25	44
Cc1nccnc1[C@H](C)NC(=O)NCCCN1CCCCC1	ZINC000875020737	DE	On-Demand	Anodyne	HRH3	25	40
Cc1nccnc1[C@H](C)NC(=O)NCCCN1CCCCC1	ZINC000875020737	DE	On-Demand	Anodyne	CCR3	20	40
Cc1nccnc1[C@H](C)NC(=O)NCCCN1CCCCC1	ZINC000875020737	DE	On-Demand	Anodyne	CHRNA7	17	46
Cc1nccnc1[C@H](C)NC(=O)NCCCN1CCCCC1	ZINC000875020737	DE	On-Demand	Anodyne	HNMT	60	36
Cc1nccnc1[C@@H](C)NC(=O)NCCCN1CCCCC1	ZINC000875020738	DE	On-Demand	Anodyne	HRH2	25	44
Cc1nccnc1[C@@H](C)NC(=O)NCCCN1CCCCC1	ZINC000875020738	DE	On-Demand	Anodyne	HRH3	25	40
Cc1nccnc1[C@@H](C)NC(=O)NCCCN1CCCCC1	ZINC000875020738	DE	On-Demand	Anodyne	CCR3	20	40
Cc1nccnc1[C@@H](C)NC(=O)NCCCN1CCCCC1	ZINC000875020738	DE	On-Demand	Anodyne	CHRNA7	17	46
Cc1nccnc1[C@@H](C)NC(=O)NCCCN1CCCCC1	ZINC000875020738	DE	On-Demand	Anodyne	HNMT	60	36
O=C(NCC[C@@H]1CCSC1)C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875020740	FD	On-Demand	Anodyne	NOS2	85	35
O=C(NCC[C@H]1CCSC1)C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875020742	FD	On-Demand	Anodyne	NOS2	85	35
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)NC[C@@H]1CCN1C1CCCC1	ZINC000875020745	GD	On-Demand	Anodyne	NOS2	100	41
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CC[C@H]2[C@@H](CCN2C)C1	ZINC000875020746	FD	On-Demand	Anodyne	BIRC2	37	41
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)NC[C@H]1CCN1C1CCCC1	ZINC000875020747	GD	On-Demand	Anodyne	NOS2	100	41
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CC[C@H]2[C@H](CCN2C)C1	ZINC000875020748	FD	On-Demand	Anodyne	BIRC2	37	41
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CC[C@@H]2[C@H](CCN2C)C1	ZINC000875020750	FD	On-Demand	Anodyne	BIRC2	37	41
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CC[C@@H]2[C@@H](CCN2C)C1	ZINC000875020752	FD	On-Demand	Anodyne	BIRC2	37	41
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCOCC3CC3)C[C@@H]1C2	ZINC000875020759	DD	On-Demand	Anodyne	EPHX2	18	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCN(C)Cc1ccccc1	ZINC000875020765	FE	On-Demand	Anodyne	SLC6A4	20	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCN(C)Cc1ccccc1	ZINC000875020765	FE	On-Demand	Anodyne	SLC6A3	44	41
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875020768	GE	On-Demand	Anodyne	NOS2	85	35
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875020770	GE	On-Demand	Anodyne	NOS2	85	35
O=C(NCCCN1CCCCC1)NNC(=O)c1nc2ccccc2s1	ZINC000875020785	FE	On-Demand	Reactive	HTR1A	36	48
O=C(NCCCN1CCCCC1)NNC(=O)c1nc2ccccc2s1	ZINC000875020785	FE	On-Demand	Reactive	DRD2	41	48
O=C(NCCCN1CCCCC1)NNC(=O)c1nc2ccccc2s1	ZINC000875020785	FE	On-Demand	Reactive	DRD4	23	48
O=C(NCCCN1CCCCC1)NNC(=O)c1nc2ccccc2s1	ZINC000875020785	FE	On-Demand	Reactive	HTR2A	38	48
O=C(NCCCN1CCCCC1)NNC(=O)c1nc2ccccc2s1	ZINC000875020785	FE	On-Demand	Reactive	DRD3	60	43
O=C(NCCCN1CCCCC1)NNC(=O)c1nc2ccccc2s1	ZINC000875020785	FE	On-Demand	Reactive	LTA4H	26	44
O=C(NCCCN1CCCCC1)NNC(=O)c1nc2ccccc2s1	ZINC000875020785	FE	On-Demand	Reactive	HTR7	31	48
O=C(NCCCN1CCCCC1)NNC(=O)c1nc2ccccc2s1	ZINC000875020785	FE	On-Demand	Reactive	TRY1_BOVIN	37	40
O=C(NCCCN1CCCCC1)NNC(=O)c1nc2ccccc2s1	ZINC000875020785	FE	On-Demand	Reactive	CCR3	24	40
O=C(NCCCN1CCCCC1)NNC(=O)c1nc2ccccc2s1	ZINC000875020785	FE	On-Demand	Reactive	CHRNA7	24	50
O=C(NCCCN1CCCCC1)NNC(=O)c1nc2ccccc2s1	ZINC000875020785	FE	On-Demand	Reactive	HNMT	92	39
O=C(NCCCN1CCCCC1)NNC(=O)c1nc2ccccc2s1	ZINC000875020785	FE	On-Demand	Reactive	TPSAB1	16	42
O=C(NCCCN1CCCCC1)NNC(=O)c1nc2ccccc2s1	ZINC000875020785	FE	On-Demand	Reactive	ST14	52	37
O=C(NCCCN1CCCCC1)NNC(=O)c1nc2ccccc2s1	ZINC000875020785	FE	On-Demand	Reactive	TMPRSS6	81	37
N#Cc1ccc2c(c1)C[C@H](NC(=O)NCCCN1CCCCC1)C2	ZINC000875020797	EE	On-Demand	Mild	HRH2	24	41
N#Cc1ccc2c(c1)C[C@H](NC(=O)NCCCN1CCCCC1)C2	ZINC000875020797	EE	On-Demand	Mild	HRH3	17	42
N#Cc1ccc2c(c1)C[C@H](NC(=O)NCCCN1CCCCC1)C2	ZINC000875020797	EE	On-Demand	Mild	CCR3	32	48
N#Cc1ccc2c(c1)C[C@@H](NC(=O)NCCCN1CCCCC1)C2	ZINC000875020798	EE	On-Demand	Mild	HRH2	24	41
N#Cc1ccc2c(c1)C[C@@H](NC(=O)NCCCN1CCCCC1)C2	ZINC000875020798	EE	On-Demand	Mild	HRH3	17	42
N#Cc1ccc2c(c1)C[C@@H](NC(=O)NCCCN1CCCCC1)C2	ZINC000875020798	EE	On-Demand	Mild	CCR3	32	48
COc1ccc2cc(CNC(=O)C(=O)N3CCN(CCC#N)CC3)ccc2c1	ZINC000875020800	GD	On-Demand	Mild	DRD4	46	35
O=C(NCCCN1CCCCC1)NCc1cc2c(nc1O)CCCC2	ZINC000875020801	EE	On-Demand	Anodyne	HNMT	56	38
O=C(NCCCN1CCCCC1)NCc1noc2cc(F)ccc12	ZINC000875020812	EF	On-Demand	Anodyne	DRD2	27	45
O=C(NCCCN1CCCCC1)NCc1noc2cc(F)ccc12	ZINC000875020812	EF	On-Demand	Anodyne	HTR2A	33	43
O=C(NCCCN1CCCCC1)NCc1noc2cc(F)ccc12	ZINC000875020812	EF	On-Demand	Anodyne	ADRA1A	36	41
O=C(NCCCN1CCCCC1)NCc1noc2cc(F)ccc12	ZINC000875020812	EF	On-Demand	Anodyne	DRD3	20	41
O=C(NCCCN1CCCCC1)NCc1noc2cc(F)ccc12	ZINC000875020812	EF	On-Demand	Anodyne	HTR7	34	43
O=C(NCCCN1CCCCC1)NCc1noc2cc(F)ccc12	ZINC000875020812	EF	On-Demand	Anodyne	CCR3	26	43
O=C(NCCCN1CCCCC1)NCc1noc2cc(F)ccc12	ZINC000875020812	EF	On-Demand	Anodyne	CHRNA7	20	48
O=C(NCCCN1CCCCC1)NCc1noc2cc(F)ccc12	ZINC000875020812	EF	On-Demand	Anodyne	HNMT	52	35
O=C(NCCCN1CCCCC1)NCc1ccc2oc(O)nc2c1	ZINC000875020836	EE	On-Demand	Anodyne	HRH2	26	43
O=C(NCCCN1CCCCC1)NCc1ccc2oc(O)nc2c1	ZINC000875020836	EE	On-Demand	Anodyne	HRH3	19	41
O=C(NCCCN1CCCCC1)NCc1ccc2oc(O)nc2c1	ZINC000875020836	EE	On-Demand	Anodyne	CCR3	21	42
O=C(NCCCN1CCCCC1)NCc1ccc2oc(O)nc2c1	ZINC000875020836	EE	On-Demand	Anodyne	CHRNA7	20	40
O=C(NCCCN1CCCCC1)NCc1ccc2oc(O)nc2c1	ZINC000875020836	EE	On-Demand	Anodyne	HNMT	81	37
CCOC(=O)c1cc(CNC(=O)NCCCN2CCCCC2)on1	ZINC000875020841	ED	On-Demand	Anodyne	SLC5A7	19	41
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)N[C@H](C)CCc2ccc(O)cc2)C1	ZINC000875020852	ED	On-Demand	Anodyne	ACE	15	40
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875020856	GD	On-Demand	Anodyne	NOS2	96	38
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875020857	GD	On-Demand	Anodyne	NOS2	96	38
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)N1CCC[C@@H]1Cn1ccnc1	ZINC000875020877	GC	On-Demand	Anodyne	NOS2	99	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(-n3ccnc3)nc2)C1	ZINC000875020878	FC	On-Demand	Anodyne	NOS2	100	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(-n3ccnc3)nc2)C1	ZINC000875020878	FC	On-Demand	Anodyne	NAMPT	20	47
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(-n3ccnc3)nc2)C1	ZINC000875020879	FC	On-Demand	Anodyne	NOS2	100	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(-n3ccnc3)nc2)C1	ZINC000875020879	FC	On-Demand	Anodyne	NAMPT	20	47
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)N1CCO[C@@H](CCF)C1	ZINC000875020896	FC	On-Demand	Anodyne	NOS2	103	38
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)N1CCO[C@H](CCF)C1	ZINC000875020897	FC	On-Demand	Anodyne	NOS2	103	38
COCCN(CC1CCN(C)CC1)C(=O)NCCc1cc(C)ccc1OC	ZINC000875020898	GF	On-Demand	Anodyne	ACKR3	65	33
CC(=O)C1CCN(C(=O)C(=O)N[C@H](c2ccc(Cl)cc2)C(C)C)CC1	ZINC000875020899	FF	On-Demand	Anodyne	PRCP	15	45
CC(=O)C1CCN(C(=O)C(=O)N[C@H](c2ccc(Cl)cc2)C(C)C)CC1	ZINC000875020899	FF	On-Demand	Anodyne	CCR1	64	41
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](c2ccc(Cl)cc2)C(C)C)CC1	ZINC000875020900	FF	On-Demand	Anodyne	PRCP	15	45
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](c2ccc(Cl)cc2)C(C)C)CC1	ZINC000875020900	FF	On-Demand	Anodyne	CCR1	64	41
COc1cccc([C@H](O)C2CCN(C(=O)NCCCOCC3CC3)CC2)c1	ZINC000875020913	GF	On-Demand	Anodyne	DRD4	42	33
O=C(NCCCOCC1CC1)N[C@H]1CCCC[C@H]1F	ZINC000875020916	CE	On-Demand	Anodyne	SPHK1	15	43
COC(=O)N(C)NC(=O)NCCCN(C)Cc1ccccc1	ZINC000875020920	DD	On-Demand	Reactive	ACHE	16	48
COC(=O)N(C)NC(=O)NCCCN(C)Cc1ccccc1	ZINC000875020920	DD	On-Demand	Reactive	LTA4H	32	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCN(C)Cc2ccccc2)C1	ZINC000875020922	FE	On-Demand	Anodyne	ACE	26	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCN(C)Cc2ccccc2)C1	ZINC000875020922	FE	On-Demand	Anodyne	AMY2	43	30
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCN(C)Cc2ccccc2)C1	ZINC000875020922	FE	On-Demand	Anodyne	Q6PRC7_IXORI	42	33
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)N1CCC(CCF)CC1	ZINC000875020933	FD	On-Demand	Anodyne	NOS2	96	36
O=C(NCc1ccc(-n2ccnc2)nc1)C(=O)N1CCC(CCF)CC1	ZINC000875020933	FD	On-Demand	Anodyne	NAMPT	21	49
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)N[C@@H](C)CCc2ccc(O)cc2)C1	ZINC000875020954	ED	On-Demand	Anodyne	ACE	15	40
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875020956	ED	On-Demand	Anodyne	BIRC2	28	43
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875020957	ED	On-Demand	Anodyne	BIRC2	28	43
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875020958	ED	On-Demand	Anodyne	BIRC2	28	43
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875020959	ED	On-Demand	Anodyne	BIRC2	28	43
CCC[C@@H](CNC(=O)C(=O)NCc1ccc(-n2ccnc2)nc1)OCC	ZINC000875020960	FD	On-Demand	Anodyne	NOS2	73	34
CCC[C@H](CNC(=O)C(=O)NCc1ccc(-n2ccnc2)nc1)OCC	ZINC000875020961	FD	On-Demand	Anodyne	NOS2	73	34
CCCCCCCNC(=O)C(=O)NCc1nnc2n1CCC2	ZINC000875020962	DC	On-Demand	Mild	ASAH1	74	32
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)NC[C@@H]1c2ccccc2CN1C	ZINC000875020968	GE	On-Demand	Anodyne	ACE	27	40
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)NC[C@@H]1c2ccccc2CN1C	ZINC000875020969	GE	On-Demand	Anodyne	ACE	27	40
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)NC[C@H]1c2ccccc2CN1C	ZINC000875020970	GE	On-Demand	Anodyne	ACE	27	40
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)NC[C@H]1c2ccccc2CN1C	ZINC000875020971	GE	On-Demand	Anodyne	ACE	27	40
O=C(NCCCN1CCCCC1)NC[C@H]1C[C@H](O)C1	ZINC000875020976	CC	On-Demand	Anodyne	CCR3	18	40
CCCCCCCNC(=O)C(=O)NCc1cnn(-c2ccccc2)c1	ZINC000875020983	EF	On-Demand	Mild	ASAH1	96	39
O=C(NCCCN1CCCCC1)N1CC2(CC(=O)N2Cc2ccccc2)C1	ZINC000875020988	FE	On-Demand	Anodyne	HTR1A	21	41
O=C(NCCCN1CCCCC1)N1CC2(CC(=O)N2Cc2ccccc2)C1	ZINC000875020988	FE	On-Demand	Anodyne	HRH2	31	40
O=C(NCCCN1CCCCC1)N1CC2(CC(=O)N2Cc2ccccc2)C1	ZINC000875020988	FE	On-Demand	Anodyne	ADRA1A	38	42
O=C(NCCCN1CCCCC1)N1CC2(CC(=O)N2Cc2ccccc2)C1	ZINC000875020988	FE	On-Demand	Anodyne	HTR4	17	40
O=C(NCCCN1CCCCC1)N1CC2(CC(=O)N2Cc2ccccc2)C1	ZINC000875020988	FE	On-Demand	Anodyne	HRH3	34	44
O=C(NCCCN1CCCCC1)N1CC2(CC(=O)N2Cc2ccccc2)C1	ZINC000875020988	FE	On-Demand	Anodyne	SIGMAR1	38	42
O=C(NCCCN1CCCCC1)N1CC2(CC(=O)N2Cc2ccccc2)C1	ZINC000875020988	FE	On-Demand	Anodyne	CCR3	21	41
O=C(NCCCN1CCCCC1)N1CC2(CC(=O)N2Cc2ccccc2)C1	ZINC000875020988	FE	On-Demand	Anodyne	CHRNA7	19	47
O=C(NCCCN1CCCCC1)N1CC2(CC(=O)N2Cc2ccccc2)C1	ZINC000875020988	FE	On-Demand	Anodyne	HNMT	59	34
C[C@H](CCc1ccc(O)cc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875020989	ED	On-Demand	Anodyne	GRIA1	49	34
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875020991	ED	On-Demand	Anodyne	GRIA1	49	34
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875020992	ED	On-Demand	Anodyne	GRIA1	49	34
O=C(NCCCN1CCCCC1)NC[C@@H]1CC(=O)c2ccccc2O1	ZINC000875020995	EE	On-Demand	Anodyne	DRD2	23	40
O=C(NCCCN1CCCCC1)NC[C@@H]1CC(=O)c2ccccc2O1	ZINC000875020995	EE	On-Demand	Anodyne	DRD3	39	40
O=C(NCCCN1CCCCC1)NC[C@@H]1CC(=O)c2ccccc2O1	ZINC000875020995	EE	On-Demand	Anodyne	CHRNA7	18	45
O=C(NCCCN1CCCCC1)NC[C@H]1CC(=O)c2ccccc2O1	ZINC000875020996	EE	On-Demand	Anodyne	DRD2	23	40
O=C(NCCCN1CCCCC1)NC[C@H]1CC(=O)c2ccccc2O1	ZINC000875020996	EE	On-Demand	Anodyne	DRD3	39	40
O=C(NCCCN1CCCCC1)NC[C@H]1CC(=O)c2ccccc2O1	ZINC000875020996	EE	On-Demand	Anodyne	CHRNA7	18	45
Cc1cncc([C@H]2CCCN2C(=O)NCCCN2CCCCC2)c1	ZINC000875020997	EG	On-Demand	Anodyne	ADRA1A	51	36
Cc1cncc([C@@H]2CCCN2C(=O)NCCCN2CCCCC2)c1	ZINC000875020998	EG	On-Demand	Anodyne	ADRA1A	51	36
Cn1cc(CCNC(=O)NCCCN2CCCCC2)c2cccnc21	ZINC000875020999	EE	On-Demand	Anodyne	HRH3	25	40
Cn1cc(CCNC(=O)NCCCN2CCCCC2)c2cccnc21	ZINC000875020999	EE	On-Demand	Anodyne	CHRNA7	18	46
Cn1cc(CCNC(=O)NCCCN2CCCCC2)c2cccnc21	ZINC000875020999	EE	On-Demand	Anodyne	HNMT	102	40
C[C@H](NC(=O)NCCCN1CCCCC1)c1ccccc1O	ZINC000875021002	DF	On-Demand	Clean	DRD2	34	43
C[C@H](NC(=O)NCCCN1CCCCC1)c1ccccc1O	ZINC000875021002	DF	On-Demand	Clean	HRH2	27	46
C[C@H](NC(=O)NCCCN1CCCCC1)c1ccccc1O	ZINC000875021002	DF	On-Demand	Clean	ADRA1D	26	40
C[C@H](NC(=O)NCCCN1CCCCC1)c1ccccc1O	ZINC000875021002	DF	On-Demand	Clean	ADRA1A	36	40
C[C@H](NC(=O)NCCCN1CCCCC1)c1ccccc1O	ZINC000875021002	DF	On-Demand	Clean	ADRA1B	25	40
C[C@H](NC(=O)NCCCN1CCCCC1)c1ccccc1O	ZINC000875021002	DF	On-Demand	Clean	DRD3	57	43
C[C@H](NC(=O)NCCCN1CCCCC1)c1ccccc1O	ZINC000875021002	DF	On-Demand	Clean	HTR4	37	42
C[C@H](NC(=O)NCCCN1CCCCC1)c1ccccc1O	ZINC000875021002	DF	On-Demand	Clean	HRH3	35	41
C[C@H](NC(=O)NCCCN1CCCCC1)c1ccccc1O	ZINC000875021002	DF	On-Demand	Clean	CCR3	28	43
C[C@H](NC(=O)NCCCN1CCCCC1)c1ccccc1O	ZINC000875021002	DF	On-Demand	Clean	CHRNA7	21	50
C[C@H](NC(=O)NCCCN1CCCCC1)c1ccccc1O	ZINC000875021002	DF	On-Demand	Clean	HNMT	63	36
C[C@@H](NC(=O)NCCCN1CCCCC1)c1ccccc1O	ZINC000875021003	DF	On-Demand	Clean	DRD2	34	43
C[C@@H](NC(=O)NCCCN1CCCCC1)c1ccccc1O	ZINC000875021003	DF	On-Demand	Clean	HRH2	27	46
C[C@@H](NC(=O)NCCCN1CCCCC1)c1ccccc1O	ZINC000875021003	DF	On-Demand	Clean	ADRA1D	26	40
C[C@@H](NC(=O)NCCCN1CCCCC1)c1ccccc1O	ZINC000875021003	DF	On-Demand	Clean	ADRA1A	36	40
C[C@@H](NC(=O)NCCCN1CCCCC1)c1ccccc1O	ZINC000875021003	DF	On-Demand	Clean	ADRA1B	25	40
C[C@@H](NC(=O)NCCCN1CCCCC1)c1ccccc1O	ZINC000875021003	DF	On-Demand	Clean	DRD3	57	43
C[C@@H](NC(=O)NCCCN1CCCCC1)c1ccccc1O	ZINC000875021003	DF	On-Demand	Clean	HTR4	37	42
C[C@@H](NC(=O)NCCCN1CCCCC1)c1ccccc1O	ZINC000875021003	DF	On-Demand	Clean	HRH3	35	41
C[C@@H](NC(=O)NCCCN1CCCCC1)c1ccccc1O	ZINC000875021003	DF	On-Demand	Clean	CCR3	28	43
C[C@@H](NC(=O)NCCCN1CCCCC1)c1ccccc1O	ZINC000875021003	DF	On-Demand	Clean	CHRNA7	21	50
C[C@@H](NC(=O)NCCCN1CCCCC1)c1ccccc1O	ZINC000875021003	DF	On-Demand	Clean	HNMT	63	36
COc1cc(NC(=O)[C@]23CCCC[C@H]2C3)c(OC)cc1NC(=O)c1ccccc1	ZINC000875021004	GI	On-Demand	Anodyne	KCNK3	43	40
COc1cc(NC(=O)[C@]23CCCC[C@@H]2C3)c(OC)cc1NC(=O)c1ccccc1	ZINC000875021005	GI	On-Demand	Anodyne	KCNK3	43	40
COc1cc(NC(=O)[C@@]23CCCC[C@H]2C3)c(OC)cc1NC(=O)c1ccccc1	ZINC000875021006	GI	On-Demand	Anodyne	KCNK3	43	40
COc1cc(NC(=O)[C@@]23CCCC[C@@H]2C3)c(OC)cc1NC(=O)c1ccccc1	ZINC000875021007	GI	On-Demand	Anodyne	KCNK3	43	40
COc1ccc2cc(CNC(=O)C(=O)N3CCC(C(C)=O)CC3)ccc2c1	ZINC000875021019	FE	On-Demand	Anodyne	MMP13	40	39
COc1ccc2cc(CNC(=O)C(=O)N3CCC(C(C)=O)CC3)ccc2c1	ZINC000875021019	FE	On-Demand	Anodyne	MTNR1A	60	40
COc1ccc2cc(CNC(=O)C(=O)N3CCC(C(C)=O)CC3)ccc2c1	ZINC000875021019	FE	On-Demand	Anodyne	MTNR1B	53	39
COc1ccc2cc(CNC(=O)C(=O)N3CCC(C(C)=O)CC3)ccc2c1	ZINC000875021019	FE	On-Demand	Anodyne	MCHR1	16	44
COc1ccc2cc(CNC(=O)C(=O)N3CC[C@@H]4[C@@H](CCN4C)C3)ccc2c1	ZINC000875021033	GE	On-Demand	Anodyne	MCHR1	15	42
COc1ccc2cc(CNC(=O)C(=O)N3CC[C@H]4[C@@H](CCN4C)C3)ccc2c1	ZINC000875021034	GE	On-Demand	Anodyne	MCHR1	15	42
COc1ccc2cc(CNC(=O)C(=O)N3CC[C@H]4[C@H](CCN4C)C3)ccc2c1	ZINC000875021035	GE	On-Demand	Anodyne	MCHR1	15	42
COc1ccc2cc(CNC(=O)C(=O)N3CC[C@@H]4[C@H](CCN4C)C3)ccc2c1	ZINC000875021036	GE	On-Demand	Anodyne	MCHR1	15	42
O=C(NCCCN1CCCCC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875021042	GG	On-Demand	Anodyne	SMO	38	42
O=C(NCCCN1CCCCC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875021042	GG	On-Demand	Anodyne	ETHR	57	49
Cn1cc(/C=C/C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)c(=O)n(C)c1=O	ZINC000875021045	JF	On-Demand	Anodyne	SCD1	36	40
Cn1cc(/C=C/C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)c(=O)n(C)c1=O	ZINC000875021045	JF	On-Demand	Anodyne	SCD	33	51
Cn1cc(/C=C\C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)c(=O)n(C)c1=O	ZINC000875021046	JF	On-Demand	Anodyne	SCD1	36	40
Cn1cc(/C=C\C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)c(=O)n(C)c1=O	ZINC000875021046	JF	On-Demand	Anodyne	SCD	33	51
C=CC(C)(C)CCCNC(=O)C(=O)N[C@@H](C)CCc1ccc(O)cc1	ZINC000875021051	EF	On-Demand	Mild	GRIA1	71	39
C=CC(C)(C)CCCNC(=O)C(=O)N[C@H](C)CCc1ccc(O)cc1	ZINC000875021052	EF	On-Demand	Mild	GRIA1	71	39
COc1ccc2cc(CNC(=O)C(=O)N[C@@H]3CCCn4nccc43)ccc2c1	ZINC000875021061	GE	On-Demand	Anodyne	DRD4	40	31
COc1ccc2cc(CNC(=O)C(=O)N[C@H]3CCCn4nccc43)ccc2c1	ZINC000875021062	GE	On-Demand	Anodyne	DRD4	40	31
O=C(O)c1cc(C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)cc([N+](=O)[O-])c1	ZINC000875021102	JJ	On-Demand	Bother	SCD1	42	47
O=C(O)c1cc(C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)cc([N+](=O)[O-])c1	ZINC000875021102	JJ	On-Demand	Bother	SCD	40	47
Cc1nc(O)nc(O)c1CCC(=O)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000875021104	IH	On-Demand	Anodyne	SCD	31	41
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000875021113	GD	On-Demand	Reactive	HTR1A	88	51
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000875021113	GD	On-Demand	Reactive	DRD2	68	47
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000875021113	GD	On-Demand	Reactive	DRD1	16	44
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000875021113	GD	On-Demand	Reactive	DRD4	53	45
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000875021113	GD	On-Demand	Reactive	ADRA1D	40	45
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000875021113	GD	On-Demand	Reactive	HTR2A	63	51
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000875021113	GD	On-Demand	Reactive	HTR2C	42	48
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000875021113	GD	On-Demand	Reactive	SLC6A4	19	48
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000875021113	GD	On-Demand	Reactive	ADRA1A	54	41
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000875021113	GD	On-Demand	Reactive	ADRA1B	25	43
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000875021113	GD	On-Demand	Reactive	DRD3	99	49
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000875021113	GD	On-Demand	Reactive	HTR7	101	51
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000875021113	GD	On-Demand	Reactive	CCR3	22	42
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](CC)c1ccc(Cl)cc1	ZINC000875021126	FE	On-Demand	Mild	UTS2	45	36
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H](CC)c1ccc(Cl)cc1	ZINC000875021127	FE	On-Demand	Mild	UTS2	45	36
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](CC)c1ccc(Cl)cc1	ZINC000875021128	FE	On-Demand	Mild	UTS2	45	36
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H](CC)c1ccc(Cl)cc1	ZINC000875021129	FE	On-Demand	Mild	UTS2	45	36
C=CCCC(C)(C)CNC(=O)C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875021154	FD	On-Demand	Mild	NOS2	43	31
C=CC(C)(C)CCCNC(=O)C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875021172	FD	On-Demand	Mild	NOS2	43	31
O=C(NCCCOCC1CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875021196	EE	On-Demand	Anodyne	SIGMAR1	29	47
COC[C@@]1(C)CN(C(=O)C(=O)NCc2ccc(-n3ccnc3)nc2)CCO1	ZINC000875021222	FC	On-Demand	Anodyne	NOS2	102	38
COC[C@]1(C)CN(C(=O)C(=O)NCc2ccc(-n3ccnc3)nc2)CCO1	ZINC000875021223	FC	On-Demand	Anodyne	NOS2	102	38
O=C(NCCCOCC1CC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875021227	EF	On-Demand	Anodyne	F2	25	40
O=C(NCCCOCC1CC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875021228	EF	On-Demand	Anodyne	F2	25	40
O=C(NCCCOCC1CC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875021229	EF	On-Demand	Anodyne	F2	25	40
O=C(NCCCOCC1CC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875021230	EF	On-Demand	Anodyne	F2	25	40
CC[C@@H](C)c1ccccc1OC(=O)[C@H]1CCCN1C(C)=O	ZINC000875021262	CG	On-Demand	Anodyne	ACE	43	42
CC[C@@H](C)c1ccccc1OC(=O)[C@H]1CCCN1C(C)=O	ZINC000875021262	CG	On-Demand	Anodyne	FKBP1A	72	39
CC[C@@H](C)c1ccccc1OC(=O)[C@H]1CCCN1C(C)=O	ZINC000875021262	CG	On-Demand	Anodyne	ELANE	58	39
CC[C@@H](C)c1ccccc1OC(=O)[C@H]1CCCN1C(C)=O	ZINC000875021262	CG	On-Demand	Anodyne	PREP	64	37
CC[C@@H](C)c1ccccc1OC(=O)[C@H]1CCCN1C(C)=O	ZINC000875021262	CG	On-Demand	Anodyne	XIAP	44	39
CN1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)Cc2cccnc21	ZINC000875021269	GF	On-Demand	Anodyne	HRH3	21	40
CN1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)Cc2cccnc21	ZINC000875021269	GF	On-Demand	Anodyne	NAMPT	34	49
CO[C@@H]1CC[C@@H](C)N(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000875021274	EF	On-Demand	Anodyne	HRH3	28	50
CO[C@@H]1CC[C@@H](C)N(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000875021274	EF	On-Demand	Anodyne	SIGMAR1	23	43
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000875021276	FF	On-Demand	Anodyne	HRH3	25	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000875021276	FF	On-Demand	Anodyne	SIGMAR1	17	45
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000875021276	FF	On-Demand	Anodyne	DPP7	46	35
N#Cc1cccc([C@H](NC(=O)NCCCOCC2CC2)C(F)(F)F)c1	ZINC000875021277	FG	On-Demand	Mild	CCR3	16	41
N#Cc1cccc([C@@H](NC(=O)NCCCOCC2CC2)C(F)(F)F)c1	ZINC000875021278	FG	On-Demand	Mild	CCR3	16	41
O=C(NCc1ccc(CN2CCCC2)cc1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875021279	GE	On-Demand	Anodyne	HRH3	17	44
O=C(NCCc1cccc(F)c1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875021292	DF	On-Demand	Anodyne	SLC18A2	15	45
O=C(NCCCOCC1CC1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875021295	EG	On-Demand	Anodyne	OXTR	44	35
O=C(NCCCOCC1CC1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875021296	EG	On-Demand	Anodyne	OXTR	44	35
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000875021302	EF	On-Demand	Anodyne	HRH2	19	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000875021302	EF	On-Demand	Anodyne	HRH3	17	40
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000875021302	EF	On-Demand	Anodyne	DPP7	18	40
CC(=O)N1CCC[C@@H]1C(=O)Oc1ccccc1C(C)C	ZINC000875021319	CF	On-Demand	Anodyne	ACE	43	40
CC(=O)N1CCC[C@@H]1C(=O)Oc1ccccc1C(C)C	ZINC000875021319	CF	On-Demand	Anodyne	FKBP1A	59	37
CC(=O)N1CCC[C@@H]1C(=O)Oc1ccccc1C(C)C	ZINC000875021319	CF	On-Demand	Anodyne	CELA1	40	39
CC(=O)N1CCC[C@@H]1C(=O)Oc1ccccc1C(C)C	ZINC000875021319	CF	On-Demand	Anodyne	ELANE	61	41
CC(=O)N1CCC[C@@H]1C(=O)Oc1ccccc1C(C)C	ZINC000875021319	CF	On-Demand	Anodyne	PREP	58	37
CC(=O)N1CCC[C@@H]1C(=O)Oc1ccccc1C(C)C	ZINC000875021319	CF	On-Demand	Anodyne	XIAP	41	36
CCOc1cccc2cc([C@H](C)NC(=O)N3CCC(CO)(CO)CC3)oc12	ZINC000875021325	GF	On-Demand	Anodyne	HCN1	50	36
CCOc1cccc2cc([C@H](C)NC(=O)N3CCC(CO)(CO)CC3)oc12	ZINC000875021325	GF	On-Demand	Anodyne	HCN4	42	36
CCOc1cccc2cc([C@@H](C)NC(=O)N3CCC(CO)(CO)CC3)oc12	ZINC000875021326	GF	On-Demand	Anodyne	HCN1	50	36
CCOc1cccc2cc([C@@H](C)NC(=O)N3CCC(CO)(CO)CC3)oc12	ZINC000875021326	GF	On-Demand	Anodyne	HCN4	42	36
COCCN(CC1CCN(C)CC1)C(=O)NCCc1cccc(F)c1	ZINC000875021335	FE	On-Demand	Anodyne	ACKR3	67	36
CN1CC[C@@H](C(=O)Oc2c(Cl)cccc2Cl)[C@@H](c2cnn(C)c2)C1	ZINC000875021346	FG	On-Demand	Anodyne	SLC6A3	19	44
CN1CC[C@@H](C(=O)Oc2c(Cl)cccc2Cl)[C@H](c2cnn(C)c2)C1	ZINC000875021347	FG	On-Demand	Anodyne	SLC6A3	19	44
O=C(NCCc1cccc(F)c1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875021352	EF	On-Demand	Anodyne	CACNA1G	19	42
O=C(NCCc1cccc(F)c1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875021353	EF	On-Demand	Anodyne	CACNA1G	19	42
O=C(NCCCOCC1CC1)NCc1ccc(CN2CCNC2=O)cc1	ZINC000875021354	FD	On-Demand	Anodyne	HRH2	15	40
C[C@@H](NC(=O)NCCCOCC1CC1)c1ccc(C(F)(F)F)nc1	ZINC000875021366	EG	On-Demand	Anodyne	TRPV1	45	39
C[C@H](NC(=O)NCCCOCC1CC1)c1ccc(C(F)(F)F)nc1	ZINC000875021367	EG	On-Demand	Anodyne	TRPV1	45	39
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000875021374	HI	On-Demand	Bother	SCD1	45	49
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000875021374	HI	On-Demand	Bother	SCD	39	58
COC(=O)N(C)NC(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000875021386	DD	On-Demand	Reactive	HRH2	25	43
COC(=O)N(C)NC(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000875021386	DD	On-Demand	Reactive	HRH3	28	42
COC(=O)N(C)NC(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000875021386	DD	On-Demand	Reactive	SIGMAR1	22	43
COC(=O)N(C)NC(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000875021386	DD	On-Demand	Reactive	MCHR1	15	42
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCN(C2CC2)CC1	ZINC000875021413	FF	On-Demand	Anodyne	FKBP1A	24	44
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCN(C2CC2)CC1	ZINC000875021413	FF	On-Demand	Anodyne	DRD4	20	47
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCN(C2CC2)CC1	ZINC000875021413	FF	On-Demand	Anodyne	GRIN2B	20	40
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCN(C2CC2)CC1	ZINC000875021413	FF	On-Demand	Anodyne	SIGMAR1	42	45
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCN(C2CC2)CC1	ZINC000875021413	FF	On-Demand	Anodyne	MTNR1A	21	43
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCN(C2CC2)CC1	ZINC000875021413	FF	On-Demand	Anodyne	MTNR1B	20	43
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCN(C2CC2)CC1	ZINC000875021413	FF	On-Demand	Anodyne	TGM2	18	43
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCN(C2CC2)CC1	ZINC000875021413	FF	On-Demand	Anodyne	AMP1_PLAFQ	24	43
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCCc2cccc(F)c2)[C@@H](O)C1	ZINC000875021420	GE	On-Demand	Anodyne	GPR119	39	56
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NCCc2cccc(F)c2)[C@@H](O)C1	ZINC000875021421	GE	On-Demand	Anodyne	GPR119	39	56
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCCc2cccc(F)c2)[C@H](O)C1	ZINC000875021422	GE	On-Demand	Anodyne	GPR119	39	56
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NCCc2cccc(F)c2)[C@H](O)C1	ZINC000875021423	GE	On-Demand	Anodyne	GPR119	39	56
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000875021426	EF	On-Demand	Anodyne	SLC6A1	59	32
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000875021426	EF	On-Demand	Anodyne	HRH3	42	50
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000875021426	EF	On-Demand	Anodyne	SIGMAR1	25	47
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000875021426	EF	On-Demand	Anodyne	CCR3	31	42
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000875021426	EF	On-Demand	Anodyne	DPP7	61	38
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000875021426	EF	On-Demand	Anodyne	MCHR1	19	41
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000875021426	EF	On-Demand	Anodyne	L3MBTL3	17	40
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000875021427	EF	On-Demand	Anodyne	SLC6A1	59	32
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000875021427	EF	On-Demand	Anodyne	HRH3	42	50
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000875021427	EF	On-Demand	Anodyne	SIGMAR1	25	47
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000875021427	EF	On-Demand	Anodyne	CCR3	31	42
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000875021427	EF	On-Demand	Anodyne	DPP7	61	38
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000875021427	EF	On-Demand	Anodyne	MCHR1	19	41
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000875021427	EF	On-Demand	Anodyne	L3MBTL3	17	40
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NC2CCN(C3CC3)CC2)CCO1	ZINC000875021428	GD	On-Demand	Anodyne	ADRA1D	30	40
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NC2CCN(C3CC3)CC2)CCO1	ZINC000875021428	GD	On-Demand	Anodyne	ADRA1A	21	40
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NC2CCN(C3CC3)CC2)CCO1	ZINC000875021428	GD	On-Demand	Anodyne	ADRA1B	24	40
COc1ccccc1[C@H]1CN(C(=O)C(=O)NC2CCN(C3CC3)CC2)CCO1	ZINC000875021429	GD	On-Demand	Anodyne	ADRA1D	30	40
COc1ccccc1[C@H]1CN(C(=O)C(=O)NC2CCN(C3CC3)CC2)CCO1	ZINC000875021429	GD	On-Demand	Anodyne	ADRA1A	21	40
COc1ccccc1[C@H]1CN(C(=O)C(=O)NC2CCN(C3CC3)CC2)CCO1	ZINC000875021429	GD	On-Demand	Anodyne	ADRA1B	24	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cccc(F)c1	ZINC000875021434	DE	On-Demand	Anodyne	SLC6A4	26	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cccc(F)c1	ZINC000875021434	DE	On-Demand	Anodyne	SLC6A3	51	46
C[C@@H]1CN(C(=O)NCc2ccc(CN3CCCC3)cc2)CC[C@H](C(F)(F)F)O1	ZINC000875021457	GH	On-Demand	Anodyne	HRH3	16	43
C[C@@H]1CN(C(=O)NCc2ccc(CN3CCCC3)cc2)CC[C@H](C(F)(F)F)O1	ZINC000875021457	GH	On-Demand	Anodyne	MLNR	44	35
C[C@@H]1CN(C(=O)NCc2ccc(CN3CCCC3)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000875021459	GH	On-Demand	Anodyne	HRH3	16	43
C[C@@H]1CN(C(=O)NCc2ccc(CN3CCCC3)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000875021459	GH	On-Demand	Anodyne	MLNR	44	35
O=C(NCCCOCC1CC1)NCc1ccc(O)c(Cl)c1	ZINC000875021474	DF	On-Demand	Anodyne	NCE103	15	44
COc1ccc([C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C(C)C)cc1	ZINC000875021490	FF	On-Demand	Anodyne	MCHR1	15	41
COc1ccc([C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C(C)C)cc1	ZINC000875021490	FF	On-Demand	Anodyne	BIRC2	33	45
COc1ccc([C@@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C(C)C)cc1	ZINC000875021491	FF	On-Demand	Anodyne	MCHR1	15	41
COc1ccc([C@@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C(C)C)cc1	ZINC000875021491	FF	On-Demand	Anodyne	BIRC2	33	45
O=C(NCC1(c2cccc(Cl)c2)CCC1)C(=O)NC1CCN(C2CC2)CC1	ZINC000875021492	GF	On-Demand	Anodyne	MCHR1	21	45
O=C1CCN(C(=O)NCCc2cccc(F)c2)CCCCCCN1	ZINC000875021498	EE	On-Demand	Anodyne	CACNA1G	15	40
CONC(=O)C1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)CC1	ZINC000875021504	FD	On-Demand	Anodyne	HRH3	33	47
CONC(=O)C1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)CC1	ZINC000875021504	FD	On-Demand	Anodyne	SIGMAR1	22	53
CONC(=O)C1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)CC1	ZINC000875021504	FD	On-Demand	Anodyne	EPHX2	26	46
CONC(=O)C1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)CC1	ZINC000875021504	FD	On-Demand	Anodyne	MCHR1	18	40
CONC(=O)C1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)CC1	ZINC000875021504	FD	On-Demand	Anodyne	CACNA1G	36	41
O=C1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)CCCCCCN1	ZINC000875021510	GF	On-Demand	Anodyne	HRH3	22	42
O=C(NCc1ccc(OC(F)F)cc1F)C(=O)NC1CCN(C2CC2)CC1	ZINC000875021512	GD	On-Demand	Anodyne	ADRA1D	15	40
O=C(NCCCOCC1CC1)NNC(=O)c1nc2ccccc2s1	ZINC000875021526	EE	On-Demand	Reactive	TPSAB1	15	42
O=C(NCCCOCC1CC1)NNC(=O)c1nc2ccccc2s1	ZINC000875021526	EE	On-Demand	Reactive	ST14	50	35
O=C(NCCCOCC1CC1)NNC(=O)c1nc2ccccc2s1	ZINC000875021526	EE	On-Demand	Reactive	TMPRSS6	78	35
CN1CC[C@H]2CN(C(=O)NCc3ccc(CN4CCCC4)cc3)CC[C@@H]21	ZINC000875021530	FF	On-Demand	Anodyne	HRH3	35	43
CN1CC[C@H]2CN(C(=O)NCc3ccc(CN4CCCC4)cc3)CC[C@@H]21	ZINC000875021530	FF	On-Demand	Anodyne	SIGMAR1	20	44
CN1CC[C@H]2CN(C(=O)NCc3ccc(CN4CCCC4)cc3)CC[C@@H]21	ZINC000875021530	FF	On-Demand	Anodyne	L3MBTL3	44	42
CN1CC[C@H]2CN(C(=O)NCc3ccc(CN4CCCC4)cc3)CC[C@H]21	ZINC000875021532	FF	On-Demand	Anodyne	HRH3	35	43
CN1CC[C@H]2CN(C(=O)NCc3ccc(CN4CCCC4)cc3)CC[C@H]21	ZINC000875021532	FF	On-Demand	Anodyne	SIGMAR1	20	44
CN1CC[C@H]2CN(C(=O)NCc3ccc(CN4CCCC4)cc3)CC[C@H]21	ZINC000875021532	FF	On-Demand	Anodyne	L3MBTL3	44	42
O=C(NCc1ccc(CN2CCCC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875021539	FD	On-Demand	Anodyne	HRH2	15	41
O=C(NCc1ccc(CN2CCCC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875021539	FD	On-Demand	Anodyne	HRH3	22	44
O=C(NCc1ccc(CN2CCCC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875021539	FD	On-Demand	Anodyne	SIGMAR1	24	46
O=C(NCc1ccc(CN2CCCC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875021539	FD	On-Demand	Anodyne	NPFFR2	32	41
O=C(NCc1ccc(CN2CCCC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875021539	FD	On-Demand	Anodyne	NPFFR1	45	41
O=C(NCc1ccc(CN2CCCC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875021539	FD	On-Demand	Anodyne	NAMPT	25	43
COc1ccc([C@H](NC(=O)N2CCc3c(CC(N)=O)cccc3C2)C(C)C)cc1	ZINC000875021540	GG	On-Demand	Anodyne	Q6PRC7_IXORI	44	31
COc1ccc([C@@H](NC(=O)N2CCc3c(CC(N)=O)cccc3C2)C(C)C)cc1	ZINC000875021541	GG	On-Demand	Anodyne	Q6PRC7_IXORI	44	31
CN1CCN(C2CCN(C(=O)NCc3ccc(CN4CCCC4)cc3)CC2)CC1	ZINC000875021542	GE	On-Demand	Anodyne	CHRM2	21	40
CN1CCN(C2CCN(C(=O)NCc3ccc(CN4CCCC4)cc3)CC2)CC1	ZINC000875021542	GE	On-Demand	Anodyne	HRH3	52	58
CN1CCN(C2CCN(C(=O)NCc3ccc(CN4CCCC4)cc3)CC2)CC1	ZINC000875021542	GE	On-Demand	Anodyne	SIGMAR1	29	46
CN1CCN(C2CCN(C(=O)NCc3ccc(CN4CCCC4)cc3)CC2)CC1	ZINC000875021542	GE	On-Demand	Anodyne	CCR3	24	43
CN1CCN(C2CCN(C(=O)NCc3ccc(CN4CCCC4)cc3)CC2)CC1	ZINC000875021542	GE	On-Demand	Anodyne	EPHX2	16	42
CN1CCN(C2CCN(C(=O)NCc3ccc(CN4CCCC4)cc3)CC2)CC1	ZINC000875021542	GE	On-Demand	Anodyne	CXCR3	25	43
CN1CCN(C2CCN(C(=O)NCc3ccc(CN4CCCC4)cc3)CC2)CC1	ZINC000875021542	GE	On-Demand	Anodyne	L3MBTL3	130	55
CN1CCN(C2CCN(C(=O)NCc3ccc(CN4CCCC4)cc3)CC2)CC1	ZINC000875021542	GE	On-Demand	Anodyne	NAMPT	27	46
O=C(NCc1ccc(CN2CCCC2)cc1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875021545	FG	On-Demand	Anodyne	ACHE	17	43
O=C(NCc1ccc(CN2CCCC2)cc1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875021545	FG	On-Demand	Anodyne	HRH3	18	44
O=C(NCc1ccc(CN2CCCC2)cc1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875021545	FG	On-Demand	Anodyne	SIGMAR1	21	47
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1ccc(-n2cccn2)nc1	ZINC000875021546	IJ	On-Demand	Anodyne	SCD1	41	46
O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1ccc(-n2cccn2)nc1	ZINC000875021546	IJ	On-Demand	Anodyne	SCD	40	48
C[S@](=N)(=O)N1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)CC1	ZINC000875021556	GD	On-Demand	Anodyne	HRH3	20	46
C[S@](=N)(=O)N1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)CC1	ZINC000875021556	GD	On-Demand	Anodyne	SIGMAR1	15	41
C[S@](=N)(=O)N1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)CC1	ZINC000875021556	GD	On-Demand	Anodyne	NAMPT	38	41
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2cccc(F)c2)C1	ZINC000875021560	GE	On-Demand	Anodyne	CACNA1G	21	42
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2cccc(F)c2)C1	ZINC000875021560	GE	On-Demand	Anodyne	BIRC2	18	44
O=C(N[C@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2cccc(F)c2)C1	ZINC000875021561	GE	On-Demand	Anodyne	CACNA1G	21	42
O=C(N[C@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2cccc(F)c2)C1	ZINC000875021561	GE	On-Demand	Anodyne	BIRC2	18	44
O=C(N[C@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2cccc(F)c2)C1	ZINC000875021562	GE	On-Demand	Anodyne	CACNA1G	21	42
O=C(N[C@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2cccc(F)c2)C1	ZINC000875021562	GE	On-Demand	Anodyne	BIRC2	18	44
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2cccc(F)c2)C1	ZINC000875021563	GE	On-Demand	Anodyne	CACNA1G	21	42
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2cccc(F)c2)C1	ZINC000875021563	GE	On-Demand	Anodyne	BIRC2	18	44
O=C(NC1CCN(C2CC2)CC1)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875021564	GD	On-Demand	Anodyne	ADRA1D	29	50
O=C(NC1CCN(C2CC2)CC1)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875021564	GD	On-Demand	Anodyne	ADRA1A	20	50
O=C(NC1CCN(C2CC2)CC1)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875021564	GD	On-Demand	Anodyne	ADRA1B	22	50
O=C(NCCc1cccc(F)c1)NC[C@H]1C[C@H](O)C1	ZINC000875021578	CD	On-Demand	Anodyne	CCR3	15	41
O=C(NCc1ccc(CN2CCCC2)cc1)N1Cc2cccc(O)c2C1	ZINC000875021584	FG	On-Demand	Clean	HRH3	17	40
O=C(NCc1ccc(CN2CCCC2)cc1)N1Cc2cccc(O)c2C1	ZINC000875021584	FG	On-Demand	Clean	SIGMAR1	16	45
O=C(NCc1ccc(CN2CCCC2)cc1)N1Cc2cccc(O)c2C1	ZINC000875021584	FG	On-Demand	Clean	NAMPT	28	51
O=C(NCCCOCC1CC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875021600	FG	On-Demand	Anodyne	SMO	35	44
O=C(NCCCOCC1CC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875021600	FG	On-Demand	Anodyne	ETHR	54	48
CCOC1CC2(C1)C[C@@H]2NC(=O)NCCCOCC1CC1	ZINC000875021607	CE	On-Demand	Anodyne	EPHX2	20	40
CCOC1CC2(C1)C[C@H]2NC(=O)NCCCOCC1CC1	ZINC000875021608	CE	On-Demand	Anodyne	EPHX2	20	40
O=C(NCc1ccc(CN2CCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875021620	DD	On-Demand	Anodyne	HRH2	23	43
O=C(NCc1ccc(CN2CCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875021620	DD	On-Demand	Anodyne	HRH3	23	41
O=C(NCc1ccc(CN2CCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875021620	DD	On-Demand	Anodyne	SIGMAR1	21	46
O=C(NCc1ccc(CN2CCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875021620	DD	On-Demand	Anodyne	CCR3	17	42
COc1ccc([C@@H]2CN(C(=O)C(=O)NC3CCN(C4CC4)CC3)CCO2)cc1	ZINC000875021623	GD	On-Demand	Anodyne	CHRM2	43	36
O=C(NC1CCN(C(=O)NCCCOCC2CC2)CC1)OCc1ccccc1	ZINC000875021625	GF	On-Demand	Anodyne	CTSB	19	50
O=C(NC1CCN(C(=O)NCCCOCC2CC2)CC1)OCc1ccccc1	ZINC000875021625	GF	On-Demand	Anodyne	CTSK	22	50
O=C(NC1CCN(C(=O)NCCCOCC2CC2)CC1)OCc1ccccc1	ZINC000875021625	GF	On-Demand	Anodyne	CTSL	24	50
O=C(NC1CCN(C(=O)NCCCOCC2CC2)CC1)OCc1ccccc1	ZINC000875021625	GF	On-Demand	Anodyne	PREP	19	40
O=C(NC1CCN(C(=O)NCCCOCC2CC2)CC1)OCc1ccccc1	ZINC000875021625	GF	On-Demand	Anodyne	CAPN2	48	35
O=C(NC1CCN(C(=O)NCCCOCC2CC2)CC1)OCc1ccccc1	ZINC000875021625	GF	On-Demand	Anodyne	TGM2	35	43
O=C(NC1CCN(C(=O)NCCCOCC2CC2)CC1)OCc1ccccc1	ZINC000875021625	GF	On-Demand	Anodyne	F13A1	22	43
O=C(NC1CCN(C(=O)NCCCOCC2CC2)CC1)OCc1ccccc1	ZINC000875021625	GF	On-Demand	Anodyne	NAAA	35	42
COCC1CC(NC(=O)NCCCOCC2CC2)C1	ZINC000875021629	CD	On-Demand	Anodyne	EPHX2	16	56
O=C(NCc1ccc(CN2CCCC2)cc1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875021645	FG	On-Demand	Anodyne	HRH3	26	47
O=C(NCc1ccc(CN2CCCC2)cc1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875021645	FG	On-Demand	Anodyne	SIGMAR1	18	45
O=C(NCc1ccc(CN2CCCC2)cc1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875021646	FG	On-Demand	Anodyne	HRH3	26	47
O=C(NCc1ccc(CN2CCCC2)cc1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875021646	FG	On-Demand	Anodyne	SIGMAR1	18	45
O=C(NCc1ccc(CN2CCCC2)cc1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875021647	FG	On-Demand	Anodyne	HRH3	26	47
O=C(NCc1ccc(CN2CCCC2)cc1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875021647	FG	On-Demand	Anodyne	SIGMAR1	18	45
O=C(NCc1ccc(CN2CCCC2)cc1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875021648	FG	On-Demand	Anodyne	HRH3	26	47
O=C(NCc1ccc(CN2CCCC2)cc1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875021648	FG	On-Demand	Anodyne	SIGMAR1	18	45
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000875021657	HJ	On-Demand	Bother	SCD1	49	56
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000875021657	HJ	On-Demand	Bother	SCD	41	58
O=C(NCCCOCC1CC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875021660	FD	On-Demand	Anodyne	ETHR	41	35
O=C(NCCCOCC1CC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875021661	FD	On-Demand	Anodyne	ETHR	41	35
O=C(NCCc1cccc(F)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875021663	EH	On-Demand	Anodyne	EPHX2	23	40
O=C(NCCc1cccc(F)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875021663	EH	On-Demand	Anodyne	CACNA1G	17	41
O=C(NCCc1cccc(F)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875021664	EH	On-Demand	Anodyne	EPHX2	23	40
O=C(NCCc1cccc(F)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875021664	EH	On-Demand	Anodyne	CACNA1G	17	41
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3ccc(CN4CCCC4)cc3)C[C@@H]1C2	ZINC000875021671	FE	On-Demand	Anodyne	HRH2	20	40
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3ccc(CN4CCCC4)cc3)C[C@@H]1C2	ZINC000875021671	FE	On-Demand	Anodyne	HRH3	19	41
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3ccc(CN4CCCC4)cc3)C[C@@H]1C2	ZINC000875021671	FE	On-Demand	Anodyne	SIGMAR1	19	40
O=C(NCCCOCC1CC1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875021674	DF	On-Demand	Anodyne	SPHK1	16	46
O=C(NCCCOCC1CC1)NC1([C@H]2CCCCO2)CCC1	ZINC000875021675	DF	On-Demand	Anodyne	SPHK1	16	46
CC(=O)C1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)CC1	ZINC000875021690	EF	On-Demand	Anodyne	HRH3	42	49
CC(=O)C1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)CC1	ZINC000875021690	EF	On-Demand	Anodyne	SIGMAR1	28	52
CC(=O)C1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)CC1	ZINC000875021690	EF	On-Demand	Anodyne	EPHX2	20	45
CC(=O)C1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)CC1	ZINC000875021690	EF	On-Demand	Anodyne	MCHR1	22	42
CC(=O)C1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)CC1	ZINC000875021690	EF	On-Demand	Anodyne	CACNA1G	34	40
CC(=O)C1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)CC1	ZINC000875021690	EF	On-Demand	Anodyne	L3MBTL3	34	44
CC(=O)C1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)CC1	ZINC000875021690	EF	On-Demand	Anodyne	NAMPT	36	40
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccccc2OC(F)F)C1	ZINC000875021713	FD	On-Demand	Anodyne	P2RX7	17	42
CC(=O)N1CCC[C@@H]1C(=O)Oc1c(Cl)cccc1Cl	ZINC000875021717	DF	On-Demand	Anodyne	FKBP1A	79	37
CC(=O)N1CCC[C@@H]1C(=O)Oc1c(Cl)cccc1Cl	ZINC000875021717	DF	On-Demand	Anodyne	PREP	75	44
CC(=O)N1CCC[C@@H]1C(=O)Oc1c(Cl)cccc1Cl	ZINC000875021717	DF	On-Demand	Anodyne	LGMN	40	34
CCOc1cccc2cc([C@H](C)NC(=O)N3CCCN(C=O)CC3)oc12	ZINC000875021748	FF	On-Demand	Anodyne	HCN1	49	35
CCOc1cccc2cc([C@H](C)NC(=O)N3CCCN(C=O)CC3)oc12	ZINC000875021748	FF	On-Demand	Anodyne	HCN4	41	35
CCOc1cccc2cc([C@@H](C)NC(=O)N3CCCN(C=O)CC3)oc12	ZINC000875021749	FF	On-Demand	Anodyne	HCN1	49	35
CCOc1cccc2cc([C@@H](C)NC(=O)N3CCCN(C=O)CC3)oc12	ZINC000875021749	FF	On-Demand	Anodyne	HCN4	41	35
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1cc([N+](=O)[O-])ccc1Cl	ZINC000875021752	HJ	On-Demand	Bother	SCD1	41	48
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1cc([N+](=O)[O-])ccc1Cl	ZINC000875021752	HJ	On-Demand	Bother	SCD	34	50
O=C(NCCCOCC1CC1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875021761	EE	On-Demand	Anodyne	ADRB1	29	41
O=C(NCCCOCC1CC1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875021761	EE	On-Demand	Anodyne	HRH2	24	42
O=C(NCCCOCC1CC1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875021762	EE	On-Demand	Anodyne	ADRB1	29	41
O=C(NCCCOCC1CC1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875021762	EE	On-Demand	Anodyne	HRH2	24	42
O=C(NCc1ccc(CN2CCCC2)cc1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875021776	GD	On-Demand	Anodyne	HRH3	27	46
O=C(NCc1ccc(CN2CCCC2)cc1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875021776	GD	On-Demand	Anodyne	SIGMAR1	24	46
O=C(NCc1ccc(CN2CCCC2)cc1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875021776	GD	On-Demand	Anodyne	L3MBTL3	21	42
O=C(NCc1ccc(CN2CCCC2)cc1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875021777	GD	On-Demand	Anodyne	HRH3	27	46
O=C(NCc1ccc(CN2CCCC2)cc1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875021777	GD	On-Demand	Anodyne	SIGMAR1	24	46
O=C(NCc1ccc(CN2CCCC2)cc1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875021777	GD	On-Demand	Anodyne	L3MBTL3	21	42
O=C(NCc1ccc(CN2CCCC2)cc1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875021778	GD	On-Demand	Anodyne	HRH3	27	46
O=C(NCc1ccc(CN2CCCC2)cc1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875021778	GD	On-Demand	Anodyne	SIGMAR1	24	46
O=C(NCc1ccc(CN2CCCC2)cc1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875021778	GD	On-Demand	Anodyne	L3MBTL3	21	42
O=C(NCc1ccc(CN2CCCC2)cc1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875021779	GD	On-Demand	Anodyne	HRH3	27	46
O=C(NCc1ccc(CN2CCCC2)cc1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875021779	GD	On-Demand	Anodyne	SIGMAR1	24	46
O=C(NCc1ccc(CN2CCCC2)cc1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875021779	GD	On-Demand	Anodyne	L3MBTL3	21	42
Cn1nnnc1C1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)CC1	ZINC000875021782	GD	On-Demand	Anodyne	HRH3	22	41
O=C(NCc1ccc(CN2CCCC2)cc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875021785	GG	On-Demand	Anodyne	HRH3	18	44
O=C(NCc1ccc(CN2CCCC2)cc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875021785	GG	On-Demand	Anodyne	SIGMAR1	15	42
O=C(NCc1ccc(CN2CCCC2)cc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875021786	GG	On-Demand	Anodyne	HRH3	18	44
O=C(NCc1ccc(CN2CCCC2)cc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875021786	GG	On-Demand	Anodyne	SIGMAR1	15	42
CCOC(=O)c1cc(CNC(=O)NCc2ccc(CN3CCCC3)cc2)on1	ZINC000875021789	GE	On-Demand	Anodyne	HRH2	24	41
CCOC(=O)c1cc(CNC(=O)NCc2ccc(CN3CCCC3)cc2)on1	ZINC000875021789	GE	On-Demand	Anodyne	CCR3	15	40
CCCCCCCNC(=O)C(=O)NC1CCN(C2CC2)CC1	ZINC000875021793	DD	On-Demand	Mild	ASAH1	68	34
CCCCCCCNC(=O)C(=O)NC1CCN(C2CC2)CC1	ZINC000875021793	DD	On-Demand	Mild	LASR	44	32
O=C(NCc1ccc(CN2CCCC2)cc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875021804	GH	On-Demand	Anodyne	HRH3	30	47
O=C(NCc1ccc(CN2CCCC2)cc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875021804	GH	On-Demand	Anodyne	SIGMAR1	19	45
O=C(NCc1ccc(CN2CCCC2)cc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875021804	GH	On-Demand	Anodyne	EPHX2	24	43
O=C(NCc1ccc(CN2CCCC2)cc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875021805	GH	On-Demand	Anodyne	HRH3	30	47
O=C(NCc1ccc(CN2CCCC2)cc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875021805	GH	On-Demand	Anodyne	SIGMAR1	19	45
O=C(NCc1ccc(CN2CCCC2)cc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875021805	GH	On-Demand	Anodyne	EPHX2	24	43
O=C(CN1CCC(NC(=O)C(=O)N[C@H]2CC23CCC3)CC1)Nc1ccccc1	ZINC000875021808	GD	On-Demand	Anodyne	DRD4	23	46
O=C(CN1CCC(NC(=O)C(=O)N[C@H]2CC23CCC3)CC1)Nc1ccccc1	ZINC000875021808	GD	On-Demand	Anodyne	SIGMAR1	15	41
O=C(CN1CCC(NC(=O)C(=O)N[C@@H]2CC23CCC3)CC1)Nc1ccccc1	ZINC000875021809	GD	On-Demand	Anodyne	DRD4	23	46
O=C(CN1CCC(NC(=O)C(=O)N[C@@H]2CC23CCC3)CC1)Nc1ccccc1	ZINC000875021809	GD	On-Demand	Anodyne	SIGMAR1	15	41
O=C(O)c1ccc(C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)s1	ZINC000875021810	HJ	On-Demand	Anodyne	SCD1	41	46
O=C(O)c1ccc(C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)s1	ZINC000875021810	HJ	On-Demand	Anodyne	SCD	39	46
O=C(NCCCOCC1CC1)NCc1nc(-c2ccncc2)cs1	ZINC000875021814	EF	On-Demand	Anodyne	ROCK1	22	42
O=C(NCCCOCC1CC1)NCc1nc(-c2ccncc2)cs1	ZINC000875021814	EF	On-Demand	Anodyne	ROCK2	15	42
CCCCCCCNC(=O)C(=O)NCc1ccccc1S(=O)(=O)N(C)C	ZINC000875021822	GD	On-Demand	Mild	ASAH1	75	34
O=C(NCCCOCC1CC1)NC1CC(Nc2ccccc2)C1	ZINC000875021827	DF	On-Demand	Anodyne	EPHX2	18	41
COC(=O)N(C)NC(=O)NCCc1cccc(F)c1	ZINC000875021843	CD	On-Demand	Reactive	MTNR1A	42	42
COC(=O)N(C)NC(=O)NCCc1cccc(F)c1	ZINC000875021843	CD	On-Demand	Reactive	MTNR1B	29	42
CC[C@@H](NC(=O)C(=O)NC1CCN(C2CC2)CC1)c1cccc(OC)c1OC	ZINC000875021852	GE	On-Demand	Anodyne	DRD2	16	45
CC[C@@H](NC(=O)C(=O)NC1CCN(C2CC2)CC1)c1cccc(OC)c1OC	ZINC000875021852	GE	On-Demand	Anodyne	ADRA1D	28	41
CC[C@@H](NC(=O)C(=O)NC1CCN(C2CC2)CC1)c1cccc(OC)c1OC	ZINC000875021852	GE	On-Demand	Anodyne	ADRA1A	20	41
CC[C@@H](NC(=O)C(=O)NC1CCN(C2CC2)CC1)c1cccc(OC)c1OC	ZINC000875021852	GE	On-Demand	Anodyne	ADRA1B	24	41
O=C(NCCO)C1CCN(C(=O)NCCc2cccc(F)c2)CC1	ZINC000875021856	EC	On-Demand	Anodyne	EPHX2	16	44
O=C(NCCO)C1CCN(C(=O)NCCc2cccc(F)c2)CC1	ZINC000875021856	EC	On-Demand	Anodyne	CACNA1G	38	50
N#Cc1cc(F)ccc1N1CCN(C(=O)C(=O)NC2CCN(C3CC3)CC2)CC1	ZINC000875021876	GD	On-Demand	Mild	ADRA1D	24	43
N#Cc1cc(F)ccc1N1CCN(C(=O)C(=O)NC2CCN(C3CC3)CC2)CC1	ZINC000875021876	GD	On-Demand	Mild	ADRA1A	18	43
N#Cc1cc(F)ccc1N1CCN(C(=O)C(=O)NC2CCN(C3CC3)CC2)CC1	ZINC000875021876	GD	On-Demand	Mild	ADRA1B	20	43
O=C(NCCc1cccc(F)c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875021884	EG	On-Demand	Anodyne	PREP	42	37
O=C(NCCc1cccc(F)c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875021885	EG	On-Demand	Anodyne	PREP	42	37
O=C(NCCc1cccc(F)c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875021886	EG	On-Demand	Anodyne	PREP	42	37
O=C(NCCc1cccc(F)c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875021887	EG	On-Demand	Anodyne	PREP	42	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000875021914	FF	On-Demand	Anodyne	SLC6A3	56	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000875021914	FF	On-Demand	Anodyne	HRH3	23	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000875021914	FF	On-Demand	Anodyne	SIGMAR1	26	47
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000875021915	FF	On-Demand	Anodyne	SLC6A3	56	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000875021915	FF	On-Demand	Anodyne	HRH3	23	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000875021915	FF	On-Demand	Anodyne	SIGMAR1	26	47
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2cccc(F)c2)C1	ZINC000875021943	DE	On-Demand	Anodyne	NOS1	15	40
CN(C)C[C@@H]1CN(C(=O)NCCc2cccc(F)c2)C[C@H]1CN(C)C	ZINC000875021945	FD	On-Demand	Anodyne	NOS1	15	41
O=CN1CCCN(C(=O)NCc2ccc(CN3CCCC3)cc2)CC1	ZINC000875021948	ED	On-Demand	Anodyne	HRH3	21	46
O=CN1CCCN(C(=O)NCc2ccc(CN3CCCC3)cc2)CC1	ZINC000875021948	ED	On-Demand	Anodyne	SIGMAR1	16	45
O=CN1CCCN(C(=O)NCc2ccc(CN3CCCC3)cc2)CC1	ZINC000875021948	ED	On-Demand	Anodyne	NAMPT	19	40
O=C(NC1CCN(C2CC2)CC1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875021953	GE	On-Demand	Anodyne	CHRNA7	50	39
O=C(NC1CCN(C2CC2)CC1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875021953	GE	On-Demand	Anodyne	C3AR1	50	48
O=C(NC1CCN(C2CC2)CC1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875021954	GE	On-Demand	Anodyne	CHRNA7	50	39
O=C(NC1CCN(C2CC2)CC1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875021954	GE	On-Demand	Anodyne	C3AR1	50	48
CC(=O)N(C)c1ccc(CNC(=O)NCc2ccc(CN3CCCC3)cc2)cc1	ZINC000875021959	GG	On-Demand	Anodyne	HRH2	24	43
CC(=O)N(C)c1ccc(CNC(=O)NCc2ccc(CN3CCCC3)cc2)cc1	ZINC000875021959	GG	On-Demand	Anodyne	HRH3	24	46
CC(=O)N(C)c1ccc(CNC(=O)NCc2ccc(CN3CCCC3)cc2)cc1	ZINC000875021959	GG	On-Demand	Anodyne	SIGMAR1	19	44
CC(=O)N(C)c1ccc(CNC(=O)NCc2ccc(CN3CCCC3)cc2)cc1	ZINC000875021959	GG	On-Demand	Anodyne	MLNR	34	40
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCOC3CCCCC3)C[C@@H]1C2	ZINC000875021963	EE	On-Demand	Anodyne	EPHX2	24	51
O=C(NC1CCN(C2CC2)CC1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875021975	FD	On-Demand	Anodyne	OXTR	43	36
O=C(NC1CCN(C2CC2)CC1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875021975	FD	On-Demand	Anodyne	SLC18A3	15	40
O=C(NC1CCN(C2CC2)CC1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875021976	FD	On-Demand	Anodyne	OXTR	43	36
O=C(NC1CCN(C2CC2)CC1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875021976	FD	On-Demand	Anodyne	SLC18A3	15	40
COC(=O)C1(O)CN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000875021977	EC	On-Demand	Anodyne	HRH3	27	43
O=C(NCCO)C1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)CC1	ZINC000875021982	GD	On-Demand	Anodyne	HRH3	23	45
O=C(NCCO)C1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)CC1	ZINC000875021982	GD	On-Demand	Anodyne	SIGMAR1	18	57
O=C(NCCO)C1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)CC1	ZINC000875021982	GD	On-Demand	Anodyne	EPHX2	21	54
O=C(NCCO)C1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)CC1	ZINC000875021982	GD	On-Demand	Anodyne	CACNA1G	37	42
CN1CC[C@@H](C(=O)Nc2ccc(S(C)(=O)=O)cc2)[C@@H](c2cnn(C)c2)C1	ZINC000875022000	GD	On-Demand	Anodyne	NAMPT	40	41
CN1CC[C@@H](C(=O)Nc2ccc(S(C)(=O)=O)cc2)[C@H](c2cnn(C)c2)C1	ZINC000875022002	GD	On-Demand	Anodyne	NAMPT	40	41
CCCCCCCNC(=O)C(=O)NCCc1cn2ccccc2n1	ZINC000875022029	EE	On-Demand	Mild	ASAH1	94	37
C[C@@H]1C[C@]1(C(=O)Nc1ccc(S(C)(=O)=O)cc1)C(=O)OC(C)(C)C	ZINC000875022040	FE	On-Demand	Anodyne	GPR119	22	41
C[C@@H]1C[C@]1(C(=O)Nc1ccc(S(C)(=O)=O)cc1)C(=O)OC(C)(C)C	ZINC000875022040	FE	On-Demand	Anodyne	P96878_MYCTU	41	32
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccc(OC)cc1)C(C)C	ZINC000875022064	FG	On-Demand	Anodyne	SLC6A4	25	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccc(OC)cc1)C(C)C	ZINC000875022064	FG	On-Demand	Anodyne	SLC6A3	52	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccc(OC)cc1)C(C)C	ZINC000875022065	FG	On-Demand	Anodyne	SLC6A4	25	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccc(OC)cc1)C(C)C	ZINC000875022065	FG	On-Demand	Anodyne	SLC6A3	52	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccc(OC)cc1)C(C)C	ZINC000875022066	FG	On-Demand	Anodyne	SLC6A4	25	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccc(OC)cc1)C(C)C	ZINC000875022066	FG	On-Demand	Anodyne	SLC6A3	52	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccc(OC)cc1)C(C)C	ZINC000875022067	FG	On-Demand	Anodyne	SLC6A4	25	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccc(OC)cc1)C(C)C	ZINC000875022067	FG	On-Demand	Anodyne	SLC6A3	52	45
COc1ccc([C@H](NC(=O)N2CCC(C(=O)NCCO)CC2)C(C)C)cc1	ZINC000875022068	GD	On-Demand	Anodyne	MTNR1A	29	42
COc1ccc([C@H](NC(=O)N2CCC(C(=O)NCCO)CC2)C(C)C)cc1	ZINC000875022068	GD	On-Demand	Anodyne	MTNR1B	25	40
COc1ccc([C@@H](NC(=O)N2CCC(C(=O)NCCO)CC2)C(C)C)cc1	ZINC000875022069	GD	On-Demand	Anodyne	MTNR1A	29	42
COc1ccc([C@@H](NC(=O)N2CCC(C(=O)NCCO)CC2)C(C)C)cc1	ZINC000875022069	GD	On-Demand	Anodyne	MTNR1B	25	40
CCCCCCCNC(=O)C(=O)NCc1ccc(N2CCN(C)CC2)nc1	ZINC000875022111	GD	On-Demand	Mild	ASAH1	77	36
CCCCCCCNC(=O)C(=O)NCc1ccc(N2CCN(C)CC2)nc1	ZINC000875022111	GD	On-Demand	Mild	TLR7	17	44
CS(=O)(=O)c1ccc(NC(=O)[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000875022129	FG	On-Demand	Anodyne	TBXAS1	29	42
CS(=O)(=O)c1ccc(NC(=O)[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000875022129	FG	On-Demand	Anodyne	TIMP3	36	40
CS(=O)(=O)c1ccc(NC(=O)[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000875022129	FG	On-Demand	Anodyne	C3AR1	43	45
CS(=O)(=O)c1ccc(NC(=O)[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000875022129	FG	On-Demand	Anodyne	CYP2C9	19	44
CS(=O)(=O)c1ccc(NC(=O)[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000875022129	FG	On-Demand	Anodyne	NAMPT	85	47
CS(=O)(=O)c1ccc(NC(=O)[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000875022130	FG	On-Demand	Anodyne	TBXAS1	29	42
CS(=O)(=O)c1ccc(NC(=O)[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000875022130	FG	On-Demand	Anodyne	TIMP3	36	40
CS(=O)(=O)c1ccc(NC(=O)[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000875022130	FG	On-Demand	Anodyne	C3AR1	43	45
CS(=O)(=O)c1ccc(NC(=O)[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000875022130	FG	On-Demand	Anodyne	CYP2C9	19	44
CS(=O)(=O)c1ccc(NC(=O)[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000875022130	FG	On-Demand	Anodyne	NAMPT	85	47
COC(=O)[C@@H]1CO[C@H](CCC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	ZINC000875022136	FD	On-Demand	Anodyne	F13A1	43	34
CS(=O)(=O)c1ccc(NC(=O)[C@@H]2CC[C@H](Cc3ccccc3)O2)cc1	ZINC000875022152	FF	On-Demand	Anodyne	PTGS2	16	48
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCN(C)CC3)nc2)C1	ZINC000875022155	GC	On-Demand	Anodyne	GPBAR1	20	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCN(C)CC3)nc2)C1	ZINC000875022156	GC	On-Demand	Anodyne	GPBAR1	20	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](c2ccccc2)C(C)C)C1	ZINC000875022172	EG	On-Demand	Anodyne	ACE	24	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](c2ccccc2)C(C)C)C1	ZINC000875022173	EG	On-Demand	Anodyne	ACE	24	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccc(F)cc1)C(C)C	ZINC000875022241	EG	On-Demand	Anodyne	SLC6A4	27	49
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccc(F)cc1)C(C)C	ZINC000875022241	EG	On-Demand	Anodyne	SLC6A3	68	53
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccc(F)cc1)C(C)C	ZINC000875022242	EG	On-Demand	Anodyne	SLC6A4	27	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccc(F)cc1)C(C)C	ZINC000875022242	EG	On-Demand	Anodyne	SLC6A3	68	53
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccc(F)cc1)C(C)C	ZINC000875022243	EG	On-Demand	Anodyne	SLC6A4	27	49
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccc(F)cc1)C(C)C	ZINC000875022243	EG	On-Demand	Anodyne	SLC6A3	68	53
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccc(F)cc1)C(C)C	ZINC000875022244	EG	On-Demand	Anodyne	SLC6A4	27	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccc(F)cc1)C(C)C	ZINC000875022244	EG	On-Demand	Anodyne	SLC6A3	68	53
CCOC1CC2(C1)C[C@H]2C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022291	DE	On-Demand	Anodyne	TIMP3	48	31
CS(=O)(=O)c1ccc(NC(=O)c2cccn(C3CC3)c2=O)cc1	ZINC000875022295	ED	On-Demand	Anodyne	AVPR2	40	36
COc1ccc([C@@H](NC(=O)N2CCC[C@@H](C(C)(C)O)C2)C(C)C)cc1	ZINC000875022304	EH	On-Demand	Anodyne	MMP13	17	40
COc1ccc([C@@H](NC(=O)N2CCC[C@@H](C(C)(C)O)C2)C(C)C)cc1	ZINC000875022304	EH	On-Demand	Anodyne	MMP1	15	40
COc1ccc([C@@H](NC(=O)N2CCC[C@@H](C(C)(C)O)C2)C(C)C)cc1	ZINC000875022304	EH	On-Demand	Anodyne	BIRC2	17	42
COc1ccc([C@H](NC(=O)N2CCC[C@H](C(C)(C)O)C2)C(C)C)cc1	ZINC000875022305	EH	On-Demand	Anodyne	MMP13	17	40
COc1ccc([C@H](NC(=O)N2CCC[C@H](C(C)(C)O)C2)C(C)C)cc1	ZINC000875022305	EH	On-Demand	Anodyne	MMP1	15	40
COc1ccc([C@H](NC(=O)N2CCC[C@H](C(C)(C)O)C2)C(C)C)cc1	ZINC000875022305	EH	On-Demand	Anodyne	BIRC2	17	42
COc1ccc([C@H](NC(=O)N2CCC[C@@H](C(C)(C)O)C2)C(C)C)cc1	ZINC000875022306	EH	On-Demand	Anodyne	MMP13	17	40
COc1ccc([C@H](NC(=O)N2CCC[C@@H](C(C)(C)O)C2)C(C)C)cc1	ZINC000875022306	EH	On-Demand	Anodyne	MMP1	15	40
COc1ccc([C@H](NC(=O)N2CCC[C@@H](C(C)(C)O)C2)C(C)C)cc1	ZINC000875022306	EH	On-Demand	Anodyne	BIRC2	17	42
COc1ccc([C@@H](NC(=O)N2CCC[C@H](C(C)(C)O)C2)C(C)C)cc1	ZINC000875022307	EH	On-Demand	Anodyne	MMP13	17	40
COc1ccc([C@@H](NC(=O)N2CCC[C@H](C(C)(C)O)C2)C(C)C)cc1	ZINC000875022307	EH	On-Demand	Anodyne	MMP1	15	40
COc1ccc([C@@H](NC(=O)N2CCC[C@H](C(C)(C)O)C2)C(C)C)cc1	ZINC000875022307	EH	On-Demand	Anodyne	BIRC2	17	42
COc1ccc([C@@H](NC(=O)N2CCCN(C(=O)CC(C)C)CC2)C(C)C)cc1	ZINC000875022367	GH	On-Demand	Anodyne	MMP1	15	40
COc1ccc([C@H](NC(=O)N2CCCN(C(=O)CC(C)C)CC2)C(C)C)cc1	ZINC000875022368	GH	On-Demand	Anodyne	MMP1	15	40
COc1ccc([C@@H](NC(=O)N2CCC(N3CCN(C)CC3)CC2)C(C)C)cc1	ZINC000875022398	GF	On-Demand	Anodyne	CHRM2	61	42
COc1ccc([C@@H](NC(=O)N2CCC(N3CCN(C)CC3)CC2)C(C)C)cc1	ZINC000875022398	GF	On-Demand	Anodyne	L3MBTL3	55	40
COc1ccc([C@H](NC(=O)N2CCC(N3CCN(C)CC3)CC2)C(C)C)cc1	ZINC000875022399	GF	On-Demand	Anodyne	CHRM2	61	42
COc1ccc([C@H](NC(=O)N2CCC(N3CCN(C)CC3)CC2)C(C)C)cc1	ZINC000875022399	GF	On-Demand	Anodyne	L3MBTL3	55	40
CCO[C@@H](C(=O)Nc1ccc(S(C)(=O)=O)cc1)C1CCCC1	ZINC000875022417	EF	On-Demand	Anodyne	TIMP3	40	31
CCO[C@@H](C(=O)Nc1ccc(S(C)(=O)=O)cc1)C1CCCC1	ZINC000875022417	EF	On-Demand	Anodyne	CA14	16	41
CCO[C@@H](C(=O)Nc1ccc(S(C)(=O)=O)cc1)C1CCCC1	ZINC000875022417	EF	On-Demand	Anodyne	F13A1	50	35
CCO[C@@H](C(=O)Nc1ccc(S(C)(=O)=O)cc1)C1CCCC1	ZINC000875022417	EF	On-Demand	Anodyne	MTCA1	17	40
CCO[C@@H](C(=O)Nc1ccc(S(C)(=O)=O)cc1)C1CCCC1	ZINC000875022417	EF	On-Demand	Anodyne	P96878_MYCTU	24	40
C[C@H](CCc1ccc(F)cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022424	EG	On-Demand	Anodyne	CA2	28	52
C[C@H](CCc1ccc(F)cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022424	EG	On-Demand	Anodyne	PTGS2	42	60
C[C@H](CCc1ccc(F)cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022424	EG	On-Demand	Anodyne	CA1	28	47
C[C@H](CCc1ccc(F)cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022424	EG	On-Demand	Anodyne	CA7	18	49
C[C@H](CCc1ccc(F)cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022424	EG	On-Demand	Anodyne	CTSF	43	32
C[C@H](CCc1ccc(F)cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022424	EG	On-Demand	Anodyne	CA4	24	41
C[C@H](CCc1ccc(F)cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022424	EG	On-Demand	Anodyne	CA14	19	52
C[C@H](CCc1ccc(F)cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022424	EG	On-Demand	Anodyne	MMP2	25	48
C[C@H](CCc1ccc(F)cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022424	EG	On-Demand	Anodyne	MMP3	25	48
C[C@H](CCc1ccc(F)cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022424	EG	On-Demand	Anodyne	CA12	23	47
C[C@H](CCc1ccc(F)cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022424	EG	On-Demand	Anodyne	CA9	21	47
C[C@H](CCc1ccc(F)cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022424	EG	On-Demand	Anodyne	AOC3	17	41
C[C@H](CCc1ccc(F)cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022424	EG	On-Demand	Anodyne	LEF	48	41
C[C@H](CCc1ccc(F)cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022424	EG	On-Demand	Anodyne	IDO1	26	42
C[C@H](CCc1ccc(F)cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022424	EG	On-Demand	Anodyne	MTCA1	28	43
C[C@H](CCc1ccc(F)cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022424	EG	On-Demand	Anodyne	P96878_MYCTU	35	43
C[C@@H](CCc1ccc(F)cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022425	EG	On-Demand	Anodyne	CA2	28	52
C[C@@H](CCc1ccc(F)cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022425	EG	On-Demand	Anodyne	PTGS2	42	60
C[C@@H](CCc1ccc(F)cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022425	EG	On-Demand	Anodyne	CA1	28	47
C[C@@H](CCc1ccc(F)cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022425	EG	On-Demand	Anodyne	CA7	18	49
C[C@@H](CCc1ccc(F)cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022425	EG	On-Demand	Anodyne	CTSF	43	32
C[C@@H](CCc1ccc(F)cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022425	EG	On-Demand	Anodyne	CA4	24	41
C[C@@H](CCc1ccc(F)cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022425	EG	On-Demand	Anodyne	CA14	19	52
C[C@@H](CCc1ccc(F)cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022425	EG	On-Demand	Anodyne	MMP2	25	48
C[C@@H](CCc1ccc(F)cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022425	EG	On-Demand	Anodyne	MMP3	25	48
C[C@@H](CCc1ccc(F)cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022425	EG	On-Demand	Anodyne	CA12	23	47
C[C@@H](CCc1ccc(F)cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022425	EG	On-Demand	Anodyne	CA9	21	47
C[C@@H](CCc1ccc(F)cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022425	EG	On-Demand	Anodyne	AOC3	17	41
C[C@@H](CCc1ccc(F)cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022425	EG	On-Demand	Anodyne	LEF	48	41
C[C@@H](CCc1ccc(F)cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022425	EG	On-Demand	Anodyne	IDO1	26	42
C[C@@H](CCc1ccc(F)cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022425	EG	On-Demand	Anodyne	MTCA1	28	43
C[C@@H](CCc1ccc(F)cc1)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022425	EG	On-Demand	Anodyne	P96878_MYCTU	35	43
CC(C)n1ncc(C(=O)Nc2ccc(S(C)(=O)=O)cc2)c1Cl	ZINC000875022437	EF	On-Demand	Anodyne	SMO	18	40
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCCCOC[C@H]1CCCO1)CC2	ZINC000875022555	GF	On-Demand	Anodyne	SLC18A2	45	32
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCCCOC[C@H]1CCCO1)CC2	ZINC000875022556	GF	On-Demand	Anodyne	SLC18A2	45	32
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCCCOC[C@@H]1CCCO1)CC2	ZINC000875022557	GF	On-Demand	Anodyne	SLC18A2	45	32
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCCCOC[C@@H]1CCCO1)CC2	ZINC000875022558	GF	On-Demand	Anodyne	SLC18A2	45	32
CCCCCCCNC(=O)C(=O)NCc1ccc(C(=O)N2CCOCC2)cc1	ZINC000875022570	GD	On-Demand	Mild	ASAH1	81	43
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1cc[n+]([O-])cc1	ZINC000875022575	EF	On-Demand	Anodyne	SCD1	46	50
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1cc[n+]([O-])cc1	ZINC000875022575	EF	On-Demand	Anodyne	SCD	41	59
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](c1ccccc1)C(C)C	ZINC000875022628	CG	On-Demand	Anodyne	TACR3	29	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](c1ccccc1)C(C)C	ZINC000875022629	CG	On-Demand	Anodyne	TACR3	29	40
CCO[C@@H](C(=O)Nc1ccc(S(C)(=O)=O)cc1)C1CCOCC1	ZINC000875022638	ED	On-Demand	Anodyne	GCK	16	44
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)ccc1F	ZINC000875022681	JI	On-Demand	Anodyne	CPT1B	18	41
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)ccc1F	ZINC000875022681	JI	On-Demand	Anodyne	SCD1	47	51
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)ccc1F	ZINC000875022681	JI	On-Demand	Anodyne	SCD	42	59
O=C(NCCCOC[C@H]1CCCO1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875022699	FE	On-Demand	Anodyne	ADRB1	17	40
O=C(NCCCOC[C@H]1CCCO1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875022699	FE	On-Demand	Anodyne	HRH2	23	41
O=C(NCCCOC[C@H]1CCCO1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875022702	FE	On-Demand	Anodyne	ADRB1	17	40
O=C(NCCCOC[C@H]1CCCO1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875022702	FE	On-Demand	Anodyne	HRH2	23	41
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022703	EF	On-Demand	Anodyne	KCNA5	19	42
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022703	EF	On-Demand	Anodyne	CA14	29	42
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022703	EF	On-Demand	Anodyne	MTNR1A	25	47
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022703	EF	On-Demand	Anodyne	MTNR1B	28	47
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022703	EF	On-Demand	Anodyne	MMP2	20	41
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022703	EF	On-Demand	Anodyne	MMP3	32	40
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022703	EF	On-Demand	Anodyne	MMP8	21	40
O=C(NCCCOC[C@@H]1CCCO1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875022704	FE	On-Demand	Anodyne	ADRB1	17	40
O=C(NCCCOC[C@@H]1CCCO1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875022704	FE	On-Demand	Anodyne	HRH2	23	41
O=C(NCCCOC[C@@H]1CCCO1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875022706	FE	On-Demand	Anodyne	ADRB1	17	40
O=C(NCCCOC[C@@H]1CCCO1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875022706	FE	On-Demand	Anodyne	HRH2	23	41
CC(=O)Nc1ccc(CNC(=O)C(=O)NC[C@H]2c3ccccc3CN2C)cc1	ZINC000875022708	GD	On-Demand	Anodyne	TSHR	40	29
CC(=O)Nc1ccc(CNC(=O)C(=O)NC[C@H]2c3ccccc3CN2C)cc1	ZINC000875022708	GD	On-Demand	Anodyne	NOD2	40	33
CC(=O)Nc1ccc(CNC(=O)C(=O)NC[C@@H]2c3ccccc3CN2C)cc1	ZINC000875022710	GD	On-Demand	Anodyne	TSHR	40	29
CC(=O)Nc1ccc(CNC(=O)C(=O)NC[C@@H]2c3ccccc3CN2C)cc1	ZINC000875022710	GD	On-Demand	Anodyne	NOD2	40	33
O=C(N[C@@H](c1ccccc1)c1ccco1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875022727	GG	On-Demand	Anodyne	ETHR	52	36
O=C(N[C@H](c1ccccc1)c1ccco1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875022729	GG	On-Demand	Anodyne	ETHR	52	36
O=C(N[C@@H](c1ccccc1)c1ccco1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875022731	GG	On-Demand	Anodyne	ETHR	52	36
O=C(N[C@H](c1ccccc1)c1ccco1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875022733	GG	On-Demand	Anodyne	ETHR	52	36
COc1ccc([C@@H](NC(=O)N2CCC[C@@H](C(C)=O)C2)C(C)C)cc1	ZINC000875022752	EG	On-Demand	Anodyne	CHRM2	21	40
COc1ccc([C@@H](NC(=O)N2CCC[C@@H](C(C)=O)C2)C(C)C)cc1	ZINC000875022752	EG	On-Demand	Anodyne	MMP13	18	42
COc1ccc([C@@H](NC(=O)N2CCC[C@@H](C(C)=O)C2)C(C)C)cc1	ZINC000875022752	EG	On-Demand	Anodyne	MMP9	16	41
COc1ccc([C@@H](NC(=O)N2CCC[C@@H](C(C)=O)C2)C(C)C)cc1	ZINC000875022752	EG	On-Demand	Anodyne	MMP1	17	42
COc1ccc([C@H](NC(=O)N2CCC[C@H](C(C)=O)C2)C(C)C)cc1	ZINC000875022754	EG	On-Demand	Anodyne	CHRM2	21	40
COc1ccc([C@H](NC(=O)N2CCC[C@H](C(C)=O)C2)C(C)C)cc1	ZINC000875022754	EG	On-Demand	Anodyne	MMP13	18	42
COc1ccc([C@H](NC(=O)N2CCC[C@H](C(C)=O)C2)C(C)C)cc1	ZINC000875022754	EG	On-Demand	Anodyne	MMP9	16	41
COc1ccc([C@H](NC(=O)N2CCC[C@H](C(C)=O)C2)C(C)C)cc1	ZINC000875022754	EG	On-Demand	Anodyne	MMP1	17	42
COc1ccc([C@H](NC(=O)N2CCC[C@@H](C(C)=O)C2)C(C)C)cc1	ZINC000875022756	EG	On-Demand	Anodyne	CHRM2	21	40
COc1ccc([C@H](NC(=O)N2CCC[C@@H](C(C)=O)C2)C(C)C)cc1	ZINC000875022756	EG	On-Demand	Anodyne	MMP13	18	42
COc1ccc([C@H](NC(=O)N2CCC[C@@H](C(C)=O)C2)C(C)C)cc1	ZINC000875022756	EG	On-Demand	Anodyne	MMP9	16	41
COc1ccc([C@H](NC(=O)N2CCC[C@@H](C(C)=O)C2)C(C)C)cc1	ZINC000875022756	EG	On-Demand	Anodyne	MMP1	17	42
COc1ccc([C@@H](NC(=O)N2CCC[C@H](C(C)=O)C2)C(C)C)cc1	ZINC000875022758	EG	On-Demand	Anodyne	CHRM2	21	40
COc1ccc([C@@H](NC(=O)N2CCC[C@H](C(C)=O)C2)C(C)C)cc1	ZINC000875022758	EG	On-Demand	Anodyne	MMP13	18	42
COc1ccc([C@@H](NC(=O)N2CCC[C@H](C(C)=O)C2)C(C)C)cc1	ZINC000875022758	EG	On-Demand	Anodyne	MMP9	16	41
COc1ccc([C@@H](NC(=O)N2CCC[C@H](C(C)=O)C2)C(C)C)cc1	ZINC000875022758	EG	On-Demand	Anodyne	MMP1	17	42
CC(=O)Nc1ccc(CNC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)cc1	ZINC000875022817	GE	On-Demand	Anodyne	NPY5R	20	41
CC(=O)Nc1ccc(CNC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)cc1	ZINC000875022818	GE	On-Demand	Anodyne	NPY5R	20	41
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)ccc1Cl	ZINC000875022842	JJ	On-Demand	Anodyne	CPT1A	17	42
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)ccc1Cl	ZINC000875022842	JJ	On-Demand	Anodyne	CPT1B	39	42
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)ccc1Cl	ZINC000875022842	JJ	On-Demand	Anodyne	SCD1	48	54
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)ccc1Cl	ZINC000875022842	JJ	On-Demand	Anodyne	SCD	41	56
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1cc(Cl)ccc1[N+](=O)[O-]	ZINC000875022843	HJ	On-Demand	Bother	SCD1	41	47
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1cc(Cl)ccc1[N+](=O)[O-]	ZINC000875022843	HJ	On-Demand	Bother	SCD	34	51
CC(=O)Nc1ccc(CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875022871	EC	On-Demand	Anodyne	NPY2R	24	41
CC(=O)Nc1ccc(CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875022873	EC	On-Demand	Anodyne	NPY2R	24	41
COc1cccc(C(C)(C)C(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	ZINC000875022945	EG	On-Demand	Anodyne	PTGS2	18	54
COc1cccc(C(C)(C)C(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	ZINC000875022945	EG	On-Demand	Anodyne	MTNR1A	24	44
COc1cccc(C(C)(C)C(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	ZINC000875022945	EG	On-Demand	Anodyne	MTNR1B	27	46
COc1cccc(C(C)(C)C(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	ZINC000875022945	EG	On-Demand	Anodyne	UREA_CANEN	21	45
COc1cccc(C(C)(C)C(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	ZINC000875022945	EG	On-Demand	Anodyne	MTCA1	21	40
COc1cccc(C(C)(C)C(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	ZINC000875022945	EG	On-Demand	Anodyne	P96878_MYCTU	22	40
COc1cccc(C(C)(C)C(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	ZINC000875022945	EG	On-Demand	Anodyne	IMDH_CRYPV	35	42
CCC[C@@H](CC)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022969	CF	On-Demand	Anodyne	CA2	26	77
CCC[C@@H](CC)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022969	CF	On-Demand	Anodyne	CA1	28	65
CCC[C@@H](CC)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022969	CF	On-Demand	Anodyne	CA7	20	77
CCC[C@@H](CC)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022969	CF	On-Demand	Anodyne	CA4	25	68
CCC[C@@H](CC)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022969	CF	On-Demand	Anodyne	CA14	21	77
CCC[C@@H](CC)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022969	CF	On-Demand	Anodyne	CA12	18	51
CCC[C@@H](CC)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022969	CF	On-Demand	Anodyne	CA9	19	51
CCC[C@@H](CC)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022969	CF	On-Demand	Anodyne	P96878_MYCTU	45	38
CCC[C@H](CC)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022970	CF	On-Demand	Anodyne	CA2	26	77
CCC[C@H](CC)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022970	CF	On-Demand	Anodyne	CA1	28	65
CCC[C@H](CC)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022970	CF	On-Demand	Anodyne	CA7	20	77
CCC[C@H](CC)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022970	CF	On-Demand	Anodyne	CA4	25	68
CCC[C@H](CC)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022970	CF	On-Demand	Anodyne	CA14	21	77
CCC[C@H](CC)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022970	CF	On-Demand	Anodyne	CA12	18	51
CCC[C@H](CC)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022970	CF	On-Demand	Anodyne	CA9	19	51
CCC[C@H](CC)C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875022970	CF	On-Demand	Anodyne	P96878_MYCTU	45	38
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000875022982	JG	On-Demand	Anodyne	CPT1A	20	41
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000875022982	JG	On-Demand	Anodyne	CPT1B	40	39
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000875022982	JG	On-Demand	Anodyne	SCD1	44	51
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000875022982	JG	On-Demand	Anodyne	SCD	37	55
CO[C@H](C(=O)Nc1ccc(S(C)(=O)=O)cc1)C(=O)OC(C)(C)C	ZINC000875022993	ED	On-Demand	Anodyne	CA2	34	52
CO[C@H](C(=O)Nc1ccc(S(C)(=O)=O)cc1)C(=O)OC(C)(C)C	ZINC000875022993	ED	On-Demand	Anodyne	CA1	39	42
CO[C@H](C(=O)Nc1ccc(S(C)(=O)=O)cc1)C(=O)OC(C)(C)C	ZINC000875022993	ED	On-Demand	Anodyne	CA7	18	52
CO[C@H](C(=O)Nc1ccc(S(C)(=O)=O)cc1)C(=O)OC(C)(C)C	ZINC000875022993	ED	On-Demand	Anodyne	CA4	22	42
CO[C@H](C(=O)Nc1ccc(S(C)(=O)=O)cc1)C(=O)OC(C)(C)C	ZINC000875022993	ED	On-Demand	Anodyne	CA14	22	52
CO[C@H](C(=O)Nc1ccc(S(C)(=O)=O)cc1)C(=O)OC(C)(C)C	ZINC000875022993	ED	On-Demand	Anodyne	CA12	32	44
CO[C@H](C(=O)Nc1ccc(S(C)(=O)=O)cc1)C(=O)OC(C)(C)C	ZINC000875022993	ED	On-Demand	Anodyne	CA9	29	47
CO[C@H](C(=O)Nc1ccc(S(C)(=O)=O)cc1)C(=O)OC(C)(C)C	ZINC000875022993	ED	On-Demand	Anodyne	CYNT	28	40
CO[C@H](C(=O)Nc1ccc(S(C)(=O)=O)cc1)C(=O)OC(C)(C)C	ZINC000875022993	ED	On-Demand	Anodyne	MTCA1	44	39
CO[C@H](C(=O)Nc1ccc(S(C)(=O)=O)cc1)C(=O)OC(C)(C)C	ZINC000875022993	ED	On-Demand	Anodyne	P96878_MYCTU	55	39
COc1ccc(OCCNC(=O)NCC[C@H](O)C2CCCC2)cc1	ZINC000875022997	EE	On-Demand	Anodyne	ADRB1	22	48
COc1ccc(OCCNC(=O)NCC[C@H](O)C2CCCC2)cc1	ZINC000875022997	EE	On-Demand	Anodyne	MTNR1A	33	40
COc1ccc(OCCNC(=O)NCC[C@H](O)C2CCCC2)cc1	ZINC000875022997	EE	On-Demand	Anodyne	MTNR1B	24	40
COc1ccc(OCCNC(=O)NCC[C@H](O)C2CCCC2)cc1	ZINC000875022997	EE	On-Demand	Anodyne	MMP3	15	40
COc1ccc(OCCNC(=O)NCC[C@@H](O)C2CCCC2)cc1	ZINC000875022998	EE	On-Demand	Anodyne	ADRB1	22	48
COc1ccc(OCCNC(=O)NCC[C@@H](O)C2CCCC2)cc1	ZINC000875022998	EE	On-Demand	Anodyne	MTNR1A	33	40
COc1ccc(OCCNC(=O)NCC[C@@H](O)C2CCCC2)cc1	ZINC000875022998	EE	On-Demand	Anodyne	MTNR1B	24	40
COc1ccc(OCCNC(=O)NCC[C@@H](O)C2CCCC2)cc1	ZINC000875022998	EE	On-Demand	Anodyne	MMP3	15	40
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)C(=O)N1CCCC2(CC1)CC2	ZINC000875022999	GE	On-Demand	Anodyne	L3MBTL3	54	38
CC1(C)CCC[C@H]1CCNC(=O)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875023000	GF	On-Demand	Anodyne	L3MBTL3	68	38
C=CC(C)(C)CCNC(=O)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875023006	FE	On-Demand	Mild	L3MBTL3	45	35
COC(=O)N(C)NC(=O)N[C@@H](CN1CCOCC1)c1ccccc1	ZINC000875023007	EC	On-Demand	Reactive	CASR	53	41
COC(=O)N(C)NC(=O)N[C@H](CN1CCOCC1)c1ccccc1	ZINC000875023008	EC	On-Demand	Reactive	CASR	53	41
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H](CN(C)C)c2ccccc2)cc1	ZINC000875023013	FF	On-Demand	Anodyne	ANPEP	17	44
CC(=O)N(C)c1ccc(CNC(=O)N[C@H](CN(C)C)c2ccccc2)cc1	ZINC000875023014	FF	On-Demand	Anodyne	ANPEP	17	44
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)C(=O)N1CCO[C@@H](CCF)C1	ZINC000875023019	GD	On-Demand	Anodyne	L3MBTL3	50	36
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)C(=O)N1CCO[C@H](CCF)C1	ZINC000875023020	GD	On-Demand	Anodyne	L3MBTL3	50	36
Cc1scc(CNC(=O)C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)c1C	ZINC000875023031	GF	On-Demand	Anodyne	L3MBTL3	47	36
O=C(N[C@@H](CN1CCOCC1)c1ccccc1)N1Cc2cccc(O)c2C1	ZINC000875023042	FE	On-Demand	Clean	CASR	45	36
O=C(N[C@H](CN1CCOCC1)c1ccccc1)N1Cc2cccc(O)c2C1	ZINC000875023043	FE	On-Demand	Clean	CASR	45	36
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](CN1CCOCC1)c1ccccc1	ZINC000875023050	ED	On-Demand	Anodyne	CASR	43	36
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](CN1CCOCC1)c1ccccc1	ZINC000875023051	ED	On-Demand	Anodyne	CASR	43	36
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NC2CCN(CC(C)C)CC2)c1	ZINC000875023054	FE	On-Demand	Anodyne	SSTR5	32	41
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NC2CCN(CC(C)C)CC2)c1	ZINC000875023055	FE	On-Demand	Anodyne	SSTR5	32	41
O=C(NCCCCC1CC1)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875023061	FE	On-Demand	Anodyne	L3MBTL3	85	43
O=C(N[C@@H](CN1CCOCC1)c1ccccc1)N[C@@H]1CCOC[C@H]1O	ZINC000875023068	EC	On-Demand	Anodyne	CASR	43	35
O=C(C[C@@H]1OC(=O)c2ccccc21)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875023085	HI	On-Demand	Anodyne	SCD	31	47
O=C(C[C@H]1OC(=O)c2ccccc21)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875023086	HI	On-Demand	Anodyne	SCD	31	47
O=C(NCCCOC[C@@H]1CCCO1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875023113	GF	On-Demand	Anodyne	CPT1A	58	32
O=C(NCCCOC[C@@H]1CCCO1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875023114	GF	On-Demand	Anodyne	CPT1A	58	32
O=C(NCCCOC[C@@H]1CCCO1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875023115	GF	On-Demand	Anodyne	CPT1A	58	32
O=C(NCCCOC[C@@H]1CCCO1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875023116	GF	On-Demand	Anodyne	CPT1A	58	32
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)c1ccco1	ZINC000875023128	FG	On-Demand	Anodyne	SLC6A4	23	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)c1ccco1	ZINC000875023128	FG	On-Demand	Anodyne	SLC6A3	53	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)c1ccco1	ZINC000875023128	FG	On-Demand	Anodyne	BIRC8	43	30
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)c1ccco1	ZINC000875023129	FG	On-Demand	Anodyne	SLC6A4	23	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)c1ccco1	ZINC000875023129	FG	On-Demand	Anodyne	SLC6A3	53	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)c1ccco1	ZINC000875023129	FG	On-Demand	Anodyne	BIRC8	43	30
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)c1ccco1	ZINC000875023130	FG	On-Demand	Anodyne	SLC6A4	23	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)c1ccco1	ZINC000875023130	FG	On-Demand	Anodyne	SLC6A3	53	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)c1ccco1	ZINC000875023130	FG	On-Demand	Anodyne	BIRC8	43	30
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)c1ccco1	ZINC000875023131	FG	On-Demand	Anodyne	SLC6A4	23	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)c1ccco1	ZINC000875023131	FG	On-Demand	Anodyne	SLC6A3	53	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)c1ccco1	ZINC000875023131	FG	On-Demand	Anodyne	BIRC8	43	30
O=C(NCCCOC[C@@H]1CCCO1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875023161	GF	On-Demand	Anodyne	SMO	37	44
O=C(NCCCOC[C@@H]1CCCO1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875023161	GF	On-Demand	Anodyne	ETHR	61	47
O=C(NCCCOC[C@H]1CCCO1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875023162	GF	On-Demand	Anodyne	SMO	37	44
O=C(NCCCOC[C@H]1CCCO1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875023162	GF	On-Demand	Anodyne	ETHR	61	47
C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875023177	CE	On-Demand	Anodyne	NAMPT	22	48
C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875023178	CE	On-Demand	Anodyne	NAMPT	22	48
C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875023180	CE	On-Demand	Anodyne	NAMPT	22	48
O=C(/C=C/c1cccs1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875023183	FJ	On-Demand	Anodyne	SCD1	38	42
O=C(/C=C/c1cccs1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875023183	FJ	On-Demand	Anodyne	SCD	34	49
O=C(/C=C\c1cccs1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875023190	FJ	On-Demand	Anodyne	SCD1	38	42
O=C(/C=C\c1cccs1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875023190	FJ	On-Demand	Anodyne	SCD	34	49
C[C@@H](OCCCNC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875023201	EF	On-Demand	Anodyne	AMY2	49	34
C[C@@H](OCCCNC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875023205	EF	On-Demand	Anodyne	AMY2	49	34
CCCCCCCNC(=O)C(=O)NC1CCN(C(=O)c2ccco2)CC1	ZINC000875023225	FE	On-Demand	Mild	EPHX2	28	47
CCCCCCCNC(=O)C(=O)NC1CCN(C(=O)c2ccco2)CC1	ZINC000875023225	FE	On-Demand	Mild	ASAH1	60	32
CN1CCN(C2CCN(C(=O)N[C@@H](c3ccccc3)c3ccco3)CC2)CC1	ZINC000875023226	GF	On-Demand	Anodyne	BIRC8	46	34
CN1CCN(C2CCN(C(=O)N[C@@H](c3ccccc3)c3ccco3)CC2)CC1	ZINC000875023226	GF	On-Demand	Anodyne	L3MBTL3	59	40
CN1CCN(C2CCN(C(=O)N[C@H](c3ccccc3)c3ccco3)CC2)CC1	ZINC000875023227	GF	On-Demand	Anodyne	BIRC8	46	34
CN1CCN(C2CCN(C(=O)N[C@H](c3ccccc3)c3ccco3)CC2)CC1	ZINC000875023227	GF	On-Demand	Anodyne	L3MBTL3	59	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)C(C)C	ZINC000875023253	EG	On-Demand	Anodyne	SLC6A4	31	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)C(C)C	ZINC000875023253	EG	On-Demand	Anodyne	SLC6A3	76	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)C(C)C	ZINC000875023254	EG	On-Demand	Anodyne	SLC6A4	31	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)C(C)C	ZINC000875023254	EG	On-Demand	Anodyne	SLC6A3	76	47
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)C(C)C	ZINC000875023255	EG	On-Demand	Anodyne	SLC6A4	31	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)C(C)C	ZINC000875023255	EG	On-Demand	Anodyne	SLC6A3	76	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)C(C)C	ZINC000875023256	EG	On-Demand	Anodyne	SLC6A4	31	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)C(C)C	ZINC000875023256	EG	On-Demand	Anodyne	SLC6A3	76	47
CCCCCCCNC(=O)C(=O)NC1CCC(C(F)(F)F)CC1	ZINC000875023325	EG	On-Demand	Mild	CES2	48	38
CCCCCCCNC(=O)C(=O)NC1CCC(C(F)(F)F)CC1	ZINC000875023325	EG	On-Demand	Mild	EST1_PIG	63	38
CCCCCCCNC(=O)C(=O)NC1CCC(C(F)(F)F)CC1	ZINC000875023325	EG	On-Demand	Mild	CES2C	56	38
CCCCCCCNC(=O)C(=O)NC1CCC(C(F)(F)F)CC1	ZINC000875023325	EG	On-Demand	Mild	ASAH1	70	34
CC(=O)C1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000875023359	GG	On-Demand	Anodyne	CHRM2	15	41
CC(=O)C1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000875023359	GG	On-Demand	Anodyne	DRD2	17	45
CC(=O)C1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000875023359	GG	On-Demand	Anodyne	DRD4	56	52
CC(=O)C1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000875023359	GG	On-Demand	Anodyne	KCNH2	18	40
CC(=O)C1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000875023359	GG	On-Demand	Anodyne	CHRM3	19	41
CC(=O)C1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000875023359	GG	On-Demand	Anodyne	LTA4H	15	40
CC(=O)C1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000875023359	GG	On-Demand	Anodyne	HRH3	24	41
CC(=O)C1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000875023359	GG	On-Demand	Anodyne	SIGMAR1	37	60
CC(=O)C1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000875023359	GG	On-Demand	Anodyne	SSTR5	51	39
CC(=O)C1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000875023359	GG	On-Demand	Anodyne	CCR1	50	45
CC(=O)C1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000875023359	GG	On-Demand	Anodyne	CCR3	38	48
CC(=O)C1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000875023359	GG	On-Demand	Anodyne	UTS2R	20	41
CC(=O)C1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000875023359	GG	On-Demand	Anodyne	MLNR	44	39
CC(=O)C1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000875023359	GG	On-Demand	Anodyne	LSS	18	43
CC(=O)C1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000875023359	GG	On-Demand	Anodyne	FAAH	18	47
CC(=O)C1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000875023359	GG	On-Demand	Anodyne	CCR2	16	45
CC(=O)C1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000875023359	GG	On-Demand	Anodyne	EPHX2	40	45
CC(=O)C1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000875023359	GG	On-Demand	Anodyne	CXCR3	47	45
CC(=O)C1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000875023359	GG	On-Demand	Anodyne	MCHR1	66	50
CCN(CC)Cc1ccccc1CNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875023378	GE	On-Demand	Anodyne	EPHX2	15	40
CN1CCC(CNC(=O)NCCCOC[C@@H]2CCCO2)(c2ccccc2)CC1	ZINC000875023421	GF	On-Demand	Anodyne	KCNA3	47	41
CN1CCC(CNC(=O)NCCCOC[C@H]2CCCO2)(c2ccccc2)CC1	ZINC000875023422	GF	On-Demand	Anodyne	KCNA3	47	41
C[C@@H](OCCCNC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875023451	EG	On-Demand	Anodyne	C3AR1	45	32
C[C@@H](OCCCNC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875023451	EG	On-Demand	Anodyne	AMY2	52	36
C[C@@H](OCCCNC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875023451	EG	On-Demand	Anodyne	REN	21	41
C[C@@H](OCCCNC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875023453	EG	On-Demand	Anodyne	C3AR1	45	32
C[C@@H](OCCCNC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875023453	EG	On-Demand	Anodyne	AMY2	52	36
C[C@@H](OCCCNC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875023453	EG	On-Demand	Anodyne	REN	21	41
CC(=O)Nc1ccc(CNC(=O)C(=O)N2CCN(C)c3ncccc3C2)cc1	ZINC000875023459	GD	On-Demand	Anodyne	NAMPT	36	40
C[C@@]1(Br)C[C@H]1C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875023491	EE	On-Demand	Anodyne	P96878_MYCTU	44	35
C[C@@]1(Br)C[C@@H]1C(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000875023496	EE	On-Demand	Anodyne	P96878_MYCTU	44	35
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCO[C@H](C)c1ccccc1	ZINC000875023500	FF	On-Demand	Anodyne	SLC6A4	24	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCO[C@H](C)c1ccccc1	ZINC000875023500	FF	On-Demand	Anodyne	SLC6A3	58	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCO[C@@H](C)c1ccccc1	ZINC000875023505	FF	On-Demand	Anodyne	SLC6A4	24	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCO[C@@H](C)c1ccccc1	ZINC000875023505	FF	On-Demand	Anodyne	SLC6A3	58	42
O=C(/C=C/c1ccco1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875023524	EI	On-Demand	Anodyne	SCD1	37	41
O=C(/C=C/c1ccco1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875023524	EI	On-Demand	Anodyne	SCD	34	50
O=C(/C=C\c1ccco1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875023525	EI	On-Demand	Anodyne	SCD1	37	41
O=C(/C=C\c1ccco1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875023525	EI	On-Demand	Anodyne	SCD	34	50
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(C(=O)c3ccco3)CC2)C1	ZINC000875023559	GC	On-Demand	Anodyne	L3MBTL3	44	36
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(C(=O)c3ccco3)CC2)C1	ZINC000875023560	GC	On-Demand	Anodyne	L3MBTL3	44	36
COc1cc(C)ccc1OC(=O)[C@@H](CC(C)C)NC(C)=O	ZINC000875023564	CE	On-Demand	Anodyne	ANPEP	23	41
COc1cc(C)ccc1OC(=O)[C@@H](CC(C)C)NC(C)=O	ZINC000875023564	CE	On-Demand	Anodyne	PAPA1_CARPA	52	33
COc1cc(C)ccc1OC(=O)[C@@H](CC(C)C)NC(C)=O	ZINC000875023564	CE	On-Demand	Anodyne	CTSK	19	40
COc1cc(C)ccc1OC(=O)[C@@H](CC(C)C)NC(C)=O	ZINC000875023564	CE	On-Demand	Anodyne	CAPNS1	57	32
COc1cc(C)ccc1OC(=O)[C@@H](CC(C)C)NC(C)=O	ZINC000875023564	CE	On-Demand	Anodyne	HLA-DRB1	58	34
COc1cc(C)ccc1OC(=O)[C@@H](CC(C)C)NC(C)=O	ZINC000875023564	CE	On-Demand	Anodyne	CAPN1	58	42
COc1cc(C)ccc1OC(=O)[C@@H](CC(C)C)NC(C)=O	ZINC000875023564	CE	On-Demand	Anodyne	CAPN2	64	37
COc1cc(C)ccc1OC(=O)[C@@H](CC(C)C)NC(C)=O	ZINC000875023564	CE	On-Demand	Anodyne	F2RL1	46	30
COc1cc(C)ccc1OC(=O)[C@@H](CC(C)C)NC(C)=O	ZINC000875023564	CE	On-Demand	Anodyne	HPN	48	32
O=C(/C=C/c1ccc([N+](=O)[O-])cc1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875023570	HJ	On-Demand	Bother	SCD	31	52
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875023571	HJ	On-Demand	Bother	SCD	31	52
CC(C)CN1CCC(NC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875023614	GD	On-Demand	Anodyne	SIGMAR1	15	40
CC(C)CN1CCC(NC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875023614	GD	On-Demand	Anodyne	BIRC2	44	37
CC(C)CN1CCC(NC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875023614	GD	On-Demand	Anodyne	WNT3	41	33
CC(C)CN1CCC(NC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875023615	GD	On-Demand	Anodyne	SIGMAR1	15	40
CC(C)CN1CCC(NC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875023615	GD	On-Demand	Anodyne	BIRC2	44	37
CC(C)CN1CCC(NC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875023615	GD	On-Demand	Anodyne	WNT3	41	33
CC(C)CN1CCC(NC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875023616	GD	On-Demand	Anodyne	SIGMAR1	15	40
CC(C)CN1CCC(NC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875023616	GD	On-Demand	Anodyne	BIRC2	44	37
CC(C)CN1CCC(NC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875023616	GD	On-Demand	Anodyne	WNT3	41	33
CC(C)CN1CCC(NC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875023617	GD	On-Demand	Anodyne	SIGMAR1	15	40
CC(C)CN1CCC(NC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875023617	GD	On-Demand	Anodyne	BIRC2	44	37
CC(C)CN1CCC(NC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875023617	GD	On-Demand	Anodyne	WNT3	41	33
CCCCCCCNC(=O)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875023621	FF	On-Demand	Mild	SPHK1	18	40
CCCCCCCNC(=O)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875023621	FF	On-Demand	Mild	ASAH1	87	36
CCCCCCCNC(=O)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875023621	FF	On-Demand	Mild	L3MBTL3	67	40
CCCCCCCNC(=O)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875023621	FF	On-Demand	Mild	HPGD	18	40
CC[C@H](C[C@H](C)O)NC(=O)NCCOc1ccc(OC)cc1	ZINC000875023630	DD	On-Demand	Anodyne	ADRB1	20	42
CC[C@H](C[C@H](C)O)NC(=O)NCCOc1ccc(OC)cc1	ZINC000875023630	DD	On-Demand	Anodyne	MTNR1B	25	40
Cc1ccc(CNC(=O)C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)o1	ZINC000875023632	FD	On-Demand	Anodyne	L3MBTL3	60	37
COc1ccc(OCCNC(=O)N2CCCCCCNC(=O)CC2)cc1	ZINC000875023635	FE	On-Demand	Anodyne	HRH2	26	41
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023640	GG	On-Demand	Anodyne	CHRM2	15	42
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023640	GG	On-Demand	Anodyne	DRD2	17	44
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023640	GG	On-Demand	Anodyne	CNR1	20	47
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023640	GG	On-Demand	Anodyne	DRD4	51	49
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023640	GG	On-Demand	Anodyne	HTR4	19	40
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023640	GG	On-Demand	Anodyne	CHRM3	20	42
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023640	GG	On-Demand	Anodyne	MC4R	21	41
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023640	GG	On-Demand	Anodyne	HRH3	32	43
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023640	GG	On-Demand	Anodyne	SIGMAR1	31	60
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023640	GG	On-Demand	Anodyne	SSTR5	44	39
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023640	GG	On-Demand	Anodyne	CCR1	40	43
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023640	GG	On-Demand	Anodyne	CCR3	46	48
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023640	GG	On-Demand	Anodyne	CCR2	19	45
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023640	GG	On-Demand	Anodyne	EPHX2	22	40
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023640	GG	On-Demand	Anodyne	DPP7	40	40
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023640	GG	On-Demand	Anodyne	CXCR3	44	43
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023640	GG	On-Demand	Anodyne	MCHR1	62	50
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023640	GG	On-Demand	Anodyne	CACNA1G	31	41
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023641	GG	On-Demand	Anodyne	CHRM2	15	42
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023641	GG	On-Demand	Anodyne	DRD2	17	44
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023641	GG	On-Demand	Anodyne	CNR1	20	47
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023641	GG	On-Demand	Anodyne	DRD4	51	49
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023641	GG	On-Demand	Anodyne	HTR4	19	40
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023641	GG	On-Demand	Anodyne	CHRM3	20	42
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023641	GG	On-Demand	Anodyne	MC4R	21	41
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023641	GG	On-Demand	Anodyne	HRH3	32	43
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023641	GG	On-Demand	Anodyne	SIGMAR1	31	60
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023641	GG	On-Demand	Anodyne	SSTR5	44	39
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023641	GG	On-Demand	Anodyne	CCR1	40	43
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023641	GG	On-Demand	Anodyne	CCR3	46	48
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023641	GG	On-Demand	Anodyne	CCR2	19	45
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023641	GG	On-Demand	Anodyne	EPHX2	22	40
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023641	GG	On-Demand	Anodyne	DPP7	40	40
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023641	GG	On-Demand	Anodyne	CXCR3	44	43
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023641	GG	On-Demand	Anodyne	MCHR1	62	50
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875023641	GG	On-Demand	Anodyne	CACNA1G	31	41
COc1ccc(OCCNC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)cc1	ZINC000875023642	GD	On-Demand	Anodyne	MTNR1A	27	40
COc1ccc(OCCNC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)cc1	ZINC000875023642	GD	On-Demand	Anodyne	MTNR1B	19	40
CCC[C@H](CNC(=O)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1)OCC	ZINC000875023643	GD	On-Demand	Anodyne	L3MBTL3	43	34
CCC[C@@H](CNC(=O)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1)OCC	ZINC000875023644	GD	On-Demand	Anodyne	L3MBTL3	43	34
COc1ccc(OCCNC(=O)NC[C@H]2C[C@H](O)C2)cc1	ZINC000875023657	CD	On-Demand	Anodyne	MTNR1A	39	42
COc1ccc(OCCNC(=O)NC[C@H]2C[C@H](O)C2)cc1	ZINC000875023657	CD	On-Demand	Anodyne	MTNR1B	26	42
CCN(CC)Cc1ccc(CNC(=O)N2CCC(C(=O)NCCO)CC2)cc1	ZINC000875023663	GD	On-Demand	Anodyne	EPHX2	17	45
COc1ccc(OCCNC(=O)NN=c2cc[nH]c(C)c2)cc1	ZINC000875023664	DD	On-Demand	Reactive	MTNR1A	30	41
COc1ccc(OCCNC(=O)NN=c2cc[nH]c(C)c2)cc1	ZINC000875023664	DD	On-Demand	Reactive	MTNR1B	21	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1CN(CC)CC	ZINC000875023667	EF	On-Demand	Anodyne	ANPEP	22	43
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)C(=O)NCC1CC=CC1	ZINC000875023674	FD	On-Demand	Anodyne	L3MBTL3	94	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(-c2csc(C)n2)s1	ZINC000875023681	GG	On-Demand	Anodyne	SLC6A3	41	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(-c2csc(C)n2)s1	ZINC000875023682	GG	On-Demand	Anodyne	SLC6A3	41	36
CCOC1CC2(C1)C[C@H]2C(=O)Nc1nc2ccc(CC)cc2s1	ZINC000875023687	EI	On-Demand	Anodyne	CSNK1D	45	44
COc1ccc(OCCNC(=O)N2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000875023690	FG	On-Demand	Anodyne	EPHX2	22	44
COc1ccc(OCCNC(=O)N2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000875023691	FG	On-Demand	Anodyne	EPHX2	22	44
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(F)cc1Br	ZINC000875023700	EG	On-Demand	Anodyne	ANPEP	24	41
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(F)cc1Br	ZINC000875023700	EG	On-Demand	Anodyne	HPN	71	37
C[C@@H]1[C@H](C(=O)NNC(=O)N[C@@H](c2ccccc2)c2ccco2)CCCN1C	ZINC000875023736	FE	On-Demand	Reactive	BIRC8	45	33
C[C@@H]1[C@H](C(=O)NNC(=O)N[C@H](c2ccccc2)c2ccco2)CCCN1C	ZINC000875023737	FE	On-Demand	Reactive	BIRC8	45	33
CCO[C@@H](C(=O)Oc1cccc(C(=O)OC)c1)C(C)C	ZINC000875023740	CE	On-Demand	Anodyne	ACR	40	50
CCO[C@@H](C(=O)Oc1cccc(C(=O)OC)c1)C(C)C	ZINC000875023740	CE	On-Demand	Anodyne	PDS	25	40
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@H](c1ccccc1)c1ccco1	ZINC000875023745	EH	On-Demand	Anodyne	TIMP3	65	33
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@@H](c1ccccc1)c1ccco1	ZINC000875023747	EH	On-Demand	Anodyne	TIMP3	65	33
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(Br)cc1F	ZINC000875023785	EG	On-Demand	Anodyne	ANPEP	24	40
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(Br)cc1F	ZINC000875023785	EG	On-Demand	Anodyne	HPN	57	33
CCCCCCCNC(=O)C(=O)NCc1ccc(NC(C)=O)cc1	ZINC000875023793	EE	On-Demand	Mild	INHA	31	46
CCCCCCCNC(=O)C(=O)NCc1ccc(NC(C)=O)cc1	ZINC000875023793	EE	On-Demand	Mild	S1PR2	63	41
CCCCCCCNC(=O)C(=O)NCc1ccc(NC(C)=O)cc1	ZINC000875023793	EE	On-Demand	Mild	S1PR1	17	41
CCCCCCCNC(=O)C(=O)NCc1ccc(NC(C)=O)cc1	ZINC000875023793	EE	On-Demand	Mild	SPHK1	25	41
CCCCCCCNC(=O)C(=O)NCc1ccc(NC(C)=O)cc1	ZINC000875023793	EE	On-Demand	Mild	ENPP2	28	43
CCCCCCCNC(=O)C(=O)NCc1ccc(NC(C)=O)cc1	ZINC000875023793	EE	On-Demand	Mild	ASAH1	92	37
O=CN1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000875023849	GE	On-Demand	Anodyne	DRD4	46	52
O=CN1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000875023849	GE	On-Demand	Anodyne	CHRM3	17	42
O=CN1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000875023849	GE	On-Demand	Anodyne	SIGMAR1	36	58
O=CN1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000875023849	GE	On-Demand	Anodyne	SSTR5	44	36
O=CN1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000875023849	GE	On-Demand	Anodyne	CCR1	25	45
O=CN1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000875023849	GE	On-Demand	Anodyne	CCR3	37	57
O=CN1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000875023849	GE	On-Demand	Anodyne	FAAH	22	50
O=CN1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000875023849	GE	On-Demand	Anodyne	CCR2	16	43
O=CN1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000875023849	GE	On-Demand	Anodyne	EPHX2	16	40
O=CN1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000875023849	GE	On-Demand	Anodyne	CXCR3	37	43
O=CN1CCCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000875023849	GE	On-Demand	Anodyne	MCHR1	51	50
COc1ccc(OCCNC(=O)N2CC(CNC(=O)C(F)(F)F)C2)cc1	ZINC000875023851	GD	On-Demand	Anodyne	NQO2	15	45
CCN(CC)Cc1ccc(CNC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875023860	FG	On-Demand	Clean	NAMPT	24	47
Cc1nnc(NNC(=O)N[C@@H](CN2CCOCC2)c2ccccc2)n1C	ZINC000875023875	FC	On-Demand	Reactive	CASR	49	40
Cc1nnc(NNC(=O)N[C@H](CN2CCOCC2)c2ccccc2)n1C	ZINC000875023876	FC	On-Demand	Reactive	CASR	49	40
COc1ccc(OCCNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875023877	FD	On-Demand	Anodyne	DRD4	20	42
COc1ccc(OCCNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875023877	FD	On-Demand	Anodyne	HRH2	31	43
COc1ccc(OCCNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875023877	FD	On-Demand	Anodyne	LTA4H	20	42
COc1ccc(OCCNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875023877	FD	On-Demand	Anodyne	CCR3	20	42
COc1ccc(OCCNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875023877	FD	On-Demand	Anodyne	PDK1	40	34
COc1ccc(OCCNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875023877	FD	On-Demand	Anodyne	MCHR1	19	44
COc1ccc(OCCNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875023877	FD	On-Demand	Anodyne	BIRC2	15	40
O=C(NC[C@H]1C[C@H](O)C1)N[C@H](CN1CCOCC1)c1ccccc1	ZINC000875023883	ED	On-Demand	Anodyne	CASR	41	33
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H](CN1CCOCC1)c1ccccc1	ZINC000875023884	ED	On-Demand	Anodyne	CASR	41	33
COC(=O)C1(O)CN(C(=O)NCCOc2ccc(OC)cc2)C1	ZINC000875023885	DC	On-Demand	Anodyne	MTNR1A	41	42
COC(=O)C1(O)CN(C(=O)NCCOc2ccc(OC)cc2)C1	ZINC000875023885	DC	On-Demand	Anodyne	MTNR1B	34	42
CCN(CC)Cc1ccccc1CNC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875023887	GD	On-Demand	Anodyne	EPHX2	27	48
COc1cccc(C(C)(C)C(=O)Nc2cc(NC(C)=O)ccc2OC)c1	ZINC000875023913	FH	On-Demand	Anodyne	MTNR1A	30	48
COc1cccc(C(C)(C)C(=O)Nc2cc(NC(C)=O)ccc2OC)c1	ZINC000875023913	FH	On-Demand	Anodyne	MTNR1B	39	48
COc1cccc(C(C)(C)C(=O)Nc2cc(NC(C)=O)ccc2OC)c1	ZINC000875023913	FH	On-Demand	Anodyne	IMDH_CRYPV	40	39
C[C@H](NC(=O)C(=O)NCC1CC1)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000875023919	FF	On-Demand	Anodyne	PRCP	53	51
O=C(CCc1nc(O)c2c3c(sc2n1)CCCC3)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875023927	JK	On-Demand	Anodyne	SCD	31	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(CN(CC)CC)cc1	ZINC000875023930	EF	On-Demand	Anodyne	ANPEP	15	42
CC(C)CN1CCC(NC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000875023935	GE	On-Demand	Anodyne	OXTR	59	38
CC(C)CN1CCC(NC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000875023935	GE	On-Demand	Anodyne	SIGMAR1	19	41
CC(C)CN1CCC(NC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000875023936	GE	On-Demand	Anodyne	OXTR	59	38
CC(C)CN1CCC(NC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000875023936	GE	On-Demand	Anodyne	SIGMAR1	19	41
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)C(=O)NC[C@@H]1CC[C@@H]2C[C@H]2C1	ZINC000875023942	GE	On-Demand	Anodyne	L3MBTL3	94	42
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)C(=O)NC[C@@H]1CC[C@H]2C[C@@H]2C1	ZINC000875023943	GE	On-Demand	Anodyne	L3MBTL3	94	42
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)C(=O)NC[C@@H]1CC[C@H]2C[C@H]2C1	ZINC000875023944	GE	On-Demand	Anodyne	L3MBTL3	94	42
CC(=O)Nc1ccc(CNC(=O)C(=O)NC2CCC(C)(N(C)C)CC2)cc1	ZINC000875023954	FD	On-Demand	Anodyne	EPHX2	15	40
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccc(NC(C)=O)cc2)C1	ZINC000875024001	ED	On-Demand	Anodyne	TSHR	42	32
C[C@@H](OCCCNC(=O)N(C)CCN1CC2(CCOCC2)C1)c1ccccc1	ZINC000875024021	GF	On-Demand	Anodyne	CASR	45	36
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)C(=O)NC[C@@H]1CC[C@@H]2C[C@@H]2C1	ZINC000875024045	GE	On-Demand	Anodyne	L3MBTL3	94	42
CCn1ncc(CNC(=O)N[C@@H](CN(C)C)c2ccccc2)n1	ZINC000875024053	DD	On-Demand	Anodyne	TACR3	47	39
CCn1ncc(CNC(=O)N[C@@H](CN(C)C)c2ccccc2)n1	ZINC000875024053	DD	On-Demand	Anodyne	UTS2	45	35
CCn1ncc(CNC(=O)N[C@H](CN(C)C)c2ccccc2)n1	ZINC000875024054	DD	On-Demand	Anodyne	TACR3	47	39
CCn1ncc(CNC(=O)N[C@H](CN(C)C)c2ccccc2)n1	ZINC000875024054	DD	On-Demand	Anodyne	UTS2	45	35
O=C(NCC[C@H]1CCSC1)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875024057	GD	On-Demand	Anodyne	L3MBTL3	70	38
O=C(NCC[C@@H]1CCSC1)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875024058	GD	On-Demand	Anodyne	L3MBTL3	70	38
COc1ccc(OCCNC(=O)N2CCC3(CCN(C)CC3)CC2)cc1	ZINC000875024073	FF	On-Demand	Anodyne	MMP13	26	44
COc1ccc(OCCNC(=O)N2CCC3(CCN(C)CC3)CC2)cc1	ZINC000875024073	FF	On-Demand	Anodyne	MTNR1A	42	41
COc1ccc(OCCNC(=O)N2CCC3(CCN(C)CC3)CC2)cc1	ZINC000875024073	FF	On-Demand	Anodyne	MTNR1B	38	41
COc1ccc(OCCNC(=O)N2CCC3(CCN(C)CC3)CC2)cc1	ZINC000875024073	FF	On-Demand	Anodyne	MMP9	22	42
COc1ccc(OCCNC(=O)N2CCC3(CCN(C)CC3)CC2)cc1	ZINC000875024073	FF	On-Demand	Anodyne	MMP10	27	44
COc1ccc(OCCNC(=O)N2CCC3(CCN(C)CC3)CC2)cc1	ZINC000875024073	FF	On-Demand	Anodyne	MMP1	20	41
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(OCC(F)(F)F)cc2)CC1	ZINC000875024075	GE	On-Demand	Anodyne	EPHX2	21	42
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)C(=O)N1C[C@@H]2CCC[C@]2(CO)C1	ZINC000875024076	GD	On-Demand	Anodyne	L3MBTL3	62	37
O=C(NCC[C@@H]1CCCOC1)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875024093	GD	On-Demand	Anodyne	L3MBTL3	67	38
O=C(NCC[C@H]1CCCOC1)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875024094	GD	On-Demand	Anodyne	L3MBTL3	67	38
COc1ccc(OCCNC(=O)NNc2cccc(C)n2)cc1	ZINC000875024096	DE	On-Demand	Reactive	MTNR1A	61	48
COc1ccc(OCCNC(=O)NNc2cccc(C)n2)cc1	ZINC000875024096	DE	On-Demand	Reactive	MTNR1B	52	48
COc1ccc(OCCNC(=O)NNc2cccc(C)n2)cc1	ZINC000875024096	DE	On-Demand	Reactive	GRM5	23	44
CCCCCCCNC(=O)C(=O)NC1CCN(CC(C)C)CC1	ZINC000875024101	EE	On-Demand	Mild	EPHX2	15	53
CCCCCCCNC(=O)C(=O)NC1CCN(CC(C)C)CC1	ZINC000875024101	EE	On-Demand	Mild	ASAH1	62	32
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)C(=O)N1CCC(CCF)CC1	ZINC000875024122	GE	On-Demand	Anodyne	MLYCD	17	40
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)C(=O)N1CCC(CCF)CC1	ZINC000875024122	GE	On-Demand	Anodyne	L3MBTL3	93	43
C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875024123	GD	On-Demand	Anodyne	L3MBTL3	78	39
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875024125	GD	On-Demand	Anodyne	L3MBTL3	78	39
C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875024126	GD	On-Demand	Anodyne	L3MBTL3	78	39
CC(C)CN1CCC(NC(=O)C(=O)N[C@@H](C)c2cc3cnccc3o2)CC1	ZINC000875024127	FE	On-Demand	Anodyne	SSTR5	43	34
CC(C)CN1CCC(NC(=O)C(=O)N[C@@H](C)c2cc3cnccc3o2)CC1	ZINC000875024127	FE	On-Demand	Anodyne	PRKD1	16	40
CC(C)CN1CCC(NC(=O)C(=O)N[C@@H](C)c2cc3cnccc3o2)CC1	ZINC000875024127	FE	On-Demand	Anodyne	PDK1	40	39
CC(C)CN1CCC(NC(=O)C(=O)N[C@H](C)c2cc3cnccc3o2)CC1	ZINC000875024128	FE	On-Demand	Anodyne	SSTR5	43	34
CC(C)CN1CCC(NC(=O)C(=O)N[C@H](C)c2cc3cnccc3o2)CC1	ZINC000875024128	FE	On-Demand	Anodyne	PRKD1	16	40
CC(C)CN1CCC(NC(=O)C(=O)N[C@H](C)c2cc3cnccc3o2)CC1	ZINC000875024128	FE	On-Demand	Anodyne	PDK1	40	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CN1CCOCC1)c1ccccc1	ZINC000875024130	GD	On-Demand	Anodyne	SLC6A4	19	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CN1CCOCC1)c1ccccc1	ZINC000875024130	GD	On-Demand	Anodyne	SLC6A3	48	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CN1CCOCC1)c1ccccc1	ZINC000875024130	GD	On-Demand	Anodyne	CCR5	23	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CN1CCOCC1)c1ccccc1	ZINC000875024131	GD	On-Demand	Anodyne	SLC6A4	19	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CN1CCOCC1)c1ccccc1	ZINC000875024131	GD	On-Demand	Anodyne	SLC6A3	48	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CN1CCOCC1)c1ccccc1	ZINC000875024131	GD	On-Demand	Anodyne	CCR5	23	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CN1CCOCC1)c1ccccc1	ZINC000875024132	GD	On-Demand	Anodyne	SLC6A4	19	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CN1CCOCC1)c1ccccc1	ZINC000875024132	GD	On-Demand	Anodyne	SLC6A3	48	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CN1CCOCC1)c1ccccc1	ZINC000875024132	GD	On-Demand	Anodyne	CCR5	23	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CN1CCOCC1)c1ccccc1	ZINC000875024133	GD	On-Demand	Anodyne	SLC6A4	19	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CN1CCOCC1)c1ccccc1	ZINC000875024133	GD	On-Demand	Anodyne	SLC6A3	48	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CN1CCOCC1)c1ccccc1	ZINC000875024133	GD	On-Demand	Anodyne	CCR5	23	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccccc2CN(CC)CC)C1	ZINC000875024144	GF	On-Demand	Anodyne	Q6PRC7_IXORI	49	32
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCO[C@@H](C)c2ccccc2)C1	ZINC000875024162	FF	On-Demand	Anodyne	C3AR1	43	30
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCO[C@@H](C)c2ccccc2)C1	ZINC000875024162	FF	On-Demand	Anodyne	AMY2	43	31
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCO[C@H](C)c2ccccc2)C1	ZINC000875024164	FF	On-Demand	Anodyne	C3AR1	43	30
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCO[C@H](C)c2ccccc2)C1	ZINC000875024164	FF	On-Demand	Anodyne	AMY2	43	31
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	ZINC000875024190	JG	On-Demand	Anodyne	MERTK	29	40
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	ZINC000875024190	JG	On-Demand	Anodyne	SCD1	37	43
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	ZINC000875024190	JG	On-Demand	Anodyne	SCD	31	47
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	ZINC000875024190	JG	On-Demand	Anodyne	NAMPT	32	42
O=C(NCCCOC[C@H]1CCCO1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875024215	GD	On-Demand	Anodyne	ETHR	47	36
O=C(NCCCOC[C@@H]1CCCO1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875024216	GD	On-Demand	Anodyne	ETHR	47	36
O=C(NCCCOC[C@H]1CCCO1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875024217	GD	On-Demand	Anodyne	ETHR	47	36
O=C(NCCCOC[C@@H]1CCCO1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875024218	GD	On-Demand	Anodyne	ETHR	47	36
CC[C@]1(C(=O)Nc2cccc3ncccc23)CCNC1=O	ZINC000875024237	CE	On-Demand	Anodyne	G2YM83_BOTF4	58	34
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)C(=O)N[C@H]1CO[C@H](C2CC2)C1	ZINC000875024257	GD	On-Demand	Anodyne	L3MBTL3	69	39
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)C(=O)N[C@H]1CO[C@@H](C2CC2)C1	ZINC000875024258	GD	On-Demand	Anodyne	L3MBTL3	69	39
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)C(=O)N[C@@H]1CO[C@H](C2CC2)C1	ZINC000875024259	GD	On-Demand	Anodyne	L3MBTL3	69	39
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)C(=O)N[C@@H]1CO[C@@H](C2CC2)C1	ZINC000875024260	GD	On-Demand	Anodyne	L3MBTL3	69	39
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875024261	HI	On-Demand	Anodyne	PREP	29	43
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875024261	HI	On-Demand	Anodyne	LGMN	67	38
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875024261	HI	On-Demand	Anodyne	SCD1	39	42
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875024261	HI	On-Demand	Anodyne	SCD	34	49
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875024261	HI	On-Demand	Anodyne	WNT3	41	38
CCCCCCCNC(=O)C(=O)NCc1ccc(C(=O)N(C)C)cc1	ZINC000875024266	EE	On-Demand	Mild	LPAR2	36	41
CCCCCCCNC(=O)C(=O)NCc1ccc(C(=O)N(C)C)cc1	ZINC000875024266	EE	On-Demand	Mild	S1PR3	20	41
CCCCCCCNC(=O)C(=O)NCc1ccc(C(=O)N(C)C)cc1	ZINC000875024266	EE	On-Demand	Mild	S1PR2	51	41
CCCCCCCNC(=O)C(=O)NCc1ccc(C(=O)N(C)C)cc1	ZINC000875024266	EE	On-Demand	Mild	SPHK1	23	40
CCCCCCCNC(=O)C(=O)NCc1ccc(C(=O)N(C)C)cc1	ZINC000875024266	EE	On-Demand	Mild	PLM2_PLAFA	26	44
CCCCCCCNC(=O)C(=O)NCc1ccc(C(=O)N(C)C)cc1	ZINC000875024266	EE	On-Demand	Mild	ASAH1	89	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CN2CCOCC2)c2ccccc2)C1	ZINC000875024273	GD	On-Demand	Anodyne	CASR	43	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CN2CCOCC2)c2ccccc2)C1	ZINC000875024273	GD	On-Demand	Anodyne	CCR5	31	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CN2CCOCC2)c2ccccc2)C1	ZINC000875024273	GD	On-Demand	Anodyne	CTSS	26	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CN2CCOCC2)c2ccccc2)C1	ZINC000875024276	GD	On-Demand	Anodyne	CASR	43	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CN2CCOCC2)c2ccccc2)C1	ZINC000875024276	GD	On-Demand	Anodyne	CCR5	31	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CN2CCOCC2)c2ccccc2)C1	ZINC000875024276	GD	On-Demand	Anodyne	CTSS	26	40
COC(=O)C1(O)CN(C(=O)N[C@@H](CN2CCOCC2)c2ccccc2)C1	ZINC000875024282	FB	On-Demand	Anodyne	CASR	41	36
COC(=O)C1(O)CN(C(=O)N[C@H](CN2CCOCC2)c2ccccc2)C1	ZINC000875024283	FB	On-Demand	Anodyne	CASR	41	36
O=C(NCC[C@H]1CC=CCC1)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875024292	GE	On-Demand	Anodyne	L3MBTL3	68	38
O=C(NCC[C@@H]1CC=CCC1)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875024293	GE	On-Demand	Anodyne	L3MBTL3	68	38
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCc2ccc(C(=O)N(C)C)cc2)c1	ZINC000875024303	GE	On-Demand	Anodyne	VHL	41	35
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCc2ccc(C(=O)N(C)C)cc2)c1	ZINC000875024304	GE	On-Demand	Anodyne	VHL	41	35
O=C(NC1CCC(C(F)(F)F)CC1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875024306	GF	On-Demand	Anodyne	WNT3	42	31
O=C(NC1CCC(C(F)(F)F)CC1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875024307	GF	On-Demand	Anodyne	WNT3	42	31
O=C(NC1CCC(C(F)(F)F)CC1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875024308	GF	On-Demand	Anodyne	WNT3	42	31
O=C(NC1CCC(C(F)(F)F)CC1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875024309	GF	On-Demand	Anodyne	WNT3	42	31
CC(=O)Nc1ccc(CNC(=O)C(=O)N2CCC[C@H]2c2cncc(C)c2)cc1	ZINC000875024421	GE	On-Demand	Anodyne	NAMPT	28	40
CC(=O)Nc1ccc(CNC(=O)C(=O)N2CCC[C@H]2c2cncc(C)c2)cc1	ZINC000875024421	GE	On-Demand	Anodyne	VHL	41	35
CC(=O)Nc1ccc(CNC(=O)C(=O)N2CCC[C@@H]2c2cncc(C)c2)cc1	ZINC000875024422	GE	On-Demand	Anodyne	NAMPT	28	40
CC(=O)Nc1ccc(CNC(=O)C(=O)N2CCC[C@@H]2c2cncc(C)c2)cc1	ZINC000875024422	GE	On-Demand	Anodyne	VHL	41	35
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCOCC(C)C)C[C@@H]1C2	ZINC000875024428	DD	On-Demand	Anodyne	EPHX2	17	43
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1cnc(Cl)c(Cl)c1	ZINC000875024440	HJ	On-Demand	Anodyne	SCD1	49	57
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1cnc(Cl)c(Cl)c1	ZINC000875024440	HJ	On-Demand	Anodyne	SCD	42	59
COc1ccc(OCCNC(=O)NC2(C)CC(F)(F)C2)cc1	ZINC000875024451	DF	On-Demand	Anodyne	MTNR1B	19	41
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1nc(Cl)ccc1Cl	ZINC000875024453	HJ	On-Demand	Anodyne	SCD1	43	51
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1nc(Cl)ccc1Cl	ZINC000875024453	HJ	On-Demand	Anodyne	SCD	36	53
CCN(CC)Cc1ccccc1CNC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875024477	GG	On-Demand	Anodyne	EPHX2	19	41
CCN(CC)Cc1ccccc1CNC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875024478	GG	On-Demand	Anodyne	EPHX2	19	41
O=CN1CCCN(C(=O)N[C@H](CN2CCOCC2)c2ccccc2)CC1	ZINC000875024493	FC	On-Demand	Anodyne	CASR	40	33
O=CN1CCCN(C(=O)N[C@@H](CN2CCOCC2)c2ccccc2)CC1	ZINC000875024494	FC	On-Demand	Anodyne	CASR	40	33
CCO[C@@H](C(=O)Nc1nc2ccc(CC)cc2s1)C1CCOCC1	ZINC000875024497	EH	On-Demand	Anodyne	CSNK1D	46	44
CCO[C@@H](C(=O)Nc1nc2ccc(CC)cc2s1)C1CCOCC1	ZINC000875024497	EH	On-Demand	Anodyne	NMT1	38	42
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875024507	GD	On-Demand	Anodyne	L3MBTL3	75	41
Cc1nnc(NNC(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)n1C	ZINC000875024511	GE	On-Demand	Reactive	DRD4	39	46
Cc1nnc(NNC(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)n1C	ZINC000875024511	GE	On-Demand	Reactive	SIGMAR1	27	51
Cc1nnc(NNC(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)n1C	ZINC000875024511	GE	On-Demand	Reactive	SSTR5	50	39
Cc1nnc(NNC(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)n1C	ZINC000875024511	GE	On-Demand	Reactive	CCR1	15	42
Cc1nnc(NNC(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)n1C	ZINC000875024511	GE	On-Demand	Reactive	CCR3	21	42
Cc1nnc(NNC(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)n1C	ZINC000875024511	GE	On-Demand	Reactive	CXCR3	40	40
Cc1nnc(NNC(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)n1C	ZINC000875024511	GE	On-Demand	Reactive	MCHR1	51	45
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024539	FG	On-Demand	Anodyne	DRD4	40	48
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024539	FG	On-Demand	Anodyne	SIGMAR1	29	56
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024539	FG	On-Demand	Anodyne	SSTR5	51	38
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024539	FG	On-Demand	Anodyne	CCR1	47	41
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024539	FG	On-Demand	Anodyne	CCR3	20	41
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024539	FG	On-Demand	Anodyne	EPHX2	21	43
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024539	FG	On-Demand	Anodyne	CXCR3	42	41
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024539	FG	On-Demand	Anodyne	MCHR1	51	49
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000875024639	JJ	On-Demand	Anodyne	CPT1A	23	40
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000875024639	JJ	On-Demand	Anodyne	CPT1B	46	40
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000875024639	JJ	On-Demand	Anodyne	SCD1	45	49
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000875024639	JJ	On-Demand	Anodyne	SCD	38	56
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000875024639	JJ	On-Demand	Anodyne	NAMPT	20	40
C#CC[C@@H](CCOC)NC(=O)N[C@H](CN(C)C)c1ccccc1	ZINC000875024643	DE	On-Demand	Mild	UTS2	53	37
C#CC[C@H](CCOC)NC(=O)N[C@H](CN(C)C)c1ccccc1	ZINC000875024644	DE	On-Demand	Mild	UTS2	53	37
C#CC[C@@H](CCOC)NC(=O)N[C@@H](CN(C)C)c1ccccc1	ZINC000875024645	DE	On-Demand	Mild	UTS2	53	37
C#CC[C@H](CCOC)NC(=O)N[C@@H](CN(C)C)c1ccccc1	ZINC000875024646	DE	On-Demand	Mild	UTS2	53	37
COc1ccc(OCCNC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875024647	DD	On-Demand	Anodyne	GRIN2B	17	41
COc1ccc(OCCNC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875024648	DD	On-Demand	Anodyne	GRIN2B	17	41
COc1ccc(OCCNC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875024649	EF	On-Demand	Clean	DRD4	42	32
COc1ccc(OCCNC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875024649	EF	On-Demand	Clean	MTNR1A	47	43
COc1ccc(OCCNC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875024649	EF	On-Demand	Clean	MTNR1B	41	43
O=C(N[C@H](CN1CCOCC1)c1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875024661	GC	On-Demand	Anodyne	CASR	43	35
O=C(N[C@@H](CN1CCOCC1)c1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875024662	GC	On-Demand	Anodyne	CASR	43	35
CC[C@]1(C(=O)Nc2cc(NC(C)=O)ccc2OC)CCNC1=O	ZINC000875024675	DD	On-Demand	Anodyne	TSHR	47	31
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)C1=NN(c2ccccc2)C(=O)CC1	ZINC000875024679	II	On-Demand	Anodyne	SCD1	37	40
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)C1=NN(c2ccccc2)C(=O)CC1	ZINC000875024679	II	On-Demand	Anodyne	SCD	32	47
C/C=C\C[C@H]1CCCN(C(=O)C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000875024680	GF	On-Demand	Anodyne	L3MBTL3	62	38
C/C=C\C[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000875024681	GF	On-Demand	Anodyne	L3MBTL3	62	38
C/C=C/C[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000875024682	GF	On-Demand	Anodyne	L3MBTL3	62	38
C/C=C/C[C@H]1CCCN(C(=O)C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000875024683	GF	On-Demand	Anodyne	L3MBTL3	62	38
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024684	FE	On-Demand	Reactive	CHRM2	16	42
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024684	FE	On-Demand	Reactive	DRD2	21	51
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024684	FE	On-Demand	Reactive	DRD4	64	53
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024684	FE	On-Demand	Reactive	ACHE	25	45
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024684	FE	On-Demand	Reactive	DRD3	15	51
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024684	FE	On-Demand	Reactive	KCNH2	19	45
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024684	FE	On-Demand	Reactive	HTR4	29	45
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024684	FE	On-Demand	Reactive	CHRM3	20	42
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024684	FE	On-Demand	Reactive	LTA4H	31	43
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024684	FE	On-Demand	Reactive	HRH3	15	44
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024684	FE	On-Demand	Reactive	SIGMAR1	49	59
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024684	FE	On-Demand	Reactive	SSTR5	70	39
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024684	FE	On-Demand	Reactive	CCR1	33	43
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024684	FE	On-Demand	Reactive	CCR3	42	43
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024684	FE	On-Demand	Reactive	CCR5	22	49
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024684	FE	On-Demand	Reactive	UTS2R	21	44
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024684	FE	On-Demand	Reactive	LSS	20	43
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024684	FE	On-Demand	Reactive	FAAH	17	41
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024684	FE	On-Demand	Reactive	SLC6A5	31	42
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024684	FE	On-Demand	Reactive	EPHX2	30	46
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024684	FE	On-Demand	Reactive	PDK1	49	38
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024684	FE	On-Demand	Reactive	CXCR3	54	44
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024684	FE	On-Demand	Reactive	MCHR1	72	51
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024684	FE	On-Demand	Reactive	CACNA1I	25	40
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024684	FE	On-Demand	Reactive	CCR8	18	43
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024684	FE	On-Demand	Reactive	ARG1	15	41
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024694	FE	On-Demand	Anodyne	DRD2	15	49
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024694	FE	On-Demand	Anodyne	DRD4	46	51
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024694	FE	On-Demand	Anodyne	ACHE	20	44
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024694	FE	On-Demand	Anodyne	KCNH2	15	41
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024694	FE	On-Demand	Anodyne	SIGMAR1	34	57
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024694	FE	On-Demand	Anodyne	SSTR5	45	36
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024694	FE	On-Demand	Anodyne	CCR1	17	44
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024694	FE	On-Demand	Anodyne	CCR3	33	44
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024694	FE	On-Demand	Anodyne	EPHX2	26	47
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024694	FE	On-Demand	Anodyne	CXCR3	55	49
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024694	FE	On-Demand	Anodyne	MCHR1	55	49
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000875024694	FE	On-Demand	Anodyne	CACNA1I	66	46
COc1ccc(OCCNC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875024697	EC	On-Demand	Anodyne	MMP13	27	40
COc1ccc(OCCNC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875024697	EC	On-Demand	Anodyne	MTNR1A	28	40
COc1ccc(OCCNC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875024697	EC	On-Demand	Anodyne	MTNR1B	26	40
COc1ccc(OCCNC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875024697	EC	On-Demand	Anodyne	MMP9	21	40
COc1ccc(OCCNC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875024697	EC	On-Demand	Anodyne	MMP1	20	40
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875024724	GE	On-Demand	Anodyne	CHRM2	20	41
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875024724	GE	On-Demand	Anodyne	DRD4	49	51
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875024724	GE	On-Demand	Anodyne	ACHE	19	45
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875024724	GE	On-Demand	Anodyne	CHRM3	23	41
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875024724	GE	On-Demand	Anodyne	SIGMAR1	43	60
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875024724	GE	On-Demand	Anodyne	SSTR5	42	36
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875024724	GE	On-Demand	Anodyne	CCR1	32	44
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875024724	GE	On-Demand	Anodyne	CCR3	33	52
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875024724	GE	On-Demand	Anodyne	FAAH	21	49
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875024724	GE	On-Demand	Anodyne	EPHX2	25	44
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875024724	GE	On-Demand	Anodyne	CXCR3	44	47
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875024724	GE	On-Demand	Anodyne	MCHR1	54	49
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875024724	GE	On-Demand	Anodyne	CACNA1G	22	42
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875024724	GE	On-Demand	Anodyne	PA	22	41
CCO[C@@H](C(=O)Nc1nc2ccc(CC)cc2s1)[C@@H]1CCOC1	ZINC000875024733	EG	On-Demand	Anodyne	CSNK1D	44	41
CCO[C@@H](C(=O)Nc1nc2ccc(CC)cc2s1)[C@H]1CCOC1	ZINC000875024734	EG	On-Demand	Anodyne	CSNK1D	44	41
O=C1OC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)C[C@@H]12	ZINC000875024736	GE	On-Demand	Anodyne	DRD4	38	46
O=C1OC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)C[C@@H]12	ZINC000875024736	GE	On-Demand	Anodyne	SIGMAR1	23	51
O=C1OC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)C[C@@H]12	ZINC000875024736	GE	On-Demand	Anodyne	CCR3	25	42
O=C1OC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)C[C@@H]12	ZINC000875024736	GE	On-Demand	Anodyne	CXCR3	28	42
O=C1OC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)C[C@@H]12	ZINC000875024736	GE	On-Demand	Anodyne	MCHR1	46	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCOc1ccc(OC)cc1	ZINC000875024743	ED	On-Demand	Anodyne	SLC6A4	27	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCOc1ccc(OC)cc1	ZINC000875024743	ED	On-Demand	Anodyne	SLC6A3	49	44
COc1ccc(OCCNC(=O)N[C@@H](C)C2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000875024744	GF	On-Demand	Anodyne	MMP3	15	42
CC(=O)Nc1ccc(CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875024751	ED	On-Demand	Anodyne	DPP7	41	34
CC(=O)Nc1ccc(CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875024752	ED	On-Demand	Anodyne	DPP7	41	34
CC(=O)Nc1ccc(CNC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875024764	GD	On-Demand	Anodyne	F2	35	40
CC(=O)Nc1ccc(CNC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875024764	GD	On-Demand	Anodyne	TRY1_BOVIN	30	40
CC(=O)Nc1ccc(CNC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875024764	GD	On-Demand	Anodyne	TMPRSS11D	64	36
CC(=O)Nc1ccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875024765	GD	On-Demand	Anodyne	F2	35	40
CC(=O)Nc1ccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875024765	GD	On-Demand	Anodyne	TRY1_BOVIN	30	40
CC(=O)Nc1ccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875024765	GD	On-Demand	Anodyne	TMPRSS11D	64	36
CC(=O)Nc1ccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875024767	GD	On-Demand	Anodyne	F2	35	40
CC(=O)Nc1ccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875024767	GD	On-Demand	Anodyne	TRY1_BOVIN	30	40
CC(=O)Nc1ccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875024767	GD	On-Demand	Anodyne	TMPRSS11D	64	36
COC(=O)c1cc(Br)ccc1NC(=O)CN1CCCCC(=O)C1=O	ZINC000875024775	GD	On-Demand	Anodyne	FAS	43	42
COc1ccc(OCCNC(=O)N[C@H](C)C2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000875024784	GF	On-Demand	Anodyne	MMP3	15	42
CCN(CC)Cc1ccc(CNC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)cc1	ZINC000875024789	FF	On-Demand	Anodyne	SLC6A4	26	41
CCN(CC)Cc1ccc(CNC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)cc1	ZINC000875024789	FF	On-Demand	Anodyne	SLC6A3	49	41
CCN(CC)Cc1ccc(CNC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)cc1	ZINC000875024790	FF	On-Demand	Anodyne	SLC6A4	26	41
CCN(CC)Cc1ccc(CNC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)cc1	ZINC000875024790	FF	On-Demand	Anodyne	SLC6A3	49	41
CCN(CC)Cc1ccccc1CNC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875024802	EF	On-Demand	Anodyne	EPHX2	18	42
CCN(CC)Cc1ccccc1CNC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875024803	EF	On-Demand	Anodyne	EPHX2	18	42
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000875024807	GD	On-Demand	Anodyne	L3MBTL3	62	37
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)C(=O)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875024815	GC	On-Demand	Anodyne	L3MBTL3	67	38
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)C(=O)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875024816	GC	On-Demand	Anodyne	L3MBTL3	67	38
COC(=O)N(C)NC(=O)NCCOc1ccc(OC)cc1	ZINC000875024830	CC	On-Demand	Reactive	MTNR1A	77	45
COC(=O)N(C)NC(=O)NCCOc1ccc(OC)cc1	ZINC000875024830	CC	On-Demand	Reactive	MTNR1B	53	45
CCN(CC)Cc1ccccc1CNC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875024838	FF	On-Demand	Anodyne	SLC6A4	25	40
CCN(CC)Cc1ccccc1CNC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875024838	FF	On-Demand	Anodyne	SLC6A3	47	40
COc1ccc(OCCNC(=O)N(C)OCC(F)(F)F)cc1	ZINC000875024856	DE	On-Demand	Anodyne	MTNR1A	26	41
COc1ccc(OCCNC(=O)N(C)OCC(F)(F)F)cc1	ZINC000875024856	DE	On-Demand	Anodyne	MTNR1B	21	41
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875024870	GD	On-Demand	Anodyne	DRD2	15	43
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875024870	GD	On-Demand	Anodyne	DRD4	53	48
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875024870	GD	On-Demand	Anodyne	HTR4	22	41
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875024870	GD	On-Demand	Anodyne	SIGMAR1	37	54
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875024870	GD	On-Demand	Anodyne	SSTR5	63	40
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875024870	GD	On-Demand	Anodyne	CCR1	34	42
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875024870	GD	On-Demand	Anodyne	CCR3	32	43
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875024870	GD	On-Demand	Anodyne	UTS2R	20	41
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875024870	GD	On-Demand	Anodyne	FAAH	21	41
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875024870	GD	On-Demand	Anodyne	EPHX2	15	40
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875024870	GD	On-Demand	Anodyne	PDK1	41	38
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875024870	GD	On-Demand	Anodyne	CXCR3	55	45
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000875024870	GD	On-Demand	Anodyne	MCHR1	58	48
CN1CC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)CC[C@H]21	ZINC000875024880	GG	On-Demand	Anodyne	DRD2	20	43
CN1CC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)CC[C@H]21	ZINC000875024880	GG	On-Demand	Anodyne	DRD4	52	50
CN1CC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)CC[C@H]21	ZINC000875024880	GG	On-Demand	Anodyne	DRD3	17	43
CN1CC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)CC[C@H]21	ZINC000875024880	GG	On-Demand	Anodyne	SIGMAR1	30	53
CN1CC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)CC[C@H]21	ZINC000875024880	GG	On-Demand	Anodyne	SSTR5	44	38
CN1CC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)CC[C@H]21	ZINC000875024880	GG	On-Demand	Anodyne	CCR1	39	41
CN1CC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)CC[C@H]21	ZINC000875024880	GG	On-Demand	Anodyne	CCR3	37	42
CN1CC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)CC[C@H]21	ZINC000875024880	GG	On-Demand	Anodyne	UTS2R	22	40
CN1CC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)CC[C@H]21	ZINC000875024880	GG	On-Demand	Anodyne	MLNR	39	41
CN1CC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)CC[C@H]21	ZINC000875024880	GG	On-Demand	Anodyne	FAAH	15	43
CN1CC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)CC[C@H]21	ZINC000875024880	GG	On-Demand	Anodyne	CCR2	18	46
CN1CC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)CC[C@H]21	ZINC000875024880	GG	On-Demand	Anodyne	EPHX2	21	43
CN1CC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)CC[C@H]21	ZINC000875024880	GG	On-Demand	Anodyne	CXCR3	45	46
CN1CC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)CC[C@H]21	ZINC000875024880	GG	On-Demand	Anodyne	MCHR1	59	48
CN1CC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)CC[C@H]21	ZINC000875024880	GG	On-Demand	Anodyne	CACNA1G	18	40
CN1CC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)CC[C@@H]21	ZINC000875024881	GG	On-Demand	Anodyne	DRD2	20	43
CN1CC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)CC[C@@H]21	ZINC000875024881	GG	On-Demand	Anodyne	DRD4	52	50
CN1CC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)CC[C@@H]21	ZINC000875024881	GG	On-Demand	Anodyne	DRD3	17	43
CN1CC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)CC[C@@H]21	ZINC000875024881	GG	On-Demand	Anodyne	SIGMAR1	30	53
CN1CC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)CC[C@@H]21	ZINC000875024881	GG	On-Demand	Anodyne	SSTR5	44	38
CN1CC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)CC[C@@H]21	ZINC000875024881	GG	On-Demand	Anodyne	CCR1	39	41
CN1CC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)CC[C@@H]21	ZINC000875024881	GG	On-Demand	Anodyne	CCR3	37	42
CN1CC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)CC[C@@H]21	ZINC000875024881	GG	On-Demand	Anodyne	UTS2R	22	40
CN1CC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)CC[C@@H]21	ZINC000875024881	GG	On-Demand	Anodyne	MLNR	39	41
CN1CC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)CC[C@@H]21	ZINC000875024881	GG	On-Demand	Anodyne	FAAH	15	43
CN1CC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)CC[C@@H]21	ZINC000875024881	GG	On-Demand	Anodyne	CCR2	18	46
CN1CC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)CC[C@@H]21	ZINC000875024881	GG	On-Demand	Anodyne	EPHX2	21	43
CN1CC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)CC[C@@H]21	ZINC000875024881	GG	On-Demand	Anodyne	CXCR3	45	46
CN1CC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)CC[C@@H]21	ZINC000875024881	GG	On-Demand	Anodyne	MCHR1	59	48
CN1CC[C@H]2CN(C(=O)NC3CCN(Cc4ccc(Cl)cc4)CC3)CC[C@@H]21	ZINC000875024881	GG	On-Demand	Anodyne	CACNA1G	18	40
COC(=O)C1(O)CN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000875024886	FD	On-Demand	Anodyne	HRH2	24	41
COC(=O)C1(O)CN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000875024886	FD	On-Demand	Anodyne	HRH3	30	45
O=C(COc1ccc2ccc(=O)oc2c1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875024889	II	On-Demand	Anodyne	MAOA	41	38
O=C(COc1ccc2ccc(=O)oc2c1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875024889	II	On-Demand	Anodyne	SCD	31	46
CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)c1	ZINC000875024902	JI	On-Demand	Anodyne	SCD1	41	48
CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)c1	ZINC000875024902	JI	On-Demand	Anodyne	SCD	34	50
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1nnc2n1CCC2	ZINC000875024907	GE	On-Demand	Anodyne	ACE	37	40
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1nnc2n1CCC2	ZINC000875024907	GE	On-Demand	Anodyne	AMP1_PLAFQ	26	41
Cn1nnnc1C1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)CC1	ZINC000875024912	GE	On-Demand	Anodyne	HRH3	26	40
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(CN2CCCCC2)cc1	ZINC000875024948	EG	On-Demand	Anodyne	HRH2	24	45
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(CN2CCCCC2)cc1	ZINC000875024948	EG	On-Demand	Anodyne	HRH3	21	42
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(CN2CCCCC2)cc1	ZINC000875024948	EG	On-Demand	Anodyne	DPP7	21	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000875025006	GG	On-Demand	Anodyne	HRH3	28	43
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000875025006	GG	On-Demand	Anodyne	SIGMAR1	15	44
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000875025006	GG	On-Demand	Anodyne	DPP7	62	36
O=C(NCc1ccc(CN2CCCCC2)cc1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875025013	GH	On-Demand	Anodyne	ACHE	15	45
O=C(NCc1ccc(CN2CCCCC2)cc1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875025013	GH	On-Demand	Anodyne	HRH3	23	45
O=C(NCc1ccc(CN2CCCCC2)cc1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875025013	GH	On-Demand	Anodyne	SIGMAR1	20	46
COC(=O)N(C)NC(=O)NCc1ccc(CN2CCCCC2)cc1	ZINC000875025070	EE	On-Demand	Reactive	HRH2	26	44
COC(=O)N(C)NC(=O)NCc1ccc(CN2CCCCC2)cc1	ZINC000875025070	EE	On-Demand	Reactive	HRH3	33	44
COC(=O)N(C)NC(=O)NCc1ccc(CN2CCCCC2)cc1	ZINC000875025070	EE	On-Demand	Reactive	SIGMAR1	21	42
Cc1nnc(NNC(=O)NCc2ccc(CN3CCCCC3)cc2)n1C	ZINC000875025119	FD	On-Demand	Reactive	HRH3	22	41
CN1CC[C@H]2CN(C(=O)NCc3ccc(CN4CCCCC4)cc3)CC[C@H]21	ZINC000875025123	FF	On-Demand	Anodyne	HRH3	38	43
CN1CC[C@H]2CN(C(=O)NCc3ccc(CN4CCCCC4)cc3)CC[C@H]21	ZINC000875025123	FF	On-Demand	Anodyne	SIGMAR1	19	43
CN1CC[C@H]2CN(C(=O)NCc3ccc(CN4CCCCC4)cc3)CC[C@H]21	ZINC000875025123	FF	On-Demand	Anodyne	L3MBTL3	42	41
CN1CC[C@H]2CN(C(=O)NCc3ccc(CN4CCCCC4)cc3)CC[C@@H]21	ZINC000875025126	FF	On-Demand	Anodyne	HRH3	38	43
CN1CC[C@H]2CN(C(=O)NCc3ccc(CN4CCCCC4)cc3)CC[C@@H]21	ZINC000875025126	FF	On-Demand	Anodyne	SIGMAR1	19	43
CN1CC[C@H]2CN(C(=O)NCc3ccc(CN4CCCCC4)cc3)CC[C@@H]21	ZINC000875025126	FF	On-Demand	Anodyne	L3MBTL3	42	41
Cc1ccc(CN2CCO[C@H](CNC(=O)NCc3c(C)cc(C)nc3O)C2)cc1	ZINC000875025139	GE	On-Demand	Anodyne	DRD4	16	43
CCCCCCCNC(=O)C(=O)N[C@H](C)c1nnc2n1CCC2	ZINC000875025140	DD	On-Demand	Mild	ASAH1	62	32
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1nnc2n1CCC2	ZINC000875025141	DD	On-Demand	Mild	ASAH1	62	32
CCOC(=O)c1cc(CNC(=O)N[C@@H](CN(C)C)c2ccccc2)on1	ZINC000875025167	FD	On-Demand	Anodyne	PAK4	43	36
CCOC(=O)c1cc(CNC(=O)N[C@H](CN(C)C)c2ccccc2)on1	ZINC000875025168	FD	On-Demand	Anodyne	PAK4	43	36
O=C(NCc1ccc(CN2CCCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875025172	EE	On-Demand	Anodyne	HRH2	24	45
O=C(NCc1ccc(CN2CCCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875025172	EE	On-Demand	Anodyne	HRH3	27	43
O=C(NCc1ccc(CN2CCCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875025172	EE	On-Demand	Anodyne	SIGMAR1	20	45
O=C(NCc1ccc(CN2CCCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875025172	EE	On-Demand	Anodyne	CCR3	15	41
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)C(=O)N[C@H]1CCCn2nccc21	ZINC000875025216	GD	On-Demand	Anodyne	L3MBTL3	73	39
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)C(=O)N[C@H]1CCCn2nccc21	ZINC000875025216	GD	On-Demand	Anodyne	NAMPT	20	40
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)C(=O)N[C@@H]1CCCn2nccc21	ZINC000875025217	GD	On-Demand	Anodyne	L3MBTL3	73	39
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)C(=O)N[C@@H]1CCCn2nccc21	ZINC000875025217	GD	On-Demand	Anodyne	NAMPT	20	40
CN1CCN(C2CCN(C(=O)NCc3cn4ccsc4n3)CC2)CC1	ZINC000875025250	FD	On-Demand	Anodyne	L3MBTL3	44	41
C[C@H](NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)c1nnc2n1CCC2	ZINC000875025267	GD	On-Demand	Anodyne	OXTR	41	35
C[C@H](NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)c1nnc2n1CCC2	ZINC000875025268	GD	On-Demand	Anodyne	OXTR	41	35
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000875025310	FG	On-Demand	Anodyne	SLC6A1	59	32
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000875025310	FG	On-Demand	Anodyne	HRH3	42	50
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000875025310	FG	On-Demand	Anodyne	SIGMAR1	25	47
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000875025310	FG	On-Demand	Anodyne	CCR3	31	42
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000875025310	FG	On-Demand	Anodyne	DPP7	61	38
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000875025310	FG	On-Demand	Anodyne	MCHR1	19	41
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000875025310	FG	On-Demand	Anodyne	L3MBTL3	17	40
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000875025311	FG	On-Demand	Anodyne	SLC6A1	59	32
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000875025311	FG	On-Demand	Anodyne	HRH3	42	50
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000875025311	FG	On-Demand	Anodyne	SIGMAR1	25	47
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000875025311	FG	On-Demand	Anodyne	CCR3	31	42
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000875025311	FG	On-Demand	Anodyne	DPP7	61	38
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000875025311	FG	On-Demand	Anodyne	MCHR1	19	41
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000875025311	FG	On-Demand	Anodyne	L3MBTL3	17	40
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1nnc2n1CCCC2	ZINC000875025331	GF	On-Demand	Anodyne	FKBP1A	27	41
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1nnc2n1CCCC2	ZINC000875025331	GF	On-Demand	Anodyne	AMP1_PLAFQ	23	40
COCC(C)(C)CCNC(=O)N[C@@H](CN(C)C)c1ccccc1	ZINC000875025338	DF	On-Demand	Anodyne	PAK4	41	33
COCC(C)(C)CCNC(=O)N[C@H](CN(C)C)c1ccccc1	ZINC000875025339	DF	On-Demand	Anodyne	PAK4	41	33
C[C@H]1C[C@H](CO)CCN1C(=O)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875025372	GD	On-Demand	Anodyne	L3MBTL3	68	37
O=C(NCCC[C@H]1C=CCC1)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875025402	GE	On-Demand	Anodyne	L3MBTL3	69	40
O=C(NCCC[C@@H]1C=CCC1)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875025403	GE	On-Demand	Anodyne	L3MBTL3	69	40
O=C(NCc1ccc(CN2CCCCC2)cc1)N1CCC2(CCNC2=O)CC1	ZINC000875025409	GE	On-Demand	Anodyne	HRH3	17	40
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1cc([N+](=O)[O-])ccc1N1CCOCC1	ZINC000875025423	JI	On-Demand	Bother	SCD1	35	40
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1cc([N+](=O)[O-])ccc1N1CCOCC1	ZINC000875025423	JI	On-Demand	Bother	SCD	30	44
O=C(NCc1cn2ccsc2n1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875025427	GG	On-Demand	Anodyne	SMO	35	41
O=C(NCc1cn2ccsc2n1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875025427	GG	On-Demand	Anodyne	ETHR	65	45
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)CC1	ZINC000875025442	GD	On-Demand	Anodyne	L3MBTL3	98	44
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)CC1	ZINC000875025442	GD	On-Demand	Anodyne	NAMPT	19	40
CCCCCCCNC(=O)C(=O)NCCc1csc(C)n1	ZINC000875025474	DE	On-Demand	Mild	ASAH1	81	36
Cc1nc(CCNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)cs1	ZINC000875025491	FD	On-Demand	Anodyne	SIRT3	49	32
Cc1nc(CCNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)cs1	ZINC000875025491	FD	On-Demand	Anodyne	SIRT2	51	32
Cc1nc(CCNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)cs1	ZINC000875025491	FD	On-Demand	Anodyne	SIRT1	49	32
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccnc(N3CCCC3)c2)C1	ZINC000875025502	FD	On-Demand	Anodyne	GPBAR1	18	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccnc(N3CCCC3)c2)C1	ZINC000875025504	FD	On-Demand	Anodyne	GPBAR1	18	43
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@H](CN(C)C)c1ccccc1	ZINC000875025517	EF	On-Demand	Anodyne	TIMP3	78	36
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@@H](CN(C)C)c1ccccc1	ZINC000875025519	EF	On-Demand	Anodyne	TIMP3	78	36
O=C(NCc1ccc(N2CCCC2=O)cc1)N1CC(c2ccccc2)C1	ZINC000875025525	EG	On-Demand	Anodyne	NPSR1	27	41
O=C(NCc1ccc(CN2CCCCC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875025534	GD	On-Demand	Anodyne	HRH2	21	43
O=C(NCc1ccc(CN2CCCCC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875025534	GD	On-Demand	Anodyne	HRH3	25	45
O=C(NCc1ccc(CN2CCCCC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875025534	GD	On-Demand	Anodyne	SIGMAR1	22	45
O=C(NCc1ccc(CN2CCCCC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875025534	GD	On-Demand	Anodyne	NPFFR2	32	40
O=C(NCc1ccc(CN2CCCCC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875025534	GD	On-Demand	Anodyne	NPFFR1	45	40
O=C(NCc1ccc(CN2CCCCC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875025534	GD	On-Demand	Anodyne	NAMPT	27	43
CN1CCN(C(=O)N[C@@H](c2ccc(Cl)cc2)c2nccn2C)CCC1(C)C	ZINC000875025556	GG	On-Demand	Anodyne	CCR1	45	37
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1cc([N+](=O)[O-])ccc1N1CCCC1	ZINC000875025558	IJ	On-Demand	Bother	SCD	30	46
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1cc([N+](=O)[O-])ccc1N1CCCC1	ZINC000875025558	IJ	On-Demand	Bother	WDR5	35	40
CN1CCN(C(=O)N[C@H](c2ccc(Cl)cc2)c2nccn2C)CCC1(C)C	ZINC000875025559	GG	On-Demand	Anodyne	CCR1	45	37
C[C@@H]1CN(C(=O)NCc2ccccc2CN2CCCC2)CC[C@H](C(F)(F)F)O1	ZINC000875025584	GH	On-Demand	Anodyne	EPHX2	17	43
C[C@@H]1CN(C(=O)NCc2ccccc2CN2CCCC2)CC[C@@H](C(F)(F)F)O1	ZINC000875025586	GH	On-Demand	Anodyne	EPHX2	17	43
CCOC1CC2(C1)C[C@H]2NC(=O)NCc1c(C)nn(Cc2ccccc2)c1C	ZINC000875025648	GG	On-Demand	Anodyne	TIMP3	40	34
CCOC1CC2(C1)C[C@@H]2NC(=O)NCc1c(C)nn(Cc2ccccc2)c1C	ZINC000875025650	GG	On-Demand	Anodyne	TIMP3	40	34
CCn1ncc(CNC(=O)NCc2c(C)nn(Cc3ccccc3)c2C)n1	ZINC000875025656	FE	On-Demand	Anodyne	P2RX7	19	48
O=C1OC[C@H]2CN(C(=O)NCc3ccc(CN4CCCCC4)cc3)C[C@@H]12	ZINC000875025660	FD	On-Demand	Anodyne	HRH3	19	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccnc(N3CCCCC3)c2)C1	ZINC000875025668	FD	On-Demand	Anodyne	GPBAR1	18	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccnc(N3CCCCC3)c2)C1	ZINC000875025669	FD	On-Demand	Anodyne	GPBAR1	18	43
CCCCCCCNC(=O)C(=O)NCC[C@H]1CCCO1	ZINC000875025708	CD	On-Demand	Mild	ASAH1	53	34
CCCCCCCNC(=O)C(=O)NCC[C@@H]1CCCO1	ZINC000875025709	CD	On-Demand	Mild	ASAH1	53	34
O=C(NCc1ccccc1CN1CCCC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875025755	GG	On-Demand	Anodyne	EPHX2	22	45
O=C(NCc1ccccc1CN1CCCC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875025756	GG	On-Demand	Anodyne	EPHX2	22	45
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000875025786	GD	On-Demand	Anodyne	DPP7	40	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000875025786	GD	On-Demand	Anodyne	L3MBTL3	86	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000875025787	GD	On-Demand	Anodyne	DPP7	40	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000875025787	GD	On-Demand	Anodyne	L3MBTL3	86	42
COc1cccc([C@H](O)C2CCN(C(=O)NCc3c(C)cc(C)nc3O)CC2)c1	ZINC000875025804	GG	On-Demand	Anodyne	DRD4	41	33
O=C(NCc1cn2ccsc2n1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875025813	FG	On-Demand	Anodyne	CPT1A	57	37
O=C(NCc1cn2ccsc2n1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875025814	FG	On-Demand	Anodyne	CPT1A	57	37
O=C(NCc1cn2ccsc2n1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875025815	FG	On-Demand	Anodyne	CPT1A	57	37
O=C(NCc1cn2ccsc2n1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875025816	FG	On-Demand	Anodyne	CPT1A	57	37
O=CN1CCCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)CC1	ZINC000875025826	FE	On-Demand	Anodyne	HRH2	18	40
O=CN1CCCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)CC1	ZINC000875025826	FE	On-Demand	Anodyne	HRH3	24	47
O=CN1CCCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)CC1	ZINC000875025826	FE	On-Demand	Anodyne	SIGMAR1	16	44
O=CN1CCCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)CC1	ZINC000875025826	FE	On-Demand	Anodyne	DPP7	50	37
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)C(=O)N[C@H]1CC12CCC2	ZINC000875025874	FD	On-Demand	Anodyne	L3MBTL3	68	38
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875025875	FD	On-Demand	Anodyne	L3MBTL3	68	38
COC(=O)N(C)NC(=O)NCc1c(C)nn(Cc2ccccc2)c1C	ZINC000875025888	ED	On-Demand	Reactive	P2RX7	18	49
COc1cc(CNC(=O)C(=O)NC[C@H]2c3ccccc3CN2C)ccn1	ZINC000875025912	FD	On-Demand	Anodyne	MT-CYB	42	33
COc1cc(CNC(=O)C(=O)NC[C@@H]2c3ccccc3CN2C)ccn1	ZINC000875025913	FD	On-Demand	Anodyne	MT-CYB	42	33
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2CN2CCCC2)CC1	ZINC000875025934	GD	On-Demand	Anodyne	EPHX2	29	56
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2CN2CCCC2)CC1	ZINC000875025934	GD	On-Demand	Anodyne	CACNA1G	32	40
N#CCCN1CCN(C(=O)C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)CC1	ZINC000875025985	GC	On-Demand	Mild	L3MBTL3	43	38
COCC(C)(C)CCNC(=O)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875026022	GD	On-Demand	Anodyne	L3MBTL3	45	37
CONC(=O)C1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)CC1	ZINC000875026028	GE	On-Demand	Anodyne	HRH3	36	48
CONC(=O)C1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)CC1	ZINC000875026028	GE	On-Demand	Anodyne	SIGMAR1	21	52
CONC(=O)C1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)CC1	ZINC000875026028	GE	On-Demand	Anodyne	EPHX2	24	45
CONC(=O)C1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)CC1	ZINC000875026028	GE	On-Demand	Anodyne	DPP7	44	35
CONC(=O)C1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)CC1	ZINC000875026028	GE	On-Demand	Anodyne	CACNA1G	41	41
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(C(=O)N4CCCC4)cc3)CC[C@@H]21	ZINC000875026034	GD	On-Demand	Anodyne	L3MBTL3	98	42
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(C(=O)N4CCCC4)cc3)CC[C@H]21	ZINC000875026035	GD	On-Demand	Anodyne	L3MBTL3	98	42
Cc1nccnc1[C@@H](C)NC(=O)N[C@H](CN(C)C)c1ccccc1	ZINC000875026037	EE	On-Demand	Anodyne	UTS2	42	36
Cc1nccnc1[C@H](C)NC(=O)N[C@H](CN(C)C)c1ccccc1	ZINC000875026038	EE	On-Demand	Anodyne	UTS2	42	36
Cc1nccnc1[C@H](C)NC(=O)N[C@@H](CN(C)C)c1ccccc1	ZINC000875026039	EE	On-Demand	Anodyne	UTS2	42	36
Cc1nccnc1[C@@H](C)NC(=O)N[C@@H](CN(C)C)c1ccccc1	ZINC000875026040	EE	On-Demand	Anodyne	UTS2	42	36
C[S@](=N)(=O)N1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)CC1	ZINC000875026063	GE	On-Demand	Anodyne	HRH3	24	48
C[S@](=N)(=O)N1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)CC1	ZINC000875026063	GE	On-Demand	Anodyne	NAMPT	38	40
O=C(C/N=C1/NS(=O)(=O)c2ccccc21)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875026067	IF	On-Demand	Mild	SCD	29	43
CC(=O)C1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)CC1	ZINC000875026070	FG	On-Demand	Anodyne	HRH3	45	51
CC(=O)C1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)CC1	ZINC000875026070	FG	On-Demand	Anodyne	SIGMAR1	27	51
CC(=O)C1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)CC1	ZINC000875026070	FG	On-Demand	Anodyne	EPHX2	21	44
CC(=O)C1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)CC1	ZINC000875026070	FG	On-Demand	Anodyne	DPP7	40	34
CC(=O)C1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)CC1	ZINC000875026070	FG	On-Demand	Anodyne	MCHR1	21	42
CC(=O)C1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)CC1	ZINC000875026070	FG	On-Demand	Anodyne	L3MBTL3	29	43
CCCCCCCNC(=O)C(=O)NCc1ccnc(OC)c1	ZINC000875026086	DD	On-Demand	Mild	LPAR2	53	32
CCCCCCCNC(=O)C(=O)NCc1ccnc(OC)c1	ZINC000875026086	DD	On-Demand	Mild	S1PR2	54	32
CCCCCCCNC(=O)C(=O)NCc1ccnc(OC)c1	ZINC000875026086	DD	On-Demand	Mild	ASAH1	73	33
COc1cc(CNC(=O)C(=O)N2CCC(N3CCN(C)CC3)CC2)ccn1	ZINC000875026089	GB	On-Demand	Anodyne	L3MBTL3	57	37
O=C(NCc1cn2ccsc2n1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875026099	FF	On-Demand	Anodyne	EPHX2	23	50
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1CN1CCCC1	ZINC000875026106	FF	On-Demand	Anodyne	SLC6A3	52	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1CN1CCCC1	ZINC000875026107	FF	On-Demand	Anodyne	SLC6A3	52	39
COc1cc(CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)ccn1	ZINC000875026110	DC	On-Demand	Anodyne	MT-CYB	42	31
COc1cc(CNC(=O)C(=O)N[C@H](C)c2ccnn2C)ccn1	ZINC000875026111	DC	On-Demand	Anodyne	MT-CYB	42	31
Cn1ccnc1[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(Cl)cc1	ZINC000875026122	GD	On-Demand	Anodyne	CACNA1H	44	36
Cn1ccnc1[C@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(Cl)cc1	ZINC000875026123	GD	On-Demand	Anodyne	CACNA1H	44	36
Cc1nccnc1[C@H](C)NC(=O)NCc1c(C)nn(Cc2ccccc2)c1C	ZINC000875026124	GG	On-Demand	Anodyne	P2RX7	18	48
Cc1nccnc1[C@@H](C)NC(=O)NCc1c(C)nn(Cc2ccccc2)c1C	ZINC000875026125	GG	On-Demand	Anodyne	P2RX7	18	48
CC[C@H](C[C@H](C)O)NC(=O)NCc1c(C)nn(Cc2ccccc2)c1C	ZINC000875026136	FF	On-Demand	Anodyne	P2RX7	15	47
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(O)cc2)C1	ZINC000875026144	DC	On-Demand	Anodyne	DPP7	58	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(O)cc2)C1	ZINC000875026146	DC	On-Demand	Anodyne	DPP7	58	35
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@@H]1CCCO1	ZINC000875026152	GE	On-Demand	Anodyne	CHRM2	16	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@@H]1CCCO1	ZINC000875026152	GE	On-Demand	Anodyne	DRD2	28	47
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@@H]1CCCO1	ZINC000875026152	GE	On-Demand	Anodyne	DRD4	56	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@@H]1CCCO1	ZINC000875026152	GE	On-Demand	Anodyne	ACHE	69	68
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@@H]1CCCO1	ZINC000875026152	GE	On-Demand	Anodyne	DRD3	19	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@@H]1CCCO1	ZINC000875026152	GE	On-Demand	Anodyne	HTR4	40	35
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@@H]1CCCO1	ZINC000875026152	GE	On-Demand	Anodyne	CHRM3	21	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@@H]1CCCO1	ZINC000875026152	GE	On-Demand	Anodyne	SIGMAR1	72	47
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@@H]1CCCO1	ZINC000875026152	GE	On-Demand	Anodyne	BCHE	20	55
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@@H]1CCCO1	ZINC000875026152	GE	On-Demand	Anodyne	CCR3	41	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@@H]1CCCO1	ZINC000875026152	GE	On-Demand	Anodyne	MCHR1	29	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@@H]1CCCO1	ZINC000875026152	GE	On-Demand	Anodyne	CACNA1G	24	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@@H]1CCCO1	ZINC000875026152	GE	On-Demand	Anodyne	CACNA1I	47	39
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@@H]1CCCO1	ZINC000875026152	GE	On-Demand	Anodyne	CYP2J2	43	31
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@H]1CCCO1	ZINC000875026154	GE	On-Demand	Anodyne	CHRM2	16	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@H]1CCCO1	ZINC000875026154	GE	On-Demand	Anodyne	DRD2	28	47
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@H]1CCCO1	ZINC000875026154	GE	On-Demand	Anodyne	DRD4	56	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@H]1CCCO1	ZINC000875026154	GE	On-Demand	Anodyne	ACHE	69	68
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@H]1CCCO1	ZINC000875026154	GE	On-Demand	Anodyne	DRD3	19	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@H]1CCCO1	ZINC000875026154	GE	On-Demand	Anodyne	HTR4	40	35
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@H]1CCCO1	ZINC000875026154	GE	On-Demand	Anodyne	CHRM3	21	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@H]1CCCO1	ZINC000875026154	GE	On-Demand	Anodyne	SIGMAR1	72	47
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@H]1CCCO1	ZINC000875026154	GE	On-Demand	Anodyne	BCHE	20	55
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@H]1CCCO1	ZINC000875026154	GE	On-Demand	Anodyne	CCR3	41	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@H]1CCCO1	ZINC000875026154	GE	On-Demand	Anodyne	MCHR1	29	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@H]1CCCO1	ZINC000875026154	GE	On-Demand	Anodyne	CACNA1G	24	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@H]1CCCO1	ZINC000875026154	GE	On-Demand	Anodyne	CACNA1I	47	39
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@H]1CCCO1	ZINC000875026154	GE	On-Demand	Anodyne	CYP2J2	43	31
O=C(NCc1ccccc1CN1CCCCC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875026159	GH	On-Demand	Anodyne	EPHX2	21	44
O=C(NCc1ccccc1CN1CCCCC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875026161	GH	On-Demand	Anodyne	EPHX2	21	44
CCC1(N2CCCC2)CCN(C(=O)C(=O)NCc2ccc(Cl)nc2)CC1	ZINC000875026197	GE	On-Demand	Anodyne	NAMPT	16	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1c(C)nn(Cc2ccccc2)c1C	ZINC000875026203	GF	On-Demand	Anodyne	SLC6A4	20	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1c(C)nn(Cc2ccccc2)c1C	ZINC000875026203	GF	On-Demand	Anodyne	SLC6A3	43	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1c(C)nn(Cc2ccccc2)c1C	ZINC000875026205	GF	On-Demand	Anodyne	SLC6A4	20	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1c(C)nn(Cc2ccccc2)c1C	ZINC000875026205	GF	On-Demand	Anodyne	SLC6A3	43	40
O=C(NCc1ccccc1CN1CCCCC1)N1CCC(CO)(CO)CC1	ZINC000875026213	GD	On-Demand	Anodyne	NPFFR1	41	37
COc1cc(CNC(=O)C(=O)N2C[C@@H](OC)CC[C@@H]2C)ccn1	ZINC000875026217	DC	On-Demand	Anodyne	HCRTR1	23	44
COc1cc(CNC(=O)C(=O)N2C[C@@H](OC)CC[C@@H]2C)ccn1	ZINC000875026217	DC	On-Demand	Anodyne	HCRTR2	35	44
COc1cc(CNC(=O)C(=O)N2C[C@H](OC)CC[C@H]2C)ccn1	ZINC000875026219	DC	On-Demand	Anodyne	HCRTR1	23	44
COc1cc(CNC(=O)C(=O)N2C[C@H](OC)CC[C@H]2C)ccn1	ZINC000875026219	DC	On-Demand	Anodyne	HCRTR2	35	44
COc1cc(CNC(=O)C(=O)N2C[C@H](OC)CC[C@@H]2C)ccn1	ZINC000875026221	DC	On-Demand	Anodyne	HCRTR1	23	44
COc1cc(CNC(=O)C(=O)N2C[C@H](OC)CC[C@@H]2C)ccn1	ZINC000875026221	DC	On-Demand	Anodyne	HCRTR2	35	44
N#CCCN1CCN(C(=O)C(=O)NCc2ccc(Cl)nc2)CC1	ZINC000875026222	EC	On-Demand	Mild	NACHRBETA2	49	37
COc1cc(CNC(=O)C(=O)N2C[C@@H](OC)CC[C@H]2C)ccn1	ZINC000875026223	DC	On-Demand	Anodyne	HCRTR1	23	44
COc1cc(CNC(=O)C(=O)N2C[C@@H](OC)CC[C@H]2C)ccn1	ZINC000875026223	DC	On-Demand	Anodyne	HCRTR2	35	44
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1ccc(O)cc1)CC2	ZINC000875026232	GE	On-Demand	Anodyne	SLC18A2	47	35
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1ccc(O)cc1)CC2	ZINC000875026232	GE	On-Demand	Anodyne	HCRTR1	16	53
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1ccc(O)cc1)CC2	ZINC000875026232	GE	On-Demand	Anodyne	MTNR1B	16	45
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1ccc(O)cc1)CC2	ZINC000875026233	GE	On-Demand	Anodyne	SLC18A2	47	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1ccc(O)cc1)CC2	ZINC000875026233	GE	On-Demand	Anodyne	HCRTR1	16	53
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1ccc(O)cc1)CC2	ZINC000875026233	GE	On-Demand	Anodyne	MTNR1B	16	45
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000875026239	FF	On-Demand	Anodyne	DPP7	28	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000875026239	FF	On-Demand	Anodyne	L3MBTL3	49	35
CCC[C@H](CNC(=O)C(=O)NCc1ccc(Cl)nc1)OCC	ZINC000875026249	ED	On-Demand	Anodyne	NACHRBETA2	17	41
CCC[C@@H](CNC(=O)C(=O)NCc1ccc(Cl)nc1)OCC	ZINC000875026250	ED	On-Demand	Anodyne	NACHRBETA2	17	41
O=CN1CCCN(C(=O)NCc2ccc(C(=O)N3CCCCC3)cc2)CC1	ZINC000875026252	FD	On-Demand	Anodyne	DPP7	41	35
O=CN1CCCN(C(=O)NCc2ccc(C(=O)N3CCCCC3)cc2)CC1	ZINC000875026252	FD	On-Demand	Anodyne	MLYCD	18	41
O=CN1CCCN(C(=O)NCc2ccc(C(=O)N3CCCCC3)cc2)CC1	ZINC000875026252	FD	On-Demand	Anodyne	L3MBTL3	69	38
O=CN1CCCN(C(=O)NCc2ccc(C(=O)N3CCCCC3)cc2)CC1	ZINC000875026252	FD	On-Demand	Anodyne	NAMPT	22	43
Cn1ncc(C(F)(F)F)c1CNC(=O)C(=O)NCc1ccc(Cl)nc1	ZINC000875026332	GD	On-Demand	Anodyne	P2RX7	24	44
Cn1ncc(C(F)(F)F)c1CNC(=O)C(=O)NCc1ccc(Cl)nc1	ZINC000875026332	GD	On-Demand	Anodyne	NACHRBETA2	17	40
CN1CCN(C(=O)NCc2ccc(C(=O)N3CCCCC3)cc2)CCC1(C)C	ZINC000875026334	GF	On-Demand	Anodyne	L3MBTL3	48	39
CN1CCN(C(=O)NCc2ccc(C(=O)N3CCCCC3)cc2)CCC1(C)C	ZINC000875026334	GF	On-Demand	Anodyne	NAMPT	21	43
O=C(NCc1ccc(Cl)nc1)C(=O)NC[C@@H]1CC[C@H]2C[C@H]2C1	ZINC000875026335	DD	On-Demand	Anodyne	NACHRBETA2	22	40
O=C(NCc1ccc(Cl)nc1)C(=O)NC[C@@H]1CC[C@@H]2C[C@H]2C1	ZINC000875026337	DD	On-Demand	Anodyne	NACHRBETA2	22	40
O=C(NCc1ccc(Cl)nc1)C(=O)NC[C@@H]1CC[C@@H]2C[C@@H]2C1	ZINC000875026339	DD	On-Demand	Anodyne	NACHRBETA2	22	40
O=C(NCc1ccc(Cl)nc1)C(=O)NC[C@@H]1CC[C@H]2C[C@@H]2C1	ZINC000875026341	DD	On-Demand	Anodyne	NACHRBETA2	22	40
COCC1CC(NC(=O)NCc2c(C)nn(Cc3ccccc3)c2C)C1	ZINC000875026355	FF	On-Demand	Anodyne	P2RX7	17	46
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NCC[C@H]3CCCO3)C2)c1	ZINC000875026374	GC	On-Demand	Anodyne	DRD4	34	42
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NCC[C@H]3CCCO3)C2)c1	ZINC000875026374	GC	On-Demand	Anodyne	PDE8B	22	41
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NCC[C@@H]3CCCO3)C2)c1	ZINC000875026381	GC	On-Demand	Anodyne	DRD4	34	42
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NCC[C@@H]3CCCO3)C2)c1	ZINC000875026381	GC	On-Demand	Anodyne	PDE8B	22	41
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NCC[C@@H]3CCCO3)C2)c1	ZINC000875026383	GC	On-Demand	Anodyne	DRD4	34	42
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NCC[C@@H]3CCCO3)C2)c1	ZINC000875026383	GC	On-Demand	Anodyne	PDE8B	22	41
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NCC[C@H]3CCCO3)C2)c1	ZINC000875026384	GC	On-Demand	Anodyne	DRD4	34	42
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NCC[C@H]3CCCO3)C2)c1	ZINC000875026384	GC	On-Demand	Anodyne	PDE8B	22	41
O=C(NCc1ccc(Cl)nc1)C(=O)NC[C@@H]1CCN1C1CCCCCC1	ZINC000875026389	GE	On-Demand	Anodyne	CXCR3	40	38
O=C(NCc1ccc(Cl)nc1)C(=O)NC[C@H]1CCN1C1CCCCCC1	ZINC000875026390	GE	On-Demand	Anodyne	CXCR3	40	38
CN1CCN(C2CCN(C(=O)C(=O)NCc3ccc(Cl)nc3)CC2)CC1	ZINC000875026393	GC	On-Demand	Anodyne	L3MBTL3	53	39
CN1CCN(C2CCN(C(=O)C(=O)NCc3ccc(Cl)nc3)CC2)CC1	ZINC000875026393	GC	On-Demand	Anodyne	NACHRBETA2	40	38
O=C(NCc1ccc(Cl)nc1)C(=O)N[C@@H]1CCCn2nccc21	ZINC000875026403	ED	On-Demand	Anodyne	NACHRBETA2	40	35
O=C(NCc1ccc(Cl)nc1)C(=O)N[C@H]1CCCn2nccc21	ZINC000875026404	ED	On-Demand	Anodyne	NACHRBETA2	40	35
COCCN(CC1CCN(C)CC1)C(=O)NCCCOc1ccccc1	ZINC000875026409	FE	On-Demand	Anodyne	LTA4H	37	41
COCCN(CC1CCN(C)CC1)C(=O)NCCCOc1ccccc1	ZINC000875026409	FE	On-Demand	Anodyne	HRH3	15	40
COCCN(CC1CCN(C)CC1)C(=O)NCCCOc1ccccc1	ZINC000875026409	FE	On-Demand	Anodyne	CHRNA10	44	39
COCCN(CC1CCN(C)CC1)C(=O)NCCCOc1ccccc1	ZINC000875026409	FE	On-Demand	Anodyne	ACKR3	66	35
O=C(NCCCCC1CC1)C(=O)NCc1ccc(Cl)nc1	ZINC000875026424	DE	On-Demand	Anodyne	NACHRBETA2	39	40
COc1cc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)ccn1	ZINC000875026432	FD	On-Demand	Anodyne	SIRT3	52	32
COc1cc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)ccn1	ZINC000875026432	FD	On-Demand	Anodyne	SIRT2	53	33
COc1cc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)ccn1	ZINC000875026432	FD	On-Demand	Anodyne	SIRT1	52	37
C#CC[C@@H](CCOC)NC(=O)NCc1c(C)nn(Cc2ccccc2)c1C	ZINC000875026436	FF	On-Demand	Mild	P2RX7	16	45
C#CC[C@H](CCOC)NC(=O)NCc1c(C)nn(Cc2ccccc2)c1C	ZINC000875026437	FF	On-Demand	Mild	P2RX7	16	45
O=C(NCc1ccc(N2CCCC2=O)cc1)N1Cc2cccc(O)c2C1	ZINC000875026438	FF	On-Demand	Clean	NAMPT	23	44
N#Cc1ccc(Cn2cc(NC(=O)NCCN3CCCCC3)cn2)cc1	ZINC000875026462	FE	On-Demand	Mild	HRH2	29	40
N#Cc1ccc(Cn2cc(NC(=O)NCCN3CCCCC3)cn2)cc1	ZINC000875026462	FE	On-Demand	Mild	HRH3	20	43
N#Cc1ccc(Cn2cc(NC(=O)NCCN3CCCCC3)cn2)cc1	ZINC000875026462	FE	On-Demand	Mild	CCR3	34	49
N#Cc1ccc(Cn2cc(NC(=O)NCCN3CCCCC3)cn2)cc1	ZINC000875026462	FE	On-Demand	Mild	CHRNA7	16	45
N#Cc1ccc(Cn2cc(NC(=O)NCCN3CCCCC3)cn2)cc1	ZINC000875026462	FE	On-Demand	Mild	ITK	19	53
N#Cc1ccc(Cn2cc(NC(=O)NCCN3CCCCC3)cn2)cc1	ZINC000875026462	FE	On-Demand	Mild	MCHR1	17	42
N#Cc1ccc(Cn2cc(NC(=O)NCCN3CCCCC3)cn2)cc1	ZINC000875026462	FE	On-Demand	Mild	PANC	41	36
O=C(NCc1ccc(Cl)nc1)C(=O)N1CCO[C@H](CCF)C1	ZINC000875026463	EC	On-Demand	Anodyne	NACHRBETA2	44	36
O=C(NCc1ccc(Cl)nc1)C(=O)N1CCO[C@@H](CCF)C1	ZINC000875026464	EC	On-Demand	Anodyne	NACHRBETA2	44	36
Cc1cc(/C=C(/C#N)C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)c(C)n1C[C@H]1CCCO1	ZINC000875026469	JK	On-Demand	Reactive	SCD	28	41
Cc1cc(/C=C(/C#N)C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)c(C)n1C[C@@H]1CCCO1	ZINC000875026471	JK	On-Demand	Reactive	SCD	28	41
O=C(NCc1ccc(Cl)nc1)C(=O)N1CCN(CCc2cnccn2)CC1	ZINC000875026486	GC	On-Demand	Anodyne	NACHRBETA2	40	35
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCc2ccc(Cl)nc2)c1	ZINC000875026496	FE	On-Demand	Anodyne	SSTR5	27	41
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCc2ccc(Cl)nc2)c1	ZINC000875026498	FE	On-Demand	Anodyne	SSTR5	27	41
O=C1CCN(C(=O)C(=O)NCc2ccc(Cl)nc2)CCCCCCN1	ZINC000875026516	FD	On-Demand	Anodyne	NACHRBETA2	43	39
N#Cc1ccc(N2CCN(C(=O)C(=O)NCc3ccc(Cl)nc3)CC2)cc1	ZINC000875026518	GD	On-Demand	Mild	NACHRBETA2	49	35
COc1cc(CNC(=O)C(=O)N2CCN(c3ccc(C#N)cc3)CC2)ccn1	ZINC000875026523	GC	On-Demand	Mild	MAPKAPK2	17	43
O=C(NCc1ccccc1CN1CCCC1)N1CCC(CO)(CO)CC1	ZINC000875026524	FD	On-Demand	Anodyne	EPHX2	16	45
O=C(NCc1ccccc1CN1CCCC1)N1CCC(CO)(CO)CC1	ZINC000875026524	FD	On-Demand	Anodyne	NPFFR1	42	38
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CN(C(=O)C(=O)NCc1ccc(O)cc1)C2	ZINC000875026549	GD	On-Demand	Anodyne	GPR119	27	43
Cn1ccnc1[C@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccc(Cl)cc1	ZINC000875026554	GG	On-Demand	Anodyne	PRCP	28	42
Cn1ccnc1[C@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccc(Cl)cc1	ZINC000875026555	GG	On-Demand	Anodyne	PRCP	28	42
Cn1ccnc1[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccc(Cl)cc1	ZINC000875026556	GG	On-Demand	Anodyne	PRCP	28	42
Cn1ccnc1[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccc(Cl)cc1	ZINC000875026557	GG	On-Demand	Anodyne	PRCP	28	42
O=C1CCCN1c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875026562	GG	On-Demand	Anodyne	PREP	20	43
O=C1CCCN1c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875026562	GG	On-Demand	Anodyne	TMPRSS11D	58	34
O=C1CCCN1c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875026563	GG	On-Demand	Anodyne	PREP	20	43
O=C1CCCN1c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875026563	GG	On-Demand	Anodyne	TMPRSS11D	58	34
O=C1CCCN1c1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875026564	GG	On-Demand	Anodyne	PREP	20	43
O=C1CCCN1c1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875026564	GG	On-Demand	Anodyne	TMPRSS11D	58	34
O=C1CCCN1c1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875026565	GG	On-Demand	Anodyne	PREP	20	43
O=C1CCCN1c1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875026565	GG	On-Demand	Anodyne	TMPRSS11D	58	34
COC(=O)C1(O)CN(C(=O)NCc2ccc(C(=O)N3CCCCC3)cc2)C1	ZINC000875026569	GC	On-Demand	Anodyne	L3MBTL3	51	36
COC(=O)C1(O)CN(C(=O)NCc2ccc(C(=O)N3CCCCC3)cc2)C1	ZINC000875026569	GC	On-Demand	Anodyne	NAMPT	28	46
O=C(NCCCOc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875026579	DD	On-Demand	Anodyne	HRH2	30	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1CN1CCCCC1	ZINC000875026599	EG	On-Demand	Anodyne	HRH2	16	42
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1CN1CCCCC1	ZINC000875026599	EG	On-Demand	Anodyne	ANPEP	17	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1CN1CCCCC1	ZINC000875026599	EG	On-Demand	Anodyne	KCNQ2	53	33
CCCCCCCNC(=O)C(=O)NCCc1cscn1	ZINC000875026614	CD	On-Demand	Mild	ASAH1	88	35
O=C(NCc1cn2ccsc2n1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875026634	FD	On-Demand	Anodyne	ETHR	49	34
O=C(NCc1cn2ccsc2n1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875026635	FD	On-Demand	Anodyne	ETHR	49	34
CCC(F)(F)C(C)(C)CNC(=O)C(=O)NCc1ccc(Cl)nc1	ZINC000875026639	EF	On-Demand	Anodyne	NACHRBETA2	17	42
COC(=O)N(C)NC(=O)NCCCOc1ccccc1	ZINC000875026668	CD	On-Demand	Reactive	DRD4	16	41
COC(=O)N(C)NC(=O)NCCCOc1ccccc1	ZINC000875026668	CD	On-Demand	Reactive	HRH2	26	40
COC(=O)N(C)NC(=O)NCCCOc1ccccc1	ZINC000875026668	CD	On-Demand	Reactive	LTA4H	34	48
COC(=O)N(C)NC(=O)NCCCOc1ccccc1	ZINC000875026668	CD	On-Demand	Reactive	MTNR1A	38	44
COC(=O)N(C)NC(=O)NCCCOc1ccccc1	ZINC000875026668	CD	On-Demand	Reactive	MTNR1B	32	44
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3ccc(Cl)nc3)C2)cc1	ZINC000875026670	GE	On-Demand	Anodyne	DRD4	37	45
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3ccc(Cl)nc3)C2)cc1	ZINC000875026670	GE	On-Demand	Anodyne	LTA4H	16	41
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3ccc(Cl)nc3)C2)cc1	ZINC000875026670	GE	On-Demand	Anodyne	SIGMAR1	19	45
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3ccc(Cl)nc3)C2)cc1	ZINC000875026670	GE	On-Demand	Anodyne	SSTR5	47	42
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3ccc(Cl)nc3)C2)cc1	ZINC000875026670	GE	On-Demand	Anodyne	CCR3	32	40
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3ccc(Cl)nc3)C2)cc1	ZINC000875026670	GE	On-Demand	Anodyne	UTS2R	23	41
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3ccc(Cl)nc3)C2)cc1	ZINC000875026670	GE	On-Demand	Anodyne	MLNR	42	33
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3ccc(Cl)nc3)C2)cc1	ZINC000875026670	GE	On-Demand	Anodyne	CCR2	18	45
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3ccc(Cl)nc3)C2)cc1	ZINC000875026670	GE	On-Demand	Anodyne	CXCR3	35	42
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3ccc(Cl)nc3)C2)cc1	ZINC000875026670	GE	On-Demand	Anodyne	MCHR1	33	48
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3ccc(Cl)nc3)C2)cc1	ZINC000875026674	GE	On-Demand	Anodyne	DRD4	37	45
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3ccc(Cl)nc3)C2)cc1	ZINC000875026674	GE	On-Demand	Anodyne	LTA4H	16	41
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3ccc(Cl)nc3)C2)cc1	ZINC000875026674	GE	On-Demand	Anodyne	SIGMAR1	19	45
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3ccc(Cl)nc3)C2)cc1	ZINC000875026674	GE	On-Demand	Anodyne	SSTR5	47	42
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3ccc(Cl)nc3)C2)cc1	ZINC000875026674	GE	On-Demand	Anodyne	CCR3	32	40
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3ccc(Cl)nc3)C2)cc1	ZINC000875026674	GE	On-Demand	Anodyne	UTS2R	23	41
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3ccc(Cl)nc3)C2)cc1	ZINC000875026674	GE	On-Demand	Anodyne	MLNR	42	33
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3ccc(Cl)nc3)C2)cc1	ZINC000875026674	GE	On-Demand	Anodyne	CCR2	18	45
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3ccc(Cl)nc3)C2)cc1	ZINC000875026674	GE	On-Demand	Anodyne	CXCR3	35	42
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3ccc(Cl)nc3)C2)cc1	ZINC000875026674	GE	On-Demand	Anodyne	MCHR1	33	48
C=CCCC(C)(C)CNC(=O)C(=O)NCc1ccc(Cl)nc1	ZINC000875026684	DE	On-Demand	Mild	NACHRBETA2	19	41
CN1CCN(C(=O)NCCCOc2ccccc2)CCC1(C)C	ZINC000875026685	DF	On-Demand	Anodyne	HRH2	31	40
CN1CCN(C(=O)NCCCOc2ccccc2)CCC1(C)C	ZINC000875026685	DF	On-Demand	Anodyne	EPHX2	19	42
O=C(NCc1ccc(Cl)nc1)C(=O)N1CCCC2(CC1)CC2	ZINC000875026688	DE	On-Demand	Anodyne	NACHRBETA2	42	40
O=C(NCCCOc1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875026692	EH	On-Demand	Anodyne	HRH2	30	40
O=C(NCCCOc1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875026692	EH	On-Demand	Anodyne	LTA4H	33	40
O=C(NCCCOc1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875026692	EH	On-Demand	Anodyne	HRH3	23	40
O=C(NCCCOc1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875026692	EH	On-Demand	Anodyne	EPHX2	34	45
O=C(NCCCOc1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875026693	EH	On-Demand	Anodyne	HRH2	30	40
O=C(NCCCOc1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875026693	EH	On-Demand	Anodyne	LTA4H	33	40
O=C(NCCCOc1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875026693	EH	On-Demand	Anodyne	HRH3	23	40
O=C(NCCCOc1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875026693	EH	On-Demand	Anodyne	EPHX2	34	45
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCOc3ccccc3)C[C@@H]1C2	ZINC000875026694	EE	On-Demand	Anodyne	HRH2	28	45
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCOc3ccccc3)C[C@@H]1C2	ZINC000875026694	EE	On-Demand	Anodyne	EPHX2	44	43
O=C(NCCO)C1CCN(C(=O)NCCCOc2ccccc2)CC1	ZINC000875026712	EC	On-Demand	Anodyne	HRH2	36	40
O=C(NCCO)C1CCN(C(=O)NCCCOc2ccccc2)CC1	ZINC000875026712	EC	On-Demand	Anodyne	LTA4H	25	43
O=C(NCCO)C1CCN(C(=O)NCCCOc2ccccc2)CC1	ZINC000875026712	EC	On-Demand	Anodyne	HRH3	17	40
O=C(NCCO)C1CCN(C(=O)NCCCOc2ccccc2)CC1	ZINC000875026712	EC	On-Demand	Anodyne	MTNR1A	19	40
O=C(NCCO)C1CCN(C(=O)NCCCOc2ccccc2)CC1	ZINC000875026712	EC	On-Demand	Anodyne	MTNR1B	18	40
O=C(NCCO)C1CCN(C(=O)NCCCOc2ccccc2)CC1	ZINC000875026712	EC	On-Demand	Anodyne	EPHX2	31	43
O=C(NCCO)C1CCN(C(=O)NCCCOc2ccccc2)CC1	ZINC000875026712	EC	On-Demand	Anodyne	CACNA1G	26	43
O=C1CCN(C(=O)NCCCOc2ccccc2)CCCCCCN1	ZINC000875026717	EF	On-Demand	Anodyne	HRH2	43	45
O=C1CCN(C(=O)NCCCOc2ccccc2)CCCCCCN1	ZINC000875026717	EF	On-Demand	Anodyne	HRH3	24	40
O=C(NCc1ccc(Cl)nc1)C(=O)NC[C@@H]1CCN1C1CCCCC1	ZINC000875026719	FD	On-Demand	Anodyne	CXCR3	40	38
O=C(NCc1ccc(Cl)nc1)C(=O)NC[C@H]1CCN1C1CCCCC1	ZINC000875026720	FD	On-Demand	Anodyne	CXCR3	40	38
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCC[C@H]1CCCO1)CC2	ZINC000875026745	GD	On-Demand	Anodyne	MTNR1B	18	41
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCC[C@@H]1CCCO1)CC2	ZINC000875026747	GD	On-Demand	Anodyne	MTNR1B	18	41
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCC[C@H]1CCCO1)CC2	ZINC000875026749	GD	On-Demand	Anodyne	MTNR1B	18	41
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCC[C@@H]1CCCO1)CC2	ZINC000875026751	GD	On-Demand	Anodyne	MTNR1B	18	41
COCC(C)(C)CCNC(=O)C(=O)NCc1ccc(Cl)nc1	ZINC000875026754	ED	On-Demand	Anodyne	NACHRBETA2	23	42
CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1CN2C(=O)C(=O)NCc1ccc(Cl)nc1	ZINC000875026755	GD	On-Demand	Anodyne	GPR119	17	41
CN1CCN(C2CCN(C(=O)C(=O)NCc3ccc(O)cc3)CC2)CC1	ZINC000875026765	FC	On-Demand	Anodyne	L3MBTL3	88	43
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCc2ccnc(N3CCCC3)c2)c1	ZINC000875026769	GE	On-Demand	Anodyne	GPBAR1	22	40
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCc2ccnc(N3CCCC3)c2)c1	ZINC000875026770	GE	On-Demand	Anodyne	GPBAR1	22	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1CN1CCCCC1	ZINC000875026774	GF	On-Demand	Anodyne	SLC6A3	49	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1CN1CCCCC1	ZINC000875026776	GF	On-Demand	Anodyne	SLC6A3	49	38
CN(C)C[C@@H]1CN(C(=O)C(=O)NCc2ccc(Cl)nc2)C[C@H]1CN(C)C	ZINC000875026778	GC	On-Demand	Anodyne	NACHRBETA2	49	42
COCC(C)(C)CCNC(=O)NCc1c(C)nn(Cc2ccccc2)c1C	ZINC000875026795	FG	On-Demand	Anodyne	P2RX7	16	47
COc1ccc([C@@H]2CN(C(=O)C(=O)NCc3ccnc(OC)c3)CCO2)cc1	ZINC000875026804	GD	On-Demand	Anodyne	NOS2	71	35
O=C(NCc1ccnc(N2CCCC2)c1)C(=O)NCc1cccc2ncccc12	ZINC000875026811	GE	On-Demand	Anodyne	SCN2A	19	42
O=C(NCc1ccnc(N2CCCC2)c1)C(=O)NCc1cccc2ncccc12	ZINC000875026811	GE	On-Demand	Anodyne	HNMT	46	35
O=C(NCc1ccnc(N2CCCC2)c1)C(=O)NCc1cccc2ncccc12	ZINC000875026811	GE	On-Demand	Anodyne	SCN10A	21	42
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1CN1CCCC1	ZINC000875026818	EF	On-Demand	Anodyne	ANPEP	19	42
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1CN1CCCC1	ZINC000875026818	EF	On-Demand	Anodyne	KCNQ2	54	34
CC[C@@H](NC(=O)C(=O)NCc1ccnc(OC)c1)c1cccc(OC)c1OC	ZINC000875026833	GD	On-Demand	Anodyne	PDS	44	34
CC(=O)[C@H]1CCCN(C(=O)NCc2c(C)nn(Cc3ccccc3)c2C)C1	ZINC000875026835	FG	On-Demand	Anodyne	P2RX7	15	44
CC(=O)[C@@H]1CCCN(C(=O)NCc2c(C)nn(Cc3ccccc3)c2C)C1	ZINC000875026836	FG	On-Demand	Anodyne	P2RX7	15	44
CC(=O)C1CCN(C(=O)NCc2c(C)nn(Cc3ccccc3)c2C)CC1	ZINC000875026863	FG	On-Demand	Anodyne	P2RX7	18	46
O=C(NCc1ccc(Cl)nc1)C(=O)NC[C@@H]1CCN1C1CCCC1	ZINC000875026883	FD	On-Demand	Anodyne	CXCR3	43	36
O=C(NCc1ccc(Cl)nc1)C(=O)NC[C@H]1CCN1C1CCCC1	ZINC000875026884	FD	On-Demand	Anodyne	CXCR3	43	36
O=C(/C=C/c1cnc2ccccc2n1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875026915	HJ	On-Demand	Anodyne	SCD	32	48
O=C(/C=C\c1cnc2ccccc2n1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875026916	HJ	On-Demand	Anodyne	SCD	32	48
O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875026922	FG	On-Demand	Anodyne	L3MBTL3	59	37
O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875026923	FG	On-Demand	Anodyne	L3MBTL3	59	37
O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875026924	FG	On-Demand	Anodyne	L3MBTL3	59	37
O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875026925	FG	On-Demand	Anodyne	L3MBTL3	59	37
CC[C@H](C[C@H](C)O)NC(=O)NCCCOc1ccccc1	ZINC000875026940	CE	On-Demand	Anodyne	HRH2	27	47
CC[C@H](C[C@H](C)O)NC(=O)NCCCOc1ccccc1	ZINC000875026940	CE	On-Demand	Anodyne	MME	21	42
CC[C@H](C[C@H](C)O)NC(=O)NCCCOc1ccccc1	ZINC000875026940	CE	On-Demand	Anodyne	CAPN2	51	34
CC[C@H](C[C@H](C)O)NC(=O)NCCCOc1ccccc1	ZINC000875026940	CE	On-Demand	Anodyne	PDS	66	40
O=C(NCc1ccc(O)cc1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875026942	FE	On-Demand	Anodyne	GHRHR	17	40
O=C(NCc1ccc(O)cc1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875026943	FE	On-Demand	Anodyne	GHRHR	17	40
O=C(NCc1ccc(Cl)nc1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875026950	FE	On-Demand	Anodyne	F2	33	43
O=C(NCc1ccc(Cl)nc1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875026950	FE	On-Demand	Anodyne	PREP	45	36
O=C(NCc1ccc(Cl)nc1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875026950	FE	On-Demand	Anodyne	TMPRSS11D	56	32
O=C(NCc1ccc(Cl)nc1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875026951	FE	On-Demand	Anodyne	F2	33	43
O=C(NCc1ccc(Cl)nc1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875026951	FE	On-Demand	Anodyne	PREP	45	36
O=C(NCc1ccc(Cl)nc1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875026951	FE	On-Demand	Anodyne	TMPRSS11D	56	32
O=C(NCc1ccc(Cl)nc1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875026952	FE	On-Demand	Anodyne	F2	33	43
O=C(NCc1ccc(Cl)nc1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875026952	FE	On-Demand	Anodyne	PREP	45	36
O=C(NCc1ccc(Cl)nc1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875026952	FE	On-Demand	Anodyne	TMPRSS11D	56	32
O=C(NCc1ccc(Cl)nc1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875026953	FE	On-Demand	Anodyne	F2	33	43
O=C(NCc1ccc(Cl)nc1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875026953	FE	On-Demand	Anodyne	PREP	45	36
O=C(NCc1ccc(Cl)nc1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875026953	FE	On-Demand	Anodyne	TMPRSS11D	56	32
C[C@H](NC(=O)C(=O)NCC[C@H]1CCCO1)c1ccc(C(F)(F)F)nc1	ZINC000875026964	FD	On-Demand	Anodyne	TRPV1	50	33
C[C@H](NC(=O)C(=O)NCC[C@@H]1CCCO1)c1ccc(C(F)(F)F)nc1	ZINC000875026965	FD	On-Demand	Anodyne	TRPV1	50	33
CCCCCCCNC(=O)C(=O)NCc1ccnc(N2CCCC2)c1	ZINC000875026987	EE	On-Demand	Mild	ASAH1	80	34
O=C1CCCN1c1ccc(CNC(=O)N2C[C@@H](O)C[C@@H]2C2CC2)cc1	ZINC000875026997	ED	On-Demand	Anodyne	VHL	41	34
O=C1CCCN1c1ccc(CNC(=O)N2C[C@H](O)C[C@@H]2C2CC2)cc1	ZINC000875026998	ED	On-Demand	Anodyne	VHL	41	34
O=C1CCCN1c1ccc(CNC(=O)N2C[C@@H](O)C[C@H]2C2CC2)cc1	ZINC000875026999	ED	On-Demand	Anodyne	VHL	41	34
O=C1CCCN1c1ccc(CNC(=O)N2C[C@H](O)C[C@H]2C2CC2)cc1	ZINC000875027000	ED	On-Demand	Anodyne	VHL	41	34
O=C(NCc1ccccc1CN1CCCC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875027013	GH	On-Demand	Anodyne	EPHX2	31	48
O=C(NCc1ccccc1CN1CCCC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875027014	GH	On-Demand	Anodyne	EPHX2	31	48
COc1cc(CNC(=O)C(=O)N[C@@H](C)c2ccc(C(F)(F)F)nc2)ccn1	ZINC000875027042	GD	On-Demand	Anodyne	TRPV1	65	34
COc1cc(CNC(=O)C(=O)N[C@H](C)c2ccc(C(F)(F)F)nc2)ccn1	ZINC000875027043	GD	On-Demand	Anodyne	TRPV1	65	34
COc1cc(CNC(=O)C(=O)N2CCc3cc(OC)c(OC)cc3[C@H]2C)ccn1	ZINC000875027049	GD	On-Demand	Anodyne	HCRTR1	18	46
COc1cc(CNC(=O)C(=O)N2CCc3cc(OC)c(OC)cc3[C@H]2C)ccn1	ZINC000875027049	GD	On-Demand	Anodyne	HCRTR2	17	46
COc1cc(CNC(=O)C(=O)N2CCc3cc(OC)c(OC)cc3[C@@H]2C)ccn1	ZINC000875027050	GD	On-Demand	Anodyne	HCRTR1	18	46
COc1cc(CNC(=O)C(=O)N2CCc3cc(OC)c(OC)cc3[C@@H]2C)ccn1	ZINC000875027050	GD	On-Demand	Anodyne	HCRTR2	17	46
Cn1ccnc1[C@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(Cl)cc1	ZINC000875027066	GF	On-Demand	Anodyne	PRCP	27	40
Cn1ccnc1[C@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(Cl)cc1	ZINC000875027067	GF	On-Demand	Anodyne	PRCP	27	40
Cn1ccnc1[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(Cl)cc1	ZINC000875027068	GF	On-Demand	Anodyne	PRCP	27	40
Cn1ccnc1[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(Cl)cc1	ZINC000875027069	GF	On-Demand	Anodyne	PRCP	27	40
O=C(NCc1ccc(Cl)nc1)C(=O)N1CCC(CCF)CC1	ZINC000875027090	ED	On-Demand	Anodyne	NACHRBETA2	41	38
Cc1ccccc1CN1CCO[C@@H](CNC(=O)C(=O)NCc2ccc(O)cc2)C1	ZINC000875027100	GD	On-Demand	Anodyne	DRD4	16	48
O=C(NCc1ccc(Cl)nc1)C(=O)N1CCC(Cc2nccs2)CC1	ZINC000875027114	GE	On-Demand	Anodyne	NACHRBETA2	41	35
O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875027115	ED	On-Demand	Anodyne	MLYCD	18	40
O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875027115	ED	On-Demand	Anodyne	L3MBTL3	72	40
O=C(NCc1ccc(Cl)nc1)C(=O)NCC(C1CCC1)C1CCC1	ZINC000875027131	EF	On-Demand	Anodyne	NACHRBETA2	39	40
O=C(NCCCOc1ccccc1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875027132	FD	On-Demand	Anodyne	GRIN2B	21	42
O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)N1Cc2cccc(O)c2C1	ZINC000875027133	GG	On-Demand	Clean	FABI	41	34
O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)N1Cc2cccc(O)c2C1	ZINC000875027133	GG	On-Demand	Clean	AVPR2	22	41
O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)N1Cc2cccc(O)c2C1	ZINC000875027133	GG	On-Demand	Clean	PREP	17	41
O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)N1Cc2cccc(O)c2C1	ZINC000875027133	GG	On-Demand	Clean	L3MBTL3	60	37
O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)N1Cc2cccc(O)c2C1	ZINC000875027133	GG	On-Demand	Clean	NAMPT	33	51
O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875027141	GD	On-Demand	Anodyne	MLYCD	18	41
O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875027141	GD	On-Demand	Anodyne	L3MBTL3	67	38
O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875027141	GD	On-Demand	Anodyne	NAMPT	27	46
O=C(NCc1ccc(O)cc1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875027142	FD	On-Demand	Anodyne	F2	36	43
O=C(NCc1ccc(O)cc1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875027142	FD	On-Demand	Anodyne	OPRM1	35	44
O=C(NCc1ccc(O)cc1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875027142	FD	On-Demand	Anodyne	OPRD1	19	41
O=C(NCc1ccc(O)cc1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875027142	FD	On-Demand	Anodyne	TRY1_BOVIN	32	42
O=C(NCc1ccc(O)cc1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875027142	FD	On-Demand	Anodyne	PREP	43	40
O=C(NCc1ccc(O)cc1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875027142	FD	On-Demand	Anodyne	TMPRSS11D	67	36
O=C(NCc1ccc(O)cc1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875027143	FD	On-Demand	Anodyne	F2	36	43
O=C(NCc1ccc(O)cc1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875027143	FD	On-Demand	Anodyne	OPRM1	35	44
O=C(NCc1ccc(O)cc1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875027143	FD	On-Demand	Anodyne	OPRD1	19	41
O=C(NCc1ccc(O)cc1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875027143	FD	On-Demand	Anodyne	TRY1_BOVIN	32	42
O=C(NCc1ccc(O)cc1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875027143	FD	On-Demand	Anodyne	PREP	43	40
O=C(NCc1ccc(O)cc1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875027143	FD	On-Demand	Anodyne	TMPRSS11D	67	36
O=C(NCc1ccc(O)cc1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875027144	FD	On-Demand	Anodyne	F2	36	43
O=C(NCc1ccc(O)cc1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875027144	FD	On-Demand	Anodyne	OPRM1	35	44
O=C(NCc1ccc(O)cc1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875027144	FD	On-Demand	Anodyne	OPRD1	19	41
O=C(NCc1ccc(O)cc1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875027144	FD	On-Demand	Anodyne	TRY1_BOVIN	32	42
O=C(NCc1ccc(O)cc1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875027144	FD	On-Demand	Anodyne	PREP	43	40
O=C(NCc1ccc(O)cc1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875027144	FD	On-Demand	Anodyne	TMPRSS11D	67	36
O=C(NCc1ccc(O)cc1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875027145	FD	On-Demand	Anodyne	F2	36	43
O=C(NCc1ccc(O)cc1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875027145	FD	On-Demand	Anodyne	OPRM1	35	44
O=C(NCc1ccc(O)cc1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875027145	FD	On-Demand	Anodyne	OPRD1	19	41
O=C(NCc1ccc(O)cc1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875027145	FD	On-Demand	Anodyne	TRY1_BOVIN	32	42
O=C(NCc1ccc(O)cc1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875027145	FD	On-Demand	Anodyne	PREP	43	40
O=C(NCc1ccc(O)cc1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875027145	FD	On-Demand	Anodyne	TMPRSS11D	67	36
C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)C(=O)NCc1ccc(Cl)nc1	ZINC000875027148	ED	On-Demand	Anodyne	NACHRBETA2	32	41
C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)C(=O)NCc1ccc(Cl)nc1	ZINC000875027149	ED	On-Demand	Anodyne	NACHRBETA2	32	41
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)C(=O)NCc1ccc(Cl)nc1	ZINC000875027150	ED	On-Demand	Anodyne	NACHRBETA2	32	41
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(Cl)nc2)CC1	ZINC000875027161	DD	On-Demand	Anodyne	NAMPT	29	43
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(Cl)nc2)CC1	ZINC000875027161	DD	On-Demand	Anodyne	Q8WSF8_APLCA	46	37
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(Cl)nc2)CC1	ZINC000875027161	DD	On-Demand	Anodyne	NACHRBETA2	56	41
O=CN1CCCN(C(=O)NCCCOc2ccccc2)CC1	ZINC000875027170	DD	On-Demand	Anodyne	HRH2	33	42
O=CN1CCCN(C(=O)NCCCOc2ccccc2)CC1	ZINC000875027170	DD	On-Demand	Anodyne	HRH3	15	40
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(Cl)nc1	ZINC000875027171	FF	On-Demand	Anodyne	CAPN2	79	40
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(Cl)nc1	ZINC000875027171	FF	On-Demand	Anodyne	AMP1_PLAFQ	41	37
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(Cl)nc1	ZINC000875027171	FF	On-Demand	Anodyne	PDS	61	38
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(Cl)nc1	ZINC000875027172	FF	On-Demand	Anodyne	CAPN2	79	40
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(Cl)nc1	ZINC000875027172	FF	On-Demand	Anodyne	AMP1_PLAFQ	41	37
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(Cl)nc1	ZINC000875027172	FF	On-Demand	Anodyne	PDS	61	38
O=C1O[C@H](C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)Cc2ccccc21	ZINC000875027226	HH	On-Demand	Anodyne	SCD	31	46
O=C1O[C@@H](C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)Cc2ccccc21	ZINC000875027227	HH	On-Demand	Anodyne	SCD	31	46
CCOC(=O)N1CCC(C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)CC1	ZINC000875027232	HH	On-Demand	Anodyne	SCD1	38	41
CCOC(=O)N1CCC(C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)CC1	ZINC000875027232	HH	On-Demand	Anodyne	SCD	33	49
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)c1ccc(S(C)(=O)=O)cc1	ZINC000875027250	ED	On-Demand	Anodyne	CTSF	43	33
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)c1ccc(S(C)(=O)=O)cc1	ZINC000875027251	ED	On-Demand	Anodyne	CTSF	43	33
O=CN1CCCN(C(=O)NCCCCOc2ccc(F)cc2)CC1	ZINC000875027270	ED	On-Demand	Anodyne	HRH2	18	43
O=CN1CCCN(C(=O)NCCCCOc2ccc(F)cc2)CC1	ZINC000875027270	ED	On-Demand	Anodyne	HRH3	15	40
CO[C@H](CNC(=O)C(=O)N(C)CCN1CC2(CCOCC2)C1)c1ccccc1	ZINC000875027271	GD	On-Demand	Anodyne	CASR	48	39
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(S(C)(=O)=O)cc1	ZINC000875027280	FD	On-Demand	Anodyne	NPY2R	18	43
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(S(C)(=O)=O)cc1	ZINC000875027280	FD	On-Demand	Anodyne	GPR119	46	41
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(S(C)(=O)=O)cc1	ZINC000875027281	FD	On-Demand	Anodyne	NPY2R	18	43
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(S(C)(=O)=O)cc1	ZINC000875027281	FD	On-Demand	Anodyne	GPR119	46	41
O=C(NCc1ccc(Cl)nc1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875027288	ED	On-Demand	Anodyne	NACHRBETA2	45	36
O=C(NCc1ccc(Cl)nc1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875027289	ED	On-Demand	Anodyne	NACHRBETA2	45	36
O=C(NCc1ccc(Cl)nc1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875027290	ED	On-Demand	Anodyne	NACHRBETA2	45	36
O=C(NCc1ccc(Cl)nc1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875027291	ED	On-Demand	Anodyne	NACHRBETA2	45	36
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3ccc(C(=O)N4CCCCC4)cc3)C[C@@H]1C2	ZINC000875027304	GE	On-Demand	Anodyne	EPHX2	17	42
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3ccc(C(=O)N4CCCCC4)cc3)C[C@@H]1C2	ZINC000875027304	GE	On-Demand	Anodyne	L3MBTL3	43	34
O=C(NCc1ccc(O)cc1)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875027308	ED	On-Demand	Anodyne	YARS	47	33
O=C(NCc1ccc(O)cc1)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875027309	ED	On-Demand	Anodyne	YARS	47	33
O=C(NCc1ccc(O)cc1)C(=O)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875027310	ED	On-Demand	Anodyne	YARS	47	33
O=C(NCc1ccc(O)cc1)C(=O)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875027311	ED	On-Demand	Anodyne	YARS	47	33
O=C(NCCCOc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000875027321	CD	On-Demand	Anodyne	HRH2	27	44
O=C(NCCCOc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000875027321	CD	On-Demand	Anodyne	GRIN2B	21	44
O=C(NCCCOc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000875027321	CD	On-Demand	Anodyne	EPHX2	20	40
O=C(NCc1ccc(O)cc1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875027325	FE	On-Demand	Anodyne	NAMPT	57	39
O=C(NCc1ccc(O)cc1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875027326	FE	On-Demand	Anodyne	NAMPT	57	39
Cc1scc(CNC(=O)C(=O)NCc2ccc(Cl)nc2)c1C	ZINC000875027329	EE	On-Demand	Anodyne	NACHRBETA2	32	43
O=C(NCCCCC1CC1)C(=O)NCc1ccc(O)cc1	ZINC000875027336	CD	On-Demand	Anodyne	GRIA1	47	35
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(O)cc1	ZINC000875027338	GE	On-Demand	Anodyne	CHRM2	21	50
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(O)cc1	ZINC000875027338	GE	On-Demand	Anodyne	DRD2	29	48
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(O)cc1	ZINC000875027338	GE	On-Demand	Anodyne	DRD4	58	46
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(O)cc1	ZINC000875027338	GE	On-Demand	Anodyne	ACHE	69	64
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(O)cc1	ZINC000875027338	GE	On-Demand	Anodyne	FABI	47	35
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(O)cc1	ZINC000875027338	GE	On-Demand	Anodyne	HRH1	17	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(O)cc1	ZINC000875027338	GE	On-Demand	Anodyne	DRD3	21	46
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(O)cc1	ZINC000875027338	GE	On-Demand	Anodyne	SLC6A3	20	51
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(O)cc1	ZINC000875027338	GE	On-Demand	Anodyne	HTR4	30	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(O)cc1	ZINC000875027338	GE	On-Demand	Anodyne	CHRM3	30	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(O)cc1	ZINC000875027338	GE	On-Demand	Anodyne	GRIN2B	51	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(O)cc1	ZINC000875027338	GE	On-Demand	Anodyne	LTA4H	22	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(O)cc1	ZINC000875027338	GE	On-Demand	Anodyne	HRH3	15	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(O)cc1	ZINC000875027338	GE	On-Demand	Anodyne	SIGMAR1	72	59
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(O)cc1	ZINC000875027338	GE	On-Demand	Anodyne	BCHE	25	52
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(O)cc1	ZINC000875027338	GE	On-Demand	Anodyne	CCR3	47	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(O)cc1	ZINC000875027338	GE	On-Demand	Anodyne	SLC6A5	30	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(O)cc1	ZINC000875027338	GE	On-Demand	Anodyne	CXCR3	19	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(O)cc1	ZINC000875027338	GE	On-Demand	Anodyne	MCHR1	31	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(O)cc1	ZINC000875027338	GE	On-Demand	Anodyne	CACNA1G	37	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(O)cc1	ZINC000875027338	GE	On-Demand	Anodyne	NPFFR1	43	38
Cc1ncc([C@@H](C)NC(=O)C(=O)NCc2ccc(Cl)nc2)s1	ZINC000875027348	ED	On-Demand	Anodyne	NACHRBETA2	17	40
Cc1ncc([C@H](C)NC(=O)C(=O)NCc2ccc(Cl)nc2)s1	ZINC000875027349	ED	On-Demand	Anodyne	NACHRBETA2	17	40
O=C(NCc1ccc(Cl)nc1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875027357	GF	On-Demand	Anodyne	NAMPT	46	39
O=C(NCc1ccc(Cl)nc1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875027358	GF	On-Demand	Anodyne	NAMPT	46	39
O=C(NCc1ccc(Cl)nc1)C(=O)NCC1CC=CC1	ZINC000875027364	CD	On-Demand	Anodyne	NACHRBETA2	45	43
CCCCCCCNC(=O)C(=O)NCc1ccc(Cl)nc1	ZINC000875027366	DE	On-Demand	Mild	LPAR2	46	36
CCCCCCCNC(=O)C(=O)NCc1ccc(Cl)nc1	ZINC000875027366	DE	On-Demand	Mild	GRIA1	41	35
CCCCCCCNC(=O)C(=O)NCc1ccc(Cl)nc1	ZINC000875027366	DE	On-Demand	Mild	S1PR2	64	39
CCCCCCCNC(=O)C(=O)NCc1ccc(Cl)nc1	ZINC000875027366	DE	On-Demand	Mild	ASAH1	85	39
CCCCCCCNC(=O)C(=O)NCc1ccc(Cl)nc1	ZINC000875027366	DE	On-Demand	Mild	NACHRBETA2	29	45
O=C(c1ccc(CNC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)cc1)N1CCCCC1	ZINC000875027367	GG	On-Demand	Anodyne	L3MBTL3	84	42
C[C@@H](NC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccc(S(C)(=O)=O)cc1	ZINC000875027397	GG	On-Demand	Anodyne	GPR119	68	43
C[C@@H](NC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccc(S(C)(=O)=O)cc1	ZINC000875027399	GG	On-Demand	Anodyne	GPR119	68	43
Cc1ccnn1CC(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	ZINC000875027423	GF	On-Demand	Anodyne	LPL	49	42
Cc1ccnn1CC(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	ZINC000875027423	GF	On-Demand	Anodyne	GRM4	27	42
Cc1ccnn1CC(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	ZINC000875027423	GF	On-Demand	Anodyne	EPHX2	25	44
Cc1ccnn1CC(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	ZINC000875027423	GF	On-Demand	Anodyne	LIPG	20	42
Cc1ccnn1CC(=O)Nc1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	ZINC000875027423	GF	On-Demand	Anodyne	IMDH_CRYPV	33	42
CON=Cc1ccc(C(=O)Oc2cc(OC)cc(OC)c2)cc1	ZINC000875027436	DF	On-Demand	Mild	ACR	69	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccc(F)cc1)c1nccn1C	ZINC000875027443	GE	On-Demand	Anodyne	SLC6A4	24	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccc(F)cc1)c1nccn1C	ZINC000875027443	GE	On-Demand	Anodyne	SLC6A3	59	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccc(F)cc1)c1nccn1C	ZINC000875027444	GE	On-Demand	Anodyne	SLC6A4	24	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccc(F)cc1)c1nccn1C	ZINC000875027444	GE	On-Demand	Anodyne	SLC6A3	59	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccc(F)cc1)c1nccn1C	ZINC000875027445	GE	On-Demand	Anodyne	SLC6A4	24	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccc(F)cc1)c1nccn1C	ZINC000875027445	GE	On-Demand	Anodyne	SLC6A3	59	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccc(F)cc1)c1nccn1C	ZINC000875027446	GE	On-Demand	Anodyne	SLC6A4	24	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccc(F)cc1)c1nccn1C	ZINC000875027446	GE	On-Demand	Anodyne	SLC6A3	59	46
O=CN1CCCN(C(=O)N[C@H]2CCSc3ccc(F)cc32)CC1	ZINC000875027466	EE	On-Demand	Anodyne	CCR3	15	42
O=CN1CCCN(C(=O)N[C@@H]2CCSc3ccc(F)cc32)CC1	ZINC000875027467	EE	On-Demand	Anodyne	CCR3	15	42
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccc(O)cc3)CC2)c(OC)c1	ZINC000875027501	GD	On-Demand	Clean	HTR1A	37	42
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccc(O)cc3)CC2)c(OC)c1	ZINC000875027501	GD	On-Demand	Clean	DRD2	35	43
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccc(O)cc3)CC2)c(OC)c1	ZINC000875027501	GD	On-Demand	Clean	DRD4	42	33
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccc(O)cc3)CC2)c(OC)c1	ZINC000875027501	GD	On-Demand	Clean	DRD3	51	43
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccc(O)cc3)CC2)c(OC)c1	ZINC000875027501	GD	On-Demand	Clean	HTR7	35	42
Cc1ccccc1CN1CCO[C@@H](CNC(=O)C(=O)NCC[C@H]2CCCO2)C1	ZINC000875027510	GC	On-Demand	Anodyne	SLC6A1	56	36
Cc1ccccc1CN1CCO[C@@H](CNC(=O)C(=O)NCC[C@H]2CCCO2)C1	ZINC000875027510	GC	On-Demand	Anodyne	PDE8B	21	43
Cc1ccccc1CN1CCO[C@@H](CNC(=O)C(=O)NCC[C@@H]2CCCO2)C1	ZINC000875027511	GC	On-Demand	Anodyne	SLC6A1	56	36
Cc1ccccc1CN1CCO[C@@H](CNC(=O)C(=O)NCC[C@@H]2CCCO2)C1	ZINC000875027511	GC	On-Demand	Anodyne	PDE8B	21	43
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NCc3ccc(O)cc3)C2)c1	ZINC000875027514	GD	On-Demand	Anodyne	DRD4	27	49
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NCc3ccc(O)cc3)C2)c1	ZINC000875027515	GD	On-Demand	Anodyne	DRD4	27	49
COC(=O)C1(O)CN(C(=O)NCCCOc2ccccc2)C1	ZINC000875027516	DC	On-Demand	Anodyne	HRH2	27	40
C=CC(C)(C)CCCNC(=O)C(=O)NCc1ccc(Cl)nc1	ZINC000875027517	DE	On-Demand	Mild	NACHRBETA2	19	43
O=C(NCCSCCC(F)(F)F)C(=O)NCc1ccc(Cl)nc1	ZINC000875027522	FE	On-Demand	Anodyne	NACHRBETA2	18	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(Cl)nc2)C1	ZINC000875027523	DD	On-Demand	Anodyne	NACHRBETA2	47	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(Cl)nc2)C1	ZINC000875027524	DD	On-Demand	Anodyne	NACHRBETA2	47	38
O=C(NCC[C@H](O)C1CCCC1)NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000875027532	GG	On-Demand	Anodyne	DPP7	69	37
O=C(NCC[C@H](O)C1CCCC1)NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000875027532	GG	On-Demand	Anodyne	PROC	47	40
O=C(NCC[C@H](O)C1CCCC1)NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000875027532	GG	On-Demand	Anodyne	L3MBTL3	74	40
O=C(NCC[C@@H](O)C1CCCC1)NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000875027533	GG	On-Demand	Anodyne	DPP7	69	37
O=C(NCC[C@@H](O)C1CCCC1)NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000875027533	GG	On-Demand	Anodyne	PROC	47	40
O=C(NCC[C@@H](O)C1CCCC1)NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000875027533	GG	On-Demand	Anodyne	L3MBTL3	74	40
O=C(NCCCOc1ccccc1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875027535	EF	On-Demand	Anodyne	GRIN2B	17	40
O=C(NCc1ccccc1CN1CCCCC1)NC[C@H]1C[C@H](O)C1	ZINC000875027538	EE	On-Demand	Anodyne	HRH2	20	40
COC(=O)N(C)NC(=O)NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000875027541	ED	On-Demand	Reactive	MLYCD	17	40
COC(=O)N(C)NC(=O)NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000875027541	ED	On-Demand	Reactive	L3MBTL3	71	40
CC[C@@H](NC(=O)C(=O)NCc1ccc(Cl)nc1)c1cccc(OC)c1OC	ZINC000875027549	GF	On-Demand	Anodyne	PDS	52	37
C=CC(C)(C)CCNC(=O)C(=O)NCc1ccc(Cl)nc1	ZINC000875027565	DE	On-Demand	Mild	NACHRBETA2	28	45
COc1ccc(N2CCN(C(=O)C(=O)NCC[C@@H]3CCCO3)CC2)c(OC)c1	ZINC000875027576	GD	On-Demand	Clean	HTR1A	33	41
COc1ccc(N2CCN(C(=O)C(=O)NCC[C@@H]3CCCO3)CC2)c(OC)c1	ZINC000875027576	GD	On-Demand	Clean	DRD2	28	41
COc1ccc(N2CCN(C(=O)C(=O)NCC[C@@H]3CCCO3)CC2)c(OC)c1	ZINC000875027576	GD	On-Demand	Clean	DRD4	45	36
COc1ccc(N2CCN(C(=O)C(=O)NCC[C@@H]3CCCO3)CC2)c(OC)c1	ZINC000875027576	GD	On-Demand	Clean	DRD3	41	40
COc1ccc(N2CCN(C(=O)C(=O)NCC[C@H]3CCCO3)CC2)c(OC)c1	ZINC000875027577	GD	On-Demand	Clean	HTR1A	33	41
COc1ccc(N2CCN(C(=O)C(=O)NCC[C@H]3CCCO3)CC2)c(OC)c1	ZINC000875027577	GD	On-Demand	Clean	DRD2	28	41
COc1ccc(N2CCN(C(=O)C(=O)NCC[C@H]3CCCO3)CC2)c(OC)c1	ZINC000875027577	GD	On-Demand	Clean	DRD4	45	36
COc1ccc(N2CCN(C(=O)C(=O)NCC[C@H]3CCCO3)CC2)c(OC)c1	ZINC000875027577	GD	On-Demand	Clean	DRD3	41	40
O=C(NCCCCOc1ccc(F)cc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875027593	GG	On-Demand	Anodyne	EPHX2	20	44
O=C(NCCCCOc1ccc(F)cc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875027594	GG	On-Demand	Anodyne	EPHX2	20	44
O=CN1CCCN(C(=O)NCCCCOc2ccc(Cl)cc2)CC1	ZINC000875027672	FE	On-Demand	Anodyne	HRH3	15	42
O=C(NCC[C@@H]1CCCO1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875027697	GD	On-Demand	Anodyne	ETHR	65	51
O=C(NCC[C@H]1CCCO1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875027698	GD	On-Demand	Anodyne	ETHR	65	51
CC[C@@H](NC(=O)C(=O)NCc1ccc(O)cc1)c1cccc(OC)c1OC	ZINC000875027707	FE	On-Demand	Anodyne	PDS	46	35
CCC1(N(C)C)CCN(C(=O)C(=O)NCc2ccc(Cl)nc2)CC1	ZINC000875027708	FD	On-Demand	Anodyne	NACHRBETA2	47	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000875027741	GF	On-Demand	Anodyne	SLC6A3	42	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000875027741	GF	On-Demand	Anodyne	L3MBTL3	74	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000875027741	GF	On-Demand	Anodyne	NAMPT	16	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000875027742	GF	On-Demand	Anodyne	SLC6A3	42	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000875027742	GF	On-Demand	Anodyne	L3MBTL3	74	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000875027742	GF	On-Demand	Anodyne	NAMPT	16	41
O=C(NCc1ccc(Cl)nc1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875027749	DD	On-Demand	Anodyne	NACHRBETA2	48	45
CN(C)C[C@@H]1CN(C(=O)NCCCOc2ccccc2)C[C@H]1CN(C)C	ZINC000875027753	FD	On-Demand	Anodyne	LTA4H	33	41
C=CC(C)(C)CCCNC(=O)C(=O)NCc1ccc(O)cc1	ZINC000875027757	DE	On-Demand	Mild	GRIA1	40	34
O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875027759	GH	On-Demand	Anodyne	L3MBTL3	64	38
O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)NC1([C@H]2CCCCO2)CCC1	ZINC000875027760	GH	On-Demand	Anodyne	L3MBTL3	64	38
CCCCCCCNC(=O)C(=O)NCc1ccc(O)cc1	ZINC000875027761	CE	On-Demand	Mild	INHA	44	33
CCCCCCCNC(=O)C(=O)NCc1ccc(O)cc1	ZINC000875027761	CE	On-Demand	Mild	S1PR4	21	40
CCCCCCCNC(=O)C(=O)NCc1ccc(O)cc1	ZINC000875027761	CE	On-Demand	Mild	LPAR2	40	40
CCCCCCCNC(=O)C(=O)NCc1ccc(O)cc1	ZINC000875027761	CE	On-Demand	Mild	S1PR3	31	40
CCCCCCCNC(=O)C(=O)NCc1ccc(O)cc1	ZINC000875027761	CE	On-Demand	Mild	GRIA1	85	46
CCCCCCCNC(=O)C(=O)NCc1ccc(O)cc1	ZINC000875027761	CE	On-Demand	Mild	S1PR2	68	43
CCCCCCCNC(=O)C(=O)NCc1ccc(O)cc1	ZINC000875027761	CE	On-Demand	Mild	S1PR1	15	43
CCCCCCCNC(=O)C(=O)NCc1ccc(O)cc1	ZINC000875027761	CE	On-Demand	Mild	SPHK1	21	40
CCCCCCCNC(=O)C(=O)NCc1ccc(O)cc1	ZINC000875027761	CE	On-Demand	Mild	S1PR5	16	40
CCCCCCCNC(=O)C(=O)NCc1ccc(O)cc1	ZINC000875027761	CE	On-Demand	Mild	ASAH1	108	42
O=C(NCc1ccc(Cl)nc1)C(=O)N[C@H]1CCCc2ccc(Cl)cc21	ZINC000875027762	GG	On-Demand	Anodyne	HTR2A	22	40
O=C(NCc1ccc(Cl)nc1)C(=O)N[C@@H]1CCCc2ccc(Cl)cc21	ZINC000875027763	GG	On-Demand	Anodyne	HTR2A	22	40
Cc1ccc(C(C)(C)CNC(=O)C(=O)NCc2ccc(Cl)nc2)nc1	ZINC000875027772	FE	On-Demand	Anodyne	NACHRBETA2	17	43
COC(=O)N(C)NC(=O)NCCCCOc1ccc(F)cc1	ZINC000875027788	DD	On-Demand	Reactive	LTA4H	17	49
COC(=O)N(C)NC(=O)NCCCCOc1ccc(F)cc1	ZINC000875027788	DD	On-Demand	Reactive	LSS	20	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCSc2ccc(F)cc21	ZINC000875027833	FG	On-Demand	Anodyne	SLC6A3	29	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCSc2ccc(F)cc21	ZINC000875027834	FG	On-Demand	Anodyne	SLC6A3	29	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCSc2ccc(F)cc21	ZINC000875027835	FG	On-Demand	Anodyne	SLC6A3	29	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCSc2ccc(F)cc21	ZINC000875027836	FG	On-Demand	Anodyne	SLC6A3	29	40
C=CC(C)(C)CCCNC(=O)C(=O)NCCc1cccnc1	ZINC000875027841	DD	On-Demand	Mild	TBXAS1	63	40
C=CC(C)(C)CCCNC(=O)C(=O)NCCc1cccnc1	ZINC000875027841	DD	On-Demand	Mild	PTAFR	33	47
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)C1CCN(C(=O)/C=C\c2ccccc2)CC1	ZINC000875027842	JJ	On-Demand	Anodyne	SCD	29	42
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)C1CCN(C(=O)/C=C/c2ccccc2)CC1	ZINC000875027843	JJ	On-Demand	Anodyne	SCD	29	42
CN(C)S(=O)(=O)c1cc(C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)ccc1Cl	ZINC000875027854	JI	On-Demand	Anodyne	CPT1A	24	43
CN(C)S(=O)(=O)c1cc(C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)ccc1Cl	ZINC000875027854	JI	On-Demand	Anodyne	CPT1B	49	40
CN(C)S(=O)(=O)c1cc(C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)ccc1Cl	ZINC000875027854	JI	On-Demand	Anodyne	SCD1	49	55
CN(C)S(=O)(=O)c1cc(C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)ccc1Cl	ZINC000875027854	JI	On-Demand	Anodyne	SCD	42	58
O=C(NCCc1cccnc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875027864	CC	On-Demand	Anodyne	CHRNA7	40	34
O=C(NCCc1cccnc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875027864	CC	On-Demand	Anodyne	NAMPT	37	41
O=C(NCCc1cccnc1)C(=O)N[C@H]1CC12CCC2	ZINC000875027865	CC	On-Demand	Anodyne	CHRNA7	40	34
O=C(NCCc1cccnc1)C(=O)N[C@H]1CC12CCC2	ZINC000875027865	CC	On-Demand	Anodyne	NAMPT	37	41
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1ccc(S(C)(=O)=O)cc1	ZINC000875027874	FE	On-Demand	Anodyne	CTSF	54	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCc1cccnc1)CC2	ZINC000875027878	GD	On-Demand	Anodyne	FKBP1A	18	41
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCc1cccnc1)CC2	ZINC000875027878	GD	On-Demand	Anodyne	SLC18A2	45	33
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCc1cccnc1)CC2	ZINC000875027878	GD	On-Demand	Anodyne	PTAFR	30	44
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCc1cccnc1)CC2	ZINC000875027878	GD	On-Demand	Anodyne	HCRTR1	17	54
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCc1cccnc1)CC2	ZINC000875027878	GD	On-Demand	Anodyne	CHRNA7	44	38
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCc1cccnc1)CC2	ZINC000875027878	GD	On-Demand	Anodyne	MTNR1B	18	47
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCc1cccnc1)CC2	ZINC000875027878	GD	On-Demand	Anodyne	HCRTR2	17	48
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCc1cccnc1)CC2	ZINC000875027879	GD	On-Demand	Anodyne	FKBP1A	18	41
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCc1cccnc1)CC2	ZINC000875027879	GD	On-Demand	Anodyne	SLC18A2	45	33
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCc1cccnc1)CC2	ZINC000875027879	GD	On-Demand	Anodyne	PTAFR	30	44
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCc1cccnc1)CC2	ZINC000875027879	GD	On-Demand	Anodyne	HCRTR1	17	54
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCc1cccnc1)CC2	ZINC000875027879	GD	On-Demand	Anodyne	CHRNA7	44	38
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCc1cccnc1)CC2	ZINC000875027879	GD	On-Demand	Anodyne	MTNR1B	18	47
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCc1cccnc1)CC2	ZINC000875027879	GD	On-Demand	Anodyne	HCRTR2	17	48
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(S(C)(=O)=O)cc1	ZINC000875027902	ED	On-Demand	Anodyne	CTSF	43	33
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(S(C)(=O)=O)cc1	ZINC000875027903	ED	On-Demand	Anodyne	CTSF	43	33
COC(=O)c1ccc(OC)c2c1CCN(C(=O)C(=O)NCCc1cccnc1)C2	ZINC000875027912	GD	On-Demand	Anodyne	PTAFR	28	41
Cn1ccnc1[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccccc1	ZINC000875027915	ED	On-Demand	Anodyne	PTAFR	20	43
Cn1ccnc1[C@H](NC(=O)N1CCCN(C=O)CC1)c1ccccc1	ZINC000875027916	ED	On-Demand	Anodyne	PTAFR	20	43
O=C(NCCCCOc1ccc(F)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875027937	DE	On-Demand	Anodyne	EPHX2	21	60
Cn1ccnc1[C@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccc(F)cc1	ZINC000875027956	FF	On-Demand	Anodyne	CCR3	47	33
Cn1ccnc1[C@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccc(F)cc1	ZINC000875027957	FF	On-Demand	Anodyne	CCR3	47	33
Cn1ccnc1[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccc(F)cc1	ZINC000875027958	FF	On-Demand	Anodyne	CCR3	47	33
Cn1ccnc1[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccc(F)cc1	ZINC000875027959	FF	On-Demand	Anodyne	CCR3	47	33
CO[C@H](CNC(=O)C(=O)N1CCC(C)(N2CCCCC2)CC1)c1ccccc1	ZINC000875027965	GE	On-Demand	Anodyne	HCN1	53	35
CO[C@H](CNC(=O)C(=O)N1CCC(C)(N2CCCCC2)CC1)c1ccccc1	ZINC000875027965	GE	On-Demand	Anodyne	HCN4	49	35
O=C(NCCO)C1CCN(C(=O)NCCCCOc2ccc(F)cc2)CC1	ZINC000875027979	GD	On-Demand	Anodyne	HRH2	21	40
O=C(NCCO)C1CCN(C(=O)NCCCCOc2ccc(F)cc2)CC1	ZINC000875027979	GD	On-Demand	Anodyne	HRH3	17	40
O=C(NCCO)C1CCN(C(=O)NCCCCOc2ccc(F)cc2)CC1	ZINC000875027979	GD	On-Demand	Anodyne	EPHX2	17	46
O=C(NCCO)C1CCN(C(=O)NCCCCOc2ccc(F)cc2)CC1	ZINC000875027979	GD	On-Demand	Anodyne	CACNA1G	37	43
O=C(NCCc1cccnc1)C(=O)NCCn1ccc(C(F)(F)F)n1	ZINC000875027997	FC	On-Demand	Anodyne	NAMPT	30	40
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCCc2cccnc2)c1	ZINC000875028025	ED	On-Demand	Anodyne	FKBP1A	36	53
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCCc2cccnc2)c1	ZINC000875028025	ED	On-Demand	Anodyne	CHRNA7	52	39
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCCc2cccnc2)c1	ZINC000875028025	ED	On-Demand	Anodyne	C3AR1	37	40
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCCc2cccnc2)c1	ZINC000875028025	ED	On-Demand	Anodyne	PREP	28	40
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCCc2cccnc2)c1	ZINC000875028025	ED	On-Demand	Anodyne	GPBAR1	22	40
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCCc2cccnc2)c1	ZINC000875028025	ED	On-Demand	Anodyne	NAMPT	40	40
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCCc2cccnc2)c1	ZINC000875028026	ED	On-Demand	Anodyne	FKBP1A	36	53
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCCc2cccnc2)c1	ZINC000875028026	ED	On-Demand	Anodyne	CHRNA7	52	39
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCCc2cccnc2)c1	ZINC000875028026	ED	On-Demand	Anodyne	C3AR1	37	40
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCCc2cccnc2)c1	ZINC000875028026	ED	On-Demand	Anodyne	PREP	28	40
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCCc2cccnc2)c1	ZINC000875028026	ED	On-Demand	Anodyne	GPBAR1	22	40
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCCc2cccnc2)c1	ZINC000875028026	ED	On-Demand	Anodyne	NAMPT	40	40
O=C1CCN(C(=O)NCCCCOc2ccc(F)cc2)CCCCCCN1	ZINC000875028041	GG	On-Demand	Anodyne	HRH3	21	41
O=C(N[C@H]1CCSc2ccc(F)cc21)N1CCC(CO)(CO)CC1	ZINC000875028050	FE	On-Demand	Anodyne	CCR3	19	42
O=C(N[C@@H]1CCSc2ccc(F)cc21)N1CCC(CO)(CO)CC1	ZINC000875028051	FE	On-Demand	Anodyne	CCR3	19	42
C=CCOc1ccc(/C=C\C(=O)Oc2cc(OC)cc(OC)c2)cc1OC	ZINC000875028088	FH	On-Demand	Mild	CYP1B1	37	44
C=CCOc1ccc(/C=C\C(=O)Oc2cc(OC)cc(OC)c2)cc1OC	ZINC000875028088	FH	On-Demand	Mild	APP	20	44
C=CCOc1ccc(/C=C\C(=O)Oc2cc(OC)cc(OC)c2)cc1OC	ZINC000875028088	FH	On-Demand	Mild	CYP1A1	38	49
C=CCOc1ccc(/C=C\C(=O)Oc2cc(OC)cc(OC)c2)cc1OC	ZINC000875028088	FH	On-Demand	Mild	TUBB1	60	40
C=CCOc1ccc(/C=C\C(=O)Oc2cc(OC)cc(OC)c2)cc1OC	ZINC000875028088	FH	On-Demand	Mild	ABCG2	20	49
C=CCOc1ccc(/C=C/C(=O)Oc2cc(OC)cc(OC)c2)cc1OC	ZINC000875028089	FH	On-Demand	Mild	CYP1B1	37	44
C=CCOc1ccc(/C=C/C(=O)Oc2cc(OC)cc(OC)c2)cc1OC	ZINC000875028089	FH	On-Demand	Mild	APP	20	44
C=CCOc1ccc(/C=C/C(=O)Oc2cc(OC)cc(OC)c2)cc1OC	ZINC000875028089	FH	On-Demand	Mild	CYP1A1	38	49
C=CCOc1ccc(/C=C/C(=O)Oc2cc(OC)cc(OC)c2)cc1OC	ZINC000875028089	FH	On-Demand	Mild	TUBB1	60	40
C=CCOc1ccc(/C=C/C(=O)Oc2cc(OC)cc(OC)c2)cc1OC	ZINC000875028089	FH	On-Demand	Mild	ABCG2	20	49
CN1CCN(C2CCN(C(=O)N[C@@H]3CC[C@H]4CCCC[C@H]4C3)CC2)CC1	ZINC000875028096	FF	On-Demand	Anodyne	L3MBTL3	73	44
CN1CCN(C2CCN(C(=O)N[C@@H]3CC[C@@H]4CCCC[C@H]4C3)CC2)CC1	ZINC000875028097	FF	On-Demand	Anodyne	L3MBTL3	73	44
CN1CCN(C2CCN(C(=O)N[C@@H]3CC[C@H]4CCCC[C@@H]4C3)CC2)CC1	ZINC000875028098	FF	On-Demand	Anodyne	L3MBTL3	73	44
CN1CCN(C2CCN(C(=O)N[C@@H]3CC[C@@H]4CCCC[C@@H]4C3)CC2)CC1	ZINC000875028099	FF	On-Demand	Anodyne	L3MBTL3	73	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCCOc1ccc(F)cc1	ZINC000875028110	FF	On-Demand	Anodyne	SLC6A4	25	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCCOc1ccc(F)cc1	ZINC000875028110	FF	On-Demand	Anodyne	SLC6A3	49	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1nnc2ccccn12	ZINC000875028117	ED	On-Demand	Anodyne	SLC6A4	24	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1nnc2ccccn12	ZINC000875028117	ED	On-Demand	Anodyne	SLC6A3	49	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1nnc2ccccn12	ZINC000875028118	ED	On-Demand	Anodyne	SLC6A4	24	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1nnc2ccccn12	ZINC000875028118	ED	On-Demand	Anodyne	SLC6A3	49	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1nnc2ccccn12	ZINC000875028119	ED	On-Demand	Anodyne	SLC6A4	24	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1nnc2ccccn12	ZINC000875028119	ED	On-Demand	Anodyne	SLC6A3	49	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1nnc2ccccn12	ZINC000875028120	ED	On-Demand	Anodyne	SLC6A4	24	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1nnc2ccccn12	ZINC000875028120	ED	On-Demand	Anodyne	SLC6A3	49	41
CO[C@H](CNC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1)c1ccccc1	ZINC000875028137	ED	On-Demand	Anodyne	SLC6A1	42	37
CO[C@H](CNC(=O)C(=O)N1CCC[C@H](C(C)=O)C1)c1ccccc1	ZINC000875028138	ED	On-Demand	Anodyne	SLC6A1	42	37
Cn1ccnc1[C@@H](NC(=O)N1CCC(c2nnnn2C)CC1)c1ccc(F)cc1	ZINC000875028179	GD	On-Demand	Anodyne	CCR3	50	33
Cn1ccnc1[C@H](NC(=O)N1CCC(c2nnnn2C)CC1)c1ccc(F)cc1	ZINC000875028180	GD	On-Demand	Anodyne	CCR3	50	33
O=C(NCCC[C@H]1C=CCC1)C(=O)NCCc1cccnc1	ZINC000875028181	DD	On-Demand	Anodyne	PTAFR	23	42
O=C(NCCC[C@@H]1C=CCC1)C(=O)NCCc1cccnc1	ZINC000875028182	DD	On-Demand	Anodyne	PTAFR	23	42
CO[C@H](CNC(=O)C(=O)N(C)C[C@@H](C)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000875028196	GD	On-Demand	Anodyne	CTSK	18	42
CO[C@H](CNC(=O)C(=O)N(C)C[C@@H](C)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000875028196	GD	On-Demand	Anodyne	FPR1	43	36
CO[C@H](CNC(=O)C(=O)N(C)C[C@H](C)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000875028197	GD	On-Demand	Anodyne	CTSK	18	42
CO[C@H](CNC(=O)C(=O)N(C)C[C@H](C)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000875028197	GD	On-Demand	Anodyne	FPR1	43	36
COCC(C)(C)CCNC(=O)C(=O)NCCNC(=O)c1ccc(C)c(F)c1	ZINC000875028202	GD	On-Demand	Anodyne	DRD4	41	32
O=C(NCCNS(=O)(=O)c1ccccc1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875028218	GC	On-Demand	Anodyne	TBXA2R	21	41
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000875028221	JJ	On-Demand	Anodyne	SCD1	39	45
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000875028221	JJ	On-Demand	Anodyne	SCD	32	47
C[C@]1(C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)Cc2ccccc2C(=O)O1	ZINC000875028227	HI	On-Demand	Anodyne	SCD1	36	40
C[C@]1(C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)Cc2ccccc2C(=O)O1	ZINC000875028227	HI	On-Demand	Anodyne	SCD	32	47
CO[C@H](CNC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1)c1ccccc1	ZINC000875028232	GF	On-Demand	Anodyne	PDE4A	15	44
CO[C@H](CNC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1)c1ccccc1	ZINC000875028232	GF	On-Demand	Anodyne	C3AR1	40	42
CO[C@H](CNC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1)c1ccccc1	ZINC000875028233	GF	On-Demand	Anodyne	PDE4A	15	44
CO[C@H](CNC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1)c1ccccc1	ZINC000875028233	GF	On-Demand	Anodyne	C3AR1	40	42
N#CCSc1ccccc1C(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875028236	HJ	On-Demand	Mild	SCD1	40	43
N#CCSc1ccccc1C(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875028236	HJ	On-Demand	Mild	SCD	34	51
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCOc2ccc(Cl)cc2)C1	ZINC000875028251	GG	On-Demand	Anodyne	PLA2G4B	42	30
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCOc2ccc(Cl)cc2)C1	ZINC000875028251	GG	On-Demand	Anodyne	ASAH1	40	34
O=C(NCCc1cccnc1)C(=O)NCc1cc(C(F)(F)F)cc(Cl)n1	ZINC000875028260	GE	On-Demand	Anodyne	PTAFR	15	40
O=C(NCCc1cccnc1)C(=O)NCc1cc(C(F)(F)F)cc(Cl)n1	ZINC000875028260	GE	On-Demand	Anodyne	DPP8	19	40
O=C1CC[C@H](C(=O)Nc2ccc(Cl)c(S(=O)(=O)N3CCCCC3)c2)O1	ZINC000875028261	GE	On-Demand	Anodyne	EPHX2	41	50
O=C(NCCO)C1CCN(C(=O)NCCCCOc2ccc(Cl)cc2)CC1	ZINC000875028282	GE	On-Demand	Anodyne	HRH3	18	42
O=C(NCCO)C1CCN(C(=O)NCCCCOc2ccc(Cl)cc2)CC1	ZINC000875028282	GE	On-Demand	Anodyne	EPHX2	22	50
CN1CC[C@H]2CN(C(=O)C(=O)NCCNS(=O)(=O)c3ccccc3)CC[C@H]21	ZINC000875028288	GB	On-Demand	Anodyne	SFRP1	57	33
CN1CC[C@H]2CN(C(=O)C(=O)NCCNS(=O)(=O)c3ccccc3)CC[C@@H]21	ZINC000875028289	GB	On-Demand	Anodyne	SFRP1	57	33
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000875028312	GD	On-Demand	Anodyne	CTSK	25	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000875028313	GD	On-Demand	Anodyne	CTSK	25	40
O=C(NCCNS(=O)(=O)c1ccccc1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875028388	GC	On-Demand	Anodyne	SFRP1	66	33
O=C(NCCNS(=O)(=O)c1ccccc1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875028388	GC	On-Demand	Anodyne	WNT3	40	31
O=C(NCCNS(=O)(=O)c1ccccc1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875028389	GC	On-Demand	Anodyne	SFRP1	66	33
O=C(NCCNS(=O)(=O)c1ccccc1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875028389	GC	On-Demand	Anodyne	WNT3	40	31
O=C(NCCNS(=O)(=O)c1ccccc1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875028390	GC	On-Demand	Anodyne	SFRP1	66	33
O=C(NCCNS(=O)(=O)c1ccccc1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875028390	GC	On-Demand	Anodyne	WNT3	40	31
O=C(NCCNS(=O)(=O)c1ccccc1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875028391	GC	On-Demand	Anodyne	SFRP1	66	33
O=C(NCCNS(=O)(=O)c1ccccc1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875028391	GC	On-Demand	Anodyne	WNT3	40	31
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(S(C)(=O)=O)cc1	ZINC000875028392	GD	On-Demand	Anodyne	SLC6A4	19	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(S(C)(=O)=O)cc1	ZINC000875028393	GD	On-Demand	Anodyne	SLC6A4	19	49
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(S(C)(=O)=O)cc1	ZINC000875028394	GD	On-Demand	Anodyne	SLC6A4	19	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(S(C)(=O)=O)cc1	ZINC000875028395	GD	On-Demand	Anodyne	SLC6A4	19	49
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1ccc(CS(=O)(=O)c2ccccc2)o1	ZINC000875028409	JJ	On-Demand	Anodyne	SCD1	38	41
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1ccc(CS(=O)(=O)c2ccccc2)o1	ZINC000875028409	JJ	On-Demand	Anodyne	SCD	33	49
C[C@H](NC(=O)C(=O)NCCc1cccnc1)c1ccnn1C	ZINC000875028421	DC	On-Demand	Anodyne	PTAFR	39	40
C[C@H](NC(=O)C(=O)NCCc1cccnc1)c1ccnn1C	ZINC000875028421	DC	On-Demand	Anodyne	KCNA5	16	42
CO[C@H](CNC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccccc1	ZINC000875028433	GC	On-Demand	Anodyne	L3MBTL3	59	39
O=C(NCCCCOc1ccc(Cl)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875028440	EF	On-Demand	Anodyne	EPHX2	17	46
Cn1ccnc1[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1ccc(F)cc1	ZINC000875028447	GD	On-Demand	Anodyne	CACNA1H	42	38
Cn1ccnc1[C@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1ccc(F)cc1	ZINC000875028448	GD	On-Demand	Anodyne	CACNA1H	42	38
O=C(NCCc1cccnc1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875028456	ED	On-Demand	Anodyne	OXTR	15	44
O=C(NCCc1cccnc1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875028457	ED	On-Demand	Anodyne	OXTR	15	44
CO[C@H](CNC(=O)C(=O)NCCC1CCN(C(C)C)CC1)c1ccccc1	ZINC000875028477	GE	On-Demand	Anodyne	ACHE	15	41
CO[C@H](CNC(=O)C(=O)NCCC1CCN(C(C)C)CC1)c1ccccc1	ZINC000875028477	GE	On-Demand	Anodyne	SLC6A3	15	40
CO[C@H](CNC(=O)C(=O)NCCC1CCN(C(C)C)CC1)c1ccccc1	ZINC000875028477	GE	On-Demand	Anodyne	SIRT2	43	30
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCOc2ccc(F)cc2)C1	ZINC000875028489	FF	On-Demand	Anodyne	PLA2G4B	42	30
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCOc2ccc(F)cc2)C1	ZINC000875028489	FF	On-Demand	Anodyne	FAAH	15	46
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCOc2ccc(F)cc2)C1	ZINC000875028489	FF	On-Demand	Anodyne	ASAH1	72	36
O=C(NCCCCOc1ccc(Cl)cc1)N1CCC(CO)(CO)CC1	ZINC000875028498	FE	On-Demand	Anodyne	EPHX2	19	40
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCCOc3ccc(F)cc3)C[C@@H]1C2	ZINC000875028502	FF	On-Demand	Anodyne	CCR3	16	40
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCCOc3ccc(F)cc3)C[C@@H]1C2	ZINC000875028502	FF	On-Demand	Anodyne	EPHX2	35	57
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2cccnc2)C1	ZINC000875028505	DC	On-Demand	Anodyne	FKBP1A	22	45
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2cccnc2)C1	ZINC000875028505	DC	On-Demand	Anodyne	CHRNA7	46	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2cccnc2)C1	ZINC000875028505	DC	On-Demand	Anodyne	C3AR1	43	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2cccnc2)C1	ZINC000875028505	DC	On-Demand	Anodyne	NAMPT	46	46
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2cccnc2)C1	ZINC000875028506	DC	On-Demand	Anodyne	FKBP1A	22	45
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2cccnc2)C1	ZINC000875028506	DC	On-Demand	Anodyne	CHRNA7	46	38
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2cccnc2)C1	ZINC000875028506	DC	On-Demand	Anodyne	C3AR1	43	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2cccnc2)C1	ZINC000875028506	DC	On-Demand	Anodyne	NAMPT	46	46
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1CCSc2ccc(F)cc21	ZINC000875028515	GG	On-Demand	Anodyne	ACKR3	45	33
CC(C)c1cc([C@@H]2CCCN(C(=O)C(=O)NCCc3cccnc3)C2)n[nH]1	ZINC000875028545	FD	On-Demand	Anodyne	CHRNA7	44	34
COC(=O)C1(O)CN(C(=O)NCCCCOc2ccc(F)cc2)C1	ZINC000875028563	EC	On-Demand	Anodyne	ASAH1	50	31
CC(=O)C1CCN(C(=O)N[C@@H]2CC[C@H]3CCCC[C@@H]3C2)CC1	ZINC000875028608	DG	On-Demand	Anodyne	EPHX2	21	42
CC(=O)C1CCN(C(=O)N[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)CC1	ZINC000875028609	DG	On-Demand	Anodyne	EPHX2	21	42
CC(=O)C1CCN(C(=O)N[C@@H]2CC[C@H]3CCCC[C@H]3C2)CC1	ZINC000875028610	DG	On-Demand	Anodyne	EPHX2	21	42
CC(=O)C1CCN(C(=O)N[C@@H]2CC[C@@H]3CCCC[C@H]3C2)CC1	ZINC000875028611	DG	On-Demand	Anodyne	EPHX2	21	42
COCC(C)(C)CCNC(=O)C(=O)NCCc1cccnc1	ZINC000875028612	DC	On-Demand	Anodyne	TBXAS1	51	41
COCC(C)(C)CCNC(=O)C(=O)NCCc1cccnc1	ZINC000875028612	DC	On-Demand	Anodyne	PTAFR	33	40
O=C(NCCCN1CCN(c2ncccn2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875028618	GC	On-Demand	Anodyne	HTR1A	42	54
O=C(NCCCN1CCN(c2ncccn2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875028618	GC	On-Demand	Anodyne	DRD2	39	46
O=C(NCCCN1CCN(c2ncccn2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875028618	GC	On-Demand	Anodyne	DRD4	23	45
O=C(NCCCN1CCN(c2ncccn2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875028618	GC	On-Demand	Anodyne	HTR2A	32	45
O=C(NCCCN1CCN(c2ncccn2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875028618	GC	On-Demand	Anodyne	HTR2C	23	45
O=C(NCCCN1CCN(c2ncccn2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875028618	GC	On-Demand	Anodyne	DRD3	52	40
O=C(NCCCN1CCN(c2ncccn2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875028618	GC	On-Demand	Anodyne	ATP6V0A1	15	45
CO[C@H](CNC(=O)C(=O)N1CCC[C@H]1c1cncc(C)c1)c1ccccc1	ZINC000875028624	FF	On-Demand	Anodyne	PREP	40	32
CO[C@H](CNC(=O)C(=O)N1CCC[C@@H]1c1cncc(C)c1)c1ccccc1	ZINC000875028625	FF	On-Demand	Anodyne	PREP	40	32
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)c1	ZINC000875028632	JH	On-Demand	Anodyne	SCD1	40	44
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)c1	ZINC000875028632	JH	On-Demand	Anodyne	SCD	35	52
CC[C@H](C[C@H](C)O)NC(=O)NCCCCOc1ccc(F)cc1	ZINC000875028633	EF	On-Demand	Anodyne	ADRB1	17	40
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCNC(=O)c2ccc(C)c(F)c2)C1	ZINC000875028643	GD	On-Demand	Anodyne	DRD4	40	31
C#CC[C@@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000875028645	GB	On-Demand	Mild	HTR1A	53	48
C#CC[C@@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000875028645	GB	On-Demand	Mild	DRD2	47	41
C#CC[C@@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000875028645	GB	On-Demand	Mild	DRD4	36	40
C#CC[C@@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000875028645	GB	On-Demand	Mild	HTR2A	32	43
C#CC[C@@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000875028645	GB	On-Demand	Mild	HTR2C	25	43
C#CC[C@@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000875028645	GB	On-Demand	Mild	DRD3	65	40
C#CC[C@@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000875028645	GB	On-Demand	Mild	ATP6V0A1	15	45
C#CC[C@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000875028646	GB	On-Demand	Mild	HTR1A	53	48
C#CC[C@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000875028646	GB	On-Demand	Mild	DRD2	47	41
C#CC[C@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000875028646	GB	On-Demand	Mild	DRD4	36	40
C#CC[C@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000875028646	GB	On-Demand	Mild	HTR2A	32	43
C#CC[C@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000875028646	GB	On-Demand	Mild	HTR2C	25	43
C#CC[C@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000875028646	GB	On-Demand	Mild	DRD3	65	40
C#CC[C@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000875028646	GB	On-Demand	Mild	ATP6V0A1	15	45
O=C(NCCCN1CCN(c2ncccn2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875028647	FC	On-Demand	Anodyne	HTR1A	47	63
O=C(NCCCN1CCN(c2ncccn2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875028647	FC	On-Demand	Anodyne	DRD2	41	53
O=C(NCCCN1CCN(c2ncccn2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875028647	FC	On-Demand	Anodyne	DRD4	22	43
O=C(NCCCN1CCN(c2ncccn2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875028647	FC	On-Demand	Anodyne	ADRA1D	21	47
O=C(NCCCN1CCN(c2ncccn2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875028647	FC	On-Demand	Anodyne	HTR2A	35	47
O=C(NCCCN1CCN(c2ncccn2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875028647	FC	On-Demand	Anodyne	HTR2C	24	47
O=C(NCCCN1CCN(c2ncccn2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875028647	FC	On-Demand	Anodyne	DRD3	50	47
O=C(NCCCN1CCN(c2ncccn2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875028648	FC	On-Demand	Anodyne	HTR1A	47	63
O=C(NCCCN1CCN(c2ncccn2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875028648	FC	On-Demand	Anodyne	DRD2	41	53
O=C(NCCCN1CCN(c2ncccn2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875028648	FC	On-Demand	Anodyne	DRD4	22	43
O=C(NCCCN1CCN(c2ncccn2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875028648	FC	On-Demand	Anodyne	ADRA1D	21	47
O=C(NCCCN1CCN(c2ncccn2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875028648	FC	On-Demand	Anodyne	HTR2A	35	47
O=C(NCCCN1CCN(c2ncccn2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875028648	FC	On-Demand	Anodyne	HTR2C	24	47
O=C(NCCCN1CCN(c2ncccn2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875028648	FC	On-Demand	Anodyne	DRD3	50	47
C[C@H](NC(=O)NC[C@H]1CC(C(F)(F)F)=NO1)c1ccc(S(C)(=O)=O)cc1	ZINC000875028663	GE	On-Demand	Anodyne	CTSF	52	34
C[C@@H](NC(=O)NC[C@@H]1CC(C(F)(F)F)=NO1)c1ccc(S(C)(=O)=O)cc1	ZINC000875028664	GE	On-Demand	Anodyne	CTSF	52	34
C[C@@H](NC(=O)NC[C@H]1CC(C(F)(F)F)=NO1)c1ccc(S(C)(=O)=O)cc1	ZINC000875028665	GE	On-Demand	Anodyne	CTSF	52	34
O=C(N[C@@H]1CC[C@@H]2CCCC[C@H]2C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875028667	FG	On-Demand	Anodyne	SMO	31	42
O=C(N[C@@H]1CC[C@@H]2CCCC[C@H]2C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875028668	FG	On-Demand	Anodyne	SMO	31	42
O=C(N[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875028669	FG	On-Demand	Anodyne	SMO	31	42
O=C(N[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875028670	FG	On-Demand	Anodyne	SMO	31	42
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCc1cccnc1	ZINC000875028676	EE	On-Demand	Anodyne	ADRB3	32	40
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCc1cccnc1	ZINC000875028676	EE	On-Demand	Anodyne	TBXAS1	49	42
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCc1cccnc1	ZINC000875028676	EE	On-Demand	Anodyne	PTAFR	38	44
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCc1cccnc1	ZINC000875028676	EE	On-Demand	Anodyne	KCNA5	20	45
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCc1cccnc1	ZINC000875028676	EE	On-Demand	Anodyne	BRS3	22	46
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCc1cccnc1	ZINC000875028676	EE	On-Demand	Anodyne	MMP3	42	38
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCc1cccnc1	ZINC000875028676	EE	On-Demand	Anodyne	CAPN1	26	41
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCc1cccnc1	ZINC000875028676	EE	On-Demand	Anodyne	CAPN2	60	41
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCc1cccnc1	ZINC000875028676	EE	On-Demand	Anodyne	LAP3	25	40
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCc1cccnc1	ZINC000875028676	EE	On-Demand	Anodyne	AMP1_PLAFQ	31	43
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCc1cccnc1	ZINC000875028677	EE	On-Demand	Anodyne	ADRB3	32	40
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCc1cccnc1	ZINC000875028677	EE	On-Demand	Anodyne	TBXAS1	49	42
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCc1cccnc1	ZINC000875028677	EE	On-Demand	Anodyne	PTAFR	38	44
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCc1cccnc1	ZINC000875028677	EE	On-Demand	Anodyne	KCNA5	20	45
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCc1cccnc1	ZINC000875028677	EE	On-Demand	Anodyne	BRS3	22	46
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCc1cccnc1	ZINC000875028677	EE	On-Demand	Anodyne	MMP3	42	38
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCc1cccnc1	ZINC000875028677	EE	On-Demand	Anodyne	CAPN1	26	41
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCc1cccnc1	ZINC000875028677	EE	On-Demand	Anodyne	CAPN2	60	41
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCc1cccnc1	ZINC000875028677	EE	On-Demand	Anodyne	LAP3	25	40
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCc1cccnc1	ZINC000875028677	EE	On-Demand	Anodyne	AMP1_PLAFQ	31	43
CC[C@]1(C(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)CCNC1=O	ZINC000875028679	GE	On-Demand	Anodyne	TGM2	62	41
CC[C@]1(C(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)CCNC1=O	ZINC000875028679	GE	On-Demand	Anodyne	F13A1	81	46
CC[C@]1(C(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)CCNC1=O	ZINC000875028679	GE	On-Demand	Anodyne	NAMPT	49	48
O=C(NCCc1cccnc1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875028698	FE	On-Demand	Anodyne	TBXAS1	28	42
O=C(NCCc1cccnc1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875028698	FE	On-Demand	Anodyne	C3AR1	44	45
O=C(NCCc1cccnc1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875028698	FE	On-Demand	Anodyne	NAMPT	31	40
O=C(NCCc1cccnc1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875028699	FE	On-Demand	Anodyne	TBXAS1	28	42
O=C(NCCc1cccnc1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875028699	FE	On-Demand	Anodyne	C3AR1	44	45
O=C(NCCc1cccnc1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875028699	FE	On-Demand	Anodyne	NAMPT	31	40
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12	ZINC000875028700	JH	On-Demand	Anodyne	SCD1	40	44
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12	ZINC000875028700	JH	On-Demand	Anodyne	SCD	34	51
CC[C@@H](NC(=O)C(=O)NCCc1cccnc1)c1cc(C)ccc1C	ZINC000875028707	EF	On-Demand	Anodyne	PTAFR	30	43
O=C(NCCc1cccnc1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875028709	DC	On-Demand	Anodyne	CHRNA7	50	40
O=C(NCCc1cccnc1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875028709	DC	On-Demand	Anodyne	C3AR1	41	41
O=C(NCCc1cccnc1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875028709	DC	On-Demand	Anodyne	ACHP_LYMST	25	40
O=C(NCCc1cccnc1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875028709	DC	On-Demand	Anodyne	NAMPT	44	44
O=C(NCCc1cccnc1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875028710	DC	On-Demand	Anodyne	CHRNA7	50	40
O=C(NCCc1cccnc1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875028710	DC	On-Demand	Anodyne	C3AR1	41	41
O=C(NCCc1cccnc1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875028710	DC	On-Demand	Anodyne	ACHP_LYMST	25	40
O=C(NCCc1cccnc1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875028710	DC	On-Demand	Anodyne	NAMPT	44	44
O=C(NCCc1cccnc1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875028711	DC	On-Demand	Anodyne	CHRNA7	50	40
O=C(NCCc1cccnc1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875028711	DC	On-Demand	Anodyne	C3AR1	41	41
O=C(NCCc1cccnc1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875028711	DC	On-Demand	Anodyne	ACHP_LYMST	25	40
O=C(NCCc1cccnc1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875028711	DC	On-Demand	Anodyne	NAMPT	44	44
O=C(NCCc1cccnc1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875028712	DC	On-Demand	Anodyne	CHRNA7	50	40
O=C(NCCc1cccnc1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875028712	DC	On-Demand	Anodyne	C3AR1	41	41
O=C(NCCc1cccnc1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875028712	DC	On-Demand	Anodyne	ACHP_LYMST	25	40
O=C(NCCc1cccnc1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875028712	DC	On-Demand	Anodyne	NAMPT	44	44
CC[C@@H]1COCCN1CCNC(=O)NCCCOc1ccccc1	ZINC000875028714	ED	On-Demand	Anodyne	HRH2	40	42
CC[C@@H]1COCCN1CCNC(=O)NCCCOc1ccccc1	ZINC000875028714	ED	On-Demand	Anodyne	EPHX2	27	43
COc1ccc(N2CCN(C(=O)C(=O)NCCc3cccnc3)CC2)c(OC)c1	ZINC000875028716	GD	On-Demand	Clean	HTR1A	41	44
COc1ccc(N2CCN(C(=O)C(=O)NCCc3cccnc3)CC2)c(OC)c1	ZINC000875028716	GD	On-Demand	Clean	DRD2	38	44
COc1ccc(N2CCN(C(=O)C(=O)NCCc3cccnc3)CC2)c(OC)c1	ZINC000875028716	GD	On-Demand	Clean	DRD4	45	36
COc1ccc(N2CCN(C(=O)C(=O)NCCc3cccnc3)CC2)c(OC)c1	ZINC000875028716	GD	On-Demand	Clean	ADRA1D	29	41
COc1ccc(N2CCN(C(=O)C(=O)NCCc3cccnc3)CC2)c(OC)c1	ZINC000875028716	GD	On-Demand	Clean	ADRA1A	27	41
COc1ccc(N2CCN(C(=O)C(=O)NCCc3cccnc3)CC2)c(OC)c1	ZINC000875028716	GD	On-Demand	Clean	DRD3	58	41
COc1ccc(N2CCN(C(=O)C(=O)NCCc3cccnc3)CC2)c(OC)c1	ZINC000875028716	GD	On-Demand	Clean	PDGFRB	30	40
COc1ccc(N2CCN(C(=O)C(=O)NCCc3cccnc3)CC2)c(OC)c1	ZINC000875028716	GD	On-Demand	Clean	TBXAS1	16	40
COc1ccc(N2CCN(C(=O)C(=O)NCCc3cccnc3)CC2)c(OC)c1	ZINC000875028716	GD	On-Demand	Clean	PTAFR	37	42
COc1ccc(N2CCN(C(=O)C(=O)NCCc3cccnc3)CC2)c(OC)c1	ZINC000875028716	GD	On-Demand	Clean	HTR7	32	44
COc1ccc(N2CCN(C(=O)C(=O)NCCc3cccnc3)CC2)c(OC)c1	ZINC000875028716	GD	On-Demand	Clean	CHRNA7	32	45
COc1ccc(N2CCN(C(=O)C(=O)NCCc3cccnc3)CC2)c(OC)c1	ZINC000875028716	GD	On-Demand	Clean	C3AR1	33	40
COc1ccc(N2CCN(C(=O)C(=O)NCCc3cccnc3)CC2)c(OC)c1	ZINC000875028716	GD	On-Demand	Clean	MTNR1A	53	44
COc1ccc(N2CCN(C(=O)C(=O)NCCc3cccnc3)CC2)c(OC)c1	ZINC000875028716	GD	On-Demand	Clean	MTNR1B	53	44
O=C(NCCc1cccnc1)C(=O)NCc1ccccc1CC(F)(F)F	ZINC000875028717	FE	On-Demand	Anodyne	TBXAS1	34	40
O=C(NCCc1cccnc1)C(=O)NCc1ccccc1CC(F)(F)F	ZINC000875028717	FE	On-Demand	Anodyne	PTAFR	18	41
O=C(NCCc1cccnc1)C(=O)N1CCC(CCF)CC1	ZINC000875028724	DD	On-Demand	Anodyne	GRIN2B	23	42
O=C(NCCc1cccnc1)C(=O)N1CCC(CCF)CC1	ZINC000875028724	DD	On-Demand	Anodyne	CHRNA7	47	38
O=C(NCCc1cccnc1)C(=O)N1CCC(CCF)CC1	ZINC000875028724	DD	On-Demand	Anodyne	C3AR1	43	42
O=C(NCCc1cccnc1)C(=O)N1CCC(CCF)CC1	ZINC000875028724	DD	On-Demand	Anodyne	SCD	19	42
O=C(NCCc1cccnc1)C(=O)N1CCC(CCF)CC1	ZINC000875028724	DD	On-Demand	Anodyne	NAMPT	47	44
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000875028725	GE	On-Demand	Anodyne	CA2	16	42
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000875028725	GE	On-Demand	Anodyne	LPL	51	41
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000875028725	GE	On-Demand	Anodyne	CA1	17	42
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000875028725	GE	On-Demand	Anodyne	CA4	16	40
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000875028725	GE	On-Demand	Anodyne	GRM4	18	42
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000875028725	GE	On-Demand	Anodyne	EPHX2	17	40
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000875028725	GE	On-Demand	Anodyne	TGM2	77	45
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000875028725	GE	On-Demand	Anodyne	F13A1	94	50
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000875028725	GE	On-Demand	Anodyne	LIPG	21	41
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000875028725	GE	On-Demand	Anodyne	NAMPT	66	49
O=C(NCCc1cccnc1)C(=O)NC[C@H]1CCCN1CC(F)F	ZINC000875028728	EC	On-Demand	Anodyne	FKBP1A	15	41
O=C(NCCc1cccnc1)C(=O)NC[C@H]1CCCN1CC(F)F	ZINC000875028728	EC	On-Demand	Anodyne	CHRNA7	47	38
O=C(NCCc1cccnc1)C(=O)NC[C@H]1CCCN1CC(F)F	ZINC000875028728	EC	On-Demand	Anodyne	C3AR1	44	42
O=C(NCCc1cccnc1)C(=O)NC[C@H]1CCCN1CC(F)F	ZINC000875028728	EC	On-Demand	Anodyne	NAMPT	32	41
O=C(NCCc1cccnc1)C(=O)NC[C@@H]1CCCN1CC(F)F	ZINC000875028729	EC	On-Demand	Anodyne	FKBP1A	15	41
O=C(NCCc1cccnc1)C(=O)NC[C@@H]1CCCN1CC(F)F	ZINC000875028729	EC	On-Demand	Anodyne	CHRNA7	47	38
O=C(NCCc1cccnc1)C(=O)NC[C@@H]1CCCN1CC(F)F	ZINC000875028729	EC	On-Demand	Anodyne	C3AR1	44	42
O=C(NCCc1cccnc1)C(=O)NC[C@@H]1CCCN1CC(F)F	ZINC000875028729	EC	On-Demand	Anodyne	NAMPT	32	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCOc2ccccc2)C1	ZINC000875028744	EE	On-Demand	Anodyne	ACE	17	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCOc2ccccc2)C1	ZINC000875028744	EE	On-Demand	Anodyne	LTA4H	31	43
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCOc2ccccc2)C1	ZINC000875028744	EE	On-Demand	Anodyne	PLA2G4B	53	32
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCOc2ccccc2)C1	ZINC000875028744	EE	On-Demand	Anodyne	FAAH	25	43
O=C(NC1CCN(C(=O)C2CC2)CC1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875028745	GD	On-Demand	Anodyne	SFRP1	72	36
O=C(NC1CCN(C(=O)C2CC2)CC1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875028745	GD	On-Demand	Anodyne	WNT3	73	36
O=C(NC1CCN(C(=O)C2CC2)CC1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875028746	GD	On-Demand	Anodyne	SFRP1	72	36
O=C(NC1CCN(C(=O)C2CC2)CC1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875028746	GD	On-Demand	Anodyne	WNT3	73	36
O=C(NC1CCN(C(=O)C2CC2)CC1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875028747	GD	On-Demand	Anodyne	SFRP1	72	36
O=C(NC1CCN(C(=O)C2CC2)CC1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875028747	GD	On-Demand	Anodyne	WNT3	73	36
O=C(NC1CCN(C(=O)C2CC2)CC1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875028748	GD	On-Demand	Anodyne	SFRP1	72	36
O=C(NC1CCN(C(=O)C2CC2)CC1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875028748	GD	On-Demand	Anodyne	WNT3	73	36
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(C(=O)c3ccoc3)CC2)C1	ZINC000875028754	GC	On-Demand	Anodyne	L3MBTL3	59	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(C(=O)c3ccoc3)CC2)C1	ZINC000875028755	GC	On-Demand	Anodyne	L3MBTL3	59	37
O=C(NCCc1cccnc1)C(=O)N[C@@H]1CCCn2nccc21	ZINC000875028756	DC	On-Demand	Anodyne	FKBP1A	15	41
O=C(NCCc1cccnc1)C(=O)N[C@@H]1CCCn2nccc21	ZINC000875028756	DC	On-Demand	Anodyne	CHRNA7	49	38
O=C(NCCc1cccnc1)C(=O)N[C@@H]1CCCn2nccc21	ZINC000875028756	DC	On-Demand	Anodyne	C3AR1	41	41
O=C(NCCc1cccnc1)C(=O)N[C@@H]1CCCn2nccc21	ZINC000875028756	DC	On-Demand	Anodyne	NAMPT	35	44
O=C(NCCc1cccnc1)C(=O)N[C@H]1CCCn2nccc21	ZINC000875028757	DC	On-Demand	Anodyne	FKBP1A	15	41
O=C(NCCc1cccnc1)C(=O)N[C@H]1CCCn2nccc21	ZINC000875028757	DC	On-Demand	Anodyne	CHRNA7	49	38
O=C(NCCc1cccnc1)C(=O)N[C@H]1CCCn2nccc21	ZINC000875028757	DC	On-Demand	Anodyne	C3AR1	41	41
O=C(NCCc1cccnc1)C(=O)N[C@H]1CCCn2nccc21	ZINC000875028757	DC	On-Demand	Anodyne	NAMPT	35	44
O=C(NCCc1cccnc1)C(=O)NCC(C1CCC1)C1CCC1	ZINC000875028762	EE	On-Demand	Anodyne	ADRB3	49	39
O=C(NCCc1cccnc1)C(=O)NCC(C1CCC1)C1CCC1	ZINC000875028762	EE	On-Demand	Anodyne	PTAFR	32	41
O=C(NCCc1cccnc1)C(=O)NCC(C1CCC1)C1CCC1	ZINC000875028762	EE	On-Demand	Anodyne	CHRNA7	44	35
O=C(NCCc1cccnc1)C(=O)NCC(C1CCC1)C1CCC1	ZINC000875028762	EE	On-Demand	Anodyne	C3AR1	44	45
O=C(NCCc1cccnc1)C(=O)NCC(C1CCC1)C1CCC1	ZINC000875028762	EE	On-Demand	Anodyne	NAMPT	37	42
CN1CCN(C2CCN(C(=O)NCCOc3ccc4ccccc4c3)CC2)CC1	ZINC000875028763	GF	On-Demand	Anodyne	PPARG	18	41
CN1CCN(C2CCN(C(=O)NCCOc3ccc4ccccc4c3)CC2)CC1	ZINC000875028763	GF	On-Demand	Anodyne	HRH3	37	44
CN1CCN(C2CCN(C(=O)NCCOc3ccc4ccccc4c3)CC2)CC1	ZINC000875028763	GF	On-Demand	Anodyne	L3MBTL3	64	39
CC1(C)[C@@H](c2ccc(F)cc2)CCN1C(=O)C(=O)NCCc1cccnc1	ZINC000875028766	FF	On-Demand	Anodyne	CHRNA7	49	42
CC1(C)[C@@H](c2ccc(F)cc2)CCN1C(=O)C(=O)NCCc1cccnc1	ZINC000875028766	FF	On-Demand	Anodyne	C3AR1	35	41
CC1(C)[C@@H](c2ccc(F)cc2)CCN1C(=O)C(=O)NCCc1cccnc1	ZINC000875028766	FF	On-Demand	Anodyne	SCD1	16	42
CC1(C)[C@@H](c2ccc(F)cc2)CCN1C(=O)C(=O)NCCc1cccnc1	ZINC000875028766	FF	On-Demand	Anodyne	SCD	20	42
CC1(C)[C@@H](c2ccc(F)cc2)CCN1C(=O)C(=O)NCCc1cccnc1	ZINC000875028766	FF	On-Demand	Anodyne	NAMPT	41	38
O=C(NCCc1cccnc1)C(=O)NCC[C@@H]1CCCOC1	ZINC000875028770	DC	On-Demand	Anodyne	CHRNA7	41	35
O=C(NCCc1cccnc1)C(=O)NCC[C@@H]1CCCOC1	ZINC000875028770	DC	On-Demand	Anodyne	NAMPT	37	40
O=C(NCCc1cccnc1)C(=O)NCC[C@H]1CCCOC1	ZINC000875028771	DC	On-Demand	Anodyne	CHRNA7	41	35
O=C(NCCc1cccnc1)C(=O)NCC[C@H]1CCCOC1	ZINC000875028771	DC	On-Demand	Anodyne	NAMPT	37	40
O=C(NCCc1cccnc1)C(=O)N[C@H]1CCCc2ccc(Cl)cc21	ZINC000875028781	FF	On-Demand	Anodyne	C3AR1	37	42
O=C(NCCc1cccnc1)C(=O)N[C@@H]1CCCc2ccc(Cl)cc21	ZINC000875028782	FF	On-Demand	Anodyne	C3AR1	37	42
CONC(=O)C1CCN(C(=O)NCCOc2ccc3ccccc3c2)CC1	ZINC000875028789	FE	On-Demand	Anodyne	PPARG	15	43
CONC(=O)C1CCN(C(=O)NCCOc2ccc3ccccc3c2)CC1	ZINC000875028789	FE	On-Demand	Anodyne	MTNR1A	41	44
CONC(=O)C1CCN(C(=O)NCCOc2ccc3ccccc3c2)CC1	ZINC000875028789	FE	On-Demand	Anodyne	MTNR1B	30	44
CONC(=O)C1CCN(C(=O)NCCOc2ccc3ccccc3c2)CC1	ZINC000875028789	FE	On-Demand	Anodyne	EPHX2	25	44
CCCCCCCNC(=O)C(=O)NCCc1cccnc1	ZINC000875028791	CD	On-Demand	Mild	INHA	51	40
CCCCCCCNC(=O)C(=O)NCCc1cccnc1	ZINC000875028791	CD	On-Demand	Mild	ADRB3	34	45
CCCCCCCNC(=O)C(=O)NCCc1cccnc1	ZINC000875028791	CD	On-Demand	Mild	TBXAS1	66	49
CCCCCCCNC(=O)C(=O)NCCc1cccnc1	ZINC000875028791	CD	On-Demand	Mild	PTAFR	42	52
CCCCCCCNC(=O)C(=O)NCCc1cccnc1	ZINC000875028791	CD	On-Demand	Mild	FAAH	30	58
CCCCCCCNC(=O)C(=O)NCCc1cccnc1	ZINC000875028791	CD	On-Demand	Mild	ASAH1	90	36
CCCCCCCNC(=O)C(=O)NCCc1cccnc1	ZINC000875028791	CD	On-Demand	Mild	NAMPT	42	44
O=C(NCCc1cccnc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875028792	ED	On-Demand	Anodyne	CHRNA7	46	38
O=C(NCCc1cccnc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875028792	ED	On-Demand	Anodyne	C3AR1	43	43
O=C(NCCc1cccnc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875028792	ED	On-Demand	Anodyne	SCD	16	42
O=C(NCCc1cccnc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875028792	ED	On-Demand	Anodyne	NAMPT	39	42
O=C(NCCc1cccnc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875028793	ED	On-Demand	Anodyne	CHRNA7	46	38
O=C(NCCc1cccnc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875028793	ED	On-Demand	Anodyne	C3AR1	43	43
O=C(NCCc1cccnc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875028793	ED	On-Demand	Anodyne	SCD	16	42
O=C(NCCc1cccnc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875028793	ED	On-Demand	Anodyne	NAMPT	39	42
COc1ccc([C@@H]2CN(C(=O)C(=O)NCCc3cccnc3)CCO2)cc1	ZINC000875028795	FD	On-Demand	Anodyne	TBXAS1	15	40
COc1ccc([C@@H]2CN(C(=O)C(=O)NCCc3cccnc3)CCO2)cc1	ZINC000875028795	FD	On-Demand	Anodyne	PTAFR	33	40
COc1ccc([C@@H]2CN(C(=O)C(=O)NCCc3cccnc3)CCO2)cc1	ZINC000875028795	FD	On-Demand	Anodyne	CHRNA7	39	42
COc1ccc([C@@H]2CN(C(=O)C(=O)NCCc3cccnc3)CCO2)cc1	ZINC000875028795	FD	On-Demand	Anodyne	C3AR1	32	43
N#C[C@@]1(C(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)CCCOC1	ZINC000875028799	GF	On-Demand	Mild	LPL	47	37
N#C[C@@]1(C(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)CCCOC1	ZINC000875028799	GF	On-Demand	Mild	TGM2	58	42
N#C[C@@]1(C(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)CCCOC1	ZINC000875028799	GF	On-Demand	Mild	F13A1	80	47
N#C[C@@]1(C(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)CCCOC1	ZINC000875028799	GF	On-Demand	Mild	NAMPT	44	49
N#C[C@]1(C(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)CCCOC1	ZINC000875028800	GF	On-Demand	Mild	LPL	47	37
N#C[C@]1(C(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)CCCOC1	ZINC000875028800	GF	On-Demand	Mild	TGM2	58	42
N#C[C@]1(C(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)CCCOC1	ZINC000875028800	GF	On-Demand	Mild	F13A1	80	47
N#C[C@]1(C(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)CCCOC1	ZINC000875028800	GF	On-Demand	Mild	NAMPT	44	49
O=C(NCCc1cccnc1)C(=O)N1CCO[C@H](CCF)C1	ZINC000875028811	DC	On-Demand	Anodyne	CHRNA7	41	34
O=C(NCCc1cccnc1)C(=O)N1CCO[C@@H](CCF)C1	ZINC000875028812	DC	On-Demand	Anodyne	CHRNA7	41	34
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCc1cscn1)CC2	ZINC000875028813	GD	On-Demand	Anodyne	SLC18A2	45	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCc1cscn1)CC2	ZINC000875028814	GD	On-Demand	Anodyne	SLC18A2	45	34
COC(=O)C1(O)CN(C(=O)NCCOc2ccc3ccccc3c2)C1	ZINC000875028825	ED	On-Demand	Anodyne	MTNR1A	43	40
COC(=O)C1(O)CN(C(=O)NCCOc2ccc3ccccc3c2)C1	ZINC000875028825	ED	On-Demand	Anodyne	MTNR1B	28	40
O=C(NCCc1cccnc1)C(=O)NC[C@@H]1CC[C@H]2C[C@@H]2C1	ZINC000875028836	DD	On-Demand	Anodyne	TBXAS1	33	40
O=C(NCCc1cccnc1)C(=O)NC[C@@H]1CC[C@H]2C[C@@H]2C1	ZINC000875028836	DD	On-Demand	Anodyne	CHRNA7	47	37
O=C(NCCc1cccnc1)C(=O)NC[C@@H]1CC[C@H]2C[C@@H]2C1	ZINC000875028836	DD	On-Demand	Anodyne	NAMPT	39	41
O=C(NCCc1cccnc1)C(=O)NC[C@@H]1CC[C@@H]2C[C@@H]2C1	ZINC000875028837	DD	On-Demand	Anodyne	TBXAS1	33	40
O=C(NCCc1cccnc1)C(=O)NC[C@@H]1CC[C@@H]2C[C@@H]2C1	ZINC000875028837	DD	On-Demand	Anodyne	CHRNA7	47	37
O=C(NCCc1cccnc1)C(=O)NC[C@@H]1CC[C@@H]2C[C@@H]2C1	ZINC000875028837	DD	On-Demand	Anodyne	NAMPT	39	41
O=C(NCCc1cccnc1)C(=O)NC[C@@H]1CC[C@H]2C[C@H]2C1	ZINC000875028838	DD	On-Demand	Anodyne	TBXAS1	33	40
O=C(NCCc1cccnc1)C(=O)NC[C@@H]1CC[C@H]2C[C@H]2C1	ZINC000875028838	DD	On-Demand	Anodyne	CHRNA7	47	37
O=C(NCCc1cccnc1)C(=O)NC[C@@H]1CC[C@H]2C[C@H]2C1	ZINC000875028838	DD	On-Demand	Anodyne	NAMPT	39	41
O=C(NCCc1cccnc1)C(=O)NC[C@@H]1CC[C@@H]2C[C@H]2C1	ZINC000875028839	DD	On-Demand	Anodyne	TBXAS1	33	40
O=C(NCCc1cccnc1)C(=O)NC[C@@H]1CC[C@@H]2C[C@H]2C1	ZINC000875028839	DD	On-Demand	Anodyne	CHRNA7	47	37
O=C(NCCc1cccnc1)C(=O)NC[C@@H]1CC[C@@H]2C[C@H]2C1	ZINC000875028839	DD	On-Demand	Anodyne	NAMPT	39	41
O=C(NCCc1cccnc1)C(=O)N1CCc2nc(C3CC3)ncc2C1	ZINC000875028843	FC	On-Demand	Anodyne	CHRNA7	40	33
O=C(NCCc1cccnc1)C(=O)N1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000875028847	GF	On-Demand	Anodyne	TBXAS1	38	42
O=C(NCCc1cccnc1)C(=O)N1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000875028847	GF	On-Demand	Anodyne	PTAFR	21	40
O=C(NCCc1cccnc1)C(=O)N1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000875028847	GF	On-Demand	Anodyne	CHRNA7	47	40
O=C(NCCc1cccnc1)C(=O)N1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000875028847	GF	On-Demand	Anodyne	ACHP_LYMST	29	40
O=C(NCCc1cccnc1)C(=O)NCc1ccnc(N2CCSCC2)c1	ZINC000875028850	GD	On-Demand	Anodyne	NAMPT	49	41
N#CCCN1CCN(C(=O)C(=O)NCCc2cccnc2)CC1	ZINC000875028855	DB	On-Demand	Mild	PTAFR	29	43
N#CCCN1CCN(C(=O)C(=O)NCCc2cccnc2)CC1	ZINC000875028855	DB	On-Demand	Mild	CHRNA7	46	38
N#CCCN1CCN(C(=O)C(=O)NCCc2cccnc2)CC1	ZINC000875028855	DB	On-Demand	Mild	NAMPT	32	41
O=C(NC1CCN(C(=O)C2CC2)CC1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875028869	GD	On-Demand	Anodyne	OXTR	47	35
O=C(NC1CCN(C(=O)C2CC2)CC1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875028870	GD	On-Demand	Anodyne	OXTR	47	35
CCCCCCCNC(=O)C(=O)NC1CCN(C(=O)c2ccoc2)CC1	ZINC000875028875	FE	On-Demand	Mild	EPHX2	25	48
CCCCCCCNC(=O)C(=O)NC1CCN(C(=O)c2ccoc2)CC1	ZINC000875028875	FE	On-Demand	Mild	ASAH1	61	33
O=C(NC1CCN(C(=O)c2ccoc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875028894	ED	On-Demand	Anodyne	L3MBTL3	50	33
O=C(NC1CCN(C(=O)c2ccoc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875028895	ED	On-Demand	Anodyne	L3MBTL3	50	33
CC1(C)CCC[C@H]1CCNC(=O)C(=O)NCCc1cccnc1	ZINC000875028916	DE	On-Demand	Anodyne	CHRNA7	42	36
CC1(C)CCC[C@H]1CCNC(=O)C(=O)NCCc1cccnc1	ZINC000875028916	DE	On-Demand	Anodyne	C3AR1	36	40
CC1(C)CCC[C@H]1CCNC(=O)C(=O)NCCc1cccnc1	ZINC000875028916	DE	On-Demand	Anodyne	NAMPT	41	40
CN1CC[C@H]2CN(C(=O)C(=O)NCCc3cccnc3)CC[C@@H]21	ZINC000875028921	DC	On-Demand	Anodyne	FKBP1A	15	40
CN1CC[C@H]2CN(C(=O)C(=O)NCCc3cccnc3)CC[C@@H]21	ZINC000875028921	DC	On-Demand	Anodyne	CHRNA7	51	41
CN1CC[C@H]2CN(C(=O)C(=O)NCCc3cccnc3)CC[C@@H]21	ZINC000875028921	DC	On-Demand	Anodyne	ACHP_LYMST	27	41
CN1CC[C@H]2CN(C(=O)C(=O)NCCc3cccnc3)CC[C@@H]21	ZINC000875028921	DC	On-Demand	Anodyne	NAMPT	48	43
CN1CC[C@H]2CN(C(=O)C(=O)NCCc3cccnc3)CC[C@H]21	ZINC000875028923	DC	On-Demand	Anodyne	FKBP1A	15	40
CN1CC[C@H]2CN(C(=O)C(=O)NCCc3cccnc3)CC[C@H]21	ZINC000875028923	DC	On-Demand	Anodyne	CHRNA7	51	41
CN1CC[C@H]2CN(C(=O)C(=O)NCCc3cccnc3)CC[C@H]21	ZINC000875028923	DC	On-Demand	Anodyne	ACHP_LYMST	27	41
CN1CC[C@H]2CN(C(=O)C(=O)NCCc3cccnc3)CC[C@H]21	ZINC000875028923	DC	On-Demand	Anodyne	NAMPT	48	43
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)C(=O)NCCc1cccnc1	ZINC000875028924	DC	On-Demand	Anodyne	CHRNA7	45	36
C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)C(=O)NCCc1cccnc1	ZINC000875028925	DC	On-Demand	Anodyne	CHRNA7	45	36
C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)C(=O)NCCc1cccnc1	ZINC000875028926	DC	On-Demand	Anodyne	CHRNA7	45	36
CCC(F)(F)C(C)(C)CNC(=O)C(=O)NCCc1cccnc1	ZINC000875028928	ED	On-Demand	Anodyne	TBXAS1	41	39
CCC(F)(F)C(C)(C)CNC(=O)C(=O)NCCc1cccnc1	ZINC000875028928	ED	On-Demand	Anodyne	PTAFR	30	40
O=C(NCCc1cccnc1)C(=O)NCc1csc(C(F)(F)F)c1	ZINC000875028936	FE	On-Demand	Anodyne	NAMPT	43	36
COC(=O)N(C)NC(=O)NCCOc1ccc2ccccc2c1	ZINC000875028952	DE	On-Demand	Reactive	MTNR1A	68	44
COC(=O)N(C)NC(=O)NCCOc1ccc2ccccc2c1	ZINC000875028952	DE	On-Demand	Reactive	MTNR1B	47	44
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCN(C(=O)C2CC2)CC1	ZINC000875028957	GE	On-Demand	Anodyne	FKBP1A	27	45
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCN(C(=O)C2CC2)CC1	ZINC000875028957	GE	On-Demand	Anodyne	DRD4	19	46
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCN(C(=O)C2CC2)CC1	ZINC000875028957	GE	On-Demand	Anodyne	SIGMAR1	33	44
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCN(C(=O)C2CC2)CC1	ZINC000875028957	GE	On-Demand	Anodyne	PREP	58	43
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCN(C(=O)C2CC2)CC1	ZINC000875028957	GE	On-Demand	Anodyne	MTNR1A	19	43
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCN(C(=O)C2CC2)CC1	ZINC000875028957	GE	On-Demand	Anodyne	MTNR1B	20	43
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCN(C(=O)C2CC2)CC1	ZINC000875028957	GE	On-Demand	Anodyne	FAAH	34	44
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCN(C(=O)C2CC2)CC1	ZINC000875028957	GE	On-Demand	Anodyne	EPHX2	31	42
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCN(C(=O)C2CC2)CC1	ZINC000875028957	GE	On-Demand	Anodyne	TGM2	30	41
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCN(C(=O)C2CC2)CC1	ZINC000875028957	GE	On-Demand	Anodyne	AMP1_PLAFQ	23	44
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CN(C(=O)C(=O)NCCc1cccnc1)C2	ZINC000875028958	GD	On-Demand	Anodyne	FKBP1A	15	41
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CN(C(=O)C(=O)NCCc1cccnc1)C2	ZINC000875028958	GD	On-Demand	Anodyne	GPR119	25	43
O=C(NCCc1cccnc1)C(=O)NCC[C@@H]1CCSC1	ZINC000875028971	DC	On-Demand	Anodyne	CHRNA7	42	36
O=C(NCCc1cccnc1)C(=O)NCC[C@H]1CCSC1	ZINC000875028972	DC	On-Demand	Anodyne	CHRNA7	42	36
O=C(NCCc1cccnc1)C(=O)NCC1(c2cccc(Cl)c2)CCC1	ZINC000875028983	FF	On-Demand	Anodyne	PTAFR	15	43
O=C(NCCc1cccnc1)C(=O)NCC1(c2cccc(Cl)c2)CCC1	ZINC000875028983	FF	On-Demand	Anodyne	CHRNA7	21	40
O=C(NCCc1cccnc1)C(=O)NC[C@@H]1CCN1C1CCCC1	ZINC000875028988	EC	On-Demand	Anodyne	FKBP1A	17	40
O=C(NCCc1cccnc1)C(=O)NC[C@@H]1CCN1C1CCCC1	ZINC000875028988	EC	On-Demand	Anodyne	TBXAS1	25	41
O=C(NCCc1cccnc1)C(=O)NC[C@@H]1CCN1C1CCCC1	ZINC000875028988	EC	On-Demand	Anodyne	CHRNA7	48	37
O=C(NCCc1cccnc1)C(=O)NC[C@@H]1CCN1C1CCCC1	ZINC000875028988	EC	On-Demand	Anodyne	C3AR1	41	42
O=C(NCCc1cccnc1)C(=O)NC[C@@H]1CCN1C1CCCC1	ZINC000875028988	EC	On-Demand	Anodyne	NAMPT	38	43
O=C(NCCc1cccnc1)C(=O)NC[C@H]1CCN1C1CCCC1	ZINC000875028989	EC	On-Demand	Anodyne	FKBP1A	17	40
O=C(NCCc1cccnc1)C(=O)NC[C@H]1CCN1C1CCCC1	ZINC000875028989	EC	On-Demand	Anodyne	TBXAS1	25	41
O=C(NCCc1cccnc1)C(=O)NC[C@H]1CCN1C1CCCC1	ZINC000875028989	EC	On-Demand	Anodyne	CHRNA7	48	37
O=C(NCCc1cccnc1)C(=O)NC[C@H]1CCN1C1CCCC1	ZINC000875028989	EC	On-Demand	Anodyne	C3AR1	41	42
O=C(NCCc1cccnc1)C(=O)NC[C@H]1CCN1C1CCCC1	ZINC000875028989	EC	On-Demand	Anodyne	NAMPT	38	43
O=C(NCCc1cccnc1)C(=O)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875028990	ED	On-Demand	Anodyne	C3AR1	38	40
O=C(NCCc1cccnc1)C(=O)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875028991	ED	On-Demand	Anodyne	C3AR1	38	40
O=C(NCCc1cccnc1)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875028992	ED	On-Demand	Anodyne	C3AR1	38	40
O=C(NCCc1cccnc1)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875028993	ED	On-Demand	Anodyne	C3AR1	38	40
O=C(NCCc1cccnc1)C(=O)N1CCCC2(CC1)CC2	ZINC000875028999	DD	On-Demand	Anodyne	NAMPT	39	44
CCC1(N2CCOCC2)CCN(C(=O)C(=O)NCCc2cccnc2)CC1	ZINC000875029000	FC	On-Demand	Anodyne	NAMPT	41	40
O=C(NCCc1cccnc1)C(=O)N1CCc2cccc(C(F)(F)F)c2C1	ZINC000875029004	GE	On-Demand	Anodyne	P2RX7	15	45
O=C(NCCc1cccnc1)C(=O)N1CCc2cccc(C(F)(F)F)c2C1	ZINC000875029004	GE	On-Demand	Anodyne	SCD1	15	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(F)c(F)c2)C1	ZINC000875029007	DD	On-Demand	Anodyne	DPP7	44	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(F)c(F)c2)C1	ZINC000875029009	DD	On-Demand	Anodyne	DPP7	44	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(Br)cc2)C1	ZINC000875029015	FD	On-Demand	Anodyne	DPP7	49	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(Br)cc2)C1	ZINC000875029016	FD	On-Demand	Anodyne	DPP7	49	34
O=C(NCCc1cccnc1)C(=O)N1CC[C@@H](Oc2cccc(Cl)c2)C1	ZINC000875029021	FE	On-Demand	Anodyne	CHRNA7	46	42
O=C(NCCc1cccnc1)C(=O)N1CC[C@@H](Oc2cccc(Cl)c2)C1	ZINC000875029021	FE	On-Demand	Anodyne	C3AR1	38	42
COCC(C)(C)CCNC(=O)C(=O)NCCc1ccccc1Cl	ZINC000875029024	EE	On-Demand	Anodyne	ECR	40	32
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029026	GE	On-Demand	Anodyne	CCR2	17	40
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029026	GE	On-Demand	Anodyne	EPHX2	43	45
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029026	GE	On-Demand	Anodyne	SFRP1	102	42
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029026	GE	On-Demand	Anodyne	WNT3	61	34
O=C(NC[C@H]1CC(C(F)(F)F)=NO1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029028	GE	On-Demand	Anodyne	CCR2	17	40
O=C(NC[C@H]1CC(C(F)(F)F)=NO1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029028	GE	On-Demand	Anodyne	EPHX2	43	45
O=C(NC[C@H]1CC(C(F)(F)F)=NO1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029028	GE	On-Demand	Anodyne	SFRP1	102	42
O=C(NC[C@H]1CC(C(F)(F)F)=NO1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029028	GE	On-Demand	Anodyne	WNT3	61	34
CCC[C@@H](CNC(=O)C(=O)NCCc1cccnc1)OCC	ZINC000875029036	DD	On-Demand	Anodyne	PTAFR	35	41
CCC[C@H](CNC(=O)C(=O)NCCc1cccnc1)OCC	ZINC000875029038	DD	On-Demand	Anodyne	PTAFR	35	41
C=CC(C)(C)CCCNC(=O)C(=O)NCc1cc(OC)ccc1OC	ZINC000875029040	EE	On-Demand	Mild	MTNR1A	40	42
C=CC(C)(C)CCCNC(=O)C(=O)NCc1cc(OC)ccc1OC	ZINC000875029040	EE	On-Demand	Mild	MTNR1B	32	50
C=CC(C)(C)CCCNC(=O)C(=O)NCc1cc(OC)ccc1OC	ZINC000875029040	EE	On-Demand	Mild	MT-ND1	23	50
C[C@H](NC(=O)NC1CCN(C(=O)c2ccccc2)CC1)c1cc2cnccc2o1	ZINC000875029045	GG	On-Demand	Anodyne	EPHX2	27	44
C[C@@H](NC(=O)NC1CCN(C(=O)c2ccccc2)CC1)c1cc2cnccc2o1	ZINC000875029047	GG	On-Demand	Anodyne	EPHX2	27	44
C/C=C/C[C@H]1CCCN(C(=O)C(=O)NCCc2cccnc2)C1	ZINC000875029048	DD	On-Demand	Anodyne	CHRNA7	42	35
C/C=C/C[C@H]1CCCN(C(=O)C(=O)NCCc2cccnc2)C1	ZINC000875029048	DD	On-Demand	Anodyne	C3AR1	41	41
C/C=C\C[C@@H]1CCCN(C(=O)C(=O)NCCc2cccnc2)C1	ZINC000875029049	DD	On-Demand	Anodyne	CHRNA7	42	35
C/C=C\C[C@@H]1CCCN(C(=O)C(=O)NCCc2cccnc2)C1	ZINC000875029049	DD	On-Demand	Anodyne	C3AR1	41	41
C/C=C/C[C@@H]1CCCN(C(=O)C(=O)NCCc2cccnc2)C1	ZINC000875029051	DD	On-Demand	Anodyne	CHRNA7	42	35
C/C=C/C[C@@H]1CCCN(C(=O)C(=O)NCCc2cccnc2)C1	ZINC000875029051	DD	On-Demand	Anodyne	C3AR1	41	41
C/C=C\C[C@H]1CCCN(C(=O)C(=O)NCCc2cccnc2)C1	ZINC000875029053	DD	On-Demand	Anodyne	CHRNA7	42	35
C/C=C\C[C@H]1CCCN(C(=O)C(=O)NCCc2cccnc2)C1	ZINC000875029053	DD	On-Demand	Anodyne	C3AR1	41	41
COc1ccc([C@@H]2CCN(C(=O)C(=O)NCCc3cccnc3)C2)cc1F	ZINC000875029056	FD	On-Demand	Anodyne	FKBP1A	24	40
COc1ccc([C@@H]2CCN(C(=O)C(=O)NCCc3cccnc3)C2)cc1F	ZINC000875029056	FD	On-Demand	Anodyne	PTAFR	30	40
COc1ccc([C@@H]2CCN(C(=O)C(=O)NCCc3cccnc3)C2)cc1F	ZINC000875029056	FD	On-Demand	Anodyne	CHRNA7	42	37
COc1ccc([C@@H]2CCN(C(=O)C(=O)NCCc3cccnc3)C2)cc1F	ZINC000875029056	FD	On-Demand	Anodyne	C3AR1	37	40
C#CC[C@H](COC)NC(=O)C(=O)NCc1cc(OC)ccc1OC	ZINC000875029058	EC	On-Demand	Mild	MTNR1B	31	41
C#CC[C@@H](COC)NC(=O)C(=O)NCc1cc(OC)ccc1OC	ZINC000875029060	EC	On-Demand	Mild	MTNR1B	31	41
C#CC[C@@H](CCOC)NC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029062	FE	On-Demand	Mild	EPHX2	32	46
C#CC[C@@H](CCOC)NC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029062	FE	On-Demand	Mild	L3MBTL3	59	32
COc1ccc([C@@H](NC(=O)C(=O)NCCc2cccnc2)C2CC2)cn1	ZINC000875029063	FD	On-Demand	Anodyne	PTAFR	31	40
COc1ccc([C@@H](NC(=O)C(=O)NCCc2cccnc2)C2CC2)cn1	ZINC000875029063	FD	On-Demand	Anodyne	C3AR1	34	41
C#CC[C@H](CCOC)NC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029064	FE	On-Demand	Mild	EPHX2	32	46
C#CC[C@H](CCOC)NC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029064	FE	On-Demand	Mild	L3MBTL3	59	32
COc1ccc([C@H](NC(=O)C(=O)NCCc2cccnc2)C2CC2)cn1	ZINC000875029065	FD	On-Demand	Anodyne	PTAFR	31	40
COc1ccc([C@H](NC(=O)C(=O)NCCc2cccnc2)C2CC2)cn1	ZINC000875029065	FD	On-Demand	Anodyne	C3AR1	34	41
O=C(NCc1ccnc(F)c1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029066	FE	On-Demand	Anodyne	CCR3	31	41
O=C(NCc1ccnc(F)c1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029066	FE	On-Demand	Anodyne	EPHX2	53	50
O=C(NCc1ccnc(F)c1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029066	FE	On-Demand	Anodyne	L3MBTL3	42	35
O=C(NCCCCC1CC1)C(=O)NCc1ccccc1C(F)(F)F	ZINC000875029068	EG	On-Demand	Anodyne	P2RX7	42	41
O=C(NCCCCC1CC1)C(=O)NCc1ccccc1C(F)(F)F	ZINC000875029068	EG	On-Demand	Anodyne	RBP4	40	34
O=C(NCCCCC1CC1)C(=O)NCc1ccccc1C(F)(F)F	ZINC000875029068	EG	On-Demand	Anodyne	SCD	15	47
O=C(CN1C(=O)c2ccccc2S1(=O)=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875029072	IF	On-Demand	Anodyne	SCD	30	44
C#CC[C@@H](COC)NC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029077	ED	On-Demand	Mild	EPHX2	33	47
C#CC[C@@H](COC)NC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029077	ED	On-Demand	Mild	SFRP1	40	37
C#CC[C@@H](COC)NC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029077	ED	On-Demand	Mild	L3MBTL3	58	33
C#CC[C@H](COC)NC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029078	ED	On-Demand	Mild	EPHX2	33	47
C#CC[C@H](COC)NC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029078	ED	On-Demand	Mild	SFRP1	40	37
C#CC[C@H](COC)NC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029078	ED	On-Demand	Mild	L3MBTL3	58	33
O=C(NCC1CCC2(CC1)CC2)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029095	FH	On-Demand	Anodyne	GRIN2B	47	34
O=C(NCC1CCC2(CC1)CC2)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029095	FH	On-Demand	Anodyne	EPHX2	52	57
O=C(NCC1CCC2(CC1)CC2)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029095	FH	On-Demand	Anodyne	L3MBTL3	57	34
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCc1cccnc1	ZINC000875029099	DC	On-Demand	Mild	PTAFR	36	40
C#CC[C@H](CCOC)NC(=O)C(=O)NCCc1cccnc1	ZINC000875029101	DC	On-Demand	Mild	PTAFR	36	40
O=C(NCCc1cccnc1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875029102	CD	On-Demand	Anodyne	TBXAS1	40	40
O=C(NCCc1cccnc1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875029102	CD	On-Demand	Anodyne	CHRNA7	47	37
O=C(NCCc1cccnc1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875029102	CD	On-Demand	Anodyne	NAMPT	39	44
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@@H](C(F)(F)F)O[C@H](C)C1	ZINC000875029114	GE	On-Demand	Anodyne	HCN1	48	33
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@@H](C(F)(F)F)O[C@H](C)C1	ZINC000875029114	GE	On-Demand	Anodyne	HCN4	42	33
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@H](C(F)(F)F)O[C@H](C)C1	ZINC000875029115	GE	On-Demand	Anodyne	HCN1	48	33
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@H](C(F)(F)F)O[C@H](C)C1	ZINC000875029115	GE	On-Demand	Anodyne	HCN4	42	33
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@H](C(F)(F)F)O[C@@H](C)C1	ZINC000875029117	GE	On-Demand	Anodyne	HCN1	48	33
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@H](C(F)(F)F)O[C@@H](C)C1	ZINC000875029117	GE	On-Demand	Anodyne	HCN4	42	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCOc1ccccc1	ZINC000875029118	EE	On-Demand	Anodyne	SLC6A4	28	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCOc1ccccc1	ZINC000875029118	EE	On-Demand	Anodyne	SLC6A3	58	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCOc1ccccc1	ZINC000875029118	EE	On-Demand	Anodyne	LTA4H	23	45
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@@H](C(F)(F)F)O[C@@H](C)C1	ZINC000875029119	GE	On-Demand	Anodyne	HCN1	48	33
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@@H](C(F)(F)F)O[C@@H](C)C1	ZINC000875029119	GE	On-Demand	Anodyne	HCN4	42	33
C=CC(C)(C)CCNC(=O)C(=O)NCCc1cccnc1	ZINC000875029120	CD	On-Demand	Mild	TBXAS1	60	39
C=CC(C)(C)CCNC(=O)C(=O)NCCc1cccnc1	ZINC000875029120	CD	On-Demand	Mild	PTAFR	29	44
CO[C@H]1CCN([C@@H]2CCC[C@@H]2NC(=O)C(=O)NCCc2cccnc2)C1	ZINC000875029129	FC	On-Demand	Anodyne	CHRNA7	48	40
CO[C@H]1CCN([C@@H]2CCC[C@@H]2NC(=O)C(=O)NCCc2cccnc2)C1	ZINC000875029129	FC	On-Demand	Anodyne	ACHP_LYMST	24	40
O=C(NCc1noc2cc(F)ccc12)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029147	GG	On-Demand	Anodyne	CCR3	23	41
O=C(NCc1noc2cc(F)ccc12)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029147	GG	On-Demand	Anodyne	EPHX2	30	45
COCC(C)(C)CCNC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029160	FF	On-Demand	Anodyne	DRD4	19	44
COCC(C)(C)CCNC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029160	FF	On-Demand	Anodyne	EPHX2	60	52
COCC(C)(C)CCNC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029160	FF	On-Demand	Anodyne	SFRP1	51	39
COCC(C)(C)CCNC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029160	FF	On-Demand	Anodyne	L3MBTL3	46	32
O=C(NC[C@@H]1C[C@H]2CCC[C@@H]2O1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029167	FF	On-Demand	Anodyne	EPHX2	37	52
O=C(NC[C@@H]1C[C@H]2CCC[C@@H]2O1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029167	FF	On-Demand	Anodyne	L3MBTL3	59	33
O=C(NC[C@@H]1C[C@H]2CCC[C@H]2O1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029168	FF	On-Demand	Anodyne	EPHX2	37	52
O=C(NC[C@@H]1C[C@H]2CCC[C@H]2O1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029168	FF	On-Demand	Anodyne	L3MBTL3	59	33
O=C(NC[C@@H]1C[C@@H]2CCC[C@@H]2O1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029169	FF	On-Demand	Anodyne	EPHX2	37	52
O=C(NC[C@@H]1C[C@@H]2CCC[C@@H]2O1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029169	FF	On-Demand	Anodyne	L3MBTL3	59	33
O=C(NC[C@@H]1C[C@@H]2CCC[C@H]2O1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029170	FF	On-Demand	Anodyne	EPHX2	37	52
O=C(NC[C@@H]1C[C@@H]2CCC[C@H]2O1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029170	FF	On-Demand	Anodyne	L3MBTL3	59	33
COc1ccccc1[C@H]1CN(C(=O)C(=O)NCc2cccc(F)c2)CCO1	ZINC000875029172	FE	On-Demand	Anodyne	DRD4	18	41
COc1ccccc1[C@H]1CN(C(=O)C(=O)NCc2cccc(F)c2)CCO1	ZINC000875029172	FE	On-Demand	Anodyne	CCR3	18	42
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NCc2cccc(F)c2)CCO1	ZINC000875029173	FE	On-Demand	Anodyne	DRD4	18	41
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NCc2cccc(F)c2)CCO1	ZINC000875029173	FE	On-Demand	Anodyne	CCR3	18	42
Cc1ccccc1CN1CCO[C@@H](CNC(=O)C(=O)NCc2cccc(F)c2)C1	ZINC000875029182	GD	On-Demand	Anodyne	DRD4	23	41
Cc1ccccc1CN1CCO[C@@H](CNC(=O)C(=O)NCc2cccc(F)c2)C1	ZINC000875029182	GD	On-Demand	Anodyne	CCR3	28	43
Cn1nc(Cl)c(C(=O)Nc2cc(Cl)ccc2N2CCCCC2)c1Cl	ZINC000875029184	GJ	On-Demand	Anodyne	CNR1	65	40
Cn1nc(Cl)c(C(=O)Nc2cc(Cl)ccc2N2CCCCC2)c1Cl	ZINC000875029184	GJ	On-Demand	Anodyne	DRD1	41	40
Cn1nc(Cl)c(C(=O)Nc2cc(Cl)ccc2N2CCCCC2)c1Cl	ZINC000875029184	GJ	On-Demand	Anodyne	CNR2	20	42
Cn1nc(Cl)c(C(=O)Nc2cc(Cl)ccc2N2CCCCC2)c1Cl	ZINC000875029184	GJ	On-Demand	Anodyne	KCNQ2	68	39
Cn1nc(Cl)c(C(=O)Nc2cc(Cl)ccc2N2CCCCC2)c1Cl	ZINC000875029184	GJ	On-Demand	Anodyne	CSF1R	15	40
Cn1nc(Cl)c(C(=O)Nc2cc(Cl)ccc2N2CCCCC2)c1Cl	ZINC000875029184	GJ	On-Demand	Anodyne	WDR5	35	41
CCOc1ccccc1CNC(=O)C(=O)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875029189	FE	On-Demand	Anodyne	HCN1	40	32
CCOc1ccccc1CNC(=O)C(=O)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875029189	FE	On-Demand	Anodyne	HCN4	40	32
CCOc1ccccc1CNC(=O)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875029190	FE	On-Demand	Anodyne	HCN1	40	32
CCOc1ccccc1CNC(=O)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875029190	FE	On-Demand	Anodyne	HCN4	40	32
CCOc1ccccc1CNC(=O)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875029191	FE	On-Demand	Anodyne	HCN1	40	32
CCOc1ccccc1CNC(=O)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875029191	FE	On-Demand	Anodyne	HCN4	40	32
CCOc1ccccc1CNC(=O)C(=O)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875029192	FE	On-Demand	Anodyne	HCN1	40	32
CCOc1ccccc1CNC(=O)C(=O)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875029192	FE	On-Demand	Anodyne	HCN4	40	32
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1cccc(F)c1)c1nccn1C	ZINC000875029202	GE	On-Demand	Anodyne	SLC6A4	19	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1cccc(F)c1)c1nccn1C	ZINC000875029202	GE	On-Demand	Anodyne	SLC6A3	43	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1cccc(F)c1)c1nccn1C	ZINC000875029203	GE	On-Demand	Anodyne	SLC6A4	19	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1cccc(F)c1)c1nccn1C	ZINC000875029203	GE	On-Demand	Anodyne	SLC6A3	43	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1cccc(F)c1)c1nccn1C	ZINC000875029204	GE	On-Demand	Anodyne	SLC6A4	19	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1cccc(F)c1)c1nccn1C	ZINC000875029204	GE	On-Demand	Anodyne	SLC6A3	43	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1cccc(F)c1)c1nccn1C	ZINC000875029205	GE	On-Demand	Anodyne	SLC6A4	19	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1cccc(F)c1)c1nccn1C	ZINC000875029205	GE	On-Demand	Anodyne	SLC6A3	43	46
CCOc1ccccc1CNC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875029211	ED	On-Demand	Anodyne	EPHX2	17	40
CCOc1ccccc1CNC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875029211	ED	On-Demand	Anodyne	HCN1	55	38
CCOc1ccccc1CNC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875029211	ED	On-Demand	Anodyne	HCN4	46	36
O=C(CCc1nc(O)c2cnn(-c3ccccc3)c2n1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875029212	JI	On-Demand	Anodyne	SCD	26	40
O=C(NCc1ccc(CN2CCNC2=O)cc1)C(=O)NCc1cccc(F)c1	ZINC000875029216	GD	On-Demand	Anodyne	FABP4	17	40
O=C(NCc1cccc(F)c1)C(=O)NCc1nc(C(F)(F)F)n2c1CCCC2	ZINC000875029224	GE	On-Demand	Anodyne	FABP4	29	41
CCOc1ccccc1CNC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875029258	EE	On-Demand	Anodyne	HCN1	49	32
CCOc1ccccc1CNC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875029258	EE	On-Demand	Anodyne	HCN4	42	32
CC(=O)NC[C@@H]1CCCCN1C(=O)NCCCOc1cccc(C)c1	ZINC000875029275	EE	On-Demand	Anodyne	HRH2	52	47
CC(=O)NC[C@@H]1CCCCN1C(=O)NCCCOc1cccc(C)c1	ZINC000875029275	EE	On-Demand	Anodyne	CPT1A	45	36
CC(=O)NC[C@@H]1CCCCN1C(=O)NCCCOc1cccc(C)c1	ZINC000875029275	EE	On-Demand	Anodyne	MTNR1A	33	42
CC(=O)NC[C@@H]1CCCCN1C(=O)NCCCOc1cccc(C)c1	ZINC000875029275	EE	On-Demand	Anodyne	MTNR1B	32	42
CONC(=O)C1CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)CC1	ZINC000875029284	GD	On-Demand	Anodyne	EPHX2	58	61
CONC(=O)C1CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)CC1	ZINC000875029284	GD	On-Demand	Anodyne	SFRP1	42	39
CONC(=O)C1CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)CC1	ZINC000875029284	GD	On-Demand	Anodyne	L3MBTL3	78	37
Cc1cncc([C@@H]2CCCN2C(=O)NC2CCN(C(=O)c3ccccc3)CC2)c1	ZINC000875029286	GH	On-Demand	Anodyne	SSTR5	33	42
Cc1cncc([C@@H]2CCCN2C(=O)NC2CCN(C(=O)c3ccccc3)CC2)c1	ZINC000875029286	GH	On-Demand	Anodyne	PREP	52	39
Cc1cncc([C@@H]2CCCN2C(=O)NC2CCN(C(=O)c3ccccc3)CC2)c1	ZINC000875029286	GH	On-Demand	Anodyne	EPHX2	22	44
Cc1cncc([C@@H]2CCCN2C(=O)NC2CCN(C(=O)c3ccccc3)CC2)c1	ZINC000875029286	GH	On-Demand	Anodyne	SFRP1	67	38
Cc1cncc([C@@H]2CCCN2C(=O)NC2CCN(C(=O)c3ccccc3)CC2)c1	ZINC000875029286	GH	On-Demand	Anodyne	WNT3	56	37
Cc1cncc([C@@H]2CCCN2C(=O)NC2CCN(C(=O)c3ccccc3)CC2)c1	ZINC000875029286	GH	On-Demand	Anodyne	L3MBTL3	52	36
Cc1cncc([C@H]2CCCN2C(=O)NC2CCN(C(=O)c3ccccc3)CC2)c1	ZINC000875029287	GH	On-Demand	Anodyne	SSTR5	33	42
Cc1cncc([C@H]2CCCN2C(=O)NC2CCN(C(=O)c3ccccc3)CC2)c1	ZINC000875029287	GH	On-Demand	Anodyne	PREP	52	39
Cc1cncc([C@H]2CCCN2C(=O)NC2CCN(C(=O)c3ccccc3)CC2)c1	ZINC000875029287	GH	On-Demand	Anodyne	EPHX2	22	44
Cc1cncc([C@H]2CCCN2C(=O)NC2CCN(C(=O)c3ccccc3)CC2)c1	ZINC000875029287	GH	On-Demand	Anodyne	SFRP1	67	38
Cc1cncc([C@H]2CCCN2C(=O)NC2CCN(C(=O)c3ccccc3)CC2)c1	ZINC000875029287	GH	On-Demand	Anodyne	WNT3	56	37
Cc1cncc([C@H]2CCCN2C(=O)NC2CCN(C(=O)c3ccccc3)CC2)c1	ZINC000875029287	GH	On-Demand	Anodyne	L3MBTL3	52	36
CCOc1ccccc1CNC(=O)C(=O)N[C@H](C)c1ccc(C(F)(F)F)nc1	ZINC000875029302	GF	On-Demand	Anodyne	TRPV1	93	36
CCOc1ccccc1CNC(=O)C(=O)N[C@H](C)c1ccc(C(F)(F)F)nc1	ZINC000875029302	GF	On-Demand	Anodyne	CARM1	33	41
CCOc1ccccc1CNC(=O)C(=O)N[C@@H](C)c1ccc(C(F)(F)F)nc1	ZINC000875029303	GF	On-Demand	Anodyne	TRPV1	93	36
CCOc1ccccc1CNC(=O)C(=O)N[C@@H](C)c1ccc(C(F)(F)F)nc1	ZINC000875029303	GF	On-Demand	Anodyne	CARM1	33	41
C[S@](=N)(=O)N1CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)CC1	ZINC000875029305	GD	On-Demand	Anodyne	EPHX2	58	51
C[S@](=N)(=O)N1CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)CC1	ZINC000875029305	GD	On-Demand	Anodyne	CCR8	46	41
C[S@](=N)(=O)N1CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)CC1	ZINC000875029305	GD	On-Demand	Anodyne	SFRP1	101	44
C[S@](=N)(=O)N1CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)CC1	ZINC000875029305	GD	On-Demand	Anodyne	WNT3	64	35
C[S@](=N)(=O)N1CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)CC1	ZINC000875029305	GD	On-Demand	Anodyne	L3MBTL3	69	36
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccccc2C(F)(F)F)C1	ZINC000875029307	FE	On-Demand	Anodyne	P2RX7	48	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccccc2C(F)(F)F)C1	ZINC000875029307	FE	On-Demand	Anodyne	RBP4	75	39
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccccc2C(F)(F)F)C1	ZINC000875029307	FE	On-Demand	Anodyne	SFRP1	97	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccccc2C(F)(F)F)C1	ZINC000875029307	FE	On-Demand	Anodyne	WNT3	71	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccccc2C(F)(F)F)C1	ZINC000875029308	FE	On-Demand	Anodyne	P2RX7	48	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccccc2C(F)(F)F)C1	ZINC000875029308	FE	On-Demand	Anodyne	RBP4	75	39
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccccc2C(F)(F)F)C1	ZINC000875029308	FE	On-Demand	Anodyne	SFRP1	97	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccccc2C(F)(F)F)C1	ZINC000875029308	FE	On-Demand	Anodyne	WNT3	71	33
O=C(c1ccccc1)N1CCC(NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)CC1	ZINC000875029313	GF	On-Demand	Anodyne	EPHX2	31	48
O=C(c1ccccc1)N1CCC(NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)CC1	ZINC000875029313	GF	On-Demand	Anodyne	SFRP1	43	40
O=C(c1ccccc1)N1CCC(NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)CC1	ZINC000875029313	GF	On-Demand	Anodyne	L3MBTL3	69	36
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@@H]1C[C@H]1C1CCOCC1	ZINC000875029314	FE	On-Demand	Anodyne	EPHX2	45	54
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@@H]1C[C@H]1C1CCOCC1	ZINC000875029314	FE	On-Demand	Anodyne	L3MBTL3	56	33
O=C(NCCc1cccnc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875029318	GE	On-Demand	Anodyne	DRD2	25	44
O=C(NCCc1cccnc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875029318	GE	On-Demand	Anodyne	FKBP1A	18	40
O=C(NCCc1cccnc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875029318	GE	On-Demand	Anodyne	DRD4	47	49
O=C(NCCc1cccnc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875029318	GE	On-Demand	Anodyne	ACHE	67	72
O=C(NCCc1cccnc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875029318	GE	On-Demand	Anodyne	HRH1	15	40
O=C(NCCc1cccnc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875029318	GE	On-Demand	Anodyne	DRD3	19	44
O=C(NCCc1cccnc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875029318	GE	On-Demand	Anodyne	CHRM3	16	48
O=C(NCCc1cccnc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875029318	GE	On-Demand	Anodyne	GRIN2B	27	42
O=C(NCCc1cccnc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875029318	GE	On-Demand	Anodyne	ADRB3	18	40
O=C(NCCc1cccnc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875029318	GE	On-Demand	Anodyne	TBXAS1	41	40
O=C(NCCc1cccnc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875029318	GE	On-Demand	Anodyne	PTAFR	26	44
O=C(NCCc1cccnc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875029318	GE	On-Demand	Anodyne	SIGMAR1	63	52
O=C(NCCc1cccnc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875029318	GE	On-Demand	Anodyne	BCHE	18	49
O=C(NCCc1cccnc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875029318	GE	On-Demand	Anodyne	CCR3	34	41
O=C(NCCc1cccnc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875029318	GE	On-Demand	Anodyne	CHRNA7	50	41
O=C(NCCc1cccnc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875029318	GE	On-Demand	Anodyne	C3AR1	40	40
O=C(NCCc1cccnc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875029318	GE	On-Demand	Anodyne	FAAH	26	48
O=C(NCCc1cccnc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875029318	GE	On-Demand	Anodyne	CXCR3	15	43
O=C(NCCc1cccnc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875029318	GE	On-Demand	Anodyne	ACHP_LYMST	24	41
O=C(NCCc1cccnc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875029318	GE	On-Demand	Anodyne	NAMPT	44	43
CCCCCCCNC(=O)C(=O)NC1CCN(C(=O)C2CC2)CC1	ZINC000875029321	ED	On-Demand	Mild	EPHX2	26	61
CCCCCCCNC(=O)C(=O)NC1CCN(C(=O)C2CC2)CC1	ZINC000875029321	ED	On-Demand	Mild	ASAH1	53	33
O=C(NCCCCC1CC1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029322	EG	On-Demand	Anodyne	CCR3	20	41
O=C(NCCCCC1CC1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029322	EG	On-Demand	Anodyne	EPHX2	52	53
O=C(NCCCCC1CC1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029322	EG	On-Demand	Anodyne	L3MBTL3	62	39
C#CC[C@@H](COC)NC(=O)C(=O)NCCc1cc(OC)ccc1OC	ZINC000875029324	EC	On-Demand	Mild	MTNR1A	75	41
C#CC[C@@H](COC)NC(=O)C(=O)NCCc1cc(OC)ccc1OC	ZINC000875029324	EC	On-Demand	Mild	MTNR1B	62	47
C#CC[C@H](COC)NC(=O)C(=O)NCCc1cc(OC)ccc1OC	ZINC000875029326	EC	On-Demand	Mild	MTNR1A	75	41
C#CC[C@H](COC)NC(=O)C(=O)NCCc1cc(OC)ccc1OC	ZINC000875029326	EC	On-Demand	Mild	MTNR1B	62	47
C[C@H](NC(=O)NC1CCN(C(=O)c2ccccc2)CC1)c1ccnn1C	ZINC000875029330	FE	On-Demand	Anodyne	EPHX2	40	49
C[C@H](NC(=O)NC1CCN(C(=O)c2ccccc2)CC1)c1ccnn1C	ZINC000875029330	FE	On-Demand	Anodyne	L3MBTL3	44	35
C[C@@H](NC(=O)NC1CCN(C(=O)c2ccccc2)CC1)c1ccnn1C	ZINC000875029331	FE	On-Demand	Anodyne	EPHX2	40	49
C[C@@H](NC(=O)NC1CCN(C(=O)c2ccccc2)CC1)c1ccnn1C	ZINC000875029331	FE	On-Demand	Anodyne	L3MBTL3	44	35
O=C(Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1)c1cnc2nccn2c1	ZINC000875029348	GF	On-Demand	Anodyne	GSK3B	15	43
O=C(Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1)c1cnc2nccn2c1	ZINC000875029348	GF	On-Demand	Anodyne	GRM4	18	44
O=C(Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1)c1cnc2nccn2c1	ZINC000875029348	GF	On-Demand	Anodyne	TGM2	66	41
O=C(Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1)c1cnc2nccn2c1	ZINC000875029348	GF	On-Demand	Anodyne	F13A1	77	46
O=C(Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1)c1cnc2nccn2c1	ZINC000875029348	GF	On-Demand	Anodyne	NAMPT	65	74
O=C(NCCc1cccnc1)C(=O)NC[C@@H]1CN(Cc2ccncc2)CCO1	ZINC000875029349	GC	On-Demand	Anodyne	CHRNA7	40	34
O=C(NCCc1cccnc1)C(=O)NC[C@H]1CN(Cc2ccncc2)CCO1	ZINC000875029350	GC	On-Demand	Anodyne	CHRNA7	40	34
O=C(NCCSCCC(F)(F)F)C(=O)NC1CCN(C(=O)C2CC2)CC1	ZINC000875029351	GD	On-Demand	Anodyne	EPHX2	19	42
CON=Cc1ccc(C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)cc1	ZINC000875029353	GI	On-Demand	Mild	SCD1	50	53
CON=Cc1ccc(C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)cc1	ZINC000875029353	GI	On-Demand	Mild	SCD	44	63
CC[C@@H](NC(=O)NC1CCN(C(=O)c2ccccc2)CC1)[C@H](O)c1ccccc1	ZINC000875029360	GG	On-Demand	Anodyne	EPHX2	42	50
CC[C@@H](NC(=O)NC1CCN(C(=O)c2ccccc2)CC1)[C@H](O)c1ccccc1	ZINC000875029360	GG	On-Demand	Anodyne	XIAP	42	36
CC[C@@H](NC(=O)NC1CCN(C(=O)c2ccccc2)CC1)[C@H](O)c1ccccc1	ZINC000875029360	GG	On-Demand	Anodyne	L3MBTL3	67	35
CC[C@@H](NC(=O)NC1CCN(C(=O)c2ccccc2)CC1)[C@@H](O)c1ccccc1	ZINC000875029362	GG	On-Demand	Anodyne	EPHX2	42	50
CC[C@@H](NC(=O)NC1CCN(C(=O)c2ccccc2)CC1)[C@@H](O)c1ccccc1	ZINC000875029362	GG	On-Demand	Anodyne	XIAP	42	36
CC[C@@H](NC(=O)NC1CCN(C(=O)c2ccccc2)CC1)[C@@H](O)c1ccccc1	ZINC000875029362	GG	On-Demand	Anodyne	L3MBTL3	67	35
O=C(NCc1ccccc1C(F)(F)F)C(=O)N1CCC(CO)(CO)CC1	ZINC000875029375	FC	On-Demand	Anodyne	P2RX7	42	40
O=C(NCc1ccccc1C(F)(F)F)C(=O)N1CCC(CO)(CO)CC1	ZINC000875029375	FC	On-Demand	Anodyne	RBP4	67	41
O=C(NCCc1cccnc1)C(=O)N[C@H]1CCc2cc(Cl)ccc21	ZINC000875029384	EE	On-Demand	Anodyne	TBXAS1	41	38
O=C(NCCc1cccnc1)C(=O)N[C@H]1CCc2cc(Cl)ccc21	ZINC000875029384	EE	On-Demand	Anodyne	CHRNA7	43	41
O=C(NCCc1cccnc1)C(=O)N[C@H]1CCc2cc(Cl)ccc21	ZINC000875029384	EE	On-Demand	Anodyne	C3AR1	35	42
O=C(NC[C@@H]1C[C@H]1C1CCOCC1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029395	GF	On-Demand	Anodyne	EPHX2	34	50
O=C(NC[C@@H]1C[C@H]1C1CCOCC1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029395	GF	On-Demand	Anodyne	L3MBTL3	47	33
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875029397	FE	On-Demand	Anodyne	SLC6A1	63	35
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875029397	FE	On-Demand	Anodyne	NPY2R	15	41
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875029397	FE	On-Demand	Anodyne	PREP	31	44
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875029397	FE	On-Demand	Anodyne	EPHX2	48	59
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875029397	FE	On-Demand	Anodyne	SFRP1	85	42
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875029397	FE	On-Demand	Anodyne	WNT3	59	35
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875029397	FE	On-Demand	Anodyne	L3MBTL3	94	44
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875029399	FE	On-Demand	Anodyne	SLC6A1	63	35
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875029399	FE	On-Demand	Anodyne	NPY2R	15	41
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875029399	FE	On-Demand	Anodyne	PREP	31	44
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875029399	FE	On-Demand	Anodyne	EPHX2	48	59
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875029399	FE	On-Demand	Anodyne	SFRP1	85	42
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875029399	FE	On-Demand	Anodyne	WNT3	59	35
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875029399	FE	On-Demand	Anodyne	L3MBTL3	94	44
O=C1CCN(C(=O)C(=O)NCCc2ccccc2Cl)CCCCCCN1	ZINC000875029404	GD	On-Demand	Anodyne	DPP7	24	41
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCc3cccnc3)C2)cc1	ZINC000875029422	FD	On-Demand	Anodyne	DRD4	37	48
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCc3cccnc3)C2)cc1	ZINC000875029422	FD	On-Demand	Anodyne	ACHE	18	43
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCc3cccnc3)C2)cc1	ZINC000875029422	FD	On-Demand	Anodyne	LTA4H	15	40
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCc3cccnc3)C2)cc1	ZINC000875029422	FD	On-Demand	Anodyne	PTAFR	23	42
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCc3cccnc3)C2)cc1	ZINC000875029422	FD	On-Demand	Anodyne	SIGMAR1	24	43
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCc3cccnc3)C2)cc1	ZINC000875029422	FD	On-Demand	Anodyne	SSTR5	45	38
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCc3cccnc3)C2)cc1	ZINC000875029422	FD	On-Demand	Anodyne	CCR3	29	40
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCc3cccnc3)C2)cc1	ZINC000875029422	FD	On-Demand	Anodyne	CHRNA7	47	39
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCc3cccnc3)C2)cc1	ZINC000875029422	FD	On-Demand	Anodyne	C3AR1	42	47
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCc3cccnc3)C2)cc1	ZINC000875029422	FD	On-Demand	Anodyne	MLNR	53	36
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCc3cccnc3)C2)cc1	ZINC000875029422	FD	On-Demand	Anodyne	CCR2	18	45
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCc3cccnc3)C2)cc1	ZINC000875029422	FD	On-Demand	Anodyne	MCHR1	36	45
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCc3cccnc3)C2)cc1	ZINC000875029423	FD	On-Demand	Anodyne	DRD4	37	48
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCc3cccnc3)C2)cc1	ZINC000875029423	FD	On-Demand	Anodyne	ACHE	18	43
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCc3cccnc3)C2)cc1	ZINC000875029423	FD	On-Demand	Anodyne	LTA4H	15	40
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCc3cccnc3)C2)cc1	ZINC000875029423	FD	On-Demand	Anodyne	PTAFR	23	42
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCc3cccnc3)C2)cc1	ZINC000875029423	FD	On-Demand	Anodyne	SIGMAR1	24	43
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCc3cccnc3)C2)cc1	ZINC000875029423	FD	On-Demand	Anodyne	SSTR5	45	38
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCc3cccnc3)C2)cc1	ZINC000875029423	FD	On-Demand	Anodyne	CCR3	29	40
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCc3cccnc3)C2)cc1	ZINC000875029423	FD	On-Demand	Anodyne	CHRNA7	47	39
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCc3cccnc3)C2)cc1	ZINC000875029423	FD	On-Demand	Anodyne	C3AR1	42	47
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCc3cccnc3)C2)cc1	ZINC000875029423	FD	On-Demand	Anodyne	MLNR	53	36
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCc3cccnc3)C2)cc1	ZINC000875029423	FD	On-Demand	Anodyne	CCR2	18	45
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCc3cccnc3)C2)cc1	ZINC000875029423	FD	On-Demand	Anodyne	MCHR1	36	45
O=C(NCCc1cccnc1)C(=O)N1CCC(Cc2nccs2)CC1	ZINC000875029425	FD	On-Demand	Anodyne	GRIN2B	28	40
O=C(NCCc1cccnc1)C(=O)N1CCC(Cc2nccs2)CC1	ZINC000875029425	FD	On-Demand	Anodyne	CHRNA7	47	40
O=C(NCCc1cccnc1)C(=O)N1CCC(Cc2nccs2)CC1	ZINC000875029425	FD	On-Demand	Anodyne	C3AR1	42	41
O=C(NCCc1cccnc1)C(=O)N1CCC(Cc2nccs2)CC1	ZINC000875029425	FD	On-Demand	Anodyne	ACHP_LYMST	23	40
O=C(NCCc1cccnc1)C(=O)N1CCC(Cc2nccs2)CC1	ZINC000875029425	FD	On-Demand	Anodyne	NAMPT	37	41
O=C(NCCc1cccnc1)C(=O)NCc1nc(C(F)(F)F)n2c1CCCC2	ZINC000875029427	GD	On-Demand	Anodyne	NAMPT	29	41
O=C(NCCc1cccnc1)C(=O)N[C@H]1CCN(c2ccc(Cl)cc2F)C1	ZINC000875029431	GD	On-Demand	Anodyne	CHRNA7	47	40
O=C(NCCc1cccnc1)C(=O)N[C@H]1CCN(c2ccc(Cl)cc2F)C1	ZINC000875029431	GD	On-Demand	Anodyne	C3AR1	40	44
O=C(NC[C@H]1CCC12CCOCC2)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029436	GF	On-Demand	Anodyne	EPHX2	37	51
O=C(NC[C@H]1CCC12CCOCC2)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029436	GF	On-Demand	Anodyne	L3MBTL3	41	32
CCCOc1ccc(OCC(=O)Oc2cc(OC)cc(OC)c2)cc1	ZINC000875029441	EG	On-Demand	Anodyne	AHR	16	47
CCCOc1ccc(OCC(=O)Oc2cc(OC)cc(OC)c2)cc1	ZINC000875029441	EG	On-Demand	Anodyne	MTNR1A	23	40
CCCOc1ccc(OCC(=O)Oc2cc(OC)cc(OC)c2)cc1	ZINC000875029441	EG	On-Demand	Anodyne	MTNR1B	21	40
CCCOc1ccc(OCC(=O)Oc2cc(OC)cc(OC)c2)cc1	ZINC000875029441	EG	On-Demand	Anodyne	PLA2G4B	99	43
O=C(NCCc1cccnc1)C(=O)N[C@@H]1CCN(c2ccc(Cl)cc2F)C1	ZINC000875029442	GD	On-Demand	Anodyne	CHRNA7	47	40
O=C(NCCc1cccnc1)C(=O)N[C@@H]1CCN(c2ccc(Cl)cc2F)C1	ZINC000875029442	GD	On-Demand	Anodyne	C3AR1	40	44
CCC1(N(C)C)CCN(C(=O)C(=O)NCCc2cccnc2)CC1	ZINC000875029452	ED	On-Demand	Anodyne	NAMPT	40	41
O=C(N[C@H](CCCc1ccccc1)c1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875029455	GH	On-Demand	Anodyne	GHRHR	55	44
O=C(N[C@@H](CCCc1ccccc1)c1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875029456	GH	On-Demand	Anodyne	GHRHR	55	44
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1cc(OC)ccc1OC	ZINC000875029457	EC	On-Demand	Mild	MTNR1B	28	40
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1cc(OC)ccc1OC	ZINC000875029458	EC	On-Demand	Mild	MTNR1B	28	40
O=C(NCCc1cccnc1)C(=O)N1CCC[C@H](c2ccc(F)c(F)c2)C1	ZINC000875029459	FE	On-Demand	Anodyne	CHRNA7	44	36
O=C(NCCc1cccnc1)C(=O)N1CCC[C@H](c2ccc(F)c(F)c2)C1	ZINC000875029459	FE	On-Demand	Anodyne	C3AR1	37	41
O=C(NCCc1cccnc1)C(=O)N1CCC[C@@H](c2ccc(F)c(F)c2)C1	ZINC000875029460	FE	On-Demand	Anodyne	CHRNA7	44	36
O=C(NCCc1cccnc1)C(=O)N1CCC[C@@H](c2ccc(F)c(F)c2)C1	ZINC000875029460	FE	On-Demand	Anodyne	C3AR1	37	41
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCc1cccnc1	ZINC000875029466	ED	On-Demand	Anodyne	CHRNA7	45	36
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCc1cccnc1	ZINC000875029467	ED	On-Demand	Anodyne	CHRNA7	45	36
O=C(NCCO)C1CCN(C(=O)NCCCOc2ccccc2F)CC1	ZINC000875029471	FD	On-Demand	Anodyne	EPHX2	17	43
O=C(NCCO)C1CCN(C(=O)NCCCOc2ccccc2F)CC1	ZINC000875029471	FD	On-Demand	Anodyne	SCD	16	41
C[C@@H]1[C@@H](NC(=O)C(=O)NCc2cccc(F)c2)CCN1C(=O)OC(C)(C)C	ZINC000875029472	GD	On-Demand	Anodyne	GPR119	20	49
CCOc1ccccc1CNC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875029474	FC	On-Demand	Anodyne	HCN1	66	38
CCOc1ccccc1CNC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875029474	FC	On-Demand	Anodyne	HCN4	48	37
CCOc1ccccc1CNC(=O)C(=O)NCc1ccc(OC(F)F)cc1F	ZINC000875029477	GF	On-Demand	Anodyne	KCNK3	25	40
COCCN(CC1CCN(C)CC1)C(=O)NCCCOc1ccccc1F	ZINC000875029488	GF	On-Demand	Anodyne	ACKR3	67	35
CCOc1ccccc1CNC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875029518	ED	On-Demand	Anodyne	HCN1	56	37
CCOc1ccccc1CNC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875029518	ED	On-Demand	Anodyne	HCN4	42	36
CCOc1ccccc1CNC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875029519	ED	On-Demand	Anodyne	HCN1	56	37
CCOc1ccccc1CNC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875029519	ED	On-Demand	Anodyne	HCN4	42	36
CCOc1ccccc1CNC(=O)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875029524	FF	On-Demand	Anodyne	EPHX2	15	43
CCOc1ccccc1CNC(=O)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875029524	FF	On-Demand	Anodyne	HCN1	52	36
CCOc1ccccc1CNC(=O)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875029524	FF	On-Demand	Anodyne	HCN4	46	36
CCOc1ccccc1CNC(=O)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875029525	FF	On-Demand	Anodyne	EPHX2	15	43
CCOc1ccccc1CNC(=O)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875029525	FF	On-Demand	Anodyne	HCN1	52	36
CCOc1ccccc1CNC(=O)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875029525	FF	On-Demand	Anodyne	HCN4	46	36
CCOc1ccccc1CNC(=O)C(=O)NCC[C@@H]1CCSC1	ZINC000875029529	ED	On-Demand	Anodyne	HCN1	46	31
CCOc1ccccc1CNC(=O)C(=O)NCC[C@@H]1CCSC1	ZINC000875029529	ED	On-Demand	Anodyne	HCN4	40	31
CCOc1ccccc1CNC(=O)C(=O)NCC[C@H]1CCSC1	ZINC000875029530	ED	On-Demand	Anodyne	HCN1	46	31
CCOc1ccccc1CNC(=O)C(=O)NCC[C@H]1CCSC1	ZINC000875029530	ED	On-Demand	Anodyne	HCN4	40	31
C[C@@H](CN(C)C(=O)C(=O)NCc1cccc(F)c1)NC(=O)OC(C)(C)C	ZINC000875029546	FD	On-Demand	Anodyne	PAPA1_CARPA	29	49
C[C@@H](CN(C)C(=O)C(=O)NCc1cccc(F)c1)NC(=O)OC(C)(C)C	ZINC000875029546	FD	On-Demand	Anodyne	FPR1	41	36
Cn1ccnc1[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1cccc(F)c1	ZINC000875029550	GD	On-Demand	Anodyne	CACNA1H	52	41
Cn1ccnc1[C@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1cccc(F)c1	ZINC000875029551	GD	On-Demand	Anodyne	CACNA1H	52	41
CCN(CCNC(=O)OC(C)(C)C)C(=O)C(=O)NCc1cccc(F)c1	ZINC000875029561	FD	On-Demand	Anodyne	PAPA1_CARPA	16	44
Cn1ccnc1[C@H](NC(=O)N[C@H]1CCN(CC(C)(C)O)C1)c1cccc(F)c1	ZINC000875029562	GD	On-Demand	Anodyne	CCR5	66	33
Cn1ccnc1[C@@H](NC(=O)N[C@H]1CCN(CC(C)(C)O)C1)c1cccc(F)c1	ZINC000875029563	GD	On-Demand	Anodyne	CCR5	66	33
CCC1(CC)CCCN1C(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029575	FH	On-Demand	Anodyne	EPHX2	48	51
CCC1(CC)CCCN1C(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029575	FH	On-Demand	Anodyne	CCR8	53	36
CCC1(CC)CCCN1C(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029575	FH	On-Demand	Anodyne	SLC12A5	45	33
CCC1(CC)CCCN1C(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029575	FH	On-Demand	Anodyne	L3MBTL3	82	37
C[C@H](NC(=O)C(=O)NCCc1ccccc1Cl)c1ccc(C(F)(F)F)nc1	ZINC000875029598	GG	On-Demand	Anodyne	TRPV1	69	35
O=C(N[C@H]1CCS(=O)(=O)c2ccccc21)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875029601	GE	On-Demand	Anodyne	RBP4	41	37
O=C(N[C@H]1CCS(=O)(=O)c2ccccc21)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875029602	GE	On-Demand	Anodyne	RBP4	41	37
O=C(N[C@@H]1CCS(=O)(=O)c2ccccc21)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875029603	GE	On-Demand	Anodyne	RBP4	41	37
O=C(N[C@@H]1CCS(=O)(=O)c2ccccc21)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875029604	GE	On-Demand	Anodyne	RBP4	41	37
O=C(NCc1ccc(F)c(F)c1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875029605	FE	On-Demand	Anodyne	F2	45	43
O=C(NCc1ccc(F)c(F)c1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875029605	FE	On-Demand	Anodyne	TRY1_BOVIN	31	40
O=C(NCc1ccc(F)c(F)c1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875029605	FE	On-Demand	Anodyne	DPP4	26	44
O=C(NCc1ccc(F)c(F)c1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875029605	FE	On-Demand	Anodyne	TMPRSS11D	64	35
O=C(NCc1ccc(F)c(F)c1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875029606	FE	On-Demand	Anodyne	F2	45	43
O=C(NCc1ccc(F)c(F)c1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875029606	FE	On-Demand	Anodyne	TRY1_BOVIN	31	40
O=C(NCc1ccc(F)c(F)c1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875029606	FE	On-Demand	Anodyne	DPP4	26	44
O=C(NCc1ccc(F)c(F)c1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875029606	FE	On-Demand	Anodyne	TMPRSS11D	64	35
O=C(NCc1ccc(F)c(F)c1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875029607	FE	On-Demand	Anodyne	F2	45	43
O=C(NCc1ccc(F)c(F)c1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875029607	FE	On-Demand	Anodyne	TRY1_BOVIN	31	40
O=C(NCc1ccc(F)c(F)c1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875029607	FE	On-Demand	Anodyne	DPP4	26	44
O=C(NCc1ccc(F)c(F)c1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875029607	FE	On-Demand	Anodyne	TMPRSS11D	64	35
O=C(NCc1ccc(F)c(F)c1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875029608	FE	On-Demand	Anodyne	F2	45	43
O=C(NCc1ccc(F)c(F)c1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875029608	FE	On-Demand	Anodyne	TRY1_BOVIN	31	40
O=C(NCc1ccc(F)c(F)c1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875029608	FE	On-Demand	Anodyne	DPP4	26	44
O=C(NCc1ccc(F)c(F)c1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875029608	FE	On-Demand	Anodyne	TMPRSS11D	64	35
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccc(F)c(F)c2)C1	ZINC000875029614	ED	On-Demand	Anodyne	P2RX7	16	40
CCOc1ccccc1CNC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875029622	DD	On-Demand	Anodyne	HCN1	54	37
CCOc1ccccc1CNC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875029622	DD	On-Demand	Anodyne	HCN4	47	37
CCOc1ccccc1CNC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875029623	DD	On-Demand	Anodyne	HCN1	54	37
CCOc1ccccc1CNC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875029623	DD	On-Demand	Anodyne	HCN4	47	37
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@H](c2nc(C)cs2)C1	ZINC000875029628	FE	On-Demand	Anodyne	HCN1	41	32
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@H](c2nc(C)cs2)C1	ZINC000875029628	FE	On-Demand	Anodyne	HCN4	41	32
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@@H](c2nc(C)cs2)C1	ZINC000875029629	FE	On-Demand	Anodyne	HCN1	41	32
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@@H](c2nc(C)cs2)C1	ZINC000875029629	FE	On-Demand	Anodyne	HCN4	41	32
CC(=O)C1CCN(C(=O)C(=O)NCc2ccccc2C(F)(F)F)CC1	ZINC000875029634	FE	On-Demand	Anodyne	P2RX7	50	43
CC(=O)C1CCN(C(=O)C(=O)NCc2ccccc2C(F)(F)F)CC1	ZINC000875029634	FE	On-Demand	Anodyne	EPHX2	26	55
CC(=O)C1CCN(C(=O)C(=O)NCc2ccccc2C(F)(F)F)CC1	ZINC000875029634	FE	On-Demand	Anodyne	RBP4	78	44
CC(=O)C1CCN(C(=O)C(=O)NCc2ccccc2C(F)(F)F)CC1	ZINC000875029634	FE	On-Demand	Anodyne	SFRP1	118	37
CC(=O)C1CCN(C(=O)C(=O)NCc2ccccc2C(F)(F)F)CC1	ZINC000875029634	FE	On-Demand	Anodyne	WNT3	82	37
CC(=O)C1CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)CC1	ZINC000875029641	FE	On-Demand	Anodyne	EPHX2	64	61
CC(=O)C1CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)CC1	ZINC000875029641	FE	On-Demand	Anodyne	SFRP1	55	42
CC(=O)C1CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)CC1	ZINC000875029641	FE	On-Demand	Anodyne	L3MBTL3	93	41
O=C(NC1CCN(C(=O)c2ccccc2)CC1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875029661	GG	On-Demand	Anodyne	EPHX2	38	56
O=C(NC1CCN(C(=O)c2ccccc2)CC1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875029661	GG	On-Demand	Anodyne	L3MBTL3	56	34
O=C(NC1CCN(C(=O)c2ccccc2)CC1)NC1([C@H]2CCCCO2)CCC1	ZINC000875029662	GG	On-Demand	Anodyne	EPHX2	38	56
O=C(NC1CCN(C(=O)c2ccccc2)CC1)NC1([C@H]2CCCCO2)CCC1	ZINC000875029662	GG	On-Demand	Anodyne	L3MBTL3	56	34
CCC(CC)(CNC(=O)NC1CCN(C(=O)c2ccccc2)CC1)C(F)(F)F	ZINC000875029666	GH	On-Demand	Anodyne	CCR2	24	42
CCC(CC)(CNC(=O)NC1CCN(C(=O)c2ccccc2)CC1)C(F)(F)F	ZINC000875029666	GH	On-Demand	Anodyne	EPHX2	58	51
CCC(CC)(CNC(=O)NC1CCN(C(=O)c2ccccc2)CC1)C(F)(F)F	ZINC000875029666	GH	On-Demand	Anodyne	CCR8	40	36
CCC(CC)(CNC(=O)NC1CCN(C(=O)c2ccccc2)CC1)C(F)(F)F	ZINC000875029666	GH	On-Demand	Anodyne	SFRP1	85	42
CCC(CC)(CNC(=O)NC1CCN(C(=O)c2ccccc2)CC1)C(F)(F)F	ZINC000875029666	GH	On-Demand	Anodyne	WNT3	47	34
CCC(CC)(CNC(=O)NC1CCN(C(=O)c2ccccc2)CC1)C(F)(F)F	ZINC000875029666	GH	On-Demand	Anodyne	L3MBTL3	59	36
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCOc3cccc(C)c3)C[C@@H]1C2	ZINC000875029672	EE	On-Demand	Anodyne	HRH2	38	48
O=C1CC[C@H](C(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)O1	ZINC000875029673	FD	On-Demand	Anodyne	EPHX2	38	49
O=C1CC[C@H](C(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)O1	ZINC000875029673	FD	On-Demand	Anodyne	TGM2	73	46
O=C1CC[C@H](C(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)O1	ZINC000875029673	FD	On-Demand	Anodyne	F13A1	85	51
O=C1CC[C@H](C(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)O1	ZINC000875029673	FD	On-Demand	Anodyne	NAMPT	44	47
Cc1ccc(CNC(=O)C(=O)NCCc2cccnc2)o1	ZINC000875029691	CC	On-Demand	Anodyne	PTAFR	27	43
Cc1ccc(CNC(=O)C(=O)NCCc2cccnc2)o1	ZINC000875029691	CC	On-Demand	Anodyne	NAMPT	40	38
C[C@H]1CN(Cc2ccccc2)C[C@H]1CNC(=O)C(=O)NCCc1cccnc1	ZINC000875029711	GD	On-Demand	Anodyne	ACHE	15	43
C[C@H]1CN(Cc2ccccc2)C[C@H]1CNC(=O)C(=O)NCCc1cccnc1	ZINC000875029711	GD	On-Demand	Anodyne	TBXAS1	42	40
C[C@H]1CN(Cc2ccccc2)C[C@H]1CNC(=O)C(=O)NCCc1cccnc1	ZINC000875029711	GD	On-Demand	Anodyne	CHRNA7	43	41
C[C@H]1CN(Cc2ccccc2)C[C@H]1CNC(=O)C(=O)NCCc1cccnc1	ZINC000875029711	GD	On-Demand	Anodyne	NAMPT	46	39
C[C@H]1CN(Cc2ccccc2)C[C@@H]1CNC(=O)C(=O)NCCc1cccnc1	ZINC000875029712	GD	On-Demand	Anodyne	ACHE	15	43
C[C@H]1CN(Cc2ccccc2)C[C@@H]1CNC(=O)C(=O)NCCc1cccnc1	ZINC000875029712	GD	On-Demand	Anodyne	TBXAS1	42	40
C[C@H]1CN(Cc2ccccc2)C[C@@H]1CNC(=O)C(=O)NCCc1cccnc1	ZINC000875029712	GD	On-Demand	Anodyne	CHRNA7	43	41
C[C@H]1CN(Cc2ccccc2)C[C@@H]1CNC(=O)C(=O)NCCc1cccnc1	ZINC000875029712	GD	On-Demand	Anodyne	NAMPT	46	39
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1CNC(=O)C(=O)NCCc1cccnc1	ZINC000875029713	GD	On-Demand	Anodyne	ACHE	15	43
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1CNC(=O)C(=O)NCCc1cccnc1	ZINC000875029713	GD	On-Demand	Anodyne	TBXAS1	42	40
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1CNC(=O)C(=O)NCCc1cccnc1	ZINC000875029713	GD	On-Demand	Anodyne	CHRNA7	43	41
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1CNC(=O)C(=O)NCCc1cccnc1	ZINC000875029713	GD	On-Demand	Anodyne	NAMPT	46	39
C[C@@H]1CN(Cc2ccccc2)C[C@H]1CNC(=O)C(=O)NCCc1cccnc1	ZINC000875029714	GD	On-Demand	Anodyne	ACHE	15	43
C[C@@H]1CN(Cc2ccccc2)C[C@H]1CNC(=O)C(=O)NCCc1cccnc1	ZINC000875029714	GD	On-Demand	Anodyne	TBXAS1	42	40
C[C@@H]1CN(Cc2ccccc2)C[C@H]1CNC(=O)C(=O)NCCc1cccnc1	ZINC000875029714	GD	On-Demand	Anodyne	CHRNA7	43	41
C[C@@H]1CN(Cc2ccccc2)C[C@H]1CNC(=O)C(=O)NCCc1cccnc1	ZINC000875029714	GD	On-Demand	Anodyne	NAMPT	46	39
O=C(NCCc1cccnc1)C(=O)N[C@H](c1ccccn1)C1CCC1	ZINC000875029716	ED	On-Demand	Anodyne	C3AR1	42	40
O=C(NCCc1cccnc1)C(=O)N[C@@H](c1ccccn1)C1CCC1	ZINC000875029717	ED	On-Demand	Anodyne	C3AR1	42	40
O=C(NCCc1cccnc1)C(=O)N1CCc2ccc(C(F)(F)F)cc2C1	ZINC000875029719	GE	On-Demand	Anodyne	CCR2	32	46
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1	ZINC000875029741	JE	On-Demand	Anodyne	SCD	29	43
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1	ZINC000875029742	JE	On-Demand	Anodyne	SCD	29	43
O=C(NCCc1cccnc1)C(=O)NC[C@@H]1CCN1C1CCCCC1	ZINC000875029749	ED	On-Demand	Anodyne	FKBP1A	17	40
O=C(NCCc1cccnc1)C(=O)NC[C@@H]1CCN1C1CCCCC1	ZINC000875029749	ED	On-Demand	Anodyne	TBXAS1	22	42
O=C(NCCc1cccnc1)C(=O)NC[C@@H]1CCN1C1CCCCC1	ZINC000875029749	ED	On-Demand	Anodyne	CHRNA7	47	37
O=C(NCCc1cccnc1)C(=O)NC[C@@H]1CCN1C1CCCCC1	ZINC000875029749	ED	On-Demand	Anodyne	C3AR1	43	43
O=C(NCCc1cccnc1)C(=O)NC[C@@H]1CCN1C1CCCCC1	ZINC000875029749	ED	On-Demand	Anodyne	NAMPT	37	45
O=C(NCCc1cccnc1)C(=O)NC[C@H]1CCN1C1CCCCC1	ZINC000875029750	ED	On-Demand	Anodyne	FKBP1A	17	40
O=C(NCCc1cccnc1)C(=O)NC[C@H]1CCN1C1CCCCC1	ZINC000875029750	ED	On-Demand	Anodyne	TBXAS1	22	42
O=C(NCCc1cccnc1)C(=O)NC[C@H]1CCN1C1CCCCC1	ZINC000875029750	ED	On-Demand	Anodyne	CHRNA7	47	37
O=C(NCCc1cccnc1)C(=O)NC[C@H]1CCN1C1CCCCC1	ZINC000875029750	ED	On-Demand	Anodyne	C3AR1	43	43
O=C(NCCc1cccnc1)C(=O)NC[C@H]1CCN1C1CCCCC1	ZINC000875029750	ED	On-Demand	Anodyne	NAMPT	37	45
O=C1CCN(C(=O)C(=O)NCCc2cccnc2)CCCCCCN1	ZINC000875029760	EC	On-Demand	Anodyne	NAMPT	38	46
CCC1(N2CCCC2)CCN(C(=O)C(=O)NCCc2cccnc2)CC1	ZINC000875029765	FD	On-Demand	Anodyne	NAMPT	44	43
CC(C)c1cc([C@@H]2CCCN(C(=O)C(=O)NCc3cccc(F)c3)C2)n[nH]1	ZINC000875029793	FF	On-Demand	Anodyne	CCR3	43	31
CC(=O)NC[C@@H]1CCCCN1C(=O)NCCCOc1ccccc1F	ZINC000875029798	FE	On-Demand	Anodyne	HCRTR1	22	42
CC(=O)NC[C@@H]1CCCCN1C(=O)NCCCOc1ccccc1F	ZINC000875029798	FE	On-Demand	Anodyne	ASAH1	41	32
CC(=O)NC[C@@H]1CCCCN1C(=O)NCCCOc1ccccc1F	ZINC000875029798	FE	On-Demand	Anodyne	ACKR3	45	32
O=C(NCCCOc1ccccc1F)NCCN1CC[C@@H](O)C1	ZINC000875029808	EC	On-Demand	Anodyne	HTR1A	26	47
O=C(NCCCOc1ccccc1F)NCCN1CC[C@@H](O)C1	ZINC000875029808	EC	On-Demand	Anodyne	DRD2	34	47
O=C(NCCCOc1ccccc1F)NCCN1CC[C@@H](O)C1	ZINC000875029808	EC	On-Demand	Anodyne	SLC6A1	63	35
O=C(NCCCOc1ccccc1F)NCCN1CC[C@@H](O)C1	ZINC000875029808	EC	On-Demand	Anodyne	DRD3	41	38
O=C(NCCCOc1ccccc1F)NCCN1CC[C@@H](O)C1	ZINC000875029808	EC	On-Demand	Anodyne	HTR7	19	47
O=C(NCCCOc1ccccc1F)NCCN1CC[C@@H](O)C1	ZINC000875029808	EC	On-Demand	Anodyne	CCR3	41	43
O=C(NCCCOc1ccccc1F)NCCN1CC[C@@H](O)C1	ZINC000875029808	EC	On-Demand	Anodyne	PLD1	57	36
O=C(NCCCOc1ccccc1F)NCCN1CC[C@@H](O)C1	ZINC000875029808	EC	On-Demand	Anodyne	PLD2	63	35
O=C(NCCCOc1ccccc1F)NCCN1CC[C@H](O)C1	ZINC000875029809	EC	On-Demand	Anodyne	HTR1A	26	47
O=C(NCCCOc1ccccc1F)NCCN1CC[C@H](O)C1	ZINC000875029809	EC	On-Demand	Anodyne	DRD2	34	47
O=C(NCCCOc1ccccc1F)NCCN1CC[C@H](O)C1	ZINC000875029809	EC	On-Demand	Anodyne	SLC6A1	63	35
O=C(NCCCOc1ccccc1F)NCCN1CC[C@H](O)C1	ZINC000875029809	EC	On-Demand	Anodyne	DRD3	41	38
O=C(NCCCOc1ccccc1F)NCCN1CC[C@H](O)C1	ZINC000875029809	EC	On-Demand	Anodyne	HTR7	19	47
O=C(NCCCOc1ccccc1F)NCCN1CC[C@H](O)C1	ZINC000875029809	EC	On-Demand	Anodyne	CCR3	41	43
O=C(NCCCOc1ccccc1F)NCCN1CC[C@H](O)C1	ZINC000875029809	EC	On-Demand	Anodyne	PLD1	57	36
O=C(NCCCOc1ccccc1F)NCCN1CC[C@H](O)C1	ZINC000875029809	EC	On-Demand	Anodyne	PLD2	63	35
CCOc1ccccc1CNC(=O)C(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1	ZINC000875029830	GC	On-Demand	Anodyne	HCN1	48	31
CCOc1ccccc1CNC(=O)C(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1	ZINC000875029830	GC	On-Demand	Anodyne	HCN4	41	31
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](c2cccc(F)c2)c2nccn2C)C1	ZINC000875029837	GE	On-Demand	Anodyne	CCR5	52	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](c2cccc(F)c2)c2nccn2C)C1	ZINC000875029838	GE	On-Demand	Anodyne	CCR5	52	34
CCOc1ccccc1CNC(=O)C(=O)N1CCN(C)c2ncccc2C1	ZINC000875029845	FD	On-Demand	Anodyne	HCN1	49	36
CN1CCN(C2CCN(C(=O)C(=O)NCc3cccc(F)c3)CC2)CC1	ZINC000875029853	FC	On-Demand	Anodyne	HRH3	19	40
CN1CCN(C2CCN(C(=O)C(=O)NCc3cccc(F)c3)CC2)CC1	ZINC000875029853	FC	On-Demand	Anodyne	L3MBTL3	70	40
COCC(C)(C)CCNC(=O)C(=O)NCc1ccc(OC)cc1OC	ZINC000875029854	FD	On-Demand	Anodyne	MTNR1A	46	37
COCC(C)(C)CCNC(=O)C(=O)NCc1ccc(OC)cc1OC	ZINC000875029854	FD	On-Demand	Anodyne	MT-ND1	18	42
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(F)c2)CC1	ZINC000875029856	DD	On-Demand	Anodyne	GRIN2B	15	40
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(F)c2)CC1	ZINC000875029856	DD	On-Demand	Anodyne	CACNA1G	32	42
CCOc1ccccc1CNC(=O)C(=O)NCCCCC1CC1	ZINC000875029857	DE	On-Demand	Anodyne	HCN1	49	34
CCOc1ccccc1CNC(=O)C(=O)NCCCCC1CC1	ZINC000875029857	DE	On-Demand	Anodyne	HCN4	43	34
C#CC[C@H](COC)NC(=O)C(=O)NCc1cccc(F)c1	ZINC000875029859	CC	On-Demand	Mild	PDS	33	41
C#CC[C@@H](COC)NC(=O)C(=O)NCc1cccc(F)c1	ZINC000875029860	CC	On-Demand	Mild	PDS	33	41
C[C@@H]1[C@@H](NC(=O)C(=O)NCc2ccc(F)c(F)c2)CCN1C(=O)OC(C)(C)C	ZINC000875029876	GE	On-Demand	Anodyne	GPR119	24	40
CN1CC[C@H]2CN(C(=O)NC3CCN(C(=O)c4ccccc4)CC3)CC[C@@H]21	ZINC000875029880	FE	On-Demand	Anodyne	EPHX2	41	49
CN1CC[C@H]2CN(C(=O)NC3CCN(C(=O)c4ccccc4)CC3)CC[C@@H]21	ZINC000875029880	FE	On-Demand	Anodyne	L3MBTL3	89	39
CN1CC[C@H]2CN(C(=O)NC3CCN(C(=O)c4ccccc4)CC3)CC[C@H]21	ZINC000875029883	FE	On-Demand	Anodyne	EPHX2	41	49
CN1CC[C@H]2CN(C(=O)NC3CCN(C(=O)c4ccccc4)CC3)CC[C@H]21	ZINC000875029883	FE	On-Demand	Anodyne	L3MBTL3	89	39
C=CC(C)(C)CCCNC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029897	FH	On-Demand	Mild	EPHX2	40	48
C=CC(C)(C)CCCNC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029897	FH	On-Demand	Mild	L3MBTL3	41	35
O=C(/C=C/c1ccsc1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875029898	FJ	On-Demand	Anodyne	SCD1	36	40
O=C(/C=C/c1ccsc1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875029898	FJ	On-Demand	Anodyne	SCD	32	50
O=C(/C=C\c1ccsc1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875029899	FJ	On-Demand	Anodyne	SCD1	36	40
O=C(/C=C\c1ccsc1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875029899	FJ	On-Demand	Anodyne	SCD	32	50
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875029900	FF	On-Demand	Anodyne	EPHX2	43	52
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875029900	FF	On-Demand	Anodyne	L3MBTL3	76	38
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875029901	FF	On-Demand	Anodyne	EPHX2	43	52
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875029901	FF	On-Demand	Anodyne	L3MBTL3	76	38
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875029902	FF	On-Demand	Anodyne	EPHX2	43	52
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875029902	FF	On-Demand	Anodyne	L3MBTL3	76	38
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875029903	FF	On-Demand	Anodyne	EPHX2	43	52
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875029903	FF	On-Demand	Anodyne	L3MBTL3	76	38
COC(=O)N(C)NC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029924	ED	On-Demand	Reactive	EPHX2	56	55
COC(=O)N(C)NC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029924	ED	On-Demand	Reactive	L3MBTL3	71	39
CC(=O)C1CCN(C(=O)N[C@H]2CCSc3ccc(Cl)cc32)CC1	ZINC000875029935	FH	On-Demand	Anodyne	EPHX2	17	40
CC(=O)C1CCN(C(=O)N[C@@H]2CCSc3ccc(Cl)cc32)CC1	ZINC000875029936	FH	On-Demand	Anodyne	EPHX2	17	40
O=C1OC[C@H]2CN(C(=O)NC3CCN(C(=O)c4ccccc4)CC3)C[C@@H]12	ZINC000875029938	FD	On-Demand	Anodyne	EPHX2	26	46
O=C1OC[C@H]2CN(C(=O)NC3CCN(C(=O)c4ccccc4)CC3)C[C@@H]12	ZINC000875029938	FD	On-Demand	Anodyne	L3MBTL3	50	34
O=C(NCc1cccc2ncccc12)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029964	GG	On-Demand	Anodyne	C3AR1	35	40
O=C(NCc1cccc2ncccc12)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029964	GG	On-Demand	Anodyne	EPHX2	46	49
CN(Cc1ccc2cc[nH]c2c1)C(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875029966	GH	On-Demand	Anodyne	CCR3	20	40
Cc1ccc(C(C)(C)CNC(=O)C(=O)NCCc2cccnc2)nc1	ZINC000875029971	ED	On-Demand	Anodyne	TBXAS1	41	41
Cc1ccc(C(C)(C)CNC(=O)C(=O)NCCc2cccnc2)nc1	ZINC000875029971	ED	On-Demand	Anodyne	PTAFR	18	40
Cc1ccc(C(C)(C)CNC(=O)C(=O)NCCc2cccnc2)nc1	ZINC000875029971	ED	On-Demand	Anodyne	NAMPT	35	40
O=C(NCCc1cccnc1)C(=O)N1CCN(c2cccc3[nH]ccc23)CC1	ZINC000875029985	GD	On-Demand	Anodyne	HPGDS	22	43
O=C(NCCc1cccnc1)C(=O)N1CCN(c2cccc3[nH]ccc23)CC1	ZINC000875029985	GD	On-Demand	Anodyne	NAMPT	21	41
CC[C@@H](NC(=O)C(=O)NCCc1cccnc1)c1cccc(OC)c1OC	ZINC000875029987	FE	On-Demand	Anodyne	PTAFR	33	43
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NC2CCN(C(=O)C3CC3)CC2)c1	ZINC000875029992	GD	On-Demand	Anodyne	SFRP1	40	33
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NC2CCN(C(=O)C3CC3)CC2)c1	ZINC000875029992	GD	On-Demand	Anodyne	WNT3	41	31
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NC2CCN(C(=O)C3CC3)CC2)c1	ZINC000875029993	GD	On-Demand	Anodyne	SFRP1	40	33
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NC2CCN(C(=O)C3CC3)CC2)c1	ZINC000875029993	GD	On-Demand	Anodyne	WNT3	41	31
CCOc1ccccc1CNC(=O)C(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875030002	ED	On-Demand	Anodyne	DPP7	20	40
CCOc1ccccc1CNC(=O)C(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875030002	ED	On-Demand	Anodyne	HCN1	63	38
CCOc1ccccc1CNC(=O)C(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875030002	ED	On-Demand	Anodyne	HCN4	57	38
CCOc1ccccc1CNC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875030003	ED	On-Demand	Anodyne	DPP7	20	40
CCOc1ccccc1CNC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875030003	ED	On-Demand	Anodyne	HCN1	63	38
CCOc1ccccc1CNC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875030003	ED	On-Demand	Anodyne	HCN4	57	38
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCOc2ccccc2F)C1	ZINC000875030037	FE	On-Demand	Anodyne	ASAH1	53	35
CCOc1ccccc1CNC(=O)C(=O)NC[C@@H]1c2ccccc2CN1C	ZINC000875030042	FE	On-Demand	Anodyne	HCN1	56	38
CCOc1ccccc1CNC(=O)C(=O)NC[C@@H]1c2ccccc2CN1C	ZINC000875030042	FE	On-Demand	Anodyne	HCN4	42	32
CCOc1ccccc1CNC(=O)C(=O)NC[C@H]1c2ccccc2CN1C	ZINC000875030043	FE	On-Demand	Anodyne	HCN1	56	38
CCOc1ccccc1CNC(=O)C(=O)NC[C@H]1c2ccccc2CN1C	ZINC000875030043	FE	On-Demand	Anodyne	HCN4	42	32
CC1(C)[C@@H](c2cccc(F)c2)CCN1C(=O)C(=O)NCCc1cccnc1	ZINC000875030072	FF	On-Demand	Anodyne	CHRNA7	45	42
CC1(C)[C@@H](c2cccc(F)c2)CCN1C(=O)C(=O)NCCc1cccnc1	ZINC000875030072	FF	On-Demand	Anodyne	NAMPT	43	38
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1ccc(Br)c([N+](=O)[O-])c1	ZINC000875030081	JJ	On-Demand	Bother	SCD1	45	49
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1ccc(Br)c([N+](=O)[O-])c1	ZINC000875030081	JJ	On-Demand	Bother	SCD	40	58
O=C(NCCc1cccnc1)C(=O)NC[C@H]1CCN1C1CCCCCC1	ZINC000875030082	FD	On-Demand	Anodyne	FKBP1A	17	40
O=C(NCCc1cccnc1)C(=O)NC[C@H]1CCN1C1CCCCCC1	ZINC000875030082	FD	On-Demand	Anodyne	TBXAS1	22	42
O=C(NCCc1cccnc1)C(=O)NC[C@H]1CCN1C1CCCCCC1	ZINC000875030082	FD	On-Demand	Anodyne	CHRNA7	47	37
O=C(NCCc1cccnc1)C(=O)NC[C@H]1CCN1C1CCCCCC1	ZINC000875030082	FD	On-Demand	Anodyne	C3AR1	43	43
O=C(NCCc1cccnc1)C(=O)NC[C@H]1CCN1C1CCCCCC1	ZINC000875030082	FD	On-Demand	Anodyne	NAMPT	37	45
O=C(NCCc1cccnc1)C(=O)NC[C@@H]1CCN1C1CCCCCC1	ZINC000875030083	FD	On-Demand	Anodyne	FKBP1A	17	40
O=C(NCCc1cccnc1)C(=O)NC[C@@H]1CCN1C1CCCCCC1	ZINC000875030083	FD	On-Demand	Anodyne	TBXAS1	22	42
O=C(NCCc1cccnc1)C(=O)NC[C@@H]1CCN1C1CCCCCC1	ZINC000875030083	FD	On-Demand	Anodyne	CHRNA7	47	37
O=C(NCCc1cccnc1)C(=O)NC[C@@H]1CCN1C1CCCCCC1	ZINC000875030083	FD	On-Demand	Anodyne	C3AR1	43	43
O=C(NCCc1cccnc1)C(=O)NC[C@@H]1CCN1C1CCCCCC1	ZINC000875030083	FD	On-Demand	Anodyne	NAMPT	37	45
Cc1scc(CNC(=O)C(=O)NCCc2cccnc2)c1C	ZINC000875030084	DD	On-Demand	Anodyne	PTAFR	23	41
Cc1scc(CNC(=O)C(=O)NCCc2cccnc2)c1C	ZINC000875030084	DD	On-Demand	Anodyne	NAMPT	32	40
COCC(C)(C)CCNC(=O)C(=O)NCc1cc(OC)ccc1OC	ZINC000875030085	FD	On-Demand	Anodyne	MTNR1A	48	39
COCC(C)(C)CCNC(=O)C(=O)NCc1cc(OC)ccc1OC	ZINC000875030085	FD	On-Demand	Anodyne	MT-ND1	24	53
O=C(NCCc1cccnc1)C(=O)N1CCN(CCc2cnccn2)CC1	ZINC000875030089	FB	On-Demand	Anodyne	PTAFR	25	40
O=C(NCCc1cccnc1)C(=O)N1CCN(CCc2cnccn2)CC1	ZINC000875030089	FB	On-Demand	Anodyne	NAMPT	27	40
O=CN1CCCN(C(=O)N[C@H](CCCc2ccccc2)c2ccccc2)CC1	ZINC000875030090	GH	On-Demand	Anodyne	GHRHR	45	39
O=CN1CCCN(C(=O)N[C@H](CCCc2ccccc2)c2ccccc2)CC1	ZINC000875030090	GH	On-Demand	Anodyne	DPP7	25	43
O=CN1CCCN(C(=O)N[C@@H](CCCc2ccccc2)c2ccccc2)CC1	ZINC000875030091	GH	On-Demand	Anodyne	GHRHR	45	39
O=CN1CCCN(C(=O)N[C@@H](CCCc2ccccc2)c2ccccc2)CC1	ZINC000875030091	GH	On-Demand	Anodyne	DPP7	25	43
COc1ccccc1[C@H]1CN(C(=O)C(=O)NCCc2cccnc2)CCO1	ZINC000875030093	FD	On-Demand	Anodyne	CHRNA7	44	41
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NCCc2cccnc2)CCO1	ZINC000875030094	FD	On-Demand	Anodyne	CHRNA7	44	41
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(C(=O)c4ccoc4)CC3)CC[C@H]21	ZINC000875030098	GC	On-Demand	Anodyne	L3MBTL3	47	33
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(C(=O)c4ccoc4)CC3)CC[C@@H]21	ZINC000875030099	GC	On-Demand	Anodyne	L3MBTL3	47	33
O=C(NCCc1cccnc1)C(=O)N[C@@H]1CO[C@H](C2CC2)C1	ZINC000875030101	DC	On-Demand	Anodyne	CHRNA7	46	37
O=C(NCCc1cccnc1)C(=O)N[C@H]1CO[C@H](C2CC2)C1	ZINC000875030102	DC	On-Demand	Anodyne	CHRNA7	46	37
O=C(NCCc1cccnc1)C(=O)N[C@@H]1CO[C@@H](C2CC2)C1	ZINC000875030103	DC	On-Demand	Anodyne	CHRNA7	46	37
O=C(NCCc1cccnc1)C(=O)N[C@H]1CO[C@@H](C2CC2)C1	ZINC000875030104	DC	On-Demand	Anodyne	CHRNA7	46	37
O=C(NCCc1cccnc1)C(=O)N[C@@H](C1CCC1)[C@H]1CCCO1	ZINC000875030107	ED	On-Demand	Anodyne	TBXAS1	23	40
O=C(NCCc1cccnc1)C(=O)N[C@@H](C1CCC1)[C@@H]1CCCO1	ZINC000875030108	ED	On-Demand	Anodyne	TBXAS1	23	40
O=C(NCCc1cccnc1)C(=O)N[C@H](C1CCC1)[C@H]1CCCO1	ZINC000875030109	ED	On-Demand	Anodyne	TBXAS1	23	40
O=C(NCCc1cccnc1)C(=O)N[C@H](C1CCC1)[C@@H]1CCCO1	ZINC000875030110	ED	On-Demand	Anodyne	TBXAS1	23	40
O=C(NCCc1cccnc1)C(=O)NCC[C@H]1CC=CCC1	ZINC000875030112	DD	On-Demand	Anodyne	CHRNA7	40	36
O=C(NCCc1cccnc1)C(=O)NCC[C@@H]1CC=CCC1	ZINC000875030113	DD	On-Demand	Anodyne	CHRNA7	40	36
CCOc1ccccc1CNC(=O)C(=O)N(C)CCN1CC2(CCOCC2)C1	ZINC000875030116	GD	On-Demand	Anodyne	HCN1	49	37
CCOc1ccccc1CNC(=O)C(=O)N(C)CCN1CC2(CCOCC2)C1	ZINC000875030116	GD	On-Demand	Anodyne	HCN4	40	32
NC(=O)[C@@H]1CCCN1CCCNC(=O)NCCCOc1ccccc1F	ZINC000875030123	FD	On-Demand	Anodyne	HTR1A	15	41
NC(=O)[C@@H]1CCCN1CCCNC(=O)NCCCOc1ccccc1F	ZINC000875030123	FD	On-Demand	Anodyne	ACKR3	40	34
O=C(NCCCCC1CC1)C(=O)NCCc1cccnc1	ZINC000875030128	CD	On-Demand	Anodyne	FKBP1A	17	45
O=C(NCCCCC1CC1)C(=O)NCCc1cccnc1	ZINC000875030128	CD	On-Demand	Anodyne	TBXA2R	18	42
O=C(NCCCCC1CC1)C(=O)NCCc1cccnc1	ZINC000875030128	CD	On-Demand	Anodyne	TBXAS1	49	43
O=C(NCCCCC1CC1)C(=O)NCCc1cccnc1	ZINC000875030128	CD	On-Demand	Anodyne	PTAFR	33	48
O=C(NCCCCC1CC1)C(=O)NCCc1cccnc1	ZINC000875030128	CD	On-Demand	Anodyne	CHRNA7	47	37
O=C(NCCCCC1CC1)C(=O)NCCc1cccnc1	ZINC000875030128	CD	On-Demand	Anodyne	NAMPT	42	46
O=C(NCc1cccc(F)c1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875030136	EE	On-Demand	Anodyne	GRIN2B	15	40
O=C(NCc1cccc(F)c1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875030137	EE	On-Demand	Anodyne	GRIN2B	15	40
O=C(NCCc1cccnc1)C(=O)N1CCc2cc(C(F)(F)F)ccc2C1	ZINC000875030156	GE	On-Demand	Anodyne	CHRNA7	26	41
O=C(NCCc1cccnc1)C(=O)N1CCc2cc(C(F)(F)F)ccc2C1	ZINC000875030156	GE	On-Demand	Anodyne	CCR2	31	43
O=C(NCCc1cccnc1)C(=O)N1CCc2cc(C(F)(F)F)ccc2C1	ZINC000875030156	GE	On-Demand	Anodyne	NAMPT	21	40
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccccc1C(=O)Nc1cccc(Cl)c1	ZINC000875030165	GH	On-Demand	Anodyne	F2	25	42
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccccc1C(=O)Nc1cccc(Cl)c1	ZINC000875030165	GH	On-Demand	Anodyne	AVPR2	30	42
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccccc1C(=O)Nc1cccc(Cl)c1	ZINC000875030165	GH	On-Demand	Anodyne	F10	17	49
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccccc1C(=O)Nc1cccc(Cl)c1	ZINC000875030165	GH	On-Demand	Anodyne	GRM4	20	40
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccccc1C(=O)Nc1cccc(Cl)c1	ZINC000875030165	GH	On-Demand	Anodyne	NR1H4	16	41
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccccc1C(=O)Nc1cccc(Cl)c1	ZINC000875030165	GH	On-Demand	Anodyne	LGMN	68	39
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccccc1C(=O)Nc1cccc(Cl)c1	ZINC000875030165	GH	On-Demand	Anodyne	GRM5	19	43
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccccc1C(=O)Nc1cccc(Cl)c1	ZINC000875030165	GH	On-Demand	Anodyne	XIAP	40	41
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccccc1C(=O)Nc1cccc(Cl)c1	ZINC000875030165	GH	On-Demand	Anodyne	BRCA1	42	30
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccccc1C(=O)Nc1cccc(Cl)c1	ZINC000875030165	GH	On-Demand	Anodyne	KCNK3	72	38
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccccc1C(=O)Nc1cccc(Cl)c1	ZINC000875030165	GH	On-Demand	Anodyne	KCNK9	63	36
O=C(Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1)C1(F)CCOCC1	ZINC000875030167	GF	On-Demand	Anodyne	LPL	49	39
O=C(Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1)C1(F)CCOCC1	ZINC000875030167	GF	On-Demand	Anodyne	MMP13	28	40
O=C(Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1)C1(F)CCOCC1	ZINC000875030167	GF	On-Demand	Anodyne	EPHX2	28	53
O=C(Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1)C1(F)CCOCC1	ZINC000875030167	GF	On-Demand	Anodyne	TGM2	69	46
O=C(Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1)C1(F)CCOCC1	ZINC000875030167	GF	On-Demand	Anodyne	F13A1	89	53
O=C(Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1)C1(F)CCOCC1	ZINC000875030167	GF	On-Demand	Anodyne	MERTK	28	43
O=C(Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1)C1(F)CCOCC1	ZINC000875030167	GF	On-Demand	Anodyne	NAMPT	49	52
C[C@H]1C[C@H](CO)CCN1C(=O)C(=O)NCCc1cccnc1	ZINC000875030170	DC	On-Demand	Anodyne	CHRNA7	45	37
C[C@H]1C[C@H](CO)CCN1C(=O)C(=O)NCCc1cccnc1	ZINC000875030170	DC	On-Demand	Anodyne	NAMPT	37	41
CCOC(=O)c1c(-c2ccc(OC)cc2)csc1NC(=O)[C@H]1CCC(=O)O1	ZINC000875030181	GG	On-Demand	Anodyne	PRKCZ	50	42
O=C(N[C@H]1CCS(=O)(=O)c2ccccc21)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875030193	GG	On-Demand	Anodyne	RBP4	50	35
O=C(N[C@@H]1CCS(=O)(=O)c2ccccc21)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875030194	GG	On-Demand	Anodyne	RBP4	50	35
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@@H]1[C@H]2C[C@@H]3CO[C@@H]1[C@H]3C2	ZINC000875030196	FE	On-Demand	Anodyne	EPHX2	30	51
NC(=O)CCN(Cc1ccccc1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875030197	GG	On-Demand	Anodyne	C3AR1	42	41
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@@H]1[C@H]2C[C@@H]3CO[C@H]1[C@H]3C2	ZINC000875030198	FE	On-Demand	Anodyne	EPHX2	30	51
NC(=O)CCN(Cc1ccccc1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875030199	GG	On-Demand	Anodyne	C3AR1	42	41
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@@H]1[C@@H]2C[C@@H]3[C@@H]1OC[C@@H]3C2	ZINC000875030200	FE	On-Demand	Anodyne	EPHX2	30	51
CN(CCNC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1	ZINC000875030201	EC	On-Demand	Anodyne	EPHX2	17	40
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@@H]1[C@@H]2C[C@H]3[C@H](CO[C@H]31)C2	ZINC000875030203	FE	On-Demand	Anodyne	EPHX2	30	51
C[C@@H](NC(=O)NC1CCN(C(=O)c2ccccc2)CC1)c1ccns1	ZINC000875030205	FF	On-Demand	Anodyne	EPHX2	35	51
C[C@@H](NC(=O)NC1CCN(C(=O)c2ccccc2)CC1)c1ccns1	ZINC000875030205	FF	On-Demand	Anodyne	L3MBTL3	64	36
O=C(N[C@H]1CCc2ccccc21)N1CCCC(F)(F)CC1	ZINC000875030208	CH	On-Demand	Anodyne	EPHX2	15	58
O=C(N[C@H]1CCc2ccccc21)N1CCCC(F)(F)CC1	ZINC000875030208	CH	On-Demand	Anodyne	XIAP	22	41
O=C(N[C@H]1CCc2ccccc21)N1CCCC(F)(F)CC1	ZINC000875030208	CH	On-Demand	Anodyne	BIRC3	45	34
O=C(N[C@H]1CCc2ccccc21)N1CCCC(F)(F)CC1	ZINC000875030208	CH	On-Demand	Anodyne	TRPM8	43	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCN(C)c1ccccc1	ZINC000875030215	ED	On-Demand	Anodyne	SLC6A4	22	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCN(C)c1ccccc1	ZINC000875030215	ED	On-Demand	Anodyne	SLC6A3	46	41
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)c1ccc(C)cc1	ZINC000875030218	DD	On-Demand	Mild	ACACA	23	40
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](C)c1ccc(C)cc1	ZINC000875030219	DD	On-Demand	Mild	ACACA	23	40
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)c1ccc(C)cc1	ZINC000875030220	DD	On-Demand	Mild	ACACA	23	40
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](C)c1ccc(C)cc1	ZINC000875030221	DD	On-Demand	Mild	ACACA	23	40
C[C@H](NC(=O)NC1CCN(C(=O)c2ccccc2)CC1)c1ccns1	ZINC000875030224	FF	On-Demand	Anodyne	EPHX2	35	51
C[C@H](NC(=O)NC1CCN(C(=O)c2ccccc2)CC1)c1ccns1	ZINC000875030224	FF	On-Demand	Anodyne	L3MBTL3	64	36
CN1Cc2ccccc2[C@@H]1CNC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875030226	GF	On-Demand	Anodyne	EPHX2	36	48
CN1Cc2ccccc2[C@@H]1CNC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875030226	GF	On-Demand	Anodyne	L3MBTL3	49	34
C#CC[C@@H](CCOC)NC(=O)N(CCC(N)=O)Cc1ccccc1	ZINC000875030227	ED	On-Demand	Mild	PTGES	21	40
CN1Cc2ccccc2[C@H]1CNC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875030228	GF	On-Demand	Anodyne	EPHX2	36	48
CN1Cc2ccccc2[C@H]1CNC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875030228	GF	On-Demand	Anodyne	L3MBTL3	49	34
C#CC[C@H](CCOC)NC(=O)N(CCC(N)=O)Cc1ccccc1	ZINC000875030229	ED	On-Demand	Mild	PTGES	21	40
O=CN1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)CC1	ZINC000875030233	FD	On-Demand	Anodyne	PREP	18	40
O=CN1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)CC1	ZINC000875030233	FD	On-Demand	Anodyne	EPHX2	40	54
O=CN1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)CC1	ZINC000875030233	FD	On-Demand	Anodyne	L3MBTL3	85	42
O=C(NCc1ccccc1C(F)(F)F)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875030236	FF	On-Demand	Anodyne	P2RX7	40	38
O=C(NCc1ccccc1C(F)(F)F)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875030236	FF	On-Demand	Anodyne	RBP4	82	39
O=C(NCc1ccccc1C(F)(F)F)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875030238	FF	On-Demand	Anodyne	P2RX7	40	38
O=C(NCc1ccccc1C(F)(F)F)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875030238	FF	On-Demand	Anodyne	RBP4	82	39
O=C(NCc1ccccc1C(F)(F)F)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875030239	FF	On-Demand	Anodyne	P2RX7	40	38
O=C(NCc1ccccc1C(F)(F)F)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875030239	FF	On-Demand	Anodyne	RBP4	82	39
O=C(NCc1ccccc1C(F)(F)F)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875030242	FF	On-Demand	Anodyne	P2RX7	40	38
O=C(NCc1ccccc1C(F)(F)F)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875030242	FF	On-Demand	Anodyne	RBP4	82	39
O=C(N[C@H]1CCc2ccccc21)N1CCO[C@H](C(F)F)CC1	ZINC000875030268	DF	On-Demand	Anodyne	EPHX2	15	50
O=C(N[C@H]1CCc2ccccc21)N1CCO[C@H](C(F)F)CC1	ZINC000875030268	DF	On-Demand	Anodyne	RBP4	45	35
O=C(N[C@H]1CCc2ccccc21)N1CCO[C@@H](C(F)F)CC1	ZINC000875030269	DF	On-Demand	Anodyne	EPHX2	15	50
O=C(N[C@H]1CCc2ccccc21)N1CCO[C@@H](C(F)F)CC1	ZINC000875030269	DF	On-Demand	Anodyne	RBP4	45	35
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCc2ccccc21	ZINC000875030273	CF	On-Demand	Anodyne	XIAP	20	43
CC[C@H](C[C@H](C)O)NC(=O)NCCCOc1cccc(C)c1	ZINC000875030302	DF	On-Demand	Anodyne	HRH2	30	50
CC[C@H](C[C@H](C)O)NC(=O)NCCCOc1cccc(C)c1	ZINC000875030302	DF	On-Demand	Anodyne	PDS	67	44
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(C(F)(F)F)cc1	ZINC000875030318	DG	On-Demand	Anodyne	ANPEP	17	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(C(F)(F)F)cc1	ZINC000875030318	DG	On-Demand	Anodyne	TRPV1	15	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(C(F)(F)F)cc1	ZINC000875030318	DG	On-Demand	Anodyne	PDS	51	39
CCCCCCCNC(=O)C(=O)NCc1ccc(F)c(F)c1	ZINC000875030325	DF	On-Demand	Mild	TRPV1	16	42
CCCCCCCNC(=O)C(=O)NCc1ccc(F)c(F)c1	ZINC000875030325	DF	On-Demand	Mild	LPAR2	38	42
CCCCCCCNC(=O)C(=O)NCc1ccc(F)c(F)c1	ZINC000875030325	DF	On-Demand	Mild	S1PR3	21	42
CCCCCCCNC(=O)C(=O)NCc1ccc(F)c(F)c1	ZINC000875030325	DF	On-Demand	Mild	GRIA1	45	38
CCCCCCCNC(=O)C(=O)NCc1ccc(F)c(F)c1	ZINC000875030325	DF	On-Demand	Mild	S1PR2	52	42
CCCCCCCNC(=O)C(=O)NCc1ccc(F)c(F)c1	ZINC000875030325	DF	On-Demand	Mild	LEF	50	36
CCCCCCCNC(=O)C(=O)NCc1ccc(F)c(F)c1	ZINC000875030325	DF	On-Demand	Mild	ASAH1	100	40
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@]2(C(=O)OC)CCC[C@H]12	ZINC000875030333	FD	On-Demand	Anodyne	HCN1	57	36
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@]2(C(=O)OC)CCC[C@H]12	ZINC000875030333	FD	On-Demand	Anodyne	HCN4	47	36
O=C(NCc1ccccc1C(F)(F)F)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875030349	GG	On-Demand	Anodyne	P2RX7	42	41
O=C(NCc1ccccc1C(F)(F)F)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875030349	GG	On-Demand	Anodyne	EPHX2	26	44
O=C(NCc1ccccc1C(F)(F)F)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875030349	GG	On-Demand	Anodyne	RBP4	66	45
O=C(NCc1ccccc1C(F)(F)F)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875030349	GG	On-Demand	Anodyne	SFRP1	112	35
O=C(NCc1ccccc1C(F)(F)F)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875030349	GG	On-Demand	Anodyne	SCD	32	40
O=C(NCc1ccccc1C(F)(F)F)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875030349	GG	On-Demand	Anodyne	WNT3	81	35
O=C(NCc1ccccc1C(F)(F)F)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875030350	GG	On-Demand	Anodyne	P2RX7	42	41
O=C(NCc1ccccc1C(F)(F)F)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875030350	GG	On-Demand	Anodyne	EPHX2	26	44
O=C(NCc1ccccc1C(F)(F)F)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875030350	GG	On-Demand	Anodyne	RBP4	66	45
O=C(NCc1ccccc1C(F)(F)F)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875030350	GG	On-Demand	Anodyne	SFRP1	112	35
O=C(NCc1ccccc1C(F)(F)F)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875030350	GG	On-Demand	Anodyne	SCD	32	40
O=C(NCc1ccccc1C(F)(F)F)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875030350	GG	On-Demand	Anodyne	WNT3	81	35
CONC(=O)C1CCN(C(=O)N[C@H]2CCSc3ccc(Cl)cc32)CC1	ZINC000875030365	GF	On-Demand	Anodyne	EPHX2	17	41
CONC(=O)C1CCN(C(=O)N[C@@H]2CCSc3ccc(Cl)cc32)CC1	ZINC000875030366	GF	On-Demand	Anodyne	EPHX2	17	41
CN1CCN(C2CCN(C(=O)C(=O)NCCc3ccccc3Cl)CC2)CC1	ZINC000875030367	GD	On-Demand	Anodyne	CCR3	24	43
CN1CCN(C2CCN(C(=O)C(=O)NCCc3ccccc3Cl)CC2)CC1	ZINC000875030367	GD	On-Demand	Anodyne	L3MBTL3	79	42
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@H]2[C@H](CCN2C)C1	ZINC000875030372	ED	On-Demand	Anodyne	HCN1	52	35
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@H]2[C@H](CCN2C)C1	ZINC000875030372	ED	On-Demand	Anodyne	HCN4	44	34
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@H]2[C@@H](CCN2C)C1	ZINC000875030373	ED	On-Demand	Anodyne	HCN1	52	35
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@H]2[C@@H](CCN2C)C1	ZINC000875030373	ED	On-Demand	Anodyne	HCN4	44	34
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@@H]2[C@H](CCN2C)C1	ZINC000875030374	ED	On-Demand	Anodyne	HCN1	52	35
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@@H]2[C@H](CCN2C)C1	ZINC000875030374	ED	On-Demand	Anodyne	HCN4	44	34
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@@H]2[C@@H](CCN2C)C1	ZINC000875030375	ED	On-Demand	Anodyne	HCN1	52	35
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@@H]2[C@@H](CCN2C)C1	ZINC000875030375	ED	On-Demand	Anodyne	HCN4	44	34
CC(C)(C)OC(=O)CN1CCC(NC(=O)C(=O)NCc2cccc(F)c2)CC1	ZINC000875030388	GD	On-Demand	Anodyne	DRD2	15	47
CC(C)(C)OC(=O)CN1CCC(NC(=O)C(=O)NCc2cccc(F)c2)CC1	ZINC000875030388	GD	On-Demand	Anodyne	SIGMAR1	17	48
CC(C)(C)OC(=O)CN1CCC(NC(=O)C(=O)NCc2cccc(F)c2)CC1	ZINC000875030388	GD	On-Demand	Anodyne	CCR3	35	41
CC(C)(C)OC(=O)CN1CCC(NC(=O)C(=O)NCc2cccc(F)c2)CC1	ZINC000875030388	GD	On-Demand	Anodyne	CCR5	48	33
CC(C)(C)OC(=O)CN1CCC(NC(=O)C(=O)NCc2cccc(F)c2)CC1	ZINC000875030388	GD	On-Demand	Anodyne	MCHR1	21	46
CCOc1ccccc1CNC(=O)C(=O)N1CCCCCCNC(=O)CC1	ZINC000875030389	GD	On-Demand	Anodyne	HCN1	52	38
CCOc1ccccc1CNC(=O)C(=O)N1CCCCCCNC(=O)CC1	ZINC000875030389	GD	On-Demand	Anodyne	HCN4	44	34
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NCc3cccc(F)c3)C2)c1	ZINC000875030406	GD	On-Demand	Anodyne	DRD4	27	42
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NCc3cccc(F)c3)C2)c1	ZINC000875030406	GD	On-Demand	Anodyne	CHRM3	18	41
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NCc3cccc(F)c3)C2)c1	ZINC000875030406	GD	On-Demand	Anodyne	CCR3	26	47
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NCc3cccc(F)c3)C2)c1	ZINC000875030407	GD	On-Demand	Anodyne	DRD4	27	42
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NCc3cccc(F)c3)C2)c1	ZINC000875030407	GD	On-Demand	Anodyne	CHRM3	18	41
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NCc3cccc(F)c3)C2)c1	ZINC000875030407	GD	On-Demand	Anodyne	CCR3	26	47
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875030409	ED	On-Demand	Anodyne	HCN1	49	33
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875030409	ED	On-Demand	Anodyne	HCN4	42	33
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875030411	ED	On-Demand	Anodyne	HCN1	49	33
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875030411	ED	On-Demand	Anodyne	HCN4	42	33
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875030413	ED	On-Demand	Anodyne	HCN1	49	33
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875030413	ED	On-Demand	Anodyne	HCN4	42	33
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875030415	ED	On-Demand	Anodyne	HCN1	49	33
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875030415	ED	On-Demand	Anodyne	HCN4	42	33
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)C1=CN2CCS(=O)(=O)N=C2C=C1	ZINC000875030417	IE	On-Demand	Anodyne	SCD	30	46
O=C(NCCc1cccnc1)C(=O)N1CCc2c(cccc2C(F)(F)F)C1	ZINC000875030419	GE	On-Demand	Anodyne	SCD1	15	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2cccc(F)c2)C1	ZINC000875030421	DD	On-Demand	Anodyne	CACNA1G	27	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2cccc(F)c2)C1	ZINC000875030422	DD	On-Demand	Anodyne	CACNA1G	27	40
O=C(NCCCOc1ccccc1F)N1CC=CC1	ZINC000875030423	CE	On-Demand	Anodyne	ASAH1	41	31
CO[C@H]1CCN([C@@H]2CCC[C@@H]2N(C)C(=O)C(=O)NCCc2cccnc2)C1	ZINC000875030426	FC	On-Demand	Anodyne	CHRNA7	45	37
CCOc1ccccc1CNC(=O)C(=O)N1C[C@H](OC)CC[C@@H]1C	ZINC000875030430	ED	On-Demand	Anodyne	HCN1	47	32
CCOc1ccccc1CNC(=O)C(=O)N1C[C@H](OC)CC[C@@H]1C	ZINC000875030430	ED	On-Demand	Anodyne	HCN4	41	32
CCOc1ccccc1CNC(=O)C(=O)N1C[C@@H](OC)CC[C@H]1C	ZINC000875030432	ED	On-Demand	Anodyne	HCN1	47	32
CCOc1ccccc1CNC(=O)C(=O)N1C[C@@H](OC)CC[C@H]1C	ZINC000875030432	ED	On-Demand	Anodyne	HCN4	41	32
CCOc1ccccc1CNC(=O)C(=O)N1C[C@H](OC)CC[C@H]1C	ZINC000875030434	ED	On-Demand	Anodyne	HCN1	47	32
CCOc1ccccc1CNC(=O)C(=O)N1C[C@H](OC)CC[C@H]1C	ZINC000875030434	ED	On-Demand	Anodyne	HCN4	41	32
CCOc1ccccc1CNC(=O)C(=O)N1C[C@@H](OC)CC[C@@H]1C	ZINC000875030436	ED	On-Demand	Anodyne	HCN1	47	32
CCOc1ccccc1CNC(=O)C(=O)N1C[C@@H](OC)CC[C@@H]1C	ZINC000875030436	ED	On-Demand	Anodyne	HCN4	41	32
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCOc1ccccc1F	ZINC000875030439	FE	On-Demand	Anodyne	SLC6A3	45	39
Cn1ccnc1[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1ccccc1F	ZINC000875030440	GD	On-Demand	Anodyne	CACNA1H	43	34
Cn1ccnc1[C@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1ccccc1F	ZINC000875030441	GD	On-Demand	Anodyne	CACNA1H	43	34
O=CN1CCCN(C(=O)NCc2ccc(Oc3ccc(F)cc3)cc2)CC1	ZINC000875030443	FF	On-Demand	Anodyne	NPSR1	25	42
CN(C)C[C@@H]1CN(C(=O)C(=O)NCCc2cccnc2)C[C@H]1CN(C)C	ZINC000875030458	FB	On-Demand	Anodyne	CHRNA7	41	38
CN(C)C[C@@H]1CN(C(=O)C(=O)NCCc2cccnc2)C[C@H]1CN(C)C	ZINC000875030458	FB	On-Demand	Anodyne	NAMPT	38	40
CCOc1ccccc1CNC(=O)C(=O)N1CCC[C@@H]1c1cncc(C)c1	ZINC000875030461	FF	On-Demand	Anodyne	SSTR5	40	43
CCOc1ccccc1CNC(=O)C(=O)N1CCC[C@@H]1c1cncc(C)c1	ZINC000875030461	FF	On-Demand	Anodyne	HCN1	44	33
CCOc1ccccc1CNC(=O)C(=O)N1CCC[C@@H]1c1cncc(C)c1	ZINC000875030461	FF	On-Demand	Anodyne	HCN4	42	33
CCOc1ccccc1CNC(=O)C(=O)N1CCC[C@H]1c1cncc(C)c1	ZINC000875030463	FF	On-Demand	Anodyne	SSTR5	40	43
CCOc1ccccc1CNC(=O)C(=O)N1CCC[C@H]1c1cncc(C)c1	ZINC000875030463	FF	On-Demand	Anodyne	HCN1	44	33
CCOc1ccccc1CNC(=O)C(=O)N1CCC[C@H]1c1cncc(C)c1	ZINC000875030463	FF	On-Demand	Anodyne	HCN4	42	33
Cn1cc(/C=C/C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)cn1	ZINC000875030465	FG	On-Demand	Anodyne	SCD1	37	42
Cn1cc(/C=C/C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)cn1	ZINC000875030465	FG	On-Demand	Anodyne	SCD	33	51
O=C(NCCc1cccnc1)C(=O)N1CCN(Cc2cc3ccccc3[nH]2)CC1	ZINC000875030466	GD	On-Demand	Anodyne	PTAFR	20	41
Cn1cc(/C=C\C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)cn1	ZINC000875030467	FG	On-Demand	Anodyne	SCD1	37	42
Cn1cc(/C=C\C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)cn1	ZINC000875030467	FG	On-Demand	Anodyne	SCD	33	51
O=C(NCCO)C1CCN(C(=O)NCCOc2ccc3ccccc3c2)CC1	ZINC000875030469	GD	On-Demand	Anodyne	MTNR1A	31	49
O=C(NCCO)C1CCN(C(=O)NCCOc2ccc3ccccc3c2)CC1	ZINC000875030469	GD	On-Demand	Anodyne	MTNR1B	26	49
O=C(NCCO)C1CCN(C(=O)NCCOc2ccc3ccccc3c2)CC1	ZINC000875030469	GD	On-Demand	Anodyne	EPHX2	21	45
O=C(NCCc1cccnc1)C(=O)N1CCN(c2cccc(F)c2)CC1	ZINC000875030471	FD	On-Demand	Anodyne	PTAFR	23	42
O=C(NCCc1cccnc1)C(=O)N1CCN(c2cccc(F)c2)CC1	ZINC000875030471	FD	On-Demand	Anodyne	CHRNA7	38	42
O=C(NCCc1cccnc1)C(=O)NCC1CC=CC1	ZINC000875030483	CC	On-Demand	Anodyne	TBXAS1	42	41
O=C(NCCc1cccnc1)C(=O)NCC1CC=CC1	ZINC000875030483	CC	On-Demand	Anodyne	PTAFR	28	41
O=C(NCCc1cccnc1)C(=O)NCC1CC=CC1	ZINC000875030483	CC	On-Demand	Anodyne	CHRNA7	48	38
O=C(NCCc1cccnc1)C(=O)NCC1CC=CC1	ZINC000875030483	CC	On-Demand	Anodyne	NAMPT	43	42
COc1ccc([C@@H]2CN(C(=O)C(=O)NCc3cccc(F)c3)CCO2)cc1	ZINC000875030493	FE	On-Demand	Anodyne	CCR3	16	43
C=CCCC(C)(C)CNC(=O)C(=O)NCCc1cccnc1	ZINC000875030504	DD	On-Demand	Mild	TBXAS1	50	38
C=CCCC(C)(C)CNC(=O)C(=O)NCCc1cccnc1	ZINC000875030504	DD	On-Demand	Mild	PTAFR	24	41
O=C(CCS(=O)(=O)c1ccc(F)cc1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875030506	IH	On-Demand	Anodyne	SCD1	36	41
O=C(CCS(=O)(=O)c1ccc(F)cc1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875030506	IH	On-Demand	Anodyne	SCD	31	47
CCOc1ccccc1CNC(=O)C(=O)NCc1cnn(CC)n1	ZINC000875030509	EC	On-Demand	Anodyne	HCN1	50	34
CCOc1ccccc1CNC(=O)C(=O)NCc1cnn(CC)n1	ZINC000875030509	EC	On-Demand	Anodyne	HCN4	42	34
CCO[C@H]1COCC[C@H]1CC(=O)N[C@H](c1nc2ccccc2[nH]1)C(C)C	ZINC000875030513	FG	On-Demand	Anodyne	MMP7	16	41
CCO[C@H]1COCC[C@@H]1CC(=O)N[C@H](c1nc2ccccc2[nH]1)C(C)C	ZINC000875030515	FG	On-Demand	Anodyne	MMP7	16	41
CCOc1ccccc1CNC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875030517	GE	On-Demand	Anodyne	ACHE	16	41
CCOc1ccccc1CNC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875030517	GE	On-Demand	Anodyne	SIRT3	41	31
CCOc1ccccc1CNC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875030517	GE	On-Demand	Anodyne	SIRT2	44	31
CCOc1ccccc1CNC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875030517	GE	On-Demand	Anodyne	SIRT1	41	31
CCOc1ccccc1CNC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875030517	GE	On-Demand	Anodyne	HCN1	69	42
CCOc1ccccc1CNC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875030517	GE	On-Demand	Anodyne	HCN4	55	41
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)C(=O)NCCc1cccnc1	ZINC000875030518	GE	On-Demand	Anodyne	FKBP1A	27	40
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)C(=O)NCCc1cccnc1	ZINC000875030518	GE	On-Demand	Anodyne	CHRNA7	43	36
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)C(=O)NCCc1cccnc1	ZINC000875030518	GE	On-Demand	Anodyne	C3AR1	42	41
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)C(=O)NCCc1cccnc1	ZINC000875030518	GE	On-Demand	Anodyne	NAMPT	34	40
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCc2cccnc2)C1	ZINC000875030539	DC	On-Demand	Anodyne	FKBP1A	22	42
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCc2cccnc2)C1	ZINC000875030539	DC	On-Demand	Anodyne	CHRNA7	44	38
Cc1ncc([C@H](C)NC(=O)C(=O)NCCc2cccnc2)s1	ZINC000875030552	DD	On-Demand	Anodyne	PTAFR	31	42
Cc1ncc([C@@H](C)NC(=O)C(=O)NCCc2cccnc2)s1	ZINC000875030553	DD	On-Demand	Anodyne	PTAFR	31	42
CC(=O)C1CCN(C(=O)NCCOc2ccc3ccccc3c2)CC1	ZINC000875030564	EG	On-Demand	Anodyne	HRH3	20	42
CC(=O)C1CCN(C(=O)NCCOc2ccc3ccccc3c2)CC1	ZINC000875030564	EG	On-Demand	Anodyne	MTNR1A	47	43
CC(=O)C1CCN(C(=O)NCCOc2ccc3ccccc3c2)CC1	ZINC000875030564	EG	On-Demand	Anodyne	MTNR1B	35	43
CC(=O)C1CCN(C(=O)NCCOc2ccc3ccccc3c2)CC1	ZINC000875030564	EG	On-Demand	Anodyne	EPHX2	29	40
C[C@H]1CC(=O)N[C@@H](C(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)C1	ZINC000875030570	GE	On-Demand	Anodyne	MMP3	19	40
C[C@H]1CC(=O)N[C@@H](C(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)C1	ZINC000875030570	GE	On-Demand	Anodyne	EPHX2	32	43
C[C@H]1CC(=O)N[C@@H](C(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)C1	ZINC000875030570	GE	On-Demand	Anodyne	TGM2	68	48
C[C@H]1CC(=O)N[C@@H](C(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)C1	ZINC000875030570	GE	On-Demand	Anodyne	MMP1	18	40
C[C@H]1CC(=O)N[C@@H](C(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)C1	ZINC000875030570	GE	On-Demand	Anodyne	F13A1	93	48
C[C@H]1CC(=O)N[C@@H](C(=O)Nc2ccc(S(=O)(=O)N3CCCCCC3)cc2)C1	ZINC000875030570	GE	On-Demand	Anodyne	NAMPT	49	44
O=C(NCCc1cccnc1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875030572	FD	On-Demand	Anodyne	F2	24	43
O=C(NCCc1cccnc1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875030572	FD	On-Demand	Anodyne	FKBP1A	47	47
O=C(NCCc1cccnc1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875030572	FD	On-Demand	Anodyne	ADRB3	56	41
O=C(NCCc1cccnc1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875030572	FD	On-Demand	Anodyne	KCNA5	20	42
O=C(NCCc1cccnc1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875030572	FD	On-Demand	Anodyne	CHRNA7	46	39
O=C(NCCc1cccnc1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875030572	FD	On-Demand	Anodyne	C3AR1	44	45
O=C(NCCc1cccnc1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875030572	FD	On-Demand	Anodyne	PREP	66	37
O=C(NCCc1cccnc1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875030572	FD	On-Demand	Anodyne	NAMPT	30	40
O=C(NCCc1cccnc1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875030573	FD	On-Demand	Anodyne	F2	24	43
O=C(NCCc1cccnc1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875030573	FD	On-Demand	Anodyne	FKBP1A	47	47
O=C(NCCc1cccnc1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875030573	FD	On-Demand	Anodyne	ADRB3	56	41
O=C(NCCc1cccnc1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875030573	FD	On-Demand	Anodyne	KCNA5	20	42
O=C(NCCc1cccnc1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875030573	FD	On-Demand	Anodyne	CHRNA7	46	39
O=C(NCCc1cccnc1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875030573	FD	On-Demand	Anodyne	C3AR1	44	45
O=C(NCCc1cccnc1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875030573	FD	On-Demand	Anodyne	PREP	66	37
O=C(NCCc1cccnc1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875030573	FD	On-Demand	Anodyne	NAMPT	30	40
O=C(NCCc1cccnc1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875030574	FD	On-Demand	Anodyne	F2	24	43
O=C(NCCc1cccnc1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875030574	FD	On-Demand	Anodyne	FKBP1A	47	47
O=C(NCCc1cccnc1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875030574	FD	On-Demand	Anodyne	ADRB3	56	41
O=C(NCCc1cccnc1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875030574	FD	On-Demand	Anodyne	KCNA5	20	42
O=C(NCCc1cccnc1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875030574	FD	On-Demand	Anodyne	CHRNA7	46	39
O=C(NCCc1cccnc1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875030574	FD	On-Demand	Anodyne	C3AR1	44	45
O=C(NCCc1cccnc1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875030574	FD	On-Demand	Anodyne	PREP	66	37
O=C(NCCc1cccnc1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875030574	FD	On-Demand	Anodyne	NAMPT	30	40
O=C(NCCc1cccnc1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875030575	FD	On-Demand	Anodyne	F2	24	43
O=C(NCCc1cccnc1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875030575	FD	On-Demand	Anodyne	FKBP1A	47	47
O=C(NCCc1cccnc1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875030575	FD	On-Demand	Anodyne	ADRB3	56	41
O=C(NCCc1cccnc1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875030575	FD	On-Demand	Anodyne	KCNA5	20	42
O=C(NCCc1cccnc1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875030575	FD	On-Demand	Anodyne	CHRNA7	46	39
O=C(NCCc1cccnc1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875030575	FD	On-Demand	Anodyne	C3AR1	44	45
O=C(NCCc1cccnc1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875030575	FD	On-Demand	Anodyne	PREP	66	37
O=C(NCCc1cccnc1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875030575	FD	On-Demand	Anodyne	NAMPT	30	40
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NCCc3cccnc3)C2)c1	ZINC000875030576	GD	On-Demand	Anodyne	PTAFR	22	40
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NCCc3cccnc3)C2)c1	ZINC000875030577	GD	On-Demand	Anodyne	PTAFR	22	40
CN(C[C@H](O)CN(C)C(=O)OC(C)(C)C)C(=O)N[C@@H]1CCc2ccccc21	ZINC000875030583	GF	On-Demand	Anodyne	XIAP	24	42
CN(C[C@H](O)CN(C)C(=O)OC(C)(C)C)C(=O)N[C@@H]1CCc2ccccc21	ZINC000875030583	GF	On-Demand	Anodyne	BIRC2	47	33
CN(C[C@H](O)CN(C)C(=O)OC(C)(C)C)C(=O)N[C@H]1CCc2ccccc21	ZINC000875030585	GF	On-Demand	Anodyne	XIAP	24	42
CN(C[C@H](O)CN(C)C(=O)OC(C)(C)C)C(=O)N[C@H]1CCc2ccccc21	ZINC000875030585	GF	On-Demand	Anodyne	BIRC2	47	33
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3ccc(C(F)(F)F)cc3)C[C@@H]1C2	ZINC000875030588	FF	On-Demand	Anodyne	CCR2	46	35
O=C(NCc1ccc(C(F)(F)F)cc1)N1CCC(CO)(CO)CC1	ZINC000875030590	ED	On-Demand	Anodyne	MTTP	29	42
O=C(NCc1ccc(C(F)(F)F)cc1)N1CCC(CO)(CO)CC1	ZINC000875030590	ED	On-Demand	Anodyne	CCR2	44	36
O=C(NCc1ccc(C(F)(F)F)cc1)N1CCC(CO)(CO)CC1	ZINC000875030590	ED	On-Demand	Anodyne	EPHX2	27	46
O=C(NCc1ccc(C(F)(F)F)cc1)N1CCC(CO)(CO)CC1	ZINC000875030590	ED	On-Demand	Anodyne	MCHR1	15	41
O=C(NCc1ccc(C(F)(F)F)cc1)N1CCC(CO)(CO)CC1	ZINC000875030590	ED	On-Demand	Anodyne	TRPM8	47	40
O=C(NCc1ccc(C(F)(F)F)cc1)N1CCC(CO)(CO)CC1	ZINC000875030590	ED	On-Demand	Anodyne	NAMPT	27	41
COC(=O)C1(O)CN(C(=O)NCc2ccc(C(F)(F)F)cc2)C1	ZINC000875030598	ED	On-Demand	Anodyne	TRPV1	15	40
COC(=O)C1(O)CN(C(=O)NCc2ccc(C(F)(F)F)cc2)C1	ZINC000875030598	ED	On-Demand	Anodyne	EPHX2	18	40
COC(=O)C1(O)CN(C(=O)NCc2ccc(C(F)(F)F)cc2)C1	ZINC000875030598	ED	On-Demand	Anodyne	NAMPT	21	40
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCc3ccccc32)CC1	ZINC000875030606	ED	On-Demand	Anodyne	EPHX2	21	48
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCc3ccccc32)CC1	ZINC000875030607	ED	On-Demand	Anodyne	EPHX2	21	48
O=C(NCCC[C@H]1C=CCC1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875030613	FG	On-Demand	Anodyne	EPHX2	32	48
O=C(NCCC[C@H]1C=CCC1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875030613	FG	On-Demand	Anodyne	L3MBTL3	40	36
O=C(NCCC[C@@H]1C=CCC1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875030615	FG	On-Demand	Anodyne	EPHX2	32	48
O=C(NCCC[C@@H]1C=CCC1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875030615	FG	On-Demand	Anodyne	L3MBTL3	40	36
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875030617	GF	On-Demand	Anodyne	EPHX2	46	46
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875030617	GF	On-Demand	Anodyne	SFRP1	57	42
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875030617	GF	On-Demand	Anodyne	L3MBTL3	51	33
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875030619	GF	On-Demand	Anodyne	EPHX2	46	46
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875030619	GF	On-Demand	Anodyne	SFRP1	57	42
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875030619	GF	On-Demand	Anodyne	L3MBTL3	51	33
O=C(N[C@H]1CCc2ccccc21)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875030623	CE	On-Demand	Anodyne	BIRC2	40	35
O=C(N[C@H]1CCc2ccccc21)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875030626	CE	On-Demand	Anodyne	BIRC2	40	35
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1cccnc1SC(F)F	ZINC000875030638	HJ	On-Demand	Anodyne	SCD1	39	42
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1cccnc1SC(F)F	ZINC000875030638	HJ	On-Demand	Anodyne	SCD	34	49
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875030656	EE	On-Demand	Anodyne	EPHX2	40	50
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875030656	EE	On-Demand	Anodyne	L3MBTL3	58	33
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCc1ccccc1C(F)(F)F	ZINC000875030662	GF	On-Demand	Anodyne	P2RX7	46	41
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCc1ccccc1C(F)(F)F	ZINC000875030662	GF	On-Demand	Anodyne	RBP4	53	34
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCc1ccccc1C(F)(F)F	ZINC000875030664	GF	On-Demand	Anodyne	P2RX7	46	41
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCc1ccccc1C(F)(F)F	ZINC000875030664	GF	On-Demand	Anodyne	RBP4	53	34
CN(C)c1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)[C@H]1CCC(=O)O1	ZINC000875030672	GD	On-Demand	Anodyne	EPHX2	26	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nnc2ccc(C(F)(F)F)cn12	ZINC000875030675	GD	On-Demand	Anodyne	SLC6A3	44	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nnc2ccc(C(F)(F)F)cn12	ZINC000875030677	GD	On-Demand	Anodyne	SLC6A3	44	46
C=CCn1c(S)nc2cc(C(=O)Nc3ncc(Cc4ccc(F)c(F)c4)s3)ccc2c1=O	ZINC000875030680	JI	On-Demand	Mild	SCD1	42	45
C=CCn1c(S)nc2cc(C(=O)Nc3ncc(Cc4ccc(F)c(F)c4)s3)ccc2c1=O	ZINC000875030680	JI	On-Demand	Mild	SCD	35	52
CN1CCN(C2CCN(C(=O)NCCN(C)c3ccccc3)CC2)CC1	ZINC000875030686	FD	On-Demand	Anodyne	L3MBTL3	76	42
O=C(N[C@H]1CCc2ccccc21)N1CC(c2ccccc2)C1	ZINC000875030696	CG	On-Demand	Anodyne	EPHX2	21	50
O=C(N[C@H]1CCc2ccccc21)N1CC(c2ccccc2)C1	ZINC000875030696	CG	On-Demand	Anodyne	RBP4	51	36
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(C(F)(F)F)cc2)C1	ZINC000875030698	FG	On-Demand	Anodyne	PPARA	16	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(C(F)(F)F)cc2)C1	ZINC000875030698	FG	On-Demand	Anodyne	TACR1	19	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(C(F)(F)F)cc2)C1	ZINC000875030698	FG	On-Demand	Anodyne	CCR2	54	36
O=C(NNc1cccc(F)c1Cl)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875030702	GG	On-Demand	Reactive	EPHX2	35	49
O=C(NNc1cccc(F)c1Cl)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875030702	GG	On-Demand	Reactive	SFRP1	34	40
O=C(NNc1cccc(F)c1Cl)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875030702	GG	On-Demand	Reactive	L3MBTL3	42	34
COCC(C)(C)CCNC(=O)C(=O)NCc1ccccc1C(F)(F)F	ZINC000875030708	FF	On-Demand	Anodyne	P2RX7	40	40
Cn1nnnc1C1CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)CC1	ZINC000875030711	GD	On-Demand	Anodyne	EPHX2	34	46
Cn1nnnc1C1CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)CC1	ZINC000875030711	GD	On-Demand	Anodyne	SMO	44	40
Cn1nnnc1C1CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)CC1	ZINC000875030711	GD	On-Demand	Anodyne	L3MBTL3	43	33
C[C@]1(C(F)(F)F)CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875030717	GG	On-Demand	Anodyne	EPHX2	72	47
C[C@]1(C(F)(F)F)CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875030717	GG	On-Demand	Anodyne	SFRP1	124	45
C[C@]1(C(F)(F)F)CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875030717	GG	On-Demand	Anodyne	WNT3	80	37
C[C@]1(C(F)(F)F)CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875030717	GG	On-Demand	Anodyne	L3MBTL3	48	33
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875030730	GF	On-Demand	Anodyne	EPHX2	31	51
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875030730	GF	On-Demand	Anodyne	L3MBTL3	60	34
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875030731	GF	On-Demand	Anodyne	EPHX2	31	51
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875030731	GF	On-Demand	Anodyne	L3MBTL3	60	34
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875030732	GF	On-Demand	Anodyne	EPHX2	31	51
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875030732	GF	On-Demand	Anodyne	L3MBTL3	60	34
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875030733	GF	On-Demand	Anodyne	EPHX2	31	51
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875030733	GF	On-Demand	Anodyne	L3MBTL3	60	34
O=C(NCc1cccc(F)c1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875030739	FE	On-Demand	Anodyne	F2	33	43
O=C(NCc1cccc(F)c1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875030739	FE	On-Demand	Anodyne	DPP4	16	41
O=C(NCc1cccc(F)c1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875030739	FE	On-Demand	Anodyne	TMPRSS11D	54	33
O=C(NCc1cccc(F)c1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875030740	FE	On-Demand	Anodyne	F2	33	43
O=C(NCc1cccc(F)c1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875030740	FE	On-Demand	Anodyne	DPP4	16	41
O=C(NCc1cccc(F)c1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875030740	FE	On-Demand	Anodyne	TMPRSS11D	54	33
O=C(NCc1cccc(F)c1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875030741	FE	On-Demand	Anodyne	F2	33	43
O=C(NCc1cccc(F)c1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875030741	FE	On-Demand	Anodyne	DPP4	16	41
O=C(NCc1cccc(F)c1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875030741	FE	On-Demand	Anodyne	TMPRSS11D	54	33
O=C(NCc1cccc(F)c1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875030742	FE	On-Demand	Anodyne	F2	33	43
O=C(NCc1cccc(F)c1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875030742	FE	On-Demand	Anodyne	DPP4	16	41
O=C(NCc1cccc(F)c1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875030742	FE	On-Demand	Anodyne	TMPRSS11D	54	33
CCOc1ccccc1CNC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875030744	GC	On-Demand	Anodyne	HCN1	66	43
CCOc1ccccc1CNC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875030744	GC	On-Demand	Anodyne	HCN4	51	43
CCOc1ccccc1CNC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875030744	GC	On-Demand	Anodyne	L3MBTL3	54	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1F)c1nccn1C	ZINC000875030746	GE	On-Demand	Anodyne	SLC6A4	22	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1F)c1nccn1C	ZINC000875030746	GE	On-Demand	Anodyne	SLC6A3	49	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1F)c1nccn1C	ZINC000875030748	GE	On-Demand	Anodyne	SLC6A4	22	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1F)c1nccn1C	ZINC000875030748	GE	On-Demand	Anodyne	SLC6A3	49	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1F)c1nccn1C	ZINC000875030750	GE	On-Demand	Anodyne	SLC6A4	22	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1F)c1nccn1C	ZINC000875030750	GE	On-Demand	Anodyne	SLC6A3	49	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1F)c1nccn1C	ZINC000875030752	GE	On-Demand	Anodyne	SLC6A4	22	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1F)c1nccn1C	ZINC000875030752	GE	On-Demand	Anodyne	SLC6A3	49	42
O=C(NCc1ccc(C(F)(F)F)cc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875030755	FH	On-Demand	Anodyne	CCR2	42	37
O=C(NCc1ccc(C(F)(F)F)cc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875030758	FH	On-Demand	Anodyne	CCR2	42	37
O=C(N[C@@H]1CCc2ccccc21)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875030772	EH	On-Demand	Anodyne	XIAP	31	45
O=C(N[C@@H]1CCc2ccccc21)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875030772	EH	On-Demand	Anodyne	BIRC2	40	34
O=C(N[C@@H]1CCc2ccccc21)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875030782	EH	On-Demand	Anodyne	XIAP	31	45
O=C(N[C@@H]1CCc2ccccc21)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875030782	EH	On-Demand	Anodyne	BIRC2	40	34
O=C(N[C@@H]1CCc2ccccc21)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875030785	EH	On-Demand	Anodyne	XIAP	31	45
O=C(N[C@@H]1CCc2ccccc21)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875030785	EH	On-Demand	Anodyne	BIRC2	40	34
O=C(N[C@@H]1CCc2ccccc21)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875030789	EH	On-Demand	Anodyne	XIAP	31	45
O=C(N[C@@H]1CCc2ccccc21)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875030789	EH	On-Demand	Anodyne	BIRC2	40	34
COC(=O)N(C)NC(=O)N[C@@H]1CCc2ccccc21	ZINC000875030791	CD	On-Demand	Reactive	XIAP	20	40
COC(=O)N(C)NC(=O)N[C@H]1CCc2ccccc21	ZINC000875030794	CD	On-Demand	Reactive	XIAP	20	40
CC(C)(C)OC(=O)NCCNC(=O)C(=O)N[C@H](CF)c1ccc(F)cc1	ZINC000875030798	FD	On-Demand	Anodyne	PAPA1_CARPA	32	43
CC(C)(C)OC(=O)NCCNC(=O)C(=O)N[C@@H](CF)c1ccc(F)cc1	ZINC000875030801	FD	On-Demand	Anodyne	PAPA1_CARPA	32	43
O=C(NCC[C@@H]1CCCS1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875030802	FF	On-Demand	Anodyne	EPHX2	41	52
O=C(NCC[C@@H]1CCCS1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875030802	FF	On-Demand	Anodyne	SFRP1	68	41
O=C(NCC[C@@H]1CCCS1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875030802	FF	On-Demand	Anodyne	WNT3	46	35
O=C(NCC[C@@H]1CCCS1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875030802	FF	On-Demand	Anodyne	L3MBTL3	65	35
O=C(NCC[C@H]1CCCS1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875030805	FF	On-Demand	Anodyne	EPHX2	41	52
O=C(NCC[C@H]1CCCS1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875030805	FF	On-Demand	Anodyne	SFRP1	68	41
O=C(NCC[C@H]1CCCS1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875030805	FF	On-Demand	Anodyne	WNT3	46	35
O=C(NCC[C@H]1CCCS1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875030805	FF	On-Demand	Anodyne	L3MBTL3	65	35
O=C(NCC[C@H]1CCSC1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875030806	FF	On-Demand	Anodyne	EPHX2	35	52
O=C(NCC[C@H]1CCSC1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875030806	FF	On-Demand	Anodyne	L3MBTL3	42	32
C=CC(C)(C)CCCNC(=O)C(=O)NCc1ccc(OC)cc1OC	ZINC000875030807	EE	On-Demand	Mild	MTNR1B	29	42
CCOc1ccccc1CNC(=O)C(=O)NCC1(OC(C)C)CCC1	ZINC000875030808	EE	On-Demand	Anodyne	HCN1	74	39
CCOc1ccccc1CNC(=O)C(=O)NCC1(OC(C)C)CCC1	ZINC000875030808	EE	On-Demand	Anodyne	HCN4	58	39
O=C(NCC[C@@H]1CCSC1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875030809	FF	On-Demand	Anodyne	EPHX2	35	52
O=C(NCC[C@@H]1CCSC1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875030809	FF	On-Demand	Anodyne	L3MBTL3	42	32
Cn1cnc(-c2nnc3n2CCN(C(=O)C(=O)NCc2cccc(F)c2)C3)c1	ZINC000875030815	GC	On-Demand	Anodyne	P2RX7	27	42
COC(=O)C1(O)CN(C(=O)NCCCOc2cccc(C)c2)C1	ZINC000875030818	DC	On-Demand	Anodyne	DRD4	15	48
COC(=O)C1(O)CN(C(=O)NCCCOc2cccc(C)c2)C1	ZINC000875030818	DC	On-Demand	Anodyne	HRH2	36	41
COC(=O)C1(O)CN(C(=O)NCCCOc2cccc(C)c2)C1	ZINC000875030818	DC	On-Demand	Anodyne	MTNR1A	22	42
COC(=O)C1(O)CN(C(=O)NCCCOc2cccc(C)c2)C1	ZINC000875030818	DC	On-Demand	Anodyne	MTNR1B	19	42
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCSc3ccc(Cl)cc32)CC1	ZINC000875030823	GE	On-Demand	Anodyne	EPHX2	19	48
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCSc3ccc(Cl)cc32)CC1	ZINC000875030826	GE	On-Demand	Anodyne	EPHX2	19	48
O=C(NCc1ccc(Oc2ccc(F)cc2)cc1)N1CCC2(CCNC2=O)CC1	ZINC000875030831	GG	On-Demand	Anodyne	CACNA1H	47	33
O=C(NCc1ccc(Oc2ccc(F)cc2)cc1)N1CCC2(CCNC2=O)CC1	ZINC000875030831	GG	On-Demand	Anodyne	S1PR2	29	41
O=C(NCc1ccc(Oc2ccc(F)cc2)cc1)N1CCC2(CCNC2=O)CC1	ZINC000875030831	GG	On-Demand	Anodyne	NPSR1	27	45
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(C(=O)c4ccccc4)CC3)C[C@@H]1C2	ZINC000875030860	GD	On-Demand	Anodyne	EPHX2	55	58
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(C(=O)c4ccccc4)CC3)C[C@@H]1C2	ZINC000875030860	GD	On-Demand	Anodyne	L3MBTL3	48	33
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@H]1CC12CCC2	ZINC000875030864	EF	On-Demand	Anodyne	EPHX2	46	60
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@H]1CC12CCC2	ZINC000875030864	EF	On-Demand	Anodyne	L3MBTL3	80	38
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@@H]1CC12CCC2	ZINC000875030866	EF	On-Demand	Anodyne	EPHX2	46	60
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@@H]1CC12CCC2	ZINC000875030866	EF	On-Demand	Anodyne	L3MBTL3	80	38
C#C[C@@H]1CC[C@@H](NC(=O)NC2CCN(C(=O)c3ccccc3)CC2)CC1	ZINC000875030868	FF	On-Demand	Mild	PREP	22	41
C#C[C@@H]1CC[C@@H](NC(=O)NC2CCN(C(=O)c3ccccc3)CC2)CC1	ZINC000875030868	FF	On-Demand	Mild	EPHX2	50	57
C#C[C@@H]1CC[C@@H](NC(=O)NC2CCN(C(=O)c3ccccc3)CC2)CC1	ZINC000875030868	FF	On-Demand	Mild	SFRP1	39	41
C#C[C@@H]1CC[C@@H](NC(=O)NC2CCN(C(=O)c3ccccc3)CC2)CC1	ZINC000875030868	FF	On-Demand	Mild	L3MBTL3	85	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875030876	GE	On-Demand	Anodyne	SLC6A4	21	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875030876	GE	On-Demand	Anodyne	SLC6A3	45	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875030876	GE	On-Demand	Anodyne	EPHX2	28	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875030876	GE	On-Demand	Anodyne	L3MBTL3	62	34
CN(C)C[C@@H]1CN(C(=O)N[C@H]2CCc3ccccc32)C[C@H]1CN(C)C	ZINC000875030884	EE	On-Demand	Anodyne	XIAP	21	40
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2CCc3ccccc32)C[C@H]1CN(C)C	ZINC000875030885	EE	On-Demand	Anodyne	XIAP	21	40
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(C(F)(F)F)cc1	ZINC000875030907	GG	On-Demand	Anodyne	SLC6A5	31	41
CS[C@@H]1C[C@@H](NC(=O)N(CCC(N)=O)Cc2ccccc2)C1	ZINC000875030915	DD	On-Demand	Anodyne	PTGES	20	45
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCc2ccccc21	ZINC000875030927	CF	On-Demand	Anodyne	XIAP	23	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCc2ccccc21	ZINC000875030927	CF	On-Demand	Anodyne	BIRC2	40	34
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCc2ccccc21	ZINC000875030928	CF	On-Demand	Anodyne	XIAP	23	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCc2ccccc21	ZINC000875030928	CF	On-Demand	Anodyne	BIRC2	40	34
CCOC1CC2(C1)C[C@H]2NC(=O)N(CCC(N)=O)Cc1ccccc1	ZINC000875030933	EE	On-Demand	Anodyne	TIMP3	61	33
CCOC1CC2(C1)C[C@@H]2NC(=O)N(CCC(N)=O)Cc1ccccc1	ZINC000875030934	EE	On-Demand	Anodyne	TIMP3	61	33
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCc2c[nH]c3cc(F)ccc23)C1	ZINC000875030960	FD	On-Demand	Anodyne	MPO	71	38
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@H]1CCCC[C@H]1F	ZINC000875030975	EF	On-Demand	Anodyne	EPHX2	58	57
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@H]1CCCC[C@H]1F	ZINC000875030975	EF	On-Demand	Anodyne	SFRP1	36	40
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@H]1CCCC[C@H]1F	ZINC000875030975	EF	On-Demand	Anodyne	L3MBTL3	86	39
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](C)c1ccc(C)cc1	ZINC000875030978	DD	On-Demand	Mild	ACACA	23	41
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](C)c1ccc(C)cc1	ZINC000875030980	DD	On-Demand	Mild	ACACA	23	41
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H](C)c1ccc(C)cc1	ZINC000875030982	DD	On-Demand	Mild	ACACA	23	41
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H](C)c1ccc(C)cc1	ZINC000875030984	DD	On-Demand	Mild	ACACA	23	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2ccccc2Cl)C1	ZINC000875031001	ED	On-Demand	Anodyne	SLC6A1	44	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2ccccc2Cl)C1	ZINC000875031001	ED	On-Demand	Anodyne	DPP7	34	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2ccccc2Cl)C1	ZINC000875031003	ED	On-Demand	Anodyne	SLC6A1	44	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2ccccc2Cl)C1	ZINC000875031003	ED	On-Demand	Anodyne	DPP7	34	43
Cc1nccnc1[C@H](C)NC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031010	FE	On-Demand	Anodyne	EPHX2	50	49
Cc1nccnc1[C@H](C)NC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031010	FE	On-Demand	Anodyne	L3MBTL3	47	33
Cc1nccnc1[C@@H](C)NC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031011	FE	On-Demand	Anodyne	EPHX2	50	49
Cc1nccnc1[C@@H](C)NC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031011	FE	On-Demand	Anodyne	L3MBTL3	47	33
CS[C@@H]1C[C@@H](NC(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875031012	EE	On-Demand	Anodyne	EPHX2	61	59
CS[C@@H]1C[C@@H](NC(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875031012	EE	On-Demand	Anodyne	L3MBTL3	75	37
O=C(NCc1ncc(Cl)s1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031013	GF	On-Demand	Anodyne	EPHX2	51	53
O=C(NCc1ncc(Cl)s1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031013	GF	On-Demand	Anodyne	L3MBTL3	41	32
CCOc1ccccc1CNC(=O)C(=O)N1CCN(C)C(C)(C)CC1	ZINC000875031042	ED	On-Demand	Anodyne	HCN1	59	38
CCOc1ccccc1CNC(=O)C(=O)N1CCN(C)C(C)(C)CC1	ZINC000875031042	ED	On-Demand	Anodyne	HCN4	45	35
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875031050	FF	On-Demand	Clean	EPHX2	39	53
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875031050	FF	On-Demand	Clean	L3MBTL3	66	38
CCOc1ccccc1CNC(=O)C(=O)NCc1ccc(C2(C)OCCO2)cc1	ZINC000875031051	GE	On-Demand	Anodyne	HCN1	48	32
CC[C@@H](NC(=O)C(=O)NCc1cccc(F)c1)c1cccc(OC)c1OC	ZINC000875031096	FF	On-Demand	Anodyne	PDS	53	43
O=C(NCc1cccc(F)c1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875031104	FF	On-Demand	Anodyne	C3AR1	38	40
O=C(NCc1cccc(F)c1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875031104	FF	On-Demand	Anodyne	NAMPT	44	36
O=C(NCc1cccc(F)c1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875031106	FF	On-Demand	Anodyne	C3AR1	38	40
O=C(NCc1cccc(F)c1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875031106	FF	On-Demand	Anodyne	NAMPT	44	36
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031113	GG	On-Demand	Anodyne	DRD4	20	46
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031113	GG	On-Demand	Anodyne	TACR1	15	41
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031113	GG	On-Demand	Anodyne	SIGMAR1	17	55
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031113	GG	On-Demand	Anodyne	CCR3	37	40
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031113	GG	On-Demand	Anodyne	EPHX2	57	51
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031113	GG	On-Demand	Anodyne	NCE103	15	47
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031113	GG	On-Demand	Anodyne	L3MBTL3	52	36
CCOc1ccccc1CNC(=O)C(=O)NCc1nn(C)cc1C(F)F	ZINC000875031123	FD	On-Demand	Anodyne	HCN1	46	31
O=C(NCc1cccc(F)c1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875031126	GE	On-Demand	Anodyne	ETHR	68	47
O=C1CCN(C(=O)C(=O)NCc2ccccc2C(F)(F)F)CCCCCCN1	ZINC000875031127	GE	On-Demand	Anodyne	P2RX7	41	40
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031135	ED	On-Demand	Anodyne	EPHX2	58	57
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031135	ED	On-Demand	Anodyne	L3MBTL3	70	35
CC[C@@H](NC(=O)C(=O)NCc1ccc(F)c(F)c1)c1cccc(OC)c1OC	ZINC000875031141	GF	On-Demand	Anodyne	PDS	49	36
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875031145	ED	On-Demand	Anodyne	HCN1	50	34
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875031145	ED	On-Demand	Anodyne	HCN4	43	34
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875031146	ED	On-Demand	Anodyne	HCN1	50	34
CCOc1ccccc1CNC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875031146	ED	On-Demand	Anodyne	HCN4	43	34
CCOc1ccccc1CNC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875031169	FD	On-Demand	Anodyne	HCN1	55	37
CCOc1ccccc1CNC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875031169	FD	On-Demand	Anodyne	HCN4	48	37
CCC[C@H](CCO)NC(=O)N[C@H]1CCc2ccccc21	ZINC000875031204	CF	On-Demand	Anodyne	XIAP	22	41
CCC[C@@H](CCO)NC(=O)N[C@H]1CCc2ccccc21	ZINC000875031205	CF	On-Demand	Anodyne	XIAP	22	41
O=C(NCCc1c[nH]c2cc(F)ccc12)C(=O)NCC[C@@H]1CCSC1	ZINC000875031210	FE	On-Demand	Anodyne	MPO	77	39
O=C(NCCc1c[nH]c2cc(F)ccc12)C(=O)NCC[C@H]1CCSC1	ZINC000875031211	FE	On-Demand	Anodyne	MPO	77	39
CC(C)(C)OC(=O)NCCCNC(=O)C(=O)NCc1cccc(F)c1F	ZINC000875031228	FD	On-Demand	Anodyne	PAPA1_CARPA	27	42
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCCNC(=O)OC(C)(C)C	ZINC000875031241	GD	On-Demand	Anodyne	DRD2	15	44
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCCNC(=O)OC(C)(C)C	ZINC000875031242	GD	On-Demand	Anodyne	DRD2	15	44
CONC(=O)C1CCN(C(=O)NCCN(C)c2ccccc2)CC1	ZINC000875031251	ED	On-Demand	Anodyne	AMY2	58	33
CONC(=O)C1CCN(C(=O)NCCN(C)c2ccccc2)CC1	ZINC000875031251	ED	On-Demand	Anodyne	EPHX2	18	40
O=C(N[C@H]1CCc2ccccc21)N[C@@H]1Cc2ccccc2NC1=O	ZINC000875031260	DF	On-Demand	Anodyne	PYGM	16	47
O=C(N[C@H]1Cc2ccccc2NC1=O)N[C@H]1CCc2ccccc21	ZINC000875031261	DF	On-Demand	Anodyne	PYGM	16	47
CC(=O)[C@H]1CCCN(C(=O)NCCN(C)c2ccccc2)C1	ZINC000875031277	DE	On-Demand	Anodyne	SLC6A1	79	40
CC(=O)[C@@H]1CCCN(C(=O)NCCN(C)c2ccccc2)C1	ZINC000875031279	DE	On-Demand	Anodyne	SLC6A1	79	40
CCOc1ccccc1CNC(=O)C(=O)N1CCO[C@H]([C@@H]2COC(C)(C)O2)C1	ZINC000875031280	GD	On-Demand	Anodyne	HCN1	47	31
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCOc2cccc(C)c2)C1	ZINC000875031286	EF	On-Demand	Anodyne	HRH2	39	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCOc1cccc(C)c1	ZINC000875031292	EE	On-Demand	Anodyne	HRH2	39	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCOc1cccc(C)c1	ZINC000875031292	EE	On-Demand	Anodyne	SLC6A3	40	40
COC(=O)N(C)NC(=O)NCCCOc1cccc(C)c1	ZINC000875031300	CD	On-Demand	Reactive	DRD4	15	49
COC(=O)N(C)NC(=O)NCCCOc1cccc(C)c1	ZINC000875031300	CD	On-Demand	Reactive	HRH2	35	43
COC(=O)N(C)NC(=O)NCCCOc1cccc(C)c1	ZINC000875031300	CD	On-Demand	Reactive	MTNR1A	43	45
COC(=O)N(C)NC(=O)NCCCOc1cccc(C)c1	ZINC000875031300	CD	On-Demand	Reactive	MTNR1B	34	45
CN1CCN(C2CCN(C(=O)C(=O)NCc3ccc(F)c(F)c3)CC2)CC1	ZINC000875031305	GC	On-Demand	Anodyne	L3MBTL3	68	40
CN1CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)Cc2cccnc21	ZINC000875031306	GE	On-Demand	Anodyne	EPHX2	24	47
CN1CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)Cc2cccnc21	ZINC000875031306	GE	On-Demand	Anodyne	SMO	40	36
COC(=O)[C@@]1(OC)CCN(C(=O)NCCCOc2cccc(C)c2)C1	ZINC000875031307	FD	On-Demand	Anodyne	HRH2	37	41
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875031314	GG	On-Demand	Anodyne	EPHX2	49	52
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875031314	GG	On-Demand	Anodyne	SFRP1	61	42
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875031314	GG	On-Demand	Anodyne	L3MBTL3	56	34
COC(=O)C1(O)CN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875031315	FC	On-Demand	Anodyne	EPHX2	44	50
COC(=O)C1(O)CN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875031315	FC	On-Demand	Anodyne	L3MBTL3	68	35
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NCc2ccccc2C(F)(F)F)CC1	ZINC000875031327	GD	On-Demand	Anodyne	P2RX7	45	37
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NCc2ccccc2C(F)(F)F)CC1	ZINC000875031327	GD	On-Demand	Anodyne	RBP4	79	36
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NCc2ccccc2C(F)(F)F)CC1	ZINC000875031327	GD	On-Demand	Anodyne	SFRP1	121	36
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NCc2ccccc2C(F)(F)F)CC1	ZINC000875031327	GD	On-Demand	Anodyne	WNT3	83	36
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1cc(Cl)c2c(c1)OCCO2	ZINC000875031337	HJ	On-Demand	Anodyne	CPT1A	15	44
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1cc(Cl)c2c(c1)OCCO2	ZINC000875031337	HJ	On-Demand	Anodyne	CPT1B	31	44
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1cc(Cl)c2c(c1)OCCO2	ZINC000875031337	HJ	On-Demand	Anodyne	SCD1	45	53
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1cc(Cl)c2c(c1)OCCO2	ZINC000875031337	HJ	On-Demand	Anodyne	SCD	37	54
CCOc1ccccc1CNC(=O)C(=O)NC1CCC(C)(N(C)C)CC1	ZINC000875031339	FE	On-Demand	Anodyne	HCN1	51	34
CCOc1ccccc1CNC(=O)C(=O)NC1CCC(C)(N(C)C)CC1	ZINC000875031339	FE	On-Demand	Anodyne	HCN4	45	34
C[C@@]1(CO)CN(C(=O)NCCCOc2ccccc2F)C[C@]1(C)CO	ZINC000875031353	FD	On-Demand	Anodyne	ASAH1	41	33
CNC(=O)NC[C@H]1COCCN1C(=O)NCCCOc1cccc(C)c1	ZINC000875031380	FD	On-Demand	Anodyne	HRH2	40	47
CNC(=O)NC[C@H]1COCCN1C(=O)NCCCOc1cccc(C)c1	ZINC000875031380	FD	On-Demand	Anodyne	AVPR1B	28	40
CNC(=O)NC[C@H]1COCCN1C(=O)NCCCOc1cccc(C)c1	ZINC000875031380	FD	On-Demand	Anodyne	EPHX2	24	40
O=C(NCC[C@H](O)C1CCCC1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031391	FF	On-Demand	Anodyne	EPHX2	47	53
O=C(NCC[C@H](O)C1CCCC1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031391	FF	On-Demand	Anodyne	L3MBTL3	77	36
O=C(NCC[C@@H](O)C1CCCC1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031393	FF	On-Demand	Anodyne	EPHX2	47	53
O=C(NCC[C@@H](O)C1CCCC1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031393	FF	On-Demand	Anodyne	L3MBTL3	77	36
CCOc1ccccc1CNC(=O)C(=O)N(C)C[C@H](C)NC(=O)OC(C)(C)C	ZINC000875031398	GE	On-Demand	Anodyne	FPR1	41	35
CCOc1ccccc1CNC(=O)C(=O)N(C)C[C@@H](C)NC(=O)OC(C)(C)C	ZINC000875031400	GE	On-Demand	Anodyne	FPR1	41	35
N#Cc1ccc2c(c1)C[C@@H](NC(=O)NC1CCN(C(=O)c3ccccc3)CC1)C2	ZINC000875031413	GF	On-Demand	Mild	EPHX2	32	49
N#Cc1ccc2c(c1)C[C@@H](NC(=O)NC1CCN(C(=O)c3ccccc3)CC1)C2	ZINC000875031413	GF	On-Demand	Mild	SFRP1	40	39
N#Cc1ccc2c(c1)C[C@@H](NC(=O)NC1CCN(C(=O)c3ccccc3)CC1)C2	ZINC000875031413	GF	On-Demand	Mild	L3MBTL3	54	34
N#Cc1ccc2c(c1)C[C@H](NC(=O)NC1CCN(C(=O)c3ccccc3)CC1)C2	ZINC000875031415	GF	On-Demand	Mild	EPHX2	32	49
N#Cc1ccc2c(c1)C[C@H](NC(=O)NC1CCN(C(=O)c3ccccc3)CC1)C2	ZINC000875031415	GF	On-Demand	Mild	SFRP1	40	39
N#Cc1ccc2c(c1)C[C@H](NC(=O)NC1CCN(C(=O)c3ccccc3)CC1)C2	ZINC000875031415	GF	On-Demand	Mild	L3MBTL3	54	34
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccccc3C(F)(F)F)CC[C@H]21	ZINC000875031423	FD	On-Demand	Anodyne	P2RX7	47	41
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccccc3C(F)(F)F)CC[C@H]21	ZINC000875031423	FD	On-Demand	Anodyne	RBP4	82	38
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccccc3C(F)(F)F)CC[C@@H]21	ZINC000875031427	FD	On-Demand	Anodyne	P2RX7	47	41
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccccc3C(F)(F)F)CC[C@@H]21	ZINC000875031427	FD	On-Demand	Anodyne	RBP4	82	38
O=C(NCc1ccc(Oc2ccc(F)cc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875031443	GF	On-Demand	Anodyne	S1PR2	31	44
O=C(NCc1ccc(Oc2ccc(F)cc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875031443	GF	On-Demand	Anodyne	NPSR1	26	44
CCCCCCCNC(=O)C(=O)NCc1cccc(F)c1	ZINC000875031445	CF	On-Demand	Mild	PLA2G7	15	43
CCCCCCCNC(=O)C(=O)NCc1cccc(F)c1	ZINC000875031445	CF	On-Demand	Mild	FAAH	15	42
CCCCCCCNC(=O)C(=O)NCc1cccc(F)c1	ZINC000875031445	CF	On-Demand	Mild	S1PR2	40	35
CCCCCCCNC(=O)C(=O)NCc1cccc(F)c1	ZINC000875031445	CF	On-Demand	Mild	ASAH1	99	36
CCCCCCCNC(=O)C(=O)NCc1cccc(F)c1	ZINC000875031445	CF	On-Demand	Mild	PDS	28	42
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCc1c[nH]c2cc(F)ccc12	ZINC000875031519	FD	On-Demand	Mild	MPO	82	39
C#CC[C@H](CCOC)NC(=O)C(=O)NCCc1c[nH]c2cc(F)ccc12	ZINC000875031520	FD	On-Demand	Mild	MPO	82	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(F)(F)F)cc1	ZINC000875031522	FF	On-Demand	Anodyne	SLC6A4	29	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(F)(F)F)cc1	ZINC000875031522	FF	On-Demand	Anodyne	SLC6A3	52	50
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(F)(F)F)cc1	ZINC000875031522	FF	On-Demand	Anodyne	CCR2	40	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(F)(F)F)cc1	ZINC000875031523	FF	On-Demand	Anodyne	SLC6A4	29	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(F)(F)F)cc1	ZINC000875031523	FF	On-Demand	Anodyne	SLC6A3	52	50
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(F)(F)F)cc1	ZINC000875031523	FF	On-Demand	Anodyne	CCR2	40	37
O=C(NCCc1c[nH]c2cc(F)ccc12)C(=O)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875031533	GE	On-Demand	Anodyne	MPO	54	35
O=C(NCCc1c[nH]c2cc(F)ccc12)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875031534	GE	On-Demand	Anodyne	MPO	54	35
O=C(NCCc1c[nH]c2cc(F)ccc12)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875031535	GE	On-Demand	Anodyne	MPO	54	35
O=C(NCCc1c[nH]c2cc(F)ccc12)C(=O)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875031536	GE	On-Demand	Anodyne	MPO	54	35
O=C(NCCN1CC[C@@H](O)C1)N[C@H]1CCc2ccccc21	ZINC000875031539	CD	On-Demand	Anodyne	HTR7	16	41
O=C(NCCN1CC[C@@H](O)C1)N[C@H]1CCc2ccccc21	ZINC000875031539	CD	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NCCN1CC[C@H](O)C1)N[C@H]1CCc2ccccc21	ZINC000875031540	CD	On-Demand	Anodyne	HTR7	16	41
O=C(NCCN1CC[C@H](O)C1)N[C@H]1CCc2ccccc21	ZINC000875031540	CD	On-Demand	Anodyne	SIGMAR1	15	40
CC[C@@H](NC(=O)N(CCC(N)=O)Cc1ccccc1)c1cccc(OC)c1OC	ZINC000875031542	GG	On-Demand	Anodyne	PTGES	24	41
O=C(NCCc1c[nH]c2cc(F)ccc12)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875031551	FE	On-Demand	Anodyne	MPO	83	39
CN(CCNC(=O)N[C@H]1CCN(CC(C)(C)O)C1)c1ccccc1	ZINC000875031564	ED	On-Demand	Anodyne	DRD4	20	40
CC(C)(C)OC(=O)NCCNC(=O)C(=O)NCc1cccc(F)c1F	ZINC000875031565	FD	On-Demand	Anodyne	P2RX7	17	41
CC(C)(C)OC(=O)NCCNC(=O)C(=O)NCc1cccc(F)c1F	ZINC000875031565	FD	On-Demand	Anodyne	PAPA1_CARPA	28	43
O=C(CS[C@@H]1CCS(=O)(=O)C1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875031578	HF	On-Demand	Anodyne	SCD	30	45
O=C(CS[C@H]1CCS(=O)(=O)C1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875031579	HF	On-Demand	Anodyne	SCD	30	45
CN1CCCC[C@H](N(C)C(=O)N[C@H]2CCc3ccccc32)C1=O	ZINC000875031580	DE	On-Demand	Anodyne	XIAP	23	42
CN1CCCC[C@H](N(C)C(=O)N[C@H]2CCc3ccccc32)C1=O	ZINC000875031580	DE	On-Demand	Anodyne	BIRC2	40	38
CN1CCCC[C@@H](N(C)C(=O)N[C@H]2CCc3ccccc32)C1=O	ZINC000875031581	DE	On-Demand	Anodyne	XIAP	23	42
CN1CCCC[C@@H](N(C)C(=O)N[C@H]2CCc3ccccc32)C1=O	ZINC000875031581	DE	On-Demand	Anodyne	BIRC2	40	38
COC(=O)c1cnc(C2CCN(C(=O)N[C@H]3CCc4ccccc43)CC2)s1	ZINC000875031582	GH	On-Demand	Anodyne	EPHX2	15	46
O=C(N[C@H]1CCc2ccccc21)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875031589	DE	On-Demand	Anodyne	CALCRL	40	35
O=C(N[C@H]1CCc2ccccc21)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875031589	DE	On-Demand	Anodyne	XIAP	19	40
O=C(N[C@H]1CCSc2ccc(Cl)cc21)N1CCC2(CCNC2=O)CC1	ZINC000875031590	GG	On-Demand	Anodyne	CACNA1H	49	34
O=C(N[C@@H]1CCSc2ccc(Cl)cc21)N1CCC2(CCNC2=O)CC1	ZINC000875031591	GG	On-Demand	Anodyne	CACNA1H	49	34
CO[C@@H]1CC[C@@H](C)N(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875031592	FF	On-Demand	Anodyne	EPHX2	29	46
CO[C@@H]1CC[C@@H](C)N(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875031592	FF	On-Demand	Anodyne	L3MBTL3	48	33
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@H]1CCc2ccc(Cl)cc21	ZINC000875031596	GH	On-Demand	Anodyne	EPHX2	37	51
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@H]1CCc2ccc(Cl)cc21	ZINC000875031596	GH	On-Demand	Anodyne	L3MBTL3	46	34
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@@H]1CCc2ccc(Cl)cc21	ZINC000875031597	GH	On-Demand	Anodyne	EPHX2	37	51
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@@H]1CCc2ccc(Cl)cc21	ZINC000875031597	GH	On-Demand	Anodyne	L3MBTL3	46	34
O=C(NC[C@@H]1CCO[C@H]1c1cn[nH]c1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031601	GE	On-Demand	Anodyne	EPHX2	19	43
Cc1cc(OCC(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)no1	ZINC000875031603	FG	On-Demand	Anodyne	SCD1	39	43
Cc1cc(OCC(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)no1	ZINC000875031603	FG	On-Demand	Anodyne	SCD	34	51
O=C(NCc1noc2ccc(F)cc12)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031614	GG	On-Demand	Anodyne	CCR3	24	41
O=C(NCc1noc2ccc(F)cc12)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031614	GG	On-Demand	Anodyne	EPHX2	30	45
C[C@H](NC(=O)NC1CCN(C(=O)c2ccccc2)CC1)[C@]12CCCC[C@@H]1C2	ZINC000875031615	FH	On-Demand	Anodyne	EPHX2	42	53
C[C@H](NC(=O)NC1CCN(C(=O)c2ccccc2)CC1)[C@]12CCCC[C@@H]1C2	ZINC000875031615	FH	On-Demand	Anodyne	L3MBTL3	58	33
C[C@H](NC(=O)NC1CCN(C(=O)c2ccccc2)CC1)[C@@]12CCCC[C@@H]1C2	ZINC000875031616	FH	On-Demand	Anodyne	EPHX2	42	53
C[C@H](NC(=O)NC1CCN(C(=O)c2ccccc2)CC1)[C@@]12CCCC[C@@H]1C2	ZINC000875031616	FH	On-Demand	Anodyne	L3MBTL3	58	33
C[C@H](NC(=O)NC1CCN(C(=O)c2ccccc2)CC1)[C@]12CCCC[C@H]1C2	ZINC000875031617	FH	On-Demand	Anodyne	EPHX2	42	53
C[C@H](NC(=O)NC1CCN(C(=O)c2ccccc2)CC1)[C@]12CCCC[C@H]1C2	ZINC000875031617	FH	On-Demand	Anodyne	L3MBTL3	58	33
C[C@H](NC(=O)NC1CCN(C(=O)c2ccccc2)CC1)[C@@]12CCCC[C@H]1C2	ZINC000875031618	FH	On-Demand	Anodyne	EPHX2	42	53
C[C@H](NC(=O)NC1CCN(C(=O)c2ccccc2)CC1)[C@@]12CCCC[C@H]1C2	ZINC000875031618	FH	On-Demand	Anodyne	L3MBTL3	58	33
C[C@]1(C(F)(F)F)CN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)CCO1	ZINC000875031626	GF	On-Demand	Anodyne	EPHX2	56	48
C[C@]1(C(F)(F)F)CN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)CCO1	ZINC000875031626	GF	On-Demand	Anodyne	SFRP1	47	39
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875031628	FF	On-Demand	Anodyne	EPHX2	46	56
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875031628	FF	On-Demand	Anodyne	L3MBTL3	61	35
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875031629	FF	On-Demand	Anodyne	EPHX2	46	56
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875031629	FF	On-Demand	Anodyne	L3MBTL3	61	35
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875031630	FF	On-Demand	Anodyne	EPHX2	46	56
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875031630	FF	On-Demand	Anodyne	L3MBTL3	61	35
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875031631	FF	On-Demand	Anodyne	EPHX2	46	56
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875031631	FF	On-Demand	Anodyne	L3MBTL3	61	35
CC[C@@H]1COCCN1CCNC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031637	GD	On-Demand	Anodyne	EPHX2	39	49
O=C(NCc1ccc(F)c(F)c1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875031638	GF	On-Demand	Anodyne	C3AR1	38	40
O=C(NCc1ccc(F)c(F)c1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875031638	GF	On-Demand	Anodyne	NAMPT	44	36
O=C(NCc1ccc(F)c(F)c1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875031639	GF	On-Demand	Anodyne	C3AR1	38	40
O=C(NCc1ccc(F)c(F)c1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875031639	GF	On-Demand	Anodyne	NAMPT	44	36
O=C(NC[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031641	FF	On-Demand	Anodyne	EPHX2	39	52
O=C(NC[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031641	FF	On-Demand	Anodyne	L3MBTL3	53	34
O=C(NC[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031642	FF	On-Demand	Anodyne	EPHX2	39	52
O=C(NC[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031642	FF	On-Demand	Anodyne	L3MBTL3	53	34
O=C(NC[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031643	FF	On-Demand	Anodyne	EPHX2	39	52
O=C(NC[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031643	FF	On-Demand	Anodyne	L3MBTL3	53	34
O=C(NC[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031644	FF	On-Demand	Anodyne	EPHX2	39	52
O=C(NC[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031644	FF	On-Demand	Anodyne	L3MBTL3	53	34
O=C(NC1CCN(C(=O)c2ccccc2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875031650	GG	On-Demand	Anodyne	GRIN2B	25	46
O=C(NC1CCN(C(=O)c2ccccc2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875031650	GG	On-Demand	Anodyne	EPHX2	66	60
O=C(NC1CCN(C(=O)c2ccccc2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875031650	GG	On-Demand	Anodyne	L3MBTL3	79	39
C[C@H](NC(=O)NC1CCN(C(=O)c2ccccc2)CC1)c1ccccc1O	ZINC000875031651	FG	On-Demand	Clean	EPHX2	46	54
C[C@H](NC(=O)NC1CCN(C(=O)c2ccccc2)CC1)c1ccccc1O	ZINC000875031651	FG	On-Demand	Clean	L3MBTL3	64	35
C[C@@H](NC(=O)NC1CCN(C(=O)c2ccccc2)CC1)c1ccccc1O	ZINC000875031652	FG	On-Demand	Clean	EPHX2	46	54
C[C@@H](NC(=O)NC1CCN(C(=O)c2ccccc2)CC1)c1ccccc1O	ZINC000875031652	FG	On-Demand	Clean	L3MBTL3	64	35
CCOC1CC2(C1)C[C@H]2NC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031653	FF	On-Demand	Anodyne	TIMP3	69	37
CCOC1CC2(C1)C[C@H]2NC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031653	FF	On-Demand	Anodyne	EPHX2	62	53
CCOC1CC2(C1)C[C@H]2NC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031653	FF	On-Demand	Anodyne	L3MBTL3	49	32
CCOC1CC2(C1)C[C@@H]2NC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031654	FF	On-Demand	Anodyne	TIMP3	69	37
CCOC1CC2(C1)C[C@@H]2NC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031654	FF	On-Demand	Anodyne	EPHX2	62	53
CCOC1CC2(C1)C[C@@H]2NC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031654	FF	On-Demand	Anodyne	L3MBTL3	49	32
CN1CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)CCC1(C)C	ZINC000875031657	FE	On-Demand	Anodyne	EPHX2	47	49
CN1CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)CCC1(C)C	ZINC000875031657	FE	On-Demand	Anodyne	L3MBTL3	59	37
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875031662	GG	On-Demand	Anodyne	PREP	25	42
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875031662	GG	On-Demand	Anodyne	EPHX2	52	53
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875031662	GG	On-Demand	Anodyne	L3MBTL3	80	41
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875031663	GG	On-Demand	Anodyne	PREP	25	42
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875031663	GG	On-Demand	Anodyne	EPHX2	52	53
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875031663	GG	On-Demand	Anodyne	L3MBTL3	80	41
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875031664	FF	On-Demand	Anodyne	EPHX2	41	53
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875031664	FF	On-Demand	Anodyne	RBP4	51	31
O=C(NC1CCN(C(=O)c2ccccc2)CC1)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875031664	FF	On-Demand	Anodyne	L3MBTL3	80	39
O=C(NCCC[C@H]1CCOC1=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031665	FD	On-Demand	Anodyne	EPHX2	36	48
O=C(NCCC[C@H]1CCOC1=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031665	FD	On-Demand	Anodyne	L3MBTL3	53	37
O=C(NCCC[C@@H]1CCOC1=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031666	FD	On-Demand	Anodyne	EPHX2	36	48
O=C(NCCC[C@@H]1CCOC1=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000875031666	FD	On-Demand	Anodyne	L3MBTL3	53	37
CCOC(=O)C1=CC[C@H](NC(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875031668	GE	On-Demand	Anodyne	EPHX2	47	48
CCOC(=O)C1=CC[C@H](NC(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875031668	GE	On-Demand	Anodyne	CCR8	29	42
CCOC(=O)C1=CC[C@H](NC(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875031668	GE	On-Demand	Anodyne	L3MBTL3	45	32
COCC1CC(NC(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875031670	EE	On-Demand	Anodyne	CHRM1	15	45
COCC1CC(NC(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875031670	EE	On-Demand	Anodyne	DRD4	20	48
COCC1CC(NC(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875031670	EE	On-Demand	Anodyne	GRIN2B	50	35
COCC1CC(NC(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875031670	EE	On-Demand	Anodyne	SIGMAR1	22	42
COCC1CC(NC(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875031670	EE	On-Demand	Anodyne	EPHX2	68	57
COCC1CC(NC(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875031670	EE	On-Demand	Anodyne	L3MBTL3	67	35
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875031672	GE	On-Demand	Anodyne	CHRM1	15	52
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875031672	GE	On-Demand	Anodyne	EPHX2	39	46
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875031672	GE	On-Demand	Anodyne	CCR8	42	39
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875031672	GE	On-Demand	Anodyne	BIRC2	25	40
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875031672	GE	On-Demand	Anodyne	L3MBTL3	56	34
O=C(N[C@H]1CCc2ccccc21)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875031682	DE	On-Demand	Anodyne	CALCRL	40	35
O=C(N[C@H]1CCc2ccccc21)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875031682	DE	On-Demand	Anodyne	XIAP	19	40
COC(=O)N(C)NC(=O)NCc1ccc(C(F)(F)F)cc1	ZINC000875031683	DE	On-Demand	Reactive	PPARA	17	42
COC(=O)N(C)NC(=O)NCc1ccc(C(F)(F)F)cc1	ZINC000875031683	DE	On-Demand	Reactive	TRPV1	16	45
COC(=O)N(C)NC(=O)NCc1ccc(C(F)(F)F)cc1	ZINC000875031683	DE	On-Demand	Reactive	PPARD	16	41
O=C(N[C@H]1CCc2ccccc21)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875031699	DH	On-Demand	Anodyne	EPHX2	17	48
O=C(N[C@H]1CCc2ccccc21)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875031700	DH	On-Demand	Anodyne	EPHX2	17	48
O=C(NCCO)C1CCN(C(=O)NCc2ccc(C(F)(F)F)cc2)CC1	ZINC000875031727	FD	On-Demand	Anodyne	MTTP	21	46
O=C(NCCO)C1CCN(C(=O)NCc2ccc(C(F)(F)F)cc2)CC1	ZINC000875031727	FD	On-Demand	Anodyne	EPHX2	36	44
O=C(NCCO)C1CCN(C(=O)NCc2ccc(C(F)(F)F)cc2)CC1	ZINC000875031727	FD	On-Demand	Anodyne	MCHR1	20	41
O=C(NCCO)C1CCN(C(=O)NCc2ccc(C(F)(F)F)cc2)CC1	ZINC000875031727	FD	On-Demand	Anodyne	CACNA1G	37	42
O=C(N[C@H]1CCc2ccccc21)N1OC2CCC1CC2	ZINC000875031735	CF	On-Demand	Anodyne	BDKRB1	17	40
O=C(N[C@H]1CCc2ccccc21)N1OC2CCC1CC2	ZINC000875031735	CF	On-Demand	Anodyne	XIAP	22	43
O=C(N[C@H]1CCc2ccccc21)N1OC2CCC1CC2	ZINC000875031735	CF	On-Demand	Anodyne	BIRC2	50	39
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCc2ccccc21	ZINC000875031742	DF	On-Demand	Anodyne	XIAP	20	40
C#CC[C@@H](COC)NC(=O)N(CCC(N)=O)Cc1ccccc1	ZINC000875031750	DD	On-Demand	Mild	PTGES	22	41
C#CC[C@H](COC)NC(=O)N(CCC(N)=O)Cc1ccccc1	ZINC000875031751	DD	On-Demand	Mild	PTGES	22	41
CN(CCNC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875031758	DE	On-Demand	Anodyne	AMY2	49	35
CN(CCNC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875031759	DE	On-Demand	Anodyne	AMY2	49	35
O=C(NCCCCC1CC1)C(=O)NCCc1c[nH]c2cc(F)ccc12	ZINC000875031766	EF	On-Demand	Anodyne	SLC6A4	19	46
O=C(NCCCCC1CC1)C(=O)NCCc1c[nH]c2cc(F)ccc12	ZINC000875031766	EF	On-Demand	Anodyne	MPO	91	42
CC(C)(C)OC(=O)NCCNC(=O)C(=O)NCC[C@@H]1CCSC1	ZINC000875031767	EC	On-Demand	Anodyne	SIRT2	15	40
CC(C)(C)OC(=O)NCCNC(=O)C(=O)NCC[C@H]1CCSC1	ZINC000875031768	EC	On-Demand	Anodyne	SIRT2	15	40
COc1ccc(-c2nnc(SCC(=O)Oc3cc(OC)cc(OC)c3)o2)cc1	ZINC000875031771	HG	On-Demand	Anodyne	GSK3B	21	52
COc1ccc(-c2nnc(SCC(=O)Oc3cc(OC)cc(OC)c3)o2)cc1	ZINC000875031771	HG	On-Demand	Anodyne	GSK3A	45	47
COc1ccc(-c2nnc(SCC(=O)Oc3cc(OC)cc(OC)c3)o2)cc1	ZINC000875031771	HG	On-Demand	Anodyne	ALOX15	46	39
NC(=O)CCN(Cc1ccccc1)C(=O)N[C@@H]1CCCC[C@@H]1F	ZINC000875031772	DE	On-Demand	Anodyne	PTGES	18	42
CN(C)C[C@@H]1CN(C(=O)NCc2ccc(C(F)(F)F)cc2)C[C@H]1CN(C)C	ZINC000875031774	GF	On-Demand	Anodyne	CCR2	45	36
CN(C)C[C@@H]1CN(C(=O)NCc2ccc(C(F)(F)F)cc2)C[C@H]1CN(C)C	ZINC000875031774	GF	On-Demand	Anodyne	MCHR1	24	41
Cc1cncc([C@@H]2CCCN2C(=O)NCCN(C)c2ccccc2)c1	ZINC000875031782	EG	On-Demand	Anodyne	PREP	62	39
Cc1cncc([C@H]2CCCN2C(=O)NCCN(C)c2ccccc2)c1	ZINC000875031783	EG	On-Demand	Anodyne	PREP	62	39
O=C(N[C@H]1CCc2ccccc21)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875031797	CE	On-Demand	Anodyne	XIAP	24	42
O=C(N[C@@H]1CCc2ccccc21)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875031801	ED	On-Demand	Anodyne	RBP4	51	39
O=C(N[C@H]1CCc2ccccc21)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875031802	ED	On-Demand	Anodyne	RBP4	51	39
CC(=O)NC[C@@H]1CCCCN1C(=O)N[C@H]1CCc2ccccc21	ZINC000875031815	DE	On-Demand	Anodyne	HCRTR1	19	42
CC(=O)NC[C@@H]1CCCCN1C(=O)N[C@H]1CCc2ccccc21	ZINC000875031815	DE	On-Demand	Anodyne	MTNR1A	15	43
CC(=O)NC[C@@H]1CCCCN1C(=O)N[C@H]1CCc2ccccc21	ZINC000875031815	DE	On-Demand	Anodyne	MTNR1B	19	43
CC(=O)NC[C@@H]1CCCCN1C(=O)N[C@H]1CCc2ccccc21	ZINC000875031815	DE	On-Demand	Anodyne	XIAP	22	42
CC(=O)NC[C@@H]1CCCCN1C(=O)N[C@H]1CCc2ccccc21	ZINC000875031815	DE	On-Demand	Anodyne	BIRC2	47	35
CN(CCNC(=O)N1CCn2c(nnc2-c2cn(C)cn2)C1)c1ccccc1	ZINC000875031817	GD	On-Demand	Anodyne	P2RX7	25	41
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)N[C@@H]2CCc3ccccc32)[C@@H](O)C1	ZINC000875031819	GE	On-Demand	Anodyne	BIRC2	44	31
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)N[C@@H]2CCc3ccccc32)[C@H](O)C1	ZINC000875031820	GE	On-Demand	Anodyne	BIRC2	44	31
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)N[C@H]2CCc3ccccc32)[C@@H](O)C1	ZINC000875031821	GE	On-Demand	Anodyne	BIRC2	44	31
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)N[C@H]2CCc3ccccc32)[C@H](O)C1	ZINC000875031822	GE	On-Demand	Anodyne	BIRC2	44	31
CN(CCNC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)c1ccccc1	ZINC000875031829	FE	On-Demand	Anodyne	SMO	39	41
CN(CCNC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)c1ccccc1	ZINC000875031829	FE	On-Demand	Anodyne	ETHR	53	35
CN(CCNC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)c1ccccc1	ZINC000875031830	FE	On-Demand	Anodyne	SMO	39	41
CN(CCNC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)c1ccccc1	ZINC000875031830	FE	On-Demand	Anodyne	ETHR	53	35
C#CC[C@@H](COC)NC(=O)C(=O)NCCc1c[nH]c2cc(F)ccc12	ZINC000875031837	ED	On-Demand	Mild	MPO	84	40
C#CC[C@H](COC)NC(=O)C(=O)NCCc1c[nH]c2cc(F)ccc12	ZINC000875031838	ED	On-Demand	Mild	MPO	84	40
O=C(N[C@H]1CCc2ccccc21)N1CCC[C@H](OC2CCC2)CC1	ZINC000875031846	EH	On-Demand	Anodyne	EPHX2	23	50
O=C(N[C@@H]1CCc2ccccc21)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875031847	EH	On-Demand	Anodyne	EPHX2	23	50
O=C(N[C@H]1CCc2ccccc21)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875031848	EH	On-Demand	Anodyne	EPHX2	23	50
O=C(N[C@@H]1CCc2ccccc21)N1CCC[C@H](OC2CCC2)CC1	ZINC000875031849	EH	On-Demand	Anodyne	EPHX2	23	50
O=C(NCc1ccc(C(F)(F)F)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875031852	DE	On-Demand	Anodyne	MTTP	17	40
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCc1c[nH]c2cc(F)ccc12	ZINC000875031863	GE	On-Demand	Anodyne	HTR1A	16	44
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCc1c[nH]c2cc(F)ccc12	ZINC000875031863	GE	On-Demand	Anodyne	HTR1D	23	44
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCc1c[nH]c2cc(F)ccc12	ZINC000875031863	GE	On-Demand	Anodyne	HTR1B	21	44
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCc1c[nH]c2cc(F)ccc12	ZINC000875031863	GE	On-Demand	Anodyne	SLC6A4	18	49
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCc1c[nH]c2cc(F)ccc12	ZINC000875031863	GE	On-Demand	Anodyne	MPO	83	39
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCc1c[nH]c2cc(F)ccc12	ZINC000875031864	GE	On-Demand	Anodyne	HTR1A	16	44
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCc1c[nH]c2cc(F)ccc12	ZINC000875031864	GE	On-Demand	Anodyne	HTR1D	23	44
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCc1c[nH]c2cc(F)ccc12	ZINC000875031864	GE	On-Demand	Anodyne	HTR1B	21	44
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCc1c[nH]c2cc(F)ccc12	ZINC000875031864	GE	On-Demand	Anodyne	SLC6A4	18	49
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCc1c[nH]c2cc(F)ccc12	ZINC000875031864	GE	On-Demand	Anodyne	MPO	83	39
COc1ccc(-c2nnc(S)n2CCC(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)cc1	ZINC000875031866	JJ	On-Demand	Anodyne	SCD1	40	44
COc1ccc(-c2nnc(S)n2CCC(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)cc1	ZINC000875031866	JJ	On-Demand	Anodyne	SCD	39	51
CN(CCNC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875031871	DD	On-Demand	Anodyne	NPY2R	26	40
CN(CCNC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875031871	DD	On-Demand	Anodyne	AMY2	46	34
CN(CCNC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875031872	DD	On-Demand	Anodyne	NPY2R	26	40
CN(CCNC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875031872	DD	On-Demand	Anodyne	AMY2	46	34
NC(=O)CCN(Cc1ccccc1)C(=O)N[C@H]1CC12CCC2	ZINC000875031883	DE	On-Demand	Anodyne	PTGES	19	41
NC(=O)CCN(Cc1ccccc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875031884	DE	On-Demand	Anodyne	PTGES	19	41
O=CN1CCCN(C(=O)NCc2ccc(C(F)(F)F)cc2)CC1	ZINC000875031894	EE	On-Demand	Anodyne	MTTP	20	43
O=CN1CCCN(C(=O)NCc2ccc(C(F)(F)F)cc2)CC1	ZINC000875031894	EE	On-Demand	Anodyne	EPHX2	19	42
O=CN1CCCN(C(=O)NCc2ccc(C(F)(F)F)cc2)CC1	ZINC000875031894	EE	On-Demand	Anodyne	DPP7	43	33
O=CN1CCCN(C(=O)NCc2ccc(C(F)(F)F)cc2)CC1	ZINC000875031894	EE	On-Demand	Anodyne	TRPM8	41	34
N#Cc1ccc2c(c1)C[C@@H](NC(=O)N(CCC(N)=O)Cc1ccccc1)C2	ZINC000875031901	FE	On-Demand	Mild	PTGES	15	44
N#Cc1ccc2c(c1)C[C@H](NC(=O)N(CCC(N)=O)Cc1ccccc1)C2	ZINC000875031902	FE	On-Demand	Mild	PTGES	15	44
CCOC(=O)[C@H](C)C1CN(C(=O)NCCN(C)c2ccccc2)C1	ZINC000875031925	ED	On-Demand	Anodyne	AMY2	45	31
CC(=O)C1CCN(C(=O)NCCN(C)c2ccccc2)CC1	ZINC000875031931	DE	On-Demand	Anodyne	CCR5	17	40
CC(C)(C)OC(=O)NCCCNC(=O)C(=O)N[C@@H](CF)c1ccc(F)cc1	ZINC000875031954	GD	On-Demand	Anodyne	PAPA1_CARPA	29	42
CC(C)(C)OC(=O)NCCCNC(=O)C(=O)N[C@H](CF)c1ccc(F)cc1	ZINC000875031955	GD	On-Demand	Anodyne	PAPA1_CARPA	29	42
CN1CCN(C(=O)N[C@H]2CCc3ccccc32)CCC1(C)C	ZINC000875031969	DF	On-Demand	Anodyne	XIAP	19	41
CN1CCN(C(=O)N[C@@H]2CCc3ccccc32)CCC1(C)C	ZINC000875031970	DF	On-Demand	Anodyne	XIAP	19	41
COc1cccc([C@@H](C)NC(=O)C(=O)N[C@H](C)c2cc3cnccc3o2)c1	ZINC000875031994	FF	On-Demand	Anodyne	ROCK1	20	50
COc1cccc([C@@H](C)NC(=O)C(=O)N[C@H](C)c2cc3cnccc3o2)c1	ZINC000875031994	FF	On-Demand	Anodyne	ROCK2	19	50
COc1cccc([C@@H](C)NC(=O)C(=O)N[C@@H](C)c2cc3cnccc3o2)c1	ZINC000875031995	FF	On-Demand	Anodyne	ROCK1	20	50
COc1cccc([C@@H](C)NC(=O)C(=O)N[C@@H](C)c2cc3cnccc3o2)c1	ZINC000875031995	FF	On-Demand	Anodyne	ROCK2	19	50
COc1cccc([C@H](C)NC(=O)C(=O)N[C@H](C)c2cc3cnccc3o2)c1	ZINC000875031996	FF	On-Demand	Anodyne	ROCK1	20	50
COc1cccc([C@H](C)NC(=O)C(=O)N[C@H](C)c2cc3cnccc3o2)c1	ZINC000875031996	FF	On-Demand	Anodyne	ROCK2	19	50
COc1cccc([C@H](C)NC(=O)C(=O)N[C@@H](C)c2cc3cnccc3o2)c1	ZINC000875031997	FF	On-Demand	Anodyne	ROCK1	20	50
COc1cccc([C@H](C)NC(=O)C(=O)N[C@@H](C)c2cc3cnccc3o2)c1	ZINC000875031997	FF	On-Demand	Anodyne	ROCK2	19	50
CCCCCCCNC(=O)C(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000875032004	FD	On-Demand	Mild	CA2	23	49
CCCCCCCNC(=O)C(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000875032004	FD	On-Demand	Mild	PTGS2	15	41
CCCCCCCNC(=O)C(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000875032004	FD	On-Demand	Mild	CA1	21	42
CCCCCCCNC(=O)C(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000875032004	FD	On-Demand	Mild	GHSR	16	44
CCCCCCCNC(=O)C(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000875032004	FD	On-Demand	Mild	S1PR2	52	40
CCCCCCCNC(=O)C(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000875032004	FD	On-Demand	Mild	CA12	16	42
CCCCCCCNC(=O)C(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000875032004	FD	On-Demand	Mild	MAPK8	22	40
CCCCCCCNC(=O)C(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000875032004	FD	On-Demand	Mild	ASAH1	87	37
COc1cccc([C@H](C)NC(=O)C(=O)N(C)CCN2CC3(CCOCC3)C2)c1	ZINC000875032015	GD	On-Demand	Anodyne	CASR	47	45
COc1cccc([C@@H](C)NC(=O)C(=O)N(C)CCN2CC3(CCOCC3)C2)c1	ZINC000875032016	GD	On-Demand	Anodyne	CASR	47	45
COc1cccc([C@H](C)NC(=O)C(=O)NCc2nn(C)cc2C(F)F)c1	ZINC000875032021	FD	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@@H](C)NC(=O)C(=O)NCc2nn(C)cc2C(F)F)c1	ZINC000875032022	FD	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@H](C)NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875032025	GG	On-Demand	Anodyne	ADRB3	19	40
COc1cccc([C@H](C)NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875032025	GG	On-Demand	Anodyne	PTAFR	31	44
COc1cccc([C@H](C)NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875032025	GG	On-Demand	Anodyne	PDE4A	21	44
COc1cccc([C@H](C)NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875032025	GG	On-Demand	Anodyne	CHRNA7	19	40
COc1cccc([C@H](C)NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875032025	GG	On-Demand	Anodyne	C3AR1	38	44
COc1cccc([C@H](C)NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875032025	GG	On-Demand	Anodyne	ROCK1	24	41
COc1cccc([C@H](C)NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875032025	GG	On-Demand	Anodyne	ROCK2	24	41
COc1cccc([C@@H](C)NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875032026	GG	On-Demand	Anodyne	ADRB3	19	40
COc1cccc([C@@H](C)NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875032026	GG	On-Demand	Anodyne	PTAFR	31	44
COc1cccc([C@@H](C)NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875032026	GG	On-Demand	Anodyne	PDE4A	21	44
COc1cccc([C@@H](C)NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875032026	GG	On-Demand	Anodyne	CHRNA7	19	40
COc1cccc([C@@H](C)NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875032026	GG	On-Demand	Anodyne	C3AR1	38	44
COc1cccc([C@@H](C)NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875032026	GG	On-Demand	Anodyne	ROCK1	24	41
COc1cccc([C@@H](C)NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875032026	GG	On-Demand	Anodyne	ROCK2	24	41
COc1cccc([C@@H](C)NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875032027	GG	On-Demand	Anodyne	ADRB3	19	40
COc1cccc([C@@H](C)NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875032027	GG	On-Demand	Anodyne	PTAFR	31	44
COc1cccc([C@@H](C)NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875032027	GG	On-Demand	Anodyne	PDE4A	21	44
COc1cccc([C@@H](C)NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875032027	GG	On-Demand	Anodyne	CHRNA7	19	40
COc1cccc([C@@H](C)NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875032027	GG	On-Demand	Anodyne	C3AR1	38	44
COc1cccc([C@@H](C)NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875032027	GG	On-Demand	Anodyne	ROCK1	24	41
COc1cccc([C@@H](C)NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875032027	GG	On-Demand	Anodyne	ROCK2	24	41
COc1cccc([C@H](C)NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875032028	GG	On-Demand	Anodyne	ADRB3	19	40
COc1cccc([C@H](C)NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875032028	GG	On-Demand	Anodyne	PTAFR	31	44
COc1cccc([C@H](C)NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875032028	GG	On-Demand	Anodyne	PDE4A	21	44
COc1cccc([C@H](C)NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875032028	GG	On-Demand	Anodyne	CHRNA7	19	40
COc1cccc([C@H](C)NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875032028	GG	On-Demand	Anodyne	C3AR1	38	44
COc1cccc([C@H](C)NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875032028	GG	On-Demand	Anodyne	ROCK1	24	41
COc1cccc([C@H](C)NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875032028	GG	On-Demand	Anodyne	ROCK2	24	41
COc1cccc([C@@H](C)NC(=O)C(=O)NCc2ccc(OC(F)F)cc2F)c1	ZINC000875032065	GF	On-Demand	Anodyne	MTNR1A	35	41
COc1cccc([C@@H](C)NC(=O)C(=O)NCc2ccc(OC(F)F)cc2F)c1	ZINC000875032065	GF	On-Demand	Anodyne	MTNR1B	35	41
COc1cccc([C@H](C)NC(=O)C(=O)NCc2ccc(OC(F)F)cc2F)c1	ZINC000875032066	GF	On-Demand	Anodyne	MTNR1A	35	41
COc1cccc([C@H](C)NC(=O)C(=O)NCc2ccc(OC(F)F)cc2F)c1	ZINC000875032066	GF	On-Demand	Anodyne	MTNR1B	35	41
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](C)c1cccc(OC)c1	ZINC000875032072	ED	On-Demand	Mild	MTNR1A	23	40
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](C)c1cccc(OC)c1	ZINC000875032072	ED	On-Demand	Mild	MTNR1B	27	40
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H](C)c1cccc(OC)c1	ZINC000875032073	ED	On-Demand	Mild	MTNR1A	23	40
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H](C)c1cccc(OC)c1	ZINC000875032073	ED	On-Demand	Mild	MTNR1B	27	40
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](C)c1cccc(OC)c1	ZINC000875032074	ED	On-Demand	Mild	MTNR1A	23	40
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](C)c1cccc(OC)c1	ZINC000875032074	ED	On-Demand	Mild	MTNR1B	27	40
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H](C)c1cccc(OC)c1	ZINC000875032075	ED	On-Demand	Mild	MTNR1A	23	40
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H](C)c1cccc(OC)c1	ZINC000875032075	ED	On-Demand	Mild	MTNR1B	27	40
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(F)cc2C(F)(F)F)CC1	ZINC000875032113	FE	On-Demand	Anodyne	P2RX7	55	52
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(F)cc2C(F)(F)F)CC1	ZINC000875032113	FE	On-Demand	Anodyne	EPHX2	22	54
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(F)cc2C(F)(F)F)CC1	ZINC000875032113	FE	On-Demand	Anodyne	SFRP1	87	33
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(F)cc2C(F)(F)F)CC1	ZINC000875032113	FE	On-Demand	Anodyne	WNT3	61	33
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCc3ccccc32)C1	ZINC000875032118	DF	On-Demand	Anodyne	ACE	36	51
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCc3ccccc32)C1	ZINC000875032118	DF	On-Demand	Anodyne	XIAP	35	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCc3ccccc32)C1	ZINC000875032118	DF	On-Demand	Anodyne	BIRC2	46	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCc3ccccc32)C1	ZINC000875032119	DF	On-Demand	Anodyne	ACE	36	51
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCc3ccccc32)C1	ZINC000875032119	DF	On-Demand	Anodyne	XIAP	35	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCc3ccccc32)C1	ZINC000875032119	DF	On-Demand	Anodyne	BIRC2	46	36
COc1cccc([C@@H](C)NC(=O)C(=O)NCCCCC2CC2)c1	ZINC000875032124	DF	On-Demand	Anodyne	DRD4	43	32
COc1cccc([C@@H](C)NC(=O)C(=O)NCCCCC2CC2)c1	ZINC000875032124	DF	On-Demand	Anodyne	MTNR1A	49	42
COc1cccc([C@@H](C)NC(=O)C(=O)NCCCCC2CC2)c1	ZINC000875032124	DF	On-Demand	Anodyne	MTNR1B	50	42
COc1cccc([C@H](C)NC(=O)C(=O)NCCCCC2CC2)c1	ZINC000875032125	DF	On-Demand	Anodyne	DRD4	43	32
COc1cccc([C@H](C)NC(=O)C(=O)NCCCCC2CC2)c1	ZINC000875032125	DF	On-Demand	Anodyne	MTNR1A	49	42
COc1cccc([C@H](C)NC(=O)C(=O)NCCCCC2CC2)c1	ZINC000875032125	DF	On-Demand	Anodyne	MTNR1B	50	42
COc1cccc([C@@H](C)NC(=O)C(=O)N2CCC(C(C)=O)CC2)c1	ZINC000875032150	ED	On-Demand	Anodyne	MTNR1A	27	41
COc1cccc([C@@H](C)NC(=O)C(=O)N2CCC(C(C)=O)CC2)c1	ZINC000875032150	ED	On-Demand	Anodyne	MTNR1B	33	41
COc1cccc([C@H](C)NC(=O)C(=O)N2CCC(C(C)=O)CC2)c1	ZINC000875032151	ED	On-Demand	Anodyne	MTNR1A	27	41
COc1cccc([C@H](C)NC(=O)C(=O)N2CCC(C(C)=O)CC2)c1	ZINC000875032151	ED	On-Demand	Anodyne	MTNR1B	33	41
COc1cccc([C@H](C)NC(=O)C(=O)N2CCC(N3CCN(C)CC3)CC2)c1	ZINC000875032156	GD	On-Demand	Anodyne	CHRM2	59	37
COc1cccc([C@H](C)NC(=O)C(=O)N2CCC(N3CCN(C)CC3)CC2)c1	ZINC000875032156	GD	On-Demand	Anodyne	L3MBTL3	45	39
COc1cccc([C@@H](C)NC(=O)C(=O)N2CCC(N3CCN(C)CC3)CC2)c1	ZINC000875032157	GD	On-Demand	Anodyne	CHRM2	59	37
COc1cccc([C@@H](C)NC(=O)C(=O)N2CCC(N3CCN(C)CC3)CC2)c1	ZINC000875032157	GD	On-Demand	Anodyne	L3MBTL3	45	39
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(F)cc2C(F)(F)F)C1	ZINC000875032163	FE	On-Demand	Anodyne	P2RX7	44	52
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(F)cc2C(F)(F)F)C1	ZINC000875032164	FE	On-Demand	Anodyne	P2RX7	44	52
C=CC(C)(C)CCCNC(=O)C(=O)N[C@@H](C)c1cccc(OC)c1	ZINC000875032170	EF	On-Demand	Mild	DRD4	40	32
C=CC(C)(C)CCCNC(=O)C(=O)N[C@H](C)c1cccc(OC)c1	ZINC000875032171	EF	On-Demand	Mild	DRD4	40	32
O=C(NCc1ccc(F)cc1C(F)(F)F)C(=O)N[C@@H]1CC12CCC2	ZINC000875032192	EF	On-Demand	Anodyne	P2RX7	24	47
O=C(NCc1ccc(F)cc1C(F)(F)F)C(=O)N[C@H]1CC12CCC2	ZINC000875032193	EF	On-Demand	Anodyne	P2RX7	24	47
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1OC)c1nccn1C	ZINC000875032210	GE	On-Demand	Anodyne	SLC6A4	21	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1OC)c1nccn1C	ZINC000875032210	GE	On-Demand	Anodyne	SLC6A3	46	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1OC)c1nccn1C	ZINC000875032211	GE	On-Demand	Anodyne	SLC6A4	21	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1OC)c1nccn1C	ZINC000875032211	GE	On-Demand	Anodyne	SLC6A3	46	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1OC)c1nccn1C	ZINC000875032212	GE	On-Demand	Anodyne	SLC6A4	21	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1OC)c1nccn1C	ZINC000875032212	GE	On-Demand	Anodyne	SLC6A3	46	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1OC)c1nccn1C	ZINC000875032213	GE	On-Demand	Anodyne	SLC6A4	21	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1OC)c1nccn1C	ZINC000875032213	GE	On-Demand	Anodyne	SLC6A3	46	43
COc1cccc([C@@H](C)NC(=O)C(=O)NCc2ncc(Br)s2)c1	ZINC000875032267	GE	On-Demand	Anodyne	ROCK1	20	41
COc1cccc([C@@H](C)NC(=O)C(=O)NCc2ncc(Br)s2)c1	ZINC000875032267	GE	On-Demand	Anodyne	MTNR1A	21	40
COc1cccc([C@@H](C)NC(=O)C(=O)NCc2ncc(Br)s2)c1	ZINC000875032267	GE	On-Demand	Anodyne	MTNR1B	22	40
COc1cccc([C@@H](C)NC(=O)C(=O)NCc2ncc(Br)s2)c1	ZINC000875032267	GE	On-Demand	Anodyne	ROCK2	23	41
COc1cccc([C@H](C)NC(=O)C(=O)NCc2ncc(Br)s2)c1	ZINC000875032268	GE	On-Demand	Anodyne	ROCK1	20	41
COc1cccc([C@H](C)NC(=O)C(=O)NCc2ncc(Br)s2)c1	ZINC000875032268	GE	On-Demand	Anodyne	MTNR1A	21	40
COc1cccc([C@H](C)NC(=O)C(=O)NCc2ncc(Br)s2)c1	ZINC000875032268	GE	On-Demand	Anodyne	MTNR1B	22	40
COc1cccc([C@H](C)NC(=O)C(=O)NCc2ncc(Br)s2)c1	ZINC000875032268	GE	On-Demand	Anodyne	ROCK2	23	41
O=C(NCCc1c[nH]c2cc(F)ccc12)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875032297	GE	On-Demand	Anodyne	MPO	67	36
O=C(NCCc1c[nH]c2cc(F)ccc12)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875032298	GE	On-Demand	Anodyne	MPO	67	36
O=C(NCCc1c[nH]c2cc(F)ccc12)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875032299	GE	On-Demand	Anodyne	MPO	67	36
O=C(NCCc1c[nH]c2cc(F)ccc12)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875032300	GE	On-Demand	Anodyne	MPO	67	36
COc1cccc([C@@H](C)NC(=O)C(=O)N2CCO[C@@H](c3ccccc3OC)C2)c1	ZINC000875032302	GE	On-Demand	Anodyne	CASR	15	41
COc1cccc([C@H](C)NC(=O)C(=O)N2CCO[C@@H](c3ccccc3OC)C2)c1	ZINC000875032303	GE	On-Demand	Anodyne	CASR	15	41
COc1cccc([C@@H](C)NC(=O)C(=O)N2CCO[C@H](c3ccccc3OC)C2)c1	ZINC000875032304	GE	On-Demand	Anodyne	CASR	15	41
COc1cccc([C@H](C)NC(=O)C(=O)N2CCO[C@H](c3ccccc3OC)C2)c1	ZINC000875032305	GE	On-Demand	Anodyne	CASR	15	41
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCCc2c[nH]c3cc(F)ccc23)c1	ZINC000875032368	GG	On-Demand	Anodyne	MPO	70	36
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCCc2c[nH]c3cc(F)ccc23)c1	ZINC000875032369	GG	On-Demand	Anodyne	MPO	70	36
CCC(CC)CNC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875032370	EE	On-Demand	Anodyne	ACE	32	42
CCC(CC)CNC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875032370	EE	On-Demand	Anodyne	FKBP1A	27	41
CCC(CC)CNC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875032371	EE	On-Demand	Anodyne	ACE	32	42
CCC(CC)CNC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875032371	EE	On-Demand	Anodyne	FKBP1A	27	41
CCC(CC)CNC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875032372	EE	On-Demand	Anodyne	ACE	32	42
CCC(CC)CNC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875032372	EE	On-Demand	Anodyne	FKBP1A	27	41
CCC(CC)CNC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875032373	EE	On-Demand	Anodyne	ACE	32	42
CCC(CC)CNC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875032373	EE	On-Demand	Anodyne	FKBP1A	27	41
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1cccc(OC)c1	ZINC000875032399	DF	On-Demand	Mild	DRD4	42	32
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1cccc(OC)c1	ZINC000875032399	DF	On-Demand	Mild	MTNR1A	80	46
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1cccc(OC)c1	ZINC000875032399	DF	On-Demand	Mild	MTNR1B	79	46
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1cccc(OC)c1	ZINC000875032399	DF	On-Demand	Mild	SOAT1	58	38
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1cccc(OC)c1	ZINC000875032399	DF	On-Demand	Mild	CAPN2	33	40
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1cccc(OC)c1	ZINC000875032399	DF	On-Demand	Mild	ASAH1	75	37
CCCCCCCNC(=O)C(=O)N[C@H](C)c1cccc(OC)c1	ZINC000875032400	DF	On-Demand	Mild	DRD4	42	32
CCCCCCCNC(=O)C(=O)N[C@H](C)c1cccc(OC)c1	ZINC000875032400	DF	On-Demand	Mild	MTNR1A	80	46
CCCCCCCNC(=O)C(=O)N[C@H](C)c1cccc(OC)c1	ZINC000875032400	DF	On-Demand	Mild	MTNR1B	79	46
CCCCCCCNC(=O)C(=O)N[C@H](C)c1cccc(OC)c1	ZINC000875032400	DF	On-Demand	Mild	SOAT1	58	38
CCCCCCCNC(=O)C(=O)N[C@H](C)c1cccc(OC)c1	ZINC000875032400	DF	On-Demand	Mild	CAPN2	33	40
CCCCCCCNC(=O)C(=O)N[C@H](C)c1cccc(OC)c1	ZINC000875032400	DF	On-Demand	Mild	ASAH1	75	37
COc1cccc([C@H](C)NC(=O)C(=O)NCC2(OC(C)C)CCC2)c1	ZINC000875032435	EE	On-Demand	Anodyne	DRD4	40	30
COc1cccc([C@@H](C)NC(=O)C(=O)NCC2(OC(C)C)CCC2)c1	ZINC000875032436	EE	On-Demand	Anodyne	DRD4	40	30
COc1cccc([C@@H](C)NC(=O)C(=O)NCc2ncc(Cl)s2)c1	ZINC000875032437	FE	On-Demand	Anodyne	ROCK1	20	41
COc1cccc([C@@H](C)NC(=O)C(=O)NCc2ncc(Cl)s2)c1	ZINC000875032437	FE	On-Demand	Anodyne	MTNR1A	21	40
COc1cccc([C@@H](C)NC(=O)C(=O)NCc2ncc(Cl)s2)c1	ZINC000875032437	FE	On-Demand	Anodyne	MTNR1B	22	40
COc1cccc([C@@H](C)NC(=O)C(=O)NCc2ncc(Cl)s2)c1	ZINC000875032437	FE	On-Demand	Anodyne	ROCK2	23	41
COc1cccc([C@H](C)NC(=O)C(=O)NCc2ncc(Cl)s2)c1	ZINC000875032438	FE	On-Demand	Anodyne	ROCK1	20	41
COc1cccc([C@H](C)NC(=O)C(=O)NCc2ncc(Cl)s2)c1	ZINC000875032438	FE	On-Demand	Anodyne	MTNR1A	21	40
COc1cccc([C@H](C)NC(=O)C(=O)NCc2ncc(Cl)s2)c1	ZINC000875032438	FE	On-Demand	Anodyne	MTNR1B	22	40
COc1cccc([C@H](C)NC(=O)C(=O)NCc2ncc(Cl)s2)c1	ZINC000875032438	FE	On-Demand	Anodyne	ROCK2	23	41
CN1CC[C@H]2CN(C(=O)C(=O)NCCc3c[nH]c4cc(F)ccc34)CC[C@H]21	ZINC000875032491	FD	On-Demand	Anodyne	HTR1D	21	42
CN1CC[C@H]2CN(C(=O)C(=O)NCCc3c[nH]c4cc(F)ccc34)CC[C@H]21	ZINC000875032491	FD	On-Demand	Anodyne	HTR1B	20	42
CN1CC[C@H]2CN(C(=O)C(=O)NCCc3c[nH]c4cc(F)ccc34)CC[C@H]21	ZINC000875032491	FD	On-Demand	Anodyne	MPO	69	36
CN1CC[C@H]2CN(C(=O)C(=O)NCCc3c[nH]c4cc(F)ccc34)CC[C@@H]21	ZINC000875032493	FD	On-Demand	Anodyne	HTR1D	21	42
CN1CC[C@H]2CN(C(=O)C(=O)NCCc3c[nH]c4cc(F)ccc34)CC[C@@H]21	ZINC000875032493	FD	On-Demand	Anodyne	HTR1B	20	42
CN1CC[C@H]2CN(C(=O)C(=O)NCCc3c[nH]c4cc(F)ccc34)CC[C@@H]21	ZINC000875032493	FD	On-Demand	Anodyne	MPO	69	36
COc1cccc([C@H](C)NC(=O)C(=O)NCc2ccc(C3(C)OCCO3)cc2)c1	ZINC000875032498	GE	On-Demand	Anodyne	DRD4	40	30
COc1cccc([C@H](C)NC(=O)C(=O)NCc2ccc(C3(C)OCCO3)cc2)c1	ZINC000875032498	GE	On-Demand	Anodyne	MTNR1A	24	41
COc1cccc([C@H](C)NC(=O)C(=O)NCc2ccc(C3(C)OCCO3)cc2)c1	ZINC000875032498	GE	On-Demand	Anodyne	MTNR1B	25	41
COc1cccc([C@@H](C)NC(=O)C(=O)NCc2ccc(C3(C)OCCO3)cc2)c1	ZINC000875032499	GE	On-Demand	Anodyne	DRD4	40	30
COc1cccc([C@@H](C)NC(=O)C(=O)NCc2ccc(C3(C)OCCO3)cc2)c1	ZINC000875032499	GE	On-Demand	Anodyne	MTNR1A	24	41
COc1cccc([C@@H](C)NC(=O)C(=O)NCc2ccc(C3(C)OCCO3)cc2)c1	ZINC000875032499	GE	On-Demand	Anodyne	MTNR1B	25	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCc2ccccc21	ZINC000875032506	DE	On-Demand	Anodyne	SLC6A4	22	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCc2ccccc21	ZINC000875032506	DE	On-Demand	Anodyne	SLC6A3	43	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCc2ccccc21	ZINC000875032507	DE	On-Demand	Anodyne	SLC6A4	22	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCc2ccccc21	ZINC000875032507	DE	On-Demand	Anodyne	SLC6A3	43	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCc2ccccc21	ZINC000875032508	DE	On-Demand	Anodyne	SLC6A4	22	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCc2ccccc21	ZINC000875032508	DE	On-Demand	Anodyne	SLC6A3	43	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCc2ccccc21	ZINC000875032509	DE	On-Demand	Anodyne	SLC6A4	22	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCc2ccccc21	ZINC000875032509	DE	On-Demand	Anodyne	SLC6A3	43	43
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)c1ccc(OC)cc1	ZINC000875032510	DD	On-Demand	Mild	ACACA	24	42
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)c1ccc(OC)cc1	ZINC000875032510	DD	On-Demand	Mild	ACACB	25	43
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](C)c1ccc(OC)cc1	ZINC000875032511	DD	On-Demand	Mild	ACACA	24	42
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](C)c1ccc(OC)cc1	ZINC000875032511	DD	On-Demand	Mild	ACACB	25	43
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](C)c1ccc(OC)cc1	ZINC000875032512	DD	On-Demand	Mild	ACACA	24	42
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](C)c1ccc(OC)cc1	ZINC000875032512	DD	On-Demand	Mild	ACACB	25	43
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)c1ccc(OC)cc1	ZINC000875032513	DD	On-Demand	Mild	ACACA	24	42
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)c1ccc(OC)cc1	ZINC000875032513	DD	On-Demand	Mild	ACACB	25	43
C[C@H](NC(=O)C(=O)NCCc1c[nH]c2cc(F)ccc12)c1ccnn1C	ZINC000875032521	FD	On-Demand	Anodyne	MPO	75	39
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](C)c1ccc(OC)cc1	ZINC000875032557	ED	On-Demand	Mild	ACACA	24	43
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](C)c1ccc(OC)cc1	ZINC000875032557	ED	On-Demand	Mild	ACACB	25	41
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H](C)c1ccc(OC)cc1	ZINC000875032558	ED	On-Demand	Mild	ACACA	24	43
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H](C)c1ccc(OC)cc1	ZINC000875032558	ED	On-Demand	Mild	ACACB	25	41
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](C)c1ccc(OC)cc1	ZINC000875032559	ED	On-Demand	Mild	ACACA	24	43
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](C)c1ccc(OC)cc1	ZINC000875032559	ED	On-Demand	Mild	ACACB	25	41
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H](C)c1ccc(OC)cc1	ZINC000875032560	ED	On-Demand	Mild	ACACA	24	43
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H](C)c1ccc(OC)cc1	ZINC000875032560	ED	On-Demand	Mild	ACACB	25	41
O=C(Cn1c(S)nc2ccccc2c1=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875032565	IH	On-Demand	Anodyne	SCD	29	43
COc1cccc([C@H](C)NC(=O)C(=O)NCCC2CCN(C(C)C)CC2)c1	ZINC000875032594	GE	On-Demand	Anodyne	DRD4	45	34
COc1cccc([C@@H](C)NC(=O)C(=O)NCCC2CCN(C(C)C)CC2)c1	ZINC000875032595	GE	On-Demand	Anodyne	DRD4	45	34
COc1ccc([C@@H]2CN(C(=O)C(=O)N[C@H](C)c3cccc(OC)c3)CCO2)cc1	ZINC000875032632	GE	On-Demand	Anodyne	EDNRA	15	40
COc1ccc([C@@H]2CN(C(=O)C(=O)N[C@@H](C)c3cccc(OC)c3)CCO2)cc1	ZINC000875032633	GE	On-Demand	Anodyne	EDNRA	15	40
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(S(C)(=O)=O)cc3)CC[C@H]21	ZINC000875032644	GC	On-Demand	Anodyne	CCR5	22	43
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(S(C)(=O)=O)cc3)CC[C@H]21	ZINC000875032644	GC	On-Demand	Anodyne	GPR119	26	41
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(S(C)(=O)=O)cc3)CC[C@H]21	ZINC000875032644	GC	On-Demand	Anodyne	NAMPT	53	37
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(S(C)(=O)=O)cc3)CC[C@@H]21	ZINC000875032645	GC	On-Demand	Anodyne	CCR5	22	43
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(S(C)(=O)=O)cc3)CC[C@@H]21	ZINC000875032645	GC	On-Demand	Anodyne	GPR119	26	41
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(S(C)(=O)=O)cc3)CC[C@@H]21	ZINC000875032645	GC	On-Demand	Anodyne	NAMPT	53	37
COc1cccc([C@@H](C)NC(=O)C(=O)NC[C@@H]2c3ccccc3CN2C)c1	ZINC000875032669	FE	On-Demand	Anodyne	DRD4	44	35
COc1cccc([C@@H](C)NC(=O)C(=O)NC[C@@H]2c3ccccc3CN2C)c1	ZINC000875032669	FE	On-Demand	Anodyne	MTNR1B	41	41
COc1cccc([C@H](C)NC(=O)C(=O)NC[C@@H]2c3ccccc3CN2C)c1	ZINC000875032670	FE	On-Demand	Anodyne	DRD4	44	35
COc1cccc([C@H](C)NC(=O)C(=O)NC[C@@H]2c3ccccc3CN2C)c1	ZINC000875032670	FE	On-Demand	Anodyne	MTNR1B	41	41
COc1cccc([C@@H](C)NC(=O)C(=O)NC[C@H]2c3ccccc3CN2C)c1	ZINC000875032671	FE	On-Demand	Anodyne	DRD4	44	35
COc1cccc([C@@H](C)NC(=O)C(=O)NC[C@H]2c3ccccc3CN2C)c1	ZINC000875032671	FE	On-Demand	Anodyne	MTNR1B	41	41
COc1cccc([C@H](C)NC(=O)C(=O)NC[C@H]2c3ccccc3CN2C)c1	ZINC000875032672	FE	On-Demand	Anodyne	DRD4	44	35
COc1cccc([C@H](C)NC(=O)C(=O)NC[C@H]2c3ccccc3CN2C)c1	ZINC000875032672	FE	On-Demand	Anodyne	MTNR1B	41	41
O=C(NCC[C@H]1CCSC1)C(=O)NCc1ccc(F)cc1C(F)(F)F	ZINC000875032679	GF	On-Demand	Anodyne	P2RX7	23	48
O=C(NCC[C@@H]1CCSC1)C(=O)NCc1ccc(F)cc1C(F)(F)F	ZINC000875032680	GF	On-Demand	Anodyne	P2RX7	23	48
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1ccc(OC)cc1	ZINC000875032687	DF	On-Demand	Mild	ACACA	24	40
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1ccc(OC)cc1	ZINC000875032687	DF	On-Demand	Mild	ACACB	25	40
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1ccc(OC)cc1	ZINC000875032687	DF	On-Demand	Mild	MTNR1A	48	41
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1ccc(OC)cc1	ZINC000875032687	DF	On-Demand	Mild	MTNR1B	39	41
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1ccc(OC)cc1	ZINC000875032687	DF	On-Demand	Mild	CAPN2	26	40
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1ccc(OC)cc1	ZINC000875032687	DF	On-Demand	Mild	ASAH1	92	37
CCCCCCCNC(=O)C(=O)N[C@H](C)c1ccc(OC)cc1	ZINC000875032688	DF	On-Demand	Mild	ACACA	24	40
CCCCCCCNC(=O)C(=O)N[C@H](C)c1ccc(OC)cc1	ZINC000875032688	DF	On-Demand	Mild	ACACB	25	40
CCCCCCCNC(=O)C(=O)N[C@H](C)c1ccc(OC)cc1	ZINC000875032688	DF	On-Demand	Mild	MTNR1A	48	41
CCCCCCCNC(=O)C(=O)N[C@H](C)c1ccc(OC)cc1	ZINC000875032688	DF	On-Demand	Mild	MTNR1B	39	41
CCCCCCCNC(=O)C(=O)N[C@H](C)c1ccc(OC)cc1	ZINC000875032688	DF	On-Demand	Mild	CAPN2	26	40
CCCCCCCNC(=O)C(=O)N[C@H](C)c1ccc(OC)cc1	ZINC000875032688	DF	On-Demand	Mild	ASAH1	92	37
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(F)cc3C(F)(F)F)CC[C@H]21	ZINC000875032704	GE	On-Demand	Anodyne	P2RX7	50	51
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(F)cc3C(F)(F)F)CC[C@@H]21	ZINC000875032705	GE	On-Demand	Anodyne	P2RX7	50	51
COc1cccc([C@H](C)NC(=O)C(=O)N(C)C[C@H](C)NC(=O)OC(C)(C)C)c1	ZINC000875032727	GE	On-Demand	Anodyne	MTNR1A	18	40
COc1cccc([C@H](C)NC(=O)C(=O)N(C)C[C@H](C)NC(=O)OC(C)(C)C)c1	ZINC000875032727	GE	On-Demand	Anodyne	MTNR1B	20	40
COc1cccc([C@H](C)NC(=O)C(=O)N(C)C[C@@H](C)NC(=O)OC(C)(C)C)c1	ZINC000875032728	GE	On-Demand	Anodyne	MTNR1A	18	40
COc1cccc([C@H](C)NC(=O)C(=O)N(C)C[C@@H](C)NC(=O)OC(C)(C)C)c1	ZINC000875032728	GE	On-Demand	Anodyne	MTNR1B	20	40
COc1cccc([C@@H](C)NC(=O)C(=O)N(C)C[C@H](C)NC(=O)OC(C)(C)C)c1	ZINC000875032729	GE	On-Demand	Anodyne	MTNR1A	18	40
COc1cccc([C@@H](C)NC(=O)C(=O)N(C)C[C@H](C)NC(=O)OC(C)(C)C)c1	ZINC000875032729	GE	On-Demand	Anodyne	MTNR1B	20	40
COc1cccc([C@@H](C)NC(=O)C(=O)N(C)C[C@@H](C)NC(=O)OC(C)(C)C)c1	ZINC000875032730	GE	On-Demand	Anodyne	MTNR1A	18	40
COc1cccc([C@@H](C)NC(=O)C(=O)N(C)C[C@@H](C)NC(=O)OC(C)(C)C)c1	ZINC000875032730	GE	On-Demand	Anodyne	MTNR1B	20	40
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)N[C@@H]2CCc3ccccc32)C1	ZINC000875032767	GF	On-Demand	Anodyne	EPHX2	25	45
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)N[C@@H]2CCc3ccccc32)C1	ZINC000875032767	GF	On-Demand	Anodyne	XIAP	21	40
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)N[C@@H]2CCc3ccccc32)C1	ZINC000875032767	GF	On-Demand	Anodyne	BIRC2	42	32
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)N[C@H]2CCc3ccccc32)C1	ZINC000875032768	GF	On-Demand	Anodyne	EPHX2	25	45
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)N[C@H]2CCc3ccccc32)C1	ZINC000875032768	GF	On-Demand	Anodyne	XIAP	21	40
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)N[C@H]2CCc3ccccc32)C1	ZINC000875032768	GF	On-Demand	Anodyne	BIRC2	42	32
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)N[C@@H]2CCc3ccccc32)C1	ZINC000875032769	GF	On-Demand	Anodyne	EPHX2	25	45
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)N[C@@H]2CCc3ccccc32)C1	ZINC000875032769	GF	On-Demand	Anodyne	XIAP	21	40
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)N[C@@H]2CCc3ccccc32)C1	ZINC000875032769	GF	On-Demand	Anodyne	BIRC2	42	32
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)N[C@H]2CCc3ccccc32)C1	ZINC000875032770	GF	On-Demand	Anodyne	EPHX2	25	45
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)N[C@H]2CCc3ccccc32)C1	ZINC000875032770	GF	On-Demand	Anodyne	XIAP	21	40
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)N[C@H]2CCc3ccccc32)C1	ZINC000875032770	GF	On-Demand	Anodyne	BIRC2	42	32
COc1cccc([C@@H](C)NC(=O)C(=O)N[C@@H](C)c2ccnn2C)c1	ZINC000875032775	ED	On-Demand	Anodyne	MTNR1A	21	40
COc1cccc([C@@H](C)NC(=O)C(=O)N[C@@H](C)c2ccnn2C)c1	ZINC000875032775	ED	On-Demand	Anodyne	MTNR1B	25	40
COc1cccc([C@H](C)NC(=O)C(=O)N[C@H](C)c2ccnn2C)c1	ZINC000875032776	ED	On-Demand	Anodyne	MTNR1A	21	40
COc1cccc([C@H](C)NC(=O)C(=O)N[C@H](C)c2ccnn2C)c1	ZINC000875032776	ED	On-Demand	Anodyne	MTNR1B	25	40
COc1cccc([C@H](C)NC(=O)C(=O)N[C@@H](C)c2ccnn2C)c1	ZINC000875032777	ED	On-Demand	Anodyne	MTNR1A	21	40
COc1cccc([C@H](C)NC(=O)C(=O)N[C@@H](C)c2ccnn2C)c1	ZINC000875032777	ED	On-Demand	Anodyne	MTNR1B	25	40
COc1cccc([C@@H](C)NC(=O)C(=O)N[C@H](C)c2ccnn2C)c1	ZINC000875032778	ED	On-Demand	Anodyne	MTNR1A	21	40
COc1cccc([C@@H](C)NC(=O)C(=O)N[C@H](C)c2ccnn2C)c1	ZINC000875032778	ED	On-Demand	Anodyne	MTNR1B	25	40
COCC(C)(C)CCNC(=O)C(=O)NCc1ccc(F)cc1C(F)(F)F	ZINC000875032836	GF	On-Demand	Anodyne	P2RX7	42	48
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)c1cccc(OC)c1	ZINC000875032860	DD	On-Demand	Mild	MTNR1A	27	44
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)c1cccc(OC)c1	ZINC000875032860	DD	On-Demand	Mild	MTNR1B	30	44
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](C)c1cccc(OC)c1	ZINC000875032861	DD	On-Demand	Mild	MTNR1A	27	44
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](C)c1cccc(OC)c1	ZINC000875032861	DD	On-Demand	Mild	MTNR1B	30	44
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](C)c1cccc(OC)c1	ZINC000875032862	DD	On-Demand	Mild	MTNR1A	27	44
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](C)c1cccc(OC)c1	ZINC000875032862	DD	On-Demand	Mild	MTNR1B	30	44
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)c1cccc(OC)c1	ZINC000875032863	DD	On-Demand	Mild	MTNR1A	27	44
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)c1cccc(OC)c1	ZINC000875032863	DD	On-Demand	Mild	MTNR1B	30	44
O=C(CN1C(=O)CCOc2ccccc21)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875032890	IH	On-Demand	Anodyne	SCD	29	42
COc1ccccc1[C@@H](NC(=O)NCCN1CC[C@@H](O)C1)c1nccn1C	ZINC000875032908	FC	On-Demand	Anodyne	HTR1A	25	40
COc1ccccc1[C@@H](NC(=O)NCCN1CC[C@@H](O)C1)c1nccn1C	ZINC000875032908	FC	On-Demand	Anodyne	DRD2	25	40
COc1ccccc1[C@@H](NC(=O)NCCN1CC[C@@H](O)C1)c1nccn1C	ZINC000875032908	FC	On-Demand	Anodyne	OPRK1	17	41
COc1ccccc1[C@@H](NC(=O)NCCN1CC[C@H](O)C1)c1nccn1C	ZINC000875032909	FC	On-Demand	Anodyne	HTR1A	25	40
COc1ccccc1[C@@H](NC(=O)NCCN1CC[C@H](O)C1)c1nccn1C	ZINC000875032909	FC	On-Demand	Anodyne	DRD2	25	40
COc1ccccc1[C@@H](NC(=O)NCCN1CC[C@H](O)C1)c1nccn1C	ZINC000875032909	FC	On-Demand	Anodyne	OPRK1	17	41
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1ccc(F)cc1C(F)(F)F	ZINC000875032925	FE	On-Demand	Mild	P2RX7	20	45
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1ccc(F)cc1C(F)(F)F	ZINC000875032926	FE	On-Demand	Mild	P2RX7	20	45
COc1cccc([C@@H](C)NC(=O)C(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875032935	FC	On-Demand	Anodyne	DRD4	41	31
COc1cccc([C@@H](C)NC(=O)C(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875032935	FC	On-Demand	Anodyne	MTNR1A	28	41
COc1cccc([C@@H](C)NC(=O)C(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875032935	FC	On-Demand	Anodyne	MTNR1B	35	41
COc1cccc([C@H](C)NC(=O)C(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875032936	FC	On-Demand	Anodyne	DRD4	41	31
COc1cccc([C@H](C)NC(=O)C(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875032936	FC	On-Demand	Anodyne	MTNR1A	28	41
COc1cccc([C@H](C)NC(=O)C(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875032936	FC	On-Demand	Anodyne	MTNR1B	35	41
O=C(N[C@H]1CCc2ccccc21)N1CCC(CO)(CO)CC1	ZINC000875032970	DD	On-Demand	Anodyne	EPHX2	23	63
O=C(N[C@@H]1CCc2ccccc21)N1CCC(CO)(CO)CC1	ZINC000875032971	DD	On-Demand	Anodyne	EPHX2	23	63
O=C(NCc1ccc(F)cc1C(F)(F)F)C(=O)N1CCC(CO)(CO)CC1	ZINC000875032976	GD	On-Demand	Anodyne	P2RX7	35	48
O=C(NCCc1c[nH]c2cc(F)ccc12)C(=O)N[C@H]1CC12CCC2	ZINC000875032978	EE	On-Demand	Anodyne	MPO	82	41
O=C(NCCc1c[nH]c2cc(F)ccc12)C(=O)N[C@@H]1CC12CCC2	ZINC000875032979	EE	On-Demand	Anodyne	MPO	82	41
C[C@@H]1CN(C(=O)N[C@H]2CCc3ccccc32)CC[C@H](C(F)(F)F)O1	ZINC000875032993	EG	On-Demand	Anodyne	RBP4	72	34
C[C@@H]1CN(C(=O)N[C@@H]2CCc3ccccc32)CC[C@@H](C(F)(F)F)O1	ZINC000875032994	EG	On-Demand	Anodyne	RBP4	72	34
C[C@@H]1CN(C(=O)N[C@@H]2CCc3ccccc32)CC[C@H](C(F)(F)F)O1	ZINC000875032995	EG	On-Demand	Anodyne	RBP4	72	34
C[C@@H]1CN(C(=O)N[C@H]2CCc3ccccc32)CC[C@@H](C(F)(F)F)O1	ZINC000875032996	EG	On-Demand	Anodyne	RBP4	72	34
COc1cccc([C@@H](C)NC(=O)C(=O)NCCSCCC(F)(F)F)c1	ZINC000875033003	GF	On-Demand	Anodyne	DRD4	41	31
COc1cccc([C@@H](C)NC(=O)C(=O)NCCSCCC(F)(F)F)c1	ZINC000875033003	GF	On-Demand	Anodyne	MTNR1A	31	42
COc1cccc([C@@H](C)NC(=O)C(=O)NCCSCCC(F)(F)F)c1	ZINC000875033003	GF	On-Demand	Anodyne	MTNR1B	30	42
COc1cccc([C@H](C)NC(=O)C(=O)NCCSCCC(F)(F)F)c1	ZINC000875033004	GF	On-Demand	Anodyne	DRD4	41	31
COc1cccc([C@H](C)NC(=O)C(=O)NCCSCCC(F)(F)F)c1	ZINC000875033004	GF	On-Demand	Anodyne	MTNR1A	31	42
COc1cccc([C@H](C)NC(=O)C(=O)NCCSCCC(F)(F)F)c1	ZINC000875033004	GF	On-Demand	Anodyne	MTNR1B	30	42
COc1cccc([C@@H](C)NC(=O)C(=O)NCCC[C@H]2C=CCC2)c1	ZINC000875033005	EF	On-Demand	Anodyne	DRD4	40	30
COc1cccc([C@@H](C)NC(=O)C(=O)NCCC[C@H]2C=CCC2)c1	ZINC000875033005	EF	On-Demand	Anodyne	MTNR1A	28	40
COc1cccc([C@@H](C)NC(=O)C(=O)NCCC[C@H]2C=CCC2)c1	ZINC000875033005	EF	On-Demand	Anodyne	MTNR1B	29	40
COc1cccc([C@H](C)NC(=O)C(=O)NCCC[C@H]2C=CCC2)c1	ZINC000875033006	EF	On-Demand	Anodyne	DRD4	40	30
COc1cccc([C@H](C)NC(=O)C(=O)NCCC[C@H]2C=CCC2)c1	ZINC000875033006	EF	On-Demand	Anodyne	MTNR1A	28	40
COc1cccc([C@H](C)NC(=O)C(=O)NCCC[C@H]2C=CCC2)c1	ZINC000875033006	EF	On-Demand	Anodyne	MTNR1B	29	40
COc1cccc([C@@H](C)NC(=O)C(=O)NCCC[C@@H]2C=CCC2)c1	ZINC000875033007	EF	On-Demand	Anodyne	DRD4	40	30
COc1cccc([C@@H](C)NC(=O)C(=O)NCCC[C@@H]2C=CCC2)c1	ZINC000875033007	EF	On-Demand	Anodyne	MTNR1A	28	40
COc1cccc([C@@H](C)NC(=O)C(=O)NCCC[C@@H]2C=CCC2)c1	ZINC000875033007	EF	On-Demand	Anodyne	MTNR1B	29	40
COc1cccc([C@H](C)NC(=O)C(=O)NCCC[C@@H]2C=CCC2)c1	ZINC000875033008	EF	On-Demand	Anodyne	DRD4	40	30
COc1cccc([C@H](C)NC(=O)C(=O)NCCC[C@@H]2C=CCC2)c1	ZINC000875033008	EF	On-Demand	Anodyne	MTNR1A	28	40
COc1cccc([C@H](C)NC(=O)C(=O)NCCC[C@@H]2C=CCC2)c1	ZINC000875033008	EF	On-Demand	Anodyne	MTNR1B	29	40
CCC(CC)CNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875033010	FF	On-Demand	Anodyne	ETHR	62	49
COc1cccc([C@@H](C)NC(=O)C(=O)NCC[C@@H]2CCSC2)c1	ZINC000875033042	EE	On-Demand	Anodyne	DRD4	40	31
COc1cccc([C@@H](C)NC(=O)C(=O)NCC[C@H]2CCSC2)c1	ZINC000875033043	EE	On-Demand	Anodyne	DRD4	40	31
COc1cccc([C@H](C)NC(=O)C(=O)NCC[C@@H]2CCSC2)c1	ZINC000875033044	EE	On-Demand	Anodyne	DRD4	40	31
COc1cccc([C@H](C)NC(=O)C(=O)NCC[C@H]2CCSC2)c1	ZINC000875033045	EE	On-Demand	Anodyne	DRD4	40	31
O=C(N[C@H]1CCc2ccccc21)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875033048	EG	On-Demand	Anodyne	EPHX2	15	50
O=C(N[C@H]1CCc2ccccc21)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875033048	EG	On-Demand	Anodyne	RBP4	52	39
O=C(N[C@@H]1CCc2ccccc21)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875033049	EG	On-Demand	Anodyne	EPHX2	15	50
O=C(N[C@@H]1CCc2ccccc21)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875033049	EG	On-Demand	Anodyne	RBP4	52	39
O=C(N[C@H]1CCc2ccccc21)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875033050	EG	On-Demand	Anodyne	EPHX2	15	50
O=C(N[C@H]1CCc2ccccc21)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875033050	EG	On-Demand	Anodyne	RBP4	52	39
O=C(N[C@@H]1CCc2ccccc21)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875033051	EG	On-Demand	Anodyne	EPHX2	15	50
O=C(N[C@@H]1CCc2ccccc21)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875033051	EG	On-Demand	Anodyne	RBP4	52	39
CC(=O)C1CCN(C(=O)C(=O)NCCc2c[nH]c3cc(F)ccc23)CC1	ZINC000875033052	FD	On-Demand	Anodyne	HTR1D	22	40
CC(=O)C1CCN(C(=O)C(=O)NCCc2c[nH]c3cc(F)ccc23)CC1	ZINC000875033052	FD	On-Demand	Anodyne	HTR1B	20	40
CC(=O)C1CCN(C(=O)C(=O)NCCc2c[nH]c3cc(F)ccc23)CC1	ZINC000875033052	FD	On-Demand	Anodyne	SLC6A4	15	42
CC(=O)C1CCN(C(=O)C(=O)NCCc2c[nH]c3cc(F)ccc23)CC1	ZINC000875033052	FD	On-Demand	Anodyne	MPO	84	40
COCC(C)(C)CCNC(=O)C(=O)NCCc1c[nH]c2cc(F)ccc12	ZINC000875033058	FE	On-Demand	Anodyne	MPO	87	43
COCC(C)(C)CCNC(=O)C(=O)NCCc1c[nH]c2cc(F)ccc12	ZINC000875033058	FE	On-Demand	Anodyne	MTNR1A	15	44
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2c[nH]c3cc(F)ccc23)C1	ZINC000875033065	FD	On-Demand	Anodyne	MPO	73	38
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2c[nH]c3cc(F)ccc23)C1	ZINC000875033066	FD	On-Demand	Anodyne	MPO	73	38
COCC(C)(C)CCNC(=O)C(=O)N[C@H](C)c1cccc(OC)c1	ZINC000875033067	EE	On-Demand	Anodyne	DRD4	43	32
COCC(C)(C)CCNC(=O)C(=O)N[C@H](C)c1cccc(OC)c1	ZINC000875033067	EE	On-Demand	Anodyne	MTNR1A	41	41
COCC(C)(C)CCNC(=O)C(=O)N[C@H](C)c1cccc(OC)c1	ZINC000875033067	EE	On-Demand	Anodyne	MTNR1B	43	41
COCC(C)(C)CCNC(=O)C(=O)N[C@@H](C)c1cccc(OC)c1	ZINC000875033068	EE	On-Demand	Anodyne	DRD4	43	32
COCC(C)(C)CCNC(=O)C(=O)N[C@@H](C)c1cccc(OC)c1	ZINC000875033068	EE	On-Demand	Anodyne	MTNR1A	41	41
COCC(C)(C)CCNC(=O)C(=O)N[C@@H](C)c1cccc(OC)c1	ZINC000875033068	EE	On-Demand	Anodyne	MTNR1B	43	41
CCC(CC)CNC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875033081	EC	On-Demand	Anodyne	L3MBTL3	34	40
COc1cccc([C@H](C)NC(=O)C(=O)N2CC[C@@H]3[C@@H](CCN3C)C2)c1	ZINC000875033088	ED	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@H](C)NC(=O)C(=O)N2CC[C@H]3[C@H](CCN3C)C2)c1	ZINC000875033089	ED	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@H](C)NC(=O)C(=O)N2CC[C@H]3[C@@H](CCN3C)C2)c1	ZINC000875033090	ED	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@H](C)NC(=O)C(=O)N2CC[C@@H]3[C@H](CCN3C)C2)c1	ZINC000875033091	ED	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@@H](C)NC(=O)C(=O)N[C@@H](C)c2ccc(C(F)(F)F)nc2)c1	ZINC000875033109	GG	On-Demand	Anodyne	ACACB	15	42
COc1cccc([C@@H](C)NC(=O)C(=O)N[C@@H](C)c2ccc(C(F)(F)F)nc2)c1	ZINC000875033109	GG	On-Demand	Anodyne	MTNR1A	19	41
COc1cccc([C@@H](C)NC(=O)C(=O)N[C@@H](C)c2ccc(C(F)(F)F)nc2)c1	ZINC000875033109	GG	On-Demand	Anodyne	MTNR1B	24	41
COc1cccc([C@H](C)NC(=O)C(=O)N[C@H](C)c2ccc(C(F)(F)F)nc2)c1	ZINC000875033110	GG	On-Demand	Anodyne	ACACB	15	42
COc1cccc([C@H](C)NC(=O)C(=O)N[C@H](C)c2ccc(C(F)(F)F)nc2)c1	ZINC000875033110	GG	On-Demand	Anodyne	MTNR1A	19	41
COc1cccc([C@H](C)NC(=O)C(=O)N[C@H](C)c2ccc(C(F)(F)F)nc2)c1	ZINC000875033110	GG	On-Demand	Anodyne	MTNR1B	24	41
COc1cccc([C@H](C)NC(=O)C(=O)N[C@@H](C)c2ccc(C(F)(F)F)nc2)c1	ZINC000875033111	GG	On-Demand	Anodyne	ACACB	15	42
COc1cccc([C@H](C)NC(=O)C(=O)N[C@@H](C)c2ccc(C(F)(F)F)nc2)c1	ZINC000875033111	GG	On-Demand	Anodyne	MTNR1A	19	41
COc1cccc([C@H](C)NC(=O)C(=O)N[C@@H](C)c2ccc(C(F)(F)F)nc2)c1	ZINC000875033111	GG	On-Demand	Anodyne	MTNR1B	24	41
COc1cccc([C@@H](C)NC(=O)C(=O)N[C@H](C)c2ccc(C(F)(F)F)nc2)c1	ZINC000875033112	GG	On-Demand	Anodyne	ACACB	15	42
COc1cccc([C@@H](C)NC(=O)C(=O)N[C@H](C)c2ccc(C(F)(F)F)nc2)c1	ZINC000875033112	GG	On-Demand	Anodyne	MTNR1A	19	41
COc1cccc([C@@H](C)NC(=O)C(=O)N[C@H](C)c2ccc(C(F)(F)F)nc2)c1	ZINC000875033112	GG	On-Demand	Anodyne	MTNR1B	24	41
NC(=O)CCOC(=O)c1cnn(Cc2ccccc2)c1	ZINC000875033124	CC	On-Demand	Anodyne	PLA2G2A	40	35
O=C(NCc1ccccc1Cn1ccnc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875033134	GG	On-Demand	Anodyne	CYP19A1	19	42
O=C(NCc1ccccc1Cn1ccnc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875033134	GG	On-Demand	Anodyne	TBXAS1	37	41
O=C(NCc1ccccc1Cn1ccnc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875033135	GG	On-Demand	Anodyne	CYP19A1	19	42
O=C(NCc1ccccc1Cn1ccnc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875033135	GG	On-Demand	Anodyne	TBXAS1	37	41
O=C(NCc1ccccc1Cn1ccnc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875033136	GG	On-Demand	Anodyne	CYP19A1	19	42
O=C(NCc1ccccc1Cn1ccnc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875033136	GG	On-Demand	Anodyne	TBXAS1	37	41
O=C(NCc1ccccc1Cn1ccnc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875033137	GG	On-Demand	Anodyne	CYP19A1	19	42
O=C(NCc1ccccc1Cn1ccnc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875033137	GG	On-Demand	Anodyne	TBXAS1	37	41
O=C(NCc1ccccc1Cn1ccnc1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875033151	FF	On-Demand	Anodyne	CYP19A1	19	42
O=C(NCc1ccccc1Cn1ccnc1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875033151	FF	On-Demand	Anodyne	CYP11B1	29	40
O=C(NCc1ccccc1Cn1ccnc1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875033151	FF	On-Demand	Anodyne	TBXAS1	25	40
O=C(NCc1ccccc1Cn1ccnc1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875033151	FF	On-Demand	Anodyne	CYP11B2	18	40
C=CC(C)(C)CCNC(=O)C(=O)NCc1cccc(OC(C)C)c1	ZINC000875033159	EF	On-Demand	Mild	PDS	51	34
O=C(NCc1ccccc1Cn1ccnc1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875033166	GG	On-Demand	Anodyne	CYP19A1	15	43
O=C(NCc1ccccc1Cn1ccnc1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875033166	GG	On-Demand	Anodyne	TBXAS1	33	42
O=C(NCc1ccccc1Cn1ccnc1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875033166	GG	On-Demand	Anodyne	EPHX2	15	45
O=C(NCc1ccccc1Cn1ccnc1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875033167	GG	On-Demand	Anodyne	CYP19A1	15	43
O=C(NCc1ccccc1Cn1ccnc1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875033167	GG	On-Demand	Anodyne	TBXAS1	33	42
O=C(NCc1ccccc1Cn1ccnc1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875033167	GG	On-Demand	Anodyne	EPHX2	15	45
COC(=O)N(C)NC(=O)NCCCCc1ccccc1	ZINC000875033168	CD	On-Demand	Reactive	SIGMAR1	17	41
COC(=O)N(C)NC(=O)NCCCCc1ccccc1	ZINC000875033168	CD	On-Demand	Reactive	SCN2A	21	45
COC(=O)N(C)NC(=O)NCCCCc1ccccc1	ZINC000875033168	CD	On-Demand	Reactive	MTNR1A	42	41
COC(=O)N(C)NC(=O)NCCCCc1ccccc1	ZINC000875033168	CD	On-Demand	Reactive	MTNR1B	39	41
COC(=O)N(C)NC(=O)NCCCCc1ccccc1	ZINC000875033168	CD	On-Demand	Reactive	FAAH	47	44
COC(=O)N(C)NC(=O)NCCCCc1ccccc1	ZINC000875033168	CD	On-Demand	Reactive	CES1	50	37
COC(=O)N(C)NC(=O)NCCCCc1ccccc1	ZINC000875033168	CD	On-Demand	Reactive	AMP1_PLAFQ	25	47
COC(=O)N(C)NC(=O)NCCCCc1ccccc1	ZINC000875033168	CD	On-Demand	Reactive	CRTM	49	39
O=C(NCCCCc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000875033179	CE	On-Demand	Anodyne	SIGMAR1	16	41
O=C(NCCCCc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000875033179	CE	On-Demand	Anodyne	MTNR1A	27	42
O=C(NCCCCc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000875033179	CE	On-Demand	Anodyne	MTNR1B	29	42
O=C(NCCCCc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000875033179	CE	On-Demand	Anodyne	FAAH	44	42
O=C(NCCCCc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000875033179	CE	On-Demand	Anodyne	CES1	49	35
O=C(NCCCCc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000875033179	CE	On-Demand	Anodyne	EPHX2	18	51
O=C(NCCCCc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000875033179	CE	On-Demand	Anodyne	AMP1_PLAFQ	22	44
COC(=O)N(C)NC(=O)NCc1ccccc1Cn1ccnc1	ZINC000875033185	DD	On-Demand	Reactive	CYP19A1	37	45
COC(=O)N(C)NC(=O)NCc1ccccc1Cn1ccnc1	ZINC000875033185	DD	On-Demand	Reactive	CYP11B1	52	46
COC(=O)N(C)NC(=O)NCc1ccccc1Cn1ccnc1	ZINC000875033185	DD	On-Demand	Reactive	TBXAS1	46	46
COC(=O)N(C)NC(=O)NCc1ccccc1Cn1ccnc1	ZINC000875033185	DD	On-Demand	Reactive	CYP11B2	30	46
C#CC[C@@H](COC)NC(=O)C(=O)NCc1cccc(OC(C)C)c1	ZINC000875033187	ED	On-Demand	Mild	PDS	43	34
C#CC[C@H](COC)NC(=O)C(=O)NCc1cccc(OC(C)C)c1	ZINC000875033188	ED	On-Demand	Mild	PDS	43	34
C[C@@H](CN(C)C(=O)C(=O)NCc1cccc(N(C)C)c1)NC(=O)OC(C)(C)C	ZINC000875033191	GD	On-Demand	Anodyne	FPR1	41	36
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2cccc(OC(C)C)c2)C1	ZINC000875033203	ED	On-Demand	Anodyne	DPP7	52	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2cccc(OC(C)C)c2)C1	ZINC000875033204	ED	On-Demand	Anodyne	DPP7	52	44
Cc1nc(CNC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)cs1	ZINC000875033213	FG	On-Demand	Mild	GRM5	25	41
Cc1nc(CNC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)cs1	ZINC000875033214	FG	On-Demand	Mild	GRM5	25	41
O=CN1CCCN(C(=O)NCCCCc2ccccc2)CC1	ZINC000875033224	DD	On-Demand	Anodyne	FKBP1A	23	44
O=CN1CCCN(C(=O)NCCCCc2ccccc2)CC1	ZINC000875033224	DD	On-Demand	Anodyne	SIGMAR1	23	42
O=CN1CCCN(C(=O)NCCCCc2ccccc2)CC1	ZINC000875033224	DD	On-Demand	Anodyne	PREP	41	43
O=CN1CCCN(C(=O)NCCCCc2ccccc2)CC1	ZINC000875033224	DD	On-Demand	Anodyne	FAAH	30	56
O=CN1CCCN(C(=O)NCCCCc2ccccc2)CC1	ZINC000875033224	DD	On-Demand	Anodyne	DPP7	26	45
O=CN1CCCN(C(=O)NCCCCc2ccccc2)CC1	ZINC000875033224	DD	On-Demand	Anodyne	AMP1_PLAFQ	24	45
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)c1C	ZINC000875033227	JK	On-Demand	Reactive	SCD1	36	40
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)c1C	ZINC000875033227	JK	On-Demand	Reactive	SCD	31	46
CCOc1ccc(C(=O)N2CCC(NC(=O)NNc3cccc(C)n3)CC2)cc1	ZINC000875033234	GF	On-Demand	Reactive	SSTR5	44	35
CCOc1ccc(C(=O)N2CCC(NC(=O)NNc3cccc(C)n3)CC2)cc1	ZINC000875033234	GF	On-Demand	Reactive	SLC6A5	34	41
CCOc1ccc(C(=O)N2CCC(NC(=O)NNc3cccc(C)n3)CC2)cc1	ZINC000875033234	GF	On-Demand	Reactive	EPHX2	39	41
CCCCCCCNC(=O)C(=O)NCCc1ccncc1	ZINC000875033242	CD	On-Demand	Mild	INHA	50	38
CCCCCCCNC(=O)C(=O)NCCc1ccncc1	ZINC000875033242	CD	On-Demand	Mild	CNR2	21	42
CCCCCCCNC(=O)C(=O)NCCc1ccncc1	ZINC000875033242	CD	On-Demand	Mild	S1PR4	30	40
CCCCCCCNC(=O)C(=O)NCCc1ccncc1	ZINC000875033242	CD	On-Demand	Mild	S1PR3	32	40
CCCCCCCNC(=O)C(=O)NCCc1ccncc1	ZINC000875033242	CD	On-Demand	Mild	CA5B	16	44
CCCCCCCNC(=O)C(=O)NCCc1ccncc1	ZINC000875033242	CD	On-Demand	Mild	GRIA1	45	37
CCCCCCCNC(=O)C(=O)NCCc1ccncc1	ZINC000875033242	CD	On-Demand	Mild	FAAH	18	42
CCCCCCCNC(=O)C(=O)NCCc1ccncc1	ZINC000875033242	CD	On-Demand	Mild	S1PR2	62	40
CCCCCCCNC(=O)C(=O)NCCc1ccncc1	ZINC000875033242	CD	On-Demand	Mild	S1PR1	16	40
CCCCCCCNC(=O)C(=O)NCCc1ccncc1	ZINC000875033242	CD	On-Demand	Mild	PLM2_PLAFA	18	43
CCCCCCCNC(=O)C(=O)NCCc1ccncc1	ZINC000875033242	CD	On-Demand	Mild	ASAH1	99	39
COc1ccc(N2CCN(C(=O)C(=O)NCCc3ccncc3)CC2)c(OC)c1	ZINC000875033257	GD	On-Demand	Clean	HTR1A	36	44
COc1ccc(N2CCN(C(=O)C(=O)NCCc3ccncc3)CC2)c(OC)c1	ZINC000875033257	GD	On-Demand	Clean	DRD2	34	44
COc1ccc(N2CCN(C(=O)C(=O)NCCc3ccncc3)CC2)c(OC)c1	ZINC000875033257	GD	On-Demand	Clean	DRD4	43	34
COc1ccc(N2CCN(C(=O)C(=O)NCCc3ccncc3)CC2)c(OC)c1	ZINC000875033257	GD	On-Demand	Clean	DRD3	55	39
COc1ccc(N2CCN(C(=O)C(=O)NCCc3ccncc3)CC2)c(OC)c1	ZINC000875033257	GD	On-Demand	Clean	HTR7	28	40
COc1ccc(N2CCN(C(=O)C(=O)NCCc3ccncc3)CC2)c(OC)c1	ZINC000875033257	GD	On-Demand	Clean	MTNR1A	56	34
COc1ccc(N2CCN(C(=O)C(=O)NCCc3ccncc3)CC2)c(OC)c1	ZINC000875033257	GD	On-Demand	Clean	MTNR1B	51	36
CCOc1ccc(C(=O)N2CCC(NC(=O)NC3(C)CC(F)(F)C3)CC2)cc1	ZINC000875033272	GG	On-Demand	Anodyne	SLC6A5	34	42
CCOc1ccc(C(=O)N2CCC(NC(=O)NC3(C)CC(F)(F)C3)CC2)cc1	ZINC000875033272	GG	On-Demand	Anodyne	EPHX2	67	48
CCOc1ccc(C(=O)N2CCC(NC(=O)NC3(C)CC(F)(F)C3)CC2)cc1	ZINC000875033272	GG	On-Demand	Anodyne	L3MBTL3	48	33
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)c1C	ZINC000875033330	JK	On-Demand	Reactive	SCD1	36	40
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)c1C	ZINC000875033330	JK	On-Demand	Reactive	SCD	31	46
Cc1ccc(CNC(=O)C(=O)NCc2cccc(OC(C)C)c2)o1	ZINC000875033332	EE	On-Demand	Anodyne	PDS	52	35
O=C(NCCCCc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875033341	DD	On-Demand	Anodyne	FKBP1A	17	43
O=C(NCCCCc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875033341	DD	On-Demand	Anodyne	GHRHR	44	37
O=C(NCCCCc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875033341	DD	On-Demand	Anodyne	SIGMAR1	29	40
O=C(NCCCCc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875033341	DD	On-Demand	Anodyne	FAAH	32	56
O=C(NCCCCc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875033341	DD	On-Demand	Anodyne	AMP1_PLAFQ	24	44
Cc1ccc(C(C)(C)CNC(=O)C(=O)NCc2cccc(OC(C)C)c2)nc1	ZINC000875033346	GF	On-Demand	Anodyne	PDS	51	35
CN1CCN(C(=O)NCc2ccccc2Cn2ccnc2)CCC1(C)C	ZINC000875033361	FF	On-Demand	Anodyne	CYP19A1	22	45
CN1CCN(C(=O)NCc2ccccc2Cn2ccnc2)CCC1(C)C	ZINC000875033361	FF	On-Demand	Anodyne	CYP11B1	35	43
CN1CCN(C(=O)NCc2ccccc2Cn2ccnc2)CCC1(C)C	ZINC000875033361	FF	On-Demand	Anodyne	TBXAS1	46	41
CN1CCN(C(=O)NCc2ccccc2Cn2ccnc2)CCC1(C)C	ZINC000875033361	FF	On-Demand	Anodyne	CYP11B2	20	43
NC(=O)C[C@H](NC(=O)c1ccccc1Cl)C(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875033367	JG	On-Demand	Anodyne	SCD1	38	44
NC(=O)C[C@H](NC(=O)c1ccccc1Cl)C(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875033367	JG	On-Demand	Anodyne	SCD	32	46
NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875033368	JG	On-Demand	Anodyne	SCD1	38	44
NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875033368	JG	On-Demand	Anodyne	SCD	32	46
O=C(CCC/N=C1/NS(=O)(=O)c2ccccc21)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875033373	JG	On-Demand	Mild	SCD	28	41
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3ccccc3Cn3ccnc3)C[C@@H]1C2	ZINC000875033374	FE	On-Demand	Anodyne	TBXAS1	27	40
O=CN1CCCN(C(=O)NCc2ccccc2Cn2ccnc2)CC1	ZINC000875033411	ED	On-Demand	Anodyne	CYP19A1	22	44
O=CN1CCCN(C(=O)NCc2ccccc2Cn2ccnc2)CC1	ZINC000875033411	ED	On-Demand	Anodyne	CYP11B1	37	42
O=CN1CCCN(C(=O)NCc2ccccc2Cn2ccnc2)CC1	ZINC000875033411	ED	On-Demand	Anodyne	TBXAS1	36	42
O=CN1CCCN(C(=O)NCc2ccccc2Cn2ccnc2)CC1	ZINC000875033411	ED	On-Demand	Anodyne	CYP11B2	22	42
O=C(NCCCCc1ccccc1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875033419	EG	On-Demand	Anodyne	MTNR1A	21	41
O=C(NCCCCc1ccccc1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875033419	EG	On-Demand	Anodyne	MTNR1B	21	41
O=C(NCCCCc1ccccc1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875033419	EG	On-Demand	Anodyne	FAAH	41	39
O=C(NCCCCc1ccccc1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875033419	EG	On-Demand	Anodyne	CES1	48	39
O=C(NCCCCc1ccccc1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875033419	EG	On-Demand	Anodyne	LUCI_PHOPY	47	33
O=C(NCCCCc1ccccc1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875033420	EG	On-Demand	Anodyne	MTNR1A	21	41
O=C(NCCCCc1ccccc1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875033420	EG	On-Demand	Anodyne	MTNR1B	21	41
O=C(NCCCCc1ccccc1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875033420	EG	On-Demand	Anodyne	FAAH	41	39
O=C(NCCCCc1ccccc1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875033420	EG	On-Demand	Anodyne	CES1	48	39
O=C(NCCCCc1ccccc1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875033420	EG	On-Demand	Anodyne	LUCI_PHOPY	47	33
CC(C)(C)OC(=O)NCCCC(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875033462	HI	On-Demand	Anodyne	SCD1	39	44
CC(C)(C)OC(=O)NCCCC(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875033462	HI	On-Demand	Anodyne	SCD	34	49
C#C[C@@H]1CC[C@@H](NC(=O)NC2CCN(C(=O)c3ccc(OCC)cc3)CC2)CC1	ZINC000875033478	GG	On-Demand	Mild	SSTR5	41	34
C#C[C@@H]1CC[C@@H](NC(=O)NC2CCN(C(=O)c3ccc(OCC)cc3)CC2)CC1	ZINC000875033478	GG	On-Demand	Mild	SLC6A5	34	42
C#C[C@@H]1CC[C@@H](NC(=O)NC2CCN(C(=O)c3ccc(OCC)cc3)CC2)CC1	ZINC000875033478	GG	On-Demand	Mild	EPHX2	56	44
C#C[C@@H]1CC[C@@H](NC(=O)NC2CCN(C(=O)c3ccc(OCC)cc3)CC2)CC1	ZINC000875033478	GG	On-Demand	Mild	PLAU	18	40
C#C[C@@H]1CC[C@@H](NC(=O)NC2CCN(C(=O)c3ccc(OCC)cc3)CC2)CC1	ZINC000875033478	GG	On-Demand	Mild	L3MBTL3	72	37
O=C(NCCc1ccncc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875033481	GE	On-Demand	Anodyne	CHRM2	15	40
O=C(NCCc1ccncc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875033481	GE	On-Demand	Anodyne	DRD2	29	44
O=C(NCCc1ccncc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875033481	GE	On-Demand	Anodyne	DRD4	53	44
O=C(NCCc1ccncc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875033481	GE	On-Demand	Anodyne	ACHE	68	73
O=C(NCCc1ccncc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875033481	GE	On-Demand	Anodyne	HRH1	15	41
O=C(NCCc1ccncc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875033481	GE	On-Demand	Anodyne	DRD3	21	43
O=C(NCCc1ccncc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875033481	GE	On-Demand	Anodyne	SLC6A3	19	50
O=C(NCCc1ccncc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875033481	GE	On-Demand	Anodyne	HTR4	24	42
O=C(NCCc1ccncc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875033481	GE	On-Demand	Anodyne	CHRM3	19	48
O=C(NCCc1ccncc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875033481	GE	On-Demand	Anodyne	GRIN2B	33	40
O=C(NCCc1ccncc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875033481	GE	On-Demand	Anodyne	HRH3	15	56
O=C(NCCc1ccncc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875033481	GE	On-Demand	Anodyne	SIGMAR1	72	48
O=C(NCCc1ccncc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875033481	GE	On-Demand	Anodyne	BCHE	20	51
O=C(NCCc1ccncc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875033481	GE	On-Demand	Anodyne	CCR3	43	44
O=C(NCCc1ccncc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875033481	GE	On-Demand	Anodyne	FAAH	20	47
O=C(NCCc1ccncc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875033481	GE	On-Demand	Anodyne	MCHR1	34	40
O=C(NCCc1ccncc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875033481	GE	On-Demand	Anodyne	CACNA1G	27	41
N#Cc1ccc(N2CCN(C(=O)C(=O)NCCc3ccncc3)CC2)cc1	ZINC000875033515	FC	On-Demand	Mild	CTSK	24	41
COc1ccc(N2CCN(C(=O)C(=O)NCCCSC)CC2)c(OC)c1	ZINC000875033524	GD	On-Demand	Clean	HTR1A	42	43
COc1ccc(N2CCN(C(=O)C(=O)NCCCSC)CC2)c(OC)c1	ZINC000875033524	GD	On-Demand	Clean	DRD2	38	43
COc1ccc(N2CCN(C(=O)C(=O)NCCCSC)CC2)c(OC)c1	ZINC000875033524	GD	On-Demand	Clean	DRD4	44	35
COc1ccc(N2CCN(C(=O)C(=O)NCCCSC)CC2)c(OC)c1	ZINC000875033524	GD	On-Demand	Clean	ADRA1D	26	42
COc1ccc(N2CCN(C(=O)C(=O)NCCCSC)CC2)c(OC)c1	ZINC000875033524	GD	On-Demand	Clean	ADRA1A	26	42
COc1ccc(N2CCN(C(=O)C(=O)NCCCSC)CC2)c(OC)c1	ZINC000875033524	GD	On-Demand	Clean	DRD3	61	43
Cc1ncc([C@@H](C)NC(=O)C(=O)NCc2cccc(OC(C)C)c2)s1	ZINC000875033591	FF	On-Demand	Anodyne	ACACA	15	44
Cc1ncc([C@@H](C)NC(=O)C(=O)NCc2cccc(OC(C)C)c2)s1	ZINC000875033591	FF	On-Demand	Anodyne	ACACB	38	44
Cc1ncc([C@@H](C)NC(=O)C(=O)NCc2cccc(OC(C)C)c2)s1	ZINC000875033591	FF	On-Demand	Anodyne	PDS	45	33
Cc1ncc([C@H](C)NC(=O)C(=O)NCc2cccc(OC(C)C)c2)s1	ZINC000875033592	FF	On-Demand	Anodyne	ACACA	15	44
Cc1ncc([C@H](C)NC(=O)C(=O)NCc2cccc(OC(C)C)c2)s1	ZINC000875033592	FF	On-Demand	Anodyne	ACACB	38	44
Cc1ncc([C@H](C)NC(=O)C(=O)NCc2cccc(OC(C)C)c2)s1	ZINC000875033592	FF	On-Demand	Anodyne	PDS	45	33
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2Cn2ccnc2)CC1	ZINC000875033594	GC	On-Demand	Anodyne	CYP19A1	19	41
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2Cn2ccnc2)CC1	ZINC000875033594	GC	On-Demand	Anodyne	CYP11B1	27	40
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2Cn2ccnc2)CC1	ZINC000875033594	GC	On-Demand	Anodyne	TBXAS1	32	40
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2Cn2ccnc2)CC1	ZINC000875033594	GC	On-Demand	Anodyne	CYP11B2	16	40
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2Cn2ccnc2)CC1	ZINC000875033594	GC	On-Demand	Anodyne	EPHX2	22	43
O=C(NCCCCc1ccccc1)N1Cc2cccc(O)c2C1	ZINC000875033595	DG	On-Demand	Clean	SCN2A	17	41
O=C(NCCCCc1ccccc1)N1Cc2cccc(O)c2C1	ZINC000875033595	DG	On-Demand	Clean	PREP	29	42
O=C(NCCCCc1ccccc1)N1Cc2cccc(O)c2C1	ZINC000875033595	DG	On-Demand	Clean	FAAH	21	50
O=C(NCCCCc1ccccc1)N1Cc2cccc(O)c2C1	ZINC000875033595	DG	On-Demand	Clean	CFTR	43	35
O=C(NCCCCc1ccccc1)N1Cc2cccc(O)c2C1	ZINC000875033595	DG	On-Demand	Clean	SLC6A5	21	41
O=C(NCCCCc1ccccc1)N1Cc2cccc(O)c2C1	ZINC000875033595	DG	On-Demand	Clean	AMP1_PLAFQ	26	42
CCOCCNC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875033606	EC	On-Demand	Anodyne	ROCK1	24	40
CCOCCNC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875033606	EC	On-Demand	Anodyne	ROCK2	17	42
C#CC[C@@H](COC)NC(=O)C(=O)NCc1ccc(C(C)(C)C)cc1	ZINC000875033613	ED	On-Demand	Mild	TRPV1	37	41
C#CC[C@H](COC)NC(=O)C(=O)NCc1ccc(C(C)(C)C)cc1	ZINC000875033615	ED	On-Demand	Mild	TRPV1	37	41
CC[C@H](C[C@H](C)O)NC(=O)NCCCCc1ccccc1	ZINC000875033616	CF	On-Demand	Anodyne	MME	57	38
CC[C@H](C[C@H](C)O)NC(=O)NCCCCc1ccccc1	ZINC000875033616	CF	On-Demand	Anodyne	ANPEP	42	51
CC[C@H](C[C@H](C)O)NC(=O)NCCCCc1ccccc1	ZINC000875033616	CF	On-Demand	Anodyne	PAPA1_CARPA	47	43
CC[C@H](C[C@H](C)O)NC(=O)NCCCCc1ccccc1	ZINC000875033616	CF	On-Demand	Anodyne	MTNR1A	25	42
CC[C@H](C[C@H](C)O)NC(=O)NCCCCc1ccccc1	ZINC000875033616	CF	On-Demand	Anodyne	MTNR1B	28	42
CC[C@H](C[C@H](C)O)NC(=O)NCCCCc1ccccc1	ZINC000875033616	CF	On-Demand	Anodyne	MMP2	27	41
CC[C@H](C[C@H](C)O)NC(=O)NCCCCc1ccccc1	ZINC000875033616	CF	On-Demand	Anodyne	MMP3	48	41
CC[C@H](C[C@H](C)O)NC(=O)NCCCCc1ccccc1	ZINC000875033616	CF	On-Demand	Anodyne	MMP8	18	46
CC[C@H](C[C@H](C)O)NC(=O)NCCCCc1ccccc1	ZINC000875033616	CF	On-Demand	Anodyne	FAAH	25	42
CC[C@H](C[C@H](C)O)NC(=O)NCCCCc1ccccc1	ZINC000875033616	CF	On-Demand	Anodyne	CAPN1	43	42
CC[C@H](C[C@H](C)O)NC(=O)NCCCCc1ccccc1	ZINC000875033616	CF	On-Demand	Anodyne	CAPN2	83	42
CC[C@H](C[C@H](C)O)NC(=O)NCCCCc1ccccc1	ZINC000875033616	CF	On-Demand	Anodyne	FPR1	27	47
CC[C@H](C[C@H](C)O)NC(=O)NCCCCc1ccccc1	ZINC000875033616	CF	On-Demand	Anodyne	NPR	44	34
CC[C@H](C[C@H](C)O)NC(=O)NCCCCc1ccccc1	ZINC000875033616	CF	On-Demand	Anodyne	AMP1_PLAFQ	32	47
CC[C@H](C[C@H](C)O)NC(=O)NCCCCc1ccccc1	ZINC000875033616	CF	On-Demand	Anodyne	PDS	48	37
CCC(F)(F)C(C)(C)CNC(=O)C(=O)NCc1cccc(OC(C)C)c1	ZINC000875033624	FG	On-Demand	Anodyne	PDS	76	40
Cc1nc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cs1	ZINC000875033634	EG	On-Demand	Anodyne	CPT1A	52	36
Cc1nc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cs1	ZINC000875033636	EG	On-Demand	Anodyne	CPT1A	52	36
CCn1c(=O)c2ccccc2n(CC(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)c1=O	ZINC000875033637	JG	On-Demand	Anodyne	SCD	31	46
Cc1nc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cs1	ZINC000875033638	EG	On-Demand	Anodyne	CPT1A	52	36
Cc1nc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cs1	ZINC000875033639	EG	On-Demand	Anodyne	CPT1A	52	36
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCCc3ccccc3)C[C@@H]1C2	ZINC000875033645	EF	On-Demand	Anodyne	EPHX2	28	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1Cn1cccn1	ZINC000875033654	FE	On-Demand	Anodyne	SLC6A3	44	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1Cn1cccn1	ZINC000875033656	FE	On-Demand	Anodyne	SLC6A3	44	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cn2cncn2)cc1	ZINC000875033665	FD	On-Demand	Anodyne	SLC6A4	30	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cn2cncn2)cc1	ZINC000875033665	FD	On-Demand	Anodyne	SLC6A3	56	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cn2cncn2)cc1	ZINC000875033665	FD	On-Demand	Anodyne	HIS3	43	32
COc1ccc2c(C)c(CCC(=O)Nc3ncc(Cc4ccc(F)c(F)c4)s3)c(=O)oc2c1	ZINC000875033668	JK	On-Demand	Anodyne	MAOB	35	46
COc1ccc2c(C)c(CCC(=O)Nc3ncc(Cc4ccc(F)c(F)c4)s3)c(=O)oc2c1	ZINC000875033668	JK	On-Demand	Anodyne	SCD1	38	43
COc1ccc2c(C)c(CCC(=O)Nc3ncc(Cc4ccc(F)c(F)c4)s3)c(=O)oc2c1	ZINC000875033668	JK	On-Demand	Anodyne	SCD	33	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cn2cncn2)cc1	ZINC000875033669	FD	On-Demand	Anodyne	SLC6A4	30	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cn2cncn2)cc1	ZINC000875033669	FD	On-Demand	Anodyne	SLC6A3	56	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cn2cncn2)cc1	ZINC000875033669	FD	On-Demand	Anodyne	HIS3	43	32
O=C1CCN(C(=O)NCCCCc2ccccc2)CCCCCCN1	ZINC000875033681	EG	On-Demand	Anodyne	FKBP1A	25	42
O=C1CCN(C(=O)NCCCCc2ccccc2)CCCCCCN1	ZINC000875033681	EG	On-Demand	Anodyne	PREP	34	41
O=C1CCN(C(=O)NCCCCc2ccccc2)CCCCCCN1	ZINC000875033681	EG	On-Demand	Anodyne	DPP7	34	43
O=C(NCC[C@H](O)C1CCCC1)NCc1ccccc1Cn1ccnc1	ZINC000875033687	FF	On-Demand	Anodyne	CYP19A1	20	42
O=C(NCC[C@H](O)C1CCCC1)NCc1ccccc1Cn1ccnc1	ZINC000875033687	FF	On-Demand	Anodyne	TBXAS1	32	40
O=C(NCC[C@@H](O)C1CCCC1)NCc1ccccc1Cn1ccnc1	ZINC000875033688	FF	On-Demand	Anodyne	CYP19A1	20	42
O=C(NCC[C@@H](O)C1CCCC1)NCc1ccccc1Cn1ccnc1	ZINC000875033688	FF	On-Demand	Anodyne	TBXAS1	32	40
COCc1c(C(=O)Oc2cc(OC)cc(OC)c2)oc2ccccc12	ZINC000875033717	EH	On-Demand	Anodyne	MTNR1A	16	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCCc1ccccc1	ZINC000875033726	EF	On-Demand	Anodyne	FKBP1A	49	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCCc1ccccc1	ZINC000875033726	EF	On-Demand	Anodyne	SLC6A4	32	51
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCCc1ccccc1	ZINC000875033726	EF	On-Demand	Anodyne	OPRM1	16	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCCc1ccccc1	ZINC000875033726	EF	On-Demand	Anodyne	SLC6A3	65	51
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCCc1ccccc1	ZINC000875033726	EF	On-Demand	Anodyne	FAAH	47	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCCc1ccccc1	ZINC000875033726	EF	On-Demand	Anodyne	CES1	52	36
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCCc1ccccc1	ZINC000875033726	EF	On-Demand	Anodyne	AMP1_PLAFQ	21	40
O=C(NCCCCc1ccccc1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875033727	EG	On-Demand	Anodyne	FKBP1A	22	42
O=C(NCCCCc1ccccc1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875033727	EG	On-Demand	Anodyne	SLC18A2	44	37
COc1ccc(-c2nnc(S)n2CC(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)cc1	ZINC000875033780	JI	On-Demand	Anodyne	SCD1	41	45
COc1ccc(-c2nnc(S)n2CC(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)cc1	ZINC000875033780	JI	On-Demand	Anodyne	SCD	37	52
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1OC(F)(F)F	ZINC000875033805	EF	On-Demand	Anodyne	ANPEP	18	47
O=C(NCCc1ccncc1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875033810	ED	On-Demand	Anodyne	OXTR	25	40
O=C(NCCc1ccncc1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875033810	ED	On-Demand	Anodyne	GHRHR	30	41
O=C(NCCc1ccncc1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875033811	ED	On-Demand	Anodyne	OXTR	25	40
O=C(NCCc1ccncc1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875033811	ED	On-Demand	Anodyne	GHRHR	30	41
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCc3ccncc3)C2)cc1	ZINC000875033825	FD	On-Demand	Anodyne	DRD4	33	49
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCc3ccncc3)C2)cc1	ZINC000875033825	FD	On-Demand	Anodyne	SIGMAR1	21	41
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCc3ccncc3)C2)cc1	ZINC000875033825	FD	On-Demand	Anodyne	SSTR5	48	39
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCc3ccncc3)C2)cc1	ZINC000875033825	FD	On-Demand	Anodyne	CCR3	33	41
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCc3ccncc3)C2)cc1	ZINC000875033825	FD	On-Demand	Anodyne	UTS2R	23	41
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCc3ccncc3)C2)cc1	ZINC000875033825	FD	On-Demand	Anodyne	MLNR	43	38
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCc3ccncc3)C2)cc1	ZINC000875033825	FD	On-Demand	Anodyne	CCR2	17	46
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCc3ccncc3)C2)cc1	ZINC000875033825	FD	On-Demand	Anodyne	MCHR1	42	45
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCc3ccncc3)C2)cc1	ZINC000875033825	FD	On-Demand	Anodyne	GPBAR1	17	42
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCc3ccncc3)C2)cc1	ZINC000875033825	FD	On-Demand	Anodyne	BIRC2	29	43
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCc3ccncc3)C2)cc1	ZINC000875033827	FD	On-Demand	Anodyne	DRD4	33	49
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCc3ccncc3)C2)cc1	ZINC000875033827	FD	On-Demand	Anodyne	SIGMAR1	21	41
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCc3ccncc3)C2)cc1	ZINC000875033827	FD	On-Demand	Anodyne	SSTR5	48	39
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCc3ccncc3)C2)cc1	ZINC000875033827	FD	On-Demand	Anodyne	CCR3	33	41
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCc3ccncc3)C2)cc1	ZINC000875033827	FD	On-Demand	Anodyne	UTS2R	23	41
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCc3ccncc3)C2)cc1	ZINC000875033827	FD	On-Demand	Anodyne	MLNR	43	38
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCc3ccncc3)C2)cc1	ZINC000875033827	FD	On-Demand	Anodyne	CCR2	17	46
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCc3ccncc3)C2)cc1	ZINC000875033827	FD	On-Demand	Anodyne	MCHR1	42	45
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCc3ccncc3)C2)cc1	ZINC000875033827	FD	On-Demand	Anodyne	GPBAR1	17	42
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCc3ccncc3)C2)cc1	ZINC000875033827	FD	On-Demand	Anodyne	BIRC2	29	43
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2OC(F)(F)F)CC1	ZINC000875033829	GD	On-Demand	Anodyne	EPHX2	38	62
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2OC(F)(F)F)CC1	ZINC000875033829	GD	On-Demand	Anodyne	CACNA1G	36	42
O=C(NCCc1ccncc1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875033852	FD	On-Demand	Anodyne	F2	26	40
O=C(NCCc1ccncc1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875033852	FD	On-Demand	Anodyne	PREP	53	37
O=C(NCCc1ccncc1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875033854	FD	On-Demand	Anodyne	F2	26	40
O=C(NCCc1ccncc1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875033854	FD	On-Demand	Anodyne	PREP	53	37
O=C(NCCc1ccncc1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875033856	FD	On-Demand	Anodyne	F2	26	40
O=C(NCCc1ccncc1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875033856	FD	On-Demand	Anodyne	PREP	53	37
O=C(NCCc1ccncc1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875033857	FD	On-Demand	Anodyne	F2	26	40
O=C(NCCc1ccncc1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875033857	FD	On-Demand	Anodyne	PREP	53	37
CC[C@@H](NC(=O)C(=O)NCCc1ccncc1)c1cccc(OC)c1OC	ZINC000875033869	FE	On-Demand	Anodyne	CNR2	24	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2ccncc2)C1	ZINC000875033870	DC	On-Demand	Anodyne	DPP7	24	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2ccncc2)C1	ZINC000875033870	DC	On-Demand	Anodyne	GPBAR1	23	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2ccncc2)C1	ZINC000875033871	DC	On-Demand	Anodyne	DPP7	24	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2ccncc2)C1	ZINC000875033871	DC	On-Demand	Anodyne	GPBAR1	23	42
CCOCCNC(=O)C(=O)N1CCN(c2ccc(F)cc2C#N)CC1	ZINC000875033927	EC	On-Demand	Mild	P2RY12	15	41
Cc1nc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cs1	ZINC000875033934	EF	On-Demand	Anodyne	TRY1_BOVIN	40	36
Cc1nc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cs1	ZINC000875033934	EF	On-Demand	Anodyne	ADAM17	15	42
Cc1nc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cs1	ZINC000875033936	EF	On-Demand	Anodyne	TRY1_BOVIN	40	36
Cc1nc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cs1	ZINC000875033936	EF	On-Demand	Anodyne	ADAM17	15	42
Cc1nc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cs1	ZINC000875033937	EF	On-Demand	Anodyne	TRY1_BOVIN	40	36
Cc1nc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cs1	ZINC000875033937	EF	On-Demand	Anodyne	ADAM17	15	42
Cc1nc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cs1	ZINC000875033938	EF	On-Demand	Anodyne	TRY1_BOVIN	40	36
Cc1nc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cs1	ZINC000875033938	EF	On-Demand	Anodyne	ADAM17	15	42
O=C(NCc1ccccc1Cn1ccnc1)NC[C@H]1C[C@H](O)C1	ZINC000875033942	DD	On-Demand	Anodyne	CYP19A1	33	48
O=C(NCc1ccccc1Cn1ccnc1)NC[C@H]1C[C@H](O)C1	ZINC000875033942	DD	On-Demand	Anodyne	CYP11B1	46	43
O=C(NCc1ccccc1Cn1ccnc1)NC[C@H]1C[C@H](O)C1	ZINC000875033942	DD	On-Demand	Anodyne	TBXAS1	41	44
O=C(NCc1ccccc1Cn1ccnc1)NC[C@H]1C[C@H](O)C1	ZINC000875033942	DD	On-Demand	Anodyne	CYP11B2	27	43
O=C(CC/N=C1/NS(=O)(=O)c2ccccc21)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875033956	JG	On-Demand	Mild	SCD	29	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCc2ccccc2)C1	ZINC000875033980	EF	On-Demand	Anodyne	ACE	68	45
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCc2ccccc2)C1	ZINC000875033980	EF	On-Demand	Anodyne	OPRM1	21	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCc2ccccc2)C1	ZINC000875033980	EF	On-Demand	Anodyne	GHRHR	43	36
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCc2ccccc2)C1	ZINC000875033980	EF	On-Demand	Anodyne	SIGMAR1	17	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCc2ccccc2)C1	ZINC000875033980	EF	On-Demand	Anodyne	CTSK	28	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCc2ccccc2)C1	ZINC000875033980	EF	On-Demand	Anodyne	SCN2A	21	43
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCc2ccccc2)C1	ZINC000875033980	EF	On-Demand	Anodyne	MMP3	43	38
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCc2ccccc2)C1	ZINC000875033980	EF	On-Demand	Anodyne	FAAH	25	47
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCc2ccccc2)C1	ZINC000875033980	EF	On-Demand	Anodyne	CAPN2	47	37
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCc2ccccc2)C1	ZINC000875033980	EF	On-Demand	Anodyne	CTRB_BOVIN	44	32
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCc2ccccc2)C1	ZINC000875033980	EF	On-Demand	Anodyne	AMP1_PLAFQ	38	45
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCc2ccccc2)C1	ZINC000875033980	EF	On-Demand	Anodyne	ASAH1	51	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCOc2ccccc2Cl)C1	ZINC000875033995	FD	On-Demand	Anodyne	SLC6A1	52	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCOc2ccccc2Cl)C1	ZINC000875033995	FD	On-Demand	Anodyne	HCN1	40	30
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCOc2ccccc2Cl)C1	ZINC000875033995	FD	On-Demand	Anodyne	HCN4	40	30
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCOc2ccccc2Cl)C1	ZINC000875033996	FD	On-Demand	Anodyne	SLC6A1	52	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCOc2ccccc2Cl)C1	ZINC000875033996	FD	On-Demand	Anodyne	HCN1	40	30
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCOc2ccccc2Cl)C1	ZINC000875033996	FD	On-Demand	Anodyne	HCN4	40	30
C=C1c2ccccc2C(=O)N1[C@H](C)C(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875034010	II	On-Demand	Anodyne	SCD	31	45
C=C1c2ccccc2C(=O)N1[C@@H](C)C(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875034011	II	On-Demand	Anodyne	SCD	31	45
O=C(NCc1ccccc1Cn1ccnc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875034017	GF	On-Demand	Anodyne	CYP19A1	18	40
O=C(NCc1ccccc1Cn1ccnc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875034017	GF	On-Demand	Anodyne	EPHX2	16	45
O=C(NCc1ccccc1Cn1ccnc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875034018	GF	On-Demand	Anodyne	CYP19A1	18	40
O=C(NCc1ccccc1Cn1ccnc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875034018	GF	On-Demand	Anodyne	EPHX2	16	45
Cc1nnc(NNC(=O)NCCCCc2ccccc2)n1C	ZINC000875034022	DD	On-Demand	Reactive	SCNN1A	40	37
Cc1nnc(NNC(=O)NCCCCc2ccccc2)n1C	ZINC000875034022	DD	On-Demand	Reactive	FAAH	49	40
Cc1nnc(NNC(=O)NCCCCc2ccccc2)n1C	ZINC000875034022	DD	On-Demand	Reactive	CES1	52	34
Cc1nnc(NNC(=O)NCCCCc2ccccc2)n1C	ZINC000875034022	DD	On-Demand	Reactive	AMP1_PLAFQ	21	42
C#CC[C@H](COC)NC(=O)NC1CCN(C(=O)c2ccc(OCC)cc2)CC1	ZINC000875034042	GE	On-Demand	Mild	EPHX2	32	41
C#CC[C@H](COC)NC(=O)NC1CCN(C(=O)c2ccc(OCC)cc2)CC1	ZINC000875034042	GE	On-Demand	Mild	L3MBTL3	46	32
C#CC[C@@H](COC)NC(=O)NC1CCN(C(=O)c2ccc(OCC)cc2)CC1	ZINC000875034043	GE	On-Demand	Mild	EPHX2	32	41
C#CC[C@@H](COC)NC(=O)NC1CCN(C(=O)c2ccc(OCC)cc2)CC1	ZINC000875034043	GE	On-Demand	Mild	L3MBTL3	46	32
CCC(CC)CNC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875034071	EE	On-Demand	Anodyne	ROCK1	26	43
CCC(CC)CNC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875034071	EE	On-Demand	Anodyne	ROCK2	18	43
CCCCCCCNC(=O)C(=O)NCc1sccc1C	ZINC000875034084	CF	On-Demand	Mild	ASAH1	88	37
CCOCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875034096	FD	On-Demand	Anodyne	CHRM2	21	41
CCOCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875034096	FD	On-Demand	Anodyne	CHRM1	18	40
CCOCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875034096	FD	On-Demand	Anodyne	DRD2	36	48
CCOCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875034096	FD	On-Demand	Anodyne	DRD4	61	47
CCOCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875034096	FD	On-Demand	Anodyne	ACHE	74	63
CCOCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875034096	FD	On-Demand	Anodyne	HRH1	33	44
CCOCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875034096	FD	On-Demand	Anodyne	DRD3	28	47
CCOCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875034096	FD	On-Demand	Anodyne	SLC6A3	26	50
CCOCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875034096	FD	On-Demand	Anodyne	HTR4	41	44
CCOCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875034096	FD	On-Demand	Anodyne	CHRM3	28	41
CCOCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875034096	FD	On-Demand	Anodyne	LTA4H	24	40
CCOCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875034096	FD	On-Demand	Anodyne	SIGMAR1	79	49
CCOCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875034096	FD	On-Demand	Anodyne	SSTR5	52	36
CCOCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875034096	FD	On-Demand	Anodyne	BCHE	22	51
CCOCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875034096	FD	On-Demand	Anodyne	CCR3	45	40
CCOCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875034096	FD	On-Demand	Anodyne	MCHR1	29	44
CCOCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875034096	FD	On-Demand	Anodyne	CACNA1G	36	43
CCOCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875034096	FD	On-Demand	Anodyne	CACNA1I	61	40
CCOCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875034096	FD	On-Demand	Anodyne	SIRT3	40	31
CCOCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875034096	FD	On-Demand	Anodyne	SIRT2	44	31
CCOCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875034096	FD	On-Demand	Anodyne	SIRT1	41	34
CCOc1ccc(C(=O)N2CCC(NC(=O)NC[C@H]3C[C@H](O)C3)CC2)cc1	ZINC000875034097	GD	On-Demand	Anodyne	SLC6A5	33	41
CCOc1ccc(C(=O)N2CCC(NC(=O)NC[C@H]3C[C@H](O)C3)CC2)cc1	ZINC000875034097	GD	On-Demand	Anodyne	EPHX2	62	45
CCOc1ccc(C(=O)N2CCC(NC(=O)NC[C@H]3C[C@H](O)C3)CC2)cc1	ZINC000875034097	GD	On-Demand	Anodyne	L3MBTL3	49	33
O=C(NCCc1ccncc1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875034101	FE	On-Demand	Anodyne	TBXAS1	15	40
O=C(NCCc1ccncc1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875034101	FE	On-Demand	Anodyne	C3AR1	40	41
O=C(NCCc1ccncc1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875034104	FE	On-Demand	Anodyne	TBXAS1	15	40
O=C(NCCc1ccncc1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875034104	FE	On-Demand	Anodyne	C3AR1	40	41
COc1ccc([C@@H](NC(=O)N2CCC3(CCN(C)CC3)CC2)C2CC2)cc1	ZINC000875034144	FH	On-Demand	Anodyne	MMP13	16	40
COc1ccc([C@@H](NC(=O)N2CCC3(CCN(C)CC3)CC2)C2CC2)cc1	ZINC000875034144	FH	On-Demand	Anodyne	MMP10	25	41
COc1ccc([C@H](NC(=O)N2CCC3(CCN(C)CC3)CC2)C2CC2)cc1	ZINC000875034147	FH	On-Demand	Anodyne	MMP13	16	40
COc1ccc([C@H](NC(=O)N2CCC3(CCN(C)CC3)CC2)C2CC2)cc1	ZINC000875034147	FH	On-Demand	Anodyne	MMP10	25	41
COc1ccc([C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C2CC2)cc1	ZINC000875034158	FE	On-Demand	Anodyne	BIRC2	27	41
COc1ccc([C@@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C2CC2)cc1	ZINC000875034160	FE	On-Demand	Anodyne	BIRC2	27	41
CCOCCNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875034180	FC	On-Demand	Clean	HTR1A	35	41
CCOCCNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875034180	FC	On-Demand	Clean	DRD2	35	43
CCOCCNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875034180	FC	On-Demand	Clean	DRD4	44	35
CCOCCNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875034180	FC	On-Demand	Clean	DRD3	56	43
CCOCCNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875034180	FC	On-Demand	Clean	MTNR1A	42	34
CCOCCNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875034180	FC	On-Demand	Clean	MTNR1B	41	38
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCCSC)CC2	ZINC000875034181	FE	On-Demand	Anodyne	SLC18A2	49	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCCSC)CC2	ZINC000875034182	FE	On-Demand	Anodyne	SLC18A2	49	37
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1Cn1cccn1	ZINC000875034185	EE	On-Demand	Anodyne	ANPEP	16	41
COc1ccc([C@@H](NC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)C2CC2)cc1	ZINC000875034196	GF	On-Demand	Anodyne	UTS2	33	40
COc1ccc([C@H](NC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)C2CC2)cc1	ZINC000875034197	GF	On-Demand	Anodyne	UTS2	33	40
CCn1nncc1CNC(=O)C(=O)NCc1cccc(OC(C)C)c1	ZINC000875034239	ED	On-Demand	Anodyne	PDS	51	36
CC[C@@H](NC(=O)C(=O)NCc1cccc(N(C)C)c1)c1cccc(OC)c1OC	ZINC000875034254	GF	On-Demand	Anodyne	PDS	45	34
O=C1CCN(C(=O)NCc2ccccc2Cn2ccnc2)CCCCCCN1	ZINC000875034271	GF	On-Demand	Anodyne	CYP19A1	27	41
O=C1CCN(C(=O)NCc2ccccc2Cn2ccnc2)CCCCCCN1	ZINC000875034271	GF	On-Demand	Anodyne	TBXAS1	33	40
O=C(NCc1ccc(Cn2cncn2)cc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875034275	GF	On-Demand	Anodyne	EPHX2	17	42
O=C(NCc1ccc(Cn2cncn2)cc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875034276	GF	On-Demand	Anodyne	EPHX2	17	42
O=C(NCCO)C1CCN(C(=O)NCCCCc2ccccc2)CC1	ZINC000875034284	ED	On-Demand	Anodyne	FKBP1A	36	52
O=C(NCCO)C1CCN(C(=O)NCCCCc2ccccc2)CC1	ZINC000875034284	ED	On-Demand	Anodyne	SCNN1A	42	37
O=C(NCCO)C1CCN(C(=O)NCCCCc2ccccc2)CC1	ZINC000875034284	ED	On-Demand	Anodyne	SIGMAR1	23	45
O=C(NCCO)C1CCN(C(=O)NCCCCc2ccccc2)CC1	ZINC000875034284	ED	On-Demand	Anodyne	SCN2A	17	40
O=C(NCCO)C1CCN(C(=O)NCCCCc2ccccc2)CC1	ZINC000875034284	ED	On-Demand	Anodyne	PREP	43	39
O=C(NCCO)C1CCN(C(=O)NCCCCc2ccccc2)CC1	ZINC000875034284	ED	On-Demand	Anodyne	MTNR1A	29	46
O=C(NCCO)C1CCN(C(=O)NCCCCc2ccccc2)CC1	ZINC000875034284	ED	On-Demand	Anodyne	MTNR1B	31	46
O=C(NCCO)C1CCN(C(=O)NCCCCc2ccccc2)CC1	ZINC000875034284	ED	On-Demand	Anodyne	FAAH	16	51
O=C(NCCO)C1CCN(C(=O)NCCCCc2ccccc2)CC1	ZINC000875034284	ED	On-Demand	Anodyne	EPHX2	21	45
O=C(NCCO)C1CCN(C(=O)NCCCCc2ccccc2)CC1	ZINC000875034284	ED	On-Demand	Anodyne	AMP1_PLAFQ	25	40
O=C(NCCO)C1CCN(C(=O)NCCCCc2ccccc2)CC1	ZINC000875034284	ED	On-Demand	Anodyne	CACNA1G	31	44
Cc1nc(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)cs1	ZINC000875034285	EF	On-Demand	Anodyne	CTSV	28	41
Cc1nc(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)cs1	ZINC000875034286	EF	On-Demand	Anodyne	CTSV	28	41
O=C(NCCCCc1ccccc1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875034290	FE	On-Demand	Anodyne	FAAH	18	46
O=C(NCCCCc1ccccc1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875034290	FE	On-Demand	Anodyne	CES1	21	41
O=C(NCCCCc1ccccc1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875034290	FE	On-Demand	Anodyne	AMP1_PLAFQ	18	40
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1Cn1ccnc1	ZINC000875034298	EE	On-Demand	Anodyne	CYP19A1	26	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1Cn1ccnc1	ZINC000875034298	EE	On-Demand	Anodyne	CYP11B1	44	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1Cn1ccnc1	ZINC000875034298	EE	On-Demand	Anodyne	ANPEP	19	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1Cn1ccnc1	ZINC000875034298	EE	On-Demand	Anodyne	TBXAS1	35	42
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1Cn1ccnc1	ZINC000875034298	EE	On-Demand	Anodyne	CYP11B2	24	43
CCC1(CC)CCCN1C(=O)NCc1ccccc1Cn1ccnc1	ZINC000875034300	EH	On-Demand	Anodyne	CYP19A1	29	42
CCC1(CC)CCCN1C(=O)NCc1ccccc1Cn1ccnc1	ZINC000875034300	EH	On-Demand	Anodyne	CYP11B1	41	43
CCC1(CC)CCCN1C(=O)NCc1ccccc1Cn1ccnc1	ZINC000875034300	EH	On-Demand	Anodyne	TBXAS1	41	41
CCC1(CC)CCCN1C(=O)NCc1ccccc1Cn1ccnc1	ZINC000875034300	EH	On-Demand	Anodyne	CYP11B2	25	43
O=C(NCc1ccccc1Cn1ccnc1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875034308	FG	On-Demand	Anodyne	CYP19A1	17	41
O=C(NCc1ccccc1Cn1ccnc1)NC1([C@H]2CCCCO2)CCC1	ZINC000875034309	FG	On-Demand	Anodyne	CYP19A1	17	41
COC(=O)C1(O)CN(C(=O)NCc2ccccc2Cn2ccnc2)C1	ZINC000875034314	EC	On-Demand	Anodyne	CYP19A1	30	43
COC(=O)C1(O)CN(C(=O)NCc2ccccc2Cn2ccnc2)C1	ZINC000875034314	EC	On-Demand	Anodyne	CYP11B1	52	43
COC(=O)C1(O)CN(C(=O)NCc2ccccc2Cn2ccnc2)C1	ZINC000875034314	EC	On-Demand	Anodyne	TBXAS1	39	44
COC(=O)C1(O)CN(C(=O)NCc2ccccc2Cn2ccnc2)C1	ZINC000875034314	EC	On-Demand	Anodyne	CYP11B2	29	43
CCn1c(S)nc2cc(C(=O)Nc3ncc(Cc4ccc(F)c(F)c4)s3)ccc2c1=O	ZINC000875034315	JI	On-Demand	Anodyne	SCD1	43	46
CCn1c(S)nc2cc(C(=O)Nc3ncc(Cc4ccc(F)c(F)c4)s3)ccc2c1=O	ZINC000875034315	JI	On-Demand	Anodyne	SCD	37	54
Cn1cc(/C=C/C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)c(=O)n(C)c1=O	ZINC000875034323	HE	On-Demand	Anodyne	SCD1	38	43
Cn1cc(/C=C/C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)c(=O)n(C)c1=O	ZINC000875034323	HE	On-Demand	Anodyne	SCD	33	48
Cn1cc(/C=C\C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)c(=O)n(C)c1=O	ZINC000875034324	HE	On-Demand	Anodyne	SCD1	38	43
Cn1cc(/C=C\C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)c(=O)n(C)c1=O	ZINC000875034324	HE	On-Demand	Anodyne	SCD	33	48
O=C(NCc1ccccc1Cn1ccnc1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875034325	GH	On-Demand	Anodyne	CYP19A1	19	42
O=C(NCc1ccccc1Cn1ccnc1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875034325	GH	On-Demand	Anodyne	TBXAS1	29	40
CC[C@@H](NC(=O)NCc1ccccc1Cn1ccnc1)[C@H](O)c1ccccc1	ZINC000875034327	GG	On-Demand	Anodyne	CYP19A1	26	45
CC[C@@H](NC(=O)NCc1ccccc1Cn1ccnc1)[C@H](O)c1ccccc1	ZINC000875034327	GG	On-Demand	Anodyne	CYP11B1	42	43
CC[C@@H](NC(=O)NCc1ccccc1Cn1ccnc1)[C@H](O)c1ccccc1	ZINC000875034327	GG	On-Demand	Anodyne	TBXAS1	41	43
CC[C@@H](NC(=O)NCc1ccccc1Cn1ccnc1)[C@H](O)c1ccccc1	ZINC000875034327	GG	On-Demand	Anodyne	CYP11B2	25	43
CC[C@@H](NC(=O)NCc1ccccc1Cn1ccnc1)[C@@H](O)c1ccccc1	ZINC000875034328	GG	On-Demand	Anodyne	CYP19A1	26	45
CC[C@@H](NC(=O)NCc1ccccc1Cn1ccnc1)[C@@H](O)c1ccccc1	ZINC000875034328	GG	On-Demand	Anodyne	CYP11B1	42	43
CC[C@@H](NC(=O)NCc1ccccc1Cn1ccnc1)[C@@H](O)c1ccccc1	ZINC000875034328	GG	On-Demand	Anodyne	TBXAS1	41	43
CC[C@@H](NC(=O)NCc1ccccc1Cn1ccnc1)[C@@H](O)c1ccccc1	ZINC000875034328	GG	On-Demand	Anodyne	CYP11B2	25	43
O=C(C[C@H]1C=CS(=O)(=O)C1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875034366	GF	On-Demand	Anodyne	SCD	31	47
O=C(C[C@@H]1C=CS(=O)(=O)C1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875034367	GF	On-Demand	Anodyne	SCD	31	47
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(Cn2cncn2)cc1	ZINC000875034385	ED	On-Demand	Anodyne	HIS3	72	36
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(C(C)(C)C)cc2)CC1	ZINC000875034396	EE	On-Demand	Anodyne	TRPV1	22	40
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCc1ccncc1)CC2	ZINC000875034411	GD	On-Demand	Anodyne	SLC18A2	47	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCc1ccncc1)CC2	ZINC000875034411	GD	On-Demand	Anodyne	HCRTR1	15	43
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCc1ccncc1)CC2	ZINC000875034411	GD	On-Demand	Anodyne	MTNR1B	15	48
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCc1ccncc1)CC2	ZINC000875034414	GD	On-Demand	Anodyne	SLC18A2	47	35
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCc1ccncc1)CC2	ZINC000875034414	GD	On-Demand	Anodyne	HCRTR1	15	43
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCc1ccncc1)CC2	ZINC000875034414	GD	On-Demand	Anodyne	MTNR1B	15	48
CCOc1ccc(C(=O)N2CCC(NC(=O)N[C@@H]3CC34CCC4)CC2)cc1	ZINC000875034416	FF	On-Demand	Anodyne	SLC6A5	33	40
CCOc1ccc(C(=O)N2CCC(NC(=O)N[C@@H]3CC34CCC4)CC2)cc1	ZINC000875034416	FF	On-Demand	Anodyne	EPHX2	55	46
CCOc1ccc(C(=O)N2CCC(NC(=O)N[C@@H]3CC34CCC4)CC2)cc1	ZINC000875034416	FF	On-Demand	Anodyne	L3MBTL3	64	35
CCOc1ccc(C(=O)N2CCC(NC(=O)N[C@H]3CC34CCC4)CC2)cc1	ZINC000875034419	FF	On-Demand	Anodyne	SLC6A5	33	40
CCOc1ccc(C(=O)N2CCC(NC(=O)N[C@H]3CC34CCC4)CC2)cc1	ZINC000875034419	FF	On-Demand	Anodyne	EPHX2	55	46
CCOc1ccc(C(=O)N2CCC(NC(=O)N[C@H]3CC34CCC4)CC2)cc1	ZINC000875034419	FF	On-Demand	Anodyne	L3MBTL3	64	35
O=C(NCc1ccccc1OC(F)(F)F)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875034425	FG	On-Demand	Anodyne	EPHX2	15	53
O=C(NCCc1ccncc1)C(=O)N[C@H]1CCN(c2ccc(Cl)cc2F)C1	ZINC000875034442	GD	On-Demand	Anodyne	GPBAR1	16	42
O=C(NCCc1ccncc1)C(=O)N[C@@H]1CCN(c2ccc(Cl)cc2F)C1	ZINC000875034444	GD	On-Demand	Anodyne	GPBAR1	16	42
CCOCCNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875034460	FD	On-Demand	Anodyne	ETHR	60	48
O=C(NCCc1ccncc1)C(=O)N1CCc2ccc(C(F)(F)F)cc2C1	ZINC000875034482	GE	On-Demand	Anodyne	CCR2	20	40
CCCN(CC(=O)Nc1ccccc1OC)C(=O)c1sccc1CC#N	ZINC000875034497	FG	On-Demand	Mild	FAS	31	41
COC(=O)C1(O)CN(C(=O)NCc2ccccc2OC(F)(F)F)C1	ZINC000875034498	ED	On-Demand	Anodyne	EPHX2	21	44
Cn1ncc(C(F)(F)F)c1CNC(=O)C(=O)NCCc1ccncc1	ZINC000875034513	FC	On-Demand	Anodyne	FLT1	25	45
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2Cn2cccn2)CC1	ZINC000875034514	GC	On-Demand	Anodyne	EPHX2	24	45
CCOCCNC(=O)C(=O)NC[C@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000875034516	FC	On-Demand	Anodyne	DRD4	18	42
CCOCCNC(=O)C(=O)NC[C@@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000875034518	FC	On-Demand	Anodyne	DRD4	18	42
CCOc1ccc([C@@H](C)NC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875034534	DF	On-Demand	Anodyne	ACACA	26	42
CCOc1ccc([C@@H](C)NC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875034534	DF	On-Demand	Anodyne	ACACB	29	47
CCOc1ccc([C@@H](C)NC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875034535	DF	On-Demand	Anodyne	ACACA	26	42
CCOc1ccc([C@@H](C)NC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875034535	DF	On-Demand	Anodyne	ACACB	29	47
CCOc1ccc([C@@H](C)NC(=O)NCCN2CCOC[C@H]2CC)cc1	ZINC000875034538	EF	On-Demand	Anodyne	ACACB	18	41
CCOc1ccc([C@@H](C)NC(=O)NCCN2CCOC[C@@H]2CC)cc1	ZINC000875034540	EF	On-Demand	Anodyne	ACACB	18	41
COCCn1c(C)cc(/C=C(\C#N)C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)c1C	ZINC000875034557	JJ	On-Demand	Reactive	SCD1	38	42
COCCn1c(C)cc(/C=C(\C#N)C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)c1C	ZINC000875034557	JJ	On-Demand	Reactive	SCD	33	49
C[C@H](NC(=O)C(=O)NCc1c(F)cccc1Cl)c1ccnn1C	ZINC000875034561	ED	On-Demand	Anodyne	P2RX7	20	47
COCCn1c(C)cc(/C=C(/C#N)C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)c1C	ZINC000875034564	JJ	On-Demand	Reactive	SCD1	38	42
COCCn1c(C)cc(/C=C(/C#N)C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)c1C	ZINC000875034564	JJ	On-Demand	Reactive	SCD	33	49
CNS(=O)(=O)c1ccc(CNC(=O)N2Cc3ccccc3[C@H](C)C2)s1	ZINC000875034565	GE	On-Demand	Anodyne	NAMPT	18	40
CNS(=O)(=O)c1ccc(CNC(=O)N2Cc3ccccc3[C@@H](C)C2)s1	ZINC000875034567	GE	On-Demand	Anodyne	NAMPT	18	40
CCOc1ccc([C@@H](C)NC(=O)N2CCC3(CCN(C)CC3)CC2)cc1	ZINC000875034579	FH	On-Demand	Anodyne	ACACB	28	48
O=C(NCCCCC1CC1)C(=O)NCc1ccc(F)c(Cl)c1	ZINC000875034600	EF	On-Demand	Anodyne	SSTR3	15	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Oc1ccc(C#N)cc1OC	ZINC000875034608	FF	On-Demand	Mild	ACE	25	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Oc1ccc(C#N)cc1OC	ZINC000875034608	FF	On-Demand	Mild	TYR	32	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Oc1ccc(C#N)cc1OC	ZINC000875034608	FF	On-Demand	Mild	MME	52	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Oc1ccc(C#N)cc1OC	ZINC000875034608	FF	On-Demand	Mild	CMA1	16	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Oc1ccc(C#N)cc1OC	ZINC000875034608	FF	On-Demand	Mild	CTRA_BOVIN	23	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Oc1ccc(C#N)cc1OC	ZINC000875034608	FF	On-Demand	Mild	CTSB	70	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Oc1ccc(C#N)cc1OC	ZINC000875034608	FF	On-Demand	Mild	PAPA1_CARPA	88	49
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Oc1ccc(C#N)cc1OC	ZINC000875034608	FF	On-Demand	Mild	CYSP_TRYCR	62	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Oc1ccc(C#N)cc1OC	ZINC000875034608	FF	On-Demand	Mild	CTSG	17	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Oc1ccc(C#N)cc1OC	ZINC000875034608	FF	On-Demand	Mild	CTSK	33	49
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Oc1ccc(C#N)cc1OC	ZINC000875034608	FF	On-Demand	Mild	CTSL	63	49
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Oc1ccc(C#N)cc1OC	ZINC000875034608	FF	On-Demand	Mild	TIMP3	46	31
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Oc1ccc(C#N)cc1OC	ZINC000875034608	FF	On-Demand	Mild	CAPNS1	62	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Oc1ccc(C#N)cc1OC	ZINC000875034608	FF	On-Demand	Mild	HLA-DRB1	100	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Oc1ccc(C#N)cc1OC	ZINC000875034608	FF	On-Demand	Mild	CTSS	32	49
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Oc1ccc(C#N)cc1OC	ZINC000875034608	FF	On-Demand	Mild	CAPN1	81	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Oc1ccc(C#N)cc1OC	ZINC000875034608	FF	On-Demand	Mild	CAPN2	99	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Oc1ccc(C#N)cc1OC	ZINC000875034608	FF	On-Demand	Mild	ACE2	45	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Oc1ccc(C#N)cc1OC	ZINC000875034608	FF	On-Demand	Mild	FPR1	47	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Oc1ccc(C#N)cc1OC	ZINC000875034608	FF	On-Demand	Mild	CTRB_BOVIN	75	47
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1cccc(Cl)c1Cl	ZINC000875034617	FE	On-Demand	Mild	P2RX7	34	42
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1cccc(Cl)c1Cl	ZINC000875034619	FE	On-Demand	Mild	P2RX7	34	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(F)c(C)c1	ZINC000875034625	DE	On-Demand	Anodyne	SLC6A4	34	49
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(F)c(C)c1	ZINC000875034625	DE	On-Demand	Anodyne	SLC6A3	63	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(F)c(C)c1	ZINC000875034627	DE	On-Demand	Anodyne	SLC6A4	34	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(F)c(C)c1	ZINC000875034627	DE	On-Demand	Anodyne	SLC6A3	63	49
CC(=O)C1CCN(C(=O)C(=O)NCCOc2ccccc2Cl)CC1	ZINC000875034632	FD	On-Demand	Anodyne	SCD	19	43
O=CN1CCCN(C(=O)NCC2(c3ccccc3)CCCC2)CC1	ZINC000875034642	EE	On-Demand	Anodyne	KCNA3	45	37
O=CN1CCCN(C(=O)NCC2(c3ccccc3)CCCC2)CC1	ZINC000875034642	EE	On-Demand	Anodyne	SMO	15	46
COc1ccc([C@@H]2CN(C(=O)C(=O)NCc3cccc(N(C)C)c3)CCO2)cc1	ZINC000875034643	GD	On-Demand	Anodyne	NOS2	47	32
CCOc1ccc([C@@H](C)NC(=O)N(CC)OCC)cc1	ZINC000875034645	CG	On-Demand	Anodyne	ACACA	30	47
CCOc1ccc([C@@H](C)NC(=O)N(CC)OCC)cc1	ZINC000875034645	CG	On-Demand	Anodyne	ACACB	31	59
O=C(NCc1ccccc1Cn1ccnc1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875034655	GD	On-Demand	Anodyne	CYP19A1	21	41
O=C(NCc1ccccc1Cn1ccnc1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875034655	GD	On-Demand	Anodyne	TBXAS1	28	40
C[C@@H]1CN(C(=O)NCc2coc(-c3cccs3)n2)CC[C@@H](C(F)(F)F)O1	ZINC000875034670	GH	On-Demand	Anodyne	ETHR	42	40
C[C@@H]1CN(C(=O)NCc2coc(-c3cccs3)n2)CC[C@H](C(F)(F)F)O1	ZINC000875034672	GH	On-Demand	Anodyne	ETHR	42	40
CCOc1ccc([C@@H](C)NC(=O)NN=c2cc[nH]c(C)c2)cc1	ZINC000875034673	DF	On-Demand	Reactive	ACACB	23	46
COC(=O)C1=NO[C@@]2(CCN(C(=O)NCCCCc3ccccc3)C2)C1	ZINC000875034684	FE	On-Demand	Anodyne	FAAH	18	43
COC(=O)C1=NO[C@]2(CCN(C(=O)NCCCCc3ccccc3)C2)C1	ZINC000875034686	FE	On-Demand	Anodyne	FAAH	18	43
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(OC(C)C)c2)CC1	ZINC000875034691	ED	On-Demand	Anodyne	MMP13	20	43
CN1CC[C@H]2CN(C(=O)C(=O)NCc3c(F)cccc3Cl)CC[C@@H]21	ZINC000875034694	FD	On-Demand	Anodyne	P2RX7	21	45
CN1CC[C@H]2CN(C(=O)C(=O)NCc3c(F)cccc3Cl)CC[C@H]21	ZINC000875034695	FD	On-Demand	Anodyne	P2RX7	21	45
CN1CCN(C2CCN(C(=O)NCC3(c4ccccc4)CCCC3)CC2)CC1	ZINC000875034708	GF	On-Demand	Anodyne	OPRL1	31	41
CN1CCN(C2CCN(C(=O)NCC3(c4ccccc4)CCCC3)CC2)CC1	ZINC000875034708	GF	On-Demand	Anodyne	KCNA3	49	42
CN1CCN(C2CCN(C(=O)NCC3(c4ccccc4)CCCC3)CC2)CC1	ZINC000875034708	GF	On-Demand	Anodyne	EPHX2	26	42
CN1CCN(C2CCN(C(=O)NCC3(c4ccccc4)CCCC3)CC2)CC1	ZINC000875034708	GF	On-Demand	Anodyne	SMO	27	52
CN1CCN(C2CCN(C(=O)NCC3(c4ccccc4)CCCC3)CC2)CC1	ZINC000875034708	GF	On-Demand	Anodyne	HCN1	41	39
CN1CCN(C2CCN(C(=O)NCC3(c4ccccc4)CCCC3)CC2)CC1	ZINC000875034708	GF	On-Demand	Anodyne	L3MBTL3	87	44
CCCCCCCNC(=O)C(=O)NCc1cccc(N(C)C)c1	ZINC000875034722	DE	On-Demand	Mild	ASAH1	84	35
CCOCCNC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1C	ZINC000875034737	FD	On-Demand	Anodyne	SLC18A2	50	39
CCOCCNC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1C	ZINC000875034738	FD	On-Demand	Anodyne	SLC18A2	50	39
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCc1ccncc1	ZINC000875034754	EE	On-Demand	Anodyne	MME	54	39
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCc1ccncc1	ZINC000875034754	EE	On-Demand	Anodyne	ANPEP	32	42
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCc1ccncc1	ZINC000875034754	EE	On-Demand	Anodyne	MMP2	26	44
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCc1ccncc1	ZINC000875034754	EE	On-Demand	Anodyne	MMP3	45	44
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCc1ccncc1	ZINC000875034754	EE	On-Demand	Anodyne	CAPN1	39	43
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCc1ccncc1	ZINC000875034754	EE	On-Demand	Anodyne	CAPN2	71	43
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCc1ccncc1	ZINC000875034754	EE	On-Demand	Anodyne	AMP1_PLAFQ	39	46
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCc1ccncc1	ZINC000875034757	EE	On-Demand	Anodyne	MME	54	39
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCc1ccncc1	ZINC000875034757	EE	On-Demand	Anodyne	ANPEP	32	42
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCc1ccncc1	ZINC000875034757	EE	On-Demand	Anodyne	MMP2	26	44
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCc1ccncc1	ZINC000875034757	EE	On-Demand	Anodyne	MMP3	45	44
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCc1ccncc1	ZINC000875034757	EE	On-Demand	Anodyne	CAPN1	39	43
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCc1ccncc1	ZINC000875034757	EE	On-Demand	Anodyne	CAPN2	71	43
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCc1ccncc1	ZINC000875034757	EE	On-Demand	Anodyne	AMP1_PLAFQ	39	46
CCOc1ccc(C(=O)N2CCC(NC(=O)N(CC)OCC)CC2)cc1	ZINC000875034786	FF	On-Demand	Anodyne	SSTR5	43	34
CCOc1ccc(C(=O)N2CCC(NC(=O)N(CC)OCC)CC2)cc1	ZINC000875034786	FF	On-Demand	Anodyne	SLC6A5	33	40
CCOc1ccc(C(=O)N2CCC(NC(=O)N(CC)OCC)CC2)cc1	ZINC000875034786	FF	On-Demand	Anodyne	EPHX2	32	40
CCOc1ccc(C(=O)N2CCC(NC(=O)N(CC)OCC)CC2)cc1	ZINC000875034786	FF	On-Demand	Anodyne	PTR1	40	35
CCOc1ccc(C(=O)N2CCC(NC(=O)N(CC)OCC)CC2)cc1	ZINC000875034786	FF	On-Demand	Anodyne	L3MBTL3	58	36
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)[C@@H](O)[C@@H](O)c1nc2ccccc2s1	ZINC000875034792	IH	On-Demand	Anodyne	SCD	30	44
CCOCCNC(=O)C(=O)NC[C@H]1c2ccccc2CN1C	ZINC000875034795	DC	On-Demand	Anodyne	ADAM9	42	34
CCOCCNC(=O)C(=O)NC[C@@H]1c2ccccc2CN1C	ZINC000875034796	DC	On-Demand	Anodyne	ADAM9	42	34
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)[C@H](O)[C@@H](O)c1nc2ccccc2s1	ZINC000875034798	IH	On-Demand	Anodyne	SCD	30	44
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)[C@@H](O)[C@H](O)c1nc2ccccc2s1	ZINC000875034800	IH	On-Demand	Anodyne	SCD	30	44
O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)[C@H](O)[C@H](O)c1nc2ccccc2s1	ZINC000875034801	IH	On-Demand	Anodyne	SCD	30	44
COc1ccc([C@@H](NC(=O)N2CCCN(C=O)CC2)C2CC2)cc1	ZINC000875034812	EE	On-Demand	Anodyne	MMP13	17	40
COc1ccc([C@H](NC(=O)N2CCCN(C=O)CC2)C2CC2)cc1	ZINC000875034814	EE	On-Demand	Anodyne	MMP13	17	40
CCOC(=O)Nc1ccc(C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)cc1	ZINC000875034826	HJ	On-Demand	Anodyne	SCD1	48	52
CCOC(=O)Nc1ccc(C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)cc1	ZINC000875034826	HJ	On-Demand	Anodyne	SCD	43	61
CCOCCNC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875034831	DC	On-Demand	Anodyne	ACE	30	40
CCOCCNC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875034831	DC	On-Demand	Anodyne	FKBP1A	35	42
CCOCCNC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875034832	DC	On-Demand	Anodyne	ACE	30	40
CCOCCNC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875034832	DC	On-Demand	Anodyne	FKBP1A	35	42
CCOCCNC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875034833	DC	On-Demand	Anodyne	ACE	30	40
CCOCCNC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875034833	DC	On-Demand	Anodyne	FKBP1A	35	42
CCOCCNC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875034834	DC	On-Demand	Anodyne	ACE	30	40
CCOCCNC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875034834	DC	On-Demand	Anodyne	FKBP1A	35	42
CCOc1ccc(C(=O)N2CCC(NC(=O)N[C@@H](C)c3ccnn3C)CC2)cc1	ZINC000875034846	GE	On-Demand	Anodyne	EPHX2	35	42
CCOc1ccc(C(=O)N2CCC(NC(=O)N[C@H](C)c3ccnn3C)CC2)cc1	ZINC000875034849	GE	On-Demand	Anodyne	EPHX2	35	42
COc1ccc([C@H](NC(=O)N2CCC(C(=O)NCCO)CC2)C2CC2)cc1	ZINC000875034854	GD	On-Demand	Anodyne	MTNR1A	24	40
COc1ccc([C@@H](NC(=O)N2CCC(C(=O)NCCO)CC2)C2CC2)cc1	ZINC000875034856	GD	On-Demand	Anodyne	MTNR1A	24	40
CCOc1ccc(C(=O)N2CCC(NC(=O)N[C@@H]3CCCC[C@@H]3F)CC2)cc1	ZINC000875034905	GG	On-Demand	Anodyne	SLC6A5	34	43
CCOc1ccc(C(=O)N2CCC(NC(=O)N[C@@H]3CCCC[C@@H]3F)CC2)cc1	ZINC000875034905	GG	On-Demand	Anodyne	EPHX2	55	44
CCOc1ccc(C(=O)N2CCC(NC(=O)N[C@@H]3CCCC[C@@H]3F)CC2)cc1	ZINC000875034905	GG	On-Demand	Anodyne	L3MBTL3	67	36
CCOc1ccc(C(=O)N2CCC(NC(=O)N[C@@H]3C[C@@H](SC)C3)CC2)cc1	ZINC000875034906	GF	On-Demand	Anodyne	SSTR5	41	34
CCOc1ccc(C(=O)N2CCC(NC(=O)N[C@@H]3C[C@@H](SC)C3)CC2)cc1	ZINC000875034906	GF	On-Demand	Anodyne	SLC6A5	34	42
CCOc1ccc(C(=O)N2CCC(NC(=O)N[C@@H]3C[C@@H](SC)C3)CC2)cc1	ZINC000875034906	GF	On-Demand	Anodyne	EPHX2	56	46
CCOc1ccc(C(=O)N2CCC(NC(=O)N[C@@H]3C[C@@H](SC)C3)CC2)cc1	ZINC000875034906	GF	On-Demand	Anodyne	L3MBTL3	57	35
CCC1(CC)CCCN1C(=O)NCc1ccc(CS(=O)(=O)NC)cc1	ZINC000875034910	FF	On-Demand	Anodyne	SLC12A5	41	31
CCC1(CC)CCCN1C(=O)NCc1ccc(CS(=O)(=O)NC)cc1	ZINC000875034910	FF	On-Demand	Anodyne	TMPRSS11D	65	33
O=C1CCN(C(=O)C(=O)NCc2c(F)cccc2Cl)CCCCCCN1	ZINC000875034932	GE	On-Demand	Anodyne	P2RX7	18	45
CCOc1ccc([C@@H](C)NC(=O)N(C)CCN2CC3(CCOCC3)C2)cc1	ZINC000875034936	GF	On-Demand	Anodyne	ACACB	20	44
CN1CCN(C2CCN(C(=O)C(=O)NCc3c(F)cccc3Cl)CC2)CC1	ZINC000875034937	GD	On-Demand	Anodyne	P2RX7	23	47
CN1CCN(C2CCN(C(=O)C(=O)NCc3c(F)cccc3Cl)CC2)CC1	ZINC000875034937	GD	On-Demand	Anodyne	L3MBTL3	70	41
COC(=O)C1(O)CN(C(=O)NCC2(c3ccccc3)CCCC2)C1	ZINC000875034944	ED	On-Demand	Anodyne	KCNA3	55	42
O=C(NCc1ccc(F)cc1F)C(=O)N1CCC(CO)(CO)CC1	ZINC000875034947	EC	On-Demand	Anodyne	P2RX7	37	41
CCOc1ccc([C@@H](C)NC(=O)NN(C)C(=O)OC)cc1	ZINC000875034949	CE	On-Demand	Reactive	ACACA	28	45
CCOc1ccc([C@@H](C)NC(=O)NN(C)C(=O)OC)cc1	ZINC000875034949	CE	On-Demand	Reactive	ACACB	30	56
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1ccc(F)cc1F	ZINC000875034950	DD	On-Demand	Mild	P2RX7	24	41
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1ccc(F)cc1F	ZINC000875034951	DD	On-Demand	Mild	P2RX7	24	41
COC(=O)N(C)NC(=O)N[C@H](c1ccccc1)C1CC1	ZINC000875034954	CE	On-Demand	Reactive	TACR3	16	42
COC(=O)N(C)NC(=O)N[C@@H](c1ccccc1)C1CC1	ZINC000875034955	CE	On-Demand	Reactive	TACR3	16	42
CCOc1ccc([C@@H](C)NC(=O)NC[C@@H]2CC(C(F)(F)F)=NO2)cc1	ZINC000875034963	FG	On-Demand	Anodyne	ACACB	22	44
CCOc1ccc([C@@H](C)NC(=O)NC[C@H]2CC(C(F)(F)F)=NO2)cc1	ZINC000875034964	FG	On-Demand	Anodyne	ACACB	22	44
O=C(N[C@@H](c1ccccc1)C1CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875034965	EH	On-Demand	Anodyne	RBP4	40	35
O=C(N[C@@H](c1ccccc1)C1CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875034966	EH	On-Demand	Anodyne	RBP4	40	35
O=C(N[C@H](c1ccccc1)C1CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875034967	EH	On-Demand	Anodyne	RBP4	40	35
O=C(N[C@H](c1ccccc1)C1CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875034968	EH	On-Demand	Anodyne	RBP4	40	35
O=C(CN1C(=O)COc2ccc(Cl)cc21)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875034969	II	On-Demand	Anodyne	PIK3CG	18	41
O=C(CN1C(=O)COc2ccc(Cl)cc21)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875034969	II	On-Demand	Anodyne	SCD1	36	41
O=C(CN1C(=O)COc2ccc(Cl)cc21)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875034969	II	On-Demand	Anodyne	SCD	32	44
Cc1nc(O)nc(O)c1CCC(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875034972	HG	On-Demand	Anodyne	SCD1	36	40
Cc1nc(O)nc(O)c1CCC(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875034972	HG	On-Demand	Anodyne	SCD	31	47
COC(=O)N(C)NC(=O)NCc1ccc(F)c(C)c1	ZINC000875034978	CD	On-Demand	Reactive	LEF	50	42
COCC(C)(C)CCNC(=O)C(=O)NCc1ccc(F)cc1F	ZINC000875034981	ED	On-Demand	Anodyne	P2RX7	41	43
O=C(NCc1ccccc1Cn1ccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875034987	EF	On-Demand	Anodyne	CYP19A1	18	42
O=C(NCc1ccccc1Cn1ccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875034987	EF	On-Demand	Anodyne	CYP11B1	31	40
O=C(NCc1ccccc1Cn1ccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875034987	EF	On-Demand	Anodyne	TBXAS1	27	41
O=C(NCc1ccccc1Cn1ccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875034987	EF	On-Demand	Anodyne	CYP11B2	18	40
CCN(CCNC(=O)OC(C)(C)C)C(=O)C(=O)NCc1ccc(F)cc1F	ZINC000875034988	GD	On-Demand	Anodyne	P2RX7	19	41
O=C(NCc1ccccc1Cn1ccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875034989	EF	On-Demand	Anodyne	CYP19A1	18	42
O=C(NCc1ccccc1Cn1ccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875034989	EF	On-Demand	Anodyne	CYP11B1	31	40
O=C(NCc1ccccc1Cn1ccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875034989	EF	On-Demand	Anodyne	TBXAS1	27	41
O=C(NCc1ccccc1Cn1ccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875034989	EF	On-Demand	Anodyne	CYP11B2	18	40
O=C(NCc1ccccc1Cn1ccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875034991	EF	On-Demand	Anodyne	CYP19A1	18	42
O=C(NCc1ccccc1Cn1ccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875034991	EF	On-Demand	Anodyne	CYP11B1	31	40
O=C(NCc1ccccc1Cn1ccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875034991	EF	On-Demand	Anodyne	TBXAS1	27	41
O=C(NCc1ccccc1Cn1ccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875034991	EF	On-Demand	Anodyne	CYP11B2	18	40
O=C(NCc1ccccc1Cn1ccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875034992	EF	On-Demand	Anodyne	CYP19A1	18	42
O=C(NCc1ccccc1Cn1ccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875034992	EF	On-Demand	Anodyne	CYP11B1	31	40
O=C(NCc1ccccc1Cn1ccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875034992	EF	On-Demand	Anodyne	TBXAS1	27	41
O=C(NCc1ccccc1Cn1ccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875034992	EF	On-Demand	Anodyne	CYP11B2	18	40
C/C=C\c1ccc(OCC(=O)Oc2cc(OC)cc(OC)c2)c(OC)c1	ZINC000875034993	FH	On-Demand	Anodyne	CYP1B1	38	45
C/C=C\c1ccc(OCC(=O)Oc2cc(OC)cc(OC)c2)c(OC)c1	ZINC000875034993	FH	On-Demand	Anodyne	CYP1A1	38	50
C/C=C\c1ccc(OCC(=O)Oc2cc(OC)cc(OC)c2)c(OC)c1	ZINC000875034993	FH	On-Demand	Anodyne	TUBB1	60	39
C/C=C\c1ccc(OCC(=O)Oc2cc(OC)cc(OC)c2)c(OC)c1	ZINC000875034993	FH	On-Demand	Anodyne	ABCG2	21	47
N#Cc1ccccc1/C=C/C(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875034997	GJ	On-Demand	Mild	SCD1	36	40
N#Cc1ccccc1/C=C/C(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875034997	GJ	On-Demand	Mild	SCD	32	47
N#Cc1ccccc1/C=C\C(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875035001	GJ	On-Demand	Mild	SCD1	36	40
N#Cc1ccccc1/C=C\C(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875035001	GJ	On-Demand	Mild	SCD	32	47
CN(C)C[C@@H]1CN(C(=O)NCCCCc2ccccc2)C[C@H]1CN(C)C	ZINC000875035003	FE	On-Demand	Anodyne	FKBP1A	21	41
CN(C)C[C@@H]1CN(C(=O)NCCCCc2ccccc2)C[C@H]1CN(C)C	ZINC000875035003	FE	On-Demand	Anodyne	OPRM1	17	45
CN(C)C[C@@H]1CN(C(=O)NCCCCc2ccccc2)C[C@H]1CN(C)C	ZINC000875035003	FE	On-Demand	Anodyne	SIGMAR1	25	40
CN(C)C[C@@H]1CN(C(=O)NCCCCc2ccccc2)C[C@H]1CN(C)C	ZINC000875035003	FE	On-Demand	Anodyne	FAAH	25	50
CN(C)C[C@@H]1CN(C(=O)NCCCCc2ccccc2)C[C@H]1CN(C)C	ZINC000875035003	FE	On-Demand	Anodyne	AMP1_PLAFQ	27	43
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)N[C@@H](c2ccccc2)C2CC2)C1	ZINC000875035008	GF	On-Demand	Anodyne	EPHX2	21	43
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)N[C@@H](c2ccccc2)C2CC2)C1	ZINC000875035008	GF	On-Demand	Anodyne	BIRC2	29	40
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)N[C@H](c2ccccc2)C2CC2)C1	ZINC000875035011	GF	On-Demand	Anodyne	EPHX2	21	43
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)N[C@H](c2ccccc2)C2CC2)C1	ZINC000875035011	GF	On-Demand	Anodyne	BIRC2	29	40
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)N[C@@H](c2ccccc2)C2CC2)C1	ZINC000875035013	GF	On-Demand	Anodyne	EPHX2	21	43
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)N[C@@H](c2ccccc2)C2CC2)C1	ZINC000875035013	GF	On-Demand	Anodyne	BIRC2	29	40
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)N[C@H](c2ccccc2)C2CC2)C1	ZINC000875035015	GF	On-Demand	Anodyne	EPHX2	21	43
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)N[C@H](c2ccccc2)C2CC2)C1	ZINC000875035015	GF	On-Demand	Anodyne	BIRC2	29	40
CCOc1ccc([C@@H](C)NC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)cc1	ZINC000875035018	GF	On-Demand	Anodyne	ACACA	26	40
CCOc1ccc([C@@H](C)NC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)cc1	ZINC000875035018	GF	On-Demand	Anodyne	ACACB	29	48
O=C(NCc1ccccc1Cn1ccnc1)NC1CC(Nc2ccccc2)C1	ZINC000875035019	GG	On-Demand	Anodyne	CYP19A1	20	46
O=C(NCc1ccccc1Cn1ccnc1)NC1CC(Nc2ccccc2)C1	ZINC000875035019	GG	On-Demand	Anodyne	CYP11B1	34	43
O=C(NCc1ccccc1Cn1ccnc1)NC1CC(Nc2ccccc2)C1	ZINC000875035019	GG	On-Demand	Anodyne	TBXAS1	39	44
O=C(NCc1ccccc1Cn1ccnc1)NC1CC(Nc2ccccc2)C1	ZINC000875035019	GG	On-Demand	Anodyne	CYP11B2	20	43
O=C(NCC[C@H]1CCSC1)C(=O)NCc1cccc(Cl)c1Cl	ZINC000875035024	FF	On-Demand	Anodyne	P2RX7	30	44
O=C(NCC[C@@H]1CCSC1)C(=O)NCc1cccc(Cl)c1Cl	ZINC000875035025	FF	On-Demand	Anodyne	P2RX7	30	44
O=C(NCc1ccccc1Cn1ccnc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875035034	GH	On-Demand	Anodyne	CYP19A1	20	41
O=C(NCc1ccccc1Cn1ccnc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875035034	GH	On-Demand	Anodyne	CYP11B1	27	40
O=C(NCc1ccccc1Cn1ccnc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875035034	GH	On-Demand	Anodyne	TBXAS1	42	42
O=C(NCc1ccccc1Cn1ccnc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875035034	GH	On-Demand	Anodyne	CYP11B2	17	40
O=C(NCc1ccccc1Cn1ccnc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875035034	GH	On-Demand	Anodyne	EPHX2	22	48
O=C(NCc1ccccc1Cn1ccnc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875035036	GH	On-Demand	Anodyne	CYP19A1	20	41
O=C(NCc1ccccc1Cn1ccnc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875035036	GH	On-Demand	Anodyne	CYP11B1	27	40
O=C(NCc1ccccc1Cn1ccnc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875035036	GH	On-Demand	Anodyne	TBXAS1	42	42
O=C(NCc1ccccc1Cn1ccnc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875035036	GH	On-Demand	Anodyne	CYP11B2	17	40
O=C(NCc1ccccc1Cn1ccnc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875035036	GH	On-Demand	Anodyne	EPHX2	22	48
CN1CCN(C2CCN(C(=O)C(=O)NCc3cccc(N(C)C)c3)CC2)CC1	ZINC000875035038	GC	On-Demand	Anodyne	L3MBTL3	61	38
C=C1c2ccccc2C(=O)N1CCC(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875035068	II	On-Demand	Anodyne	SCD	30	44
O=C(NCCO)C1CCN(C(=O)NCC2(c3ccccc3)CCCC2)CC1	ZINC000875035070	FE	On-Demand	Anodyne	KCNA3	47	43
O=C(NCCO)C1CCN(C(=O)NCC2(c3ccccc3)CCCC2)CC1	ZINC000875035070	FE	On-Demand	Anodyne	EPHX2	26	40
O=C(NCCO)C1CCN(C(=O)NCC2(c3ccccc3)CCCC2)CC1	ZINC000875035070	FE	On-Demand	Anodyne	CACNA1G	23	54
O=C(NCCO)C1CCN(C(=O)NCC2(c3ccccc3)CCCC2)CC1	ZINC000875035070	FE	On-Demand	Anodyne	SMO	18	49
O=C(NCCCCc1ccccc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875035079	EG	On-Demand	Anodyne	FKBP1A	27	42
O=C(NCCCCc1ccccc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875035079	EG	On-Demand	Anodyne	FAAH	18	48
O=C(NCCCCc1ccccc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875035079	EG	On-Demand	Anodyne	CES1	25	42
O=C(NCCCCc1ccccc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875035080	EG	On-Demand	Anodyne	FKBP1A	27	42
O=C(NCCCCc1ccccc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875035080	EG	On-Demand	Anodyne	FAAH	18	48
O=C(NCCCCc1ccccc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875035080	EG	On-Demand	Anodyne	CES1	25	42
CN(C)C[C@@H]1CN(C(=O)NCc2ccccc2Cn2ccnc2)C[C@H]1CN(C)C	ZINC000875035103	GD	On-Demand	Anodyne	CYP19A1	24	43
CN(C)C[C@@H]1CN(C(=O)NCc2ccccc2Cn2ccnc2)C[C@H]1CN(C)C	ZINC000875035103	GD	On-Demand	Anodyne	CYP11B1	36	43
CN(C)C[C@@H]1CN(C(=O)NCc2ccccc2Cn2ccnc2)C[C@H]1CN(C)C	ZINC000875035103	GD	On-Demand	Anodyne	TBXAS1	36	42
CN(C)C[C@@H]1CN(C(=O)NCc2ccccc2Cn2ccnc2)C[C@H]1CN(C)C	ZINC000875035103	GD	On-Demand	Anodyne	CYP11B2	21	43
COC(=O)C1(O)CN(C(=O)NCCCCc2ccccc2)C1	ZINC000875035107	DC	On-Demand	Anodyne	SIGMAR1	23	40
COC(=O)C1(O)CN(C(=O)NCCCCc2ccccc2)C1	ZINC000875035107	DC	On-Demand	Anodyne	SCN2A	20	42
COC(=O)C1(O)CN(C(=O)NCCCCc2ccccc2)C1	ZINC000875035107	DC	On-Demand	Anodyne	FAAH	52	48
COC(=O)C1(O)CN(C(=O)NCCCCc2ccccc2)C1	ZINC000875035107	DC	On-Demand	Anodyne	CES1	43	39
COC(=O)C1(O)CN(C(=O)NCCCCc2ccccc2)C1	ZINC000875035107	DC	On-Demand	Anodyne	AMP1_PLAFQ	23	43
O=C(NCc1ccccc1Cn1ccnc1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875035110	GG	On-Demand	Anodyne	CYP19A1	21	43
O=C(NCc1ccccc1Cn1ccnc1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875035110	GG	On-Demand	Anodyne	CYP11B1	31	40
O=C(NCc1ccccc1Cn1ccnc1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875035110	GG	On-Demand	Anodyne	TBXAS1	34	44
O=C(NCc1ccccc1Cn1ccnc1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875035110	GG	On-Demand	Anodyne	CYP11B2	19	40
O=C(NCCCCc1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875035111	EI	On-Demand	Anodyne	ACE	30	41
O=C(NCCCCc1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875035111	EI	On-Demand	Anodyne	FKBP1A	42	46
O=C(NCCCCc1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875035111	EI	On-Demand	Anodyne	SIGMAR1	25	40
O=C(NCCCCc1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875035111	EI	On-Demand	Anodyne	PREP	75	45
O=C(NCCCCc1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875035111	EI	On-Demand	Anodyne	FAAH	31	53
O=C(NCCCCc1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875035111	EI	On-Demand	Anodyne	EPHX2	33	42
O=C(NCCCCc1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875035111	EI	On-Demand	Anodyne	AMP1_PLAFQ	25	40
O=C(NCCCCc1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875035112	EI	On-Demand	Anodyne	ACE	30	41
O=C(NCCCCc1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875035112	EI	On-Demand	Anodyne	FKBP1A	42	46
O=C(NCCCCc1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875035112	EI	On-Demand	Anodyne	SIGMAR1	25	40
O=C(NCCCCc1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875035112	EI	On-Demand	Anodyne	PREP	75	45
O=C(NCCCCc1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875035112	EI	On-Demand	Anodyne	FAAH	31	53
O=C(NCCCCc1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875035112	EI	On-Demand	Anodyne	EPHX2	33	42
O=C(NCCCCc1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875035112	EI	On-Demand	Anodyne	AMP1_PLAFQ	25	40
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CN(C(=O)C(=O)NCCc1ccncc1)C2	ZINC000875035217	GD	On-Demand	Anodyne	GPR119	30	43
CCOc1ccc(C(=O)N2CCC(NC(=O)N3C[C@H]4CC=CC[C@H]4C3)CC2)cc1	ZINC000875035287	GG	On-Demand	Anodyne	SSTR5	41	34
CCOc1ccc(C(=O)N2CCC(NC(=O)N3C[C@H]4CC=CC[C@H]4C3)CC2)cc1	ZINC000875035287	GG	On-Demand	Anodyne	SLC6A5	33	40
CCOc1ccc(C(=O)N2CCC(NC(=O)N3C[C@H]4CC=CC[C@H]4C3)CC2)cc1	ZINC000875035287	GG	On-Demand	Anodyne	L3MBTL3	57	36
CCOc1ccc(C(=O)N2CCC(NC(=O)NC3CC(COC)C3)CC2)cc1	ZINC000875035288	GE	On-Demand	Anodyne	SSTR5	41	34
CCOc1ccc(C(=O)N2CCC(NC(=O)NC3CC(COC)C3)CC2)cc1	ZINC000875035288	GE	On-Demand	Anodyne	SLC6A5	34	42
CCOc1ccc(C(=O)N2CCC(NC(=O)NC3CC(COC)C3)CC2)cc1	ZINC000875035288	GE	On-Demand	Anodyne	EPHX2	58	48
CCOc1ccc(C(=O)N2CCC(NC(=O)NC3CC(COC)C3)CC2)cc1	ZINC000875035288	GE	On-Demand	Anodyne	L3MBTL3	57	35
CCOc1ccc(C(=O)N2CCC(NC(=O)N[C@@H]3C[C@H]4C[C@H]3[C@H]3C[C@@H]34)CC2)cc1	ZINC000875035292	GG	On-Demand	Anodyne	EPHX2	47	43
CCOc1ccc(C(=O)N2CCC(NC(=O)N[C@@H]3C[C@H]4C[C@H]3[C@H]3C[C@@H]34)CC2)cc1	ZINC000875035292	GG	On-Demand	Anodyne	L3MBTL3	48	32
CCOc1ccc(C(=O)N2CCC(NC(=O)N[C@@H]3C[C@H]4C[C@H]3[C@H]3C[C@H]34)CC2)cc1	ZINC000875035293	GG	On-Demand	Anodyne	EPHX2	47	43
CCOc1ccc(C(=O)N2CCC(NC(=O)N[C@@H]3C[C@H]4C[C@H]3[C@H]3C[C@H]34)CC2)cc1	ZINC000875035293	GG	On-Demand	Anodyne	L3MBTL3	48	32
CCOc1ccc(C(=O)N2CCC(NC(=O)N[C@@H]3C[C@H]4C[C@H]3[C@@H]3C[C@H]43)CC2)cc1	ZINC000875035294	GG	On-Demand	Anodyne	EPHX2	47	43
CCOc1ccc(C(=O)N2CCC(NC(=O)N[C@@H]3C[C@H]4C[C@H]3[C@@H]3C[C@H]43)CC2)cc1	ZINC000875035294	GG	On-Demand	Anodyne	L3MBTL3	48	32
CCOc1ccc(C(=O)N2CCC(NC(=O)N[C@@H]3C[C@H]4C[C@H]3[C@@H]3C[C@@H]43)CC2)cc1	ZINC000875035295	GG	On-Demand	Anodyne	EPHX2	47	43
CCOc1ccc(C(=O)N2CCC(NC(=O)N[C@@H]3C[C@H]4C[C@H]3[C@@H]3C[C@@H]43)CC2)cc1	ZINC000875035295	GG	On-Demand	Anodyne	L3MBTL3	48	32
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)cc1	ZINC000875035305	JK	On-Demand	Anodyne	SCD1	48	51
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)cc1	ZINC000875035305	JK	On-Demand	Anodyne	SCD	43	59
O=C(NCCOc1ccccc1Cl)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875035337	GF	On-Demand	Anodyne	SCD1	22	42
O=C(NCCOc1ccccc1Cl)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875035337	GF	On-Demand	Anodyne	SCD	21	44
O=C(NCCOc1ccccc1Cl)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875035338	GF	On-Demand	Anodyne	SCD1	22	42
O=C(NCCOc1ccccc1Cl)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875035338	GF	On-Demand	Anodyne	SCD	21	44
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccccc2Cn2ccnc2)C1	ZINC000875035343	FE	On-Demand	Anodyne	CYP19A1	19	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccccc2Cn2ccnc2)C1	ZINC000875035343	FE	On-Demand	Anodyne	CYP11B1	36	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccccc2Cn2ccnc2)C1	ZINC000875035343	FE	On-Demand	Anodyne	TBXAS1	37	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccccc2Cn2ccnc2)C1	ZINC000875035343	FE	On-Demand	Anodyne	CYP11B2	21	42
O=C(NCc1ccc(Cn2cncn2)cc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875035349	GF	On-Demand	Anodyne	HIS3	41	35
O=C(NCc1ccc(Cn2cncn2)cc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875035349	GF	On-Demand	Anodyne	PREP	16	41
O=C(NCc1ccc(Cn2cncn2)cc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875035349	GF	On-Demand	Anodyne	TMPRSS11D	57	34
O=C(NCc1ccc(Cn2cncn2)cc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875035350	GF	On-Demand	Anodyne	HIS3	41	35
O=C(NCc1ccc(Cn2cncn2)cc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875035350	GF	On-Demand	Anodyne	PREP	16	41
O=C(NCc1ccc(Cn2cncn2)cc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875035350	GF	On-Demand	Anodyne	TMPRSS11D	57	34
O=C(NCc1ccc(Cn2cncn2)cc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875035351	GF	On-Demand	Anodyne	HIS3	41	35
O=C(NCc1ccc(Cn2cncn2)cc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875035351	GF	On-Demand	Anodyne	PREP	16	41
O=C(NCc1ccc(Cn2cncn2)cc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875035351	GF	On-Demand	Anodyne	TMPRSS11D	57	34
O=C(NCc1ccc(Cn2cncn2)cc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875035352	GF	On-Demand	Anodyne	HIS3	41	35
O=C(NCc1ccc(Cn2cncn2)cc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875035352	GF	On-Demand	Anodyne	PREP	16	41
O=C(NCc1ccc(Cn2cncn2)cc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875035352	GF	On-Demand	Anodyne	TMPRSS11D	57	34
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1Cn1ccnc1	ZINC000875035362	FE	On-Demand	Anodyne	CYP19A1	19	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1Cn1ccnc1	ZINC000875035362	FE	On-Demand	Anodyne	CYP11B1	29	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1Cn1ccnc1	ZINC000875035362	FE	On-Demand	Anodyne	TBXAS1	28	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1Cn1ccnc1	ZINC000875035362	FE	On-Demand	Anodyne	CYP11B2	18	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1Cn1ccnc1	ZINC000875035363	FE	On-Demand	Anodyne	CYP19A1	19	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1Cn1ccnc1	ZINC000875035363	FE	On-Demand	Anodyne	CYP11B1	29	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1Cn1ccnc1	ZINC000875035363	FE	On-Demand	Anodyne	TBXAS1	28	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1Cn1ccnc1	ZINC000875035363	FE	On-Demand	Anodyne	CYP11B2	18	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1csc(C)n1	ZINC000875035367	DD	On-Demand	Anodyne	SLC6A3	42	35
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1csc(C)n1	ZINC000875035368	DD	On-Demand	Anodyne	SLC6A3	42	35
Cc1nc(CNC(=O)NC[C@@H]2CN(Cc3ccccc3C)CCO2)cs1	ZINC000875035371	FE	On-Demand	Anodyne	PDE8B	47	35
Cc1nc(CNC(=O)NC[C@H]2CN(Cc3ccccc3C)CCO2)cs1	ZINC000875035372	FE	On-Demand	Anodyne	PDE8B	47	35
COCC(C)(C)CCNC(=O)C(=O)NCc1cccc(OC(C)C)c1	ZINC000875035375	FE	On-Demand	Anodyne	PDS	57	34
O=C(NCc1ccccc1Cn1ccnc1)N1CCC(CO)(CO)CC1	ZINC000875035381	FD	On-Demand	Anodyne	CYP19A1	25	50
O=C(NCc1ccccc1Cn1ccnc1)N1CCC(CO)(CO)CC1	ZINC000875035381	FD	On-Demand	Anodyne	CYP11B1	40	46
O=C(NCc1ccccc1Cn1ccnc1)N1CCC(CO)(CO)CC1	ZINC000875035381	FD	On-Demand	Anodyne	TBXAS1	45	46
O=C(NCc1ccccc1Cn1ccnc1)N1CCC(CO)(CO)CC1	ZINC000875035381	FD	On-Demand	Anodyne	CYP11B2	23	46
CCOc1ccc([C@@H](C)NC(=O)NNc2nnc(C)n2C)cc1	ZINC000875035398	DD	On-Demand	Reactive	ACACB	24	46
CC(=O)C1CCN(C(=O)NCC2(c3ccccc3)CCCC2)CC1	ZINC000875035403	EH	On-Demand	Anodyne	KCNA3	52	44
CC(=O)C1CCN(C(=O)NCC2(c3ccccc3)CCCC2)CC1	ZINC000875035403	EH	On-Demand	Anodyne	EPHX2	38	40
CC(=O)C1CCN(C(=O)NCC2(c3ccccc3)CCCC2)CC1	ZINC000875035403	EH	On-Demand	Anodyne	CACNA1G	15	50
CC(=O)C1CCN(C(=O)NCC2(c3ccccc3)CCCC2)CC1	ZINC000875035403	EH	On-Demand	Anodyne	SMO	22	52
CC(=O)C1CCN(C(=O)NCC2(c3ccccc3)CCCC2)CC1	ZINC000875035403	EH	On-Demand	Anodyne	HCN1	57	32
CC(=O)C1CCN(C(=O)NCC2(c3ccccc3)CCCC2)CC1	ZINC000875035403	EH	On-Demand	Anodyne	HCN4	49	32
O=C(NCC1(c2ccccc2)CCCC1)N1CCC2(CCNC2=O)CC1	ZINC000875035416	FF	On-Demand	Anodyne	KCNA3	42	42
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NCc2ccc(F)cc2F)CC1	ZINC000875035420	FC	On-Demand	Anodyne	P2RX7	34	41
CCOc1ccc([C@@H](C)NC(=O)N(C)OCC(F)(F)F)cc1	ZINC000875035423	DG	On-Demand	Anodyne	ACACA	25	43
CCOc1ccc([C@@H](C)NC(=O)N(C)OCC(F)(F)F)cc1	ZINC000875035423	DG	On-Demand	Anodyne	ACACB	27	53
O=C(NCc1ccc(F)c(Cl)c1)C(=O)N[C@@H]1CC12CCC2	ZINC000875035425	DE	On-Demand	Anodyne	SSTR3	18	41
O=C(NCc1ccc(F)c(Cl)c1)C(=O)N[C@@H]1CC12CCC2	ZINC000875035425	DE	On-Demand	Anodyne	ENV	40	36
O=C(NCc1ccc(F)c(Cl)c1)C(=O)N[C@H]1CC12CCC2	ZINC000875035426	DE	On-Demand	Anodyne	SSTR3	18	41
O=C(NCc1ccc(F)c(Cl)c1)C(=O)N[C@H]1CC12CCC2	ZINC000875035426	DE	On-Demand	Anodyne	ENV	40	36
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCn2cnc3ccccc32)C1	ZINC000875035429	EC	On-Demand	Anodyne	HPGD	24	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCn2cnc3ccccc32)C1	ZINC000875035430	EC	On-Demand	Anodyne	HPGD	24	40
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCc1c(F)cccc1Cl	ZINC000875035437	GE	On-Demand	Anodyne	P2RX7	21	45
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCc1c(F)cccc1Cl	ZINC000875035438	GE	On-Demand	Anodyne	P2RX7	21	45
Cn1nnnc1C1CCN(C(=O)NCC2(c3ccccc3)CCCC2)CC1	ZINC000875035442	FF	On-Demand	Anodyne	KCNA3	47	38
Cn1nnnc1C1CCN(C(=O)NCC2(c3ccccc3)CCCC2)CC1	ZINC000875035442	FF	On-Demand	Anodyne	SMO	27	52
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(F)c(Cl)c2)CC1	ZINC000875035471	ED	On-Demand	Anodyne	EPHX2	22	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](c2ccccc2)C2CC2)C1	ZINC000875035490	EF	On-Demand	Anodyne	ACE	33	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](c2ccccc2)C2CC2)C1	ZINC000875035490	EF	On-Demand	Anodyne	P2RY12	36	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](c2ccccc2)C2CC2)C1	ZINC000875035490	EF	On-Demand	Anodyne	Q6PRC7_IXORI	55	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](c2ccccc2)C2CC2)C1	ZINC000875035491	EF	On-Demand	Anodyne	ACE	33	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](c2ccccc2)C2CC2)C1	ZINC000875035491	EF	On-Demand	Anodyne	P2RY12	36	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](c2ccccc2)C2CC2)C1	ZINC000875035491	EF	On-Demand	Anodyne	Q6PRC7_IXORI	55	35
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1ccc(C(C)(C)C)cc1	ZINC000875035531	EE	On-Demand	Mild	TRPV1	27	41
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1ccc(C(C)(C)C)cc1	ZINC000875035532	EE	On-Demand	Mild	TRPV1	27	41
CCOCCNC(=O)C(=O)N[C@H](C)c1ccc(C(F)(F)F)nc1	ZINC000875035583	ED	On-Demand	Anodyne	TRPV1	49	35
CCOCCNC(=O)C(=O)N[C@@H](C)c1ccc(C(F)(F)F)nc1	ZINC000875035584	ED	On-Demand	Anodyne	TRPV1	49	35
CCOc1ccc(C(=O)N2CCC(NC(=O)NCCC(C)(C)OC)CC2)cc1	ZINC000875035595	GF	On-Demand	Anodyne	SSTR5	45	36
CCOc1ccc(C(=O)N2CCC(NC(=O)NCCC(C)(C)OC)CC2)cc1	ZINC000875035595	GF	On-Demand	Anodyne	SLC6A5	37	43
CCOc1ccc(C(=O)N2CCC(NC(=O)NCCC(C)(C)OC)CC2)cc1	ZINC000875035595	GF	On-Demand	Anodyne	EPHX2	47	43
CCOc1ccc(C(=O)N2CCC(NC(=O)NCCC(C)(C)OC)CC2)cc1	ZINC000875035595	GF	On-Demand	Anodyne	L3MBTL3	44	32
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(OC(C)C)cc2)C1	ZINC000875035598	ED	On-Demand	Anodyne	DPP7	53	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(OC(C)C)cc2)C1	ZINC000875035600	ED	On-Demand	Anodyne	DPP7	53	40
O=C(NCc1ccccc1Cn1cccn1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875035601	GH	On-Demand	Anodyne	EPHX2	24	48
O=C(CCn1c(S)nnc1-c1cccs1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875035603	JJ	On-Demand	Anodyne	SCD	29	43
O=C(NCc1ccccc1Cn1cccn1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875035604	GH	On-Demand	Anodyne	EPHX2	24	48
O=C(NCCc1ccncc1)C(=O)NCc1ccccc1CC(F)(F)F	ZINC000875035625	FE	On-Demand	Anodyne	CA5B	16	41
C[C@H]1CN(Cc2ccccc2)C[C@H]1CNC(=O)C(=O)NCCc1ccncc1	ZINC000875035634	GD	On-Demand	Anodyne	DRD4	17	47
C[C@H]1CN(Cc2ccccc2)C[C@H]1CNC(=O)C(=O)NCCc1ccncc1	ZINC000875035634	GD	On-Demand	Anodyne	ACHE	15	42
C[C@H]1CN(Cc2ccccc2)C[C@@H]1CNC(=O)C(=O)NCCc1ccncc1	ZINC000875035635	GD	On-Demand	Anodyne	DRD4	17	47
C[C@H]1CN(Cc2ccccc2)C[C@@H]1CNC(=O)C(=O)NCCc1ccncc1	ZINC000875035635	GD	On-Demand	Anodyne	ACHE	15	42
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1CNC(=O)C(=O)NCCc1ccncc1	ZINC000875035636	GD	On-Demand	Anodyne	DRD4	17	47
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1CNC(=O)C(=O)NCCc1ccncc1	ZINC000875035636	GD	On-Demand	Anodyne	ACHE	15	42
C[C@@H]1CN(Cc2ccccc2)C[C@H]1CNC(=O)C(=O)NCCc1ccncc1	ZINC000875035637	GD	On-Demand	Anodyne	DRD4	17	47
C[C@@H]1CN(Cc2ccccc2)C[C@H]1CNC(=O)C(=O)NCCc1ccncc1	ZINC000875035637	GD	On-Demand	Anodyne	ACHE	15	42
O=C(NCCc1ccncc1)C(=O)N1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000875035646	GF	On-Demand	Anodyne	CCR3	17	42
CCOc1ccc(C(=O)N2CCC(NC(=O)N[C@H](CC)C[C@H](C)O)CC2)cc1	ZINC000875035655	GF	On-Demand	Anodyne	EPHX2	40	41
CCOc1ccc(C(=O)N2CCC(NC(=O)N[C@H](CC)C[C@H](C)O)CC2)cc1	ZINC000875035655	GF	On-Demand	Anodyne	L3MBTL3	42	33
CCOc1ccc(C(=O)N2CCC(NC(=O)N[C@H](CC)C[C@@H](C)O)CC2)cc1	ZINC000875035656	GF	On-Demand	Anodyne	EPHX2	40	41
CCOc1ccc(C(=O)N2CCC(NC(=O)N[C@H](CC)C[C@@H](C)O)CC2)cc1	ZINC000875035656	GF	On-Demand	Anodyne	L3MBTL3	42	33
CCOc1ccc(C(=O)N2CCC(NC(=O)N[C@@H](CC)C[C@H](C)O)CC2)cc1	ZINC000875035657	GF	On-Demand	Anodyne	EPHX2	40	41
CCOc1ccc(C(=O)N2CCC(NC(=O)N[C@@H](CC)C[C@H](C)O)CC2)cc1	ZINC000875035657	GF	On-Demand	Anodyne	L3MBTL3	42	33
CCOc1ccc(C(=O)N2CCC(NC(=O)N[C@@H](CC)C[C@@H](C)O)CC2)cc1	ZINC000875035658	GF	On-Demand	Anodyne	EPHX2	40	41
CCOc1ccc(C(=O)N2CCC(NC(=O)N[C@@H](CC)C[C@@H](C)O)CC2)cc1	ZINC000875035658	GF	On-Demand	Anodyne	L3MBTL3	42	33
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCCc2ccncc2)c1	ZINC000875035674	ED	On-Demand	Anodyne	FKBP1A	23	41
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCCc2ccncc2)c1	ZINC000875035675	ED	On-Demand	Anodyne	FKBP1A	23	41
O=CN1CCCN(C(=O)NCc2ccccc2OC(F)(F)F)CC1	ZINC000875035684	ED	On-Demand	Anodyne	EPHX2	17	59
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1coc(-c2cccs2)n1	ZINC000875035694	FF	On-Demand	Anodyne	SLC6A4	17	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1coc(-c2cccs2)n1	ZINC000875035694	FF	On-Demand	Anodyne	SLC6A3	32	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1coc(-c2cccs2)n1	ZINC000875035695	FF	On-Demand	Anodyne	SLC6A4	17	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1coc(-c2cccs2)n1	ZINC000875035695	FF	On-Demand	Anodyne	SLC6A3	32	43
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(F)c(C)c2)C1	ZINC000875035699	DE	On-Demand	Anodyne	LEF	59	39
CNS(=O)(=O)c1ccc(CNC(=O)N2Cc3cccc(O)c3C2)s1	ZINC000875035724	FD	On-Demand	Clean	NAMPT	22	42
O=C1CCN(C(=O)C(=O)NCc2ccc(F)c(Cl)c2)CCCCCCN1	ZINC000875035737	GE	On-Demand	Anodyne	F2R	40	31
O=C1CCN(C(=O)C(=O)NCc2ccc(F)c(Cl)c2)CCCCCCN1	ZINC000875035737	GE	On-Demand	Anodyne	MAPK1	29	44
CCOc1ccc([C@@H](C)NC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875035740	EG	On-Demand	Anodyne	ACACA	25	41
CCOc1ccc([C@@H](C)NC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875035740	EG	On-Demand	Anodyne	ACACB	27	46
CCOc1ccc([C@@H](C)NC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875035743	EG	On-Demand	Anodyne	ACACA	25	41
CCOc1ccc([C@@H](C)NC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875035743	EG	On-Demand	Anodyne	ACACB	27	46
O=C(NCc1ccc(F)cc1F)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875035751	DE	On-Demand	Anodyne	P2RX7	42	41
C[C@@H]1[C@@H](NC(=O)C(=O)NCc2ccc(F)cc2F)CCN1C(=O)OC(C)(C)C	ZINC000875035752	GE	On-Demand	Anodyne	P2RX7	33	41
C[C@@H]1[C@@H](NC(=O)C(=O)NCc2ccc(F)cc2F)CCN1C(=O)OC(C)(C)C	ZINC000875035752	GE	On-Demand	Anodyne	GPR119	19	45
O=C(NCCSCCC(F)(F)F)C(=O)NCc1ccc(F)cc1F	ZINC000875035757	FE	On-Demand	Anodyne	P2RX7	31	41
CCOc1ccc([C@@H](C)NC(=O)NC2(C)CC(F)(F)C2)cc1	ZINC000875035758	DH	On-Demand	Anodyne	ACACA	24	42
CCOc1ccc([C@@H](C)NC(=O)NC2(C)CC(F)(F)C2)cc1	ZINC000875035758	DH	On-Demand	Anodyne	ACACB	25	51
CONC(=O)C1CCN(C(=O)NCC2(c3ccccc3)CCCC2)CC1	ZINC000875035763	FF	On-Demand	Anodyne	KCNA3	55	42
CONC(=O)C1CCN(C(=O)NCC2(c3ccccc3)CCCC2)CC1	ZINC000875035763	FF	On-Demand	Anodyne	CACNA1G	27	51
CONC(=O)C1CCN(C(=O)NCC2(c3ccccc3)CCCC2)CC1	ZINC000875035763	FF	On-Demand	Anodyne	SMO	20	49
CONC(=O)C1CCN(C(=O)NCC2(c3ccccc3)CCCC2)CC1	ZINC000875035763	FF	On-Demand	Anodyne	NPFFR1	19	40
CONC(=O)C1CCN(C(=O)NCC2(c3ccccc3)CCCC2)CC1	ZINC000875035763	FF	On-Demand	Anodyne	HCN1	40	31
CONC(=O)C1CCN(C(=O)NCC2(c3ccccc3)CCCC2)CC1	ZINC000875035763	FF	On-Demand	Anodyne	HCN4	40	31
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(F)cc3F)CC[C@H]21	ZINC000875035767	ED	On-Demand	Anodyne	P2RX7	53	41
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(F)cc3F)CC[C@@H]21	ZINC000875035768	ED	On-Demand	Anodyne	P2RX7	53	41
O=C(NCc1ccc(F)cc1F)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875035769	GF	On-Demand	Anodyne	C3AR1	37	40
O=C(NCc1ccc(F)cc1F)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875035770	GF	On-Demand	Anodyne	C3AR1	37	40
CN(C)C[C@@H]1CN(C(=O)C(=O)NCc2ccc(F)cc2F)C[C@H]1CN(C)C	ZINC000875035775	GC	On-Demand	Anodyne	P2RX7	50	42
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000875035782	HI	On-Demand	Bother	SCD1	43	56
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000875035782	HI	On-Demand	Bother	SCD	36	56
CCOc1ccc([C@@H](C)NC(=O)N2CC[C@@]3(CC(C(=O)OC)=NO3)C2)cc1	ZINC000875035788	GE	On-Demand	Anodyne	ACACB	20	42
CCOc1ccc([C@@H](C)NC(=O)N2CC[C@]3(CC(C(=O)OC)=NO3)C2)cc1	ZINC000875035791	GE	On-Demand	Anodyne	ACACB	20	42
CCOc1ccc(C(=O)N2CCC(NC(=O)NN=c3cc[nH]c(C)c3)CC2)cc1	ZINC000875035800	GE	On-Demand	Reactive	EPHX2	38	41
O=C(NCc1ccccc1Cn1cccn1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875035829	GF	On-Demand	Anodyne	EPHX2	19	44
O=C(NCc1ccccc1Cn1cccn1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875035834	GF	On-Demand	Anodyne	EPHX2	19	44
O=C(NCc1ccc(Cn2cncn2)cc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875035849	GE	On-Demand	Anodyne	CYP19A1	22	42
O=C(NCc1ccc(Cn2cncn2)cc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875035849	GE	On-Demand	Anodyne	CNR1	15	43
O=C(NCc1ccc(Cn2cncn2)cc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875035850	GE	On-Demand	Anodyne	CYP19A1	22	42
O=C(NCc1ccc(Cn2cncn2)cc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875035850	GE	On-Demand	Anodyne	CNR1	15	43
O=C(NCc1ccccc1OC(F)(F)F)N1CCC(CO)(CO)CC1	ZINC000875035861	FD	On-Demand	Anodyne	EPHX2	34	43
O=C(NCc1ccccc1OC(F)(F)F)N1CCC(CO)(CO)CC1	ZINC000875035861	FD	On-Demand	Anodyne	CCR8	15	40
O=C(NCCc1ccncc1)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875035875	FD	On-Demand	Anodyne	NPY2R	43	37
CCOc1ccc(C(=O)N2CCC(NC(=O)NN=c3cc[nH]cc3C)CC2)cc1	ZINC000875035883	GE	On-Demand	Reactive	EPHX2	33	40
O=C(Cn1c(S)nnc1-c1ccc(Cl)cc1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875035887	JJ	On-Demand	Anodyne	SCD1	38	44
O=C(Cn1c(S)nnc1-c1ccc(Cl)cc1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000875035887	JJ	On-Demand	Anodyne	SCD	32	47
CCOCCNC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875035895	DD	On-Demand	Anodyne	GHRHR	34	41
CCOCCNC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875035896	DD	On-Demand	Anodyne	GHRHR	34	41
CCOCCNC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875035900	EC	On-Demand	Anodyne	NPY2R	60	37
CC[C@@H](NC(=O)NCc1ccc(Cn2cncn2)cc1)[C@@H](O)c1ccccc1	ZINC000875035904	GF	On-Demand	Anodyne	HIS3	57	37
CC[C@@H](NC(=O)NCc1ccc(Cn2cncn2)cc1)[C@H](O)c1ccccc1	ZINC000875035906	GF	On-Demand	Anodyne	HIS3	57	37
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NCCc3ccncc3)C2)c1	ZINC000875035930	GD	On-Demand	Anodyne	DRD4	22	40
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NCCc3ccncc3)C2)c1	ZINC000875035931	GD	On-Demand	Anodyne	DRD4	22	40
COCC(C)(C)CCNC(=O)C(=O)NCc1ccc(C(C)(C)C)cc1	ZINC000875035968	EF	On-Demand	Anodyne	TRPV1	38	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccc(OC)cc1)C1CC1	ZINC000875035969	FF	On-Demand	Anodyne	SLC6A4	24	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccc(OC)cc1)C1CC1	ZINC000875035969	FF	On-Demand	Anodyne	SLC6A3	50	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccc(OC)cc1)C1CC1	ZINC000875035970	FF	On-Demand	Anodyne	SLC6A4	24	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccc(OC)cc1)C1CC1	ZINC000875035970	FF	On-Demand	Anodyne	SLC6A3	50	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccc(OC)cc1)C1CC1	ZINC000875035971	FF	On-Demand	Anodyne	SLC6A4	24	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccc(OC)cc1)C1CC1	ZINC000875035971	FF	On-Demand	Anodyne	SLC6A3	50	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccc(OC)cc1)C1CC1	ZINC000875035972	FF	On-Demand	Anodyne	SLC6A4	24	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccc(OC)cc1)C1CC1	ZINC000875035972	FF	On-Demand	Anodyne	SLC6A3	50	45
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2ccc(OCC)cc2)C1	ZINC000875035980	EF	On-Demand	Anodyne	ACACA	30	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2ccc(OCC)cc2)C1	ZINC000875035980	EF	On-Demand	Anodyne	ACACB	35	48
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2ccc(OCC)cc2)C1	ZINC000875035982	EF	On-Demand	Anodyne	ACACA	30	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2ccc(OCC)cc2)C1	ZINC000875035982	EF	On-Demand	Anodyne	ACACB	35	48
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(F)cc2F)CC1	ZINC000875035993	DD	On-Demand	Anodyne	HTR2A	15	41
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(F)cc2F)CC1	ZINC000875035993	DD	On-Demand	Anodyne	P2RX7	61	42
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(F)cc2F)CC1	ZINC000875035993	DD	On-Demand	Anodyne	EPHX2	21	50
CCOc1ccc([C@@H](C)NC(=O)N2CCCC[C@@H]2CNC(=O)NC)cc1	ZINC000875035999	FF	On-Demand	Anodyne	ACACA	24	42
CCOc1ccc([C@@H](C)NC(=O)N2CCCC[C@@H]2CNC(=O)NC)cc1	ZINC000875035999	FF	On-Demand	Anodyne	ACACB	27	44
CCOc1ccc([C@@H](C)NC(=O)N2CCCC[C@H]2CNC(=O)NC)cc1	ZINC000875036002	FF	On-Demand	Anodyne	ACACA	24	42
CCOc1ccc([C@@H](C)NC(=O)N2CCCC[C@H]2CNC(=O)NC)cc1	ZINC000875036002	FF	On-Demand	Anodyne	ACACB	27	44
O=C(NCC1(c2ccccc2)CCCC1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875036003	GF	On-Demand	Anodyne	KCNA3	43	36
CCOc1ccc([C@@H](C)NC(=O)N[C@@H]2C[C@H]3C[C@@]3(C(=O)OC)C2)cc1	ZINC000875036009	EF	On-Demand	Anodyne	ACACB	21	45
CCCCCCCNC(=O)C(=O)NCc1ccc(F)cc1F	ZINC000875036010	DF	On-Demand	Mild	P2RX7	44	47
CCCCCCCNC(=O)C(=O)NCc1ccc(F)cc1F	ZINC000875036010	DF	On-Demand	Mild	GRIA1	54	35
CCCCCCCNC(=O)C(=O)NCc1ccc(F)cc1F	ZINC000875036010	DF	On-Demand	Mild	ASAH1	98	39
O=C(N[C@H](c1ccccc1)C1CC1)N1Cc2cccnc2N2C[C@H](O)C[C@H]2C1	ZINC000875036011	GF	On-Demand	Anodyne	TTK	24	42
O=C(N[C@@H](c1ccccc1)C1CC1)N1Cc2cccnc2N2C[C@H](O)C[C@H]2C1	ZINC000875036012	GF	On-Demand	Anodyne	TTK	24	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2c(F)cccc2Cl)C1	ZINC000875036015	ED	On-Demand	Anodyne	P2RX7	26	48
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2c(F)cccc2Cl)C1	ZINC000875036016	ED	On-Demand	Anodyne	P2RX7	26	48
CCOc1ccc([C@@H](C)NC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875036026	DE	On-Demand	Anodyne	ACACB	26	47
O=C(N[C@@H](c1ccccc1)C1CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875036041	EI	On-Demand	Anodyne	EPHX2	20	42
O=C(N[C@@H](c1ccccc1)C1CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875036042	EI	On-Demand	Anodyne	EPHX2	20	42
O=C(N[C@H](c1ccccc1)C1CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875036043	EI	On-Demand	Anodyne	EPHX2	20	42
O=C(N[C@H](c1ccccc1)C1CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875036044	EI	On-Demand	Anodyne	EPHX2	20	42
C#CC[C@H](COC)NC(=O)C(=O)NCc1ccc(F)cc1F	ZINC000875036050	DC	On-Demand	Mild	P2RX7	15	40
C#CC[C@@H](COC)NC(=O)C(=O)NCc1ccc(F)cc1F	ZINC000875036051	DC	On-Demand	Mild	P2RX7	15	40
CCOc1ccc([C@@H](C)NC(=O)N(CCOC)CC2CCN(C)CC2)cc1	ZINC000875036053	GG	On-Demand	Anodyne	ACACA	21	41
CCOc1ccc([C@@H](C)NC(=O)N(CCOC)CC2CCN(C)CC2)cc1	ZINC000875036053	GG	On-Demand	Anodyne	ACACB	21	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)C1CC1	ZINC000875036073	EF	On-Demand	Anodyne	SLC6A4	29	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)C1CC1	ZINC000875036073	EF	On-Demand	Anodyne	SLC6A3	70	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)C1CC1	ZINC000875036074	EF	On-Demand	Anodyne	SLC6A4	29	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)C1CC1	ZINC000875036074	EF	On-Demand	Anodyne	SLC6A3	70	47
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)C1CC1	ZINC000875036075	EF	On-Demand	Anodyne	SLC6A4	29	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)C1CC1	ZINC000875036075	EF	On-Demand	Anodyne	SLC6A3	70	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)C1CC1	ZINC000875036076	EF	On-Demand	Anodyne	SLC6A4	29	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)C1CC1	ZINC000875036076	EF	On-Demand	Anodyne	SLC6A3	70	47
O=C(NCC1(c2ccccc2)CCCC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875036078	GH	On-Demand	Anodyne	SMO	42	60
O=C(NCC1(c2ccccc2)CCCC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875036078	GH	On-Demand	Anodyne	ETHR	53	35
O=C(NCC1(c2ccccc2)CCCC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875036079	GH	On-Demand	Anodyne	SMO	42	60
O=C(NCC1(c2ccccc2)CCCC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875036079	GH	On-Demand	Anodyne	ETHR	53	35
CCCCCCCNC(=O)C(=O)NCCn1cnc2ccccc21	ZINC000875036089	EE	On-Demand	Mild	CNR1	20	42
CCCCCCCNC(=O)C(=O)NCCn1cnc2ccccc21	ZINC000875036089	EE	On-Demand	Mild	NR1I2	16	44
CCCCCCCNC(=O)C(=O)NCCn1cnc2ccccc21	ZINC000875036089	EE	On-Demand	Mild	ASAH1	91	38
CCOc1ccc([C@@H](C)NC(=O)N2CCO[C@H](C(F)(F)F)CC2)cc1	ZINC000875036090	FH	On-Demand	Anodyne	ACACB	20	43
CCOc1ccc([C@@H](C)NC(=O)N2CCO[C@H](C(F)(F)F)CC2)cc1	ZINC000875036090	FH	On-Demand	Anodyne	CTSS	19	40
CCOc1ccc([C@@H](C)NC(=O)N2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000875036091	FH	On-Demand	Anodyne	ACACB	20	43
CCOc1ccc([C@@H](C)NC(=O)N2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000875036091	FH	On-Demand	Anodyne	CTSS	19	40
CCOc1ccc([C@@H](C)NC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875036094	EH	On-Demand	Clean	ACACB	24	46
O=C(NC[C@H]1C[C@H](O)C1)NCC1(c2ccccc2)CCCC1	ZINC000875036096	DF	On-Demand	Anodyne	KCNA3	48	39
O=C(NCc1cccc(Cl)c1Cl)C(=O)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875036120	GF	On-Demand	Anodyne	P2RX7	19	42
O=C(NCc1cccc(Cl)c1Cl)C(=O)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875036121	GF	On-Demand	Anodyne	P2RX7	19	42
O=C(NCc1cccc(Cl)c1Cl)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875036122	GF	On-Demand	Anodyne	P2RX7	19	42
O=C(NCc1cccc(Cl)c1Cl)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875036123	GF	On-Demand	Anodyne	P2RX7	19	42
O=C(NCc1ccc(F)cc1F)C(=O)N[C@@H]1CC12CCC2	ZINC000875036126	CD	On-Demand	Anodyne	P2RX7	27	41
O=C(NCc1ccc(F)cc1F)C(=O)N[C@H]1CC12CCC2	ZINC000875036127	CD	On-Demand	Anodyne	P2RX7	27	41
CCOc1ccc([C@@H](C)NC(=O)NN=c2cc[nH]cc2C)cc1	ZINC000875036137	DF	On-Demand	Reactive	ACACB	22	46
CCOc1ccc([C@@H](C)NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)cc1	ZINC000875036146	EG	On-Demand	Anodyne	ACACA	25	41
CCOc1ccc([C@@H](C)NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)cc1	ZINC000875036146	EG	On-Demand	Anodyne	ACACB	27	46
O=C(NCC1(c2ccccc2)CCCC1)N1CCC(CO)(CO)CC1	ZINC000875036149	EE	On-Demand	Anodyne	KCNA3	47	39
O=C(NCC1(c2ccccc2)CCCC1)N1CCC(CO)(CO)CC1	ZINC000875036149	EE	On-Demand	Anodyne	EPHX2	17	43
O=C(NCC1(c2ccccc2)CCCC1)N1CCC(CO)(CO)CC1	ZINC000875036149	EE	On-Demand	Anodyne	SMO	15	48
O=C(NCC1(c2ccccc2)CCCC1)N1CCC(CO)(CO)CC1	ZINC000875036149	EE	On-Demand	Anodyne	NPFFR1	19	41
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2c(F)cccc2Cl)C1	ZINC000875036151	EE	On-Demand	Anodyne	P2RX7	27	51
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(F)c(Cl)c2)C1	ZINC000875036161	ED	On-Demand	Anodyne	DPP7	40	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(F)c(Cl)c2)C1	ZINC000875036162	ED	On-Demand	Anodyne	DPP7	40	38
CCOc1ccc([C@@H](C)NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875036172	EE	On-Demand	Anodyne	ACACB	19	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(F)c(C)c1	ZINC000875036178	CE	On-Demand	Anodyne	ANPEP	15	42
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(F)c(C)c1	ZINC000875036178	CE	On-Demand	Anodyne	LEF	54	39
CN1CCN(C2CCN(C(=O)C(=O)NCc3ccc(F)c(Cl)c3)CC2)CC1	ZINC000875036190	GD	On-Demand	Anodyne	HRH3	15	42
CN1CCN(C2CCN(C(=O)C(=O)NCc3ccc(F)c(Cl)c3)CC2)CC1	ZINC000875036190	GD	On-Demand	Anodyne	CCR3	37	40
CN1CCN(C2CCN(C(=O)C(=O)NCc3ccc(F)c(Cl)c3)CC2)CC1	ZINC000875036190	GD	On-Demand	Anodyne	MAPK1	27	45
CN1CCN(C2CCN(C(=O)C(=O)NCc3ccc(F)c(Cl)c3)CC2)CC1	ZINC000875036190	GD	On-Demand	Anodyne	CXCR3	19	45
CN1CCN(C2CCN(C(=O)C(=O)NCc3ccc(F)c(Cl)c3)CC2)CC1	ZINC000875036190	GD	On-Demand	Anodyne	L3MBTL3	58	38
CCOc1ccc([C@@H](C)NC(=O)N2CCCCCCNC(=O)CC2)cc1	ZINC000875036192	FG	On-Demand	Anodyne	ACACB	20	43
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](c1ccccc1)C1CC1	ZINC000875036202	CF	On-Demand	Anodyne	TACR3	24	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](c1ccccc1)C1CC1	ZINC000875036204	CF	On-Demand	Anodyne	TACR3	24	40
CCOc1ccc([C@@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)cc1	ZINC000875036208	FD	On-Demand	Anodyne	ACACA	21	46
CCOc1ccc([C@@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)cc1	ZINC000875036208	FD	On-Demand	Anodyne	ACACB	24	46
CCOc1ccc([C@@H](C)NC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875036210	ED	On-Demand	Anodyne	ACACA	25	40
CCOc1ccc([C@@H](C)NC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875036210	ED	On-Demand	Anodyne	ACACB	28	49
COC(=O)N(C)NC(=O)NCC1(c2ccccc2)CCCC1	ZINC000875036223	DE	On-Demand	Reactive	KCNA3	55	45
COC(=O)N(C)NC(=O)NCC1(c2ccccc2)CCCC1	ZINC000875036223	DE	On-Demand	Reactive	NMBR	44	35
O=C(NCc1coc(-c2cccs2)n1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875036229	GG	On-Demand	Anodyne	ETHR	54	43
O=C(NCc1coc(-c2cccs2)n1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875036230	GG	On-Demand	Anodyne	ETHR	54	43
CO[C@@H]1C[C@@H]2CN(C(=O)N[C@H](c3ccccc3)C3CC3)Cc3cccnc3N2C1	ZINC000875036232	GG	On-Demand	Anodyne	TTK	23	40
CO[C@@H]1C[C@@H]2CN(C(=O)N[C@@H](c3ccccc3)C3CC3)Cc3cccnc3N2C1	ZINC000875036233	GG	On-Demand	Anodyne	TTK	23	40
CN1CCN(C2CCN(C(=O)C(=O)NCCn3cnc4ccccc43)CC2)CC1	ZINC000875036240	GC	On-Demand	Anodyne	L3MBTL3	49	37
CCOc1ccc([C@@H](C)NC(=O)NC[C@H]2C[C@H](O)C2)cc1	ZINC000875036247	CE	On-Demand	Anodyne	ACACA	23	42
CCOc1ccc([C@@H](C)NC(=O)NC[C@H]2C[C@H](O)C2)cc1	ZINC000875036247	CE	On-Demand	Anodyne	ACACB	26	50
CCOc1ccc([C@@H](C)NC(=O)NC2CC(C(=O)OC)C2)cc1	ZINC000875036251	DE	On-Demand	Anodyne	ACACA	31	44
CCOc1ccc([C@@H](C)NC(=O)NC2CC(C(=O)OC)C2)cc1	ZINC000875036251	DE	On-Demand	Anodyne	ACACB	33	53
CCOc1ccc([C@@H](C)NC(=O)NNc2cccc(C)n2)cc1	ZINC000875036258	DG	On-Demand	Reactive	ACACA	23	41
CCOc1ccc([C@@H](C)NC(=O)NNc2cccc(C)n2)cc1	ZINC000875036258	DG	On-Demand	Reactive	ACACB	24	47
CCOc1ccc([C@@H](C)NC(=O)NNc2cccc(C)n2)cc1	ZINC000875036258	DG	On-Demand	Reactive	GRM5	19	40
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccc(F)cc2F)C1	ZINC000875036263	ED	On-Demand	Anodyne	TRPV1	43	34
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccc(F)cc2F)C1	ZINC000875036263	ED	On-Demand	Anodyne	P2RX7	45	41
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000875036277	HJ	On-Demand	Bother	TAAR1	16	42
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000875036277	HJ	On-Demand	Bother	SCD1	48	57
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000875036277	HJ	On-Demand	Bother	SCD	39	57
CCOc1ccc([C@@H](C)NC(=O)N2CCN(C)C(C)(C)CC2)cc1	ZINC000875036279	EG	On-Demand	Anodyne	ACACB	25	46
C#CC[C@H](COC)NC(=O)C(=O)NCc1cccc(Cl)c1Cl	ZINC000875036287	ED	On-Demand	Mild	P2RX7	24	41
C#CC[C@@H](COC)NC(=O)C(=O)NCc1cccc(Cl)c1Cl	ZINC000875036288	ED	On-Demand	Mild	P2RX7	24	41
O=C1OC[C@H]2CN(C(=O)NCC3(c4ccccc4)CCCC3)C[C@@H]12	ZINC000875036295	EE	On-Demand	Anodyne	KCNA3	41	36
O=C1OC[C@H]2CN(C(=O)NCC3(c4ccccc4)CCCC3)C[C@@H]12	ZINC000875036295	EE	On-Demand	Anodyne	SMO	15	45
CC[C@@H](NC(=O)C(=O)NCc1ccc(F)cc1F)c1cccc(OC)c1OC	ZINC000875036297	GF	On-Demand	Anodyne	P2RX7	20	42
CC[C@@H](NC(=O)C(=O)NCc1ccc(F)cc1F)c1cccc(OC)c1OC	ZINC000875036297	GF	On-Demand	Anodyne	KCNK3	19	41
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCc2ccc(F)cc2F)c1	ZINC000875036313	FF	On-Demand	Anodyne	P2RX7	42	43
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCc2ccc(F)cc2F)c1	ZINC000875036314	FF	On-Demand	Anodyne	P2RX7	42	43
CN1CCN(C2CCN(C(=O)C(=O)NCc3ccc(F)cc3F)CC2)CC1	ZINC000875036315	GC	On-Demand	Anodyne	P2RX7	47	42
CN1CCN(C2CCN(C(=O)C(=O)NCc3ccc(F)cc3F)CC2)CC1	ZINC000875036315	GC	On-Demand	Anodyne	L3MBTL3	62	40
CCOc1ccc([C@@H](C)NC(=O)N2CC(CNC(=O)C(F)(F)F)C2)cc1	ZINC000875036316	FE	On-Demand	Anodyne	ACACB	21	44
CNS(=O)(=O)c1ccc(CNC(=O)N2CCN(C)c3ncccc3C2)s1	ZINC000875036318	GD	On-Demand	Anodyne	NAMPT	23	40
CN(C)C[C@@H]1CN(C(=O)C(=O)NCc2c(F)cccc2Cl)C[C@H]1CN(C)C	ZINC000875036319	GD	On-Demand	Anodyne	P2RX7	18	47
CCOc1ccc([C@@H](C)NC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)cc1	ZINC000875036323	EF	On-Demand	Anodyne	SLC6A4	25	51
CCOc1ccc([C@@H](C)NC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)cc1	ZINC000875036323	EF	On-Demand	Anodyne	SLC6A3	52	51
CCOc1ccc([C@@H](C)NC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)cc1	ZINC000875036323	EF	On-Demand	Anodyne	ACACA	26	42
CCOc1ccc([C@@H](C)NC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)cc1	ZINC000875036323	EF	On-Demand	Anodyne	ACACB	28	45
CCOc1ccc([C@@H](C)NC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)cc1	ZINC000875036325	EF	On-Demand	Anodyne	SLC6A4	25	51
CCOc1ccc([C@@H](C)NC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)cc1	ZINC000875036325	EF	On-Demand	Anodyne	SLC6A3	52	51
CCOc1ccc([C@@H](C)NC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)cc1	ZINC000875036325	EF	On-Demand	Anodyne	ACACA	26	42
CCOc1ccc([C@@H](C)NC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)cc1	ZINC000875036325	EF	On-Demand	Anodyne	ACACB	28	45
CCOc1ccc([C@@H](C)NC(=O)N(CCOC)C2CCOCC2)cc1	ZINC000875036327	FF	On-Demand	Anodyne	ACACA	24	44
CCOc1ccc([C@@H](C)NC(=O)N(CCOC)C2CCOCC2)cc1	ZINC000875036327	FF	On-Demand	Anodyne	ACACB	25	47
COc1cccc(/C=C(\C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)n2nnnc2C)c1	ZINC000875036328	JH	On-Demand	Anodyne	SCD1	39	42
COc1cccc(/C=C(\C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)n2nnnc2C)c1	ZINC000875036328	JH	On-Demand	Anodyne	SCD	34	49
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(F)cc2F)C1	ZINC000875036348	DD	On-Demand	Anodyne	P2RX7	45	44
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(F)cc2F)C1	ZINC000875036349	DD	On-Demand	Anodyne	P2RX7	45	44
CC(=O)C1CCN(C(=O)C(=O)NCc2c(F)cccc2Cl)CC1	ZINC000875036352	ED	On-Demand	Anodyne	P2RX7	33	51
CC(=O)C1CCN(C(=O)C(=O)NCc2c(F)cccc2Cl)CC1	ZINC000875036352	ED	On-Demand	Anodyne	EPHX2	19	51
O=C(NCCCCC1CC1)C(=O)NCc1ccc(F)cc1F	ZINC000875036361	DE	On-Demand	Anodyne	TRPV1	49	33
O=C(NCCCCC1CC1)C(=O)NCc1ccc(F)cc1F	ZINC000875036361	DE	On-Demand	Anodyne	P2RX7	34	42
O=C(NCc1cccc(Cl)c1Cl)C(=O)N[C@@H]1CC12CCC2	ZINC000875036363	EF	On-Demand	Anodyne	P2RX7	30	43
O=C(NCc1cccc(Cl)c1Cl)C(=O)N[C@H]1CC12CCC2	ZINC000875036364	EF	On-Demand	Anodyne	P2RX7	30	43
C=CC(C)(C)CCCNC(=O)C(=O)NCc1ccc(F)cc1F	ZINC000875036367	DF	On-Demand	Mild	P2RX7	20	45
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCc1ccc(F)cc1F	ZINC000875036371	FD	On-Demand	Anodyne	P2RX7	57	42
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCc1ccc(F)cc1F	ZINC000875036372	FD	On-Demand	Anodyne	P2RX7	57	42
CCOc1ccc([C@@H](C)NC(=O)N[C@@H]2CCOC[C@H]2O)cc1	ZINC000875036374	DD	On-Demand	Anodyne	ACACA	22	41
CCOc1ccc([C@@H](C)NC(=O)N[C@@H]2CCOC[C@H]2O)cc1	ZINC000875036374	DD	On-Demand	Anodyne	ACACB	26	46
Cc1nnc(NNC(=O)NCC2(c3ccccc3)CCCC2)n1C	ZINC000875036380	EE	On-Demand	Reactive	KCNA3	49	39
CCOc1ccc([C@@H](C)NC(=O)NC[C@@H]2CCO[C@@H]2C(=O)OC)cc1	ZINC000875036384	FE	On-Demand	Anodyne	ACACB	17	43
COCC(C)(C)CCNC(=O)C(=O)NCc1cccc(Cl)c1Cl	ZINC000875036400	FF	On-Demand	Anodyne	P2RX7	37	45
O=C(NCC1(c2ccccc2)CCCC1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875036401	GF	On-Demand	Anodyne	KCNA3	47	37
O=C(NCC1(c2ccccc2)CCCC1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875036401	GF	On-Demand	Anodyne	SMO	15	48
O=C(NCC1(c2ccccc2)CCCC1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875036402	GF	On-Demand	Anodyne	KCNA3	47	37
O=C(NCC1(c2ccccc2)CCCC1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875036402	GF	On-Demand	Anodyne	SMO	15	48
O=C(NCC1(c2ccccc2)CCCC1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875036403	GF	On-Demand	Anodyne	KCNA3	47	37
O=C(NCC1(c2ccccc2)CCCC1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875036403	GF	On-Demand	Anodyne	SMO	15	48
O=C(NCC1(c2ccccc2)CCCC1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875036404	GF	On-Demand	Anodyne	KCNA3	47	37
O=C(NCC1(c2ccccc2)CCCC1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875036404	GF	On-Demand	Anodyne	SMO	15	48
CCOc1ccc([C@@H](C)NC(=O)N2CC(O)(C(=O)OC)C2)cc1	ZINC000875036405	DD	On-Demand	Anodyne	ACACA	25	41
CCOc1ccc([C@@H](C)NC(=O)N2CC(O)(C(=O)OC)C2)cc1	ZINC000875036405	DD	On-Demand	Anodyne	ACACB	27	51
CC[C@@H](NC(C)=O)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875036421	ED	On-Demand	Anodyne	CA2	18	50
CC[C@@H](NC(C)=O)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875036421	ED	On-Demand	Anodyne	CA1	18	42
CC[C@@H](NC(C)=O)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875036421	ED	On-Demand	Anodyne	TIMP3	48	32
CC[C@@H](NC(C)=O)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875036421	ED	On-Demand	Anodyne	CA4	18	43
CC[C@@H](NC(C)=O)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875036421	ED	On-Demand	Anodyne	CA14	17	50
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cnc(Cl)c(Cl)c1	ZINC000875036431	HJ	On-Demand	Anodyne	SCD1	47	56
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cnc(Cl)c(Cl)c1	ZINC000875036431	HJ	On-Demand	Anodyne	SCD	38	56
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000875036435	JJ	On-Demand	Anodyne	CPT1A	25	40
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000875036435	JJ	On-Demand	Anodyne	CPT1B	42	40
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000875036435	JJ	On-Demand	Anodyne	SCD1	45	54
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000875036435	JJ	On-Demand	Anodyne	SCD	37	54
CCCOc1ccccc1NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875036443	EH	On-Demand	Anodyne	G2YM83_BOTF4	44	33
Nc1ccc(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cc1[N+](=O)[O-]	ZINC000875036476	GH	On-Demand	Bother	SCD1	45	57
Nc1ccc(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cc1[N+](=O)[O-]	ZINC000875036476	GH	On-Demand	Bother	SCD	37	57
CCO[C@@H](C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1)C(C)C	ZINC000875036478	EF	On-Demand	Anodyne	CA2	15	47
CCO[C@@H](C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1)C(C)C	ZINC000875036478	EF	On-Demand	Anodyne	CA1	18	47
CCO[C@@H](C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1)C(C)C	ZINC000875036478	EF	On-Demand	Anodyne	CA14	16	47
CCCCCCCNC(=O)C(=O)NCc1ccc2ccccc2n1	ZINC000875036484	EF	On-Demand	Mild	CYSLTR1	44	41
CCCCCCCNC(=O)C(=O)NCc1ccc2ccccc2n1	ZINC000875036484	EF	On-Demand	Mild	TSPO	18	41
CCCCCCCNC(=O)C(=O)NCc1ccc2ccccc2n1	ZINC000875036484	EF	On-Demand	Mild	ASAH1	88	38
CCC[C@@H](CC)C(=O)Nc1cccc(-n2cnnn2)c1C	ZINC000875036511	CF	On-Demand	Anodyne	KCNQ2	41	36
CCC[C@H](CC)C(=O)Nc1cccc(-n2cnnn2)c1C	ZINC000875036512	CF	On-Demand	Anodyne	KCNQ2	41	36
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875036513	HJ	On-Demand	Bother	SCD1	34	44
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875036513	HJ	On-Demand	Bother	SCD	30	51
O=C(/C=C/c1ccc([N+](=O)[O-])cc1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875036514	HJ	On-Demand	Bother	SCD1	34	44
O=C(/C=C/c1ccc([N+](=O)[O-])cc1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875036514	HJ	On-Demand	Bother	SCD	30	51
Cc1c(NC(=O)[C@H](Cc2cccnc2)C2CCCC2)cccc1-n1cnnn1	ZINC000875036568	GG	On-Demand	Anodyne	C3AR1	40	40
Cc1c(NC(=O)[C@@H](Cc2cccnc2)C2CCCC2)cccc1-n1cnnn1	ZINC000875036569	GG	On-Demand	Anodyne	C3AR1	40	40
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cc(Cl)ccc1[N+](=O)[O-]	ZINC000875036635	HJ	On-Demand	Bother	SCD1	41	48
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cc(Cl)ccc1[N+](=O)[O-]	ZINC000875036635	HJ	On-Demand	Bother	SCD	33	48
O=C(NCc1ccc2ccccc2n1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875036653	GF	On-Demand	Anodyne	ALOX5	29	43
O=C(NCc1ccc2ccccc2n1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875036653	GF	On-Demand	Anodyne	TRY1_BOVIN	40	33
O=C(NCc1ccc2ccccc2n1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875036654	GF	On-Demand	Anodyne	ALOX5	29	43
O=C(NCc1ccc2ccccc2n1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875036654	GF	On-Demand	Anodyne	TRY1_BOVIN	40	33
O=C(NCc1ccc2ccccc2n1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875036655	GF	On-Demand	Anodyne	ALOX5	29	43
O=C(NCc1ccc2ccccc2n1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875036655	GF	On-Demand	Anodyne	TRY1_BOVIN	40	33
O=C(NCc1ccc2ccccc2n1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875036656	GF	On-Demand	Anodyne	ALOX5	29	43
O=C(NCc1ccc2ccccc2n1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875036656	GF	On-Demand	Anodyne	TRY1_BOVIN	40	33
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000875036673	JG	On-Demand	Anodyne	CPT1A	19	41
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000875036673	JG	On-Demand	Anodyne	SCD1	44	52
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000875036673	JG	On-Demand	Anodyne	SCD	36	52
CCO[C@@H](C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1)C1CCOCC1	ZINC000875036716	GE	On-Demand	Anodyne	TIMP3	40	30
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cc([N+](=O)[O-])ccc1Cl	ZINC000875036728	HJ	On-Demand	Bother	SCD1	41	49
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cc([N+](=O)[O-])ccc1Cl	ZINC000875036728	HJ	On-Demand	Bother	SCD	33	49
CCC[C@@H](OCC)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875036735	EF	On-Demand	Anodyne	CA2	15	49
CCC[C@@H](OCC)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875036735	EF	On-Demand	Anodyne	CA1	15	43
CCC[C@@H](OCC)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875036735	EF	On-Demand	Anodyne	CA14	16	48
CCC[C@H](OCC)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875036736	EF	On-Demand	Anodyne	CA2	15	49
CCC[C@H](OCC)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875036736	EF	On-Demand	Anodyne	CA1	15	43
CCC[C@H](OCC)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875036736	EF	On-Demand	Anodyne	CA14	16	48
O=Cc1ccccc1OCC(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875036794	GH	On-Demand	Anodyne	SCD1	41	51
O=Cc1ccccc1OCC(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875036794	GH	On-Demand	Anodyne	SCD	35	51
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)ccc1Cl	ZINC000875036798	JJ	On-Demand	Anodyne	SCD1	47	55
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)ccc1Cl	ZINC000875036798	JJ	On-Demand	Anodyne	SCD	38	55
CN1CCN(C2CCN(C(=O)N[C@@H](c3cccs3)C3CC3)CC2)CC1	ZINC000875036799	FF	On-Demand	Anodyne	L3MBTL3	82	46
CN1CCN(C2CCN(C(=O)N[C@H](c3cccs3)C3CC3)CC2)CC1	ZINC000875036800	FF	On-Demand	Anodyne	L3MBTL3	82	46
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cc(=O)c2ccccc2o1	ZINC000875036808	GI	On-Demand	Anodyne	SCD1	39	49
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cc(=O)c2ccccc2o1	ZINC000875036808	GI	On-Demand	Anodyne	SCD	33	49
CO[C@H](C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)OC(C)(C)C	ZINC000875036823	GD	On-Demand	Anodyne	CA2	25	49
CO[C@H](C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)OC(C)(C)C	ZINC000875036823	GD	On-Demand	Anodyne	CA1	29	40
CO[C@H](C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)OC(C)(C)C	ZINC000875036823	GD	On-Demand	Anodyne	CA4	17	40
CO[C@H](C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)OC(C)(C)C	ZINC000875036823	GD	On-Demand	Anodyne	CA14	18	49
CO[C@H](C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)OC(C)(C)C	ZINC000875036823	GD	On-Demand	Anodyne	CA12	25	42
CO[C@H](C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)OC(C)(C)C	ZINC000875036823	GD	On-Demand	Anodyne	CA9	23	42
CO[C@H](C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1)C(=O)OC(C)(C)C	ZINC000875036823	GD	On-Demand	Anodyne	P96878_MYCTU	49	37
O=C(/C=C\c1ccco1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875036844	EI	On-Demand	Anodyne	SCD1	36	46
O=C(/C=C\c1ccco1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875036844	EI	On-Demand	Anodyne	SCD	32	49
O=C(/C=C/c1ccco1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875036845	EI	On-Demand	Anodyne	SCD1	36	46
O=C(/C=C/c1ccco1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875036845	EI	On-Demand	Anodyne	SCD	32	49
CC(=O)CC(C)(C)CC(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875036907	EG	On-Demand	Anodyne	CA2	19	40
O=C(Nc1ccc(S(=O)(=O)C(F)F)cc1)[C@@H]1C[C@H]1C1CCOCC1	ZINC000875036915	FF	On-Demand	Anodyne	NAMPT	17	44
O=C(Nc1ccc(S(=O)(=O)C(F)F)cc1)c1cnn(C2CC2)c1	ZINC000875036948	EE	On-Demand	Anodyne	PRNP	44	33
O=C(COCC(F)F)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875036953	ED	On-Demand	Anodyne	CA2	23	40
O=C(COCC(F)F)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875036953	ED	On-Demand	Anodyne	CA1	27	40
O=C(COCC(F)F)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875036953	ED	On-Demand	Anodyne	CA5B	21	40
O=C(COCC(F)F)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875036953	ED	On-Demand	Anodyne	CA4	23	40
O=C(COCC(F)F)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875036953	ED	On-Demand	Anodyne	CA5A	25	40
O=C(COCC(F)F)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875036953	ED	On-Demand	Anodyne	CA12	16	40
O=C(COCC(F)F)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875036953	ED	On-Demand	Anodyne	CA9	17	40
O=C(COCC(F)F)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875036953	ED	On-Demand	Anodyne	P96878_MYCTU	41	34
O=C(/C=C\c1cccs1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875036964	FJ	On-Demand	Anodyne	SCD1	37	48
O=C(/C=C\c1cccs1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875036964	FJ	On-Demand	Anodyne	SCD	32	48
O=C(/C=C/c1cccs1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875036965	FJ	On-Demand	Anodyne	SCD1	37	48
O=C(/C=C/c1cccs1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875036965	FJ	On-Demand	Anodyne	SCD	32	48
O=C(Nc1ccc(S(=O)(=O)C(F)F)cc1)C12CC(C1)C2	ZINC000875036966	DE	On-Demand	Anodyne	P96878_MYCTU	40	35
CCO[C@@H](C(=O)Nc1cccc(-n2cnnn2)c1C)C1CCCC1	ZINC000875037009	EF	On-Demand	Anodyne	KCNQ2	40	33
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875037023	GG	On-Demand	Anodyne	KCNA5	17	40
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875037023	GG	On-Demand	Anodyne	CA14	26	40
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875037023	GG	On-Demand	Anodyne	MTNR1A	20	44
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875037023	GG	On-Demand	Anodyne	MTNR1B	25	44
CCO[C@@H](C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1)C1CC1	ZINC000875037032	EE	On-Demand	Anodyne	TIMP3	49	32
CCO[C@H]1COCC[C@H]1CC(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875037048	GE	On-Demand	Anodyne	TIMP3	48	32
CCO[C@H]1COCC[C@@H]1CC(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875037049	GE	On-Demand	Anodyne	TIMP3	48	32
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875037051	FE	On-Demand	Anodyne	CA2	17	49
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875037051	FE	On-Demand	Anodyne	ANPEP	26	44
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875037051	FE	On-Demand	Anodyne	CA1	18	49
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875037051	FE	On-Demand	Anodyne	TIMP3	41	32
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875037051	FE	On-Demand	Anodyne	CA4	17	49
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875037051	FE	On-Demand	Anodyne	MMP2	24	41
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875037051	FE	On-Demand	Anodyne	MMP3	35	41
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875037051	FE	On-Demand	Anodyne	CAPN1	36	43
O=C(Nc1ccc(S(=O)(=O)C(F)F)cc1)[C@@H]1C[C@H]1c1ccsc1	ZINC000875037104	FG	On-Demand	Anodyne	NAMPT	22	44
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cccnc1Cl	ZINC000875037186	FI	On-Demand	Anodyne	SCD1	43	52
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cccnc1Cl	ZINC000875037186	FI	On-Demand	Anodyne	SCD	35	52
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cccnc1Cl	ZINC000875037186	FI	On-Demand	Anodyne	G2YM83_BOTF4	77	38
O=C(CC(F)(F)C(F)(F)F)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875037200	FG	On-Demand	Mild	CA2	21	49
O=C(CC(F)(F)C(F)(F)F)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875037200	FG	On-Demand	Mild	CA4	23	49
O=C(Nc1ccc(S(=O)(=O)C(F)F)cc1)c1ccc(C2CCOCC2)cc1	ZINC000875037205	GH	On-Demand	Anodyne	PRNP	45	35
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)s1	ZINC000875037206	FE	On-Demand	Anodyne	SIRT3	52	32
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)s1	ZINC000875037206	FE	On-Demand	Anodyne	SIRT2	53	33
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)s1	ZINC000875037206	FE	On-Demand	Anodyne	SIRT1	52	32
CCOC1CC2(C1)C[C@H]2C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875037222	FF	On-Demand	Anodyne	TIMP3	64	34
O=C(N[C@@H](c1cccs1)C1CC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875037228	FG	On-Demand	Anodyne	ETHR	66	43
O=C(N[C@H](c1cccs1)C1CC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875037229	FG	On-Demand	Anodyne	ETHR	66	43
O=C(N[C@@H](c1cccs1)C1CC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875037230	FG	On-Demand	Anodyne	ETHR	66	43
O=C(N[C@H](c1cccs1)C1CC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875037231	FG	On-Demand	Anodyne	ETHR	66	43
CCCCCCCNC(=O)C(=O)NCc1ccc(C)s1	ZINC000875037288	CF	On-Demand	Mild	ASAH1	98	39
COC(=O)C1(O)CN(C(=O)N[C@H](C)c2ccc3c(c2)OCO3)C1	ZINC000875037323	DC	On-Demand	Anodyne	KCNQ2	22	47
COC(=O)C1(O)CN(C(=O)N[C@@H](C)c2ccc3c(c2)OCO3)C1	ZINC000875037324	DC	On-Demand	Anodyne	KCNQ2	22	47
CC[C@@](C)(NC(=O)NCc1ccc(-n2ccnc2)nc1)c1ccc(F)cc1	ZINC000875037326	FH	On-Demand	Anodyne	NOS2	52	31
O=C(/C=C\c1ccc(O)cc1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875037328	FI	On-Demand	Anodyne	SCD1	36	47
O=C(/C=C\c1ccc(O)cc1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875037328	FI	On-Demand	Anodyne	SCD	32	55
O=C(/C=C/c1ccc(O)cc1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875037329	FI	On-Demand	Anodyne	SCD1	36	47
O=C(/C=C/c1ccc(O)cc1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875037329	FI	On-Demand	Anodyne	SCD	32	55
CN1CCN(C(=O)NCc2ccc(-n3ccnc3)nc2)CCC1(C)C	ZINC000875037330	ED	On-Demand	Anodyne	NOS2	96	37
CN1CCN(C(=O)NCc2ccc(-n3ccnc3)nc2)CCC1(C)C	ZINC000875037330	ED	On-Demand	Anodyne	NAMPT	26	49
C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875037333	ED	On-Demand	Anodyne	NOS2	90	36
C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875037333	ED	On-Demand	Anodyne	NAMPT	18	46
C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875037335	ED	On-Demand	Anodyne	NOS2	90	36
C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875037335	ED	On-Demand	Anodyne	NAMPT	18	46
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875037336	ED	On-Demand	Anodyne	NOS2	90	36
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875037336	ED	On-Demand	Anodyne	NAMPT	18	46
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1ccc2c(c1)OCO2	ZINC000875037337	EF	On-Demand	Anodyne	KCNQ2	23	43
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1ccc2c(c1)OCO2	ZINC000875037338	EF	On-Demand	Anodyne	KCNQ2	23	43
C[C@@](CO)(Cc1ccccc1F)NC(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875037356	GE	On-Demand	Anodyne	NOS2	68	33
O=C(NCC[C@@H](O)C(F)F)NCc1ccc(-n2ccnc2)nc1	ZINC000875037363	ED	On-Demand	Anodyne	NOS2	77	31
O=C(NCC[C@H](O)C(F)F)NCc1ccc(-n2ccnc2)nc1	ZINC000875037364	ED	On-Demand	Anodyne	NOS2	77	31
O=C(C/N=C1/NS(=O)(=O)c2ccccc21)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875037365	IF	On-Demand	Mild	SCD1	33	42
O=C(C/N=C1/NS(=O)(=O)c2ccccc21)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875037365	IF	On-Demand	Mild	SCD	28	42
CC[C@@H](NC(=O)N1C[C@@]2(C)CS(=O)(=O)C[C@@]2(C)C1)c1ccc(Cl)cc1	ZINC000875037370	GG	On-Demand	Anodyne	CACNA1H	24	40
CC[C@@H](NC(=O)N1C[C@@]2(C)CS(=O)(=O)C[C@@]2(C)C1)c1ccc(Cl)cc1	ZINC000875037370	GG	On-Demand	Anodyne	CCR1	43	36
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875037372	DD	On-Demand	Anodyne	NOS2	54	33
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCCC[C@@H]1[C@H]1CCCC[C@H]1O	ZINC000875037376	GF	On-Demand	Anodyne	NOS2	97	41
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCCC[C@@H]1[C@H]1CCCC[C@H]1O	ZINC000875037376	GF	On-Demand	Anodyne	NAMPT	21	48
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O	ZINC000875037377	GF	On-Demand	Anodyne	NOS2	97	41
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O	ZINC000875037377	GF	On-Demand	Anodyne	NAMPT	21	48
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O	ZINC000875037378	GF	On-Demand	Anodyne	NOS2	97	41
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O	ZINC000875037378	GF	On-Demand	Anodyne	NAMPT	21	48
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O	ZINC000875037379	GF	On-Demand	Anodyne	NOS2	97	41
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O	ZINC000875037379	GF	On-Demand	Anodyne	NAMPT	21	48
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)c1ccc2c(c1)OCO2	ZINC000875037385	DE	On-Demand	Anodyne	KCNQ2	23	47
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)c1ccc2c(c1)OCO2	ZINC000875037386	DE	On-Demand	Anodyne	KCNQ2	23	47
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875037391	GE	On-Demand	Anodyne	NOS2	88	38
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875037391	GE	On-Demand	Anodyne	NAMPT	28	52
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875037392	GE	On-Demand	Anodyne	NOS2	88	38
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875037392	GE	On-Demand	Anodyne	NAMPT	28	52
O=C(NCc1cnn(-c2ccccc2)c1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875037393	GF	On-Demand	Anodyne	NAMPT	21	41
CO[C@H]1CCN([C@@H]2CCC[C@@H]2N(C)C(=O)NCc2ccc(-n3ccnc3)nc2)C1	ZINC000875037397	GE	On-Demand	Anodyne	NOS2	98	39
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3ccc(-n4ccnc4)nc3)C[C@@H]1C2	ZINC000875037404	FD	On-Demand	Anodyne	NOS2	100	41
COC(=O)N(C)NC(=O)N[C@H](C)c1ccc2c(c1)OCO2	ZINC000875037406	CD	On-Demand	Reactive	EDNRB	43	37
COC(=O)N(C)NC(=O)N[C@H](C)c1ccc2c(c1)OCO2	ZINC000875037406	CD	On-Demand	Reactive	EDNRA	41	37
COC(=O)N(C)NC(=O)N[C@H](C)c1ccc2c(c1)OCO2	ZINC000875037406	CD	On-Demand	Reactive	KCNQ2	23	49
COC(=O)N(C)NC(=O)N[C@@H](C)c1ccc2c(c1)OCO2	ZINC000875037407	CD	On-Demand	Reactive	EDNRB	43	37
COC(=O)N(C)NC(=O)N[C@@H](C)c1ccc2c(c1)OCO2	ZINC000875037407	CD	On-Demand	Reactive	EDNRA	41	37
COC(=O)N(C)NC(=O)N[C@@H](C)c1ccc2c(c1)OCO2	ZINC000875037407	CD	On-Demand	Reactive	KCNQ2	23	49
O=C(NCc1ccc(-n2ccnc2)nc1)NC1CC(Nc2ccccc2)C1	ZINC000875037411	FF	On-Demand	Anodyne	NOS2	91	37
O=C(NCc1ccc(-n2ccnc2)nc1)NC1CC(Nc2ccccc2)C1	ZINC000875037411	FF	On-Demand	Anodyne	NAMPT	38	60
O=C(NCc1ccc(-n2ccnc2)nc1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875037412	GE	On-Demand	Anodyne	NOS2	86	40
O=C(NCc1ccc(-n2ccnc2)nc1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875037412	GE	On-Demand	Anodyne	NAMPT	37	55
CN(CCNC(=O)NCc1ccc(-n2ccnc2)nc1)CC(F)F	ZINC000875037413	ED	On-Demand	Anodyne	NOS2	83	34
O=CN1CCCN(C(=O)NCc2ccc(-n3ccnc3)nc2)CC1	ZINC000875037414	EC	On-Demand	Anodyne	NOS2	101	41
O=CN1CCCN(C(=O)NCc2ccc(-n3ccnc3)nc2)CC1	ZINC000875037414	EC	On-Demand	Anodyne	NAMPT	29	50
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc2c(c1)OCO2	ZINC000875037415	CD	On-Demand	Anodyne	KCNQ2	23	47
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc2c(c1)OCO2	ZINC000875037416	CD	On-Demand	Anodyne	KCNQ2	23	47
CCC[C@@H](CCO)NC(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875037436	DD	On-Demand	Anodyne	NOS2	72	33
CCC[C@@H](CCO)NC(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875037436	DD	On-Demand	Anodyne	NAMPT	19	52
CCC[C@H](CCO)NC(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875037437	DD	On-Demand	Anodyne	NOS2	72	33
CCC[C@H](CCO)NC(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875037437	DD	On-Demand	Anodyne	NAMPT	19	52
CN1CCO[C@H](CN(C)C(=O)NCc2ccc(-n3ccnc3)nc2)C1	ZINC000875037438	EC	On-Demand	Anodyne	NOS2	103	41
O=C(NCc1ccc(-n2ccnc2)nc1)N[C@@H]1Cc2cncn2C1	ZINC000875037440	DC	On-Demand	Anodyne	NOS2	86	34
O=C(NCc1ccc(-n2ccnc2)nc1)N[C@@H]1Cc2cncn2C1	ZINC000875037440	DC	On-Demand	Anodyne	NAMPT	15	51
O=C(NCc1ccc(-n2ccnc2)nc1)N[C@H]1Cc2cncn2C1	ZINC000875037441	DC	On-Demand	Anodyne	NOS2	86	34
O=C(NCc1ccc(-n2ccnc2)nc1)N[C@H]1Cc2cncn2C1	ZINC000875037441	DC	On-Demand	Anodyne	NAMPT	15	51
O=C(NCc1ccc(-n2ccnc2)nc1)N1CC(Cc2ccco2)C1	ZINC000875037442	EE	On-Demand	Anodyne	NOS2	102	41
O=C(NCc1ccc(-n2ccnc2)nc1)N1CC(Cc2ccco2)C1	ZINC000875037442	EE	On-Demand	Anodyne	NAMPT	20	47
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1cccc(NC(C)=O)c1	ZINC000875037451	EF	On-Demand	Mild	INHA	18	40
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1cccc(NC(C)=O)c1	ZINC000875037451	EF	On-Demand	Mild	SOAT1	39	41
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1cccc(NC(C)=O)c1	ZINC000875037451	EF	On-Demand	Mild	ASAH1	64	37
CCCCCCCNC(=O)C(=O)N[C@H](C)c1cccc(NC(C)=O)c1	ZINC000875037452	EF	On-Demand	Mild	INHA	18	40
CCCCCCCNC(=O)C(=O)N[C@H](C)c1cccc(NC(C)=O)c1	ZINC000875037452	EF	On-Demand	Mild	SOAT1	39	41
CCCCCCCNC(=O)C(=O)N[C@H](C)c1cccc(NC(C)=O)c1	ZINC000875037452	EF	On-Demand	Mild	ASAH1	64	37
O=C(NCC[C@H](O)C1CCCC1)NCc1ccc(-n2ccnc2)nc1	ZINC000875037453	EE	On-Demand	Anodyne	NOS2	96	38
O=C(NCC[C@H](O)C1CCCC1)NCc1ccc(-n2ccnc2)nc1	ZINC000875037453	EE	On-Demand	Anodyne	NAMPT	18	51
O=C(NCC[C@@H](O)C1CCCC1)NCc1ccc(-n2ccnc2)nc1	ZINC000875037454	EE	On-Demand	Anodyne	NOS2	96	38
O=C(NCC[C@@H](O)C1CCCC1)NCc1ccc(-n2ccnc2)nc1	ZINC000875037454	EE	On-Demand	Anodyne	NAMPT	18	51
CC[C@@H](NC(=O)N1CCC(C(=O)NOC)CC1)c1ccc(Cl)cc1	ZINC000875037457	FF	On-Demand	Anodyne	CACNA1H	38	42
CC[C@@H](NC(=O)N1CCC(C(=O)NOC)CC1)c1ccc(Cl)cc1	ZINC000875037457	FF	On-Demand	Anodyne	SLC6A3	19	41
CC[C@@H](NC(=O)N1CCC(C(=O)NOC)CC1)c1ccc(Cl)cc1	ZINC000875037457	FF	On-Demand	Anodyne	CCR1	40	41
CC[C@@H](NC(=O)N(C)CCN1CC2(CCOCC2)C1)c1ccc(Cl)cc1	ZINC000875037460	GH	On-Demand	Anodyne	UTS2	44	35
CC[C@@H](NC(=O)N1CCc2c(CC(N)=O)cccc2C1)c1ccc(Cl)cc1	ZINC000875037464	GH	On-Demand	Anodyne	MAPK1	46	40
O=C(NCc1ccc(-n2ccnc2)nc1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875037467	FE	On-Demand	Anodyne	NOS2	96	38
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc2c(c1)OCO2	ZINC000875037468	ED	On-Demand	Anodyne	EDNRA	36	41
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc2c(c1)OCO2	ZINC000875037468	ED	On-Demand	Anodyne	KCNQ2	23	46
CN1CCCC[C@H](N(C)C(=O)NCc2ccc(-n3ccnc3)nc2)C1=O	ZINC000875037474	FD	On-Demand	Anodyne	NOS2	103	44
CN1CCCC[C@@H](N(C)C(=O)NCc2ccc(-n3ccnc3)nc2)C1=O	ZINC000875037475	FD	On-Demand	Anodyne	NOS2	103	44
CC[C@@H](NC(=O)N1CC(O)(C(=O)OC)C1)c1ccc(Cl)cc1	ZINC000875037476	ED	On-Demand	Anodyne	CACNA1H	34	41
CC[C@@H](NC(=O)N1CC(O)(C(=O)OC)C1)c1ccc(Cl)cc1	ZINC000875037476	ED	On-Demand	Anodyne	AKT3	22	40
CC1(C)CCC[C@@](O)(CNC(=O)NCc2ccc(-n3ccnc3)nc2)CC1	ZINC000875037478	FF	On-Demand	Anodyne	NOS2	91	38
CC1(C)CCC[C@@](O)(CNC(=O)NCc2ccc(-n3ccnc3)nc2)CC1	ZINC000875037478	FF	On-Demand	Anodyne	NAMPT	18	51
CC1(C)CCC[C@](O)(CNC(=O)NCc2ccc(-n3ccnc3)nc2)CC1	ZINC000875037479	FF	On-Demand	Anodyne	NOS2	91	38
CC1(C)CCC[C@](O)(CNC(=O)NCc2ccc(-n3ccnc3)nc2)CC1	ZINC000875037479	FF	On-Demand	Anodyne	NAMPT	18	51
CC[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccc(Cl)cc1	ZINC000875037500	DF	On-Demand	Anodyne	CACNA1H	27	44
CC[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccc(Cl)cc1	ZINC000875037500	DF	On-Demand	Anodyne	UTS2	42	33
O=C(NCc1ccc(-n2ccnc2)nc1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875037501	FF	On-Demand	Anodyne	NOS2	84	33
CC[C@@H](NC(=O)N1Cc2cccc(O)c2C1)c1ccc(Cl)cc1	ZINC000875037503	EI	On-Demand	Clean	CACNA1H	31	43
CC[C@@H](NC(=O)N1Cc2cccc(O)c2C1)c1ccc(Cl)cc1	ZINC000875037503	EI	On-Demand	Clean	UTS2	46	38
O=C1CCN(C(=O)NCc2ccc(-n3ccnc3)nc2)CCCCCCN1	ZINC000875037508	FD	On-Demand	Anodyne	NOS2	95	36
O=C1CCN(C(=O)NCc2ccc(-n3ccnc3)nc2)CCCCCCN1	ZINC000875037508	FD	On-Demand	Anodyne	NAMPT	28	47
CC[C@@H](NC(=O)N1C[C@H]2C(=O)OC[C@H]2C1)c1ccc(Cl)cc1	ZINC000875037512	DF	On-Demand	Anodyne	CACNA1H	25	40
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc2c(c1)OCO2	ZINC000875037520	DE	On-Demand	Anodyne	KCNQ2	23	45
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc2c(c1)OCO2	ZINC000875037526	DE	On-Demand	Anodyne	KCNQ2	23	45
O=C(NCc1ccc(-n2ccnc2)nc1)NC[C@@H]1C[C@H](O)C1	ZINC000875037531	DC	On-Demand	Anodyne	NOS2	94	35
O=C(NCc1ccc(-n2ccnc2)nc1)NC[C@@H]1C[C@H](O)C1	ZINC000875037531	DC	On-Demand	Anodyne	NAMPT	27	55
O=C(NCc1ccc(-n2ccnc2)nc1)NC[C@H]1C[C@H](O)C1	ZINC000875037533	DC	On-Demand	Anodyne	NOS2	94	35
O=C(NCc1ccc(-n2ccnc2)nc1)NC[C@H]1C[C@H](O)C1	ZINC000875037533	DC	On-Demand	Anodyne	NAMPT	27	55
O=C(NCc1ccc(-n2ccnc2)nc1)NCC1CC(O)C1	ZINC000875037535	DC	On-Demand	Anodyne	NOS2	94	35
O=C(NCc1ccc(-n2ccnc2)nc1)NCC1CC(O)C1	ZINC000875037535	DC	On-Demand	Anodyne	NAMPT	27	55
CC[C@@H](NC(=O)N1CCn2c(nnc2-c2cn(C)cn2)C1)c1ccc(Cl)cc1	ZINC000875037539	GG	On-Demand	Anodyne	P2RX7	25	43
CC[C@@H](NC(=O)N1CCn2c(nnc2-c2cn(C)cn2)C1)c1ccc(Cl)cc1	ZINC000875037539	GG	On-Demand	Anodyne	MAPK1	45	38
C[C@@H]1CN(C(=O)N[C@H](C)c2ccc3c(c2)OCO3)CC[C@@H](C(F)(F)F)O1	ZINC000875037557	FG	On-Demand	Anodyne	KCNQ2	22	41
COC(=O)C1=NO[C@@]2(CCN(C(=O)NCC3(c4ccccc4)CC3)C2)C1	ZINC000875037560	FD	On-Demand	Anodyne	KCNA3	45	36
C[C@@H]1CN(C(=O)N[C@H](C)c2ccc3c(c2)OCO3)CC[C@H](C(F)(F)F)O1	ZINC000875037561	FG	On-Demand	Anodyne	KCNQ2	22	41
COC(=O)C1=NO[C@]2(CCN(C(=O)NCC3(c4ccccc4)CC3)C2)C1	ZINC000875037563	FD	On-Demand	Anodyne	KCNA3	45	36
O=C(C[C@@H]1OC(=O)c2ccccc21)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875037565	HI	On-Demand	Anodyne	SCD1	35	44
O=C(C[C@@H]1OC(=O)c2ccccc21)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875037565	HI	On-Demand	Anodyne	SCD	30	44
Cn1nc(Cl)c(C(=O)Nc2ccccc2C(=O)N2CCCCC2)c1Cl	ZINC000875037567	GH	On-Demand	Anodyne	EPHB3	43	35
Cn1nc(Cl)c(C(=O)Nc2ccccc2C(=O)N2CCCCC2)c1Cl	ZINC000875037567	GH	On-Demand	Anodyne	NPSR1	18	54
Cn1nc(Cl)c(C(=O)Nc2ccccc2C(=O)N2CCCCC2)c1Cl	ZINC000875037567	GH	On-Demand	Anodyne	G2YM83_BOTF4	53	34
O=C(C[C@H]1OC(=O)c2ccccc21)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875037570	HI	On-Demand	Anodyne	SCD1	35	44
O=C(C[C@H]1OC(=O)c2ccccc21)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875037570	HI	On-Demand	Anodyne	SCD	30	44
C[C@@H]1CN(C(=O)NCc2ccc(-n3ccnc3)nc2)CC[C@@H](C(F)(F)F)O1	ZINC000875037573	GF	On-Demand	Anodyne	NOS2	100	37
C[C@@H]1CN(C(=O)NCc2ccc(-n3ccnc3)nc2)CC[C@@H](C(F)(F)F)O1	ZINC000875037573	GF	On-Demand	Anodyne	NAMPT	32	45
C[C@@H]1CN(C(=O)NCc2ccc(-n3ccnc3)nc2)CC[C@H](C(F)(F)F)O1	ZINC000875037575	GF	On-Demand	Anodyne	NOS2	100	37
C[C@@H]1CN(C(=O)NCc2ccc(-n3ccnc3)nc2)CC[C@H](C(F)(F)F)O1	ZINC000875037575	GF	On-Demand	Anodyne	NAMPT	32	45
CN(C)C[C@@H]1CN(C(=O)NCC2(c3ccccc3)CC2)C[C@H]1CN(C)C	ZINC000875037584	FE	On-Demand	Anodyne	KCNA3	49	39
O=C(NCc1ccc(-n2ccnc2)nc1)N1CC2(CCCO2)C1	ZINC000875037596	DD	On-Demand	Anodyne	NOS2	94	36
O=C(NCc1ccc(-n2ccnc2)nc1)N1CC2(CCCO2)C1	ZINC000875037596	DD	On-Demand	Anodyne	NAMPT	30	49
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCCN(C=O)CC1	ZINC000875037601	DD	On-Demand	Anodyne	DPP7	40	35
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCCN(C=O)CC1	ZINC000875037601	DD	On-Demand	Anodyne	BIRC2	29	40
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCCN(C=O)CC1	ZINC000875037601	DD	On-Demand	Anodyne	Q6PRC7_IXORI	45	36
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCCN(C=O)CC1	ZINC000875037603	DD	On-Demand	Anodyne	DPP7	40	35
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCCN(C=O)CC1	ZINC000875037603	DD	On-Demand	Anodyne	BIRC2	29	40
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCCN(C=O)CC1	ZINC000875037603	DD	On-Demand	Anodyne	Q6PRC7_IXORI	45	36
O=C(NCc1ccc(-n2ccnc2)nc1)N1C[C@@H]2CCC[C@]2(CO)C1	ZINC000875037615	ED	On-Demand	Anodyne	NOS2	106	41
O=C(NCc1ccc(-n2ccnc2)nc1)N1C[C@@H]2CCC[C@]2(CO)C1	ZINC000875037615	ED	On-Demand	Anodyne	NAMPT	20	47
C#CC[C@@H](COC)NC(=O)NC1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	ZINC000875037618	GD	On-Demand	Mild	EPHX2	36	50
C#CC[C@@H](COC)NC(=O)NC1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	ZINC000875037618	GD	On-Demand	Mild	TGM2	41	39
C#CC[C@H](COC)NC(=O)NC1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	ZINC000875037620	GD	On-Demand	Mild	EPHX2	36	50
C#CC[C@H](COC)NC(=O)NC1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	ZINC000875037620	GD	On-Demand	Mild	TGM2	41	39
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875037626	GG	On-Demand	Anodyne	NOS2	97	40
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875037626	GG	On-Demand	Anodyne	NAMPT	19	51
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875037628	GG	On-Demand	Anodyne	NOS2	97	40
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875037628	GG	On-Demand	Anodyne	NAMPT	19	51
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875037630	GG	On-Demand	Anodyne	NOS2	97	40
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875037630	GG	On-Demand	Anodyne	NAMPT	19	51
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875037632	GG	On-Demand	Anodyne	NOS2	97	40
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875037632	GG	On-Demand	Anodyne	NAMPT	19	51
O=C(NCc1ccc(-n2ccnc2)nc1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875037633	FE	On-Demand	Anodyne	NOS2	88	35
O=C(NC[C@H]1CC(C(F)(F)F)=NO1)NCC1(c2ccccc2)CC1	ZINC000875037637	EF	On-Demand	Anodyne	KCNA3	42	34
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)NCC1(c2ccccc2)CC1	ZINC000875037638	EF	On-Demand	Anodyne	KCNA3	42	34
C[C@@H](CCc1ccc(O)cc1)NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875037646	DD	On-Demand	Anodyne	YARS	68	36
O=C(NCc1ccc(COCC(F)(F)F)cc1)N1Cc2cccc(O)c2C1	ZINC000875037648	GH	On-Demand	Clean	NAMPT	23	45
COC(=O)C1(O)CN(C(=O)NCC2(c3ccccc3)CC2)C1	ZINC000875037649	DC	On-Demand	Anodyne	KCNA3	56	44
O=C(CCc1nc(O)c2c3c(sc2n1)CCCC3)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875037652	JK	On-Demand	Anodyne	SCD1	33	40
O=C(CCc1nc(O)c2c3c(sc2n1)CCCC3)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875037652	JK	On-Demand	Anodyne	SCD	28	40
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCC(C(C)=O)CC3)c2c1	ZINC000875037660	FD	On-Demand	Anodyne	HTR1A	22	47
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCC(C(C)=O)CC3)c2c1	ZINC000875037660	FD	On-Demand	Anodyne	HTR1D	92	47
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCC(C(C)=O)CC3)c2c1	ZINC000875037660	FD	On-Demand	Anodyne	HTR1B	73	47
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCC(C(C)=O)CC3)c2c1	ZINC000875037660	FD	On-Demand	Anodyne	NQO2	44	63
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCC(C(C)=O)CC3)c2c1	ZINC000875037660	FD	On-Demand	Anodyne	MPO	45	37
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCC(C(C)=O)CC3)c2c1	ZINC000875037660	FD	On-Demand	Anodyne	HTR1E	20	40
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCC(C(C)=O)CC3)c2c1	ZINC000875037660	FD	On-Demand	Anodyne	MTNR1A	119	63
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCC(C(C)=O)CC3)c2c1	ZINC000875037660	FD	On-Demand	Anodyne	MTNR1B	94	63
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCC(C(C)=O)CC3)c2c1	ZINC000875037660	FD	On-Demand	Anodyne	ABCG2	26	43
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875037661	GF	On-Demand	Anodyne	NOS2	44	31
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCC[C@@H]4[C@H](O)C(C)(C)[C@@H]43)c2c1	ZINC000875037662	GD	On-Demand	Anodyne	HTR1A	17	45
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCC[C@@H]4[C@H](O)C(C)(C)[C@@H]43)c2c1	ZINC000875037662	GD	On-Demand	Anodyne	HTR1D	63	45
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCC[C@@H]4[C@H](O)C(C)(C)[C@@H]43)c2c1	ZINC000875037662	GD	On-Demand	Anodyne	HTR1B	54	41
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCC[C@@H]4[C@H](O)C(C)(C)[C@@H]43)c2c1	ZINC000875037662	GD	On-Demand	Anodyne	NQO2	31	54
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCC[C@@H]4[C@H](O)C(C)(C)[C@@H]43)c2c1	ZINC000875037662	GD	On-Demand	Anodyne	MTNR1A	73	55
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCC[C@@H]4[C@H](O)C(C)(C)[C@@H]43)c2c1	ZINC000875037662	GD	On-Demand	Anodyne	MTNR1B	56	54
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCC[C@@H]4[C@H](O)C(C)(C)[C@@H]43)c2c1	ZINC000875037662	GD	On-Demand	Anodyne	ABCG2	24	40
CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)c1	ZINC000875037664	JI	On-Demand	Anodyne	SCD1	41	49
CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)c1	ZINC000875037664	JI	On-Demand	Anodyne	SCD	33	49
C[C@@H](NC(=O)N1CCN(C)C(C)(C)CC1)c1ccc2c(c1)OCO2	ZINC000875037666	EF	On-Demand	Anodyne	KCNQ2	22	44
CN(C)C[C@@H]1CN(C(=O)NCc2ccc(-n3ccnc3)nc2)C[C@H]1CN(C)C	ZINC000875037671	GD	On-Demand	Anodyne	NOS2	104	40
CN(C)C[C@@H]1CN(C(=O)NCc2ccc(-n3ccnc3)nc2)C[C@H]1CN(C)C	ZINC000875037671	GD	On-Demand	Anodyne	NAMPT	24	49
O=C(NCCc1nnc2n1CCCCC2)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875037673	GE	On-Demand	Anodyne	DPP7	17	40
O=C(NCCc1nnc2n1CCCCC2)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875037674	GE	On-Demand	Anodyne	DPP7	17	40
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCCn1cccn1)CC2	ZINC000875037676	GD	On-Demand	Anodyne	SLC18A2	45	34
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCCn1cccn1)CC2	ZINC000875037677	GD	On-Demand	Anodyne	SLC18A2	45	34
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875037680	GD	On-Demand	Anodyne	NOS2	98	39
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCCC(F)(F)CC1	ZINC000875037690	EF	On-Demand	Anodyne	NOS2	95	36
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCCC(F)(F)CC1	ZINC000875037690	EF	On-Demand	Anodyne	NAMPT	34	50
O=C(NCc1cnn(-c2ccccc2)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875037691	FH	On-Demand	Anodyne	EPHX2	22	41
O=C(NCc1cnn(-c2ccccc2)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875037692	FH	On-Demand	Anodyne	EPHX2	22	41
O=C(NCC1(c2ccccc2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875037698	EG	On-Demand	Anodyne	KCNA3	47	36
O=C(NCC1(c2ccccc2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875037698	EG	On-Demand	Anodyne	SMO	21	47
O=C(NCC1(c2ccccc2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875037700	EG	On-Demand	Anodyne	KCNA3	47	36
O=C(NCC1(c2ccccc2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875037700	EG	On-Demand	Anodyne	SMO	21	47
CC[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(Cl)cc1	ZINC000875037703	DH	On-Demand	Anodyne	CACNA1H	45	44
CC[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(Cl)cc1	ZINC000875037703	DH	On-Demand	Anodyne	CCR1	51	40
CC[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(Cl)cc1	ZINC000875037703	DH	On-Demand	Anodyne	UTS2	46	37
CC[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(Cl)cc1	ZINC000875037707	DH	On-Demand	Anodyne	CACNA1H	45	44
CC[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(Cl)cc1	ZINC000875037707	DH	On-Demand	Anodyne	CCR1	51	40
CC[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(Cl)cc1	ZINC000875037707	DH	On-Demand	Anodyne	UTS2	46	37
COc1ccc2cc(CNC(=O)NCc3nc(N(C)C)n[nH]3)ccc2c1	ZINC000875037715	FE	On-Demand	Anodyne	ROCK2	33	41
C[C@@H](NC(=O)NC1(C)CC(F)(F)C1)c1ccc2c(c1)OCO2	ZINC000875037716	DF	On-Demand	Anodyne	KCNQ2	24	51
C[C@H](NC(=O)NC1(C)CC(F)(F)C1)c1ccc2c(c1)OCO2	ZINC000875037717	DF	On-Demand	Anodyne	KCNQ2	24	51
CO[C@H]1CN(C(=O)NCc2ccc(-n3ccnc3)nc2)[C@](C)(CO)C1	ZINC000875037720	EC	On-Demand	Anodyne	NOS2	87	37
CO[C@H]1CN(C(=O)NCc2ccc(-n3ccnc3)nc2)[C@@](C)(CO)C1	ZINC000875037721	EC	On-Demand	Anodyne	NOS2	87	37
NC(=O)[C@@H](c1ccccc1)N1CCN(C(=O)N[C@@H]2C[C@H]2C2CCOCC2)CC1	ZINC000875037722	GD	On-Demand	Anodyne	EPHX2	16	40
NC(=O)[C@H](c1ccccc1)N1CCN(C(=O)N[C@@H]2C[C@H]2C2CCOCC2)CC1	ZINC000875037723	GD	On-Demand	Anodyne	EPHX2	16	40
Cc1cccc(CNC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875037739	FF	On-Demand	Anodyne	CMA1	20	40
Cc1cccc(CNC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875037739	FF	On-Demand	Anodyne	C3AR1	39	46
Cc1cccc(CNC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875037739	FF	On-Demand	Anodyne	NAMPT	43	36
Cc1cccc(CNC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875037740	FF	On-Demand	Anodyne	CMA1	20	40
Cc1cccc(CNC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875037740	FF	On-Demand	Anodyne	C3AR1	39	46
Cc1cccc(CNC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875037740	FF	On-Demand	Anodyne	NAMPT	43	36
Cc1cccc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)c1	ZINC000875037763	EE	On-Demand	Anodyne	ACHE	20	51
Cc1cccc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)c1	ZINC000875037763	EE	On-Demand	Anodyne	SIRT3	42	33
Cc1cccc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)c1	ZINC000875037763	EE	On-Demand	Anodyne	SIRT2	46	33
Cc1cccc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)c1	ZINC000875037763	EE	On-Demand	Anodyne	SIRT1	42	33
O=C1CCN(C(=O)C(=O)NCc2cc(F)ccc2F)CCCCCCN1	ZINC000875037785	FD	On-Demand	Anodyne	P2RX7	23	40
O=C(NC[C@H]1C[C@H](O)C1)NCC1(c2ccccc2)CCC1	ZINC000875037793	CE	On-Demand	Anodyne	KCNA3	48	39
Cc1cccc(CNC(=O)C(=O)NC(c2ccnn2C)c2ccnn2C)c1	ZINC000875037796	FC	On-Demand	Anodyne	CTSV	32	40
O=C(NCC1(c2ccccc2)CCC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875037801	EG	On-Demand	Anodyne	KCNA3	46	37
Cc1cccc(CNC(=O)C(=O)N2CCC[C@@H]2c2cncc(C)c2)c1	ZINC000875037802	EF	On-Demand	Anodyne	PREP	46	37
Cc1cccc(CNC(=O)C(=O)N2CCC[C@H]2c2cncc(C)c2)c1	ZINC000875037803	EF	On-Demand	Anodyne	PREP	46	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccc(Br)s1	ZINC000875037828	GF	On-Demand	Anodyne	SLC6A4	24	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccc(Br)s1	ZINC000875037828	GF	On-Demand	Anodyne	SLC6A3	43	43
O=C(NCc1ccc(-n2ccnc2)nc1)N1CC(OCC(F)F)C1	ZINC000875037830	ED	On-Demand	Anodyne	NOS2	93	37
O=C(NCc1ccc(-n2ccnc2)nc1)N1CC(OCC(F)F)C1	ZINC000875037830	ED	On-Demand	Anodyne	NAMPT	18	46
CC[C@@H](NC(=O)N(C)OCC(F)(F)F)c1ccc(Cl)cc1	ZINC000875037837	DH	On-Demand	Anodyne	UTS2	48	39
CC[C@@H](NC(=O)NCc1ccc(-n2ccnc2)nc1)[C@H](O)c1ccccc1	ZINC000875037840	FF	On-Demand	Anodyne	NOS2	75	33
CC[C@@H](NC(=O)NCc1ccc(-n2ccnc2)nc1)[C@H](O)c1ccccc1	ZINC000875037840	FF	On-Demand	Anodyne	NAMPT	18	57
CC[C@@H](NC(=O)NCc1ccc(-n2ccnc2)nc1)[C@@H](O)c1ccccc1	ZINC000875037841	FF	On-Demand	Anodyne	NOS2	75	33
CC[C@@H](NC(=O)NCc1ccc(-n2ccnc2)nc1)[C@@H](O)c1ccccc1	ZINC000875037841	FF	On-Demand	Anodyne	NAMPT	18	57
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2ccc3c(c2)OCO3)C1	ZINC000875037845	EE	On-Demand	Anodyne	EDNRB	55	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2ccc3c(c2)OCO3)C1	ZINC000875037845	EE	On-Demand	Anodyne	EDNRA	60	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2ccc3c(c2)OCO3)C1	ZINC000875037845	EE	On-Demand	Anodyne	KCNQ2	22	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2ccc3c(c2)OCO3)C1	ZINC000875037848	EE	On-Demand	Anodyne	EDNRB	55	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2ccc3c(c2)OCO3)C1	ZINC000875037848	EE	On-Demand	Anodyne	EDNRA	60	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2ccc3c(c2)OCO3)C1	ZINC000875037848	EE	On-Demand	Anodyne	KCNQ2	22	43
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875037850	FE	On-Demand	Anodyne	NOS2	102	38
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875037850	FE	On-Demand	Anodyne	NAMPT	23	44
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875037851	FE	On-Demand	Anodyne	NOS2	102	38
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875037851	FE	On-Demand	Anodyne	NAMPT	23	44
CS[C@@H]1C[C@@H](NC(=O)NC2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)C1	ZINC000875037854	GE	On-Demand	Anodyne	EPHX2	53	57
CS[C@@H]1C[C@@H](NC(=O)NC2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)C1	ZINC000875037854	GE	On-Demand	Anodyne	TGM2	68	41
CS[C@@H]1C[C@@H](NC(=O)NC2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)C1	ZINC000875037854	GE	On-Demand	Anodyne	F13A1	55	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2ccc(Br)cc2)C1	ZINC000875037855	GD	On-Demand	Anodyne	GPBAR1	23	48
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2ccc(Br)cc2)C1	ZINC000875037856	GD	On-Demand	Anodyne	GPBAR1	23	48
C[C@H](NC(=O)C(=O)NCCCn1cccn1)c1ccc(C(F)(F)F)nc1	ZINC000875037859	FD	On-Demand	Anodyne	TRPV1	41	31
O=C(NCC1(c2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875037860	DD	On-Demand	Anodyne	KCNA3	48	40
O=C(NCC1(c2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875037860	DD	On-Demand	Anodyne	NPFFR1	18	43
COc1ccccc1[C@H]1CN(C(=O)C(=O)NCc2cc(F)ccc2F)CCO1	ZINC000875037861	GE	On-Demand	Anodyne	DRD4	15	41
COc1ccccc1[C@H]1CN(C(=O)C(=O)NCc2cc(F)ccc2F)CCO1	ZINC000875037861	GE	On-Demand	Anodyne	ACKR3	45	31
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NCc2cc(F)ccc2F)CCO1	ZINC000875037862	GE	On-Demand	Anodyne	DRD4	15	41
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NCc2cc(F)ccc2F)CCO1	ZINC000875037862	GE	On-Demand	Anodyne	ACKR3	45	31
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1(c2ccccc2)CC1	ZINC000875037864	EE	On-Demand	Anodyne	SLC6A4	24	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1(c2ccccc2)CC1	ZINC000875037864	EE	On-Demand	Anodyne	SLC6A3	48	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1(c2ccccc2)CC1	ZINC000875037864	EE	On-Demand	Anodyne	KCNA3	54	42
Cn1nnnc1C1CCN(C(=O)NCC2(c3ccccc3)CCC2)CC1	ZINC000875037891	FE	On-Demand	Anodyne	KCNA3	47	38
Cn1nnnc1C1CCN(C(=O)NCC2(c3ccccc3)CCC2)CC1	ZINC000875037891	FE	On-Demand	Anodyne	SMO	25	50
O=C(NCc1nc(-c2ccncc2)cs1)N[C@H](c1cccs1)C1CC1	ZINC000875037898	FI	On-Demand	Anodyne	ROCK1	25	46
O=C(NCc1nc(-c2ccncc2)cs1)N[C@H](c1cccs1)C1CC1	ZINC000875037898	FI	On-Demand	Anodyne	ROCK2	17	46
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1nc(Cl)ccc1Cl	ZINC000875037911	HJ	On-Demand	Anodyne	SCD1	43	52
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1nc(Cl)ccc1Cl	ZINC000875037911	HJ	On-Demand	Anodyne	SCD	35	52
COc1ccc2cc(CNC(=O)N3CCn4nnc(CO)c4C3)ccc2c1	ZINC000875037922	FD	On-Demand	Anodyne	MMP13	21	40
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@H]4CC=CC[C@H]4C3)c2c1	ZINC000875037923	FE	On-Demand	Anodyne	HTR1A	18	47
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@H]4CC=CC[C@H]4C3)c2c1	ZINC000875037923	FE	On-Demand	Anodyne	HTR1D	51	47
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@H]4CC=CC[C@H]4C3)c2c1	ZINC000875037923	FE	On-Demand	Anodyne	HTR1B	38	47
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@H]4CC=CC[C@H]4C3)c2c1	ZINC000875037923	FE	On-Demand	Anodyne	NQO2	36	61
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@H]4CC=CC[C@H]4C3)c2c1	ZINC000875037923	FE	On-Demand	Anodyne	MPO	47	37
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@H]4CC=CC[C@H]4C3)c2c1	ZINC000875037923	FE	On-Demand	Anodyne	HTR1E	15	41
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@H]4CC=CC[C@H]4C3)c2c1	ZINC000875037923	FE	On-Demand	Anodyne	MTNR1A	105	63
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@H]4CC=CC[C@H]4C3)c2c1	ZINC000875037923	FE	On-Demand	Anodyne	MTNR1B	79	61
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@H]4CC=CC[C@H]4C3)c2c1	ZINC000875037923	FE	On-Demand	Anodyne	ABCG2	27	44
O=C(NCCCCC1CC1)C(=O)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875037932	GE	On-Demand	Anodyne	SCD1	21	50
O=C(NCCCCC1CC1)C(=O)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875037932	GE	On-Demand	Anodyne	SCD	20	50
CC[C@@H](NC(=O)NNc1nnc(C)n1C)c1ccc(Cl)cc1	ZINC000875037934	DF	On-Demand	Reactive	UTS2	42	35
O=C(NCc1ccc(-n2ccnc2)nc1)NC1(c2c(F)cccc2F)CCC1	ZINC000875037938	GG	On-Demand	Anodyne	NOS2	88	37
O=C(NCc1ccc(-n2ccnc2)nc1)NC1(c2c(F)cccc2F)CCC1	ZINC000875037938	GG	On-Demand	Anodyne	NAMPT	33	53
O=C(NCc1ccc(-n2ccnc2)nc1)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875037951	ED	On-Demand	Anodyne	NOS2	87	34
O=C(NCc1ccc(-n2ccnc2)nc1)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875037953	ED	On-Demand	Anodyne	NOS2	87	34
O=C(NCCCn1cccn1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875037954	FD	On-Demand	Anodyne	FKBP1A	15	41
O=C(NCCCn1cccn1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875037955	FD	On-Demand	Anodyne	FKBP1A	15	41
O=C(NCCCn1cccn1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875037956	FD	On-Demand	Anodyne	FKBP1A	15	41
O=C(NCc1nc(-c2ccncc2)cs1)N[C@@H](c1cccs1)C1CC1	ZINC000875037957	FI	On-Demand	Anodyne	ROCK1	25	46
O=C(NCc1nc(-c2ccncc2)cs1)N[C@@H](c1cccs1)C1CC1	ZINC000875037957	FI	On-Demand	Anodyne	ROCK2	17	46
O=C(NCCCn1cccn1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875037958	FD	On-Demand	Anodyne	FKBP1A	15	41
C[C@@H]1[C@@H](NC(=O)C(=O)NCc2cc(F)ccc2F)CCN1C(=O)OC(C)(C)C	ZINC000875037959	GE	On-Demand	Anodyne	GPR119	22	52
CN(C)C(=O)c1ccc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)cc1	ZINC000875037963	GI	On-Demand	Anodyne	TAAR1	41	35
CN(C)C(=O)c1ccc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)cc1	ZINC000875037963	GI	On-Demand	Anodyne	KCNK3	91	41
CN(C)C(=O)c1ccc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)cc1	ZINC000875037963	GI	On-Demand	Anodyne	KCNK9	46	37
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875037967	ED	On-Demand	Anodyne	MME	28	40
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875037967	ED	On-Demand	Anodyne	YARS	41	32
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875037970	ED	On-Demand	Anodyne	MME	28	40
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875037970	ED	On-Demand	Anodyne	YARS	41	32
C[C@@H](NC(=O)N1CCN([C@H](C(N)=O)c2ccccc2)CC1)c1ccnn1C	ZINC000875037989	FD	On-Demand	Anodyne	PTAFR	28	44
C[C@@H](NC(=O)N1CCN([C@H](C(N)=O)c2ccccc2)CC1)c1ccnn1C	ZINC000875037989	FD	On-Demand	Anodyne	Q6PRC7_IXORI	51	32
C[C@@H](NC(=O)N1CCN([C@@H](C(N)=O)c2ccccc2)CC1)c1ccnn1C	ZINC000875037993	FD	On-Demand	Anodyne	PTAFR	28	44
C[C@@H](NC(=O)N1CCN([C@@H](C(N)=O)c2ccccc2)CC1)c1ccnn1C	ZINC000875037993	FD	On-Demand	Anodyne	Q6PRC7_IXORI	51	32
CC[C@@H](NC(=O)N1CC(CNC(=O)C(F)(F)F)C1)c1ccc(Cl)cc1	ZINC000875037994	GG	On-Demand	Anodyne	CACNA1H	20	40
O=C(NCC1(c2ccccc2)CCC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875038006	GG	On-Demand	Anodyne	SMO	41	58
O=C(NCC1(c2ccccc2)CCC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875038006	GG	On-Demand	Anodyne	ETHR	53	35
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H](C)c1ccc2c(c1)OCO2	ZINC000875038008	GE	On-Demand	Anodyne	KCNQ2	21	40
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H](C)c1ccc2c(c1)OCO2	ZINC000875038008	GE	On-Demand	Anodyne	MCHR1	15	48
O=C(NCC1(c2ccccc2)CCC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875038009	GG	On-Demand	Anodyne	SMO	41	58
O=C(NCC1(c2ccccc2)CCC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875038009	GG	On-Demand	Anodyne	ETHR	53	35
COCCN(CC1CCN(C)CC1)C(=O)N[C@H](C)c1ccc2c(c1)OCO2	ZINC000875038010	GE	On-Demand	Anodyne	KCNQ2	21	40
COCCN(CC1CCN(C)CC1)C(=O)N[C@H](C)c1ccc2c(c1)OCO2	ZINC000875038010	GE	On-Demand	Anodyne	MCHR1	15	48
O=C(NCC1(c2ccccc2)CCC1)N1CCC(CO)(CO)CC1	ZINC000875038025	ED	On-Demand	Anodyne	KCNA3	47	39
O=C(NCC1(c2ccccc2)CCC1)N1CCC(CO)(CO)CC1	ZINC000875038025	ED	On-Demand	Anodyne	EPHX2	17	43
O=C(NCC1(c2ccccc2)CCC1)N1CCC(CO)(CO)CC1	ZINC000875038025	ED	On-Demand	Anodyne	NPFFR1	18	41
O=C(NCCN1CC[C@H](O)C1)NCc1ccc(-n2ccnc2)nc1	ZINC000875038029	EC	On-Demand	Anodyne	NOS2	99	36
O=C(NCCN1CC[C@H](O)C1)NCc1ccc(-n2ccnc2)nc1	ZINC000875038029	EC	On-Demand	Anodyne	NAMPT	25	51
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc(-n2ccnc2)nc1	ZINC000875038031	EC	On-Demand	Anodyne	NOS2	99	36
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc(-n2ccnc2)nc1	ZINC000875038031	EC	On-Demand	Anodyne	NAMPT	25	51
CCOC(=O)[C@@H]1CN(C(=O)NCc2ccc(-n3ccnc3)nc2)CCC1(F)F	ZINC000875038036	GD	On-Demand	Anodyne	NOS2	98	37
CC[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccc(Cl)cc1	ZINC000875038045	FE	On-Demand	Anodyne	CACNA1H	27	42
CC[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccc(Cl)cc1	ZINC000875038045	FE	On-Demand	Anodyne	EPHX2	17	45
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(S(C)(=O)=O)CC1	ZINC000875038061	DC	On-Demand	Anodyne	EPHX2	25	46
C[C@@](CO)(Cc1ccc(F)cc1)NC(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875038077	GE	On-Demand	Anodyne	NOS2	40	31
Cc1cccc(CNC(=O)C(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875038084	DC	On-Demand	Anodyne	FBP1	15	42
C[C@@H](NC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1ccc2c(c1)OCO2	ZINC000875038085	FF	On-Demand	Anodyne	KCNQ2	23	42
C[C@@H](NC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1ccc2c(c1)OCO2	ZINC000875038087	FF	On-Demand	Anodyne	KCNQ2	23	42
O=C(NCc1ccc(-n2ccnc2)nc1)N[C@@H]1C[C@H](CO)C1	ZINC000875038091	DC	On-Demand	Anodyne	NOS2	93	35
O=C(NCc1ccc(-n2ccnc2)nc1)N[C@@H]1C[C@H](CO)C1	ZINC000875038091	DC	On-Demand	Anodyne	NAMPT	26	54
Cc1cccc(CNC(=O)C(=O)N[C@@H](C)C2CN(C(=O)OC(C)(C)C)C2)c1	ZINC000875038120	GD	On-Demand	Anodyne	GPR119	23	45
Cc1cccc(CNC(=O)C(=O)N[C@H](C)C2CN(C(=O)OC(C)(C)C)C2)c1	ZINC000875038121	GD	On-Demand	Anodyne	GPR119	23	45
C[C@@H](NC(=O)N1CCCCCCNC(=O)CC1)c1ccc2c(c1)OCO2	ZINC000875038124	FF	On-Demand	Anodyne	KCNQ2	21	45
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1ccc2c(c1)OCO2	ZINC000875038125	DF	On-Demand	Anodyne	KCNQ2	22	46
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(S(C)(=O)=O)CC2)C1	ZINC000875038127	FC	On-Demand	Anodyne	EPHX2	17	41
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875038132	FF	On-Demand	Anodyne	NOS2	99	39
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875038132	FF	On-Demand	Anodyne	NAMPT	23	46
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875038133	FF	On-Demand	Anodyne	NOS2	99	39
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875038133	FF	On-Demand	Anodyne	NAMPT	23	46
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875038139	GF	On-Demand	Anodyne	NOS2	98	38
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875038140	GF	On-Demand	Anodyne	NOS2	98	38
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875038141	GF	On-Demand	Anodyne	NOS2	98	38
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875038142	GF	On-Demand	Anodyne	NOS2	98	38
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](C)c1ccc(OC(F)(F)F)cc1	ZINC000875038149	FD	On-Demand	Mild	ACACA	21	41
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)c1ccc(OC(F)(F)F)cc1	ZINC000875038153	FD	On-Demand	Mild	ACACA	21	41
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)c1ccc(OC(F)(F)F)cc1	ZINC000875038154	FD	On-Demand	Mild	ACACA	21	41
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](C)c1ccc(OC(F)(F)F)cc1	ZINC000875038156	FD	On-Demand	Mild	ACACA	21	41
CC[C@@H](NC(=O)N1CCN([S@](C)(=N)=O)CC1)c1ccc(Cl)cc1	ZINC000875038163	FF	On-Demand	Anodyne	CACNA1H	29	42
CC[C@@H](NC(=O)N1CCN([S@@](C)(=N)=O)CC1)c1ccc(Cl)cc1	ZINC000875038169	FF	On-Demand	Anodyne	CACNA1H	29	42
CC[C@H](C[C@H](C)O)NC(=O)NCc1cnn(-c2ccccc2)c1	ZINC000875038171	DE	On-Demand	Anodyne	ANPEP	15	40
CC[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(Cl)cc1	ZINC000875038182	EF	On-Demand	Anodyne	CACNA1H	55	51
CC[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(Cl)cc1	ZINC000875038182	EF	On-Demand	Anodyne	CCR1	51	39
CC[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(Cl)cc1	ZINC000875038182	EF	On-Demand	Anodyne	AKT3	25	43
CC[C@@H]1COCCN1CCNC(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875038194	FD	On-Demand	Anodyne	NOS2	99	42
CC[C@@H]1COCCN1CCNC(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875038194	FD	On-Demand	Anodyne	NAMPT	17	46
CCCCCCCNC(=O)C(=O)NCc1cc(F)ccc1F	ZINC000875038200	DF	On-Demand	Mild	ASAH1	99	39
COc1ccc2[nH]cc(CCNC(=O)C(=O)NCC3(OC(C)C)CCC3)c2c1	ZINC000875038239	GE	On-Demand	Anodyne	HTR1D	39	46
COc1ccc2[nH]cc(CCNC(=O)C(=O)NCC3(OC(C)C)CCC3)c2c1	ZINC000875038239	GE	On-Demand	Anodyne	HTR1B	33	46
COc1ccc2[nH]cc(CCNC(=O)C(=O)NCC3(OC(C)C)CCC3)c2c1	ZINC000875038239	GE	On-Demand	Anodyne	NQO2	34	59
COc1ccc2[nH]cc(CCNC(=O)C(=O)NCC3(OC(C)C)CCC3)c2c1	ZINC000875038239	GE	On-Demand	Anodyne	MTNR1A	95	60
COc1ccc2[nH]cc(CCNC(=O)C(=O)NCC3(OC(C)C)CCC3)c2c1	ZINC000875038239	GE	On-Demand	Anodyne	MTNR1B	75	59
COc1ccc2[nH]cc(CCNC(=O)C(=O)NCC3(OC(C)C)CCC3)c2c1	ZINC000875038239	GE	On-Demand	Anodyne	ABCG2	27	44
COCC1CC(NC(=O)NC2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)C1	ZINC000875038247	GD	On-Demand	Anodyne	MMP13	21	42
COCC1CC(NC(=O)NC2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)C1	ZINC000875038247	GD	On-Demand	Anodyne	MMP3	24	42
COCC1CC(NC(=O)NC2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)C1	ZINC000875038247	GD	On-Demand	Anodyne	EPHX2	58	56
COCC1CC(NC(=O)NC2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)C1	ZINC000875038247	GD	On-Demand	Anodyne	TGM2	83	44
COCC1CC(NC(=O)NC2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)C1	ZINC000875038247	GD	On-Demand	Anodyne	MMP7	19	42
COCC1CC(NC(=O)NC2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)C1	ZINC000875038247	GD	On-Demand	Anodyne	MMP1	20	42
COCC1CC(NC(=O)NC2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)C1	ZINC000875038247	GD	On-Demand	Anodyne	F13A1	80	44
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875038248	FE	On-Demand	Anodyne	GRIA1	45	34
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875038252	FE	On-Demand	Anodyne	GRIA1	45	34
CC(=O)Nc1cccc([C@@H](C)NC(=O)C(=O)NCCCCC2CC2)c1	ZINC000875038255	EF	On-Demand	Anodyne	PTGIR	15	40
CC(=O)Nc1cccc([C@H](C)NC(=O)C(=O)NCCCCC2CC2)c1	ZINC000875038257	EF	On-Demand	Anodyne	PTGIR	15	40
C[C@H](NC(=O)NC(C)(C)[C@H]1CCCCO1)c1ccc2c(c1)OCO2	ZINC000875038271	EG	On-Demand	Anodyne	KCNQ2	21	43
C[C@H](NC(=O)NC(C)(C)[C@@H]1CCCCO1)c1ccc2c(c1)OCO2	ZINC000875038274	EG	On-Demand	Anodyne	KCNQ2	21	43
CN1CCN(C2CCN(C(=O)NCC3(c4ccccc4)CCC3)CC2)CC1	ZINC000875038275	FF	On-Demand	Anodyne	OPRL1	30	41
CN1CCN(C2CCN(C(=O)NCC3(c4ccccc4)CCC3)CC2)CC1	ZINC000875038275	FF	On-Demand	Anodyne	KCNA3	49	42
CN1CCN(C2CCN(C(=O)NCC3(c4ccccc4)CCC3)CC2)CC1	ZINC000875038275	FF	On-Demand	Anodyne	EPHX2	26	42
CN1CCN(C2CCN(C(=O)NCC3(c4ccccc4)CCC3)CC2)CC1	ZINC000875038275	FF	On-Demand	Anodyne	SMO	26	50
CN1CCN(C2CCN(C(=O)NCC3(c4ccccc4)CCC3)CC2)CC1	ZINC000875038275	FF	On-Demand	Anodyne	L3MBTL3	87	44
C[C@@H](NC(=O)NC(C)(C)[C@H]1CCCCO1)c1ccc2c(c1)OCO2	ZINC000875038277	EG	On-Demand	Anodyne	KCNQ2	21	43
C[C@@H](NC(=O)NC(C)(C)[C@@H]1CCCCO1)c1ccc2c(c1)OCO2	ZINC000875038280	EG	On-Demand	Anodyne	KCNQ2	21	43
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)CCc1ccc(O)cc1	ZINC000875038301	DF	On-Demand	Anodyne	MME	22	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)CCc1ccc(O)cc1	ZINC000875038301	DF	On-Demand	Anodyne	GRIA1	47	33
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)CCc1ccc(O)cc1	ZINC000875038307	DF	On-Demand	Anodyne	MME	22	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)CCc1ccc(O)cc1	ZINC000875038307	DF	On-Demand	Anodyne	GRIA1	47	33
CC[C@@H](NC(=O)NN(C)C(=O)OC)c1ccc(Cl)cc1	ZINC000875038329	CF	On-Demand	Reactive	UTS2	58	42
CN1CC[C@H]2CN(C(=O)NCC3(c4ccccc4)CCC3)CC[C@H]21	ZINC000875038331	EF	On-Demand	Anodyne	KCNA3	51	42
CN1CC[C@H]2CN(C(=O)NCC3(c4ccccc4)CCC3)CC[C@H]21	ZINC000875038331	EF	On-Demand	Anodyne	SMO	15	45
CN1CC[C@H]2CN(C(=O)NCC3(c4ccccc4)CCC3)CC[C@@H]21	ZINC000875038338	EF	On-Demand	Anodyne	KCNA3	51	42
CN1CC[C@H]2CN(C(=O)NCC3(c4ccccc4)CCC3)CC[C@@H]21	ZINC000875038338	EF	On-Demand	Anodyne	SMO	15	45
CC(=O)[C@H]1CCCN(C(=O)NCC2(c3ccccc3)CCC2)C1	ZINC000875038341	DG	On-Demand	Anodyne	SLC6A1	57	33
CC(=O)[C@H]1CCCN(C(=O)NCC2(c3ccccc3)CCC2)C1	ZINC000875038341	DG	On-Demand	Anodyne	KCNA3	51	42
CC(=O)[C@H]1CCCN(C(=O)NCC2(c3ccccc3)CCC2)C1	ZINC000875038341	DG	On-Demand	Anodyne	EPHX2	18	40
CC(=O)[C@H]1CCCN(C(=O)NCC2(c3ccccc3)CCC2)C1	ZINC000875038341	DG	On-Demand	Anodyne	CACNA1G	15	46
CC(=O)[C@H]1CCCN(C(=O)NCC2(c3ccccc3)CCC2)C1	ZINC000875038341	DG	On-Demand	Anodyne	SMO	18	44
CC(=O)[C@H]1CCCN(C(=O)NCC2(c3ccccc3)CCC2)C1	ZINC000875038341	DG	On-Demand	Anodyne	HCN1	41	31
CC(=O)[C@H]1CCCN(C(=O)NCC2(c3ccccc3)CCC2)C1	ZINC000875038341	DG	On-Demand	Anodyne	HCN4	41	31
CC(=O)[C@@H]1CCCN(C(=O)NCC2(c3ccccc3)CCC2)C1	ZINC000875038343	DG	On-Demand	Anodyne	SLC6A1	57	33
CC(=O)[C@@H]1CCCN(C(=O)NCC2(c3ccccc3)CCC2)C1	ZINC000875038343	DG	On-Demand	Anodyne	KCNA3	51	42
CC(=O)[C@@H]1CCCN(C(=O)NCC2(c3ccccc3)CCC2)C1	ZINC000875038343	DG	On-Demand	Anodyne	EPHX2	18	40
CC(=O)[C@@H]1CCCN(C(=O)NCC2(c3ccccc3)CCC2)C1	ZINC000875038343	DG	On-Demand	Anodyne	CACNA1G	15	46
CC(=O)[C@@H]1CCCN(C(=O)NCC2(c3ccccc3)CCC2)C1	ZINC000875038343	DG	On-Demand	Anodyne	SMO	18	44
CC(=O)[C@@H]1CCCN(C(=O)NCC2(c3ccccc3)CCC2)C1	ZINC000875038343	DG	On-Demand	Anodyne	HCN1	41	31
CC(=O)[C@@H]1CCCN(C(=O)NCC2(c3ccccc3)CCC2)C1	ZINC000875038343	DG	On-Demand	Anodyne	HCN4	41	31
Cc1cccc(CNC(=O)C(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875038346	EF	On-Demand	Anodyne	EPHX2	15	40
Cc1cccc(CNC(=O)C(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875038349	EF	On-Demand	Anodyne	EPHX2	15	40
O=C(NCCCn1cccn1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875038363	GD	On-Demand	Anodyne	DRD2	31	43
O=C(NCCCn1cccn1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875038363	GD	On-Demand	Anodyne	DRD4	47	43
O=C(NCCCn1cccn1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875038363	GD	On-Demand	Anodyne	ACHE	67	60
O=C(NCCCn1cccn1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875038363	GD	On-Demand	Anodyne	HTR2A	22	40
O=C(NCCCn1cccn1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875038363	GD	On-Demand	Anodyne	HRH1	15	41
O=C(NCCCn1cccn1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875038363	GD	On-Demand	Anodyne	DRD3	35	43
O=C(NCCCn1cccn1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875038363	GD	On-Demand	Anodyne	SLC6A3	15	47
O=C(NCCCn1cccn1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875038363	GD	On-Demand	Anodyne	HTR4	30	40
O=C(NCCCn1cccn1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875038363	GD	On-Demand	Anodyne	SIGMAR1	60	44
O=C(NCCCn1cccn1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875038363	GD	On-Demand	Anodyne	BCHE	21	48
O=C(NCCCn1cccn1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875038363	GD	On-Demand	Anodyne	CCR3	45	46
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875038368	FH	On-Demand	Anodyne	ACE	22	42
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875038368	FH	On-Demand	Anodyne	NTSR1	87	34
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875038368	FH	On-Demand	Anodyne	NTSR2	64	33
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875038368	FH	On-Demand	Anodyne	CACNA1B	15	40
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875038368	FH	On-Demand	Anodyne	YARS	46	35
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875038368	FH	On-Demand	Anodyne	DPP7	47	32
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875038368	FH	On-Demand	Anodyne	BIRC2	51	43
CN(C)C[C@@H]1CN(C(=O)C(=O)NCc2cc(F)ccc2F)C[C@H]1CN(C)C	ZINC000875038370	GC	On-Demand	Anodyne	P2RX7	44	38
CN(C)C[C@@H]1CN(C(=O)C(=O)NCc2cc(F)ccc2F)C[C@H]1CN(C)C	ZINC000875038370	GC	On-Demand	Anodyne	DPP4	15	45
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875038372	FH	On-Demand	Anodyne	ACE	22	42
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875038372	FH	On-Demand	Anodyne	NTSR1	87	34
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875038372	FH	On-Demand	Anodyne	NTSR2	64	33
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875038372	FH	On-Demand	Anodyne	CACNA1B	15	40
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875038372	FH	On-Demand	Anodyne	YARS	46	35
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875038372	FH	On-Demand	Anodyne	DPP7	47	32
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875038372	FH	On-Demand	Anodyne	BIRC2	51	43
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875038374	FH	On-Demand	Anodyne	ACE	22	42
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875038374	FH	On-Demand	Anodyne	NTSR1	87	34
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875038374	FH	On-Demand	Anodyne	NTSR2	64	33
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875038374	FH	On-Demand	Anodyne	CACNA1B	15	40
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875038374	FH	On-Demand	Anodyne	YARS	46	35
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875038374	FH	On-Demand	Anodyne	DPP7	47	32
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875038374	FH	On-Demand	Anodyne	BIRC2	51	43
O=C(NCCO)C1CCN(C(=O)NCC2(c3ccccc3)CCC2)CC1	ZINC000875038375	FD	On-Demand	Anodyne	KCNA3	47	43
O=C(NCCO)C1CCN(C(=O)NCC2(c3ccccc3)CCC2)CC1	ZINC000875038375	FD	On-Demand	Anodyne	EPHX2	26	40
O=C(NCCO)C1CCN(C(=O)NCC2(c3ccccc3)CCC2)CC1	ZINC000875038375	FD	On-Demand	Anodyne	CACNA1G	23	54
O=C(NCCO)C1CCN(C(=O)NCC2(c3ccccc3)CCC2)CC1	ZINC000875038375	FD	On-Demand	Anodyne	SMO	17	47
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875038376	FH	On-Demand	Anodyne	ACE	22	42
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875038376	FH	On-Demand	Anodyne	NTSR1	87	34
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875038376	FH	On-Demand	Anodyne	NTSR2	64	33
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875038376	FH	On-Demand	Anodyne	CACNA1B	15	40
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875038376	FH	On-Demand	Anodyne	YARS	46	35
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875038376	FH	On-Demand	Anodyne	DPP7	47	32
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875038376	FH	On-Demand	Anodyne	BIRC2	51	43
CN1CCN(C2CCN(C(=O)C(=O)NCc3cc(F)ccc3F)CC2)CC1	ZINC000875038384	GC	On-Demand	Anodyne	P2RX7	43	41
CN1CCN(C2CCN(C(=O)C(=O)NCc3cc(F)ccc3F)CC2)CC1	ZINC000875038384	GC	On-Demand	Anodyne	DPP4	15	46
CN1CCN(C2CCN(C(=O)C(=O)NCc3cc(F)ccc3F)CC2)CC1	ZINC000875038384	GC	On-Demand	Anodyne	L3MBTL3	67	40
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H]4CSC[C@@H]4C3)c2c1	ZINC000875038388	GE	On-Demand	Anodyne	HTR1A	17	47
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H]4CSC[C@@H]4C3)c2c1	ZINC000875038388	GE	On-Demand	Anodyne	HTR1D	63	47
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H]4CSC[C@@H]4C3)c2c1	ZINC000875038388	GE	On-Demand	Anodyne	HTR1B	52	47
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H]4CSC[C@@H]4C3)c2c1	ZINC000875038388	GE	On-Demand	Anodyne	NQO2	31	56
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H]4CSC[C@@H]4C3)c2c1	ZINC000875038388	GE	On-Demand	Anodyne	MTNR1A	78	56
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H]4CSC[C@@H]4C3)c2c1	ZINC000875038388	GE	On-Demand	Anodyne	MTNR1B	59	56
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H]4CSC[C@@H]4C3)c2c1	ZINC000875038388	GE	On-Demand	Anodyne	ABCG2	25	41
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H]4CSC[C@@H]4C3)c2c1	ZINC000875038390	GE	On-Demand	Anodyne	HTR1A	17	47
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H]4CSC[C@@H]4C3)c2c1	ZINC000875038390	GE	On-Demand	Anodyne	HTR1D	63	47
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H]4CSC[C@@H]4C3)c2c1	ZINC000875038390	GE	On-Demand	Anodyne	HTR1B	52	47
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H]4CSC[C@@H]4C3)c2c1	ZINC000875038390	GE	On-Demand	Anodyne	NQO2	31	56
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H]4CSC[C@@H]4C3)c2c1	ZINC000875038390	GE	On-Demand	Anodyne	MTNR1A	78	56
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H]4CSC[C@@H]4C3)c2c1	ZINC000875038390	GE	On-Demand	Anodyne	MTNR1B	59	56
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H]4CSC[C@@H]4C3)c2c1	ZINC000875038390	GE	On-Demand	Anodyne	ABCG2	25	41
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H]4CSC[C@H]4C3)c2c1	ZINC000875038391	GE	On-Demand	Anodyne	HTR1A	17	47
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H]4CSC[C@H]4C3)c2c1	ZINC000875038391	GE	On-Demand	Anodyne	HTR1D	63	47
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H]4CSC[C@H]4C3)c2c1	ZINC000875038391	GE	On-Demand	Anodyne	HTR1B	52	47
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H]4CSC[C@H]4C3)c2c1	ZINC000875038391	GE	On-Demand	Anodyne	NQO2	31	56
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H]4CSC[C@H]4C3)c2c1	ZINC000875038391	GE	On-Demand	Anodyne	MTNR1A	78	56
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H]4CSC[C@H]4C3)c2c1	ZINC000875038391	GE	On-Demand	Anodyne	MTNR1B	59	56
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H]4CSC[C@H]4C3)c2c1	ZINC000875038391	GE	On-Demand	Anodyne	ABCG2	25	41
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H]4CSC[C@H]4C3)c2c1	ZINC000875038393	GE	On-Demand	Anodyne	HTR1A	17	47
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H]4CSC[C@H]4C3)c2c1	ZINC000875038393	GE	On-Demand	Anodyne	HTR1D	63	47
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H]4CSC[C@H]4C3)c2c1	ZINC000875038393	GE	On-Demand	Anodyne	HTR1B	52	47
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H]4CSC[C@H]4C3)c2c1	ZINC000875038393	GE	On-Demand	Anodyne	NQO2	31	56
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H]4CSC[C@H]4C3)c2c1	ZINC000875038393	GE	On-Demand	Anodyne	MTNR1A	78	56
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H]4CSC[C@H]4C3)c2c1	ZINC000875038393	GE	On-Demand	Anodyne	MTNR1B	59	56
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H]4CSC[C@H]4C3)c2c1	ZINC000875038393	GE	On-Demand	Anodyne	ABCG2	25	41
C[C@@H](NC(=O)NCc1ccc(-n2ccnc2)nc1)[C@@H](O)C(F)(F)F	ZINC000875038424	ED	On-Demand	Anodyne	NOS2	51	32
C[C@@H](NC(=O)NCc1ccc(-n2ccnc2)nc1)[C@H](O)C(F)(F)F	ZINC000875038427	ED	On-Demand	Anodyne	NOS2	51	32
C[C@@H](NC(=O)NC1([C@H]2CCCCO2)CCC1)c1ccc2c(c1)OCO2	ZINC000875038428	EG	On-Demand	Anodyne	KCNQ2	21	42
C[C@@H](NC(=O)NC1([C@@H]2CCCCO2)CCC1)c1ccc2c(c1)OCO2	ZINC000875038429	EG	On-Demand	Anodyne	KCNQ2	21	42
C[C@H](NC(=O)NC1([C@@H]2CCCCO2)CCC1)c1ccc2c(c1)OCO2	ZINC000875038431	EG	On-Demand	Anodyne	KCNQ2	21	42
C[C@H](NC(=O)NC1([C@H]2CCCCO2)CCC1)c1ccc2c(c1)OCO2	ZINC000875038433	EG	On-Demand	Anodyne	KCNQ2	21	42
O=C(NCCO)C1CCN(C(=O)NCc2cnn(-c3ccccc3)c2)CC1	ZINC000875038434	FC	On-Demand	Anodyne	EPHX2	19	40
COC(=O)[C@@]1(C)CN(C(=O)NCc2ccc(-n3ccnc3)nc2)C[C@@H]1C	ZINC000875038435	FD	On-Demand	Anodyne	NOS2	94	36
COC(=O)[C@@]1(C)CN(C(=O)NCc2ccc(-n3ccnc3)nc2)C[C@@H]1C	ZINC000875038435	FD	On-Demand	Anodyne	NAMPT	16	46
CCOC(=O)[C@@]1(C)CN(C(=O)NCc2ccc(-n3ccnc3)nc2)CCO1	ZINC000875038439	FD	On-Demand	Anodyne	NOS2	97	36
COC(=O)C1=NO[C@@]2(CCN(C(=O)NCC3(c4ccccc4)CCC3)C2)C1	ZINC000875038442	FE	On-Demand	Anodyne	KCNA3	45	35
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCCC2(CC1)CC2	ZINC000875038443	EF	On-Demand	Anodyne	NOS2	98	38
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCCC2(CC1)CC2	ZINC000875038443	EF	On-Demand	Anodyne	NAMPT	35	50
COC(=O)C1=NO[C@]2(CCN(C(=O)NCC3(c4ccccc4)CCC3)C2)C1	ZINC000875038444	FE	On-Demand	Anodyne	KCNA3	45	35
O=C(NCc1ccc(-n2ccnc2)nc1)N1C[C@H](O)C[C@H]1C1CC1	ZINC000875038445	ED	On-Demand	Anodyne	NOS2	94	35
O=C(NCc1ccc(-n2ccnc2)nc1)N1C[C@H](O)C[C@H]1C1CC1	ZINC000875038445	ED	On-Demand	Anodyne	NAMPT	16	46
O=C(NCc1ccc(-n2ccnc2)nc1)N1C[C@@H](O)C[C@H]1C1CC1	ZINC000875038447	ED	On-Demand	Anodyne	NOS2	94	35
O=C(NCc1ccc(-n2ccnc2)nc1)N1C[C@@H](O)C[C@H]1C1CC1	ZINC000875038447	ED	On-Demand	Anodyne	NAMPT	16	46
O=C(NCc1ccc(-n2ccnc2)nc1)N1C[C@H](O)C[C@@H]1C1CC1	ZINC000875038449	ED	On-Demand	Anodyne	NOS2	94	35
O=C(NCc1ccc(-n2ccnc2)nc1)N1C[C@H](O)C[C@@H]1C1CC1	ZINC000875038449	ED	On-Demand	Anodyne	NAMPT	16	46
NC(=O)[C@H](c1ccccc1)N1CCN(C(=O)N[C@@H]2CCCC[C@@H]2F)CC1	ZINC000875038450	FD	On-Demand	Anodyne	EPHX2	18	41
O=C(NCc1ccc(-n2ccnc2)nc1)N1C[C@@H](O)C[C@@H]1C1CC1	ZINC000875038451	ED	On-Demand	Anodyne	NOS2	94	35
O=C(NCc1ccc(-n2ccnc2)nc1)N1C[C@@H](O)C[C@@H]1C1CC1	ZINC000875038451	ED	On-Demand	Anodyne	NAMPT	16	46
NC(=O)[C@@H](c1ccccc1)N1CCN(C(=O)N[C@@H]2CCCC[C@@H]2F)CC1	ZINC000875038452	FD	On-Demand	Anodyne	EPHX2	18	41
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCO[C@@H](C(F)F)CC1	ZINC000875038457	FD	On-Demand	Anodyne	NOS2	105	40
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCO[C@@H](C(F)F)CC1	ZINC000875038457	FD	On-Demand	Anodyne	NAMPT	23	44
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCO[C@H](C(F)F)CC1	ZINC000875038458	FD	On-Demand	Anodyne	NOS2	105	40
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCO[C@H](C(F)F)CC1	ZINC000875038458	FD	On-Demand	Anodyne	NAMPT	23	44
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2cc(F)ccc2F)C1	ZINC000875038481	ED	On-Demand	Anodyne	P2RX7	41	37
CCC1(CC)CCCN1C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875038497	EG	On-Demand	Anodyne	NOS2	95	37
CCC1(CC)CCCN1C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875038497	EG	On-Demand	Anodyne	NAMPT	34	49
CC[C@@H](NC(=O)N1CCC(C(C)=O)CC1)c1ccc(Cl)cc1	ZINC000875038517	DH	On-Demand	Anodyne	CACNA1H	47	45
CC[C@@H](NC(=O)N1CCC(C(C)=O)CC1)c1ccc(Cl)cc1	ZINC000875038517	DH	On-Demand	Anodyne	CCR1	53	41
CC[C@@H](NC(=O)N1CCC(C(C)=O)CC1)c1ccc(Cl)cc1	ZINC000875038517	DH	On-Demand	Anodyne	UTS2	44	36
CC[C@@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccc(Cl)cc1	ZINC000875038527	GG	On-Demand	Anodyne	CACNA1H	20	41
CC[C@@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccc(Cl)cc1	ZINC000875038527	GG	On-Demand	Anodyne	UTS2	64	43
C[C@@H](NC(=O)N1CC(CNC(=O)C(F)(F)F)C1)c1ccc2c(c1)OCO2	ZINC000875038528	FD	On-Demand	Anodyne	KCNQ2	22	42
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](C)c1ccc(OC(F)(F)F)cc1	ZINC000875038531	GE	On-Demand	Mild	ACACA	20	42
O=C(NCc1ccc(-n2ccnc2)nc1)N[C@]12CCCC[C@@H]1C2	ZINC000875038533	DE	On-Demand	Anodyne	NOS2	97	41
O=C(NCc1ccc(-n2ccnc2)nc1)N[C@]12CCCC[C@@H]1C2	ZINC000875038533	DE	On-Demand	Anodyne	NAMPT	18	51
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H](C)c1ccc(OC(F)(F)F)cc1	ZINC000875038534	GE	On-Demand	Mild	ACACA	20	42
O=C(NCc1ccc(-n2ccnc2)nc1)N[C@@]12CCCC[C@@H]1C2	ZINC000875038535	DE	On-Demand	Anodyne	NOS2	97	41
O=C(NCc1ccc(-n2ccnc2)nc1)N[C@@]12CCCC[C@@H]1C2	ZINC000875038535	DE	On-Demand	Anodyne	NAMPT	18	51
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H](C)c1ccc(OC(F)(F)F)cc1	ZINC000875038536	GE	On-Demand	Mild	ACACA	20	42
O=C(NCc1ccc(-n2ccnc2)nc1)N[C@@]12CCCC[C@H]1C2	ZINC000875038537	DE	On-Demand	Anodyne	NOS2	97	41
O=C(NCc1ccc(-n2ccnc2)nc1)N[C@@]12CCCC[C@H]1C2	ZINC000875038537	DE	On-Demand	Anodyne	NAMPT	18	51
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](C)c1ccc(OC(F)(F)F)cc1	ZINC000875038538	GE	On-Demand	Mild	ACACA	20	42
O=C(NCc1ccc(-n2ccnc2)nc1)N[C@]12CCCC[C@H]1C2	ZINC000875038539	DE	On-Demand	Anodyne	NOS2	97	41
O=C(NCc1ccc(-n2ccnc2)nc1)N[C@]12CCCC[C@H]1C2	ZINC000875038539	DE	On-Demand	Anodyne	NAMPT	18	51
CN(C[C@@H]1C[C@H](O)C1)C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875038549	DD	On-Demand	Anodyne	NOS2	96	36
CC[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1ccc(Cl)cc1	ZINC000875038557	EG	On-Demand	Anodyne	CACNA1H	69	54
CC[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1ccc(Cl)cc1	ZINC000875038557	EG	On-Demand	Anodyne	AKT3	24	43
C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCCN2C(=O)NCc2ccc(-n3ccnc3)nc2)C1	ZINC000875038559	GG	On-Demand	Anodyne	NOS2	85	40
C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCCN2C(=O)NCc2ccc(-n3ccnc3)nc2)C1	ZINC000875038566	GG	On-Demand	Anodyne	NOS2	85	40
C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCCN2C(=O)NCc2ccc(-n3ccnc3)nc2)C1	ZINC000875038568	GG	On-Demand	Anodyne	NOS2	85	40
C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCCN2C(=O)NCc2ccc(-n3ccnc3)nc2)C1	ZINC000875038569	GG	On-Demand	Anodyne	NOS2	85	40
O=C(NCc1ccc(-n2ccnc2)nc1)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875038577	FF	On-Demand	Anodyne	NOS2	101	38
O=C(NCc1ccc(-n2ccnc2)nc1)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875038577	FF	On-Demand	Anodyne	NAMPT	31	46
O=C(NCc1ccc(-n2ccnc2)nc1)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875038580	FF	On-Demand	Anodyne	NOS2	101	38
O=C(NCc1ccc(-n2ccnc2)nc1)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875038580	FF	On-Demand	Anodyne	NAMPT	31	46
CC(=O)Nc1cccc([C@@H](C)NC(=O)C(=O)NC[C@@H]2c3ccccc3CN2C)c1	ZINC000875038593	GE	On-Demand	Anodyne	PTGIR	15	42
CC(=O)Nc1cccc([C@H](C)NC(=O)C(=O)NC[C@@H]2c3ccccc3CN2C)c1	ZINC000875038595	GE	On-Demand	Anodyne	PTGIR	15	42
CC(=O)Nc1cccc([C@@H](C)NC(=O)C(=O)NC[C@H]2c3ccccc3CN2C)c1	ZINC000875038598	GE	On-Demand	Anodyne	PTGIR	15	42
CC(=O)Nc1cccc([C@H](C)NC(=O)C(=O)NC[C@H]2c3ccccc3CN2C)c1	ZINC000875038600	GE	On-Demand	Anodyne	PTGIR	15	42
O=C(NCC1(c2ccccc2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875038622	EH	On-Demand	Anodyne	KCNA3	51	40
O=C(NCC1(c2ccccc2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875038622	EH	On-Demand	Anodyne	EPHX2	34	41
O=C(NCC1(c2ccccc2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875038622	EH	On-Demand	Anodyne	SMO	20	49
O=C(NCC1(c2ccccc2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875038625	EH	On-Demand	Anodyne	KCNA3	51	40
O=C(NCC1(c2ccccc2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875038625	EH	On-Demand	Anodyne	EPHX2	34	41
O=C(NCC1(c2ccccc2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875038625	EH	On-Demand	Anodyne	SMO	20	49
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccc2c(c1)OCO2	ZINC000875038639	EF	On-Demand	Anodyne	KCNQ2	22	44
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccc2c(c1)OCO2	ZINC000875038639	EF	On-Demand	Anodyne	NOS2	43	30
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccc2c(c1)OCO2	ZINC000875038642	EF	On-Demand	Anodyne	KCNQ2	22	44
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccc2c(c1)OCO2	ZINC000875038642	EF	On-Demand	Anodyne	NOS2	43	30
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1cccs1)C1CC1	ZINC000875038644	EF	On-Demand	Anodyne	SLC6A4	22	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1cccs1)C1CC1	ZINC000875038644	EF	On-Demand	Anodyne	SLC6A3	42	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1cccs1)C1CC1	ZINC000875038647	EF	On-Demand	Anodyne	SLC6A4	22	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1cccs1)C1CC1	ZINC000875038647	EF	On-Demand	Anodyne	SLC6A3	42	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1cccs1)C1CC1	ZINC000875038649	EF	On-Demand	Anodyne	SLC6A4	22	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1cccs1)C1CC1	ZINC000875038649	EF	On-Demand	Anodyne	SLC6A3	42	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1cccs1)C1CC1	ZINC000875038651	EF	On-Demand	Anodyne	SLC6A4	22	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1cccs1)C1CC1	ZINC000875038651	EF	On-Demand	Anodyne	SLC6A3	42	46
C[C@H](CCc1ccc(O)cc1)NC(=O)NC(C)(C)[C@@H]1CCCCO1	ZINC000875038655	EG	On-Demand	Anodyne	YARS	55	32
C[C@H](CCc1ccc(O)cc1)NC(=O)NC(C)(C)[C@H]1CCCCO1	ZINC000875038656	EG	On-Demand	Anodyne	YARS	55	32
C[C@@H](CCc1ccc(O)cc1)NC(=O)NC(C)(C)[C@H]1CCCCO1	ZINC000875038657	EG	On-Demand	Anodyne	YARS	55	32
C[C@@H](CCc1ccc(O)cc1)NC(=O)NC(C)(C)[C@@H]1CCCCO1	ZINC000875038658	EG	On-Demand	Anodyne	YARS	55	32
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCN(C)C(C)(C)CC3)c2c1	ZINC000875038665	GD	On-Demand	Anodyne	HTR1A	18	49
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCN(C)C(C)(C)CC3)c2c1	ZINC000875038665	GD	On-Demand	Anodyne	HTR1D	59	44
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCN(C)C(C)(C)CC3)c2c1	ZINC000875038665	GD	On-Demand	Anodyne	HTR1B	49	44
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCN(C)C(C)(C)CC3)c2c1	ZINC000875038665	GD	On-Demand	Anodyne	NQO2	36	57
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCN(C)C(C)(C)CC3)c2c1	ZINC000875038665	GD	On-Demand	Anodyne	MTNR1A	86	58
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCN(C)C(C)(C)CC3)c2c1	ZINC000875038665	GD	On-Demand	Anodyne	MTNR1B	69	57
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCN(C)C(C)(C)CC3)c2c1	ZINC000875038665	GD	On-Demand	Anodyne	ABCG2	25	42
C[C@H](NC(=O)C(=O)NCc1cc(F)ccc1F)c1ccnn1C	ZINC000875038679	DD	On-Demand	Anodyne	P2RX7	43	44
COC(=O)N(C)NC(=O)NCC1(c2ccccc2)CC1	ZINC000875038680	CD	On-Demand	Reactive	KCNA3	56	46
COC(=O)N(C)NC(=O)NCC1(c2ccccc2)CC1	ZINC000875038680	CD	On-Demand	Reactive	SOAT1	15	45
O=C(NCC1(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875038681	DG	On-Demand	Clean	KCNA3	43	37
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875038682	HI	On-Demand	Anodyne	PREP	18	42
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875038682	HI	On-Demand	Anodyne	LGMN	50	36
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875038682	HI	On-Demand	Anodyne	SCD1	37	45
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875038682	HI	On-Demand	Anodyne	SCD	31	45
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2(c3ccccc3)CC2)C1	ZINC000875038688	EF	On-Demand	Anodyne	KCNA3	52	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2(c3ccccc3)CC2)C1	ZINC000875038688	EF	On-Demand	Anodyne	SOAT1	15	41
O=C(NCc1ccc(N2CCOCC2)nc1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875038701	GE	On-Demand	Anodyne	STAT6	62	37
COc1ccc2[nH]cc(CCNC(=O)C(=O)NCC[C@@H]3CCSC3)c2c1	ZINC000875038702	GE	On-Demand	Anodyne	HTR1A	17	46
COc1ccc2[nH]cc(CCNC(=O)C(=O)NCC[C@@H]3CCSC3)c2c1	ZINC000875038702	GE	On-Demand	Anodyne	HTR1D	43	46
COc1ccc2[nH]cc(CCNC(=O)C(=O)NCC[C@@H]3CCSC3)c2c1	ZINC000875038702	GE	On-Demand	Anodyne	HTR1B	36	46
COc1ccc2[nH]cc(CCNC(=O)C(=O)NCC[C@@H]3CCSC3)c2c1	ZINC000875038702	GE	On-Demand	Anodyne	NQO2	41	60
COc1ccc2[nH]cc(CCNC(=O)C(=O)NCC[C@@H]3CCSC3)c2c1	ZINC000875038702	GE	On-Demand	Anodyne	MTNR1A	96	61
COc1ccc2[nH]cc(CCNC(=O)C(=O)NCC[C@@H]3CCSC3)c2c1	ZINC000875038702	GE	On-Demand	Anodyne	MTNR1B	70	60
COc1ccc2[nH]cc(CCNC(=O)C(=O)NCC[C@@H]3CCSC3)c2c1	ZINC000875038702	GE	On-Demand	Anodyne	ABCG2	26	43
COc1ccc2[nH]cc(CCNC(=O)C(=O)NCC[C@H]3CCSC3)c2c1	ZINC000875038703	GE	On-Demand	Anodyne	HTR1A	17	46
COc1ccc2[nH]cc(CCNC(=O)C(=O)NCC[C@H]3CCSC3)c2c1	ZINC000875038703	GE	On-Demand	Anodyne	HTR1D	43	46
COc1ccc2[nH]cc(CCNC(=O)C(=O)NCC[C@H]3CCSC3)c2c1	ZINC000875038703	GE	On-Demand	Anodyne	HTR1B	36	46
COc1ccc2[nH]cc(CCNC(=O)C(=O)NCC[C@H]3CCSC3)c2c1	ZINC000875038703	GE	On-Demand	Anodyne	NQO2	41	60
COc1ccc2[nH]cc(CCNC(=O)C(=O)NCC[C@H]3CCSC3)c2c1	ZINC000875038703	GE	On-Demand	Anodyne	MTNR1A	96	61
COc1ccc2[nH]cc(CCNC(=O)C(=O)NCC[C@H]3CCSC3)c2c1	ZINC000875038703	GE	On-Demand	Anodyne	MTNR1B	70	60
COc1ccc2[nH]cc(CCNC(=O)C(=O)NCC[C@H]3CCSC3)c2c1	ZINC000875038703	GE	On-Demand	Anodyne	ABCG2	26	43
COc1ccc2[nH]cc(CCNC(=O)C(=O)NCCCCC3CC3)c2c1	ZINC000875038710	FF	On-Demand	Anodyne	HTR1A	29	52
COc1ccc2[nH]cc(CCNC(=O)C(=O)NCCCCC3CC3)c2c1	ZINC000875038710	FF	On-Demand	Anodyne	ACHE	34	47
COc1ccc2[nH]cc(CCNC(=O)C(=O)NCCCCC3CC3)c2c1	ZINC000875038710	FF	On-Demand	Anodyne	HTR1D	77	49
COc1ccc2[nH]cc(CCNC(=O)C(=O)NCCCCC3CC3)c2c1	ZINC000875038710	FF	On-Demand	Anodyne	HTR1B	61	49
COc1ccc2[nH]cc(CCNC(=O)C(=O)NCCCCC3CC3)c2c1	ZINC000875038710	FF	On-Demand	Anodyne	SLC6A4	17	49
COc1ccc2[nH]cc(CCNC(=O)C(=O)NCCCCC3CC3)c2c1	ZINC000875038710	FF	On-Demand	Anodyne	TPR	15	58
COc1ccc2[nH]cc(CCNC(=O)C(=O)NCCCCC3CC3)c2c1	ZINC000875038710	FF	On-Demand	Anodyne	NQO2	47	65
COc1ccc2[nH]cc(CCNC(=O)C(=O)NCCCCC3CC3)c2c1	ZINC000875038710	FF	On-Demand	Anodyne	MPO	68	39
COc1ccc2[nH]cc(CCNC(=O)C(=O)NCCCCC3CC3)c2c1	ZINC000875038710	FF	On-Demand	Anodyne	HTR1E	28	43
COc1ccc2[nH]cc(CCNC(=O)C(=O)NCCCCC3CC3)c2c1	ZINC000875038710	FF	On-Demand	Anodyne	MTNR1A	127	66
COc1ccc2[nH]cc(CCNC(=O)C(=O)NCCCCC3CC3)c2c1	ZINC000875038710	FF	On-Demand	Anodyne	MTNR1B	98	65
COc1ccc2[nH]cc(CCNC(=O)C(=O)NCCCCC3CC3)c2c1	ZINC000875038710	FF	On-Demand	Anodyne	ABCG2	27	45
CC[C@H](C[C@H](C)O)NC(=O)NCC1(c2ccccc2)CC1	ZINC000875038716	CF	On-Demand	Anodyne	KCNA3	49	40
CC[C@H](C[C@H](C)O)NC(=O)NCC1(c2ccccc2)CC1	ZINC000875038716	CF	On-Demand	Anodyne	NMBR	41	39
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	ZINC000875038733	GD	On-Demand	Anodyne	EPHX2	48	51
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cc([N+](=O)[O-])ccc1N1CCOCC1	ZINC000875038737	JI	On-Demand	Bother	SCD1	34	43
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cc([N+](=O)[O-])ccc1N1CCOCC1	ZINC000875038737	JI	On-Demand	Bother	SCD	29	43
C[C@@H]1CN(C(=O)NCc2ccc(-n3ccnc3)nc2)CC[C@H]1C(=O)OC(C)(C)C	ZINC000875038739	GF	On-Demand	Anodyne	NOS2	100	37
C[C@@H]1CN(C(=O)NCc2ccc(-n3ccnc3)nc2)CC[C@H]1C(=O)OC(C)(C)C	ZINC000875038739	GF	On-Demand	Anodyne	NAMPT	18	43
C[C@@H]1CN(C(=O)NCc2ccc(-n3ccnc3)nc2)CC[C@@H]1C(=O)OC(C)(C)C	ZINC000875038742	GF	On-Demand	Anodyne	NOS2	100	37
C[C@@H]1CN(C(=O)NCc2ccc(-n3ccnc3)nc2)CC[C@@H]1C(=O)OC(C)(C)C	ZINC000875038742	GF	On-Demand	Anodyne	NAMPT	18	43
C[C@@H](NC(=O)N1Cc2cccc(O)c2C1)c1ccc2c(c1)OCO2	ZINC000875038744	EF	On-Demand	Clean	KCNQ2	22	47
C[C@H](NC(=O)N1Cc2cccc(O)c2C1)c1ccc2c(c1)OCO2	ZINC000875038746	EF	On-Demand	Clean	KCNQ2	22	47
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2cccc(C)c2)C1	ZINC000875038773	DD	On-Demand	Anodyne	DPP7	43	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2cccc(C)c2)C1	ZINC000875038775	DD	On-Demand	Anodyne	DPP7	43	37
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(-n3ccnc3)nc2)C1	ZINC000875038788	FD	On-Demand	Anodyne	NOS2	98	39
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(-n3ccnc3)nc2)C1	ZINC000875038788	FD	On-Demand	Anodyne	NAMPT	18	45
C[C@H]1[C@H](CC(F)(F)F)C[C@@H](C)N1C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875038792	GH	On-Demand	Anodyne	NOS2	69	33
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCc2nc(C3CC3)ncc2C1	ZINC000875038804	GE	On-Demand	Anodyne	NOS2	98	37
O=C(NCc1ccc(-n2ccnc2)nc1)N1CCc2nc(C3CC3)ncc2C1	ZINC000875038804	GE	On-Demand	Anodyne	NAMPT	24	42
CC[C@@H](NC(=O)NC1CCN(S(C)(=O)=O)CC1)[C@@H](O)c1ccccc1	ZINC000875038822	FD	On-Demand	Anodyne	CCR5	28	41
CC[C@@H](NC(=O)NC1CCN(S(C)(=O)=O)CC1)[C@@H](O)c1ccccc1	ZINC000875038822	FD	On-Demand	Anodyne	EPHX2	40	46
CC[C@@H](NC(=O)NC1CCN(S(C)(=O)=O)CC1)[C@@H](O)c1ccccc1	ZINC000875038822	FD	On-Demand	Anodyne	XIAP	55	36
CC[C@@H](NC(=O)NC1CCN(S(C)(=O)=O)CC1)[C@@H](O)c1ccccc1	ZINC000875038822	FD	On-Demand	Anodyne	BIRC2	41	31
CC[C@@H](NC(=O)NC1CCN(S(C)(=O)=O)CC1)[C@H](O)c1ccccc1	ZINC000875038826	FD	On-Demand	Anodyne	CCR5	28	41
CC[C@@H](NC(=O)NC1CCN(S(C)(=O)=O)CC1)[C@H](O)c1ccccc1	ZINC000875038826	FD	On-Demand	Anodyne	EPHX2	40	46
CC[C@@H](NC(=O)NC1CCN(S(C)(=O)=O)CC1)[C@H](O)c1ccccc1	ZINC000875038826	FD	On-Demand	Anodyne	XIAP	55	36
CC[C@@H](NC(=O)NC1CCN(S(C)(=O)=O)CC1)[C@H](O)c1ccccc1	ZINC000875038826	FD	On-Demand	Anodyne	BIRC2	41	31
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(C)cc1C	ZINC000875038838	CF	On-Demand	Anodyne	ANPEP	26	40
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(C)cc1C	ZINC000875038838	CF	On-Demand	Anodyne	CAPNS1	50	31
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(C)cc1C	ZINC000875038838	CF	On-Demand	Anodyne	HLA-DRB1	48	32
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(C)cc1C	ZINC000875038838	CF	On-Demand	Anodyne	CAPN1	43	40
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(C)cc1C	ZINC000875038838	CF	On-Demand	Anodyne	CAPN2	40	36
O=C(NC1CCN(C(=O)c2ccccc2F)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875038844	FD	On-Demand	Anodyne	EPHX2	17	43
O=C(NC1CCN(C(=O)c2ccccc2F)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875038846	FD	On-Demand	Anodyne	EPHX2	17	43
O=C(NCC1(c2ccccc2)CCC1)N1CCC2(CCNC2=O)CC1	ZINC000875038847	EE	On-Demand	Anodyne	KCNA3	42	42
NC(=O)[C@H](c1ccccc1)N1CCN(C(=O)NCc2ccnc(F)c2)CC1	ZINC000875038853	FD	On-Demand	Anodyne	NPY2R	53	34
NC(=O)[C@@H](c1ccccc1)N1CCN(C(=O)NCc2ccnc(F)c2)CC1	ZINC000875038855	FD	On-Demand	Anodyne	NPY2R	53	34
C[C@@H](NC(=O)NCC[C@@H](O)C1CCCC1)c1nc2ccccc2n1C(F)F	ZINC000875038859	GH	On-Demand	Anodyne	PDE6D	61	35
C[C@@H](NC(=O)NCC[C@H](O)C1CCCC1)c1nc2ccccc2n1C(F)F	ZINC000875038860	GH	On-Demand	Anodyne	PDE6D	61	35
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cnn(-c2ccccc2)c1	ZINC000875038868	FE	On-Demand	Anodyne	SLC6A3	45	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cnn(-c2ccccc2)c1	ZINC000875038870	FE	On-Demand	Anodyne	SLC6A3	45	39
O=C(NCc1ccc(-n2ccnc2)nc1)N[C@H]1[C@@H]2c3ccc(Cl)cc3C[C@H]21	ZINC000875038874	GG	On-Demand	Anodyne	NOS2	82	32
O=C(NCc1ccc(-n2ccnc2)nc1)N[C@@H]1[C@@H]2Cc3cc(Cl)ccc3[C@@H]21	ZINC000875038876	GG	On-Demand	Anodyne	NOS2	82	32
O=C(NCc1ccc(-n2ccnc2)nc1)N[C@@H]1[C@H]2Cc3cc(Cl)ccc3[C@H]21	ZINC000875038879	GG	On-Demand	Anodyne	NOS2	82	32
O=C(NCc1ccc(-n2ccnc2)nc1)N[C@@H]1[C@H]2Cc3cc(Cl)ccc3[C@@H]21	ZINC000875038881	GG	On-Demand	Anodyne	NOS2	82	32
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)ccc1F	ZINC000875038883	JI	On-Demand	Anodyne	SCD1	47	57
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)ccc1F	ZINC000875038883	JI	On-Demand	Anodyne	SCD	41	57
C[C@@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccc2c(c1)OCO2	ZINC000875038893	GD	On-Demand	Anodyne	KCNQ2	23	46
C[C@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccc2c(c1)OCO2	ZINC000875038895	GD	On-Demand	Anodyne	KCNQ2	23	46
COc1cc(NC(=O)c2ccco2)c(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cc1OC	ZINC000875038912	JK	On-Demand	Anodyne	SCD1	46	56
COc1cc(NC(=O)c2ccco2)c(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cc1OC	ZINC000875038912	JK	On-Demand	Anodyne	SCD	41	56
CC[C@@H](NC(=O)N1C[C@H]2C(=O)N(C)C(=O)[C@H]2C1)c1ccc(Cl)cc1	ZINC000875038913	EE	On-Demand	Anodyne	CACNA1H	29	42
CC[C@@H](NC(=O)N1C[C@H]2C(=O)N(C)C(=O)[C@H]2C1)c1ccc(Cl)cc1	ZINC000875038913	EE	On-Demand	Anodyne	UTS2	44	36
CO[C@H]1CCN([C@@H]2CCC[C@@H]2NC(=O)NCc2ccc(-n3ccnc3)nc2)C1	ZINC000875038916	GD	On-Demand	Anodyne	NOS2	93	39
O=C(NCc1ccc(-n2ccnc2)nc1)N[C@H]1CCC[C@@H]1O	ZINC000875038917	DC	On-Demand	Anodyne	NOS2	95	38
O=C(NCc1ccc(-n2ccnc2)nc1)N[C@H]1CCC[C@@H]1O	ZINC000875038917	DC	On-Demand	Anodyne	NAMPT	34	54
C[C@@H](CCc1ccc(O)cc1)NC(=O)NCC[C@@H](O)C1CCCC1	ZINC000875038921	EF	On-Demand	Anodyne	MMP2	63	33
C[C@@H](CCc1ccc(O)cc1)NC(=O)NCC[C@@H](O)C1CCCC1	ZINC000875038921	EF	On-Demand	Anodyne	GRIA1	52	39
C[C@@H](CCc1ccc(O)cc1)NC(=O)NCC[C@@H](O)C1CCCC1	ZINC000875038921	EF	On-Demand	Anodyne	YARS	51	34
C[C@H](CCc1ccc(O)cc1)NC(=O)NCC[C@H](O)C1CCCC1	ZINC000875038922	EF	On-Demand	Anodyne	MMP2	63	33
C[C@H](CCc1ccc(O)cc1)NC(=O)NCC[C@H](O)C1CCCC1	ZINC000875038922	EF	On-Demand	Anodyne	GRIA1	52	39
C[C@H](CCc1ccc(O)cc1)NC(=O)NCC[C@H](O)C1CCCC1	ZINC000875038922	EF	On-Demand	Anodyne	YARS	51	34
C[C@@H](CCc1ccc(O)cc1)NC(=O)NCC[C@H](O)C1CCCC1	ZINC000875038924	EF	On-Demand	Anodyne	MMP2	63	33
C[C@@H](CCc1ccc(O)cc1)NC(=O)NCC[C@H](O)C1CCCC1	ZINC000875038924	EF	On-Demand	Anodyne	GRIA1	52	39
C[C@@H](CCc1ccc(O)cc1)NC(=O)NCC[C@H](O)C1CCCC1	ZINC000875038924	EF	On-Demand	Anodyne	YARS	51	34
CC[C@@H](NC(=O)C(=O)NCc1cccc(C)c1)c1cccc(OC)c1OC	ZINC000875038925	FF	On-Demand	Anodyne	PDS	48	40
C[C@H](CCc1ccc(O)cc1)NC(=O)NCC[C@@H](O)C1CCCC1	ZINC000875038926	EF	On-Demand	Anodyne	MMP2	63	33
C[C@H](CCc1ccc(O)cc1)NC(=O)NCC[C@@H](O)C1CCCC1	ZINC000875038926	EF	On-Demand	Anodyne	GRIA1	52	39
C[C@H](CCc1ccc(O)cc1)NC(=O)NCC[C@@H](O)C1CCCC1	ZINC000875038926	EF	On-Demand	Anodyne	YARS	51	34
O=C(NCCO)C1CCN(C(=O)NCC2(c3ccccc3)CC2)CC1	ZINC000875038929	ED	On-Demand	Anodyne	KCNA3	48	44
O=C(NCCO)C1CCN(C(=O)NCC2(c3ccccc3)CC2)CC1	ZINC000875038929	ED	On-Demand	Anodyne	CACNA1G	26	48
O=C(NCCO)C1CCN(C(=O)NCC2(c3ccccc3)CC2)CC1	ZINC000875038929	ED	On-Demand	Anodyne	SMO	15	44
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875038931	FG	On-Demand	Anodyne	BIRC2	22	40
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875038932	FG	On-Demand	Anodyne	BIRC2	22	40
O=C1CCN(C(=O)NCC2(c3ccccc3)CC2)CCCCCCN1	ZINC000875038935	EF	On-Demand	Anodyne	KCNA3	39	43
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCCCCCNC(=O)CC1	ZINC000875038937	FF	On-Demand	Anodyne	DPP7	41	34
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCCCCCNC(=O)CC1	ZINC000875038938	FF	On-Demand	Anodyne	DPP7	41	34
O=C(NCC1(c2ccccc2)CC1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875038946	FE	On-Demand	Anodyne	KCNA3	44	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)nc1	ZINC000875038951	DD	On-Demand	Anodyne	SLC6A3	47	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)nc1	ZINC000875038952	DD	On-Demand	Anodyne	SLC6A3	47	38
O=C(NC[C@H]1C[C@H](O)C1)NCC1(c2ccccc2)CC1	ZINC000875038993	CD	On-Demand	Anodyne	KCNA3	50	40
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(C)c2)CC1	ZINC000875039026	DD	On-Demand	Anodyne	EPHX2	19	40
COC(=O)N(C)NC(=O)NCC1(c2ccccc2)CCC1	ZINC000875039030	CE	On-Demand	Reactive	KCNA3	55	45
COC(=O)N(C)NC(=O)NCC1(c2ccccc2)CCC1	ZINC000875039030	CE	On-Demand	Reactive	NMBR	42	33
O=C(NCc1ccc(-n2ccnc2)nc1)N1OC2CCC1CC2	ZINC000875039033	DE	On-Demand	Anodyne	NOS2	106	41
O=C(NCc1ccc(-n2ccnc2)nc1)N1OC2CCC1CC2	ZINC000875039033	DE	On-Demand	Anodyne	NAMPT	24	50
C[C@H](NC(=O)C(=O)NCc1cc(F)ccc1F)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875039034	GD	On-Demand	Anodyne	GPR119	30	61
C[C@@H](NC(=O)NC[C@H]1CC(C(F)(F)F)=NO1)c1ccc2c(c1)OCO2	ZINC000875039040	FE	On-Demand	Anodyne	KCNQ2	20	41
C[C@@H](NC(=O)NC[C@@H]1CC(C(F)(F)F)=NO1)c1ccc2c(c1)OCO2	ZINC000875039041	FE	On-Demand	Anodyne	KCNQ2	20	41
C[C@H](NC(=O)NC[C@H]1CC(C(F)(F)F)=NO1)c1ccc2c(c1)OCO2	ZINC000875039043	FE	On-Demand	Anodyne	KCNQ2	20	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1(c2ccccc2)CCC1	ZINC000875039054	EF	On-Demand	Anodyne	SLC6A4	21	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1(c2ccccc2)CCC1	ZINC000875039054	EF	On-Demand	Anodyne	SLC6A3	43	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1(c2ccccc2)CCC1	ZINC000875039054	EF	On-Demand	Anodyne	KCNA3	53	43
CC[C@@H](NC(=O)N1CCC(c2nnnn2C)CC1)c1ccc(Cl)cc1	ZINC000875039059	FF	On-Demand	Anodyne	CACNA1H	28	40
CC[C@@H](NC(=O)N1CCC(c2nnnn2C)CC1)c1ccc(Cl)cc1	ZINC000875039059	FF	On-Demand	Anodyne	IL2RA	51	34
CC[C@@H](NC(=O)N1CCC(c2nnnn2C)CC1)c1ccc(Cl)cc1	ZINC000875039059	FF	On-Demand	Anodyne	CCR1	36	42
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)c1ccc2c(c1)OCO2	ZINC000875039076	GH	On-Demand	Anodyne	KCNQ2	24	46
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)c1ccc2c(c1)OCO2	ZINC000875039079	GH	On-Demand	Anodyne	KCNQ2	24	46
O=C(NCc1ccc(-n2ccnc2)nc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875039091	DE	On-Demand	Anodyne	NOS2	84	33
O=C(NCc1ccc(-n2ccnc2)nc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875039091	DE	On-Demand	Anodyne	NAMPT	20	51
Cc1cccc(CNC(=O)C(=O)N2CCC(N3CCN(C)CC3)CC2)c1	ZINC000875039099	FC	On-Demand	Anodyne	L3MBTL3	75	40
O=C(NCc1ccc(-n2ccnc2)nc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875039100	DE	On-Demand	Anodyne	NOS2	84	33
O=C(NCc1ccc(-n2ccnc2)nc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875039100	DE	On-Demand	Anodyne	NAMPT	20	51
O=C(NCc1ccc(-n2ccnc2)nc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875039102	DE	On-Demand	Anodyne	NOS2	84	33
O=C(NCc1ccc(-n2ccnc2)nc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875039102	DE	On-Demand	Anodyne	NAMPT	20	51
O=C(NCc1ccc(-n2ccnc2)nc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875039104	DE	On-Demand	Anodyne	NOS2	84	33
O=C(NCc1ccc(-n2ccnc2)nc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875039104	DE	On-Demand	Anodyne	NAMPT	20	51
COC(=O)C1(O)CN(C(=O)NCC2(c3ccccc3)CCC2)C1	ZINC000875039108	DD	On-Demand	Anodyne	KCNA3	55	42
O=C(NCc1ccc(-n2ccnc2)nc1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875039123	FF	On-Demand	Anodyne	NOS2	97	38
O=C(NCc1ccc(-n2ccnc2)nc1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875039123	FF	On-Demand	Anodyne	NAMPT	17	48
O=C(NCc1ccc(-n2ccnc2)nc1)NC1([C@H]2CCCCO2)CCC1	ZINC000875039124	FF	On-Demand	Anodyne	NOS2	97	38
O=C(NCc1ccc(-n2ccnc2)nc1)NC1([C@H]2CCCCO2)CCC1	ZINC000875039124	FF	On-Demand	Anodyne	NAMPT	17	48
C[C@@H](NC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccc2c(c1)OCO2	ZINC000875039126	FH	On-Demand	Anodyne	KCNQ2	22	43
C[C@@H](NC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccc2c(c1)OCO2	ZINC000875039128	FH	On-Demand	Anodyne	KCNQ2	22	43
O=C(NCc1ccc(-n2ccnc2)nc1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875039134	GE	On-Demand	Anodyne	NOS2	99	38
O=C(NCc1ccc(-n2ccnc2)nc1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875039134	GE	On-Demand	Anodyne	NAMPT	32	43
NC(=O)[C@@H](c1ccccc1)N1CCN(C(=O)NCCCCC2CC2)CC1	ZINC000875039141	FE	On-Demand	Anodyne	TPSAB1	15	47
NC(=O)[C@H](c1ccccc1)N1CCN(C(=O)NCCCCC2CC2)CC1	ZINC000875039143	FE	On-Demand	Anodyne	TPSAB1	15	47
CCC1(CC)CCCN1C(=O)NC1CCN(S(C)(=O)=O)CC1	ZINC000875039144	ED	On-Demand	Anodyne	EPHX2	17	45
O=C(NCc1ccc(-n2ccnc2)nc1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875039146	FD	On-Demand	Anodyne	NOS2	84	33
Cc1cccc(CNC(=O)C(=O)NCc2ccc(CN3CCNC3=O)cc2)c1	ZINC000875039147	GD	On-Demand	Anodyne	CHRM3	15	45
O=C(NCc1ccc(-n2ccnc2)nc1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875039148	FD	On-Demand	Anodyne	NOS2	84	33
O=C(NCc1ccc(-n2ccnc2)nc1)N1CC(Cc2cccs2)C1	ZINC000875039162	FF	On-Demand	Anodyne	NOS2	100	40
O=C(NCc1ccc(-n2ccnc2)nc1)N1CC(Cc2cccs2)C1	ZINC000875039162	FF	On-Demand	Anodyne	NAMPT	18	47
CC[C@@H](NC(=O)N(CCOC)C1CCOCC1)c1ccc(Cl)cc1	ZINC000875039166	FH	On-Demand	Anodyne	UTS2	48	37
C[C@@H](NC(=O)N1Cc2cccnc2N2CCC[C@H]2C1)c1ccc2c(c1)OCO2	ZINC000875039173	GG	On-Demand	Anodyne	NOS2	54	33
C[C@H](NC(=O)N1Cc2cccnc2N2CCC[C@H]2C1)c1ccc2c(c1)OCO2	ZINC000875039175	GG	On-Demand	Anodyne	NOS2	54	33
CC(=O)C1CCN(C(=O)NCC2(c3ccccc3)CCC2)CC1	ZINC000875039176	DG	On-Demand	Anodyne	KCNA3	52	44
CC(=O)C1CCN(C(=O)NCC2(c3ccccc3)CCC2)CC1	ZINC000875039176	DG	On-Demand	Anodyne	EPHX2	38	40
CC(=O)C1CCN(C(=O)NCC2(c3ccccc3)CCC2)CC1	ZINC000875039176	DG	On-Demand	Anodyne	CACNA1G	15	50
CC(=O)C1CCN(C(=O)NCC2(c3ccccc3)CCC2)CC1	ZINC000875039176	DG	On-Demand	Anodyne	SMO	21	50
CC(=O)C1CCN(C(=O)NCC2(c3ccccc3)CCC2)CC1	ZINC000875039176	DG	On-Demand	Anodyne	HCN1	46	30
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2(c3ccccc3)CCC2)C1	ZINC000875039187	EF	On-Demand	Anodyne	KCNA3	52	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2(c3ccccc3)CCC2)C1	ZINC000875039187	EF	On-Demand	Anodyne	SOAT1	15	44
CC[C@@H](NC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)c1ccc(Cl)cc1	ZINC000875039210	GH	On-Demand	Anodyne	PRCP	20	40
CC[C@@H](NC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)c1ccc(Cl)cc1	ZINC000875039210	GH	On-Demand	Anodyne	ETHR	56	35
CC[C@@H](NC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)c1ccc(Cl)cc1	ZINC000875039212	GH	On-Demand	Anodyne	PRCP	20	40
CC[C@@H](NC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)c1ccc(Cl)cc1	ZINC000875039212	GH	On-Demand	Anodyne	ETHR	56	35
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc2c(c1)OCO2	ZINC000875039220	EE	On-Demand	Anodyne	KCNQ2	22	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc2c(c1)OCO2	ZINC000875039221	EE	On-Demand	Anodyne	KCNQ2	22	42
CC(=O)C1CCN(C(=O)C(=O)NCc2cc(F)ccc2F)CC1	ZINC000875039226	DD	On-Demand	Anodyne	P2RX7	51	40
CC(=O)C1CCN(C(=O)C(=O)NCc2cc(F)ccc2F)CC1	ZINC000875039226	DD	On-Demand	Anodyne	DPP4	21	52
CC(=O)C1CCN(C(=O)C(=O)NCc2cc(F)ccc2F)CC1	ZINC000875039226	DD	On-Demand	Anodyne	EPHX2	22	42
C#CC[C@@H](COC)NC(=O)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875039227	FC	On-Demand	Mild	HTR1D	33	46
C#CC[C@@H](COC)NC(=O)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875039227	FC	On-Demand	Mild	HTR1B	32	43
C#CC[C@@H](COC)NC(=O)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875039227	FC	On-Demand	Mild	NQO2	34	45
C#CC[C@@H](COC)NC(=O)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875039227	FC	On-Demand	Mild	HTR1E	20	40
C#CC[C@@H](COC)NC(=O)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875039227	FC	On-Demand	Mild	MTNR1A	95	61
C#CC[C@@H](COC)NC(=O)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875039227	FC	On-Demand	Mild	MTNR1B	71	60
C#CC[C@@H](COC)NC(=O)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875039227	FC	On-Demand	Mild	ABCG2	26	43
C#CC[C@H](COC)NC(=O)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875039228	FC	On-Demand	Mild	HTR1D	33	46
C#CC[C@H](COC)NC(=O)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875039228	FC	On-Demand	Mild	HTR1B	32	43
C#CC[C@H](COC)NC(=O)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875039228	FC	On-Demand	Mild	NQO2	34	45
C#CC[C@H](COC)NC(=O)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875039228	FC	On-Demand	Mild	HTR1E	20	40
C#CC[C@H](COC)NC(=O)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875039228	FC	On-Demand	Mild	MTNR1A	95	61
C#CC[C@H](COC)NC(=O)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875039228	FC	On-Demand	Mild	MTNR1B	71	60
C#CC[C@H](COC)NC(=O)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875039228	FC	On-Demand	Mild	ABCG2	26	43
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H](C(C)(C)O)C3)c2c1	ZINC000875039247	FD	On-Demand	Anodyne	HTR1A	23	45
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H](C(C)(C)O)C3)c2c1	ZINC000875039247	FD	On-Demand	Anodyne	HTR1D	85	45
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H](C(C)(C)O)C3)c2c1	ZINC000875039247	FD	On-Demand	Anodyne	HTR1B	66	45
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H](C(C)(C)O)C3)c2c1	ZINC000875039247	FD	On-Demand	Anodyne	NQO2	43	58
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H](C(C)(C)O)C3)c2c1	ZINC000875039247	FD	On-Demand	Anodyne	MPO	44	35
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H](C(C)(C)O)C3)c2c1	ZINC000875039247	FD	On-Demand	Anodyne	MTNR1A	99	59
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H](C(C)(C)O)C3)c2c1	ZINC000875039247	FD	On-Demand	Anodyne	MTNR1B	79	58
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H](C(C)(C)O)C3)c2c1	ZINC000875039247	FD	On-Demand	Anodyne	ABCG2	27	44
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H](C(C)(C)O)C3)c2c1	ZINC000875039248	FD	On-Demand	Anodyne	HTR1A	23	45
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H](C(C)(C)O)C3)c2c1	ZINC000875039248	FD	On-Demand	Anodyne	HTR1D	85	45
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H](C(C)(C)O)C3)c2c1	ZINC000875039248	FD	On-Demand	Anodyne	HTR1B	66	45
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H](C(C)(C)O)C3)c2c1	ZINC000875039248	FD	On-Demand	Anodyne	NQO2	43	58
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H](C(C)(C)O)C3)c2c1	ZINC000875039248	FD	On-Demand	Anodyne	MPO	44	35
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H](C(C)(C)O)C3)c2c1	ZINC000875039248	FD	On-Demand	Anodyne	MTNR1A	99	59
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H](C(C)(C)O)C3)c2c1	ZINC000875039248	FD	On-Demand	Anodyne	MTNR1B	79	58
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H](C(C)(C)O)C3)c2c1	ZINC000875039248	FD	On-Demand	Anodyne	ABCG2	27	44
C[C@H](CCc1ccc(O)cc1)NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875039249	EG	On-Demand	Anodyne	YARS	56	34
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875039250	EG	On-Demand	Anodyne	YARS	56	34
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCC[C@H](C(C)=O)C3)c2c1	ZINC000875039264	FD	On-Demand	Anodyne	HTR1A	19	47
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCC[C@H](C(C)=O)C3)c2c1	ZINC000875039264	FD	On-Demand	Anodyne	HTR1D	73	47
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCC[C@H](C(C)=O)C3)c2c1	ZINC000875039264	FD	On-Demand	Anodyne	HTR1B	59	47
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCC[C@H](C(C)=O)C3)c2c1	ZINC000875039264	FD	On-Demand	Anodyne	NQO2	40	59
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCC[C@H](C(C)=O)C3)c2c1	ZINC000875039264	FD	On-Demand	Anodyne	MTNR1A	101	59
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCC[C@H](C(C)=O)C3)c2c1	ZINC000875039264	FD	On-Demand	Anodyne	MTNR1B	81	59
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCC[C@H](C(C)=O)C3)c2c1	ZINC000875039264	FD	On-Demand	Anodyne	ABCG2	25	41
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCC[C@@H](C(C)=O)C3)c2c1	ZINC000875039265	FD	On-Demand	Anodyne	HTR1A	19	47
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCC[C@@H](C(C)=O)C3)c2c1	ZINC000875039265	FD	On-Demand	Anodyne	HTR1D	73	47
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCC[C@@H](C(C)=O)C3)c2c1	ZINC000875039265	FD	On-Demand	Anodyne	HTR1B	59	47
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCC[C@@H](C(C)=O)C3)c2c1	ZINC000875039265	FD	On-Demand	Anodyne	NQO2	40	59
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCC[C@@H](C(C)=O)C3)c2c1	ZINC000875039265	FD	On-Demand	Anodyne	MTNR1A	101	59
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCC[C@@H](C(C)=O)C3)c2c1	ZINC000875039265	FD	On-Demand	Anodyne	MTNR1B	81	59
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CCC[C@@H](C(C)=O)C3)c2c1	ZINC000875039265	FD	On-Demand	Anodyne	ABCG2	25	41
COCC(C)(C)CCNC(=O)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875039269	GE	On-Demand	Anodyne	ACHE	18	44
COCC(C)(C)CCNC(=O)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875039269	GE	On-Demand	Anodyne	HTR1D	38	50
COCC(C)(C)CCNC(=O)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875039269	GE	On-Demand	Anodyne	HTR1B	35	44
COCC(C)(C)CCNC(=O)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875039269	GE	On-Demand	Anodyne	NQO2	45	66
COCC(C)(C)CCNC(=O)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875039269	GE	On-Demand	Anodyne	MPO	58	40
COCC(C)(C)CCNC(=O)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875039269	GE	On-Demand	Anodyne	HTR1E	22	44
COCC(C)(C)CCNC(=O)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875039269	GE	On-Demand	Anodyne	MTNR1A	111	67
COCC(C)(C)CCNC(=O)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875039269	GE	On-Demand	Anodyne	MTNR1B	84	66
COCC(C)(C)CCNC(=O)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875039269	GE	On-Demand	Anodyne	ABCG2	29	48
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875039278	FD	On-Demand	Mild	HTR1D	32	44
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875039278	FD	On-Demand	Mild	NQO2	34	58
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875039278	FD	On-Demand	Mild	MTNR1A	92	59
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875039278	FD	On-Demand	Mild	MTNR1B	69	58
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875039278	FD	On-Demand	Mild	ABCG2	27	44
C#CC[C@H](CCOC)NC(=O)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875039279	FD	On-Demand	Mild	HTR1D	32	44
C#CC[C@H](CCOC)NC(=O)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875039279	FD	On-Demand	Mild	NQO2	34	58
C#CC[C@H](CCOC)NC(=O)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875039279	FD	On-Demand	Mild	MTNR1A	92	59
C#CC[C@H](CCOC)NC(=O)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875039279	FD	On-Demand	Mild	MTNR1B	69	58
C#CC[C@H](CCOC)NC(=O)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875039279	FD	On-Demand	Mild	ABCG2	27	44
C[C@H]1CN(C(=O)N[C@H](C)CCc2ccc(O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000875039292	FG	On-Demand	Anodyne	BIRC2	22	40
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CC[C@@H](C(F)(F)F)O[C@H](C)C1	ZINC000875039293	FG	On-Demand	Anodyne	BIRC2	22	40
C[C@H]1CN(C(=O)N[C@H](C)CCc2ccc(O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000875039294	FG	On-Demand	Anodyne	BIRC2	22	40
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CC[C@H](C(F)(F)F)O[C@H](C)C1	ZINC000875039295	FG	On-Demand	Anodyne	BIRC2	22	40
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@@H](C3CCC3)[C@H]3CCOC3)c2c1	ZINC000875039299	GE	On-Demand	Anodyne	HTR1D	29	41
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@@H](C3CCC3)[C@H]3CCOC3)c2c1	ZINC000875039299	GE	On-Demand	Anodyne	NQO2	33	54
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@@H](C3CCC3)[C@H]3CCOC3)c2c1	ZINC000875039299	GE	On-Demand	Anodyne	MTNR1A	88	55
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@@H](C3CCC3)[C@H]3CCOC3)c2c1	ZINC000875039299	GE	On-Demand	Anodyne	MTNR1B	67	54
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@@H](C3CCC3)[C@H]3CCOC3)c2c1	ZINC000875039299	GE	On-Demand	Anodyne	ABCG2	25	41
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@H](C3CCC3)[C@H]3CCOC3)c2c1	ZINC000875039300	GE	On-Demand	Anodyne	HTR1D	29	41
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@H](C3CCC3)[C@H]3CCOC3)c2c1	ZINC000875039300	GE	On-Demand	Anodyne	NQO2	33	54
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@H](C3CCC3)[C@H]3CCOC3)c2c1	ZINC000875039300	GE	On-Demand	Anodyne	MTNR1A	88	55
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@H](C3CCC3)[C@H]3CCOC3)c2c1	ZINC000875039300	GE	On-Demand	Anodyne	MTNR1B	67	54
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@H](C3CCC3)[C@H]3CCOC3)c2c1	ZINC000875039300	GE	On-Demand	Anodyne	ABCG2	25	41
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@H](C3CCC3)[C@@H]3CCOC3)c2c1	ZINC000875039301	GE	On-Demand	Anodyne	HTR1D	29	41
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@H](C3CCC3)[C@@H]3CCOC3)c2c1	ZINC000875039301	GE	On-Demand	Anodyne	NQO2	33	54
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@H](C3CCC3)[C@@H]3CCOC3)c2c1	ZINC000875039301	GE	On-Demand	Anodyne	MTNR1A	88	55
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@H](C3CCC3)[C@@H]3CCOC3)c2c1	ZINC000875039301	GE	On-Demand	Anodyne	MTNR1B	67	54
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@H](C3CCC3)[C@@H]3CCOC3)c2c1	ZINC000875039301	GE	On-Demand	Anodyne	ABCG2	25	41
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@@H](C3CCC3)[C@@H]3CCOC3)c2c1	ZINC000875039302	GE	On-Demand	Anodyne	HTR1D	29	41
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@@H](C3CCC3)[C@@H]3CCOC3)c2c1	ZINC000875039302	GE	On-Demand	Anodyne	NQO2	33	54
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@@H](C3CCC3)[C@@H]3CCOC3)c2c1	ZINC000875039302	GE	On-Demand	Anodyne	MTNR1A	88	55
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@@H](C3CCC3)[C@@H]3CCOC3)c2c1	ZINC000875039302	GE	On-Demand	Anodyne	MTNR1B	67	54
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@@H](C3CCC3)[C@@H]3CCOC3)c2c1	ZINC000875039302	GE	On-Demand	Anodyne	ABCG2	25	41
O=C(NCC1(c2ccccc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875039313	EG	On-Demand	Anodyne	KCNA3	46	38
C[C@H](CCc1ccc(O)cc1)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875039318	GH	On-Demand	Anodyne	ACE	45	37
C[C@H](CCc1ccc(O)cc1)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875039318	GH	On-Demand	Anodyne	OPRM1	48	43
C[C@H](CCc1ccc(O)cc1)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875039318	GH	On-Demand	Anodyne	OPRK1	22	41
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875039319	GH	On-Demand	Anodyne	ACE	45	37
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875039319	GH	On-Demand	Anodyne	OPRM1	48	43
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875039319	GH	On-Demand	Anodyne	OPRK1	22	41
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039324	GD	On-Demand	Mild	DRD2	27	44
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039324	GD	On-Demand	Mild	DRD4	35	48
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039324	GD	On-Demand	Mild	ACHE	15	40
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039324	GD	On-Demand	Mild	HTR2A	19	48
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039324	GD	On-Demand	Mild	DRD3	21	44
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039324	GD	On-Demand	Mild	SLC6A3	28	41
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039324	GD	On-Demand	Mild	HTR4	32	41
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039324	GD	On-Demand	Mild	LTA4H	18	42
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039324	GD	On-Demand	Mild	SIGMAR1	48	52
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039324	GD	On-Demand	Mild	CCR5	23	41
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039324	GD	On-Demand	Mild	MCHR1	24	43
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039324	GD	On-Demand	Mild	BIRC2	44	44
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039325	GD	On-Demand	Mild	DRD2	27	44
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039325	GD	On-Demand	Mild	DRD4	35	48
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039325	GD	On-Demand	Mild	ACHE	15	40
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039325	GD	On-Demand	Mild	HTR2A	19	48
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039325	GD	On-Demand	Mild	DRD3	21	44
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039325	GD	On-Demand	Mild	SLC6A3	28	41
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039325	GD	On-Demand	Mild	HTR4	32	41
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039325	GD	On-Demand	Mild	LTA4H	18	42
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039325	GD	On-Demand	Mild	SIGMAR1	48	52
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039325	GD	On-Demand	Mild	CCR5	23	41
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039325	GD	On-Demand	Mild	MCHR1	24	43
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039325	GD	On-Demand	Mild	BIRC2	44	44
Cn1nc(Cl)c(C(=O)Nc2ccccc2C(=O)NC2CC2)c1Cl	ZINC000875039330	FF	On-Demand	Anodyne	CNR1	18	40
Cn1nc(Cl)c(C(=O)Nc2ccccc2C(=O)NC2CC2)c1Cl	ZINC000875039330	FF	On-Demand	Anodyne	HTR4	16	41
Cn1nc(Cl)c(C(=O)Nc2ccccc2C(=O)NC2CC2)c1Cl	ZINC000875039330	FF	On-Demand	Anodyne	CNR2	26	40
Cn1nc(Cl)c(C(=O)Nc2ccccc2C(=O)NC2CC2)c1Cl	ZINC000875039330	FF	On-Demand	Anodyne	EPHB3	54	33
Cn1nc(Cl)c(C(=O)Nc2ccccc2C(=O)NC2CC2)c1Cl	ZINC000875039330	FF	On-Demand	Anodyne	G2YM83_BOTF4	62	38
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039344	FC	On-Demand	Mild	DRD2	23	41
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039344	FC	On-Demand	Mild	DRD4	31	46
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039344	FC	On-Demand	Mild	HTR2A	17	46
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039344	FC	On-Demand	Mild	DRD3	15	41
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039344	FC	On-Demand	Mild	SLC6A3	33	42
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039344	FC	On-Demand	Mild	HTR4	26	40
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039344	FC	On-Demand	Mild	LTA4H	18	43
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039344	FC	On-Demand	Mild	SIGMAR1	49	53
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039344	FC	On-Demand	Mild	MCHR1	18	41
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039344	FC	On-Demand	Mild	BIRC2	39	42
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039345	FC	On-Demand	Mild	DRD2	23	41
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039345	FC	On-Demand	Mild	DRD4	31	46
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039345	FC	On-Demand	Mild	HTR2A	17	46
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039345	FC	On-Demand	Mild	DRD3	15	41
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039345	FC	On-Demand	Mild	SLC6A3	33	42
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039345	FC	On-Demand	Mild	HTR4	26	40
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039345	FC	On-Demand	Mild	LTA4H	18	43
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039345	FC	On-Demand	Mild	SIGMAR1	49	53
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039345	FC	On-Demand	Mild	MCHR1	18	41
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039345	FC	On-Demand	Mild	BIRC2	39	42
COC(=O)C1(O)CN(C(=O)N[C@@H](c2ccc(Cl)cc2)C(C)C)C1	ZINC000875039347	ED	On-Demand	Anodyne	CCR1	52	38
COC(=O)C1(O)CN(C(=O)N[C@H](c2ccc(Cl)cc2)C(C)C)C1	ZINC000875039348	ED	On-Demand	Anodyne	CCR1	52	38
O=C(NC1CCN(C2CC2)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875039349	EE	On-Demand	Anodyne	OPRL1	20	40
O=C(NC1CCN(C2CC2)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875039349	EE	On-Demand	Anodyne	EPHX2	23	45
O=C(NC1CCN(C2CC2)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875039349	EE	On-Demand	Anodyne	L3MBTL3	41	35
O=C(NC1CCN(C2CC2)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875039350	EE	On-Demand	Anodyne	OPRL1	20	40
O=C(NC1CCN(C2CC2)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875039350	EE	On-Demand	Anodyne	EPHX2	23	45
O=C(NC1CCN(C2CC2)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875039350	EE	On-Demand	Anodyne	L3MBTL3	41	35
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc2c(c1)OCO2	ZINC000875039352	EE	On-Demand	Anodyne	KCNQ2	22	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc2c(c1)OCO2	ZINC000875039354	EE	On-Demand	Anodyne	KCNQ2	22	42
CCCCCCCNC(=O)C(=O)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875039361	GF	On-Demand	Mild	EPHX2	30	52
CCCCCCCNC(=O)C(=O)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875039361	GF	On-Demand	Mild	SCD1	17	46
CCCCCCCNC(=O)C(=O)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875039361	GF	On-Demand	Mild	ASAH1	86	38
CCCCCCCNC(=O)C(=O)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875039361	GF	On-Demand	Mild	SCD	15	46
O=C(NCc1ccc(-n2ccnc2)nc1)N(C1CC1)C1CC1	ZINC000875039366	CE	On-Demand	Anodyne	NOS2	104	39
O=C(NCc1ccc(-n2ccnc2)nc1)N(C1CC1)C1CC1	ZINC000875039366	CE	On-Demand	Anodyne	NAMPT	23	53
C[C@@H](NC(=O)N(C)CCN1CC2(CCOCC2)C1)c1ccc2c(c1)OCO2	ZINC000875039372	GE	On-Demand	Anodyne	KCNQ2	20	41
COC(=O)[C@@H]1CN(C(=O)NCc2ccc(-n3ccnc3)nc2)C[C@@H](C)O1	ZINC000875039375	FC	On-Demand	Anodyne	NOS2	102	40
COC(=O)[C@@H]1CN(C(=O)NCc2ccc(-n3ccnc3)nc2)C[C@@H](C)O1	ZINC000875039375	FC	On-Demand	Anodyne	NAMPT	19	44
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875039379	ED	On-Demand	Anodyne	NOS2	94	37
Cc1cccc(CNC(=O)C(=O)N2CCn3c(nnc3-c3cn(C)cn3)C2)c1	ZINC000875039381	GC	On-Demand	Anodyne	P2RX7	23	40
CNc1ccc(C(=O)Oc2cc(OC)cc(OC)c2)cc1[N+](=O)[O-]	ZINC000875039382	EF	On-Demand	Bother	TAAR1	23	47
CNc1ccc(C(=O)Oc2cc(OC)cc(OC)c2)cc1[N+](=O)[O-]	ZINC000875039382	EF	On-Demand	Bother	AKR1C2	18	44
C[S@](=N)(=O)N1CCN(C(=O)NCC2(c3ccccc3)CCC2)CC1	ZINC000875039389	FE	On-Demand	Anodyne	KCNA3	46	38
C[S@](=N)(=O)N1CCN(C(=O)NCC2(c3ccccc3)CCC2)CC1	ZINC000875039389	FE	On-Demand	Anodyne	SLC6A9	31	44
COC(=O)[C@@]1(OC)CCN(C(=O)NCc2ccc(-n3ccnc3)nc2)C1	ZINC000875039402	FC	On-Demand	Anodyne	NOS2	92	38
COC(=O)[C@@]1(OC)CCN(C(=O)NCc2ccc(-n3ccnc3)nc2)C1	ZINC000875039402	FC	On-Demand	Anodyne	NAMPT	15	47
O=C(NCc1ccc(-n2ccnc2)nc1)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875039404	FD	On-Demand	Anodyne	NOS2	102	40
O=C(NCc1ccc(-n2ccnc2)nc1)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875039404	FD	On-Demand	Anodyne	NAMPT	21	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccc(C)cc1)C1CC1	ZINC000875039405	EG	On-Demand	Anodyne	SLC6A4	26	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccc(C)cc1)C1CC1	ZINC000875039405	EG	On-Demand	Anodyne	SLC6A3	59	46
O=C(NCc1ccc(-n2ccnc2)nc1)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875039406	FD	On-Demand	Anodyne	NOS2	102	40
O=C(NCc1ccc(-n2ccnc2)nc1)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875039406	FD	On-Demand	Anodyne	NAMPT	21	46
C[C@@H]1CC(C)(C)C[C@](C)(NC(=O)NC2CCN(S(C)(=O)=O)CC2)C1	ZINC000875039408	FE	On-Demand	Anodyne	EPHX2	15	57
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccc(C)cc1)C1CC1	ZINC000875039409	EG	On-Demand	Anodyne	SLC6A4	26	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccc(C)cc1)C1CC1	ZINC000875039409	EG	On-Demand	Anodyne	SLC6A3	59	46
N#CCc1ccsc1C(=O)Nc1ccccc1C(=O)N1CCCCC1	ZINC000875039410	FH	On-Demand	Mild	NPSR1	17	50
C[C@H]1CCC[C@@H](C2CN(C(=O)NCc3ccc(-n4ccnc4)nc3)C2)C1	ZINC000875039411	FG	On-Demand	Anodyne	NOS2	96	36
C[C@H]1CCC[C@@H](C2CN(C(=O)NCc3ccc(-n4ccnc4)nc3)C2)C1	ZINC000875039411	FG	On-Demand	Anodyne	NAMPT	23	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccc(C)cc1)C1CC1	ZINC000875039414	EG	On-Demand	Anodyne	SLC6A4	26	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccc(C)cc1)C1CC1	ZINC000875039414	EG	On-Demand	Anodyne	SLC6A3	59	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccc(C)cc1)C1CC1	ZINC000875039418	EG	On-Demand	Anodyne	SLC6A4	26	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccc(C)cc1)C1CC1	ZINC000875039418	EG	On-Demand	Anodyne	SLC6A3	59	46
O=C(NCc1ccc(-n2ccnc2)nc1)N1O[C@H]2C=C[C@H]1CC2	ZINC000875039425	DD	On-Demand	Anodyne	NOS2	96	36
O=C(NCc1ccc(-n2ccnc2)nc1)N1O[C@H]2C=C[C@H]1CC2	ZINC000875039425	DD	On-Demand	Anodyne	NAMPT	16	46
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875039426	GD	On-Demand	Mild	DRD4	22	41
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875039426	GD	On-Demand	Mild	SLC6A3	22	43
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875039426	GD	On-Demand	Mild	KCNH2	18	43
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875039426	GD	On-Demand	Mild	SIGMAR1	33	50
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875039426	GD	On-Demand	Mild	SSTR5	48	39
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875039426	GD	On-Demand	Mild	CCR3	53	45
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875039426	GD	On-Demand	Mild	MLNR	45	38
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875039426	GD	On-Demand	Mild	MCHR1	46	47
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875039426	GD	On-Demand	Mild	CACNA1G	46	41
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875039430	GD	On-Demand	Mild	DRD4	22	41
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875039430	GD	On-Demand	Mild	SLC6A3	22	43
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875039430	GD	On-Demand	Mild	KCNH2	18	43
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875039430	GD	On-Demand	Mild	SIGMAR1	33	50
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875039430	GD	On-Demand	Mild	SSTR5	48	39
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875039430	GD	On-Demand	Mild	CCR3	53	45
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875039430	GD	On-Demand	Mild	MLNR	45	38
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875039430	GD	On-Demand	Mild	MCHR1	46	47
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875039430	GD	On-Demand	Mild	CACNA1G	46	41
Cc1cccc(CNC(=O)C(=O)N[C@H](C)c2ccc(C(F)(F)F)nc2)c1	ZINC000875039434	FF	On-Demand	Anodyne	TRPV1	55	37
Cc1cccc(CNC(=O)C(=O)N[C@H](C)c2ccc(C(F)(F)F)nc2)c1	ZINC000875039434	FF	On-Demand	Anodyne	CARM1	51	41
Cc1cccc(CNC(=O)C(=O)N[C@@H](C)c2ccc(C(F)(F)F)nc2)c1	ZINC000875039436	FF	On-Demand	Anodyne	TRPV1	55	37
Cc1cccc(CNC(=O)C(=O)N[C@@H](C)c2ccc(C(F)(F)F)nc2)c1	ZINC000875039436	FF	On-Demand	Anodyne	CARM1	51	41
O=C(NCc1ccc(-n2ccnc2)nc1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875039443	GD	On-Demand	Anodyne	NOS2	97	38
O=C(NCc1ccc(-n2ccnc2)nc1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875039443	GD	On-Demand	Anodyne	NAMPT	16	46
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCCC(C)(C)CO)CC2	ZINC000875039445	GE	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCCC(C)(C)CO)CC2	ZINC000875039449	GE	On-Demand	Anodyne	SLC18A2	48	36
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1ccc2c(c1)OCO2	ZINC000875039450	FF	On-Demand	Anodyne	KCNQ2	22	46
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875039457	GD	On-Demand	Anodyne	DRD4	25	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875039457	GD	On-Demand	Anodyne	KCNH2	16	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875039457	GD	On-Demand	Anodyne	HRH3	16	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875039457	GD	On-Demand	Anodyne	SIGMAR1	35	55
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875039457	GD	On-Demand	Anodyne	SSTR5	43	39
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875039457	GD	On-Demand	Anodyne	CCR3	118	47
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875039457	GD	On-Demand	Anodyne	MLNR	84	45
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875039457	GD	On-Demand	Anodyne	MCHR1	50	49
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875039457	GD	On-Demand	Anodyne	CACNA1G	43	52
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875039461	GD	On-Demand	Anodyne	DRD4	25	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875039461	GD	On-Demand	Anodyne	KCNH2	16	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875039461	GD	On-Demand	Anodyne	HRH3	16	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875039461	GD	On-Demand	Anodyne	SIGMAR1	35	55
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875039461	GD	On-Demand	Anodyne	SSTR5	43	39
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875039461	GD	On-Demand	Anodyne	CCR3	118	47
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875039461	GD	On-Demand	Anodyne	MLNR	84	45
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875039461	GD	On-Demand	Anodyne	MCHR1	50	49
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875039461	GD	On-Demand	Anodyne	CACNA1G	43	52
C[C@@H](NC(=O)NCC[C@H](O)C1CCCC1)c1ccc2c(c1)OCO2	ZINC000875039479	EF	On-Demand	Anodyne	KCNQ2	22	44
C[C@@H](NC(=O)NCC[C@@H](O)C1CCCC1)c1ccc2c(c1)OCO2	ZINC000875039480	EF	On-Demand	Anodyne	KCNQ2	22	44
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cc[n+]([O-])cc1	ZINC000875039489	EF	On-Demand	Anodyne	ITK	15	44
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cc[n+]([O-])cc1	ZINC000875039489	EF	On-Demand	Anodyne	SCD1	45	58
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cc[n+]([O-])cc1	ZINC000875039489	EF	On-Demand	Anodyne	SCD	38	58
Cc1ccccc1CN1CCC(NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)CC1	ZINC000875039490	GF	On-Demand	Anodyne	DRD4	21	57
Cc1ccccc1CN1CCC(NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)CC1	ZINC000875039490	GF	On-Demand	Anodyne	SIGMAR1	19	47
Cc1cccc(CNC(=O)C(=O)N(C)C[C@H](C)NC(=O)OC(C)(C)C)c1	ZINC000875039491	FD	On-Demand	Anodyne	FPR1	46	39
N#Cc1cccc([C@H](NC(=O)NC2CCN(C3CC3)CC2)C(F)(F)F)c1	ZINC000875039492	FG	On-Demand	Mild	MCHR1	22	42
Cc1cccc(CNC(=O)C(=O)N(C)C[C@@H](C)NC(=O)OC(C)(C)C)c1	ZINC000875039493	FD	On-Demand	Anodyne	FPR1	46	39
CC(=O)NC[C@@H]1CCCCN1C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875039496	FD	On-Demand	Anodyne	NOS2	102	45
CC(=O)NC[C@@H]1CCCCN1C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875039496	FD	On-Demand	Anodyne	NAMPT	20	47
O=C(COc1ccc2ccc(=O)oc2c1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875039498	II	On-Demand	Anodyne	MAOA	42	39
O=C(COc1ccc2ccc(=O)oc2c1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875039498	II	On-Demand	Anodyne	MAOB	22	40
O=C(COc1ccc2ccc(=O)oc2c1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875039498	II	On-Demand	Anodyne	SCD1	35	45
O=C(COc1ccc2ccc(=O)oc2c1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875039498	II	On-Demand	Anodyne	SCD	30	45
N#Cc1cccc([C@@H](NC(=O)NC2CCN(C3CC3)CC2)C(F)(F)F)c1	ZINC000875039504	FG	On-Demand	Mild	MCHR1	22	42
CN(C)S(=O)(=O)c1ccccc1CNC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875039508	FD	On-Demand	Anodyne	NPY2R	24	41
CN(C)S(=O)(=O)c1ccccc1CNC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875039508	FD	On-Demand	Anodyne	EPHX2	17	42
Cc1cccc(CNC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)c1	ZINC000875039509	GF	On-Demand	Anodyne	ETHR	64	45
CN(C)S(=O)(=O)c1ccccc1CNC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875039510	FD	On-Demand	Anodyne	NPY2R	24	41
CN(C)S(=O)(=O)c1ccccc1CNC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875039510	FD	On-Demand	Anodyne	EPHX2	17	42
CC[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccc(Cl)cc1	ZINC000875039526	GG	On-Demand	Anodyne	CACNA1H	39	43
CC[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccc(Cl)cc1	ZINC000875039526	GG	On-Demand	Anodyne	CCR1	41	38
CC[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccc(Cl)cc1	ZINC000875039526	GG	On-Demand	Anodyne	MAPK1	41	38
CC[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccc(Cl)cc1	ZINC000875039526	GG	On-Demand	Anodyne	L3MBTL3	63	41
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875039529	GE	On-Demand	Anodyne	DRD4	24	46
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875039529	GE	On-Demand	Anodyne	KCNH2	16	42
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875039529	GE	On-Demand	Anodyne	SIGMAR1	39	60
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875039529	GE	On-Demand	Anodyne	SSTR5	43	39
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875039529	GE	On-Demand	Anodyne	CCR3	73	50
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875039529	GE	On-Demand	Anodyne	MLNR	64	43
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875039529	GE	On-Demand	Anodyne	MCHR1	46	50
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875039529	GE	On-Demand	Anodyne	CACNA1G	36	52
CC[C@@H](NC(=O)N(C)CCS(N)(=O)=O)c1ccc(Cl)cc1	ZINC000875039532	ED	On-Demand	Anodyne	UTS2	52	41
O=C(NCc1ccc(-n2ccnc2)nc1)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875039536	ED	On-Demand	Anodyne	NOS2	98	38
O=C(NCc1ccc(-n2ccnc2)nc1)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875039536	ED	On-Demand	Anodyne	NAMPT	34	51
O=CN1CCCN(C(=O)NCC2(c3ccccc3)CCC2)CC1	ZINC000875039545	DD	On-Demand	Anodyne	KCNA3	46	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875039557	FD	On-Demand	Anodyne	NOS2	89	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000875039559	FD	On-Demand	Anodyne	NOS2	89	38
CC[C@@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)c1ccc(Cl)cc1	ZINC000875039577	DH	On-Demand	Anodyne	CACNA1H	30	41
CC[C@@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)c1ccc(Cl)cc1	ZINC000875039577	DH	On-Demand	Anodyne	SLC6A3	15	40
CC[C@@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)c1ccc(Cl)cc1	ZINC000875039577	DH	On-Demand	Anodyne	CCR1	46	38
CC[C@@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)c1ccc(Cl)cc1	ZINC000875039577	DH	On-Demand	Anodyne	DPP7	45	41
CC[C@@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)c1ccc(Cl)cc1	ZINC000875039577	DH	On-Demand	Anodyne	UTS2	43	41
CC[C@@H](NC(=O)N1CCC[C@H](C(C)=O)C1)c1ccc(Cl)cc1	ZINC000875039579	DH	On-Demand	Anodyne	CACNA1H	30	41
CC[C@@H](NC(=O)N1CCC[C@H](C(C)=O)C1)c1ccc(Cl)cc1	ZINC000875039579	DH	On-Demand	Anodyne	SLC6A3	15	40
CC[C@@H](NC(=O)N1CCC[C@H](C(C)=O)C1)c1ccc(Cl)cc1	ZINC000875039579	DH	On-Demand	Anodyne	CCR1	46	38
CC[C@@H](NC(=O)N1CCC[C@H](C(C)=O)C1)c1ccc(Cl)cc1	ZINC000875039579	DH	On-Demand	Anodyne	DPP7	45	41
CC[C@@H](NC(=O)N1CCC[C@H](C(C)=O)C1)c1ccc(Cl)cc1	ZINC000875039579	DH	On-Demand	Anodyne	UTS2	43	41
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@H](c1cccs1)C1CC1	ZINC000875039596	DG	On-Demand	Anodyne	TIMP3	69	38
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@@H](c1cccs1)C1CC1	ZINC000875039600	DG	On-Demand	Anodyne	TIMP3	69	38
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@H](c1ccc(C)cc1)C1CC1	ZINC000875039637	EH	On-Demand	Anodyne	TIMP3	63	31
O=CN1CCCN(C(=O)NC2CCN(CC(=O)Nc3ccccc3)CC2)CC1	ZINC000875039641	GC	On-Demand	Anodyne	DRD4	26	46
O=CN1CCCN(C(=O)NC2CCN(CC(=O)Nc3ccccc3)CC2)CC1	ZINC000875039641	GC	On-Demand	Anodyne	SIGMAR1	16	42
O=CN1CCCN(C(=O)NC2CCN(CC(=O)Nc3ccccc3)CC2)CC1	ZINC000875039641	GC	On-Demand	Anodyne	CCR3	16	46
O=C(NCCCCC1CC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039642	FF	On-Demand	Anodyne	HTR1A	47	45
O=C(NCCCCC1CC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039642	FF	On-Demand	Anodyne	CHRM1	23	41
O=C(NCCCCC1CC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039642	FF	On-Demand	Anodyne	DRD2	68	47
O=C(NCCCCC1CC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039642	FF	On-Demand	Anodyne	DRD4	49	54
O=C(NCCCCC1CC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039642	FF	On-Demand	Anodyne	ACHE	41	43
O=C(NCCCCC1CC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039642	FF	On-Demand	Anodyne	HTR2A	45	54
O=C(NCCCCC1CC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039642	FF	On-Demand	Anodyne	HTR2C	23	46
O=C(NCCCCC1CC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039642	FF	On-Demand	Anodyne	SLC6A4	17	45
O=C(NCCCCC1CC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039642	FF	On-Demand	Anodyne	ADRA1A	23	42
O=C(NCCCCC1CC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039642	FF	On-Demand	Anodyne	HRH1	15	41
O=C(NCCCCC1CC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039642	FF	On-Demand	Anodyne	OPRM1	16	48
O=C(NCCCCC1CC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039642	FF	On-Demand	Anodyne	DRD3	88	47
O=C(NCCCCC1CC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039642	FF	On-Demand	Anodyne	SLC6A3	18	40
O=C(NCCCCC1CC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039642	FF	On-Demand	Anodyne	HTR4	42	42
O=C(NCCCCC1CC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039642	FF	On-Demand	Anodyne	LTA4H	15	41
O=C(NCCCCC1CC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039642	FF	On-Demand	Anodyne	SIGMAR1	66	60
O=C(NCCCCC1CC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039642	FF	On-Demand	Anodyne	CCR3	40	49
O=C(NCCCCC1CC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039642	FF	On-Demand	Anodyne	SCN2A	16	45
O=C(NCCCCC1CC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039642	FF	On-Demand	Anodyne	CACNA1G	27	41
O=C(NCCCCC1CC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039642	FF	On-Demand	Anodyne	CYP2J2	48	34
O=C(NCCCCC1CC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039642	FF	On-Demand	Anodyne	BIRC2	27	41
C[C@H](CCc1ccc(O)cc1)NC(=O)NC1(C)CC(F)(F)C1	ZINC000875039663	DG	On-Demand	Anodyne	GRIA1	44	31
C[C@@H](CCc1ccc(O)cc1)NC(=O)NC1(C)CC(F)(F)C1	ZINC000875039664	DG	On-Demand	Anodyne	GRIA1	44	31
CO[C@H]1C[C@H]2CN(C(=O)NCC3(c4ccccc4)CC3)Cc3cccnc3N2C1	ZINC000875039665	GF	On-Demand	Anodyne	KCNA3	44	38
CO[C@@H]1C[C@@H]2CN(C(=O)NCC3(c4ccccc4)CC3)Cc3cccnc3N2C1	ZINC000875039668	GF	On-Demand	Anodyne	KCNA3	44	38
COc1ccccc1[C@@H]1CSCCCN1C(=O)NC1CCN(C2CC2)CC1	ZINC000875039671	GH	On-Demand	Anodyne	ADRA1D	31	40
COc1ccccc1[C@@H]1CSCCCN1C(=O)NC1CCN(C2CC2)CC1	ZINC000875039671	GH	On-Demand	Anodyne	ADRA1A	23	40
COc1ccccc1[C@@H]1CSCCCN1C(=O)NC1CCN(C2CC2)CC1	ZINC000875039671	GH	On-Demand	Anodyne	ADRA1B	25	40
O=C(NC1CCN(C2CC2)CC1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875039681	FF	On-Demand	Anodyne	L3MBTL3	40	35
O=C(NC1CCN(C2CC2)CC1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875039682	FF	On-Demand	Anodyne	L3MBTL3	40	35
O=C(NC1CCN(C2CC2)CC1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875039683	FF	On-Demand	Anodyne	L3MBTL3	40	35
O=C(NC1CCN(C2CC2)CC1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875039684	FF	On-Demand	Anodyne	L3MBTL3	40	35
O=C(NCCC[C@H]1C=CCC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039696	GF	On-Demand	Anodyne	DRD4	28	50
O=C(NCCC[C@H]1C=CCC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039696	GF	On-Demand	Anodyne	HTR2A	23	50
O=C(NCCC[C@H]1C=CCC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039696	GF	On-Demand	Anodyne	DRD3	42	38
O=C(NCCC[C@H]1C=CCC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039696	GF	On-Demand	Anodyne	SIGMAR1	42	55
O=C(NCCC[C@H]1C=CCC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039696	GF	On-Demand	Anodyne	CCR3	15	41
O=C(NCCC[C@H]1C=CCC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039696	GF	On-Demand	Anodyne	BIRC2	22	40
O=C(NCCC[C@@H]1C=CCC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039697	GF	On-Demand	Anodyne	DRD4	28	50
O=C(NCCC[C@@H]1C=CCC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039697	GF	On-Demand	Anodyne	HTR2A	23	50
O=C(NCCC[C@@H]1C=CCC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039697	GF	On-Demand	Anodyne	DRD3	42	38
O=C(NCCC[C@@H]1C=CCC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039697	GF	On-Demand	Anodyne	SIGMAR1	42	55
O=C(NCCC[C@@H]1C=CCC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039697	GF	On-Demand	Anodyne	CCR3	15	41
O=C(NCCC[C@@H]1C=CCC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039697	GF	On-Demand	Anodyne	BIRC2	22	40
C[C@H](NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1)c1ccnn1C	ZINC000875039700	GD	On-Demand	Anodyne	DRD4	27	41
C[C@H](NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1)c1ccnn1C	ZINC000875039700	GD	On-Demand	Anodyne	KCNH2	21	44
C[C@H](NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1)c1ccnn1C	ZINC000875039700	GD	On-Demand	Anodyne	SIGMAR1	36	53
C[C@H](NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1)c1ccnn1C	ZINC000875039700	GD	On-Demand	Anodyne	SSTR5	58	41
C[C@H](NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1)c1ccnn1C	ZINC000875039700	GD	On-Demand	Anodyne	CCR3	88	45
C[C@H](NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1)c1ccnn1C	ZINC000875039700	GD	On-Demand	Anodyne	MLNR	43	40
C[C@H](NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1)c1ccnn1C	ZINC000875039700	GD	On-Demand	Anodyne	MCHR1	55	47
C[C@H](NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1)c1ccnn1C	ZINC000875039700	GD	On-Demand	Anodyne	CACNA1G	45	43
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875039724	GD	On-Demand	Mild	DRD4	24	52
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875039724	GD	On-Demand	Mild	CCR8	43	31
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875039725	GD	On-Demand	Mild	DRD4	24	52
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875039725	GD	On-Demand	Mild	CCR8	43	31
C[C@H](NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1)c1ccnn1C	ZINC000875039729	GD	On-Demand	Anodyne	DRD4	26	51
C[C@H](NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1)c1ccnn1C	ZINC000875039729	GD	On-Demand	Anodyne	HTR2A	20	51
C[C@H](NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1)c1ccnn1C	ZINC000875039729	GD	On-Demand	Anodyne	HTR4	22	42
C[C@H](NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1)c1ccnn1C	ZINC000875039729	GD	On-Demand	Anodyne	LTA4H	15	41
C[C@H](NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1)c1ccnn1C	ZINC000875039729	GD	On-Demand	Anodyne	SIGMAR1	46	56
C[C@H](NC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1)c1ccnn1C	ZINC000875039729	GD	On-Demand	Anodyne	BIRC2	55	46
CCCCCCCNC(=O)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875039736	FE	On-Demand	Mild	HTR1A	26	40
CCCCCCCNC(=O)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875039736	FE	On-Demand	Mild	CHRM1	15	51
CCCCCCCNC(=O)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875039736	FE	On-Demand	Mild	DRD4	27	57
CCCCCCCNC(=O)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875039736	FE	On-Demand	Mild	HTR2A	15	57
CCCCCCCNC(=O)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875039736	FE	On-Demand	Mild	HTR4	23	42
CCCCCCCNC(=O)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875039736	FE	On-Demand	Mild	CHRM3	15	51
CCCCCCCNC(=O)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875039736	FE	On-Demand	Mild	SIGMAR1	17	53
CCCCCCCNC(=O)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875039736	FE	On-Demand	Mild	SSTR5	55	38
CCCCCCCNC(=O)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875039736	FE	On-Demand	Mild	EPHX2	15	42
CCCCCCCNC(=O)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875039736	FE	On-Demand	Mild	ASAH1	51	32
CN(C)S(=O)(=O)c1ccccc1CNC(=O)N1Cc2cccc(O)c2C1	ZINC000875039739	GD	On-Demand	Clean	NAMPT	16	42
O=C(NCC[C@H]1CCSC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875039740	GE	On-Demand	Anodyne	DRD4	23	42
O=C(NCC[C@H]1CCSC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875039740	GE	On-Demand	Anodyne	ACHE	20	50
O=C(NCC[C@H]1CCSC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875039740	GE	On-Demand	Anodyne	KCNH2	15	41
O=C(NCC[C@H]1CCSC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875039740	GE	On-Demand	Anodyne	SIGMAR1	32	52
O=C(NCC[C@H]1CCSC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875039740	GE	On-Demand	Anodyne	CCR3	58	48
O=C(NCC[C@H]1CCSC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875039740	GE	On-Demand	Anodyne	MCHR1	42	48
O=C(NCC[C@H]1CCSC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875039740	GE	On-Demand	Anodyne	CACNA1G	32	42
O=C(NCC[C@@H]1CCSC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875039741	GE	On-Demand	Anodyne	DRD4	23	42
O=C(NCC[C@@H]1CCSC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875039741	GE	On-Demand	Anodyne	ACHE	20	50
O=C(NCC[C@@H]1CCSC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875039741	GE	On-Demand	Anodyne	KCNH2	15	41
O=C(NCC[C@@H]1CCSC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875039741	GE	On-Demand	Anodyne	SIGMAR1	32	52
O=C(NCC[C@@H]1CCSC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875039741	GE	On-Demand	Anodyne	CCR3	58	48
O=C(NCC[C@@H]1CCSC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875039741	GE	On-Demand	Anodyne	MCHR1	42	48
O=C(NCC[C@@H]1CCSC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875039741	GE	On-Demand	Anodyne	CACNA1G	32	42
Cc1ccccc1CN1CCC(NC(=O)C(=O)N[C@@H]2CC23CCC3)CC1	ZINC000875039750	FE	On-Demand	Anodyne	DRD4	21	55
Cc1ccccc1CN1CCC(NC(=O)C(=O)N[C@@H]2CC23CCC3)CC1	ZINC000875039750	FE	On-Demand	Anodyne	SIGMAR1	21	44
Cc1ccccc1CN1CCC(NC(=O)C(=O)N[C@H]2CC23CCC3)CC1	ZINC000875039753	FE	On-Demand	Anodyne	DRD4	21	55
Cc1ccccc1CN1CCC(NC(=O)C(=O)N[C@H]2CC23CCC3)CC1	ZINC000875039753	FE	On-Demand	Anodyne	SIGMAR1	21	44
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@@H](c1ccc(C)cc1)C1CC1	ZINC000875039763	EH	On-Demand	Anodyne	TIMP3	63	31
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	ZINC000875039820	JG	On-Demand	Anodyne	MERTK	29	40
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	ZINC000875039820	JG	On-Demand	Anodyne	SCD1	37	44
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	ZINC000875039820	JG	On-Demand	Anodyne	SCD	30	44
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	ZINC000875039820	JG	On-Demand	Anodyne	NAMPT	32	40
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NCc2cc(F)ccc2F)CC1	ZINC000875039823	FC	On-Demand	Anodyne	DPP4	17	43
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)C(O)(c1ccccc1)c1ccccc1	ZINC000875039825	IJ	On-Demand	Anodyne	CDK5	22	44
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)C(O)(c1ccccc1)c1ccccc1	ZINC000875039825	IJ	On-Demand	Anodyne	SCD1	40	49
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)C(O)(c1ccccc1)c1ccccc1	ZINC000875039825	IJ	On-Demand	Anodyne	SCD	36	49
C[C@H](CCc1ccc(O)cc1)NC(=O)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875039844	GG	On-Demand	Anodyne	BIRC2	42	40
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875039847	GG	On-Demand	Anodyne	BIRC2	42	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2nc3ccccc3n2C(F)F)C1	ZINC000875039856	GG	On-Demand	Anodyne	P2RY12	44	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2nc3ccccc3n2C(F)F)C1	ZINC000875039856	GG	On-Demand	Anodyne	PDE6D	81	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2nc3ccccc3n2C(F)F)C1	ZINC000875039859	GG	On-Demand	Anodyne	P2RY12	44	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2nc3ccccc3n2C(F)F)C1	ZINC000875039859	GG	On-Demand	Anodyne	PDE6D	81	36
Cc1cccc(CNC(=O)C(=O)N[C@H](C)c2ccnn2C)c1	ZINC000875039871	DD	On-Demand	Anodyne	CTSV	40	39
Cc1cccc(CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)c1	ZINC000875039873	DD	On-Demand	Anodyne	CTSV	40	39
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cc(Cl)nc(Cl)c1	ZINC000875039874	HJ	On-Demand	Anodyne	SCD1	47	57
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cc(Cl)nc(Cl)c1	ZINC000875039874	HJ	On-Demand	Anodyne	SCD	38	57
COC(=O)[C@@]12C[C@@H](NC(=O)NCC3(c4ccccc4)CC3)C[C@@H]1C2	ZINC000875039876	EE	On-Demand	Anodyne	KCNA3	55	46
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)CCc2ccc(O)cc2)C1	ZINC000875039884	EF	On-Demand	Anodyne	ACE	38	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)CCc2ccc(O)cc2)C1	ZINC000875039884	EF	On-Demand	Anodyne	GRIA1	46	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)CCc2ccc(O)cc2)C1	ZINC000875039884	EF	On-Demand	Anodyne	YARS	62	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)CCc2ccc(O)cc2)C1	ZINC000875039886	EF	On-Demand	Anodyne	ACE	38	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)CCc2ccc(O)cc2)C1	ZINC000875039886	EF	On-Demand	Anodyne	GRIA1	46	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)CCc2ccc(O)cc2)C1	ZINC000875039886	EF	On-Demand	Anodyne	YARS	62	42
O=C(NCC1(c2ccccc2)CCC1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875039890	FE	On-Demand	Anodyne	KCNA3	43	36
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H]4[C@H](CCN4C)C3)c2c1	ZINC000875039897	GD	On-Demand	Anodyne	HTR1A	21	46
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H]4[C@H](CCN4C)C3)c2c1	ZINC000875039897	GD	On-Demand	Anodyne	HTR1D	84	46
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H]4[C@H](CCN4C)C3)c2c1	ZINC000875039897	GD	On-Demand	Anodyne	HTR1B	71	46
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H]4[C@H](CCN4C)C3)c2c1	ZINC000875039897	GD	On-Demand	Anodyne	NQO2	30	55
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H]4[C@H](CCN4C)C3)c2c1	ZINC000875039897	GD	On-Demand	Anodyne	MTNR1A	76	56
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H]4[C@H](CCN4C)C3)c2c1	ZINC000875039897	GD	On-Demand	Anodyne	MTNR1B	59	55
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H]4[C@H](CCN4C)C3)c2c1	ZINC000875039897	GD	On-Demand	Anodyne	ABCG2	25	42
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H]4[C@H](CCN4C)C3)c2c1	ZINC000875039899	GD	On-Demand	Anodyne	HTR1A	21	46
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H]4[C@H](CCN4C)C3)c2c1	ZINC000875039899	GD	On-Demand	Anodyne	HTR1D	84	46
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H]4[C@H](CCN4C)C3)c2c1	ZINC000875039899	GD	On-Demand	Anodyne	HTR1B	71	46
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H]4[C@H](CCN4C)C3)c2c1	ZINC000875039899	GD	On-Demand	Anodyne	NQO2	30	55
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H]4[C@H](CCN4C)C3)c2c1	ZINC000875039899	GD	On-Demand	Anodyne	MTNR1A	76	56
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H]4[C@H](CCN4C)C3)c2c1	ZINC000875039899	GD	On-Demand	Anodyne	MTNR1B	59	55
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H]4[C@H](CCN4C)C3)c2c1	ZINC000875039899	GD	On-Demand	Anodyne	ABCG2	25	42
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H]4[C@@H](CCN4C)C3)c2c1	ZINC000875039900	GD	On-Demand	Anodyne	HTR1A	21	46
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H]4[C@@H](CCN4C)C3)c2c1	ZINC000875039900	GD	On-Demand	Anodyne	HTR1D	84	46
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H]4[C@@H](CCN4C)C3)c2c1	ZINC000875039900	GD	On-Demand	Anodyne	HTR1B	71	46
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H]4[C@@H](CCN4C)C3)c2c1	ZINC000875039900	GD	On-Demand	Anodyne	NQO2	30	55
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H]4[C@@H](CCN4C)C3)c2c1	ZINC000875039900	GD	On-Demand	Anodyne	MTNR1A	76	56
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H]4[C@@H](CCN4C)C3)c2c1	ZINC000875039900	GD	On-Demand	Anodyne	MTNR1B	59	55
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@@H]4[C@@H](CCN4C)C3)c2c1	ZINC000875039900	GD	On-Demand	Anodyne	ABCG2	25	42
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H]4[C@@H](CCN4C)C3)c2c1	ZINC000875039901	GD	On-Demand	Anodyne	HTR1A	21	46
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H]4[C@@H](CCN4C)C3)c2c1	ZINC000875039901	GD	On-Demand	Anodyne	HTR1D	84	46
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H]4[C@@H](CCN4C)C3)c2c1	ZINC000875039901	GD	On-Demand	Anodyne	HTR1B	71	46
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H]4[C@@H](CCN4C)C3)c2c1	ZINC000875039901	GD	On-Demand	Anodyne	NQO2	30	55
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H]4[C@@H](CCN4C)C3)c2c1	ZINC000875039901	GD	On-Demand	Anodyne	MTNR1A	76	56
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H]4[C@@H](CCN4C)C3)c2c1	ZINC000875039901	GD	On-Demand	Anodyne	MTNR1B	59	55
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3CC[C@H]4[C@@H](CCN4C)C3)c2c1	ZINC000875039901	GD	On-Demand	Anodyne	ABCG2	25	42
Cc1cccc(CNC(=O)C(=O)N2CCN([S@@](C)(=N)=O)CC2)c1	ZINC000875039909	EC	On-Demand	Anodyne	FBP1	15	42
Cc1cccc(CNC(=O)C(=O)N2CCN([S@](C)(=N)=O)CC2)c1	ZINC000875039911	EC	On-Demand	Anodyne	FBP1	15	42
CN(C)C[C@@H]1CN(C(=O)NCC2(c3ccccc3)CCC2)C[C@H]1CN(C)C	ZINC000875039913	FE	On-Demand	Anodyne	KCNA3	49	38
C[C@@H]1CC(=O)N[C@H](C(=O)Nc2ccc(S(=O)(=O)N3CCC[C@@H](C)C3)cc2)C1	ZINC000875039938	GD	On-Demand	Anodyne	TGM2	58	42
C[C@@H]1CC(=O)N[C@H](C(=O)Nc2ccc(S(=O)(=O)N3CCC[C@@H](C)C3)cc2)C1	ZINC000875039938	GD	On-Demand	Anodyne	F13A1	81	42
C[C@@H]1CC(=O)N[C@H](C(=O)Nc2ccc(S(=O)(=O)N3CCC[C@@H](C)C3)cc2)C1	ZINC000875039938	GD	On-Demand	Anodyne	NAMPT	32	51
C[C@@H]1CC(=O)N[C@H](C(=O)Nc2ccc(S(=O)(=O)N3CCC[C@H](C)C3)cc2)C1	ZINC000875039939	GD	On-Demand	Anodyne	TGM2	58	42
C[C@@H]1CC(=O)N[C@H](C(=O)Nc2ccc(S(=O)(=O)N3CCC[C@H](C)C3)cc2)C1	ZINC000875039939	GD	On-Demand	Anodyne	F13A1	81	42
C[C@@H]1CC(=O)N[C@H](C(=O)Nc2ccc(S(=O)(=O)N3CCC[C@H](C)C3)cc2)C1	ZINC000875039939	GD	On-Demand	Anodyne	NAMPT	32	51
O=C(NC1CCN(Cc2ccccn2)CC1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875039947	GD	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NC1CCN(Cc2ccccn2)CC1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875039948	GD	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NC1CCN(Cc2ccccn2)CC1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875039949	GD	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NC1CCN(Cc2ccccn2)CC1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875039950	GD	On-Demand	Anodyne	SIGMAR1	15	40
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)CC1	ZINC000875039960	GD	On-Demand	Anodyne	CHRM1	21	42
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)CC1	ZINC000875039960	GD	On-Demand	Anodyne	DRD2	22	42
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)CC1	ZINC000875039960	GD	On-Demand	Anodyne	DRD4	29	53
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)CC1	ZINC000875039960	GD	On-Demand	Anodyne	HTR2A	22	53
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)CC1	ZINC000875039960	GD	On-Demand	Anodyne	OPRM1	16	45
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)CC1	ZINC000875039960	GD	On-Demand	Anodyne	DRD3	15	42
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)CC1	ZINC000875039960	GD	On-Demand	Anodyne	HTR4	39	41
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)CC1	ZINC000875039960	GD	On-Demand	Anodyne	GRIN2B	43	36
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)CC1	ZINC000875039960	GD	On-Demand	Anodyne	LTA4H	15	46
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)CC1	ZINC000875039960	GD	On-Demand	Anodyne	SIGMAR1	56	65
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)CC1	ZINC000875039960	GD	On-Demand	Anodyne	CCR3	25	40
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)CC1	ZINC000875039960	GD	On-Demand	Anodyne	CCR5	30	42
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)CC1	ZINC000875039960	GD	On-Demand	Anodyne	MCHR1	24	40
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)CC1	ZINC000875039960	GD	On-Demand	Anodyne	CACNA1G	28	44
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)CC1	ZINC000875039960	GD	On-Demand	Anodyne	BIRC2	38	43
O=C(NC1CCN(CCc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875039961	FD	On-Demand	Anodyne	CHRM1	17	40
O=C(NC1CCN(CCc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875039961	FD	On-Demand	Anodyne	DRD2	22	44
O=C(NC1CCN(CCc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875039961	FD	On-Demand	Anodyne	DRD4	25	53
O=C(NC1CCN(CCc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875039961	FD	On-Demand	Anodyne	HTR2A	19	53
O=C(NC1CCN(CCc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875039961	FD	On-Demand	Anodyne	OPRM1	22	42
O=C(NC1CCN(CCc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875039961	FD	On-Demand	Anodyne	OPRD1	15	42
O=C(NC1CCN(CCc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875039961	FD	On-Demand	Anodyne	CHRM3	22	40
O=C(NC1CCN(CCc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875039961	FD	On-Demand	Anodyne	LTA4H	15	41
O=C(NC1CCN(CCc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875039961	FD	On-Demand	Anodyne	SIGMAR1	66	61
O=C(NC1CCN(CCc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875039961	FD	On-Demand	Anodyne	CACNA1G	19	41
O=C(NC1CCN(CCc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875039961	FD	On-Demand	Anodyne	BIRC2	32	43
O=C(NC1CCN(CCc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875039962	FD	On-Demand	Anodyne	CHRM1	17	40
O=C(NC1CCN(CCc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875039962	FD	On-Demand	Anodyne	DRD2	22	44
O=C(NC1CCN(CCc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875039962	FD	On-Demand	Anodyne	DRD4	25	53
O=C(NC1CCN(CCc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875039962	FD	On-Demand	Anodyne	HTR2A	19	53
O=C(NC1CCN(CCc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875039962	FD	On-Demand	Anodyne	OPRM1	22	42
O=C(NC1CCN(CCc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875039962	FD	On-Demand	Anodyne	OPRD1	15	42
O=C(NC1CCN(CCc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875039962	FD	On-Demand	Anodyne	CHRM3	22	40
O=C(NC1CCN(CCc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875039962	FD	On-Demand	Anodyne	LTA4H	15	41
O=C(NC1CCN(CCc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875039962	FD	On-Demand	Anodyne	SIGMAR1	66	61
O=C(NC1CCN(CCc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875039962	FD	On-Demand	Anodyne	CACNA1G	19	41
O=C(NC1CCN(CCc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875039962	FD	On-Demand	Anodyne	BIRC2	32	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccccc3C)CC2)C1	ZINC000875039963	GD	On-Demand	Anodyne	DRD4	19	52
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccccc3C)CC2)C1	ZINC000875039963	GD	On-Demand	Anodyne	SLC6A1	66	36
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccccc3C)CC2)C1	ZINC000875039963	GD	On-Demand	Anodyne	SIGMAR1	20	44
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccccc3C)CC2)C1	ZINC000875039963	GD	On-Demand	Anodyne	CCR8	44	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccccc3C)CC2)C1	ZINC000875039964	GD	On-Demand	Anodyne	DRD4	19	52
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccccc3C)CC2)C1	ZINC000875039964	GD	On-Demand	Anodyne	SLC6A1	66	36
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccccc3C)CC2)C1	ZINC000875039964	GD	On-Demand	Anodyne	SIGMAR1	20	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccccc3C)CC2)C1	ZINC000875039964	GD	On-Demand	Anodyne	CCR8	44	33
CC[C@]1(C(=O)Nc2ccc(S(=O)(=O)N3CCC[C@@H](C)C3)cc2)CCNC1=O	ZINC000875039980	GD	On-Demand	Anodyne	TGM2	40	34
CC[C@]1(C(=O)Nc2ccc(S(=O)(=O)N3CCC[C@@H](C)C3)cc2)CCNC1=O	ZINC000875039980	GD	On-Demand	Anodyne	F13A1	60	37
CC[C@]1(C(=O)Nc2ccc(S(=O)(=O)N3CCC[C@@H](C)C3)cc2)CCNC1=O	ZINC000875039980	GD	On-Demand	Anodyne	NAMPT	34	53
CC[C@]1(C(=O)Nc2ccc(S(=O)(=O)N3CCC[C@H](C)C3)cc2)CCNC1=O	ZINC000875039981	GD	On-Demand	Anodyne	TGM2	40	34
CC[C@]1(C(=O)Nc2ccc(S(=O)(=O)N3CCC[C@H](C)C3)cc2)CCNC1=O	ZINC000875039981	GD	On-Demand	Anodyne	F13A1	60	37
CC[C@]1(C(=O)Nc2ccc(S(=O)(=O)N3CCC[C@H](C)C3)cc2)CCNC1=O	ZINC000875039981	GD	On-Demand	Anodyne	NAMPT	34	53
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875039982	FD	On-Demand	Mild	DRD4	16	50
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875039982	FD	On-Demand	Mild	SIGMAR1	17	42
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875039983	FD	On-Demand	Mild	DRD4	16	50
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875039983	FD	On-Demand	Mild	SIGMAR1	17	42
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(Cc3ccccc3C)CC2)CC1	ZINC000875039984	GD	On-Demand	Anodyne	DRD4	21	56
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(Cc3ccccc3C)CC2)CC1	ZINC000875039984	GD	On-Demand	Anodyne	SIGMAR1	22	47
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(Cc3ccccc3C)CC2)CC1	ZINC000875039984	GD	On-Demand	Anodyne	CCR8	64	35
O=C(NC1CCN(Cc2ccccn2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875039987	ED	On-Demand	Anodyne	SIGMAR1	16	42
O=C(NC1CCN(Cc2ccccn2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875039988	ED	On-Demand	Anodyne	SIGMAR1	16	42
O=C(NCc1ccccc1S(=O)(=O)N1CCCCC1)NC[C@H]1C[C@H](O)C1	ZINC000875039989	GD	On-Demand	Anodyne	LPL	45	37
O=C(NCc1ccccc1S(=O)(=O)N1CCCCC1)NC[C@H]1C[C@H](O)C1	ZINC000875039989	GD	On-Demand	Anodyne	EPHX2	23	42
O=C(NCc1ccccc1S(=O)(=O)N1CCCCC1)NC[C@H]1C[C@H](O)C1	ZINC000875039989	GD	On-Demand	Anodyne	NAMPT	26	47
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039996	GD	On-Demand	Anodyne	HTR1A	34	41
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039996	GD	On-Demand	Anodyne	DRD2	47	44
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039996	GD	On-Demand	Anodyne	DRD4	48	50
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039996	GD	On-Demand	Anodyne	ACHE	31	42
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039996	GD	On-Demand	Anodyne	HTR2A	30	50
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039996	GD	On-Demand	Anodyne	OPRM1	16	43
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039996	GD	On-Demand	Anodyne	DRD3	55	43
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039996	GD	On-Demand	Anodyne	HTR4	45	41
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039996	GD	On-Demand	Anodyne	LTA4H	20	42
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039996	GD	On-Demand	Anodyne	SIGMAR1	56	55
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039996	GD	On-Demand	Anodyne	MCHR1	30	45
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039996	GD	On-Demand	Anodyne	CACNA1G	37	40
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039996	GD	On-Demand	Anodyne	CYP2J2	44	32
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875039996	GD	On-Demand	Anodyne	BIRC2	31	40
O=C(CN1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)CC1)Nc1ccccc1	ZINC000875040008	GE	On-Demand	Anodyne	DRD4	25	53
O=C(CN1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)CC1)Nc1ccccc1	ZINC000875040008	GE	On-Demand	Anodyne	SIGMAR1	15	44
O=C(CN1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)CC1)Nc1ccccc1	ZINC000875040008	GE	On-Demand	Anodyne	EPHX2	30	41
O=C(CN1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)CC1)Nc1ccccc1	ZINC000875040009	GE	On-Demand	Anodyne	DRD4	25	53
O=C(CN1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)CC1)Nc1ccccc1	ZINC000875040009	GE	On-Demand	Anodyne	SIGMAR1	15	44
O=C(CN1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)CC1)Nc1ccccc1	ZINC000875040009	GE	On-Demand	Anodyne	EPHX2	30	41
O=C(CN1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)CC1)Nc1ccccc1	ZINC000875040010	GE	On-Demand	Anodyne	DRD4	25	53
O=C(CN1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)CC1)Nc1ccccc1	ZINC000875040010	GE	On-Demand	Anodyne	SIGMAR1	15	44
O=C(CN1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)CC1)Nc1ccccc1	ZINC000875040010	GE	On-Demand	Anodyne	EPHX2	30	41
O=C(CN1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)CC1)Nc1ccccc1	ZINC000875040011	GE	On-Demand	Anodyne	DRD4	25	53
O=C(CN1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)CC1)Nc1ccccc1	ZINC000875040011	GE	On-Demand	Anodyne	SIGMAR1	15	44
O=C(CN1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)CC1)Nc1ccccc1	ZINC000875040011	GE	On-Demand	Anodyne	EPHX2	30	41
O=C(NC1CCN(C2CC2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875040012	EF	On-Demand	Anodyne	LTA4H	18	45
O=C(NC1CCN(C2CC2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875040012	EF	On-Demand	Anodyne	SIGMAR1	17	41
O=C(NC1CCN(C2CC2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875040012	EF	On-Demand	Anodyne	EPHX2	42	44
O=C(NC1CCN(C2CC2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875040012	EF	On-Demand	Anodyne	L3MBTL3	42	36
CC(C)n1ncc(C(=O)Nc2ccc3c(c2)C(=O)N(C)C3=O)c1Br	ZINC000875040013	GF	On-Demand	Anodyne	HTR2A	15	42
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)C1=NN(c2ccccc2)C(=O)CC1	ZINC000875040030	II	On-Demand	Anodyne	SCD1	37	46
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)C1=NN(c2ccccc2)C(=O)CC1	ZINC000875040030	II	On-Demand	Anodyne	SCD	31	46
C[C@@H](NC(=O)N1CCN([C@H](C(N)=O)c2ccccc2)CC1)c1ccns1	ZINC000875040047	FD	On-Demand	Anodyne	PTAFR	24	42
C[C@@H](NC(=O)N1CCN([C@@H](C(N)=O)c2ccccc2)CC1)c1ccns1	ZINC000875040048	FD	On-Demand	Anodyne	PTAFR	24	42
Cc1cccc(CNC(=O)C(=O)NC2CCN(CC(=O)OC(C)(C)C)CC2)c1	ZINC000875040060	GD	On-Demand	Anodyne	DRD4	34	48
Cc1cccc(CNC(=O)C(=O)NC2CCN(CC(=O)OC(C)(C)C)CC2)c1	ZINC000875040060	GD	On-Demand	Anodyne	CHRM3	15	45
O=C(NCC1(c2ccccc2)CCC1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875040071	FE	On-Demand	Anodyne	KCNA3	47	37
O=C(NCC1(c2ccccc2)CCC1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875040072	FE	On-Demand	Anodyne	KCNA3	47	37
O=C(NCC1(c2ccccc2)CCC1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875040073	FE	On-Demand	Anodyne	KCNA3	47	37
O=C(NCC1(c2ccccc2)CCC1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875040074	FE	On-Demand	Anodyne	KCNA3	47	37
CC[C@@H](NC(=O)NCc1ccc(OC)nc1)[C@H](O)c1ccccc1	ZINC000875040089	EE	On-Demand	Anodyne	PDS	43	34
CC[C@@H](NC(=O)NCc1ccc(OC)nc1)[C@@H](O)c1ccccc1	ZINC000875040091	EE	On-Demand	Anodyne	PDS	43	34
CCC1(CC)CCCN1C(=O)NCc1ccc(OC)nc1	ZINC000875040092	CF	On-Demand	Anodyne	SLC12A5	44	34
CCC1(CC)CCCN1C(=O)NCc1ccc(OC)nc1	ZINC000875040092	CF	On-Demand	Anodyne	NAMPT	16	44
CN1CC[C@H]2CN(C(=O)C(=O)NCc3cc(F)ccc3F)CC[C@@H]21	ZINC000875040098	ED	On-Demand	Anodyne	P2RX7	46	37
CN1CC[C@H]2CN(C(=O)C(=O)NCc3cc(F)ccc3F)CC[C@@H]21	ZINC000875040098	ED	On-Demand	Anodyne	DPP4	16	47
CN1CC[C@H]2CN(C(=O)C(=O)NCc3cc(F)ccc3F)CC[C@H]21	ZINC000875040100	ED	On-Demand	Anodyne	P2RX7	46	37
CN1CC[C@H]2CN(C(=O)C(=O)NCc3cc(F)ccc3F)CC[C@H]21	ZINC000875040100	ED	On-Demand	Anodyne	DPP4	16	47
C[C@@H](CCc1ccc(O)cc1)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875040116	ED	On-Demand	Anodyne	BIRC2	53	51
C[C@H](CCc1ccc(O)cc1)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875040117	ED	On-Demand	Anodyne	BIRC2	53	51
Cc1nnc(NNC(=O)NCC2(c3ccccc3)CC2)n1C	ZINC000875040129	DD	On-Demand	Reactive	KCNA3	51	41
Cc1nnc(NNC(=O)NCC2(c3ccccc3)CC2)n1C	ZINC000875040129	DD	On-Demand	Reactive	SOAT1	15	43
CCCCCCCCCCNC(=O)C(=O)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875040134	EF	On-Demand	Mild	ASAH1	63	33
CCCCCCCCCCNC(=O)C(=O)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875040135	EF	On-Demand	Mild	ASAH1	63	33
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cc2c(s1)CCC2	ZINC000875040142	GJ	On-Demand	Anodyne	SCD1	38	49
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cc2c(s1)CCC2	ZINC000875040142	GJ	On-Demand	Anodyne	SCD	33	49
COC(=O)[C@@]12C[C@@H](NC(=O)NCC3(c4ccccc4)CCC3)C[C@@H]1C2	ZINC000875040143	EF	On-Demand	Anodyne	KCNA3	54	45
Cc1cccc(CNC(=O)C(=O)N[C@@H]2CC[C@@H](NC(=O)OC(C)(C)C)CC2)c1	ZINC000875040144	GF	On-Demand	Anodyne	FAAH	21	47
Cc1nnc(NNC(=O)NCC2(c3ccccc3)CCC2)n1C	ZINC000875040154	DD	On-Demand	Reactive	KCNA3	49	39
O=C1OC[C@H]2CN(C(=O)NCC3(c4ccccc4)CCC3)C[C@@H]12	ZINC000875040157	DD	On-Demand	Anodyne	KCNA3	41	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1nc2ccccc2n1C(F)F	ZINC000875040166	GG	On-Demand	Anodyne	SLC6A4	26	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1nc2ccccc2n1C(F)F	ZINC000875040166	GG	On-Demand	Anodyne	SLC6A3	54	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1nc2ccccc2n1C(F)F	ZINC000875040168	GG	On-Demand	Anodyne	SLC6A4	26	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1nc2ccccc2n1C(F)F	ZINC000875040168	GG	On-Demand	Anodyne	SLC6A3	54	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1nc2ccccc2n1C(F)F	ZINC000875040169	GG	On-Demand	Anodyne	SLC6A4	26	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1nc2ccccc2n1C(F)F	ZINC000875040169	GG	On-Demand	Anodyne	SLC6A3	54	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1nc2ccccc2n1C(F)F	ZINC000875040170	GG	On-Demand	Anodyne	SLC6A4	26	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1nc2ccccc2n1C(F)F	ZINC000875040170	GG	On-Demand	Anodyne	SLC6A3	54	45
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875040188	DF	On-Demand	Anodyne	ACE	18	41
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875040188	DF	On-Demand	Anodyne	BIRC2	41	46
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875040189	DF	On-Demand	Anodyne	ACE	18	41
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875040189	DF	On-Demand	Anodyne	BIRC2	41	46
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875040190	DF	On-Demand	Anodyne	ACE	18	41
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875040190	DF	On-Demand	Anodyne	BIRC2	41	46
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875040191	DF	On-Demand	Anodyne	ACE	18	41
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875040191	DF	On-Demand	Anodyne	BIRC2	41	46
O=C(NCCCn1cccn1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875040198	FD	On-Demand	Anodyne	C3AR1	38	40
O=C(NCCCn1cccn1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875040199	FD	On-Demand	Anodyne	C3AR1	38	40
COCCN(CC1CCN(C)CC1)C(=O)NCC1(c2ccccc2)CC1	ZINC000875040206	FF	On-Demand	Anodyne	KCNA3	54	42
O=C(NCCCn1cccn1)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875040207	GD	On-Demand	Anodyne	NPY2R	46	33
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCc1cc(F)ccc1F	ZINC000875040217	FD	On-Demand	Anodyne	P2RX7	51	40
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCc1cc(F)ccc1F	ZINC000875040218	FD	On-Demand	Anodyne	P2RX7	51	40
O=C(NCc1nnc2n1CCC2)NNc1ccc(OCc2ccccc2)cc1	ZINC000875040220	GF	On-Demand	Reactive	LTA4H	30	42
O=C(NCc1nnc2n1CCC2)NNc1ccc(OCc2ccccc2)cc1	ZINC000875040220	GF	On-Demand	Reactive	ADAM17	23	41
CONC(=O)C1CCN(C(=O)NCC2(c3ccccc3)CCC2)CC1	ZINC000875040249	EE	On-Demand	Anodyne	KCNA3	55	42
CONC(=O)C1CCN(C(=O)NCC2(c3ccccc3)CCC2)CC1	ZINC000875040249	EE	On-Demand	Anodyne	CACNA1G	26	51
CONC(=O)C1CCN(C(=O)NCC2(c3ccccc3)CCC2)CC1	ZINC000875040249	EE	On-Demand	Anodyne	SMO	19	47
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040259	GD	On-Demand	Anodyne	CHRM1	20	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040259	GD	On-Demand	Anodyne	DRD2	21	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040259	GD	On-Demand	Anodyne	DRD4	28	49
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040259	GD	On-Demand	Anodyne	HTR2A	19	49
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040259	GD	On-Demand	Anodyne	SLC6A1	91	36
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040259	GD	On-Demand	Anodyne	OPRM1	16	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040259	GD	On-Demand	Anodyne	LTA4H	16	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040259	GD	On-Demand	Anodyne	HRH3	18	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040259	GD	On-Demand	Anodyne	SIGMAR1	48	60
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040259	GD	On-Demand	Anodyne	CCR5	41	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040259	GD	On-Demand	Anodyne	EPHX2	18	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040259	GD	On-Demand	Anodyne	DPP7	19	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040259	GD	On-Demand	Anodyne	MCHR1	18	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040259	GD	On-Demand	Anodyne	CACNA1G	27	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040259	GD	On-Demand	Anodyne	BIRC2	54	47
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040260	GD	On-Demand	Anodyne	CHRM1	20	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040260	GD	On-Demand	Anodyne	DRD2	21	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040260	GD	On-Demand	Anodyne	DRD4	28	49
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040260	GD	On-Demand	Anodyne	HTR2A	19	49
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040260	GD	On-Demand	Anodyne	SLC6A1	91	36
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040260	GD	On-Demand	Anodyne	OPRM1	16	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040260	GD	On-Demand	Anodyne	LTA4H	16	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040260	GD	On-Demand	Anodyne	HRH3	18	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040260	GD	On-Demand	Anodyne	SIGMAR1	48	60
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040260	GD	On-Demand	Anodyne	CCR5	41	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040260	GD	On-Demand	Anodyne	EPHX2	18	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040260	GD	On-Demand	Anodyne	DPP7	19	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040260	GD	On-Demand	Anodyne	MCHR1	18	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040260	GD	On-Demand	Anodyne	CACNA1G	27	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040260	GD	On-Demand	Anodyne	BIRC2	54	47
O=C(NCc1ncc(Cl)s1)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875040261	GD	On-Demand	Anodyne	DRD4	16	52
O=C(NCc1ncc(Cl)s1)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875040261	GD	On-Demand	Anodyne	SIGMAR1	17	41
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875040264	FC	On-Demand	Mild	DRD4	20	51
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875040264	FC	On-Demand	Mild	SSTR5	41	35
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875040265	FC	On-Demand	Mild	DRD4	20	51
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875040265	FC	On-Demand	Mild	SSTR5	41	35
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCc1cccc(OC)c1	ZINC000875040272	EC	On-Demand	Mild	DRD4	44	34
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCc1cccc(OC)c1	ZINC000875040272	EC	On-Demand	Mild	CTSL	17	41
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCc1cccc(OC)c1	ZINC000875040272	EC	On-Demand	Mild	MTNR1A	73	46
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCc1cccc(OC)c1	ZINC000875040272	EC	On-Demand	Mild	MTNR1B	66	46
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCc1cccc(OC)c1	ZINC000875040272	EC	On-Demand	Mild	CRTM	45	35
C#CC[C@H](CCOC)NC(=O)C(=O)NCCc1cccc(OC)c1	ZINC000875040273	EC	On-Demand	Mild	DRD4	44	34
C#CC[C@H](CCOC)NC(=O)C(=O)NCCc1cccc(OC)c1	ZINC000875040273	EC	On-Demand	Mild	CTSL	17	41
C#CC[C@H](CCOC)NC(=O)C(=O)NCCc1cccc(OC)c1	ZINC000875040273	EC	On-Demand	Mild	MTNR1A	73	46
C#CC[C@H](CCOC)NC(=O)C(=O)NCCc1cccc(OC)c1	ZINC000875040273	EC	On-Demand	Mild	MTNR1B	66	46
C#CC[C@H](CCOC)NC(=O)C(=O)NCCc1cccc(OC)c1	ZINC000875040273	EC	On-Demand	Mild	CRTM	45	35
C#CC[C@@H](COC)NC(=O)C(=O)NCCc1cccc(OC)c1	ZINC000875040289	DC	On-Demand	Mild	DRD4	41	32
C#CC[C@@H](COC)NC(=O)C(=O)NCCc1cccc(OC)c1	ZINC000875040289	DC	On-Demand	Mild	MTNR1A	77	47
C#CC[C@@H](COC)NC(=O)C(=O)NCCc1cccc(OC)c1	ZINC000875040289	DC	On-Demand	Mild	MTNR1B	70	47
C#CC[C@H](COC)NC(=O)C(=O)NCCc1cccc(OC)c1	ZINC000875040290	DC	On-Demand	Mild	DRD4	41	32
C#CC[C@H](COC)NC(=O)C(=O)NCCc1cccc(OC)c1	ZINC000875040290	DC	On-Demand	Mild	MTNR1A	77	47
C#CC[C@H](COC)NC(=O)C(=O)NCCc1cccc(OC)c1	ZINC000875040290	DC	On-Demand	Mild	MTNR1B	70	47
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040301	GE	On-Demand	Anodyne	DRD2	20	53
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040301	GE	On-Demand	Anodyne	DRD4	36	44
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040301	GE	On-Demand	Anodyne	ACHE	21	43
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040301	GE	On-Demand	Anodyne	KCNH2	22	46
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040301	GE	On-Demand	Anodyne	SIGMAR1	35	52
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040301	GE	On-Demand	Anodyne	SSTR5	52	42
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040301	GE	On-Demand	Anodyne	CCR3	66	48
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040301	GE	On-Demand	Anodyne	MLNR	57	43
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040301	GE	On-Demand	Anodyne	SLC6A5	29	40
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040301	GE	On-Demand	Anodyne	MCHR1	54	51
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040301	GE	On-Demand	Anodyne	CACNA1G	56	44
O=C(NCCc1cccc2cccnc12)N1CCC[C@H](OC2CCC2)CC1	ZINC000875040306	FH	On-Demand	Anodyne	EPHX2	16	42
O=C(NCCc1cccc2cccnc12)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875040307	FH	On-Demand	Anodyne	EPHX2	16	42
O=C(NC1CCN(C2CC2)CC1)N1Cc2cccc(O)c2C1	ZINC000875040316	DE	On-Demand	Clean	L3MBTL3	60	37
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875040322	GD	On-Demand	Anodyne	DRD4	27	52
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875040322	GD	On-Demand	Anodyne	DRD3	15	43
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875040322	GD	On-Demand	Anodyne	SIGMAR1	17	51
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875040322	GD	On-Demand	Anodyne	SSTR5	49	38
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875040322	GD	On-Demand	Anodyne	MCHR1	26	42
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1S(=O)(=O)N1CCCCC1	ZINC000875040326	GE	On-Demand	Anodyne	NAMPT	17	44
COC(=O)N(C)NC(=O)N[C@@H](c1ccc(Cl)cc1)C(C)C	ZINC000875040330	DF	On-Demand	Reactive	UTS2	45	35
COC(=O)N(C)NC(=O)N[C@H](c1ccc(Cl)cc1)C(C)C	ZINC000875040331	DF	On-Demand	Reactive	UTS2	45	35
N#Cc1ccc(Cn2cc(NC(=O)NC3CCN(C4CC4)CC3)cn2)cc1	ZINC000875040334	FF	On-Demand	Mild	ITK	15	49
N#Cc1ccc(Cn2cc(NC(=O)NC3CCN(C4CC4)CC3)cn2)cc1	ZINC000875040334	FF	On-Demand	Mild	CXCR3	20	40
N#Cc1ccc(Cn2cc(NC(=O)NC3CCN(C4CC4)CC3)cn2)cc1	ZINC000875040334	FF	On-Demand	Mild	PANC	53	37
Cc1ccccc1CN1CCC(NC(=O)C(=O)NCC[C@H]2CCSC2)CC1	ZINC000875040335	GE	On-Demand	Anodyne	DRD4	18	53
Cc1ccccc1CN1CCC(NC(=O)C(=O)NCC[C@H]2CCSC2)CC1	ZINC000875040335	GE	On-Demand	Anodyne	ACHE	15	46
Cc1ccccc1CN1CCC(NC(=O)C(=O)NCC[C@H]2CCSC2)CC1	ZINC000875040335	GE	On-Demand	Anodyne	SIGMAR1	18	41
Cc1ccccc1CN1CCC(NC(=O)C(=O)NCC[C@@H]2CCSC2)CC1	ZINC000875040336	GE	On-Demand	Anodyne	DRD4	18	53
Cc1ccccc1CN1CCC(NC(=O)C(=O)NCC[C@@H]2CCSC2)CC1	ZINC000875040336	GE	On-Demand	Anodyne	ACHE	15	46
Cc1ccccc1CN1CCC(NC(=O)C(=O)NCC[C@@H]2CCSC2)CC1	ZINC000875040336	GE	On-Demand	Anodyne	SIGMAR1	18	41
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875040341	GD	On-Demand	Anodyne	DRD4	31	42
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875040341	GD	On-Demand	Anodyne	KCNH2	20	43
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875040341	GD	On-Demand	Anodyne	SIGMAR1	34	53
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875040341	GD	On-Demand	Anodyne	SSTR5	72	43
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875040341	GD	On-Demand	Anodyne	CCR1	32	40
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875040341	GD	On-Demand	Anodyne	CCR3	59	45
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875040341	GD	On-Demand	Anodyne	MLNR	81	44
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875040341	GD	On-Demand	Anodyne	MCHR1	46	48
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875040341	GD	On-Demand	Anodyne	CACNA1G	42	46
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCN(C3CC3)CC2)CC1	ZINC000875040344	FH	On-Demand	Anodyne	DRD2	20	46
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCN(C3CC3)CC2)CC1	ZINC000875040344	FH	On-Demand	Anodyne	ADRA1D	41	46
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCN(C3CC3)CC2)CC1	ZINC000875040344	FH	On-Demand	Anodyne	ADRA1A	31	46
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCN(C3CC3)CC2)CC1	ZINC000875040344	FH	On-Demand	Anodyne	ADRA1B	33	46
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCN(C3CC3)CC2)CC1	ZINC000875040344	FH	On-Demand	Anodyne	EBP	25	45
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCN(C3CC3)CC2)CC1	ZINC000875040344	FH	On-Demand	Anodyne	EPHX2	30	41
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCN(C3CC3)CC2)CC1	ZINC000875040344	FH	On-Demand	Anodyne	RBP4	31	41
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCN(C3CC3)CC2)CC1	ZINC000875040344	FH	On-Demand	Anodyne	L3MBTL3	54	35
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCN(C3CC3)CC2)CC1	ZINC000875040345	FH	On-Demand	Anodyne	DRD2	20	46
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCN(C3CC3)CC2)CC1	ZINC000875040345	FH	On-Demand	Anodyne	ADRA1D	41	46
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCN(C3CC3)CC2)CC1	ZINC000875040345	FH	On-Demand	Anodyne	ADRA1A	31	46
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCN(C3CC3)CC2)CC1	ZINC000875040345	FH	On-Demand	Anodyne	ADRA1B	33	46
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCN(C3CC3)CC2)CC1	ZINC000875040345	FH	On-Demand	Anodyne	EBP	25	45
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCN(C3CC3)CC2)CC1	ZINC000875040345	FH	On-Demand	Anodyne	EPHX2	30	41
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCN(C3CC3)CC2)CC1	ZINC000875040345	FH	On-Demand	Anodyne	RBP4	31	41
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCN(C3CC3)CC2)CC1	ZINC000875040345	FH	On-Demand	Anodyne	L3MBTL3	54	35
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)CCc1ccc(O)cc1	ZINC000875040361	EE	On-Demand	Anodyne	SLC6A4	26	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)CCc1ccc(O)cc1	ZINC000875040361	EE	On-Demand	Anodyne	SLC6A3	55	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)CCc1ccc(O)cc1	ZINC000875040362	EE	On-Demand	Anodyne	SLC6A4	26	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)CCc1ccc(O)cc1	ZINC000875040362	EE	On-Demand	Anodyne	SLC6A3	55	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)CCc1ccc(O)cc1	ZINC000875040363	EE	On-Demand	Anodyne	SLC6A4	26	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)CCc1ccc(O)cc1	ZINC000875040363	EE	On-Demand	Anodyne	SLC6A3	55	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)CCc1ccc(O)cc1	ZINC000875040364	EE	On-Demand	Anodyne	SLC6A4	26	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)CCc1ccc(O)cc1	ZINC000875040364	EE	On-Demand	Anodyne	SLC6A3	55	43
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@@H](OC)CC[C@@H]3C)c2c1	ZINC000875040366	FD	On-Demand	Anodyne	HTR1A	20	45
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@@H](OC)CC[C@@H]3C)c2c1	ZINC000875040366	FD	On-Demand	Anodyne	HTR1D	57	44
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@@H](OC)CC[C@@H]3C)c2c1	ZINC000875040366	FD	On-Demand	Anodyne	HTR1B	44	44
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@@H](OC)CC[C@@H]3C)c2c1	ZINC000875040366	FD	On-Demand	Anodyne	NQO2	43	61
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@@H](OC)CC[C@@H]3C)c2c1	ZINC000875040366	FD	On-Demand	Anodyne	MTNR1A	108	61
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@@H](OC)CC[C@@H]3C)c2c1	ZINC000875040366	FD	On-Demand	Anodyne	MTNR1B	82	61
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@@H](OC)CC[C@@H]3C)c2c1	ZINC000875040366	FD	On-Demand	Anodyne	ABCG2	26	44
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@@H](OC)CC[C@H]3C)c2c1	ZINC000875040367	FD	On-Demand	Anodyne	HTR1A	20	45
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@@H](OC)CC[C@H]3C)c2c1	ZINC000875040367	FD	On-Demand	Anodyne	HTR1D	57	44
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@@H](OC)CC[C@H]3C)c2c1	ZINC000875040367	FD	On-Demand	Anodyne	HTR1B	44	44
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@@H](OC)CC[C@H]3C)c2c1	ZINC000875040367	FD	On-Demand	Anodyne	NQO2	43	61
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@@H](OC)CC[C@H]3C)c2c1	ZINC000875040367	FD	On-Demand	Anodyne	MTNR1A	108	61
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@@H](OC)CC[C@H]3C)c2c1	ZINC000875040367	FD	On-Demand	Anodyne	MTNR1B	82	61
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@@H](OC)CC[C@H]3C)c2c1	ZINC000875040367	FD	On-Demand	Anodyne	ABCG2	26	44
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@H](OC)CC[C@H]3C)c2c1	ZINC000875040368	FD	On-Demand	Anodyne	HTR1A	20	45
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@H](OC)CC[C@H]3C)c2c1	ZINC000875040368	FD	On-Demand	Anodyne	HTR1D	57	44
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@H](OC)CC[C@H]3C)c2c1	ZINC000875040368	FD	On-Demand	Anodyne	HTR1B	44	44
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@H](OC)CC[C@H]3C)c2c1	ZINC000875040368	FD	On-Demand	Anodyne	NQO2	43	61
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@H](OC)CC[C@H]3C)c2c1	ZINC000875040368	FD	On-Demand	Anodyne	MTNR1A	108	61
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@H](OC)CC[C@H]3C)c2c1	ZINC000875040368	FD	On-Demand	Anodyne	MTNR1B	82	61
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@H](OC)CC[C@H]3C)c2c1	ZINC000875040368	FD	On-Demand	Anodyne	ABCG2	26	44
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@H](OC)CC[C@@H]3C)c2c1	ZINC000875040369	FD	On-Demand	Anodyne	HTR1A	20	45
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@H](OC)CC[C@@H]3C)c2c1	ZINC000875040369	FD	On-Demand	Anodyne	HTR1D	57	44
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@H](OC)CC[C@@H]3C)c2c1	ZINC000875040369	FD	On-Demand	Anodyne	HTR1B	44	44
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@H](OC)CC[C@@H]3C)c2c1	ZINC000875040369	FD	On-Demand	Anodyne	NQO2	43	61
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@H](OC)CC[C@@H]3C)c2c1	ZINC000875040369	FD	On-Demand	Anodyne	MTNR1A	108	61
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@H](OC)CC[C@@H]3C)c2c1	ZINC000875040369	FD	On-Demand	Anodyne	MTNR1B	82	61
COc1ccc2[nH]cc(CCNC(=O)C(=O)N3C[C@H](OC)CC[C@@H]3C)c2c1	ZINC000875040369	FD	On-Demand	Anodyne	ABCG2	26	44
COC(=O)N(C)NC(=O)N[C@@H](C)CCc1ccc(O)cc1	ZINC000875040382	CD	On-Demand	Reactive	GRIA1	45	32
COC(=O)N(C)NC(=O)N[C@H](C)CCc1ccc(O)cc1	ZINC000875040383	CD	On-Demand	Reactive	GRIA1	45	32
C[C@H](CCc1ccc(O)cc1)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875040385	CD	On-Demand	Anodyne	GRIA1	49	33
C[C@H](CCc1ccc(O)cc1)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875040385	CD	On-Demand	Anodyne	YARS	57	34
C[C@@H](CCc1ccc(O)cc1)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875040386	CD	On-Demand	Anodyne	GRIA1	49	33
C[C@@H](CCc1ccc(O)cc1)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875040386	CD	On-Demand	Anodyne	YARS	57	34
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@H]3CC34CCC4)c2c1	ZINC000875040397	ED	On-Demand	Anodyne	HTR1A	18	46
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@H]3CC34CCC4)c2c1	ZINC000875040397	ED	On-Demand	Anodyne	ACHE	24	43
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@H]3CC34CCC4)c2c1	ZINC000875040397	ED	On-Demand	Anodyne	HTR1D	44	46
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@H]3CC34CCC4)c2c1	ZINC000875040397	ED	On-Demand	Anodyne	HTR1B	37	46
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@H]3CC34CCC4)c2c1	ZINC000875040397	ED	On-Demand	Anodyne	NQO2	35	60
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@H]3CC34CCC4)c2c1	ZINC000875040397	ED	On-Demand	Anodyne	MPO	44	39
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@H]3CC34CCC4)c2c1	ZINC000875040397	ED	On-Demand	Anodyne	HTR1E	15	40
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@H]3CC34CCC4)c2c1	ZINC000875040397	ED	On-Demand	Anodyne	MTNR1A	100	61
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@H]3CC34CCC4)c2c1	ZINC000875040397	ED	On-Demand	Anodyne	MTNR1B	75	60
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@H]3CC34CCC4)c2c1	ZINC000875040397	ED	On-Demand	Anodyne	ABCG2	26	43
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@@H]3CC34CCC4)c2c1	ZINC000875040398	ED	On-Demand	Anodyne	HTR1A	18	46
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@@H]3CC34CCC4)c2c1	ZINC000875040398	ED	On-Demand	Anodyne	ACHE	24	43
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@@H]3CC34CCC4)c2c1	ZINC000875040398	ED	On-Demand	Anodyne	HTR1D	44	46
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@@H]3CC34CCC4)c2c1	ZINC000875040398	ED	On-Demand	Anodyne	HTR1B	37	46
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@@H]3CC34CCC4)c2c1	ZINC000875040398	ED	On-Demand	Anodyne	NQO2	35	60
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@@H]3CC34CCC4)c2c1	ZINC000875040398	ED	On-Demand	Anodyne	MPO	44	39
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@@H]3CC34CCC4)c2c1	ZINC000875040398	ED	On-Demand	Anodyne	HTR1E	15	40
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@@H]3CC34CCC4)c2c1	ZINC000875040398	ED	On-Demand	Anodyne	MTNR1A	100	61
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@@H]3CC34CCC4)c2c1	ZINC000875040398	ED	On-Demand	Anodyne	MTNR1B	75	60
COc1ccc2[nH]cc(CCNC(=O)C(=O)N[C@@H]3CC34CCC4)c2c1	ZINC000875040398	ED	On-Demand	Anodyne	ABCG2	26	43
COC(=O)N(C)NC(=O)NCc1ccc(N2CCOCC2)nc1	ZINC000875040411	DC	On-Demand	Reactive	EPHB4	47	37
COC(=O)N(C)NC(=O)NCc1ccc(N2CCOCC2)nc1	ZINC000875040411	DC	On-Demand	Reactive	NAMPT	17	44
O=C(N[C@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCC2(c3ccccc3)CC2)C1	ZINC000875040413	GF	On-Demand	Anodyne	KCNA3	40	36
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCC2(c3ccccc3)CC2)C1	ZINC000875040414	GF	On-Demand	Anodyne	KCNA3	40	36
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCC2(c3ccccc3)CC2)C1	ZINC000875040415	GF	On-Demand	Anodyne	KCNA3	40	36
O=C(N[C@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCC2(c3ccccc3)CC2)C1	ZINC000875040416	GF	On-Demand	Anodyne	KCNA3	40	36
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2cc(F)ccc2F)C1	ZINC000875040433	DD	On-Demand	Anodyne	SLC6A1	43	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2cc(F)ccc2F)C1	ZINC000875040433	DD	On-Demand	Anodyne	P2RX7	40	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2cc(F)ccc2F)C1	ZINC000875040433	DD	On-Demand	Anodyne	DPP4	22	46
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2cc(F)ccc2F)C1	ZINC000875040434	DD	On-Demand	Anodyne	SLC6A1	43	37
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2cc(F)ccc2F)C1	ZINC000875040434	DD	On-Demand	Anodyne	P2RX7	40	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2cc(F)ccc2F)C1	ZINC000875040434	DD	On-Demand	Anodyne	DPP4	22	46
CC[C@@H]1COCCN1CCNC(=O)NCC1(c2ccccc2)CC1	ZINC000875040447	EE	On-Demand	Anodyne	KCNA3	46	37
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875040465	EF	On-Demand	Anodyne	ACE	25	44
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875040465	EF	On-Demand	Anodyne	NTSR1	93	35
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875040465	EF	On-Demand	Anodyne	NTSR2	65	34
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875040465	EF	On-Demand	Anodyne	CACNA1B	15	41
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875040465	EF	On-Demand	Anodyne	BIRC2	49	49
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875040466	EF	On-Demand	Anodyne	ACE	25	44
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875040466	EF	On-Demand	Anodyne	NTSR1	93	35
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875040466	EF	On-Demand	Anodyne	NTSR2	65	34
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875040466	EF	On-Demand	Anodyne	CACNA1B	15	41
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875040466	EF	On-Demand	Anodyne	BIRC2	49	49
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875040467	EF	On-Demand	Anodyne	ACE	25	44
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875040467	EF	On-Demand	Anodyne	NTSR1	93	35
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875040467	EF	On-Demand	Anodyne	NTSR2	65	34
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875040467	EF	On-Demand	Anodyne	CACNA1B	15	41
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875040467	EF	On-Demand	Anodyne	BIRC2	49	49
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875040468	EF	On-Demand	Anodyne	ACE	25	44
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875040468	EF	On-Demand	Anodyne	NTSR1	93	35
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875040468	EF	On-Demand	Anodyne	NTSR2	65	34
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875040468	EF	On-Demand	Anodyne	CACNA1B	15	41
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875040468	EF	On-Demand	Anodyne	BIRC2	49	49
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NCCCn2cccn2)CCO1	ZINC000875040469	FC	On-Demand	Anodyne	HTR1A	15	40
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NCCCn2cccn2)CCO1	ZINC000875040469	FC	On-Demand	Anodyne	DRD2	18	40
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NCCCn2cccn2)CCO1	ZINC000875040469	FC	On-Demand	Anodyne	DRD3	30	40
COc1ccccc1[C@H]1CN(C(=O)C(=O)NCCCn2cccn2)CCO1	ZINC000875040470	FC	On-Demand	Anodyne	HTR1A	15	40
COc1ccccc1[C@H]1CN(C(=O)C(=O)NCCCn2cccn2)CCO1	ZINC000875040470	FC	On-Demand	Anodyne	DRD2	18	40
COc1ccccc1[C@H]1CN(C(=O)C(=O)NCCCn2cccn2)CCO1	ZINC000875040470	FC	On-Demand	Anodyne	DRD3	30	40
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875040472	FG	On-Demand	Anodyne	BIRC2	22	40
C[C@H](CCc1ccc(O)cc1)NC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875040473	FG	On-Demand	Anodyne	BIRC2	22	40
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875040474	FG	On-Demand	Anodyne	BIRC2	22	40
C[C@@H](CCc1ccc(O)cc1)NC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875040475	FG	On-Demand	Anodyne	BIRC2	22	40
N#Cc1cc(F)ccc1N1CCN(C(=O)C(=O)NCCCn2cccn2)CC1	ZINC000875040476	GC	On-Demand	Mild	ADRA1D	17	40
N#Cc1cc(F)ccc1N1CCN(C(=O)C(=O)NCCCn2cccn2)CC1	ZINC000875040476	GC	On-Demand	Mild	ADRA1A	22	40
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCc2cc(F)ccc2F)c1	ZINC000875040481	FF	On-Demand	Anodyne	P2RX7	36	41
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCc2cc(F)ccc2F)c1	ZINC000875040482	FF	On-Demand	Anodyne	P2RX7	36	41
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000875040488	FD	On-Demand	Anodyne	DRD4	17	50
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000875040488	FD	On-Demand	Anodyne	SIGMAR1	15	40
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000875040488	FD	On-Demand	Anodyne	SSTR5	61	36
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000875040488	FD	On-Demand	Anodyne	MCHR1	19	40
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040510	GF	On-Demand	Anodyne	DRD2	27	49
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040510	GF	On-Demand	Anodyne	DRD4	37	45
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040510	GF	On-Demand	Anodyne	ACHE	38	51
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040510	GF	On-Demand	Anodyne	DRD3	27	49
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040510	GF	On-Demand	Anodyne	SLC6A3	18	45
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040510	GF	On-Demand	Anodyne	KCNH2	20	43
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040510	GF	On-Demand	Anodyne	SIGMAR1	42	56
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040510	GF	On-Demand	Anodyne	SSTR5	47	41
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040510	GF	On-Demand	Anodyne	CCR3	97	52
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040510	GF	On-Demand	Anodyne	MLNR	46	41
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040510	GF	On-Demand	Anodyne	SLC6A5	29	41
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040510	GF	On-Demand	Anodyne	MCHR1	55	52
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040510	GF	On-Demand	Anodyne	CACNA1G	51	45
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040517	GD	On-Demand	Anodyne	CHRM1	23	40
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040517	GD	On-Demand	Anodyne	DRD2	20	41
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040517	GD	On-Demand	Anodyne	DRD4	29	48
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040517	GD	On-Demand	Anodyne	HTR2A	16	48
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040517	GD	On-Demand	Anodyne	OPRM1	16	46
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040517	GD	On-Demand	Anodyne	LTA4H	15	44
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040517	GD	On-Demand	Anodyne	SIGMAR1	47	57
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040517	GD	On-Demand	Anodyne	MCHR1	18	41
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875040517	GD	On-Demand	Anodyne	BIRC2	37	42
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875040523	FD	On-Demand	Anodyne	DRD4	28	44
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875040523	FD	On-Demand	Anodyne	KCNH2	17	42
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875040523	FD	On-Demand	Anodyne	CHRM3	16	42
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875040523	FD	On-Demand	Anodyne	SIGMAR1	39	57
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875040523	FD	On-Demand	Anodyne	SSTR5	42	39
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875040523	FD	On-Demand	Anodyne	CCR3	72	50
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875040523	FD	On-Demand	Anodyne	MLNR	43	40
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875040523	FD	On-Demand	Anodyne	CXCR3	27	42
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875040523	FD	On-Demand	Anodyne	MCHR1	48	53
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875040523	FD	On-Demand	Anodyne	CACNA1G	38	52
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875040524	FD	On-Demand	Anodyne	DRD4	28	44
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875040524	FD	On-Demand	Anodyne	KCNH2	17	42
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875040524	FD	On-Demand	Anodyne	CHRM3	16	42
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875040524	FD	On-Demand	Anodyne	SIGMAR1	39	57
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875040524	FD	On-Demand	Anodyne	SSTR5	42	39
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875040524	FD	On-Demand	Anodyne	CCR3	72	50
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875040524	FD	On-Demand	Anodyne	MLNR	43	40
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875040524	FD	On-Demand	Anodyne	CXCR3	27	42
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875040524	FD	On-Demand	Anodyne	MCHR1	48	53
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875040524	FD	On-Demand	Anodyne	CACNA1G	38	52
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(Cc3ccccc3C)CC2)C1	ZINC000875040538	GE	On-Demand	Anodyne	DRD4	23	51
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(Cc3ccccc3C)CC2)C1	ZINC000875040538	GE	On-Demand	Anodyne	SIGMAR1	18	45
Cc1ccccc1CN1CCC(NC(=O)C(=O)N[C@@H](C)c2ccnn2C)CC1	ZINC000875040557	GD	On-Demand	Anodyne	DRD4	18	52
Cc1ccccc1CN1CCC(NC(=O)C(=O)N[C@@H](C)c2ccnn2C)CC1	ZINC000875040557	GD	On-Demand	Anodyne	SIGMAR1	17	42
Cc1ccccc1CN1CCC(NC(=O)C(=O)N[C@H](C)c2ccnn2C)CC1	ZINC000875040558	GD	On-Demand	Anodyne	DRD4	18	52
Cc1ccccc1CN1CCC(NC(=O)C(=O)N[C@H](C)c2ccnn2C)CC1	ZINC000875040558	GD	On-Demand	Anodyne	SIGMAR1	17	42
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NC2CCN(CCN(C)C)CC2)c1	ZINC000875040565	GD	On-Demand	Anodyne	SSTR5	30	40
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NC2CCN(CCN(C)C)CC2)c1	ZINC000875040566	GD	On-Demand	Anodyne	SSTR5	30	40
O=C(NCC[C@H]1CCSC1)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875040572	GD	On-Demand	Anodyne	SIRT3	51	33
O=C(NCC[C@H]1CCSC1)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875040572	GD	On-Demand	Anodyne	SIRT2	52	33
O=C(NCC[C@H]1CCSC1)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875040572	GD	On-Demand	Anodyne	SIRT1	51	33
O=C(NCC[C@@H]1CCSC1)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875040573	GD	On-Demand	Anodyne	SIRT3	51	33
O=C(NCC[C@@H]1CCSC1)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875040573	GD	On-Demand	Anodyne	SIRT2	52	33
O=C(NCC[C@@H]1CCSC1)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875040573	GD	On-Demand	Anodyne	SIRT1	51	33
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1S(=O)(=O)N(C)C	ZINC000875040575	FD	On-Demand	Anodyne	ANPEP	16	41
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1ccc2c(c1)C(=O)N(C)C2=O	ZINC000875040589	FF	On-Demand	Anodyne	MTNR1A	20	41
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1ccc2c(c1)C(=O)N(C)C2=O	ZINC000875040589	FF	On-Demand	Anodyne	MTNR1B	24	41
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1ccc2c(c1)C(=O)N(C)C2=O	ZINC000875040589	FF	On-Demand	Anodyne	ROCK2	21	41
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(CCc4ccccc4)CC3)CC[C@@H]21	ZINC000875040600	GD	On-Demand	Anodyne	CHRM1	20	42
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(CCc4ccccc4)CC3)CC[C@@H]21	ZINC000875040600	GD	On-Demand	Anodyne	DRD2	20	41
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(CCc4ccccc4)CC3)CC[C@@H]21	ZINC000875040600	GD	On-Demand	Anodyne	DRD4	29	51
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(CCc4ccccc4)CC3)CC[C@@H]21	ZINC000875040600	GD	On-Demand	Anodyne	HTR2A	16	51
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(CCc4ccccc4)CC3)CC[C@@H]21	ZINC000875040600	GD	On-Demand	Anodyne	OPRM1	15	44
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(CCc4ccccc4)CC3)CC[C@@H]21	ZINC000875040600	GD	On-Demand	Anodyne	DRD3	16	41
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(CCc4ccccc4)CC3)CC[C@@H]21	ZINC000875040600	GD	On-Demand	Anodyne	SIGMAR1	43	44
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(CCc4ccccc4)CC3)CC[C@@H]21	ZINC000875040600	GD	On-Demand	Anodyne	BIRC2	60	42
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(CCc4ccccc4)CC3)CC[C@H]21	ZINC000875040601	GD	On-Demand	Anodyne	CHRM1	20	42
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(CCc4ccccc4)CC3)CC[C@H]21	ZINC000875040601	GD	On-Demand	Anodyne	DRD2	20	41
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(CCc4ccccc4)CC3)CC[C@H]21	ZINC000875040601	GD	On-Demand	Anodyne	DRD4	29	51
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(CCc4ccccc4)CC3)CC[C@H]21	ZINC000875040601	GD	On-Demand	Anodyne	HTR2A	16	51
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(CCc4ccccc4)CC3)CC[C@H]21	ZINC000875040601	GD	On-Demand	Anodyne	OPRM1	15	44
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(CCc4ccccc4)CC3)CC[C@H]21	ZINC000875040601	GD	On-Demand	Anodyne	DRD3	16	41
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(CCc4ccccc4)CC3)CC[C@H]21	ZINC000875040601	GD	On-Demand	Anodyne	SIGMAR1	43	44
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(CCc4ccccc4)CC3)CC[C@H]21	ZINC000875040601	GD	On-Demand	Anodyne	BIRC2	60	42
O=C(NCCC[C@H]1C=CCC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040606	GF	On-Demand	Anodyne	DRD4	21	42
O=C(NCCC[C@H]1C=CCC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040606	GF	On-Demand	Anodyne	KCNH2	15	42
O=C(NCCC[C@H]1C=CCC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040606	GF	On-Demand	Anodyne	SIGMAR1	29	51
O=C(NCCC[C@H]1C=CCC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040606	GF	On-Demand	Anodyne	CCR3	57	48
O=C(NCCC[C@H]1C=CCC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040606	GF	On-Demand	Anodyne	MCHR1	42	48
O=C(NCCC[C@H]1C=CCC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040606	GF	On-Demand	Anodyne	CACNA1G	39	41
O=C(NCCC[C@@H]1C=CCC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040607	GF	On-Demand	Anodyne	DRD4	21	42
O=C(NCCC[C@@H]1C=CCC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040607	GF	On-Demand	Anodyne	KCNH2	15	42
O=C(NCCC[C@@H]1C=CCC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040607	GF	On-Demand	Anodyne	SIGMAR1	29	51
O=C(NCCC[C@@H]1C=CCC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040607	GF	On-Demand	Anodyne	CCR3	57	48
O=C(NCCC[C@@H]1C=CCC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040607	GF	On-Demand	Anodyne	MCHR1	42	48
O=C(NCCC[C@@H]1C=CCC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040607	GF	On-Demand	Anodyne	CACNA1G	39	41
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)Oc3cc(OC)cc(OC)c3)CC2)cc1	ZINC000875040608	IG	On-Demand	Anodyne	CHRM2	31	43
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)Oc3cc(OC)cc(OC)c3)CC2)cc1	ZINC000875040608	IG	On-Demand	Anodyne	FKBP1A	24	41
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)Oc3cc(OC)cc(OC)c3)CC2)cc1	ZINC000875040608	IG	On-Demand	Anodyne	MMP13	78	48
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)Oc3cc(OC)cc(OC)c3)CC2)cc1	ZINC000875040608	IG	On-Demand	Anodyne	ADAM17	44	40
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)Oc3cc(OC)cc(OC)c3)CC2)cc1	ZINC000875040608	IG	On-Demand	Anodyne	MMP2	34	48
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)Oc3cc(OC)cc(OC)c3)CC2)cc1	ZINC000875040608	IG	On-Demand	Anodyne	MMP3	65	48
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)Oc3cc(OC)cc(OC)c3)CC2)cc1	ZINC000875040608	IG	On-Demand	Anodyne	MMP8	29	48
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)Oc3cc(OC)cc(OC)c3)CC2)cc1	ZINC000875040608	IG	On-Demand	Anodyne	MMP9	40	48
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)Oc3cc(OC)cc(OC)c3)CC2)cc1	ZINC000875040608	IG	On-Demand	Anodyne	EPHX2	30	53
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)Oc3cc(OC)cc(OC)c3)CC2)cc1	ZINC000875040608	IG	On-Demand	Anodyne	PKM	20	48
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)Oc3cc(OC)cc(OC)c3)CC2)cc1	ZINC000875040608	IG	On-Demand	Anodyne	MMP7	57	48
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)Oc3cc(OC)cc(OC)c3)CC2)cc1	ZINC000875040608	IG	On-Demand	Anodyne	MMP1	68	48
O=C(/C=C/c1cnc2ccccc2n1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875040619	HJ	On-Demand	Anodyne	SCD1	34	44
O=C(/C=C/c1cnc2ccccc2n1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875040619	HJ	On-Demand	Anodyne	SCD	30	47
O=C(/C=C\c1cnc2ccccc2n1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875040620	HJ	On-Demand	Anodyne	SCD1	34	44
O=C(/C=C\c1cnc2ccccc2n1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875040620	HJ	On-Demand	Anodyne	SCD	30	47
O=C(NCc1cccc(F)c1F)C(=O)NC1CCN(C[C@@H]2CCCO2)CC1	ZINC000875040621	GD	On-Demand	Anodyne	SIGMAR1	15	43
O=C(NCc1cccc(F)c1F)C(=O)NC1CCN(C[C@H]2CCCO2)CC1	ZINC000875040622	GD	On-Demand	Anodyne	SIGMAR1	15	43
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NC1CCN(C2CC2)CC1	ZINC000875040629	FF	On-Demand	Anodyne	SLC6A5	30	42
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NC1CCN(C2CC2)CC1	ZINC000875040629	FF	On-Demand	Anodyne	EPHX2	21	42
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(Cc4ccccn4)CC3)CC[C@@H]21	ZINC000875040643	GC	On-Demand	Anodyne	DRD4	15	52
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(Cc4ccccn4)CC3)CC[C@H]21	ZINC000875040644	GC	On-Demand	Anodyne	DRD4	15	52
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875040690	FD	On-Demand	Anodyne	HTR1A	17	40
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875040690	FD	On-Demand	Anodyne	DRD2	25	47
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875040690	FD	On-Demand	Anodyne	DRD4	21	57
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875040690	FD	On-Demand	Anodyne	ACHE	24	46
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875040690	FD	On-Demand	Anodyne	DRD3	32	44
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875040690	FD	On-Demand	Anodyne	SIGMAR1	17	40
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875040690	FD	On-Demand	Anodyne	SSTR5	41	34
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875040690	FD	On-Demand	Anodyne	SIRT3	47	34
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875040690	FD	On-Demand	Anodyne	SIRT2	47	34
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875040690	FD	On-Demand	Anodyne	SIRT1	45	34
O=C(NC1CCN(C2CC2)CC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875040691	FF	On-Demand	Anodyne	OPRL1	20	47
O=C(NC1CCN(C2CC2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875040692	FE	On-Demand	Anodyne	CHRM2	24	43
O=C(NC1CCN(C2CC2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875040692	FE	On-Demand	Anodyne	CHRM1	17	43
O=C(NC1CCN(C2CC2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875040692	FE	On-Demand	Anodyne	DRD2	15	48
O=C(NC1CCN(C2CC2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875040692	FE	On-Demand	Anodyne	DRD4	39	49
O=C(NC1CCN(C2CC2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875040692	FE	On-Demand	Anodyne	ACHE	23	40
O=C(NC1CCN(C2CC2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875040692	FE	On-Demand	Anodyne	CHRM3	23	43
O=C(NC1CCN(C2CC2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875040692	FE	On-Demand	Anodyne	HRH3	15	45
O=C(NC1CCN(C2CC2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875040692	FE	On-Demand	Anodyne	SIGMAR1	48	52
O=C(NC1CCN(C2CC2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875040692	FE	On-Demand	Anodyne	CCR3	37	46
O=C(NC1CCN(C2CC2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875040692	FE	On-Demand	Anodyne	FAAH	23	40
O=C(NC1CCN(C2CC2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875040692	FE	On-Demand	Anodyne	SLC6A5	15	40
O=C(NC1CCN(C2CC2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875040692	FE	On-Demand	Anodyne	EPHX2	17	46
O=C(NC1CCN(C2CC2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875040692	FE	On-Demand	Anodyne	MCHR1	23	43
O=C(NC1CCN(C2CC2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875040692	FE	On-Demand	Anodyne	CCR8	19	41
CC[C@@H](NC(=O)NC1CCN(C2CC2)CC1)[C@@H](O)c1ccccc1	ZINC000875040699	EE	On-Demand	Anodyne	EPHX2	30	42
CC[C@@H](NC(=O)NC1CCN(C2CC2)CC1)[C@@H](O)c1ccccc1	ZINC000875040699	EE	On-Demand	Anodyne	XIAP	62	40
CC[C@@H](NC(=O)NC1CCN(C2CC2)CC1)[C@@H](O)c1ccccc1	ZINC000875040699	EE	On-Demand	Anodyne	BIRC2	51	32
CC[C@@H](NC(=O)NC1CCN(C2CC2)CC1)[C@@H](O)c1ccccc1	ZINC000875040699	EE	On-Demand	Anodyne	BIRC8	53	32
CC[C@@H](NC(=O)NC1CCN(C2CC2)CC1)[C@H](O)c1ccccc1	ZINC000875040700	EE	On-Demand	Anodyne	EPHX2	30	42
CC[C@@H](NC(=O)NC1CCN(C2CC2)CC1)[C@H](O)c1ccccc1	ZINC000875040700	EE	On-Demand	Anodyne	XIAP	62	40
CC[C@@H](NC(=O)NC1CCN(C2CC2)CC1)[C@H](O)c1ccccc1	ZINC000875040700	EE	On-Demand	Anodyne	BIRC2	51	32
CC[C@@H](NC(=O)NC1CCN(C2CC2)CC1)[C@H](O)c1ccccc1	ZINC000875040700	EE	On-Demand	Anodyne	BIRC8	53	32
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(C2CC2)CC1	ZINC000875040709	FE	On-Demand	Anodyne	SIGMAR1	15	47
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(C2CC2)CC1	ZINC000875040709	FE	On-Demand	Anodyne	CCR3	20	41
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(C2CC2)CC1	ZINC000875040709	FE	On-Demand	Anodyne	SLC6A5	15	42
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(C2CC2)CC1	ZINC000875040709	FE	On-Demand	Anodyne	EPHX2	24	45
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(C2CC2)CC1	ZINC000875040710	FE	On-Demand	Anodyne	SIGMAR1	15	47
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(C2CC2)CC1	ZINC000875040710	FE	On-Demand	Anodyne	CCR3	20	41
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(C2CC2)CC1	ZINC000875040710	FE	On-Demand	Anodyne	SLC6A5	15	42
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(C2CC2)CC1	ZINC000875040710	FE	On-Demand	Anodyne	EPHX2	24	45
O=C(NNc1cccc(F)c1Cl)NC1CCN(C2CC2)CC1	ZINC000875040712	EF	On-Demand	Reactive	EPHX2	18	42
O=C(NC1CCN(CCc2ccccc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875040723	GE	On-Demand	Anodyne	CHRM1	18	41
O=C(NC1CCN(CCc2ccccc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875040723	GE	On-Demand	Anodyne	DRD2	20	42
O=C(NC1CCN(CCc2ccccc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875040723	GE	On-Demand	Anodyne	DRD4	27	55
O=C(NC1CCN(CCc2ccccc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875040723	GE	On-Demand	Anodyne	HTR2A	21	55
O=C(NC1CCN(CCc2ccccc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875040723	GE	On-Demand	Anodyne	LTA4H	15	41
O=C(NC1CCN(CCc2ccccc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875040723	GE	On-Demand	Anodyne	SIGMAR1	53	65
O=C(NC1CCN(CCc2ccccc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875040723	GE	On-Demand	Anodyne	CCR3	23	41
O=C(NC1CCN(CCc2ccccc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875040723	GE	On-Demand	Anodyne	MCHR1	18	42
O=C(NC1CCN(CCc2ccccc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875040723	GE	On-Demand	Anodyne	CACNA1G	17	41
O=C(NC1CCN(CCc2ccccc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875040723	GE	On-Demand	Anodyne	BIRC2	48	43
CN(C)S(=O)(=O)c1ccccc1CNC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875040768	GD	On-Demand	Anodyne	EPHX2	17	41
CN(C)S(=O)(=O)c1ccccc1CNC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875040769	GD	On-Demand	Anodyne	EPHX2	17	41
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(CCN(C)C)CC1	ZINC000875040771	FC	On-Demand	Anodyne	SLC6A5	16	41
COC(=O)N(C)NC(=O)NCCc1cccc2cccnc12	ZINC000875040773	DD	On-Demand	Reactive	NQO2	34	43
COC(=O)N(C)NC(=O)NCCc1cccc2cccnc12	ZINC000875040773	DD	On-Demand	Reactive	MTNR1A	56	44
COC(=O)N(C)NC(=O)NCCc1cccc2cccnc12	ZINC000875040773	DD	On-Demand	Reactive	MTNR1B	35	40
O=C(NC1CCN(Cc2ccccn2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875040779	FD	On-Demand	Anodyne	DRD4	17	58
O=C(NC1CCN(Cc2ccccn2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875040779	FD	On-Demand	Anodyne	SIGMAR1	16	43
O=C(NC1CCN(Cc2ccccn2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875040779	FD	On-Demand	Anodyne	MCHR1	15	40
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875040782	GE	On-Demand	Anodyne	DRD2	17	42
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875040782	GE	On-Demand	Anodyne	DRD4	32	53
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875040782	GE	On-Demand	Anodyne	ACHE	17	45
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875040782	GE	On-Demand	Anodyne	DRD3	17	40
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875040782	GE	On-Demand	Anodyne	HTR4	21	40
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875040782	GE	On-Demand	Anodyne	SIGMAR1	21	45
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875040782	GE	On-Demand	Anodyne	SSTR5	36	42
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875040782	GE	On-Demand	Anodyne	MCHR1	30	42
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000875040789	GD	On-Demand	Anodyne	DRD4	21	48
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000875040789	GD	On-Demand	Anodyne	SIGMAR1	15	42
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000875040789	GD	On-Demand	Anodyne	EPHX2	31	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000875040791	FC	On-Demand	Anodyne	DRD4	16	52
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000875040791	FC	On-Demand	Anodyne	SIGMAR1	16	44
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000875040791	FC	On-Demand	Anodyne	BIRC2	18	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000875040792	FC	On-Demand	Anodyne	DRD4	16	52
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000875040792	FC	On-Demand	Anodyne	SIGMAR1	16	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000875040792	FC	On-Demand	Anodyne	BIRC2	18	40
C=CC(C)(C)CCCNC(=O)C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875040805	FE	On-Demand	Mild	DRD4	15	52
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040823	GD	On-Demand	Mild	DRD4	29	43
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040823	GD	On-Demand	Mild	SLC6A3	21	40
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040823	GD	On-Demand	Mild	KCNH2	20	44
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040823	GD	On-Demand	Mild	SIGMAR1	32	49
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040823	GD	On-Demand	Mild	SSTR5	49	41
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040823	GD	On-Demand	Mild	CCR3	57	46
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040823	GD	On-Demand	Mild	MLNR	59	40
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040823	GD	On-Demand	Mild	MCHR1	50	46
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040823	GD	On-Demand	Mild	CACNA1G	44	42
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040824	GD	On-Demand	Mild	DRD4	29	43
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040824	GD	On-Demand	Mild	SLC6A3	21	40
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040824	GD	On-Demand	Mild	KCNH2	20	44
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040824	GD	On-Demand	Mild	SIGMAR1	32	49
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040824	GD	On-Demand	Mild	SSTR5	49	41
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040824	GD	On-Demand	Mild	CCR3	57	46
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040824	GD	On-Demand	Mild	MLNR	59	40
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040824	GD	On-Demand	Mild	MCHR1	50	46
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875040824	GD	On-Demand	Mild	CACNA1G	44	42
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccccc1OC(F)F	ZINC000875040825	GF	On-Demand	Anodyne	ACKR3	59	29
O=C(NCCO)C1CCN(C(=O)NCCc2cccc3cccnc23)CC1	ZINC000875040826	FD	On-Demand	Anodyne	MTNR1A	23	43
O=C(NCCO)C1CCN(C(=O)NCCc2cccc3cccnc23)CC1	ZINC000875040826	FD	On-Demand	Anodyne	MTNR1B	16	43
Cc1ccccc1CN1CCC(NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875040830	GD	On-Demand	Anodyne	CHRM1	17	41
Cc1ccccc1CN1CCC(NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875040830	GD	On-Demand	Anodyne	DRD4	20	53
Cc1ccccc1CN1CCC(NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875040830	GD	On-Demand	Anodyne	CHRM3	15	56
Cc1ccccc1CN1CCC(NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875040830	GD	On-Demand	Anodyne	SIGMAR1	18	45
Cc1ccccc1CN1CCC(NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875040830	GD	On-Demand	Anodyne	CCR8	64	34
Cc1ccccc1CN1CCC(NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875040831	GD	On-Demand	Anodyne	CHRM1	17	41
Cc1ccccc1CN1CCC(NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875040831	GD	On-Demand	Anodyne	DRD4	20	53
Cc1ccccc1CN1CCC(NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875040831	GD	On-Demand	Anodyne	CHRM3	15	56
Cc1ccccc1CN1CCC(NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875040831	GD	On-Demand	Anodyne	SIGMAR1	18	45
Cc1ccccc1CN1CCC(NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875040831	GD	On-Demand	Anodyne	CCR8	64	34
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)CC1	ZINC000875040832	GD	On-Demand	Anodyne	DRD4	30	44
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)CC1	ZINC000875040832	GD	On-Demand	Anodyne	KCNH2	17	46
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)CC1	ZINC000875040832	GD	On-Demand	Anodyne	SIGMAR1	41	60
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)CC1	ZINC000875040832	GD	On-Demand	Anodyne	SSTR5	48	41
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)CC1	ZINC000875040832	GD	On-Demand	Anodyne	CCR3	88	50
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)CC1	ZINC000875040832	GD	On-Demand	Anodyne	SLC18A3	17	42
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)CC1	ZINC000875040832	GD	On-Demand	Anodyne	MLNR	70	45
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)CC1	ZINC000875040832	GD	On-Demand	Anodyne	EPHX2	24	42
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)CC1	ZINC000875040832	GD	On-Demand	Anodyne	MCHR1	57	53
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)CC1	ZINC000875040832	GD	On-Demand	Anodyne	CACNA1G	49	48
O=C(NCC[C@@H]1CCSC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875040842	GE	On-Demand	Anodyne	DRD2	26	43
O=C(NCC[C@@H]1CCSC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875040842	GE	On-Demand	Anodyne	DRD4	27	51
O=C(NCC[C@@H]1CCSC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875040842	GE	On-Demand	Anodyne	ACHE	22	42
O=C(NCC[C@@H]1CCSC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875040842	GE	On-Demand	Anodyne	HTR2A	19	51
O=C(NCC[C@@H]1CCSC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875040842	GE	On-Demand	Anodyne	DRD3	22	40
O=C(NCC[C@@H]1CCSC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875040842	GE	On-Demand	Anodyne	SIGMAR1	43	56
O=C(NCC[C@H]1CCSC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875040843	GE	On-Demand	Anodyne	DRD2	26	43
O=C(NCC[C@H]1CCSC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875040843	GE	On-Demand	Anodyne	DRD4	27	51
O=C(NCC[C@H]1CCSC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875040843	GE	On-Demand	Anodyne	ACHE	22	42
O=C(NCC[C@H]1CCSC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875040843	GE	On-Demand	Anodyne	HTR2A	19	51
O=C(NCC[C@H]1CCSC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875040843	GE	On-Demand	Anodyne	DRD3	22	40
O=C(NCC[C@H]1CCSC1)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875040843	GE	On-Demand	Anodyne	SIGMAR1	43	56
O=C(CN1CCC(NC(=O)NC[C@H]2C[C@H](O)C2)CC1)Nc1ccccc1	ZINC000875040853	FD	On-Demand	Anodyne	DRD4	26	52
O=C(CN1CCC(NC(=O)NC[C@H]2C[C@H](O)C2)CC1)Nc1ccccc1	ZINC000875040853	FD	On-Demand	Anodyne	SIGMAR1	16	43
O=C(CN1CCC(NC(=O)NC[C@H]2C[C@H](O)C2)CC1)Nc1ccccc1	ZINC000875040853	FD	On-Demand	Anodyne	CCR3	28	40
O=C(CN1CCC(NC(=O)NC[C@H]2C[C@H](O)C2)CC1)Nc1ccccc1	ZINC000875040853	FD	On-Demand	Anodyne	EPHX2	40	40
C[C@H](NC(=O)C(=O)NC1CCN(CCN(C)C)CC1)c1cc2cnccc2o1	ZINC000875040854	GD	On-Demand	Anodyne	CASR	42	37
CCCCN(C)S(=O)(=O)c1ccc(NC(=O)C2(F)CCOCC2)cc1	ZINC000875040867	FF	On-Demand	Anodyne	MMP13	23	43
O=C(CN1CCC(NC(=O)N2Cc3cccc(O)c3C2)CC1)Nc1ccccc1	ZINC000875040877	GF	On-Demand	Clean	DRD4	31	44
O=C(CN1CCC(NC(=O)N2Cc3cccc(O)c3C2)CC1)Nc1ccccc1	ZINC000875040877	GF	On-Demand	Clean	SIGMAR1	17	41
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H](C)C2)cc1	ZINC000875040928	GE	On-Demand	Anodyne	TGM2	66	40
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H](C)C2)cc1	ZINC000875040928	GE	On-Demand	Anodyne	F13A1	88	41
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H](C)C2)cc1	ZINC000875040928	GE	On-Demand	Anodyne	NAMPT	50	55
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2CCC[C@@H](C)C2)cc1	ZINC000875040929	GE	On-Demand	Anodyne	TGM2	66	40
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2CCC[C@@H](C)C2)cc1	ZINC000875040929	GE	On-Demand	Anodyne	F13A1	88	41
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2CCC[C@@H](C)C2)cc1	ZINC000875040929	GE	On-Demand	Anodyne	NAMPT	50	55
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(C2CC2)CC1	ZINC000875040933	CD	On-Demand	Anodyne	EPHX2	16	41
Cc1ccccc1CN1CCC(NC(=O)C(=O)N2CC[C@H]3[C@H](CCN3C)C2)CC1	ZINC000875040943	GD	On-Demand	Anodyne	DRD4	20	53
Cc1ccccc1CN1CCC(NC(=O)C(=O)N2CC[C@H]3[C@H](CCN3C)C2)CC1	ZINC000875040943	GD	On-Demand	Anodyne	SIGMAR1	16	43
Cc1ccccc1CN1CCC(NC(=O)C(=O)N2CC[C@H]3[C@H](CCN3C)C2)CC1	ZINC000875040943	GD	On-Demand	Anodyne	CCR8	60	34
Cc1ccccc1CN1CCC(NC(=O)C(=O)N2CC[C@H]3[C@@H](CCN3C)C2)CC1	ZINC000875040944	GD	On-Demand	Anodyne	DRD4	20	53
Cc1ccccc1CN1CCC(NC(=O)C(=O)N2CC[C@H]3[C@@H](CCN3C)C2)CC1	ZINC000875040944	GD	On-Demand	Anodyne	SIGMAR1	16	43
Cc1ccccc1CN1CCC(NC(=O)C(=O)N2CC[C@H]3[C@@H](CCN3C)C2)CC1	ZINC000875040944	GD	On-Demand	Anodyne	CCR8	60	34
Cc1ccccc1CN1CCC(NC(=O)C(=O)N2CC[C@@H]3[C@@H](CCN3C)C2)CC1	ZINC000875040945	GD	On-Demand	Anodyne	DRD4	20	53
Cc1ccccc1CN1CCC(NC(=O)C(=O)N2CC[C@@H]3[C@@H](CCN3C)C2)CC1	ZINC000875040945	GD	On-Demand	Anodyne	SIGMAR1	16	43
Cc1ccccc1CN1CCC(NC(=O)C(=O)N2CC[C@@H]3[C@@H](CCN3C)C2)CC1	ZINC000875040945	GD	On-Demand	Anodyne	CCR8	60	34
Cc1ccccc1CN1CCC(NC(=O)C(=O)N2CC[C@@H]3[C@H](CCN3C)C2)CC1	ZINC000875040946	GD	On-Demand	Anodyne	DRD4	20	53
Cc1ccccc1CN1CCC(NC(=O)C(=O)N2CC[C@@H]3[C@H](CCN3C)C2)CC1	ZINC000875040946	GD	On-Demand	Anodyne	SIGMAR1	16	43
Cc1ccccc1CN1CCC(NC(=O)C(=O)N2CC[C@@H]3[C@H](CCN3C)C2)CC1	ZINC000875040946	GD	On-Demand	Anodyne	CCR8	60	34
COC(=O)[C@@]12C[C@@H](NC(=O)NCC#Cc3cccc(C(F)(F)F)c3)C[C@@H]1C2	ZINC000875040956	GF	On-Demand	Mild	CCR2	49	33
O=C(NCCc1cn2ccccc2n1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875040962	GG	On-Demand	Anodyne	CPT1A	43	34
O=C(NCCc1cn2ccccc2n1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875040963	GG	On-Demand	Anodyne	CPT1A	43	34
O=C(NCCc1cn2ccccc2n1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875040964	GG	On-Demand	Anodyne	CPT1A	43	34
O=C(NCCc1cn2ccccc2n1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875040965	GG	On-Demand	Anodyne	CPT1A	43	34
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12	ZINC000875041014	JH	On-Demand	Anodyne	SCD1	40	49
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12	ZINC000875041014	JH	On-Demand	Anodyne	SCD	32	49
O=C(NC1CCN(C(=O)c2ccco2)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875041018	GF	On-Demand	Anodyne	EPHX2	23	40
O=C(NC1CCN(C(=O)c2ccco2)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875041019	GF	On-Demand	Anodyne	EPHX2	23	40
O=C(N[C@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCC#Cc2ccccc2)C1	ZINC000875041023	GD	On-Demand	Mild	EPHX2	22	40
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCC#Cc2ccccc2)C1	ZINC000875041024	GD	On-Demand	Mild	EPHX2	22	40
O=C(N[C@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCC#Cc2ccccc2)C1	ZINC000875041025	GD	On-Demand	Mild	EPHX2	22	40
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCC#Cc2ccccc2)C1	ZINC000875041026	GD	On-Demand	Mild	EPHX2	22	40
C#CC[C@H](COC)NC(=O)C(=O)NCc1ccccc1CN1CCC[C@H](C)C1	ZINC000875041027	GD	On-Demand	Mild	SLC6A1	77	36
C#CC[C@@H](COC)NC(=O)C(=O)NCc1ccccc1CN1CCC[C@H](C)C1	ZINC000875041028	GD	On-Demand	Mild	SLC6A1	77	36
C#CC[C@@H](COC)NC(=O)C(=O)NCc1ccccc1CN1CCC[C@@H](C)C1	ZINC000875041029	GD	On-Demand	Mild	SLC6A1	77	36
C#CC[C@H](COC)NC(=O)C(=O)NCc1ccccc1CN1CCC[C@@H](C)C1	ZINC000875041030	GD	On-Demand	Mild	SLC6A1	77	36
O=C(NC1CCN(C(=O)c2ccco2)CC1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875041033	GF	On-Demand	Anodyne	EPHX2	18	41
O=C(NC1CCN(C(=O)c2ccco2)CC1)NC1([C@H]2CCCCO2)CCC1	ZINC000875041034	GF	On-Demand	Anodyne	EPHX2	18	41
CCOC(=O)c1cc(C(=O)Oc2cc(OC)cc(OC)c2)cc([N+](=O)[O-])c1	ZINC000875041037	GG	On-Demand	Bother	CACNA1C	43	41
CCOC(=O)c1cc(C(=O)Oc2cc(OC)cc(OC)c2)cc([N+](=O)[O-])c1	ZINC000875041037	GG	On-Demand	Bother	CACNA1D	68	38
CCOC(=O)c1cc(C(=O)Oc2cc(OC)cc(OC)c2)cc([N+](=O)[O-])c1	ZINC000875041037	GG	On-Demand	Bother	CTRB1	25	42
C#CC[C@@H](COC)NC(=O)C(=O)NCc1ccc(CN2CCC(C)CC2)cc1	ZINC000875041046	GD	On-Demand	Mild	SIGMAR1	20	42
C#CC[C@H](COC)NC(=O)C(=O)NCc1ccc(CN2CCC(C)CC2)cc1	ZINC000875041047	GD	On-Demand	Mild	SIGMAR1	20	42
O=C(NCc1ccccc1OC(F)F)N1CCC[C@H](OC2CCC2)CC1	ZINC000875041055	FH	On-Demand	Anodyne	EPHX2	26	53
O=C(NCc1ccccc1OC(F)F)N1CCC[C@H](OC2CCC2)CC1	ZINC000875041055	FH	On-Demand	Anodyne	SCD1	20	43
O=C(NCc1ccccc1OC(F)F)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875041056	FH	On-Demand	Anodyne	EPHX2	26	53
O=C(NCc1ccccc1OC(F)F)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875041056	FH	On-Demand	Anodyne	SCD1	20	43
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1ccc(Br)c([N+](=O)[O-])c1	ZINC000875041074	JJ	On-Demand	Bother	SCD1	45	57
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1ccc(Br)c([N+](=O)[O-])c1	ZINC000875041074	JJ	On-Demand	Bother	SCD	37	57
O=C(NCC[C@H](O)C1CCCC1)NC1CCN(C(=O)c2ccco2)CC1	ZINC000875041088	FE	On-Demand	Anodyne	EPHX2	31	44
O=C(NCC[C@@H](O)C1CCCC1)NC1CCN(C(=O)c2ccco2)CC1	ZINC000875041089	FE	On-Demand	Anodyne	EPHX2	31	44
CC[C@H](C[C@H](C)O)NC(=O)NCC#Cc1ccccc1	ZINC000875041094	CD	On-Demand	Mild	MME	30	40
CC[C@H](C[C@H](C)O)NC(=O)NCC#Cc1ccccc1	ZINC000875041094	CD	On-Demand	Mild	PTGES	15	40
O=C(NCC#Cc1cccc(C(F)(F)F)c1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875041098	GG	On-Demand	Mild	CCR2	45	36
CC(=O)C1CCN(C(=O)NCC#Cc2cccc(C(F)(F)F)c2)CC1	ZINC000875041114	FG	On-Demand	Mild	CACNA1B	47	36
CC(=O)C1CCN(C(=O)NCC#Cc2cccc(C(F)(F)F)c2)CC1	ZINC000875041114	FG	On-Demand	Mild	CCR2	64	38
CC(=O)C1CCN(C(=O)NCC#Cc2cccc(C(F)(F)F)c2)CC1	ZINC000875041114	FG	On-Demand	Mild	EPHX2	20	43
C[C@H](NC(=O)NCC#Cc1ccccc1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875041156	FF	On-Demand	Mild	FPR1	42	32
C[C@H](NC(=O)NCC#Cc1ccccc1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875041156	FF	On-Demand	Mild	GPR119	15	42
C[C@@H](NC(=O)NCC#Cc1ccccc1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875041157	FF	On-Demand	Mild	FPR1	42	32
C[C@@H](NC(=O)NCC#Cc1ccccc1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875041157	FF	On-Demand	Mild	GPR119	15	42
O=C(NC1CCN(C(=O)c2ccco2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875041159	GF	On-Demand	Anodyne	GRIN2B	24	42
O=C(NC1CCN(C(=O)c2ccco2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875041159	GF	On-Demand	Anodyne	EPHX2	37	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC#Cc1ccccc1	ZINC000875041175	DD	On-Demand	Mild	SLC6A4	26	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC#Cc1ccccc1	ZINC000875041175	DD	On-Demand	Mild	SLC6A3	55	48
O=C(NC[C@H]1CC(C(F)(F)F)=NO1)NC1CCN(C(=O)c2ccco2)CC1	ZINC000875041185	GD	On-Demand	Anodyne	RBP4	20	50
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)NC1CCN(C(=O)c2ccco2)CC1	ZINC000875041186	GD	On-Demand	Anodyne	RBP4	20	50
CC(=O)[C@H]1CCCN(C(=O)NCC#Cc2cccc(C(F)(F)F)c2)C1	ZINC000875041189	FG	On-Demand	Mild	CACNA1B	45	33
CC(=O)[C@H]1CCCN(C(=O)NCC#Cc2cccc(C(F)(F)F)c2)C1	ZINC000875041189	FG	On-Demand	Mild	CCR2	71	39
CC(=O)[C@@H]1CCCN(C(=O)NCC#Cc2cccc(C(F)(F)F)c2)C1	ZINC000875041190	FG	On-Demand	Mild	CACNA1B	45	33
CC(=O)[C@@H]1CCCN(C(=O)NCC#Cc2cccc(C(F)(F)F)c2)C1	ZINC000875041190	FG	On-Demand	Mild	CCR2	71	39
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(C(=O)c2ccco2)CC1	ZINC000875041211	ED	On-Demand	Anodyne	EPHX2	29	40
O=C(NCc1ccccc1OC(F)F)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875041228	FG	On-Demand	Anodyne	EPHX2	20	49
O=C(NCc1ccccc1OC(F)F)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875041229	FG	On-Demand	Anodyne	EPHX2	20	49
O=C(NCCO)C1CCN(C(=O)NCC#Cc2ccccc2)CC1	ZINC000875041231	EC	On-Demand	Mild	EPHX2	20	41
CCCNC(=O)c1ccccc1NC(=O)[C@]1(C2CCCC2)CCNC1=O	ZINC000875041247	FE	On-Demand	Anodyne	KCNA3	40	40
CCCNC(=O)c1ccccc1NC(=O)[C@]1(C2CCCC2)CCNC1=O	ZINC000875041247	FE	On-Demand	Anodyne	HCN1	40	32
CCCNC(=O)c1ccccc1NC(=O)[C@]1(C2CCCC2)CCNC1=O	ZINC000875041247	FE	On-Demand	Anodyne	HCN4	41	34
CCCNC(=O)c1ccccc1NC(=O)[C@@]1(C2CCCC2)CCNC1=O	ZINC000875041248	FE	On-Demand	Anodyne	KCNA3	40	40
CCCNC(=O)c1ccccc1NC(=O)[C@@]1(C2CCCC2)CCNC1=O	ZINC000875041248	FE	On-Demand	Anodyne	HCN1	40	32
CCCNC(=O)c1ccccc1NC(=O)[C@@]1(C2CCCC2)CCNC1=O	ZINC000875041248	FE	On-Demand	Anodyne	HCN4	41	34
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(CN3CCCC[C@@H]3C)cc2)CC1	ZINC000875041264	GF	On-Demand	Anodyne	HRH3	25	44
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(CN3CCCC[C@H]3C)cc2)CC1	ZINC000875041265	GF	On-Demand	Anodyne	HRH3	25	44
O=C(NC1CCN(C(=O)c2ccco2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875041266	GE	On-Demand	Anodyne	EPHX2	20	43
O=C(NC1CCN(C(=O)c2ccco2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875041266	GE	On-Demand	Anodyne	RBP4	22	52
O=C(NC1CCN(C(=O)c2ccco2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875041267	GE	On-Demand	Anodyne	EPHX2	20	43
O=C(NC1CCN(C(=O)c2ccco2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875041267	GE	On-Demand	Anodyne	RBP4	22	52
CC[C@@H](NC(=O)NC1CCN(C(=O)c2ccco2)CC1)[C@H](O)c1ccccc1	ZINC000875041272	GF	On-Demand	Anodyne	EPHX2	28	42
CC[C@@H](NC(=O)NC1CCN(C(=O)c2ccco2)CC1)[C@@H](O)c1ccccc1	ZINC000875041273	GF	On-Demand	Anodyne	EPHX2	28	42
COCCN(CC1CCN(C)CC1)C(=O)NCC#Cc1ccccc1	ZINC000875041280	EE	On-Demand	Mild	ACKR3	44	33
COc1ccc([C@@H]2CN(C(=O)C(=O)NCCc3cccc(OC)c3)CCO2)cc1	ZINC000875041281	GD	On-Demand	Anodyne	DRD4	42	32
COc1ccc([C@@H]2CN(C(=O)C(=O)NCCc3cccc(OC)c3)CCO2)cc1	ZINC000875041281	GD	On-Demand	Anodyne	MTNR1A	78	42
COc1ccc([C@@H]2CN(C(=O)C(=O)NCCc3cccc(OC)c3)CCO2)cc1	ZINC000875041281	GD	On-Demand	Anodyne	MTNR1B	66	42
C=CC(C)(C)CCCNC(=O)C(=O)NCCc1cccc(OC)c1	ZINC000875041283	EE	On-Demand	Mild	DRD4	43	33
C=CC(C)(C)CCCNC(=O)C(=O)NCCc1cccc(OC)c1	ZINC000875041283	EE	On-Demand	Mild	MTNR1A	85	55
C=CC(C)(C)CCCNC(=O)C(=O)NCCc1cccc(OC)c1	ZINC000875041283	EE	On-Demand	Mild	MTNR1B	78	55
C=CC(C)(C)CCCNC(=O)C(=O)NCCc1cccc(OC)c1	ZINC000875041283	EE	On-Demand	Mild	CRTM	40	41
CONC(=O)C1CCN(C(=O)NCC#Cc2cccc(C(F)(F)F)c2)CC1	ZINC000875041286	GE	On-Demand	Mild	CCR2	62	37
CON=Cc1ccc(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cc1	ZINC000875041306	GI	On-Demand	Mild	SCD1	50	62
CON=Cc1ccc(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cc1	ZINC000875041306	GI	On-Demand	Mild	SCD	43	62
C[C@H]1CCC[C@@H](C2CN(C(=O)NC3CCN(C(=O)c4ccco4)CC3)C2)C1	ZINC000875041328	FG	On-Demand	Anodyne	L3MBTL3	43	36
Cn1nnnc1C1CCN(C(=O)NCC#Cc2cccc(C(F)(F)F)c2)CC1	ZINC000875041330	GE	On-Demand	Mild	CCR2	53	34
CCOC(=O)[C@H](C)C1CN(C(=O)NCC#Cc2cccc(C(F)(F)F)c2)C1	ZINC000875041333	GF	On-Demand	Mild	CCR2	58	36
CCOC(=O)[C@H](C)C1CN(C(=O)NCC#Cc2cccc(C(F)(F)F)c2)C1	ZINC000875041333	GF	On-Demand	Mild	PDS	41	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1OC(F)F	ZINC000875041335	FF	On-Demand	Anodyne	SLC6A4	33	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1OC(F)F	ZINC000875041335	FF	On-Demand	Anodyne	SLC6A3	74	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1OC(F)F	ZINC000875041335	FF	On-Demand	Anodyne	P2RX7	17	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1OC(F)F	ZINC000875041336	FF	On-Demand	Anodyne	SLC6A4	33	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1OC(F)F	ZINC000875041336	FF	On-Demand	Anodyne	SLC6A3	74	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1OC(F)F	ZINC000875041336	FF	On-Demand	Anodyne	P2RX7	17	40
COCC(C)(C)CCNC(=O)C(=O)NCCc1cccc(OC)c1	ZINC000875041337	ED	On-Demand	Anodyne	DRD4	45	34
COCC(C)(C)CCNC(=O)C(=O)NCCc1cccc(OC)c1	ZINC000875041337	ED	On-Demand	Anodyne	MTNR1A	92	52
COCC(C)(C)CCNC(=O)C(=O)NCCc1cccc(OC)c1	ZINC000875041337	ED	On-Demand	Anodyne	MTNR1B	83	52
O=C(NCC#Cc1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875041347	EG	On-Demand	Mild	EPHX2	30	41
O=C(NCC#Cc1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875041348	EG	On-Demand	Mild	EPHX2	30	41
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(CN3CCC(C)CC3)cc2)CC1	ZINC000875041355	GE	On-Demand	Anodyne	HRH3	18	47
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(CN3CCC(C)CC3)cc2)CC1	ZINC000875041355	GE	On-Demand	Anodyne	SIGMAR1	26	50
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(CN3CCC(C)CC3)cc2)CC1	ZINC000875041355	GE	On-Demand	Anodyne	MCHR1	17	41
O=C(NCC#Cc1ccccc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875041374	EG	On-Demand	Mild	TRY1_BOVIN	43	39
O=C(NCC#Cc1ccccc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875041374	EG	On-Demand	Mild	CPT1A	65	38
O=C(NCC#Cc1ccccc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875041374	EG	On-Demand	Mild	PREP	45	36
O=C(NCC#Cc1ccccc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875041375	EG	On-Demand	Mild	TRY1_BOVIN	43	39
O=C(NCC#Cc1ccccc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875041375	EG	On-Demand	Mild	CPT1A	65	38
O=C(NCC#Cc1ccccc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875041375	EG	On-Demand	Mild	PREP	45	36
O=C(NCC#Cc1ccccc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875041376	EG	On-Demand	Mild	TRY1_BOVIN	43	39
O=C(NCC#Cc1ccccc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875041376	EG	On-Demand	Mild	CPT1A	65	38
O=C(NCC#Cc1ccccc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875041376	EG	On-Demand	Mild	PREP	45	36
O=C(NCC#Cc1ccccc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875041377	EG	On-Demand	Mild	TRY1_BOVIN	43	39
O=C(NCC#Cc1ccccc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875041377	EG	On-Demand	Mild	CPT1A	65	38
O=C(NCC#Cc1ccccc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875041377	EG	On-Demand	Mild	PREP	45	36
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000875041379	GF	On-Demand	Mild	SLC6A3	28	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000875041379	GF	On-Demand	Mild	CCR2	49	34
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NCC#Cc2ccccc2)[C@H](O)C1	ZINC000875041385	FD	On-Demand	Mild	GPR119	37	43
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCC#Cc2ccccc2)[C@H](O)C1	ZINC000875041386	FD	On-Demand	Mild	GPR119	37	43
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NCC#Cc2ccccc2)[C@@H](O)C1	ZINC000875041387	FD	On-Demand	Mild	GPR119	37	43
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCC#Cc2ccccc2)[C@@H](O)C1	ZINC000875041388	FD	On-Demand	Mild	GPR119	37	43
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1ccccc1CSC1=NCCS1	ZINC000875041389	JK	On-Demand	Anodyne	SCD1	35	44
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1ccccc1CSC1=NCCS1	ZINC000875041389	JK	On-Demand	Anodyne	SCD	30	44
C=CCOC(=O)c1ccc(OCC(N)=O)c(OC)c1	ZINC000875041398	CC	On-Demand	Mild	ACR	20	45
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1	ZINC000875041400	JE	On-Demand	Anodyne	SCD1	32	41
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1	ZINC000875041400	JE	On-Demand	Anodyne	SCD	26	41
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1	ZINC000875041401	JE	On-Demand	Anodyne	SCD1	32	41
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1	ZINC000875041401	JE	On-Demand	Anodyne	SCD	26	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(N2CCN(C)CC2)nc1	ZINC000875041422	GD	On-Demand	Anodyne	SLC6A3	41	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(N2CCN(C)CC2)nc1	ZINC000875041423	GD	On-Demand	Anodyne	SLC6A3	41	37
O=C(NCC#Cc1cccc(C(F)(F)F)c1)NC[C@H]1C[C@H](O)C1	ZINC000875041427	EE	On-Demand	Mild	PDS	40	31
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1ccccc1CN1CCC[C@H](C)C1	ZINC000875041470	GE	On-Demand	Mild	SLC6A1	69	36
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1ccccc1CN1CCC[C@@H](C)C1	ZINC000875041471	GE	On-Demand	Mild	SLC6A1	69	36
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1ccccc1CN1CCC[C@H](C)C1	ZINC000875041472	GE	On-Demand	Mild	SLC6A1	69	36
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1ccccc1CN1CCC[C@@H](C)C1	ZINC000875041473	GE	On-Demand	Mild	SLC6A1	69	36
O=C(NCC#Cc1cccc(C(F)(F)F)c1)N1CCC2(CCNC2=O)CC1	ZINC000875041474	GE	On-Demand	Mild	CACNA1H	39	41
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(CN3CCC[C@H](C)C3)cc2)CC1	ZINC000875041478	GE	On-Demand	Anodyne	MLNR	40	34
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(CN3CCC[C@@H](C)C3)cc2)CC1	ZINC000875041479	GE	On-Demand	Anodyne	MLNR	40	34
O=C(NCC#Cc1cccc(C(F)(F)F)c1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875041482	GG	On-Demand	Mild	CACNA1B	40	33
O=C(NCC#Cc1cccc(C(F)(F)F)c1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875041482	GG	On-Demand	Mild	CCR2	44	38
O=C(NCC#Cc1cccc(C(F)(F)F)c1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875041483	GG	On-Demand	Mild	CACNA1B	40	33
O=C(NCC#Cc1cccc(C(F)(F)F)c1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875041483	GG	On-Demand	Mild	CCR2	44	38
CN1CC[C@H]2CN(C(=O)NCC#Cc3cccc(C(F)(F)F)c3)CC[C@H]21	ZINC000875041485	FF	On-Demand	Mild	CACNA1B	46	33
CN1CC[C@H]2CN(C(=O)NCC#Cc3cccc(C(F)(F)F)c3)CC[C@H]21	ZINC000875041485	FF	On-Demand	Mild	CCR2	71	40
CN1CC[C@H]2CN(C(=O)NCC#Cc3cccc(C(F)(F)F)c3)CC[C@@H]21	ZINC000875041487	FF	On-Demand	Mild	CACNA1B	46	33
CN1CC[C@H]2CN(C(=O)NCC#Cc3cccc(C(F)(F)F)c3)CC[C@@H]21	ZINC000875041487	FF	On-Demand	Mild	CCR2	71	40
O=C(CCS(=O)(=O)c1ccc(F)cc1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875041515	IH	On-Demand	Anodyne	SCD1	36	46
O=C(CCS(=O)(=O)c1ccc(F)cc1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875041515	IH	On-Demand	Anodyne	SCD	30	46
C[S@](=N)(=O)N1CCN(C(=O)NCC#Cc2cccc(C(F)(F)F)c2)CC1	ZINC000875041532	GD	On-Demand	Mild	CACNA1B	48	35
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1ccc(CN2CCC(C)CC2)cc1	ZINC000875041546	GE	On-Demand	Mild	SIGMAR1	18	42
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1ccc(CN2CCC(C)CC2)cc1	ZINC000875041547	GE	On-Demand	Mild	SIGMAR1	18	42
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1OC(F)F	ZINC000875041555	DF	On-Demand	Anodyne	ANPEP	18	48
CC[C@H](C[C@H](C)O)NC(=O)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000875041571	EF	On-Demand	Mild	PDS	44	36
O=C(NCC#Cc1ccccc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875041587	EF	On-Demand	Mild	F2	33	40
O=C(NCC#Cc1ccccc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875041587	EF	On-Demand	Mild	TRY1_BOVIN	46	40
O=C(NCC#Cc1ccccc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875041587	EF	On-Demand	Mild	PREP	44	37
O=C(NCC#Cc1ccccc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875041588	EF	On-Demand	Mild	F2	33	40
O=C(NCC#Cc1ccccc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875041588	EF	On-Demand	Mild	TRY1_BOVIN	46	40
O=C(NCC#Cc1ccccc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875041588	EF	On-Demand	Mild	PREP	44	37
O=C(NCC#Cc1ccccc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875041589	EF	On-Demand	Mild	F2	33	40
O=C(NCC#Cc1ccccc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875041589	EF	On-Demand	Mild	TRY1_BOVIN	46	40
O=C(NCC#Cc1ccccc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875041589	EF	On-Demand	Mild	PREP	44	37
O=C(NCC#Cc1ccccc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875041590	EF	On-Demand	Mild	F2	33	40
O=C(NCC#Cc1ccccc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875041590	EF	On-Demand	Mild	TRY1_BOVIN	46	40
O=C(NCC#Cc1ccccc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875041590	EF	On-Demand	Mild	PREP	44	37
O=C(NC1CCN(C(=O)c2ccco2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875041626	EE	On-Demand	Anodyne	EPHX2	26	40
O=C(NC1CCN(C(=O)c2ccco2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875041627	EE	On-Demand	Anodyne	EPHX2	26	40
O=C(NC1CCN(C(=O)c2ccco2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875041628	EE	On-Demand	Anodyne	EPHX2	26	40
O=C(NC1CCN(C(=O)c2ccco2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875041629	EE	On-Demand	Anodyne	EPHX2	26	40
CCOC(=O)[C@@H]1CN(C(=O)C(=O)NCCc2cccc(OC)c2)CC12COC2	ZINC000875041633	GC	On-Demand	Anodyne	MTNR1A	45	44
CCOC(=O)[C@@H]1CN(C(=O)C(=O)NCCc2cccc(OC)c2)CC12COC2	ZINC000875041633	GC	On-Demand	Anodyne	MTNR1B	42	44
C[C@@H]1CN(C(=O)NCc2ccccc2OC(F)F)CC[C@@H](C(F)(F)F)O1	ZINC000875041652	GH	On-Demand	Anodyne	EPHX2	16	48
C[C@@H]1CN(C(=O)NCc2ccccc2OC(F)F)CC[C@H](C(F)(F)F)O1	ZINC000875041653	GH	On-Demand	Anodyne	EPHX2	16	48
CCCNC(=O)c1ccccc1NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875041666	FG	On-Demand	Anodyne	G2YM83_BOTF4	66	35
CCCNC(=O)c1ccccc1NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875041666	FG	On-Demand	Anodyne	POLR1A	45	34
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2OC(F)F)CC1	ZINC000875041680	FD	On-Demand	Anodyne	EPHX2	29	47
CC[C@@H](NC(=O)NCc1ccc(C(=O)N(C)C)cc1)[C@@H](O)c1ccccc1	ZINC000875041729	FF	On-Demand	Anodyne	ANPEP	15	43
CC[C@@H](NC(=O)NCc1ccc(C(=O)N(C)C)cc1)[C@@H](O)c1ccccc1	ZINC000875041729	FF	On-Demand	Anodyne	PDS	42	34
CC[C@@H](NC(=O)NCc1ccc(C(=O)N(C)C)cc1)[C@H](O)c1ccccc1	ZINC000875041732	FF	On-Demand	Anodyne	ANPEP	15	43
CC[C@@H](NC(=O)NCc1ccc(C(=O)N(C)C)cc1)[C@H](O)c1ccccc1	ZINC000875041732	FF	On-Demand	Anodyne	PDS	42	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2cccc(OCC(F)(F)F)c2)C1	ZINC000875041740	GE	On-Demand	Anodyne	DPP7	19	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2cccc(OCC(F)(F)F)c2)C1	ZINC000875041740	GE	On-Demand	Anodyne	PDS	47	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2cccc(OCC(F)(F)F)c2)C1	ZINC000875041741	GE	On-Demand	Anodyne	DPP7	19	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2cccc(OCC(F)(F)F)c2)C1	ZINC000875041741	GE	On-Demand	Anodyne	PDS	47	35
N#CCSc1ccccc1C(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875041746	HJ	On-Demand	Mild	SCD1	39	49
N#CCSc1ccccc1C(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875041746	HJ	On-Demand	Mild	SCD	33	49
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(C(=O)N(C)C)cc1	ZINC000875041759	DD	On-Demand	Anodyne	ANPEP	15	42
COC(=O)N(C)NC(=O)NCc1ccc(C(=O)N(C)C)cc1	ZINC000875041772	DC	On-Demand	Reactive	MT-ND1	18	40
C[C@@H]1CN(CCCNC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)C[C@@H](C)O1	ZINC000875041773	GF	On-Demand	Mild	CCR3	28	44
C[C@@H]1CN(CCCNC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)C[C@@H](C)O1	ZINC000875041774	GF	On-Demand	Mild	CCR3	28	44
O=C1O[C@H](C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)Cc2ccccc21	ZINC000875041777	HH	On-Demand	Anodyne	SCD1	34	44
O=C1O[C@H](C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)Cc2ccccc21	ZINC000875041777	HH	On-Demand	Anodyne	SCD	30	44
O=C1O[C@@H](C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)Cc2ccccc21	ZINC000875041778	HH	On-Demand	Anodyne	SCD1	34	44
O=C1O[C@@H](C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)Cc2ccccc21	ZINC000875041778	HH	On-Demand	Anodyne	SCD	30	44
CC(C)CN1CCC(NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)CC1	ZINC000875041790	GG	On-Demand	Anodyne	OPRL1	19	45
COC(=O)C1CCN(C(=O)[C@@H](C)OC(=O)c2ccc(OCC(N)=O)c(OC)c2)CC1	ZINC000875041830	HC	On-Demand	Anodyne	PTR1	47	34
COC(=O)C1CCN(C(=O)[C@H](C)OC(=O)c2ccc(OCC(N)=O)c(OC)c2)CC1	ZINC000875041831	HC	On-Demand	Anodyne	PTR1	47	34
O=C(NCc1ccc(OCC(F)(F)F)cc1)N1CCC(CO)(CO)CC1	ZINC000875041837	GD	On-Demand	Anodyne	EPHX2	18	43
O=C(Nc1cccc2cccnc12)C1(F)CCOCC1	ZINC000875041839	CF	On-Demand	Anodyne	WNT3	15	42
O=C(Nc1cccc2cccnc12)C1(F)CCOCC1	ZINC000875041839	CF	On-Demand	Anodyne	G2YM83_BOTF4	45	33
CN1CC[C@H]2CN(C(=O)C(=O)NCc3cccc(OCC(F)(F)F)c3)CC[C@H]21	ZINC000875041883	GD	On-Demand	Anodyne	PDS	42	34
CN1CC[C@H]2CN(C(=O)C(=O)NCc3cccc(OCC(F)(F)F)c3)CC[C@@H]21	ZINC000875041884	GD	On-Demand	Anodyne	PDS	42	34
COC(=O)c1ccc(CCNC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)cc1	ZINC000875041912	FD	On-Demand	Anodyne	SLC6A4	24	40
COC(=O)c1ccc(CCNC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)cc1	ZINC000875041912	FD	On-Demand	Anodyne	SLC6A3	46	40
COC(=O)c1ccc(CCNC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)cc1	ZINC000875041913	FD	On-Demand	Anodyne	SLC6A4	24	40
COC(=O)c1ccc(CCNC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)cc1	ZINC000875041913	FD	On-Demand	Anodyne	SLC6A3	46	40
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(CC(C)C)CC1	ZINC000875041930	CD	On-Demand	Anodyne	EPHX2	17	40
CC(C)CN1CCC(NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875041940	FG	On-Demand	Anodyne	BIRC2	30	40
CC(C)CN1CCC(NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875041940	FG	On-Demand	Anodyne	WNT3	41	32
CC(C)CN1CCC(NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875041941	FG	On-Demand	Anodyne	BIRC2	30	40
CC(C)CN1CCC(NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875041941	FG	On-Demand	Anodyne	WNT3	41	32
CC(C)CN1CCC(NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875041942	FG	On-Demand	Anodyne	BIRC2	30	40
CC(C)CN1CCC(NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875041942	FG	On-Demand	Anodyne	WNT3	41	32
CC(C)CN1CCC(NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875041943	FG	On-Demand	Anodyne	BIRC2	30	40
CC(C)CN1CCC(NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875041943	FG	On-Demand	Anodyne	WNT3	41	32
CC[C@H](C[C@H](C)O)NC(=O)NCCc1ccc(C(=O)OC)cc1	ZINC000875041956	DD	On-Demand	Anodyne	ADRB1	21	40
CC[C@H](C[C@H](C)O)NC(=O)NCCc1ccc(C(=O)OC)cc1	ZINC000875041956	DD	On-Demand	Anodyne	ADRB3	18	40
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)[C@H]1CSCCS1	ZINC000875041958	FH	On-Demand	Anodyne	SCD1	35	46
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)[C@H]1CSCCS1	ZINC000875041958	FH	On-Demand	Anodyne	SCD	29	46
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)[C@@H]1CSCCS1	ZINC000875041959	FH	On-Demand	Anodyne	SCD1	35	46
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)[C@@H]1CSCCS1	ZINC000875041959	FH	On-Demand	Anodyne	SCD	29	46
O=C(Nc1cccc2cccnc12)C1([C@@H]2CCCCO2)CCC1	ZINC000875041997	DH	On-Demand	Anodyne	WNT3	15	43
O=C(Nc1cccc2cccnc12)C1([C@H]2CCCCO2)CCC1	ZINC000875041998	DH	On-Demand	Anodyne	WNT3	15	43
O=C(NCc1nc(-c2ccncc2)cs1)N[C@H]1CCCc2nc(O)ccc21	ZINC000875042045	GG	On-Demand	Anodyne	ROCK1	19	40
O=C(NCc1nc(-c2ccncc2)cs1)N[C@@H]1CCCc2nc(O)ccc21	ZINC000875042046	GG	On-Demand	Anodyne	ROCK1	19	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)c2ccc(OCC(N)=O)c(OC)c2)CC1	ZINC000875042064	IC	On-Demand	Anodyne	P2RY12	72	38
CCOC(=O)N1CCN(C(=O)[C@H](C)OC(=O)c2ccc(OCC(N)=O)c(OC)c2)CC1	ZINC000875042065	IC	On-Demand	Anodyne	P2RY12	72	38
O=C(Nc1cccc2cccnc12)c1c(C(F)F)nc2n1CCCC2	ZINC000875042091	EH	On-Demand	Anodyne	WNT3	15	40
C[C@@H]1CN(CCCNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)C[C@@H](C)O1	ZINC000875042099	GE	On-Demand	Anodyne	ADRA1D	16	41
C[C@@H]1CN(CCCNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)C[C@@H](C)O1	ZINC000875042099	GE	On-Demand	Anodyne	ADRA1A	30	41
C[C@@H]1CN(CCCNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)C[C@@H](C)O1	ZINC000875042099	GE	On-Demand	Anodyne	ADRA1B	23	42
C[C@@H]1CN(CCCNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)C[C@@H](C)O1	ZINC000875042099	GE	On-Demand	Anodyne	TRY1_BOVIN	47	35
C[C@@H]1CN(CCCNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)C[C@@H](C)O1	ZINC000875042100	GE	On-Demand	Anodyne	ADRA1D	16	41
C[C@@H]1CN(CCCNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)C[C@@H](C)O1	ZINC000875042100	GE	On-Demand	Anodyne	ADRA1A	30	41
C[C@@H]1CN(CCCNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)C[C@@H](C)O1	ZINC000875042100	GE	On-Demand	Anodyne	ADRA1B	23	42
C[C@@H]1CN(CCCNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)C[C@@H](C)O1	ZINC000875042100	GE	On-Demand	Anodyne	TRY1_BOVIN	47	35
C#CC[C@H](COC)NC(=O)C(=O)NCc1cccc(OCC(F)(F)F)c1	ZINC000875042125	FD	On-Demand	Mild	PDS	69	39
C#CC[C@@H](COC)NC(=O)C(=O)NCc1cccc(OCC(F)(F)F)c1	ZINC000875042126	FD	On-Demand	Mild	PDS	69	39
NC(=O)c1ccc(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cc1	ZINC000875042154	FG	On-Demand	Anodyne	ITK	15	45
NC(=O)c1ccc(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cc1	ZINC000875042154	FG	On-Demand	Anodyne	SCD1	51	66
NC(=O)c1ccc(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cc1	ZINC000875042154	FG	On-Demand	Anodyne	SCD	44	66
CC(C)CN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875042155	EG	On-Demand	Anodyne	DRD2	15	54
CC(C)CN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875042155	EG	On-Demand	Anodyne	DRD4	25	54
CC(C)CN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875042155	EG	On-Demand	Anodyne	LTA4H	23	42
CC(C)CN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875042155	EG	On-Demand	Anodyne	SIGMAR1	28	47
CC(C)CN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875042155	EG	On-Demand	Anodyne	CCR3	32	41
CC(C)CN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875042155	EG	On-Demand	Anodyne	EPHX2	46	46
CC(C)CN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875042155	EG	On-Demand	Anodyne	CXCR3	20	40
CC(C)CN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875042155	EG	On-Demand	Anodyne	MCHR1	21	40
CN1CCN(C(=O)c2ccc(CNC(=O)C(=O)N[C@H]3CC34CCC4)cc2)CC1	ZINC000875042163	GC	On-Demand	Anodyne	L3MBTL3	43	39
CN1CCN(C(=O)c2ccc(CNC(=O)C(=O)N[C@@H]3CC34CCC4)cc2)CC1	ZINC000875042164	GC	On-Demand	Anodyne	L3MBTL3	43	39
N#Cc1ccc(Cn2cc(NC(=O)NCC3CC3)cn2)cc1	ZINC000875042187	CE	On-Demand	Mild	CCR3	27	45
N#Cc1ccc(Cn2cc(NC(=O)NCC3CC3)cn2)cc1	ZINC000875042187	CE	On-Demand	Mild	ITK	20	54
N#Cc1ccc(Cn2cc(NC(=O)NCC3CC3)cn2)cc1	ZINC000875042187	CE	On-Demand	Mild	PANC	59	40
O=C(Nc1cccc2cccnc12)C1([C@@H]2CCCCO2)CCOCC1	ZINC000875042208	EH	On-Demand	Anodyne	WNT3	15	42
O=C(Nc1cccc2cccnc12)C1([C@H]2CCCCO2)CCOCC1	ZINC000875042209	EH	On-Demand	Anodyne	WNT3	15	42
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000875042219	JJ	On-Demand	Anodyne	SCD1	38	45
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000875042219	JJ	On-Demand	Anodyne	SCD	31	45
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000875042219	JJ	On-Demand	Anodyne	NAMPT	34	44
O=C(NCC1CC1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875042248	EF	On-Demand	Anodyne	SMO	25	42
C[C@]1(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)Cc2ccccc2C(=O)O1	ZINC000875042290	HI	On-Demand	Anodyne	SCD1	36	45
C[C@]1(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)Cc2ccccc2C(=O)O1	ZINC000875042290	HI	On-Demand	Anodyne	SCD	31	45
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OCC(F)(F)F)cc1	ZINC000875042324	EF	On-Demand	Anodyne	ANPEP	15	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OCC(F)(F)F)cc1	ZINC000875042324	EF	On-Demand	Anodyne	PDS	71	38
O=C(NCc1ccc(OCC(F)(F)F)cc1)N1Cc2cccc(O)c2C1	ZINC000875042330	FH	On-Demand	Clean	NAMPT	26	45
O=C1C[C@@H](C(F)(F)F)[C@H](C(=O)Nc2cccc3cccnc23)CN1	ZINC000875042336	EE	On-Demand	Anodyne	WNT3	18	45
O=C1C[C@H](C(F)(F)F)[C@H](C(=O)Nc2cccc3cccnc23)CN1	ZINC000875042337	EE	On-Demand	Anodyne	WNT3	18	45
O=C1C[C@H](C(F)(F)F)[C@@H](C(=O)Nc2cccc3cccnc23)CN1	ZINC000875042338	EE	On-Demand	Anodyne	WNT3	18	45
O=C1C[C@@H](C(F)(F)F)[C@@H](C(=O)Nc2cccc3cccnc23)CN1	ZINC000875042339	EE	On-Demand	Anodyne	WNT3	18	45
CC(C)CN1CCC(NC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875042342	GH	On-Demand	Mild	MCHR1	51	47
CC(C)CN1CCC(NC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875042343	GH	On-Demand	Mild	MCHR1	51	47
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)[C@@H]1CC(=O)N(C2CCCC2)C1	ZINC000875042368	HH	On-Demand	Anodyne	INHA	23	51
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)[C@@H]1CC(=O)N(C2CCCC2)C1	ZINC000875042368	HH	On-Demand	Anodyne	SCD1	32	41
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)[C@@H]1CC(=O)N(C2CCCC2)C1	ZINC000875042368	HH	On-Demand	Anodyne	SCD	27	41
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)[C@H]1CC(=O)N(C2CCCC2)C1	ZINC000875042369	HH	On-Demand	Anodyne	INHA	23	51
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)[C@H]1CC(=O)N(C2CCCC2)C1	ZINC000875042369	HH	On-Demand	Anodyne	SCD1	32	41
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)[C@H]1CC(=O)N(C2CCCC2)C1	ZINC000875042369	HH	On-Demand	Anodyne	SCD	27	41
C[C@@H]1CN(CCCNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C[C@@H](C)O1	ZINC000875042386	GE	On-Demand	Mild	CCR3	34	49
C[C@@H]1CN(CCCNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C[C@@H](C)O1	ZINC000875042386	GE	On-Demand	Mild	ITK	15	47
C[C@@H]1CN(CCCNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C[C@@H](C)O1	ZINC000875042386	GE	On-Demand	Mild	PANC	53	35
CN(C)S(=O)(=O)c1cc(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)ccc1Cl	ZINC000875042398	JI	On-Demand	Anodyne	SCD1	48	57
CN(C)S(=O)(=O)c1cc(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)ccc1Cl	ZINC000875042398	JI	On-Demand	Anodyne	SCD	41	57
CCOC(=O)N1CCC(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)CC1	ZINC000875042401	HH	On-Demand	Anodyne	SCD1	36	46
CCOC(=O)N1CCC(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)CC1	ZINC000875042401	HH	On-Demand	Anodyne	SCD	31	46
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)C1CCN(C(=O)/C=C\c2ccccc2)CC1	ZINC000875042402	JJ	On-Demand	Anodyne	SCD1	32	41
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)C1CCN(C(=O)/C=C\c2ccccc2)CC1	ZINC000875042402	JJ	On-Demand	Anodyne	SCD	28	41
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)C1CCN(C(=O)/C=C\c2ccccc2)CC1	ZINC000875042402	JJ	On-Demand	Anodyne	MGEA5	35	40
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)C1CCN(C(=O)/C=C/c2ccccc2)CC1	ZINC000875042403	JJ	On-Demand	Anodyne	SCD1	32	41
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)C1CCN(C(=O)/C=C/c2ccccc2)CC1	ZINC000875042403	JJ	On-Demand	Anodyne	SCD	28	41
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)C1CCN(C(=O)/C=C/c2ccccc2)CC1	ZINC000875042403	JJ	On-Demand	Anodyne	MGEA5	35	40
O=C(Nc1cccc2cccnc12)[C@@]12CCCC[C@@H]1C2	ZINC000875042409	CH	On-Demand	Anodyne	WNT3	19	44
O=C(Nc1cccc2cccnc12)[C@]12CCCC[C@@H]1C2	ZINC000875042410	CH	On-Demand	Anodyne	WNT3	19	44
O=C(Nc1cccc2cccnc12)[C@]12CCCC[C@H]1C2	ZINC000875042411	CH	On-Demand	Anodyne	WNT3	19	44
O=C(Nc1cccc2cccnc12)[C@@]12CCCC[C@H]1C2	ZINC000875042412	CH	On-Demand	Anodyne	WNT3	19	44
O=C(NCc1ccccc1OC1CCCC1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875042437	GD	On-Demand	Anodyne	EPHX2	16	41
C[C@]1(C(F)(F)F)CN(C(=O)Nc2cccc(OCC(N)=O)c2)CCO1	ZINC000875042456	FD	On-Demand	Anodyne	EPHX2	51	47
CN1CC[C@H]2CN(C(=O)Nc3cccc(OCC(N)=O)c3)CC[C@H]21	ZINC000875042472	ED	On-Demand	Anodyne	CCR3	20	43
CN1CC[C@H]2CN(C(=O)Nc3cccc(OCC(N)=O)c3)CC[C@H]21	ZINC000875042472	ED	On-Demand	Anodyne	LIMK2	32	41
CN1CC[C@H]2CN(C(=O)Nc3cccc(OCC(N)=O)c3)CC[C@@H]21	ZINC000875042473	ED	On-Demand	Anodyne	CCR3	20	43
CN1CC[C@H]2CN(C(=O)Nc3cccc(OCC(N)=O)c3)CC[C@@H]21	ZINC000875042473	ED	On-Demand	Anodyne	LIMK2	32	41
O=C(NCC[C@H](O)C1CCCC1)NCc1ccnc(N2CCCC2)c1	ZINC000875042485	EE	On-Demand	Anodyne	GPBAR1	18	42
O=C(NCC[C@@H](O)C1CCCC1)NCc1ccnc(N2CCCC2)c1	ZINC000875042486	EE	On-Demand	Anodyne	GPBAR1	18	42
NC(=O)COc1cccc(NC(=O)N2CC[C@@]3(CCc4ccccc43)C2)c1	ZINC000875042497	FF	On-Demand	Anodyne	NPY5R	35	42
NC(=O)COc1cccc(NC(=O)N2CC[C@@]3(CCc4ccccc43)C2)c1	ZINC000875042497	FF	On-Demand	Anodyne	EPHX2	36	45
NC(=O)COc1cccc(NC(=O)N2CC[C@]3(CCc4ccccc43)C2)c1	ZINC000875042498	FF	On-Demand	Anodyne	NPY5R	35	42
NC(=O)COc1cccc(NC(=O)N2CC[C@]3(CCc4ccccc43)C2)c1	ZINC000875042498	FF	On-Demand	Anodyne	EPHX2	36	45
NC(=O)COc1cccc(NC(=O)NC[C@@H]2CC=CC[C@H]2C(F)(F)F)c1	ZINC000875042506	FF	On-Demand	Anodyne	EPHX2	22	40
C[C@@H]1CN(CCCNC(=O)N2CCC[C@](O)(c3ccccc3)C2)C[C@@H](C)O1	ZINC000875042555	GE	On-Demand	Anodyne	ADRA1A	48	38
C[C@@H]1CN(CCCNC(=O)N2CCC[C@](O)(c3ccccc3)C2)C[C@@H](C)O1	ZINC000875042555	GE	On-Demand	Anodyne	CCR1	32	40
C[C@@H]1CN(CCCNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)C[C@@H](C)O1	ZINC000875042557	GE	On-Demand	Anodyne	ADRA1A	48	38
C[C@@H]1CN(CCCNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)C[C@@H](C)O1	ZINC000875042557	GE	On-Demand	Anodyne	CCR1	32	40
NC(=O)COc1cccc(NC(=O)NCCCCC2CC2)c1	ZINC000875042563	DE	On-Demand	Anodyne	HRH2	36	48
NC(=O)COc1cccc(NC(=O)NCCCCC2CC2)c1	ZINC000875042563	DE	On-Demand	Anodyne	CCR3	55	46
NC(=O)COc1cccc(NC(=O)NCCCCC2CC2)c1	ZINC000875042563	DE	On-Demand	Anodyne	EPHX2	32	43
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(OCC(F)(F)F)c2)CC1	ZINC000875042564	GE	On-Demand	Anodyne	EPHX2	17	43
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(OCC(F)(F)F)c2)CC1	ZINC000875042564	GE	On-Demand	Anodyne	PDS	56	37
O=C(NCC[C@@H]1CCSC1)C(=O)NCc1cccc(OCC(F)(F)F)c1	ZINC000875042575	GF	On-Demand	Anodyne	PDS	43	36
O=C(NCc1ccnc(N2CCCC2)c1)N1Cc2cccc(O)c2C1	ZINC000875042576	EF	On-Demand	Clean	NAMPT	25	42
O=C(NCC[C@H]1CCSC1)C(=O)NCc1cccc(OCC(F)(F)F)c1	ZINC000875042577	GF	On-Demand	Anodyne	PDS	43	36
NC(=O)COc1cccc(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)c1	ZINC000875042578	GD	On-Demand	Anodyne	HRH2	26	40
NC(=O)COc1cccc(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)c1	ZINC000875042578	GD	On-Demand	Anodyne	PLA2G2A	53	36
NC(=O)COc1cccc(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)c1	ZINC000875042578	GD	On-Demand	Anodyne	NPFFR2	30	41
NC(=O)COc1cccc(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)c1	ZINC000875042578	GD	On-Demand	Anodyne	FAAH	30	55
NC(=O)COc1cccc(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)c1	ZINC000875042578	GD	On-Demand	Anodyne	EPHX2	31	42
NC(=O)COc1cccc(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)c1	ZINC000875042578	GD	On-Demand	Anodyne	NPFFR1	40	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(=O)N(C)C)cc1	ZINC000875042579	FD	On-Demand	Anodyne	SLC6A4	28	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(=O)N(C)C)cc1	ZINC000875042579	FD	On-Demand	Anodyne	SLC6A3	51	40
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NC1CCN(C2CCCC2)CC1	ZINC000875042580	GD	On-Demand	Anodyne	SIGMAR1	18	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(=O)N(C)C)cc1	ZINC000875042581	FD	On-Demand	Anodyne	SLC6A4	28	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(=O)N(C)C)cc1	ZINC000875042581	FD	On-Demand	Anodyne	SLC6A3	51	40
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NC1CCN(C2CCCC2)CC1	ZINC000875042582	GD	On-Demand	Anodyne	SIGMAR1	18	43
CC(C)CN1CCC(NC(=O)N[C@@H]2CC(C)(C)CC[C@H]2O)CC1	ZINC000875042593	EE	On-Demand	Anodyne	EPHX2	20	47
CC[C@]1(C(=O)Nc2cccc3cccnc23)CCNC1=O	ZINC000875042604	CE	On-Demand	Anodyne	G2YM83_BOTF4	64	34
CN1CCC(CNC(=O)N[C@H]2CCCc3nc(O)ccc32)(c2ccccc2)CC1	ZINC000875042623	GG	On-Demand	Anodyne	KCNA3	44	35
CN1CCC(CNC(=O)N[C@@H]2CCCc3nc(O)ccc32)(c2ccccc2)CC1	ZINC000875042624	GG	On-Demand	Anodyne	KCNA3	44	35
Cc1cc(OCC(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)no1	ZINC000875042629	FG	On-Demand	Anodyne	SCD1	37	48
Cc1cc(OCC(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)no1	ZINC000875042629	FG	On-Demand	Anodyne	SCD	31	48
O=C(NCc1ccnc(N2CCCC2)c1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875042631	GF	On-Demand	Anodyne	NAMPT	21	40
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cccnc1SC(F)F	ZINC000875042640	HJ	On-Demand	Anodyne	SCD1	38	48
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cccnc1SC(F)F	ZINC000875042640	HJ	On-Demand	Anodyne	SCD	33	48
CC[C@@H](NC(=O)NCc1ccnc(N2CCCC2)c1)[C@@H](O)c1ccccc1	ZINC000875042651	FF	On-Demand	Anodyne	KCNQ2	50	36
CC[C@@H](NC(=O)NCc1ccnc(N2CCCC2)c1)[C@H](O)c1ccccc1	ZINC000875042652	FF	On-Demand	Anodyne	KCNQ2	50	36
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)c1	ZINC000875042737	JH	On-Demand	Anodyne	SCD1	40	49
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)c1	ZINC000875042737	JH	On-Demand	Anodyne	SCD	33	49
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCC(F)(F)F)cc1	ZINC000875042798	GF	On-Demand	Anodyne	SLC6A4	23	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCC(F)(F)F)cc1	ZINC000875042798	GF	On-Demand	Anodyne	SLC6A3	43	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCC(F)(F)F)cc1	ZINC000875042799	GF	On-Demand	Anodyne	SLC6A4	23	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCC(F)(F)F)cc1	ZINC000875042799	GF	On-Demand	Anodyne	SLC6A3	43	42
CC(C)CN1CCC(NC(=O)NC[C@H]2C[C@H](O)C2)CC1	ZINC000875042802	CD	On-Demand	Anodyne	EPHX2	21	40
CC[C@@H](NC(=O)NC1CCN(CC(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000875042808	EF	On-Demand	Anodyne	CCR5	33	41
CC[C@@H](NC(=O)NC1CCN(CC(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000875042808	EF	On-Demand	Anodyne	EPHX2	27	42
CC[C@@H](NC(=O)NC1CCN(CC(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000875042808	EF	On-Demand	Anodyne	XIAP	49	36
CC[C@@H](NC(=O)NC1CCN(CC(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000875042808	EF	On-Demand	Anodyne	BIRC8	44	31
CC[C@@H](NC(=O)NC1CCN(CC(C)C)CC1)[C@H](O)c1ccccc1	ZINC000875042811	EF	On-Demand	Anodyne	CCR5	33	41
CC[C@@H](NC(=O)NC1CCN(CC(C)C)CC1)[C@H](O)c1ccccc1	ZINC000875042811	EF	On-Demand	Anodyne	EPHX2	27	42
CC[C@@H](NC(=O)NC1CCN(CC(C)C)CC1)[C@H](O)c1ccccc1	ZINC000875042811	EF	On-Demand	Anodyne	XIAP	49	36
CC[C@@H](NC(=O)NC1CCN(CC(C)C)CC1)[C@H](O)c1ccccc1	ZINC000875042811	EF	On-Demand	Anodyne	BIRC8	44	31
C[C@@H]1CN(CCCNC(=O)N2CC[C@H](C(C)(C)O)C2)C[C@@H](C)O1	ZINC000875042823	ED	On-Demand	Anodyne	ERG2	17	40
C[C@@H]1CN(CCCNC(=O)N2CC[C@H](C(C)(C)O)C2)C[C@@H](C)O1	ZINC000875042823	ED	On-Demand	Anodyne	Q2TU57_MAIZE	18	40
C[C@@H]1CN(CCCNC(=O)N2CC[C@@H](C(C)(C)O)C2)C[C@@H](C)O1	ZINC000875042825	ED	On-Demand	Anodyne	ERG2	17	40
C[C@@H]1CN(CCCNC(=O)N2CC[C@@H](C(C)(C)O)C2)C[C@@H](C)O1	ZINC000875042825	ED	On-Demand	Anodyne	Q2TU57_MAIZE	18	40
CC(C)CN1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875042832	GG	On-Demand	Mild	SIGMAR1	15	43
CC(C)CN1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875042832	GG	On-Demand	Mild	CCR3	30	41
CC(C)CN1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875042832	GG	On-Demand	Mild	ITK	16	47
CC(C)CN1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875042832	GG	On-Demand	Mild	MLNR	29	41
CC(C)CN1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875042832	GG	On-Demand	Mild	EPHX2	28	40
CC(C)CN1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875042832	GG	On-Demand	Mild	MCHR1	26	45
CC(C)CN1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875042832	GG	On-Demand	Mild	PANC	53	37
O=C(NCc1ccc(OCC(F)(F)F)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875042849	EE	On-Demand	Anodyne	CACNA1I	16	40
CC(C)CN1CCC(NC(=O)NCC[C@H](O)C2CCCC2)CC1	ZINC000875042852	EE	On-Demand	Anodyne	EPHX2	17	42
CC(C)CN1CCC(NC(=O)NCC[C@@H](O)C2CCCC2)CC1	ZINC000875042853	EE	On-Demand	Anodyne	EPHX2	17	42
COC(=O)[C@@H]1CN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C[C@@H](C)O1	ZINC000875042866	GD	On-Demand	Anodyne	L3MBTL3	49	35
O=C(CCNC(=O)N1CCC[C@@](O)(c2ccccc2)C1)N1CCOCC1	ZINC000875042881	FC	On-Demand	Anodyne	EPHX2	16	55
O=C(CCNC(=O)N1CCC[C@](O)(c2ccccc2)C1)N1CCOCC1	ZINC000875042882	FC	On-Demand	Anodyne	EPHX2	16	55
COC(=O)C1(O)CN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000875042895	FC	On-Demand	Anodyne	L3MBTL3	59	36
COC(=O)C1(O)CN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000875042895	FC	On-Demand	Anodyne	NAMPT	26	44
C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875042900	FE	On-Demand	Anodyne	L3MBTL3	88	41
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875042902	FE	On-Demand	Anodyne	L3MBTL3	88	41
C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875042903	FE	On-Demand	Anodyne	L3MBTL3	88	41
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N[C@@]12CCCC[C@H]1C2	ZINC000875042917	EG	On-Demand	Anodyne	L3MBTL3	78	40
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N[C@]12CCCC[C@H]1C2	ZINC000875042919	EG	On-Demand	Anodyne	L3MBTL3	78	40
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N[C@]12CCCC[C@@H]1C2	ZINC000875042922	EG	On-Demand	Anodyne	L3MBTL3	78	40
C#C[C@@H]1CC[C@@H](NC(=O)Nc2cccc(OCC(N)=O)c2)CC1	ZINC000875042923	DD	On-Demand	Mild	CCR3	15	41
C#C[C@@H]1CC[C@@H](NC(=O)Nc2cccc(OCC(N)=O)c2)CC1	ZINC000875042923	DD	On-Demand	Mild	EPHX2	51	49
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N[C@@]12CCCC[C@@H]1C2	ZINC000875042924	EG	On-Demand	Anodyne	L3MBTL3	78	40
CN1CCO[C@H](CN(C)C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000875042952	FD	On-Demand	Anodyne	L3MBTL3	53	35
O=C(NCCO)C1CCN(C(=O)NCc2ccnc(N3CCCCC3)c2)CC1	ZINC000875042957	GD	On-Demand	Anodyne	EPHX2	18	44
O=C(NCCO)C1CCN(C(=O)NCc2ccnc(N3CCCCC3)c2)CC1	ZINC000875042957	GD	On-Demand	Anodyne	GPBAR1	23	43
CN1CCN(C(=O)Nc2cccc(OCC(N)=O)c2)CCC1(C)C	ZINC000875042980	ED	On-Demand	Anodyne	CACNA1H	41	35
CN1CCN(C(=O)Nc2cccc(OCC(N)=O)c2)CCC1(C)C	ZINC000875042980	ED	On-Demand	Anodyne	PDGFRB	44	36
CN1CCN(C(=O)Nc2cccc(OCC(N)=O)c2)CCC1(C)C	ZINC000875042980	ED	On-Demand	Anodyne	FAAH	17	40
CN1CCN(C(=O)Nc2cccc(OCC(N)=O)c2)CCC1(C)C	ZINC000875042980	ED	On-Demand	Anodyne	S1PR2	27	41
CN1CCN(C(=O)Nc2cccc(OCC(N)=O)c2)CCC1(C)C	ZINC000875042980	ED	On-Demand	Anodyne	EPHX2	33	43
CN1CCN(C(=O)Nc2cccc(OCC(N)=O)c2)CCC1(C)C	ZINC000875042980	ED	On-Demand	Anodyne	LIMK2	28	41
CCCCCCCNC(=O)C(=O)NC1CCN(C2CCCC2)CC1	ZINC000875042985	EF	On-Demand	Mild	ASAH1	53	33
CN(CCNC(=O)NCc1ccc(C(=O)N2CCCC2)cc1)CC(F)F	ZINC000875042988	FD	On-Demand	Anodyne	L3MBTL3	45	36
NC(=O)COc1cccc(NC(=O)N2CCC[C@@](F)(c3ccccc3)C2)c1	ZINC000875042999	FG	On-Demand	Anodyne	EPHX2	45	46
NC(=O)COc1cccc(NC(=O)N2CCC[C@](F)(c3ccccc3)C2)c1	ZINC000875043000	FG	On-Demand	Anodyne	EPHX2	45	46
Cc1csc([C@H]2CCN(C(=O)Nc3cccc(OCC(N)=O)c3)C2)n1	ZINC000875043012	FE	On-Demand	Anodyne	CPT1A	43	40
Cc1csc([C@H]2CCN(C(=O)Nc3cccc(OCC(N)=O)c3)C2)n1	ZINC000875043012	FE	On-Demand	Anodyne	LIMK2	34	44
C[C@]1(C(F)(F)F)CCN(C(=O)Nc2cccc(OCC(N)=O)c2)C1	ZINC000875043017	EE	On-Demand	Anodyne	S1PR2	26	40
C[C@]1(C(F)(F)F)CCN(C(=O)Nc2cccc(OCC(N)=O)c2)C1	ZINC000875043017	EE	On-Demand	Anodyne	EPHX2	49	52
NC(=O)CCOC(=O)[C@@H]1CCCN(C(=O)Nc2ccccc2)C1	ZINC000875043021	DD	On-Demand	Anodyne	FKBP1A	30	48
NC(=O)CCOC(=O)[C@@H]1CCCN(C(=O)Nc2ccccc2)C1	ZINC000875043021	DD	On-Demand	Anodyne	SLC6A1	74	37
NC(=O)CCOC(=O)[C@@H]1CCCN(C(=O)Nc2ccccc2)C1	ZINC000875043021	DD	On-Demand	Anodyne	EPHX2	16	44
NC(=O)CCOC(=O)[C@@H]1CCCN(C(=O)Nc2ccccc2)C1	ZINC000875043021	DD	On-Demand	Anodyne	DPP7	38	40
NC(=O)CCOC(=O)[C@H]1CCCN(C(=O)Nc2ccccc2)C1	ZINC000875043022	DD	On-Demand	Anodyne	FKBP1A	30	48
NC(=O)CCOC(=O)[C@H]1CCCN(C(=O)Nc2ccccc2)C1	ZINC000875043022	DD	On-Demand	Anodyne	SLC6A1	74	37
NC(=O)CCOC(=O)[C@H]1CCCN(C(=O)Nc2ccccc2)C1	ZINC000875043022	DD	On-Demand	Anodyne	EPHX2	16	44
NC(=O)CCOC(=O)[C@H]1CCCN(C(=O)Nc2ccccc2)C1	ZINC000875043022	DD	On-Demand	Anodyne	DPP7	38	40
CN1Cc2ccccc2[C@@H]1CNC(=O)Nc1cccc(OCC(N)=O)c1	ZINC000875043037	FD	On-Demand	Anodyne	EPHX2	21	41
CN1Cc2ccccc2[C@H]1CNC(=O)Nc1cccc(OCC(N)=O)c1	ZINC000875043038	FD	On-Demand	Anodyne	EPHX2	21	41
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875043075	GF	On-Demand	Anodyne	L3MBTL3	79	40
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875043076	GF	On-Demand	Anodyne	L3MBTL3	79	40
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875043084	GD	On-Demand	Anodyne	MLYCD	18	40
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875043084	GD	On-Demand	Anodyne	L3MBTL3	71	38
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875043084	GD	On-Demand	Anodyne	NAMPT	27	44
C=CCn1c(S)nc2cc(C(=O)Nc3ncc(Cc4cc(F)cc(F)c4)s3)ccc2c1=O	ZINC000875043104	JI	On-Demand	Mild	SCD1	41	51
C=CCn1c(S)nc2cc(C(=O)Nc3ncc(Cc4cc(F)cc(F)c4)s3)ccc2c1=O	ZINC000875043104	JI	On-Demand	Mild	SCD	34	51
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N[C@H]1CCC[C@@H]1O	ZINC000875043110	ED	On-Demand	Anodyne	L3MBTL3	92	43
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N[C@H]1CCC[C@@H]1O	ZINC000875043110	ED	On-Demand	Anodyne	NAMPT	15	46
CCCCCCCNC(=O)C(=O)NCc1ccc(N2CCCC2)nc1	ZINC000875043120	EE	On-Demand	Mild	S1PR2	42	33
CCCCCCCNC(=O)C(=O)NCc1ccc(N2CCCC2)nc1	ZINC000875043120	EE	On-Demand	Mild	ASAH1	85	36
O=C(NCC[C@@H](O)C1CCCC1)NCc1ccnc(N2CCCCC2)c1	ZINC000875043160	FF	On-Demand	Anodyne	GPBAR1	18	41
O=C(NCC[C@H](O)C1CCCC1)NCc1ccnc(N2CCCCC2)c1	ZINC000875043161	FF	On-Demand	Anodyne	GPBAR1	18	41
CCC(CC)(CNC(=O)Nc1cccc(OCC(N)=O)c1)C(F)(F)F	ZINC000875043171	FG	On-Demand	Anodyne	EPHX2	24	40
CCC(CC)(CNC(=O)Nc1cccc(OCC(N)=O)c1)C(F)(F)F	ZINC000875043171	FG	On-Demand	Anodyne	KCNK3	41	36
NC(=O)COc1cccc(NC(=O)N[C@@H]2CC23CCC3)c1	ZINC000875043183	CD	On-Demand	Anodyne	EPHX2	31	43
NC(=O)COc1cccc(NC(=O)N[C@H]2CC23CCC3)c1	ZINC000875043184	CD	On-Demand	Anodyne	EPHX2	31	43
NC(=O)COc1cccc(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)c1	ZINC000875043191	DD	On-Demand	Anodyne	EPHX2	27	41
NC(=O)COc1cccc(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)c1	ZINC000875043192	DD	On-Demand	Anodyne	EPHX2	27	41
NC(=O)COc1cccc(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)c1	ZINC000875043193	DD	On-Demand	Anodyne	EPHX2	27	41
NC(=O)COc1cccc(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)c1	ZINC000875043194	DD	On-Demand	Anodyne	EPHX2	27	41
CN1CCN(C2CCN(C(=O)Nc3cccc(OCC(N)=O)c3)CC2)CC1	ZINC000875043214	GC	On-Demand	Anodyne	HTR1D	18	41
CN1CCN(C2CCN(C(=O)Nc3cccc(OCC(N)=O)c3)CC2)CC1	ZINC000875043214	GC	On-Demand	Anodyne	HTR1B	22	41
CN1CCN(C2CCN(C(=O)Nc3cccc(OCC(N)=O)c3)CC2)CC1	ZINC000875043214	GC	On-Demand	Anodyne	CCR3	24	43
CN1CCN(C2CCN(C(=O)Nc3cccc(OCC(N)=O)c3)CC2)CC1	ZINC000875043214	GC	On-Demand	Anodyne	EPHX2	33	44
CN1CCN(C2CCN(C(=O)Nc3cccc(OCC(N)=O)c3)CC2)CC1	ZINC000875043214	GC	On-Demand	Anodyne	SCD1	17	43
CN1CCN(C2CCN(C(=O)Nc3cccc(OCC(N)=O)c3)CC2)CC1	ZINC000875043214	GC	On-Demand	Anodyne	LIMK2	23	42
CN1CCN(C2CCN(C(=O)Nc3cccc(OCC(N)=O)c3)CC2)CC1	ZINC000875043214	GC	On-Demand	Anodyne	L3MBTL3	58	38
NC(=O)COc1cccc(NC(=O)NCC[C@H]2CCCS2)c1	ZINC000875043220	DD	On-Demand	Anodyne	HRH2	23	42
NC(=O)COc1cccc(NC(=O)NCC[C@H]2CCCS2)c1	ZINC000875043220	DD	On-Demand	Anodyne	PRMT3	24	40
NC(=O)COc1cccc(NC(=O)NCC[C@@H]2CCCS2)c1	ZINC000875043221	DD	On-Demand	Anodyne	HRH2	23	42
NC(=O)COc1cccc(NC(=O)NCC[C@@H]2CCCS2)c1	ZINC000875043221	DD	On-Demand	Anodyne	PRMT3	24	40
O=C(CN1C(=O)c2ccccc2S1(=O)=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875043233	IF	On-Demand	Anodyne	SCD1	34	43
O=C(CN1C(=O)c2ccccc2S1(=O)=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875043233	IF	On-Demand	Anodyne	SCD	29	43
NC(=O)[C@@H]1CC[C@H](CCC(=O)Nc2ccc(-c3nc4ccccc4s3)cc2)O1	ZINC000875043238	GH	On-Demand	Anodyne	ETHR	15	48
CN(C)C[C@@H]1CN(C(=O)Nc2cccc(OCC(N)=O)c2)C[C@H]1CN(C)C	ZINC000875043241	GC	On-Demand	Anodyne	LIMK2	37	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875043265	GE	On-Demand	Anodyne	SLC6A3	45	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875043265	GE	On-Demand	Anodyne	PTR1	47	35
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875043265	GE	On-Demand	Anodyne	L3MBTL3	81	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875043265	GE	On-Demand	Anodyne	NAMPT	16	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875043265	GE	On-Demand	Anodyne	TMPRSS11D	44	31
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875043266	GE	On-Demand	Anodyne	SLC6A3	45	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875043266	GE	On-Demand	Anodyne	PTR1	47	35
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875043266	GE	On-Demand	Anodyne	L3MBTL3	81	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875043266	GE	On-Demand	Anodyne	NAMPT	16	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875043266	GE	On-Demand	Anodyne	TMPRSS11D	44	31
O=C(NCCC(=O)N1CCOCC1)NC1CC(Nc2ccccc2)C1	ZINC000875043271	ED	On-Demand	Anodyne	EPHX2	27	41
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CC=CC1	ZINC000875043272	CE	On-Demand	Anodyne	MLYCD	18	41
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CC=CC1	ZINC000875043272	CE	On-Demand	Anodyne	L3MBTL3	79	42
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CC=CC1	ZINC000875043272	CE	On-Demand	Anodyne	NAMPT	31	45
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cc(Cl)c2c(c1)OCCO2	ZINC000875043279	HJ	On-Demand	Anodyne	SCD1	43	50
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cc(Cl)c2c(c1)OCCO2	ZINC000875043279	HJ	On-Demand	Anodyne	SCD	35	50
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CC(Cc2ccco2)C1	ZINC000875043282	FF	On-Demand	Anodyne	L3MBTL3	58	36
COC(=O)N(C)NC(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875043299	ED	On-Demand	Reactive	L3MBTL3	74	41
O=CN1CCCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)CC1	ZINC000875043302	FD	On-Demand	Anodyne	MLYCD	18	40
O=CN1CCCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)CC1	ZINC000875043302	FD	On-Demand	Anodyne	L3MBTL3	73	38
O=CN1CCCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)CC1	ZINC000875043302	FD	On-Demand	Anodyne	NAMPT	23	42
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CC(OCC(F)F)C1	ZINC000875043316	FE	On-Demand	Anodyne	L3MBTL3	65	37
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)NC1CN(c2ccncn2)C1	ZINC000875043351	GD	On-Demand	Anodyne	L3MBTL3	44	34
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)NC1CN(c2ccncn2)C1	ZINC000875043351	GD	On-Demand	Anodyne	NAMPT	34	45
NC(=O)COc1cccc(NC(=O)N[C@@H]2CCCC[C@@H]2F)c1	ZINC000875043381	DD	On-Demand	Anodyne	CCR3	41	48
NC(=O)COc1cccc(NC(=O)N[C@@H]2CCCC[C@@H]2F)c1	ZINC000875043381	DD	On-Demand	Anodyne	CCKBR	42	34
NC(=O)COc1cccc(NC(=O)N[C@@H]2CCCC[C@@H]2F)c1	ZINC000875043381	DD	On-Demand	Anodyne	EPHX2	39	49
CN(C)C[C@@H]1CN(C(=O)NCc2ccnc(N3CCCC3)c2)C[C@H]1CN(C)C	ZINC000875043388	GD	On-Demand	Anodyne	NOS2	41	33
O=C(NCc1ccnc(N2CCCC2)c1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875043395	GG	On-Demand	Anodyne	CPT1A	58	40
O=C(NCc1ccnc(N2CCCC2)c1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875043395	GG	On-Demand	Anodyne	CPT2	15	40
O=C(NCc1ccnc(N2CCCC2)c1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875043396	GG	On-Demand	Anodyne	CPT1A	58	40
O=C(NCc1ccnc(N2CCCC2)c1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875043396	GG	On-Demand	Anodyne	CPT2	15	40
O=C(NCc1ccnc(N2CCCC2)c1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875043397	GG	On-Demand	Anodyne	CPT1A	58	40
O=C(NCc1ccnc(N2CCCC2)c1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875043397	GG	On-Demand	Anodyne	CPT2	15	40
O=C(NCc1ccnc(N2CCCC2)c1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875043398	GG	On-Demand	Anodyne	CPT1A	58	40
O=C(NCc1ccnc(N2CCCC2)c1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875043398	GG	On-Demand	Anodyne	CPT2	15	40
O=C(NCc1ccnc(N2CCCCC2)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875043420	GH	On-Demand	Anodyne	EPHX2	21	42
O=C(NCc1ccnc(N2CCCCC2)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875043421	GH	On-Demand	Anodyne	EPHX2	21	42
O=C(/C=C/c1ccsc1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875043422	FJ	On-Demand	Anodyne	SCD1	35	46
O=C(/C=C/c1ccsc1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875043422	FJ	On-Demand	Anodyne	SCD	31	49
O=C(/C=C\c1ccsc1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875043423	FJ	On-Demand	Anodyne	SCD1	35	46
O=C(/C=C\c1ccsc1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875043423	FJ	On-Demand	Anodyne	SCD	31	49
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccnc(N2CCCC2)c1	ZINC000875043436	FD	On-Demand	Anodyne	SLC6A3	40	35
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccnc(N2CCCC2)c1	ZINC000875043437	FD	On-Demand	Anodyne	SLC6A3	40	35
O=C(NCCN1CC[C@H](O)C1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875043474	FC	On-Demand	Anodyne	CCR3	26	42
O=C(NCCN1CC[C@H](O)C1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875043474	FC	On-Demand	Anodyne	L3MBTL3	75	44
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875043475	FC	On-Demand	Anodyne	CCR3	26	42
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875043475	FC	On-Demand	Anodyne	L3MBTL3	75	44
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CCO[C@H](C(F)F)CC1	ZINC000875043476	GE	On-Demand	Anodyne	EPHX2	16	41
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CCO[C@H](C(F)F)CC1	ZINC000875043476	GE	On-Demand	Anodyne	L3MBTL3	86	41
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CCO[C@@H](C(F)F)CC1	ZINC000875043477	GE	On-Demand	Anodyne	EPHX2	16	41
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CCO[C@@H](C(F)F)CC1	ZINC000875043477	GE	On-Demand	Anodyne	L3MBTL3	86	41
COC(=O)[C@@]1(OC)CCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000875043483	GD	On-Demand	Anodyne	L3MBTL3	56	36
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875043486	GH	On-Demand	Anodyne	MLYCD	19	43
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875043486	GH	On-Demand	Anodyne	L3MBTL3	60	37
O=C(NCC[C@H](O)C1CCCC1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875043487	FF	On-Demand	Anodyne	DPP7	57	35
O=C(NCC[C@H](O)C1CCCC1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875043487	FF	On-Demand	Anodyne	PROC	45	39
O=C(NCC[C@H](O)C1CCCC1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875043487	FF	On-Demand	Anodyne	L3MBTL3	80	40
O=C(NCC[C@@H](O)C1CCCC1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875043488	FF	On-Demand	Anodyne	DPP7	57	35
O=C(NCC[C@@H](O)C1CCCC1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875043488	FF	On-Demand	Anodyne	PROC	45	39
O=C(NCC[C@@H](O)C1CCCC1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875043488	FF	On-Demand	Anodyne	L3MBTL3	80	40
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CC(Cc2cccs2)C1	ZINC000875043506	GG	On-Demand	Anodyne	DPP7	31	41
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CC(Cc2cccs2)C1	ZINC000875043506	GG	On-Demand	Anodyne	L3MBTL3	54	35
N#Cc1ccc(Cn2cc(NC(=O)NC3CCC(C(F)(F)F)CC3)cn2)cc1	ZINC000875043517	GI	On-Demand	Mild	ITK	15	49
N#Cc1ccc(Cn2cc(NC(=O)NC3CCC(C(F)(F)F)CC3)cn2)cc1	ZINC000875043517	GI	On-Demand	Mild	EPHX2	41	35
N#Cc1ccc(Cn2cc(NC(=O)NC3CCC(C(F)(F)F)CC3)cn2)cc1	ZINC000875043517	GI	On-Demand	Mild	PANC	57	40
O=C(NCc1ccc(N2CCCC2)nc1)C(=O)NCc1cccc2ncccc12	ZINC000875043520	GE	On-Demand	Anodyne	SCN2A	17	40
O=C(NCc1ccc(N2CCCC2)nc1)C(=O)NCc1cccc2ncccc12	ZINC000875043520	GE	On-Demand	Anodyne	SCN10A	18	40
CC1(C)[C@@H](c2ccccc2F)CCN1C(=O)Nc1cccc(OCC(N)=O)c1	ZINC000875043574	GG	On-Demand	Anodyne	EPHX2	22	40
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875043609	EE	On-Demand	Anodyne	EPHX2	22	47
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875043609	EE	On-Demand	Anodyne	TPSAB1	15	48
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875043611	EE	On-Demand	Anodyne	EPHX2	22	47
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875043611	EE	On-Demand	Anodyne	TPSAB1	15	48
C#CC[C@H](COC)NC(=O)C(=O)NCc1cccc(OCc2ccccn2)c1	ZINC000875043618	GD	On-Demand	Mild	PDS	50	35
C#CC[C@@H](COC)NC(=O)C(=O)NCc1cccc(OCc2ccccn2)c1	ZINC000875043620	GD	On-Demand	Mild	PDS	50	35
COc1ccccc1[C@H]1CCCN(C(=O)Nc2cccc(OCC(N)=O)c2)CC1	ZINC000875043621	GG	On-Demand	Anodyne	PDGFRB	46	38
COc1ccccc1[C@H]1CCCN(C(=O)Nc2cccc(OCC(N)=O)c2)CC1	ZINC000875043621	GG	On-Demand	Anodyne	CCR3	17	47
COc1ccccc1[C@H]1CCCN(C(=O)Nc2cccc(OCC(N)=O)c2)CC1	ZINC000875043621	GG	On-Demand	Anodyne	CPT1A	22	40
COc1ccccc1[C@H]1CCCN(C(=O)Nc2cccc(OCC(N)=O)c2)CC1	ZINC000875043621	GG	On-Demand	Anodyne	RBP4	38	43
COc1ccccc1[C@H]1CCCN(C(=O)Nc2cccc(OCC(N)=O)c2)CC1	ZINC000875043621	GG	On-Demand	Anodyne	LIMK2	17	43
COc1ccccc1[C@H]1CCCN(C(=O)Nc2cccc(OCC(N)=O)c2)CC1	ZINC000875043621	GG	On-Demand	Anodyne	ACKR3	44	30
N#Cc1ccc(Cn2cc(NC(=O)NC(C3CC3)C3CC3)cn2)cc1	ZINC000875043622	EG	On-Demand	Mild	ITK	18	55
N#Cc1ccc(Cn2cc(NC(=O)NC(C3CC3)C3CC3)cn2)cc1	ZINC000875043622	EG	On-Demand	Mild	PANC	58	39
COc1ccccc1[C@@H]1CCCN(C(=O)Nc2cccc(OCC(N)=O)c2)CC1	ZINC000875043624	GG	On-Demand	Anodyne	PDGFRB	46	38
COc1ccccc1[C@@H]1CCCN(C(=O)Nc2cccc(OCC(N)=O)c2)CC1	ZINC000875043624	GG	On-Demand	Anodyne	CCR3	17	47
COc1ccccc1[C@@H]1CCCN(C(=O)Nc2cccc(OCC(N)=O)c2)CC1	ZINC000875043624	GG	On-Demand	Anodyne	CPT1A	22	40
COc1ccccc1[C@@H]1CCCN(C(=O)Nc2cccc(OCC(N)=O)c2)CC1	ZINC000875043624	GG	On-Demand	Anodyne	RBP4	38	43
COc1ccccc1[C@@H]1CCCN(C(=O)Nc2cccc(OCC(N)=O)c2)CC1	ZINC000875043624	GG	On-Demand	Anodyne	LIMK2	17	43
COc1ccccc1[C@@H]1CCCN(C(=O)Nc2cccc(OCC(N)=O)c2)CC1	ZINC000875043624	GG	On-Demand	Anodyne	ACKR3	44	30
CCC1(CC)CCCN1C(=O)NCc1ccc(NC(C)=O)cc1	ZINC000875043630	DH	On-Demand	Anodyne	SLC12A5	56	33
NC(=O)COc1cccc(NC(=O)N2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000875043632	FD	On-Demand	Anodyne	EPHX2	44	41
NC(=O)COc1cccc(NC(=O)N2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000875043632	FD	On-Demand	Anodyne	LIMK2	18	41
NC(=O)COc1cccc(NC(=O)N2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000875043633	FD	On-Demand	Anodyne	EPHX2	44	41
NC(=O)COc1cccc(NC(=O)N2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000875043633	FD	On-Demand	Anodyne	LIMK2	18	41
CC(C)(C)OC(=O)N1CC[C@@](C#N)(C(=O)Nc2cc(Cl)ccc2F)C1	ZINC000875043640	FH	On-Demand	Mild	GPR119	21	47
CC(C)(C)OC(=O)N1CC[C@](C#N)(C(=O)Nc2cc(Cl)ccc2F)C1	ZINC000875043642	FH	On-Demand	Mild	GPR119	21	47
Cc1cncc([C@@H]2CCCN2C(=O)Nc2cccc(OCC(N)=O)c2)c1	ZINC000875043672	FF	On-Demand	Anodyne	CPT1A	107	41
Cc1cncc([C@H]2CCCN2C(=O)Nc2cccc(OCC(N)=O)c2)c1	ZINC000875043673	FF	On-Demand	Anodyne	CPT1A	107	41
O=C(NCc1ccnc(N2CCCC2)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875043675	FG	On-Demand	Anodyne	EPHX2	21	43
O=C(NCc1ccnc(N2CCCC2)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875043677	FG	On-Demand	Anodyne	EPHX2	21	43
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N[C@@H]1CCO[C@H]1c1cc[nH]n1	ZINC000875043704	GD	On-Demand	Anodyne	L3MBTL3	59	35
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000875043720	GE	On-Demand	Anodyne	DPP7	53	36
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000875043720	GE	On-Demand	Anodyne	L3MBTL3	58	38
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000875043720	GE	On-Demand	Anodyne	TMPRSS11D	43	33
CS[C@@H]1C[C@@H](NC(=O)Nc2cccc(OCC(N)=O)c2)C1	ZINC000875043729	DD	On-Demand	Anodyne	CCR3	23	40
CS[C@@H]1C[C@@H](NC(=O)Nc2cccc(OCC(N)=O)c2)C1	ZINC000875043729	DD	On-Demand	Anodyne	EPHX2	43	45
O=C(NCc1cn2cc(Cl)ccc2n1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875043734	GG	On-Demand	Anodyne	F2	30	41
O=C(NCc1cn2cc(Cl)ccc2n1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875043735	GG	On-Demand	Anodyne	F2	30	41
O=C(NCc1cn2cc(Cl)ccc2n1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875043736	GG	On-Demand	Anodyne	F2	30	41
O=C(NCc1cn2cc(Cl)ccc2n1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875043737	GG	On-Demand	Anodyne	F2	30	41
O=C(NCc1ccnc(N2CCCCC2)c1)N1Cc2cccc(O)c2C1	ZINC000875043738	FG	On-Demand	Clean	NAMPT	28	42
O=C(NCCC(=O)N1CCOCC1)NNc1ccc(OCc2ccccc2)cc1	ZINC000875043740	GE	On-Demand	Reactive	LTA4H	25	42
O=C(NCCC(=O)N1CCOCC1)NNc1ccc(OCc2ccccc2)cc1	ZINC000875043740	GE	On-Demand	Reactive	EPHX2	21	43
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cccnc1S	ZINC000875043750	FH	On-Demand	Anodyne	SCD1	42	52
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cccnc1S	ZINC000875043750	FH	On-Demand	Anodyne	SCD	35	52
CCOc1ccc(C(=O)CCC(=O)Oc2cc(OC)cc(OC)c2)cc1	ZINC000875043755	FH	On-Demand	Anodyne	AHR	15	45
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1C[C@@H]2CCC[C@]2(CO)C1	ZINC000875043759	FE	On-Demand	Anodyne	L3MBTL3	72	38
NC(=O)COc1cccc(NC(=O)NCC[C@@H]2CCSC2)c1	ZINC000875043762	DD	On-Demand	Anodyne	HRH2	15	40
NC(=O)COc1cccc(NC(=O)NCC[C@@H]2CCSC2)c1	ZINC000875043762	DD	On-Demand	Anodyne	CCR3	35	40
NC(=O)COc1cccc(NC(=O)NCC[C@@H]2CCSC2)c1	ZINC000875043762	DD	On-Demand	Anodyne	PRMT3	24	40
NC(=O)COc1cccc(NC(=O)NCC[C@H]2CCSC2)c1	ZINC000875043763	DD	On-Demand	Anodyne	HRH2	15	40
NC(=O)COc1cccc(NC(=O)NCC[C@H]2CCSC2)c1	ZINC000875043763	DD	On-Demand	Anodyne	CCR3	35	40
NC(=O)COc1cccc(NC(=O)NCC[C@H]2CCSC2)c1	ZINC000875043763	DD	On-Demand	Anodyne	PRMT3	24	40
CC[C@@H](NC(=O)NCc1ccc(C(=O)N2CCCC2)cc1)[C@H](O)c1ccccc1	ZINC000875043774	GG	On-Demand	Anodyne	MTTP	17	41
CC[C@@H](NC(=O)NCc1ccc(C(=O)N2CCCC2)cc1)[C@H](O)c1ccccc1	ZINC000875043774	GG	On-Demand	Anodyne	L3MBTL3	65	38
CC[C@@H](NC(=O)NCc1ccc(C(=O)N2CCCC2)cc1)[C@@H](O)c1ccccc1	ZINC000875043777	GG	On-Demand	Anodyne	MTTP	17	41
CC[C@@H](NC(=O)NCc1ccc(C(=O)N2CCCC2)cc1)[C@@H](O)c1ccccc1	ZINC000875043777	GG	On-Demand	Anodyne	L3MBTL3	65	38
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N[C@@H]1COCC[C@H]1O	ZINC000875043790	EC	On-Demand	Anodyne	L3MBTL3	76	40
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)NC1CC(Nc2ccccc2)C1	ZINC000875043803	GG	On-Demand	Anodyne	AVPR2	34	43
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)NC1CC(Nc2ccccc2)C1	ZINC000875043803	GG	On-Demand	Anodyne	LTA4H	20	41
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)NC1CC(Nc2ccccc2)C1	ZINC000875043803	GG	On-Demand	Anodyne	PREP	30	44
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)NC1CC(Nc2ccccc2)C1	ZINC000875043803	GG	On-Demand	Anodyne	EPHX2	32	43
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)NC1CC(Nc2ccccc2)C1	ZINC000875043803	GG	On-Demand	Anodyne	L3MBTL3	73	39
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)NC1CC(Nc2ccccc2)C1	ZINC000875043803	GG	On-Demand	Anodyne	NAMPT	21	47
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)NC1CC(Nc2ccccc2)C1	ZINC000875043803	GG	On-Demand	Anodyne	TMPRSS11D	44	31
C[C@@]1(CO)CN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C[C@]1(C)CO	ZINC000875043821	GD	On-Demand	Anodyne	L3MBTL3	70	38
C[C@@]1(CO)CN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C[C@]1(C)CO	ZINC000875043821	GD	On-Demand	Anodyne	NAMPT	34	47
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1Cc2cccc(O)c2C1	ZINC000875043830	FF	On-Demand	Clean	FABI	41	34
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1Cc2cccc(O)c2C1	ZINC000875043830	FF	On-Demand	Clean	AVPR2	23	42
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1Cc2cccc(O)c2C1	ZINC000875043830	FF	On-Demand	Clean	PREP	19	42
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1Cc2cccc(O)c2C1	ZINC000875043830	FF	On-Demand	Clean	L3MBTL3	62	37
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1Cc2cccc(O)c2C1	ZINC000875043830	FF	On-Demand	Clean	NAMPT	31	52
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CC2(CCCO2)C1	ZINC000875043833	ED	On-Demand	Anodyne	EPHX2	15	40
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CC2(CCCO2)C1	ZINC000875043833	ED	On-Demand	Anodyne	L3MBTL3	49	36
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CC2(CCCO2)C1	ZINC000875043833	ED	On-Demand	Anodyne	NAMPT	33	46
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N[C@H]1Cc2ccccc2NC1=O	ZINC000875043842	GE	On-Demand	Anodyne	PLG	41	32
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N[C@H]1Cc2ccccc2NC1=O	ZINC000875043842	GE	On-Demand	Anodyne	AVPR2	20	41
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N[C@H]1Cc2ccccc2NC1=O	ZINC000875043842	GE	On-Demand	Anodyne	TRYP_PIG	46	32
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N[C@H]1Cc2ccccc2NC1=O	ZINC000875043842	GE	On-Demand	Anodyne	L3MBTL3	59	36
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N[C@@H]1Cc2ccccc2NC1=O	ZINC000875043843	GE	On-Demand	Anodyne	PLG	41	32
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N[C@@H]1Cc2ccccc2NC1=O	ZINC000875043843	GE	On-Demand	Anodyne	AVPR2	20	41
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N[C@@H]1Cc2ccccc2NC1=O	ZINC000875043843	GE	On-Demand	Anodyne	TRYP_PIG	46	32
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N[C@@H]1Cc2ccccc2NC1=O	ZINC000875043843	GE	On-Demand	Anodyne	L3MBTL3	59	36
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)NC[C@@H]1C[C@H](O)C1	ZINC000875043844	ED	On-Demand	Anodyne	EPHX2	15	47
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)NC[C@@H]1C[C@H](O)C1	ZINC000875043844	ED	On-Demand	Anodyne	L3MBTL3	78	40
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875043845	ED	On-Demand	Anodyne	EPHX2	15	47
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875043845	ED	On-Demand	Anodyne	L3MBTL3	78	40
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)NCC1CC(O)C1	ZINC000875043846	ED	On-Demand	Anodyne	EPHX2	15	47
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)NCC1CC(O)C1	ZINC000875043846	ED	On-Demand	Anodyne	L3MBTL3	78	40
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)C1=CN2CCS(=O)(=O)N=C2C=C1	ZINC000875043849	IE	On-Demand	Anodyne	SCD1	34	43
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)C1=CN2CCS(=O)(=O)N=C2C=C1	ZINC000875043849	IE	On-Demand	Anodyne	SCD	28	43
CC[C@@H](NC(=O)NCc1ccc(NC(C)=O)cc1)[C@@H](O)c1ccccc1	ZINC000875043857	FF	On-Demand	Anodyne	ANPEP	21	44
CC[C@@H](NC(=O)NCc1ccc(NC(C)=O)cc1)[C@@H](O)c1ccccc1	ZINC000875043857	FF	On-Demand	Anodyne	TIMP3	44	33
CC[C@@H](NC(=O)NCc1ccc(NC(C)=O)cc1)[C@@H](O)c1ccccc1	ZINC000875043857	FF	On-Demand	Anodyne	NPY5R	32	42
CC[C@@H](NC(=O)NCc1ccc(NC(C)=O)cc1)[C@@H](O)c1ccccc1	ZINC000875043857	FF	On-Demand	Anodyne	PDS	43	34
CC[C@@H](NC(=O)NCc1ccc(NC(C)=O)cc1)[C@H](O)c1ccccc1	ZINC000875043860	FF	On-Demand	Anodyne	ANPEP	21	44
CC[C@@H](NC(=O)NCc1ccc(NC(C)=O)cc1)[C@H](O)c1ccccc1	ZINC000875043860	FF	On-Demand	Anodyne	TIMP3	44	33
CC[C@@H](NC(=O)NCc1ccc(NC(C)=O)cc1)[C@H](O)c1ccccc1	ZINC000875043860	FF	On-Demand	Anodyne	NPY5R	32	42
CC[C@@H](NC(=O)NCc1ccc(NC(C)=O)cc1)[C@H](O)c1ccccc1	ZINC000875043860	FF	On-Demand	Anodyne	PDS	43	34
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3ccc(NC(=O)C(C)C)cc3)C[C@@H]1C2	ZINC000875043861	FE	On-Demand	Anodyne	EPHX2	24	41
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(C4CCCC4)CC3)CC[C@H]21	ZINC000875043946	FD	On-Demand	Anodyne	L3MBTL3	41	32
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)cc1	ZINC000875043947	FF	On-Demand	Anodyne	EPHX2	28	53
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)cc1	ZINC000875043947	FF	On-Demand	Anodyne	SLC12A5	43	32
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@](O)(c3ccccc3)C2)cc1	ZINC000875043949	FF	On-Demand	Anodyne	EPHX2	28	53
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@](O)(c3ccccc3)C2)cc1	ZINC000875043949	FF	On-Demand	Anodyne	SLC12A5	43	32
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(C4CCCC4)CC3)CC[C@@H]21	ZINC000875043950	FD	On-Demand	Anodyne	L3MBTL3	41	32
C#CC[C@@H](COC)NC(=O)C(=O)NCc1cccc(OCC(=O)N(C)C)c1	ZINC000875043956	GB	On-Demand	Mild	PDS	55	35
C#CC[C@H](COC)NC(=O)C(=O)NCc1cccc(OCC(=O)N(C)C)c1	ZINC000875043957	GB	On-Demand	Mild	PDS	55	35
CC(=O)C1CCN(C(=O)C(=O)NCc2ccccc2OC2CCCC2)CC1	ZINC000875043963	FE	On-Demand	Anodyne	EPHX2	24	43
C#CC[C@@H](COC)NC(=O)C(=O)NCc1ccc(OCC)cc1	ZINC000875043966	DC	On-Demand	Mild	PDS	50	37
C#CC[C@H](COC)NC(=O)C(=O)NCc1ccc(OCC)cc1	ZINC000875043967	DC	On-Demand	Mild	PDS	50	37
CC(=O)Nc1ccc(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875043972	GF	On-Demand	Anodyne	ADRB1	27	41
CC(=O)Nc1ccc(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875043972	GF	On-Demand	Anodyne	ADRB3	23	44
CC(=O)Nc1ccc(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875043972	GF	On-Demand	Anodyne	ROCK2	16	48
CC(=O)Nc1ccc(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875043972	GF	On-Demand	Anodyne	PDS	66	40
NC(=O)COc1cccc(NC(=O)NCC2CCC3(CC2)CC3)c1	ZINC000875043973	EF	On-Demand	Anodyne	HRH2	15	40
NC(=O)COc1cccc(NC(=O)NCC2CCC3(CC2)CC3)c1	ZINC000875043973	EF	On-Demand	Anodyne	CCR3	40	40
NC(=O)COc1cccc(NC(=O)NCC2CCC3(CC2)CC3)c1	ZINC000875043973	EF	On-Demand	Anodyne	EPHX2	28	48
CC(=O)Nc1ccc(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875043974	GF	On-Demand	Anodyne	ADRB1	27	41
CC(=O)Nc1ccc(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875043974	GF	On-Demand	Anodyne	ADRB3	23	44
CC(=O)Nc1ccc(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875043974	GF	On-Demand	Anodyne	ROCK2	16	48
CC(=O)Nc1ccc(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875043974	GF	On-Demand	Anodyne	PDS	66	40
CS(=O)(=O)Nc1cccc(CNC(=O)N2CC[C@H](c3ccc(O)cc3)C2)c1	ZINC000875043977	GE	On-Demand	Anodyne	GRIN2B	22	40
C[C@H]1CN(C(=O)Nc2cccc(OCC(N)=O)c2)CC[C@@H](C(F)(F)F)O1	ZINC000875043981	GE	On-Demand	Anodyne	EPHX2	34	40
C[C@H]1CN(C(=O)Nc2cccc(OCC(N)=O)c2)CC[C@H](C(F)(F)F)O1	ZINC000875043982	GE	On-Demand	Anodyne	EPHX2	34	40
C[C@@H]1CN(C(=O)Nc2cccc(OCC(N)=O)c2)CC[C@@H](C(F)(F)F)O1	ZINC000875043983	GE	On-Demand	Anodyne	EPHX2	34	40
C[C@@H]1CN(C(=O)Nc2cccc(OCC(N)=O)c2)CC[C@H](C(F)(F)F)O1	ZINC000875043984	GE	On-Demand	Anodyne	EPHX2	34	40
NC(=O)COc1cccc(NC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875043985	FF	On-Demand	Anodyne	CCR3	18	44
NC(=O)COc1cccc(NC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875043985	FF	On-Demand	Anodyne	EPHX2	41	40
NC(=O)COc1cccc(NC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875043985	FF	On-Demand	Anodyne	LIMK2	19	42
NC(=O)COc1cccc(NC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875043986	FF	On-Demand	Anodyne	CCR3	18	44
NC(=O)COc1cccc(NC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875043986	FF	On-Demand	Anodyne	EPHX2	41	40
NC(=O)COc1cccc(NC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875043986	FF	On-Demand	Anodyne	LIMK2	19	42
C=CC(C)(C)CCCNC(=O)Nc1cccc(OCC(N)=O)c1	ZINC000875043987	DF	On-Demand	Mild	HRH2	29	42
CS(=O)(=O)Nc1cccc(CNC(=O)N2CC[C@@H](c3ccc(O)cc3)C2)c1	ZINC000875043988	GE	On-Demand	Anodyne	GRIN2B	22	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(OCc3ccccn3)cc2)C1	ZINC000875044003	GE	On-Demand	Anodyne	DPP7	23	41
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875044039	FF	On-Demand	Anodyne	L3MBTL3	65	37
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875044041	FF	On-Demand	Anodyne	L3MBTL3	65	37
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875044044	FF	On-Demand	Anodyne	L3MBTL3	65	37
NC(=O)COc1cccc(NC(=O)NCCC[C@@H]2C=CCC2)c1	ZINC000875044045	DE	On-Demand	Anodyne	HRH2	25	43
NC(=O)COc1cccc(NC(=O)NCCC[C@@H]2C=CCC2)c1	ZINC000875044045	DE	On-Demand	Anodyne	CCR3	34	41
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875044046	FF	On-Demand	Anodyne	L3MBTL3	65	37
NC(=O)COc1cccc(NC(=O)NCCC[C@H]2C=CCC2)c1	ZINC000875044047	DE	On-Demand	Anodyne	HRH2	25	43
NC(=O)COc1cccc(NC(=O)NCCC[C@H]2C=CCC2)c1	ZINC000875044047	DE	On-Demand	Anodyne	CCR3	34	41
O=C(NCc1ccnc(N2CCCC2)c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875044052	GG	On-Demand	Anodyne	PREP	34	40
O=C(NCc1ccnc(N2CCCC2)c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875044054	GG	On-Demand	Anodyne	PREP	34	40
O=C(NCc1ccnc(N2CCCC2)c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875044056	GG	On-Demand	Anodyne	PREP	34	40
O=C(NCc1ccnc(N2CCCC2)c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875044058	GG	On-Demand	Anodyne	PREP	34	40
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875044061	GH	On-Demand	Anodyne	EPHX2	28	42
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875044061	GH	On-Demand	Anodyne	L3MBTL3	94	46
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875044061	GH	On-Demand	Anodyne	NAMPT	21	40
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875044063	GH	On-Demand	Anodyne	EPHX2	28	42
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875044063	GH	On-Demand	Anodyne	L3MBTL3	94	46
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875044063	GH	On-Demand	Anodyne	NAMPT	21	40
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CC(c2ccccc2)C1	ZINC000875044066	FG	On-Demand	Anodyne	SLC18A3	26	42
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CC(c2ccccc2)C1	ZINC000875044066	FG	On-Demand	Anodyne	PREP	37	49
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CC(c2ccccc2)C1	ZINC000875044066	FG	On-Demand	Anodyne	EPHX2	23	43
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CC(c2ccccc2)C1	ZINC000875044066	FG	On-Demand	Anodyne	DPP7	52	39
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CC(c2ccccc2)C1	ZINC000875044066	FG	On-Demand	Anodyne	TPSAB1	26	47
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CC(c2ccccc2)C1	ZINC000875044066	FG	On-Demand	Anodyne	NPSR1	37	42
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CC(c2ccccc2)C1	ZINC000875044066	FG	On-Demand	Anodyne	L3MBTL3	88	43
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CC(c2ccccc2)C1	ZINC000875044066	FG	On-Demand	Anodyne	NAMPT	33	45
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CC(c2ccccc2)C1	ZINC000875044066	FG	On-Demand	Anodyne	TMPRSS11D	61	33
Cn1cc(/C=C\C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cn1	ZINC000875044068	FG	On-Demand	Anodyne	SCD1	35	45
Cn1cc(/C=C\C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cn1	ZINC000875044068	FG	On-Demand	Anodyne	SCD	30	49
Cn1cc(/C=C/C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cn1	ZINC000875044070	FG	On-Demand	Anodyne	SCD1	35	45
Cn1cc(/C=C/C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cn1	ZINC000875044070	FG	On-Demand	Anodyne	SCD	30	49
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875044095	FF	On-Demand	Anodyne	L3MBTL3	82	39
O=C(c1ccc(CNC(=O)N2OC3CCC2CC3)cc1)N1CCCC1	ZINC000875044098	EF	On-Demand	Anodyne	L3MBTL3	101	48
O=C(c1ccc(CNC(=O)N2OC3CCC2CC3)cc1)N1CCCC1	ZINC000875044098	EF	On-Demand	Anodyne	NAMPT	22	41
O=C(c1ccc(CNC(=O)N2OC3CCC2CC3)cc1)N1CCCC1	ZINC000875044098	EF	On-Demand	Anodyne	TMPRSS11D	53	32
CN1CCCC[C@@H](N(C)C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1=O	ZINC000875044104	GE	On-Demand	Anodyne	L3MBTL3	73	40
CN1CCCC[C@H](N(C)C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1=O	ZINC000875044105	GE	On-Demand	Anodyne	L3MBTL3	73	40
O=C(c1ccc(CNC(=O)N(C2CC2)C2CC2)cc1)N1CCCC1	ZINC000875044106	EF	On-Demand	Anodyne	PREP	30	42
O=C(c1ccc(CNC(=O)N(C2CC2)C2CC2)cc1)N1CCCC1	ZINC000875044106	EF	On-Demand	Anodyne	DPP7	40	34
O=C(c1ccc(CNC(=O)N(C2CC2)C2CC2)cc1)N1CCCC1	ZINC000875044106	EF	On-Demand	Anodyne	L3MBTL3	98	45
O=C(c1ccc(CNC(=O)N(C2CC2)C2CC2)cc1)N1CCCC1	ZINC000875044106	EF	On-Demand	Anodyne	TMPRSS11D	59	33
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N[C@H]1Cc2cncn2C1	ZINC000875044108	FD	On-Demand	Anodyne	L3MBTL3	43	34
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N[C@H]1Cc2cncn2C1	ZINC000875044108	FD	On-Demand	Anodyne	NAMPT	35	46
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N[C@@H]1Cc2cncn2C1	ZINC000875044109	FD	On-Demand	Anodyne	L3MBTL3	43	34
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N[C@@H]1Cc2cncn2C1	ZINC000875044109	FD	On-Demand	Anodyne	NAMPT	35	46
CN(C[C@@H]1C[C@H](O)C1)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875044137	ED	On-Demand	Anodyne	L3MBTL3	67	39
COc1ccc(OCCCC(=O)Oc2cc(OC)cc(OC)c2)cc1	ZINC000875044138	EG	On-Demand	Anodyne	LTA4H	15	41
COc1ccc(OCCCC(=O)Oc2cc(OC)cc(OC)c2)cc1	ZINC000875044138	EG	On-Demand	Anodyne	AHR	17	45
COc1ccc(OCCCC(=O)Oc2cc(OC)cc(OC)c2)cc1	ZINC000875044138	EG	On-Demand	Anodyne	MTNR1A	39	40
COc1ccc(OCCCC(=O)Oc2cc(OC)cc(OC)c2)cc1	ZINC000875044138	EG	On-Demand	Anodyne	MTNR1B	36	40
COc1ccc(OCCCC(=O)Oc2cc(OC)cc(OC)c2)cc1	ZINC000875044138	EG	On-Demand	Anodyne	PLA2G4B	83	36
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875044148	GG	On-Demand	Anodyne	FABI	45	38
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875044148	GG	On-Demand	Anodyne	L3MBTL3	96	44
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875044148	GG	On-Demand	Anodyne	NAMPT	24	40
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875044149	GG	On-Demand	Anodyne	FABI	45	38
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875044149	GG	On-Demand	Anodyne	L3MBTL3	96	44
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875044149	GG	On-Demand	Anodyne	NAMPT	24	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(OCc3ccccn3)cc2)C1	ZINC000875044155	GE	On-Demand	Anodyne	DPP7	23	41
O=C(NC(C1CC1)C1CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875044156	DF	On-Demand	Anodyne	OPRL1	17	41
O=C(NC(C1CC1)C1CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875044157	DF	On-Demand	Anodyne	OPRL1	17	41
CC(=O)Nc1ccc(CNC(=O)N2Cc3cccnc3N3CCC[C@H]3C2)cc1	ZINC000875044168	GF	On-Demand	Anodyne	NAMPT	46	43
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(NC(C)=O)cc2)C1	ZINC000875044171	ED	On-Demand	Anodyne	TPSAB1	17	42
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccc(NC(C)=O)cc2)CC1	ZINC000875044175	GI	On-Demand	Anodyne	DRD2	17	43
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccc(NC(C)=O)cc2)CC1	ZINC000875044175	GI	On-Demand	Anodyne	TSHR	71	35
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccc(NC(C)=O)cc2)CC1	ZINC000875044175	GI	On-Demand	Anodyne	HTR1D	15	43
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccc(NC(C)=O)cc2)CC1	ZINC000875044175	GI	On-Demand	Anodyne	HTR1B	15	43
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccc(NC(C)=O)cc2)CC1	ZINC000875044175	GI	On-Demand	Anodyne	EPHX2	28	41
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccc(NC(C)=O)cc2)CC1	ZINC000875044175	GI	On-Demand	Anodyne	TPSAB1	15	47
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccc(NC(C)=O)cc2)CC1	ZINC000875044175	GI	On-Demand	Anodyne	RBP4	26	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccc(NC(C)=O)cc2)CC1	ZINC000875044176	GI	On-Demand	Anodyne	DRD2	17	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccc(NC(C)=O)cc2)CC1	ZINC000875044176	GI	On-Demand	Anodyne	TSHR	71	35
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccc(NC(C)=O)cc2)CC1	ZINC000875044176	GI	On-Demand	Anodyne	HTR1D	15	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccc(NC(C)=O)cc2)CC1	ZINC000875044176	GI	On-Demand	Anodyne	HTR1B	15	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccc(NC(C)=O)cc2)CC1	ZINC000875044176	GI	On-Demand	Anodyne	EPHX2	28	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccc(NC(C)=O)cc2)CC1	ZINC000875044176	GI	On-Demand	Anodyne	TPSAB1	15	47
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccc(NC(C)=O)cc2)CC1	ZINC000875044176	GI	On-Demand	Anodyne	RBP4	26	41
CS(=O)(=O)Nc1cccc(CNC(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)c1	ZINC000875044177	GF	On-Demand	Anodyne	TRPV1	22	41
Cc1nc(CCNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cs1	ZINC000875044224	EF	On-Demand	Anodyne	TRY1_BOVIN	48	35
Cc1nc(CCNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cs1	ZINC000875044226	EF	On-Demand	Anodyne	TRY1_BOVIN	48	35
Cc1nc(CCNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cs1	ZINC000875044228	EF	On-Demand	Anodyne	TRY1_BOVIN	48	35
Cc1nc(CCNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cs1	ZINC000875044229	EF	On-Demand	Anodyne	TRY1_BOVIN	48	35
CS(=O)(=O)Nc1cccc(CNC(=O)NC2CC(Nc3ccccc3)C2)c1	ZINC000875044240	GF	On-Demand	Anodyne	TRPV1	15	40
NC(=O)COc1cccc(NC(=O)NC[C@@H]2CCN2C2CCCCCC2)c1	ZINC000875044241	FE	On-Demand	Anodyne	HRH2	34	42
NC(=O)COc1cccc(NC(=O)NC[C@@H]2CCN2C2CCCCCC2)c1	ZINC000875044241	FE	On-Demand	Anodyne	CCR3	41	38
NC(=O)COc1cccc(NC(=O)NC[C@@H]2CCN2C2CCCCCC2)c1	ZINC000875044241	FE	On-Demand	Anodyne	CPT1A	27	40
NC(=O)COc1cccc(NC(=O)NC[C@@H]2CCN2C2CCCCCC2)c1	ZINC000875044241	FE	On-Demand	Anodyne	EPHX2	28	46
NC(=O)COc1cccc(NC(=O)NC[C@H]2CCN2C2CCCCCC2)c1	ZINC000875044243	FE	On-Demand	Anodyne	HRH2	34	42
NC(=O)COc1cccc(NC(=O)NC[C@H]2CCN2C2CCCCCC2)c1	ZINC000875044243	FE	On-Demand	Anodyne	CCR3	41	38
NC(=O)COc1cccc(NC(=O)NC[C@H]2CCN2C2CCCCCC2)c1	ZINC000875044243	FE	On-Demand	Anodyne	CPT1A	27	40
NC(=O)COc1cccc(NC(=O)NC[C@H]2CCN2C2CCCCCC2)c1	ZINC000875044243	FE	On-Demand	Anodyne	EPHX2	28	46
CC[C@@H](C)[C@@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044247	FG	On-Demand	Anodyne	PRSS1	19	41
CC[C@@H](C)[C@@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044247	FG	On-Demand	Anodyne	NPR1	41	32
CC[C@@H](C)[C@@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044247	FG	On-Demand	Anodyne	CTSB	25	44
CC[C@@H](C)[C@@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044247	FG	On-Demand	Anodyne	CTSG	30	42
CC[C@@H](C)[C@@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044247	FG	On-Demand	Anodyne	CTSK	21	44
CC[C@@H](C)[C@@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044247	FG	On-Demand	Anodyne	CTSL	37	44
CC[C@@H](C)[C@@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044247	FG	On-Demand	Anodyne	CTRB1	43	46
CC[C@@H](C)[C@@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044247	FG	On-Demand	Anodyne	CELA2A	31	46
CC[C@@H](C)[C@@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044247	FG	On-Demand	Anodyne	CTSS	25	44
CC[C@@H](C)[C@@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044247	FG	On-Demand	Anodyne	CTRB_BOVIN	45	31
CC[C@@H](C)[C@@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044247	FG	On-Demand	Anodyne	AKR1C3	20	42
CC[C@@H](C)[C@@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044247	FG	On-Demand	Anodyne	UTS2	43	37
CC[C@@H](C)[C@@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044247	FG	On-Demand	Anodyne	KCNK3	34	41
CC[C@@H](C)[C@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044256	FG	On-Demand	Anodyne	PRSS1	19	41
CC[C@@H](C)[C@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044256	FG	On-Demand	Anodyne	NPR1	41	32
CC[C@@H](C)[C@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044256	FG	On-Demand	Anodyne	CTSB	25	44
CC[C@@H](C)[C@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044256	FG	On-Demand	Anodyne	CTSG	30	42
CC[C@@H](C)[C@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044256	FG	On-Demand	Anodyne	CTSK	21	44
CC[C@@H](C)[C@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044256	FG	On-Demand	Anodyne	CTSL	37	44
CC[C@@H](C)[C@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044256	FG	On-Demand	Anodyne	CTRB1	43	46
CC[C@@H](C)[C@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044256	FG	On-Demand	Anodyne	CELA2A	31	46
CC[C@@H](C)[C@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044256	FG	On-Demand	Anodyne	CTSS	25	44
CC[C@@H](C)[C@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044256	FG	On-Demand	Anodyne	CTRB_BOVIN	45	31
CC[C@@H](C)[C@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044256	FG	On-Demand	Anodyne	AKR1C3	20	42
CC[C@@H](C)[C@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044256	FG	On-Demand	Anodyne	UTS2	43	37
CC[C@@H](C)[C@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044256	FG	On-Demand	Anodyne	KCNK3	34	41
CC[C@H](C)[C@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044257	FG	On-Demand	Anodyne	PRSS1	19	41
CC[C@H](C)[C@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044257	FG	On-Demand	Anodyne	NPR1	41	32
CC[C@H](C)[C@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044257	FG	On-Demand	Anodyne	CTSB	25	44
CC[C@H](C)[C@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044257	FG	On-Demand	Anodyne	CTSG	30	42
CC[C@H](C)[C@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044257	FG	On-Demand	Anodyne	CTSK	21	44
CC[C@H](C)[C@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044257	FG	On-Demand	Anodyne	CTSL	37	44
CC[C@H](C)[C@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044257	FG	On-Demand	Anodyne	CTRB1	43	46
CC[C@H](C)[C@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044257	FG	On-Demand	Anodyne	CELA2A	31	46
CC[C@H](C)[C@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044257	FG	On-Demand	Anodyne	CTSS	25	44
CC[C@H](C)[C@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044257	FG	On-Demand	Anodyne	CTRB_BOVIN	45	31
CC[C@H](C)[C@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044257	FG	On-Demand	Anodyne	AKR1C3	20	42
CC[C@H](C)[C@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044257	FG	On-Demand	Anodyne	UTS2	43	37
CC[C@H](C)[C@H](NC(=O)c1ccccc1)C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875044257	FG	On-Demand	Anodyne	KCNK3	34	41
CC[C@@H]1COCCN1CCNC(=O)NCc1ccc(NC(C)=O)cc1	ZINC000875044266	ED	On-Demand	Anodyne	MTOR	49	40
COCCN(CC1CCN(C)CC1)C(=O)Nc1cccc(OCC(N)=O)c1	ZINC000875044275	GD	On-Demand	Anodyne	EPHX2	17	40
COCCN(CC1CCN(C)CC1)C(=O)Nc1cccc(OCC(N)=O)c1	ZINC000875044275	GD	On-Demand	Anodyne	CHRNA10	48	34
COCCN(CC1CCN(C)CC1)C(=O)Nc1cccc(OCC(N)=O)c1	ZINC000875044275	GD	On-Demand	Anodyne	ACKR3	44	31
CC(=O)Nc1ccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875044280	ED	On-Demand	Anodyne	CHRM3	15	41
CC(=O)Nc1ccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875044280	ED	On-Demand	Anodyne	CCR3	29	42
CC(=O)Nc1ccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875044280	ED	On-Demand	Anodyne	CCR2	17	45
CC(=O)Nc1ccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875044280	ED	On-Demand	Anodyne	EPHX2	32	41
O=C(NCCO)C1CCN(C(=O)NCc2ccnc(N3CCCC3)c2)CC1	ZINC000875044298	GC	On-Demand	Anodyne	EPHX2	19	45
O=C(NCCO)C1CCN(C(=O)NCc2ccnc(N3CCCC3)c2)CC1	ZINC000875044298	GC	On-Demand	Anodyne	GPBAR1	23	44
CN1CCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)CCC1(C)C	ZINC000875044314	FF	On-Demand	Anodyne	L3MBTL3	48	39
CN1CCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)CCC1(C)C	ZINC000875044314	FF	On-Demand	Anodyne	NAMPT	20	41
NC(=O)COc1cccc(NC(=O)N2CCN(c3ccc(F)cc3F)CC2)c1	ZINC000875044317	GE	On-Demand	Anodyne	CACNA1H	42	35
NC(=O)COc1cccc(NC(=O)N2CCN(c3ccc(F)cc3F)CC2)c1	ZINC000875044317	GE	On-Demand	Anodyne	HTR1B	25	41
NC(=O)COc1cccc(NC(=O)N2CCN(c3ccc(F)cc3F)CC2)c1	ZINC000875044317	GE	On-Demand	Anodyne	PDGFRB	34	44
NC(=O)COc1cccc(NC(=O)N2CCN(c3ccc(F)cc3F)CC2)c1	ZINC000875044317	GE	On-Demand	Anodyne	NPY2R	87	38
NC(=O)COc1cccc(NC(=O)N2CCN(c3ccc(F)cc3F)CC2)c1	ZINC000875044317	GE	On-Demand	Anodyne	FAAH	24	41
NC(=O)COc1cccc(NC(=O)N2CCN(c3ccc(F)cc3F)CC2)c1	ZINC000875044317	GE	On-Demand	Anodyne	EPHX2	22	46
NC(=O)COc1cccc(NC(=O)N2CCN(c3ccc(F)cc3F)CC2)c1	ZINC000875044317	GE	On-Demand	Anodyne	TAAR1	34	40
NC(=O)COc1cccc(NC(=O)N2CCN(c3ccc(F)cc3F)CC2)c1	ZINC000875044317	GE	On-Demand	Anodyne	LIMK2	28	44
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875044318	GG	On-Demand	Anodyne	L3MBTL3	67	38
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)NC1([C@H]2CCCCO2)CCC1	ZINC000875044320	GG	On-Demand	Anodyne	L3MBTL3	67	38
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(OCc3ccccn3)c2)CC1	ZINC000875044332	GE	On-Demand	Anodyne	PDS	41	32
O=C(c1ccc(CNC(=O)N2C[C@H]3C[C@@H](O)C[C@H]2C3)cc1)N1CCCC1	ZINC000875044361	FD	On-Demand	Anodyne	L3MBTL3	69	39
O=C(c1ccc(CNC(=O)N2C[C@H]3C[C@H](O)C[C@H]2C3)cc1)N1CCCC1	ZINC000875044363	FD	On-Demand	Anodyne	L3MBTL3	69	39
CCCCCCCNC(=O)C(=O)NCc1ccnc(N2CCN(C)CC2)c1	ZINC000875044376	GD	On-Demand	Mild	HRH4	19	46
CCCCCCCNC(=O)C(=O)NCc1ccnc(N2CCN(C)CC2)c1	ZINC000875044376	GD	On-Demand	Mild	ASAH1	59	35
CC(=O)NC[C@@H]1CCCCN1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875044379	GE	On-Demand	Anodyne	HCRTR1	17	42
CC(=O)NC[C@@H]1CCCCN1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875044379	GE	On-Demand	Anodyne	L3MBTL3	77	39
CC(=O)NC[C@@H]1CCCCN1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875044379	GE	On-Demand	Anodyne	TMPRSS11D	40	31
NC(=O)COc1cccc(NC(=O)N2CC[C@@H]3CSC[C@@H]3C2)c1	ZINC000875044389	ED	On-Demand	Anodyne	LIMK2	20	40
NC(=O)COc1cccc(NC(=O)N2CC[C@H]3CSC[C@H]3C2)c1	ZINC000875044391	ED	On-Demand	Anodyne	LIMK2	20	40
NC(=O)COc1cccc(NC(=O)N2CC[C@H]3CSC[C@@H]3C2)c1	ZINC000875044393	ED	On-Demand	Anodyne	LIMK2	20	40
NC(=O)COc1cccc(NC(=O)N2CC[C@@H]3CSC[C@H]3C2)c1	ZINC000875044395	ED	On-Demand	Anodyne	LIMK2	20	40
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(C3CCCC3)CC2)CC1	ZINC000875044401	ED	On-Demand	Anodyne	L3MBTL3	59	35
CCCCCCCNC(=O)C(=O)NCc1ccnc(N2CCOCC2)c1	ZINC000875044411	FD	On-Demand	Mild	EPHB4	47	34
CCCCCCCNC(=O)C(=O)NCc1ccnc(N2CCOCC2)c1	ZINC000875044411	FD	On-Demand	Mild	ASAH1	59	45
O=C(c1ccc(CNC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)cc1)N1CCCC1	ZINC000875044466	GF	On-Demand	Anodyne	L3MBTL3	87	41
CS(=O)(=O)Nc1cccc(CNC(=O)N2CC[C@H]3CC[C@@H](C2)[S@]3=O)c1	ZINC000875044473	GD	On-Demand	Anodyne	ST14	51	33
CS(=O)(=O)Nc1cccc(CNC(=O)N2CC[C@H]3CC[C@@H](C2)[S@@]3=O)c1	ZINC000875044474	GD	On-Demand	Anodyne	ST14	51	33
CC(=O)Nc1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875044475	GG	On-Demand	Anodyne	TSHR	42	31
CC(=O)Nc1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875044475	GG	On-Demand	Anodyne	OPRK1	15	41
CC(=O)Nc1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875044475	GG	On-Demand	Anodyne	CCR5	18	44
CC(=O)Nc1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875044475	GG	On-Demand	Anodyne	CPT1A	20	41
CC(=O)Nc1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875044475	GG	On-Demand	Anodyne	PREP	25	42
CC(=O)Nc1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875044475	GG	On-Demand	Anodyne	TPSAB1	16	48
CC(=O)Nc1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875044475	GG	On-Demand	Anodyne	TMPRSS11D	62	35
CC(=O)Nc1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875044476	GG	On-Demand	Anodyne	TSHR	42	31
CC(=O)Nc1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875044476	GG	On-Demand	Anodyne	OPRK1	15	41
CC(=O)Nc1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875044476	GG	On-Demand	Anodyne	CCR5	18	44
CC(=O)Nc1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875044476	GG	On-Demand	Anodyne	CPT1A	20	41
CC(=O)Nc1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875044476	GG	On-Demand	Anodyne	PREP	25	42
CC(=O)Nc1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875044476	GG	On-Demand	Anodyne	TPSAB1	16	48
CC(=O)Nc1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875044476	GG	On-Demand	Anodyne	TMPRSS11D	62	35
CC(=O)Nc1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875044477	GG	On-Demand	Anodyne	TSHR	42	31
CC(=O)Nc1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875044477	GG	On-Demand	Anodyne	OPRK1	15	41
CC(=O)Nc1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875044477	GG	On-Demand	Anodyne	CCR5	18	44
CC(=O)Nc1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875044477	GG	On-Demand	Anodyne	CPT1A	20	41
CC(=O)Nc1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875044477	GG	On-Demand	Anodyne	PREP	25	42
CC(=O)Nc1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875044477	GG	On-Demand	Anodyne	TPSAB1	16	48
CC(=O)Nc1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875044477	GG	On-Demand	Anodyne	TMPRSS11D	62	35
CC(=O)Nc1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875044478	GG	On-Demand	Anodyne	TSHR	42	31
CC(=O)Nc1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875044478	GG	On-Demand	Anodyne	OPRK1	15	41
CC(=O)Nc1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875044478	GG	On-Demand	Anodyne	CCR5	18	44
CC(=O)Nc1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875044478	GG	On-Demand	Anodyne	CPT1A	20	41
CC(=O)Nc1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875044478	GG	On-Demand	Anodyne	PREP	25	42
CC(=O)Nc1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875044478	GG	On-Demand	Anodyne	TPSAB1	16	48
CC(=O)Nc1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875044478	GG	On-Demand	Anodyne	TMPRSS11D	62	35
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000875044503	FG	On-Demand	Anodyne	EPHX2	40	43
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000875044503	FG	On-Demand	Anodyne	TPSAB1	15	58
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000875044504	FG	On-Demand	Anodyne	EPHX2	40	43
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000875044504	FG	On-Demand	Anodyne	TPSAB1	15	58
COc1cc(NC(=O)[C@H]2C[C@H]2C)c(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cc1OC	ZINC000875044525	JJ	On-Demand	Anodyne	SCD1	43	54
COc1cc(NC(=O)[C@H]2C[C@H]2C)c(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cc1OC	ZINC000875044525	JJ	On-Demand	Anodyne	SCD	36	54
COc1cc(NC(=O)[C@H]2C[C@@H]2C)c(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cc1OC	ZINC000875044526	JJ	On-Demand	Anodyne	SCD1	43	54
COc1cc(NC(=O)[C@H]2C[C@@H]2C)c(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cc1OC	ZINC000875044526	JJ	On-Demand	Anodyne	SCD	36	54
COc1cc(NC(=O)[C@@H]2C[C@H]2C)c(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cc1OC	ZINC000875044527	JJ	On-Demand	Anodyne	SCD1	43	54
COc1cc(NC(=O)[C@@H]2C[C@H]2C)c(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cc1OC	ZINC000875044527	JJ	On-Demand	Anodyne	SCD	36	54
COc1cc(NC(=O)[C@@H]2C[C@@H]2C)c(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cc1OC	ZINC000875044528	JJ	On-Demand	Anodyne	SCD1	43	54
COc1cc(NC(=O)[C@@H]2C[C@@H]2C)c(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cc1OC	ZINC000875044528	JJ	On-Demand	Anodyne	SCD	36	54
CC(=O)Nc1ccc(CNC(=O)NC[C@H]2C[C@H](O)C2)cc1	ZINC000875044560	CD	On-Demand	Anodyne	EPHX2	16	42
CS(=O)(=O)NC1CN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000875044562	GC	On-Demand	Anodyne	L3MBTL3	68	38
CS(=O)(=O)NC1CN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000875044562	GC	On-Demand	Anodyne	NAMPT	33	40
CS(=O)(=O)NC1CN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000875044562	GC	On-Demand	Anodyne	TMPRSS11D	50	32
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875044597	FG	On-Demand	Anodyne	F2	39	44
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875044597	FG	On-Demand	Anodyne	TSHR	56	33
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875044597	FG	On-Demand	Anodyne	TRY1_BOVIN	35	41
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875044597	FG	On-Demand	Anodyne	DPP4	16	40
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875044597	FG	On-Demand	Anodyne	PREP	32	45
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875044597	FG	On-Demand	Anodyne	TPSAB1	15	47
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875044597	FG	On-Demand	Anodyne	TMPRSS11D	66	37
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875044599	FG	On-Demand	Anodyne	F2	39	44
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875044599	FG	On-Demand	Anodyne	TSHR	56	33
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875044599	FG	On-Demand	Anodyne	TRY1_BOVIN	35	41
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875044599	FG	On-Demand	Anodyne	DPP4	16	40
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875044599	FG	On-Demand	Anodyne	PREP	32	45
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875044599	FG	On-Demand	Anodyne	TPSAB1	15	47
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875044599	FG	On-Demand	Anodyne	TMPRSS11D	66	37
CCO[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)C(C)C	ZINC000875044613	EF	On-Demand	Anodyne	ACE	66	47
CCO[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)C(C)C	ZINC000875044613	EF	On-Demand	Anodyne	MME	151	47
CCO[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)C(C)C	ZINC000875044613	EF	On-Demand	Anodyne	ANPEP	71	39
CCO[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)C(C)C	ZINC000875044613	EF	On-Demand	Anodyne	TACR1	23	42
CCO[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)C(C)C	ZINC000875044613	EF	On-Demand	Anodyne	CTRA_BOVIN	16	44
CCO[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)C(C)C	ZINC000875044613	EF	On-Demand	Anodyne	FCER2	96	40
CCO[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)C(C)C	ZINC000875044613	EF	On-Demand	Anodyne	CASP3	21	40
CCO[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)C(C)C	ZINC000875044613	EF	On-Demand	Anodyne	KLK3	51	32
CCO[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)C(C)C	ZINC000875044613	EF	On-Demand	Anodyne	CTSB	74	41
CCO[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)C(C)C	ZINC000875044613	EF	On-Demand	Anodyne	PAPA1_CARPA	77	43
CCO[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)C(C)C	ZINC000875044613	EF	On-Demand	Anodyne	CYSP_TRYCR	68	40
CCO[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)C(C)C	ZINC000875044613	EF	On-Demand	Anodyne	CTSK	29	40
CCO[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)C(C)C	ZINC000875044613	EF	On-Demand	Anodyne	CTSL	54	40
CCO[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)C(C)C	ZINC000875044613	EF	On-Demand	Anodyne	CPA1	29	47
CCO[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)C(C)C	ZINC000875044613	EF	On-Demand	Anodyne	CACNA1B	40	34
CCO[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)C(C)C	ZINC000875044613	EF	On-Demand	Anodyne	TIMP3	86	39
CCO[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)C(C)C	ZINC000875044613	EF	On-Demand	Anodyne	CAPNS1	73	42
CCO[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)C(C)C	ZINC000875044613	EF	On-Demand	Anodyne	MMP2	28	40
CCO[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)C(C)C	ZINC000875044613	EF	On-Demand	Anodyne	MMP3	45	40
CCO[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)C(C)C	ZINC000875044613	EF	On-Demand	Anodyne	MMP8	31	41
CCO[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)C(C)C	ZINC000875044613	EF	On-Demand	Anodyne	HLA-DRB1	100	43
CCO[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)C(C)C	ZINC000875044613	EF	On-Demand	Anodyne	CTSS	22	40
CCO[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)C(C)C	ZINC000875044613	EF	On-Demand	Anodyne	CAPN1	100	47
CCO[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)C(C)C	ZINC000875044613	EF	On-Demand	Anodyne	MMP9	32	41
CCO[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)C(C)C	ZINC000875044613	EF	On-Demand	Anodyne	CAPN2	117	42
CCO[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)C(C)C	ZINC000875044613	EF	On-Demand	Anodyne	ACE2	90	47
CCO[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)C(C)C	ZINC000875044613	EF	On-Demand	Anodyne	MMP7	30	40
CCO[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)C(C)C	ZINC000875044613	EF	On-Demand	Anodyne	MMP1	46	46
CCO[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)C(C)C	ZINC000875044613	EF	On-Demand	Anodyne	FPR1	80	41
CCO[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)C(C)C	ZINC000875044613	EF	On-Demand	Anodyne	NPR	81	41
CCO[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)C(C)C	ZINC000875044613	EF	On-Demand	Anodyne	BLA1_STEMA	65	35
CCO[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)C(C)C	ZINC000875044613	EF	On-Demand	Anodyne	PSMB8	49	35
CCO[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(CC)CC)C(C)C	ZINC000875044613	EF	On-Demand	Anodyne	NPFFR1	55	32
O=C(NCC[C@H](O)C(F)F)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875044622	FD	On-Demand	Anodyne	DPP7	66	37
O=C(NCC[C@H](O)C(F)F)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875044622	FD	On-Demand	Anodyne	MLYCD	18	41
O=C(NCC[C@H](O)C(F)F)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875044622	FD	On-Demand	Anodyne	L3MBTL3	57	37
O=C(NCC[C@@H](O)C(F)F)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875044623	FD	On-Demand	Anodyne	DPP7	66	37
O=C(NCC[C@@H](O)C(F)F)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875044623	FD	On-Demand	Anodyne	MLYCD	18	41
O=C(NCC[C@@H](O)C(F)F)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875044623	FD	On-Demand	Anodyne	L3MBTL3	57	37
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N[C@@H]1C[C@H](CO)C1	ZINC000875044624	ED	On-Demand	Anodyne	EPHX2	18	41
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N[C@@H]1C[C@H](CO)C1	ZINC000875044624	ED	On-Demand	Anodyne	L3MBTL3	71	39
O=C(c1ccc(CNC(=O)N2CCC[C@@H]2Cn2ccnc2)cc1)N1CCCC1	ZINC000875044625	GE	On-Demand	Anodyne	NOS2	41	37
O=C(c1ccc(CNC(=O)N2CCC[C@@H]2Cn2ccnc2)cc1)N1CCCC1	ZINC000875044625	GE	On-Demand	Anodyne	L3MBTL3	55	37
O=C(c1ccc(CNC(=O)N2CCC[C@@H]2Cn2ccnc2)cc1)N1CCCC1	ZINC000875044625	GE	On-Demand	Anodyne	NAMPT	28	43
O=C(c1ccc(CNC(=O)N2CCC[C@@H]2Cn2ccnc2)cc1)N1CCCC1	ZINC000875044625	GE	On-Demand	Anodyne	TMPRSS11D	49	31
COC(=O)[C@@]1(C)CN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C[C@@H]1C	ZINC000875044626	GE	On-Demand	Anodyne	L3MBTL3	49	36
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N[C@@H]1CCOC[C@@H]1O	ZINC000875044636	EC	On-Demand	Anodyne	L3MBTL3	71	39
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N[C@H]1CCOC[C@@H]1O	ZINC000875044637	EC	On-Demand	Anodyne	L3MBTL3	71	39
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N[C@@H]1CCOC[C@H]1O	ZINC000875044638	EC	On-Demand	Anodyne	L3MBTL3	71	39
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N[C@H]1CCOC[C@H]1O	ZINC000875044639	EC	On-Demand	Anodyne	L3MBTL3	71	39
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)NC[C@H](O)[C@H]1CCCO1	ZINC000875044640	FD	On-Demand	Anodyne	L3MBTL3	69	39
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)NC[C@@H](O)[C@H]1CCCO1	ZINC000875044641	FD	On-Demand	Anodyne	L3MBTL3	69	39
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)NC[C@H](O)[C@@H]1CCCO1	ZINC000875044642	FD	On-Demand	Anodyne	L3MBTL3	69	39
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)NC[C@@H](O)[C@@H]1CCCO1	ZINC000875044643	FD	On-Demand	Anodyne	L3MBTL3	69	39
CCCCCCCNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)nc1	ZINC000875044658	GE	On-Demand	Mild	ASAH1	59	34
CCCCCCCNC(=O)C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1	ZINC000875044659	GE	On-Demand	Mild	ASAH1	59	34
CCCCCCCNC(=O)C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)nc1	ZINC000875044660	GE	On-Demand	Mild	ASAH1	59	34
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N[C@H]1COC[C@H]1O	ZINC000875044668	EC	On-Demand	Anodyne	L3MBTL3	69	39
O=C(c1ccc(CNC(=O)N2CC[C@@H]3CC[C@@H](O)[C@@H]32)cc1)N1CCCC1	ZINC000875044669	FD	On-Demand	Anodyne	L3MBTL3	88	43
O=C(c1ccc(CNC(=O)N2CC[C@@H]3CC[C@@H](O)[C@@H]32)cc1)N1CCCC1	ZINC000875044669	FD	On-Demand	Anodyne	NAMPT	22	42
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CCCC(F)(F)CC1	ZINC000875044675	FG	On-Demand	Anodyne	L3MBTL3	61	38
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CCCC(F)(F)CC1	ZINC000875044675	FG	On-Demand	Anodyne	NAMPT	21	43
O=C(c1ccc(CNC(=O)N2C[C@H](O)C[C@H]2C2CC2)cc1)N1CCCC1	ZINC000875044681	FD	On-Demand	Anodyne	L3MBTL3	77	41
O=C(c1ccc(CNC(=O)N2C[C@H](O)C[C@@H]2C2CC2)cc1)N1CCCC1	ZINC000875044682	FD	On-Demand	Anodyne	L3MBTL3	77	41
O=C(c1ccc(CNC(=O)N2C[C@@H](O)C[C@H]2C2CC2)cc1)N1CCCC1	ZINC000875044683	FD	On-Demand	Anodyne	L3MBTL3	77	41
O=C(c1ccc(CNC(=O)N2C[C@@H](O)C[C@@H]2C2CC2)cc1)N1CCCC1	ZINC000875044684	FD	On-Demand	Anodyne	L3MBTL3	77	41
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875044685	FG	On-Demand	Anodyne	F2	39	44
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875044685	FG	On-Demand	Anodyne	TSHR	56	33
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875044685	FG	On-Demand	Anodyne	TRY1_BOVIN	35	41
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875044685	FG	On-Demand	Anodyne	DPP4	16	40
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875044685	FG	On-Demand	Anodyne	PREP	32	45
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875044685	FG	On-Demand	Anodyne	TPSAB1	15	47
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875044685	FG	On-Demand	Anodyne	TMPRSS11D	66	37
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875044687	FG	On-Demand	Anodyne	F2	39	44
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875044687	FG	On-Demand	Anodyne	TSHR	56	33
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875044687	FG	On-Demand	Anodyne	TRY1_BOVIN	35	41
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875044687	FG	On-Demand	Anodyne	DPP4	16	40
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875044687	FG	On-Demand	Anodyne	PREP	32	45
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875044687	FG	On-Demand	Anodyne	TPSAB1	15	47
CC(=O)Nc1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875044687	FG	On-Demand	Anodyne	TMPRSS11D	66	37
CC(=O)Nc1ccc(CNC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)cc1	ZINC000875044689	GD	On-Demand	Anodyne	TPSAB1	15	41
CCC[C@@H](CCO)NC(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875044690	EE	On-Demand	Anodyne	L3MBTL3	53	35
CCC[C@H](CCO)NC(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875044692	EE	On-Demand	Anodyne	L3MBTL3	53	35
CO[C@H]1CN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)[C@](C)(CO)C1	ZINC000875044696	GD	On-Demand	Anodyne	L3MBTL3	47	36
CO[C@H]1CN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)[C@@](C)(CO)C1	ZINC000875044697	GD	On-Demand	Anodyne	L3MBTL3	47	36
CN(CCNC(=O)NCc1cccc(NS(C)(=O)=O)c1)CC(F)F	ZINC000875044703	FD	On-Demand	Anodyne	TRPV1	23	41
O=C(NC(C1CC1)C1CC1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875044718	GH	On-Demand	Anodyne	ABL1	15	45
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CCCC2(CC1)CC2	ZINC000875044719	FG	On-Demand	Anodyne	L3MBTL3	66	40
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CCCC2(CC1)CC2	ZINC000875044719	FG	On-Demand	Anodyne	NAMPT	23	44
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875044721	GE	On-Demand	Anodyne	DPP7	45	35
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875044721	GE	On-Demand	Anodyne	L3MBTL3	105	45
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875044722	GE	On-Demand	Anodyne	DPP7	45	35
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875044722	GE	On-Demand	Anodyne	L3MBTL3	105	45
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3ccc(C(=O)N4CCCC4)cc3)C[C@@H]1C2	ZINC000875044744	GE	On-Demand	Anodyne	EPHX2	18	42
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3ccc(C(=O)N4CCCC4)cc3)C[C@@H]1C2	ZINC000875044744	GE	On-Demand	Anodyne	L3MBTL3	49	35
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875044750	EE	On-Demand	Anodyne	DPP7	23	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875044750	EE	On-Demand	Anodyne	L3MBTL3	51	35
CN(C)CCOc1cccc(CNC(=O)C(=O)NCc2ncc(Cl)s2)c1	ZINC000875044757	GD	On-Demand	Anodyne	ROCK2	27	43
CN(C)CCOc1cccc(CNC(=O)C(=O)NCc2ncc(Cl)s2)c1	ZINC000875044757	GD	On-Demand	Anodyne	PDS	51	35
CC(=O)Nc1ccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875044766	DD	On-Demand	Anodyne	NPY2R	24	41
CC(=O)Nc1ccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875044766	DD	On-Demand	Anodyne	EPHX2	31	41
CC(=O)Nc1ccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875044766	DD	On-Demand	Anodyne	TPSAB1	17	47
CC(=O)Nc1ccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875044768	DD	On-Demand	Anodyne	NPY2R	24	41
CC(=O)Nc1ccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875044768	DD	On-Demand	Anodyne	EPHX2	31	41
CC(=O)Nc1ccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875044768	DD	On-Demand	Anodyne	TPSAB1	17	47
CC(=O)Nc1ccc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)cc1	ZINC000875044791	GF	On-Demand	Anodyne	TSHR	48	31
CC(=O)Nc1ccc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)cc1	ZINC000875044791	GF	On-Demand	Anodyne	SIGMAR1	18	42
CC(=O)Nc1ccc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)cc1	ZINC000875044791	GF	On-Demand	Anodyne	FAAH	17	43
CC(=O)Nc1ccc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)cc1	ZINC000875044791	GF	On-Demand	Anodyne	NOD2	41	34
CC(=O)Nc1ccc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)cc1	ZINC000875044791	GF	On-Demand	Anodyne	NAMPT	54	40
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)[C@H]1CC1(Cl)Cl	ZINC000875044792	FI	On-Demand	Anodyne	SCD1	37	48
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)[C@H]1CC1(Cl)Cl	ZINC000875044792	FI	On-Demand	Anodyne	SCD	31	48
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)[C@@H]1CC1(Cl)Cl	ZINC000875044793	FI	On-Demand	Anodyne	SCD1	37	48
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)[C@@H]1CC1(Cl)Cl	ZINC000875044793	FI	On-Demand	Anodyne	SCD	31	48
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(NC(C)=O)cc1	ZINC000875044811	DD	On-Demand	Anodyne	ANPEP	24	45
O=C(NC(C1CC1)C1CC1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875044812	EG	On-Demand	Anodyne	ACE	25	40
O=C(NC(C1CC1)C1CC1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875044813	EG	On-Demand	Anodyne	ACE	25	40
O=C(NC(C1CC1)C1CC1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875044814	EG	On-Demand	Anodyne	ACE	25	40
O=C(NC(C1CC1)C1CC1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875044815	EG	On-Demand	Anodyne	ACE	25	40
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccc(OCc3ccccn3)cc2)C1	ZINC000875044830	GE	On-Demand	Anodyne	TSHR	41	32
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2cccc(OCc3ccccn3)c2)C1	ZINC000875044842	GE	On-Demand	Anodyne	PDS	42	33
COC(=O)c1ccc(CCNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875044853	FD	On-Demand	Anodyne	SSTR5	40	36
COC(=O)c1ccc(CCNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875044853	FD	On-Demand	Anodyne	MCHR1	19	40
COC(=O)c1ccc(CCNC(=O)N2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000875044854	FG	On-Demand	Anodyne	EPHX2	20	40
COC(=O)c1ccc(CCNC(=O)N2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000875044855	FG	On-Demand	Anodyne	EPHX2	20	40
O=C(Nc1cc(Cl)ccc1F)c1c(C(F)F)nc2n1CCCC2	ZINC000875044887	EI	On-Demand	Anodyne	CNR1	51	32
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1ccc(CS(=O)(=O)c2ccccc2)o1	ZINC000875044904	JJ	On-Demand	Anodyne	SCD1	38	47
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1ccc(CS(=O)(=O)c2ccccc2)o1	ZINC000875044904	JJ	On-Demand	Anodyne	SCD	32	47
CS(=O)(=O)Nc1cccc(CNC(=O)N(C2CC2)C2CC2)c1	ZINC000875044911	DD	On-Demand	Anodyne	TRPV1	34	40
CC(=O)Nc1ccc(CNC(=O)N2CCC3(CCN(C)CC3)CC2)cc1	ZINC000875044918	FF	On-Demand	Anodyne	TPSAB1	16	47
CC(=O)Nc1ccc(CNC(=O)N2CCC3(CCN(C)CC3)CC2)cc1	ZINC000875044918	FF	On-Demand	Anodyne	NAMPT	41	38
C#CC[C@H](COC)NC(=O)C(=O)NCc1ccc(OCc2ccccn2)cc1	ZINC000875044926	GD	On-Demand	Mild	LPAR1	18	40
C#CC[C@H](COC)NC(=O)C(=O)NCc1ccc(OCc2ccccn2)cc1	ZINC000875044926	GD	On-Demand	Mild	LPAR3	21	40
C#CC[C@@H](COC)NC(=O)C(=O)NCc1ccc(OCc2ccccn2)cc1	ZINC000875044927	GD	On-Demand	Mild	LPAR1	18	40
C#CC[C@@H](COC)NC(=O)C(=O)NCc1ccc(OCc2ccccn2)cc1	ZINC000875044927	GD	On-Demand	Mild	LPAR3	21	40
CC(=O)Nc1ccc(CNC(=O)N2CCO[C@H](C(F)(F)F)CC2)cc1	ZINC000875044946	FF	On-Demand	Anodyne	EPHX2	43	36
CC(=O)Nc1ccc(CNC(=O)N2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000875044947	FF	On-Demand	Anodyne	EPHX2	43	36
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(OCCN(C)C)c2)CC1	ZINC000875044968	GD	On-Demand	Anodyne	HRH2	30	40
CC(=O)Nc1ccc(CNC(=O)N2CCN(C)C(C)(C)CC2)cc1	ZINC000875044983	EE	On-Demand	Anodyne	TPSAB1	17	47
CC(=O)Nc1ccc(CNC(=O)NC2CC(Nc3ccccc3)C2)cc1	ZINC000875044995	FG	On-Demand	Anodyne	TSHR	40	30
CC(=O)Nc1ccc(CNC(=O)NC2CC(Nc3ccccc3)C2)cc1	ZINC000875044995	FG	On-Demand	Anodyne	TIMP3	47	32
CC(=O)Nc1ccc(CNC(=O)NC2CC(Nc3ccccc3)C2)cc1	ZINC000875044995	FG	On-Demand	Anodyne	EPHX2	43	46
CC(=O)Nc1ccc(CNC(=O)NC2CC(Nc3ccccc3)C2)cc1	ZINC000875044995	FG	On-Demand	Anodyne	NAMPT	38	40
O=C(NCc1ccc(C(=O)N2CCOCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875045010	EC	On-Demand	Anodyne	EPHX2	16	44
O=C(NCC[C@H](O)C1CCCC1)NCc1ccc(C(=O)N2CCOCC2)cc1	ZINC000875045018	GD	On-Demand	Anodyne	L3MBTL3	47	35
O=C(NCC[C@@H](O)C1CCCC1)NCc1ccc(C(=O)N2CCOCC2)cc1	ZINC000875045019	GD	On-Demand	Anodyne	L3MBTL3	47	35
CS(=O)(=O)Nc1cccc(CNC(=O)N2CC=CC2)c1	ZINC000875045033	CD	On-Demand	Anodyne	TRPV1	21	40
COc1cc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)ccn1	ZINC000875045048	DD	On-Demand	Anodyne	GRIN2B	18	40
CC(=O)Nc1ccc(CNC(=O)N2Cc3cccnc3N3C[C@H](O)C[C@H]3C2)cc1	ZINC000875045071	GD	On-Demand	Anodyne	NAMPT	35	43
CC(=O)Nc1ccc(CNC(=O)N2Cc3cccnc3N3C[C@H](O)C[C@H]3C2)cc1	ZINC000875045071	GD	On-Demand	Anodyne	VHL	56	32
O=C(NC(C1CC1)C1CC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875045078	EG	On-Demand	Anodyne	OPRL1	19	52
COc1ccccc1[C@H]1CCCN(C(=O)NCC[C@H]2CCCO2)CC1	ZINC000875045087	EH	On-Demand	Anodyne	DRD2	23	48
COc1ccccc1[C@H]1CCCN(C(=O)NCC[C@H]2CCCO2)CC1	ZINC000875045087	EH	On-Demand	Anodyne	DRD4	15	48
COc1ccccc1[C@H]1CCCN(C(=O)NCC[C@H]2CCCO2)CC1	ZINC000875045087	EH	On-Demand	Anodyne	ACKR3	61	33
COc1ccccc1[C@@H]1CCCN(C(=O)NCC[C@H]2CCCO2)CC1	ZINC000875045090	EH	On-Demand	Anodyne	DRD2	23	48
COc1ccccc1[C@@H]1CCCN(C(=O)NCC[C@H]2CCCO2)CC1	ZINC000875045090	EH	On-Demand	Anodyne	DRD4	15	48
COc1ccccc1[C@@H]1CCCN(C(=O)NCC[C@H]2CCCO2)CC1	ZINC000875045090	EH	On-Demand	Anodyne	ACKR3	61	33
COc1ccccc1[C@H]1CCCN(C(=O)NCC[C@@H]2CCCO2)CC1	ZINC000875045092	EH	On-Demand	Anodyne	DRD2	23	48
COc1ccccc1[C@H]1CCCN(C(=O)NCC[C@@H]2CCCO2)CC1	ZINC000875045092	EH	On-Demand	Anodyne	DRD4	15	48
COc1ccccc1[C@H]1CCCN(C(=O)NCC[C@@H]2CCCO2)CC1	ZINC000875045092	EH	On-Demand	Anodyne	ACKR3	61	33
COc1ccccc1[C@@H]1CCCN(C(=O)NCC[C@@H]2CCCO2)CC1	ZINC000875045095	EH	On-Demand	Anodyne	DRD2	23	48
COc1ccccc1[C@@H]1CCCN(C(=O)NCC[C@@H]2CCCO2)CC1	ZINC000875045095	EH	On-Demand	Anodyne	DRD4	15	48
COc1ccccc1[C@@H]1CCCN(C(=O)NCC[C@@H]2CCCO2)CC1	ZINC000875045095	EH	On-Demand	Anodyne	ACKR3	61	33
O=C(NCc1ccc(C(=O)N2CCOCC2)cc1)N1Cc2cccc(O)c2C1	ZINC000875045104	GE	On-Demand	Clean	NAMPT	30	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(NC(C)=O)cc1	ZINC000875045114	ED	On-Demand	Anodyne	SLC6A4	30	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(NC(C)=O)cc1	ZINC000875045114	ED	On-Demand	Anodyne	SLC6A3	54	49
COc1cc(C#N)cc(Cl)c1OC(=O)Cn1cc(C)c(C(F)(F)F)n1	ZINC000875045115	FG	On-Demand	Mild	CCR1	19	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(NC(C)=O)cc1	ZINC000875045116	ED	On-Demand	Anodyne	SLC6A4	30	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(NC(C)=O)cc1	ZINC000875045116	ED	On-Demand	Anodyne	SLC6A3	54	49
COc1ccc([N+](=O)[O-])cc1OC(=O)[C@H]1CCCN1C(C)=O	ZINC000875045126	DD	On-Demand	Bother	FKBP1A	39	40
COc1ccc([N+](=O)[O-])cc1OC(=O)[C@H]1CCCN1C(C)=O	ZINC000875045126	DD	On-Demand	Bother	LGMN	52	35
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3ccc(NC(C)=O)cc3)C[C@@H]1C2	ZINC000875045141	ED	On-Demand	Anodyne	EPHX2	31	44
COc1cc(CNC(=O)C(=O)NCc2cccc3[nH]ccc23)ccc1OC(C)C	ZINC000875045146	GF	On-Demand	Anodyne	EDNRB	49	34
COc1cc(CNC(=O)C(=O)NCc2cccc3[nH]ccc23)ccc1OC(C)C	ZINC000875045146	GF	On-Demand	Anodyne	TACR1	18	41
C=CC(C)(C)CCNC(=O)C(=O)NCc1ccc(OC(C)C)c(OC)c1	ZINC000875045234	FF	On-Demand	Mild	MT-ND1	23	41
COc1cc(CNC(=O)C(=O)NCc2cccnc2C)ccc1OC(C)C	ZINC000875045235	FE	On-Demand	Anodyne	HCRTR2	15	41
O=C(NC(C1CC1)C1CC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875045241	DG	On-Demand	Anodyne	ACE	32	42
O=C(NC(C1CC1)C1CC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875045242	DG	On-Demand	Anodyne	ACE	32	42
O=C(NC(C1CC1)C1CC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875045243	DG	On-Demand	Anodyne	ACE	32	42
O=C(NC(C1CC1)C1CC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875045244	DG	On-Demand	Anodyne	ACE	32	42
CC(=O)N[C@H](CC(C)C)C(=O)N1CCCc2cc(C)ccc21	ZINC000875045247	DF	On-Demand	Anodyne	CTSL	15	40
CS(=O)(=O)Nc1cccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875045264	GF	On-Demand	Anodyne	EPHX2	23	43
CS(=O)(=O)Nc1cccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875045265	GF	On-Demand	Anodyne	EPHX2	23	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2cccc(OCCN(C)C)c2)C1	ZINC000875045284	GD	On-Demand	Anodyne	HRH2	31	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2cccc(OCCN(C)C)c2)C1	ZINC000875045284	GD	On-Demand	Anodyne	HRH3	15	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2cccc(OCCN(C)C)c2)C1	ZINC000875045285	GD	On-Demand	Anodyne	HRH2	31	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2cccc(OCCN(C)C)c2)C1	ZINC000875045285	GD	On-Demand	Anodyne	HRH3	15	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(OCCN(C)C)cc2)C1	ZINC000875045303	GD	On-Demand	Anodyne	HRH3	29	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(OCCN(C)C)cc2)C1	ZINC000875045304	GD	On-Demand	Anodyne	HRH3	29	40
O=C(CS[C@@H]1CCS(=O)(=O)C1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875045306	HF	On-Demand	Anodyne	SCD1	32	42
O=C(CS[C@@H]1CCS(=O)(=O)C1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875045306	HF	On-Demand	Anodyne	SCD	27	42
O=C(CS[C@H]1CCS(=O)(=O)C1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875045307	HF	On-Demand	Anodyne	SCD1	32	42
O=C(CS[C@H]1CCS(=O)(=O)C1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875045307	HF	On-Demand	Anodyne	SCD	27	42
O=C(NCC[C@@H]1CCCO1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875045308	EF	On-Demand	Anodyne	CPT1A	55	32
O=C(NCC[C@@H]1CCCO1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875045309	EF	On-Demand	Anodyne	CPT1A	55	32
O=C(NCC[C@@H]1CCCO1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875045310	EF	On-Demand	Anodyne	CPT1A	55	32
O=C(NCC[C@@H]1CCCO1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875045311	EF	On-Demand	Anodyne	CPT1A	55	32
COc1ccc([N+](=O)[O-])cc1OC(=O)C1CCN(C(C)C)CC1	ZINC000875045313	DF	On-Demand	Bother	SLC5A7	32	41
CC(C)(C)OC(=O)N1CCC(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)CC1	ZINC000875045389	IJ	On-Demand	Anodyne	SCD1	36	45
CC(C)(C)OC(=O)N1CCC(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)CC1	ZINC000875045389	IJ	On-Demand	Anodyne	GPR119	48	42
CC(C)(C)OC(=O)N1CCC(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)CC1	ZINC000875045389	IJ	On-Demand	Anodyne	SCD	31	45
COc1cc(C#N)cc(Cl)c1OC(=O)[C@@H]1C[C@H]1c1ccsc1	ZINC000875045405	EH	On-Demand	Mild	NPBWR1	88	34
COc1cc(C#N)cc(Cl)c1OC(=O)[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000875045438	GG	On-Demand	Mild	SLC18A3	19	42
COc1cc(C#N)cc(Cl)c1OC(=O)[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000875045439	GG	On-Demand	Mild	SLC18A3	19	42
COc1cc(C#N)cc(Cl)c1OC(=O)c1ccnc(N2CCOCC2)n1	ZINC000875045488	FE	On-Demand	Mild	PDE5A	18	40
COc1cc(C#N)cc(Cl)c1OC(=O)c1ccnc(N2CCOCC2)n1	ZINC000875045488	FE	On-Demand	Mild	TNIK	30	40
N#Cc1ccc(Cn2cc(NC(=O)NCC[C@@H]3CCCO3)cn2)cc1	ZINC000875045525	EE	On-Demand	Mild	CCR3	21	41
N#Cc1ccc(Cn2cc(NC(=O)NCC[C@@H]3CCCO3)cn2)cc1	ZINC000875045525	EE	On-Demand	Mild	ITK	22	47
N#Cc1ccc(Cn2cc(NC(=O)NCC[C@@H]3CCCO3)cn2)cc1	ZINC000875045525	EE	On-Demand	Mild	PANC	59	40
N#Cc1ccc(Cn2cc(NC(=O)NCC[C@H]3CCCO3)cn2)cc1	ZINC000875045526	EE	On-Demand	Mild	CCR3	21	41
N#Cc1ccc(Cn2cc(NC(=O)NCC[C@H]3CCCO3)cn2)cc1	ZINC000875045526	EE	On-Demand	Mild	ITK	22	47
N#Cc1ccc(Cn2cc(NC(=O)NCC[C@H]3CCCO3)cn2)cc1	ZINC000875045526	EE	On-Demand	Mild	PANC	59	40
COc1ccc([N+](=O)[O-])cc1OC(=O)CC(F)(F)C(F)(F)F	ZINC000875045571	EG	On-Demand	Bother	KCNMA1	20	40
COc1cc(CNC(=O)C(=O)N2[C@H]3CC[C@H]2[C@@H](C)[C@H](O)C3)ccc1OC(C)C	ZINC000875045632	GD	On-Demand	Anodyne	SLC6A4	16	41
COc1cc(CNC(=O)C(=O)N2[C@H]3CC[C@H]2[C@H](C)[C@@H](O)C3)ccc1OC(C)C	ZINC000875045633	GD	On-Demand	Anodyne	SLC6A4	16	41
COc1cc(CNC(=O)C(=O)N2[C@H]3CC[C@H]2[C@@H](C)[C@@H](O)C3)ccc1OC(C)C	ZINC000875045634	GD	On-Demand	Anodyne	SLC6A4	16	41
COc1cc(CNC(=O)C(=O)N2[C@H]3CC[C@H]2[C@H](C)[C@H](O)C3)ccc1OC(C)C	ZINC000875045635	GD	On-Demand	Anodyne	SLC6A4	16	41
CN1CCN(C(C)(C)CNC(=O)N2C[C@@H]3[C@@H](C[C@H]3c3ccccc3)C2)CC1	ZINC000875045671	FE	On-Demand	Anodyne	EPHX2	15	40
CN1CCN(C(C)(C)CNC(=O)N2C[C@@H]3[C@@H](C[C@H]3c3ccccc3)C2)CC1	ZINC000875045671	FE	On-Demand	Anodyne	RBP4	45	36
C#CC[C@@H](COC)NC(=O)C(=O)NCc1cccc(OCC)c1	ZINC000875045673	DC	On-Demand	Mild	ROCK2	18	41
C#CC[C@@H](COC)NC(=O)C(=O)NCc1cccc(OCC)c1	ZINC000875045673	DC	On-Demand	Mild	PDS	95	42
C#CC[C@H](COC)NC(=O)C(=O)NCc1cccc(OCC)c1	ZINC000875045674	DC	On-Demand	Mild	ROCK2	18	41
C#CC[C@H](COC)NC(=O)C(=O)NCc1cccc(OCC)c1	ZINC000875045674	DC	On-Demand	Mild	PDS	95	42
O=C(NCC[C@@H]1CCCO1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875045704	EE	On-Demand	Anodyne	ACHE	28	46
O=C(NCC[C@H]1CCCO1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875045705	EE	On-Demand	Anodyne	ACHE	28	46
CCc1ccc(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)s1	ZINC000875045716	FJ	On-Demand	Anodyne	SCD1	44	56
CCc1ccc(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)s1	ZINC000875045716	FJ	On-Demand	Anodyne	SCD	37	56
COc1cc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)ccn1	ZINC000875045757	FF	On-Demand	Anodyne	FKBP1A	55	40
COc1cc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)ccn1	ZINC000875045757	FF	On-Demand	Anodyne	CPT1A	81	38
COc1cc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)ccn1	ZINC000875045758	FF	On-Demand	Anodyne	FKBP1A	55	40
COc1cc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)ccn1	ZINC000875045758	FF	On-Demand	Anodyne	CPT1A	81	38
COc1cc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)ccn1	ZINC000875045759	FF	On-Demand	Anodyne	FKBP1A	55	40
COc1cc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)ccn1	ZINC000875045759	FF	On-Demand	Anodyne	CPT1A	81	38
COc1cc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)ccn1	ZINC000875045760	FF	On-Demand	Anodyne	FKBP1A	55	40
COc1cc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)ccn1	ZINC000875045760	FF	On-Demand	Anodyne	CPT1A	81	38
COc1ccc(-c2nnc(S)n2CCC(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cc1	ZINC000875045794	JJ	On-Demand	Anodyne	SCD1	39	49
COc1ccc(-c2nnc(S)n2CCC(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cc1	ZINC000875045794	JJ	On-Demand	Anodyne	SCD	36	49
COc1cc(CNC(=O)N2CC3(CCN(C(=O)OC(C)(C)C)CC3)C2)ccn1	ZINC000875045823	GF	On-Demand	Anodyne	GPR119	31	40
CC[C@@H](NC(=O)NCc1ccnc(OC)c1)[C@H](O)c1ccccc1	ZINC000875045827	EE	On-Demand	Anodyne	PDS	47	36
CC[C@@H](NC(=O)NCc1ccnc(OC)c1)[C@@H](O)c1ccccc1	ZINC000875045829	EE	On-Demand	Anodyne	PDS	47	36
COc1cc(CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)ccc1OC(C)C	ZINC000875045862	GD	On-Demand	Anodyne	MT-ND1	19	40
COc1cc(CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)ccc1OC(C)C	ZINC000875045863	GD	On-Demand	Anodyne	MT-ND1	19	40
O=C(NCC[C@H]1CCCO1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875045864	DE	On-Demand	Anodyne	EPHX2	18	44
O=C(NCC[C@H]1CCCO1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875045864	DE	On-Demand	Anodyne	SMO	28	41
O=C(NCC[C@@H]1CCCO1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875045865	DE	On-Demand	Anodyne	EPHX2	18	44
O=C(NCC[C@@H]1CCCO1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875045865	DE	On-Demand	Anodyne	SMO	28	41
O=C(NCC[C@H]1CCCO1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875045866	DE	On-Demand	Anodyne	EPHX2	18	44
O=C(NCC[C@H]1CCCO1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875045866	DE	On-Demand	Anodyne	SMO	28	41
O=C(NCC[C@@H]1CCCO1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875045867	DE	On-Demand	Anodyne	EPHX2	18	44
O=C(NCC[C@@H]1CCCO1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875045867	DE	On-Demand	Anodyne	SMO	28	41
COc1cc(CNC(=O)C(=O)NCc2ccc(C)o2)ccc1OC(C)C	ZINC000875045874	FE	On-Demand	Anodyne	MT-ND1	23	41
COc1cc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)ccn1	ZINC000875045878	EF	On-Demand	Anodyne	EPHX2	19	43
C=CC(C)(C)CCCNC(=O)C(=O)NCc1cccc(OCC)c1	ZINC000875045908	EF	On-Demand	Mild	PDS	81	38
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)C1=CC=CN2CCS(=O)(=O)N=C12	ZINC000875045968	IE	On-Demand	Anodyne	SCD1	34	42
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)C1=CC=CN2CCS(=O)(=O)N=C12	ZINC000875045968	IE	On-Demand	Anodyne	SCD	27	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccnc(OC)c1	ZINC000875045975	DD	On-Demand	Anodyne	SLC6A3	49	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccnc(OC)c1	ZINC000875045976	DD	On-Demand	Anodyne	SLC6A3	49	37
O=C(CN1CCSC1=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875046046	FG	On-Demand	Anodyne	SCD1	34	44
O=C(CN1CCSC1=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875046046	FG	On-Demand	Anodyne	SCD	29	44
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1cccc(OCC)c1	ZINC000875046054	ED	On-Demand	Mild	ROCK2	20	40
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1cccc(OCC)c1	ZINC000875046054	ED	On-Demand	Mild	PDS	85	38
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1cccc(OCC)c1	ZINC000875046055	ED	On-Demand	Mild	ROCK2	20	40
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1cccc(OCC)c1	ZINC000875046055	ED	On-Demand	Mild	PDS	85	38
O=C(NCC[C@H]1CCCO1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875046064	GF	On-Demand	Anodyne	ETHR	40	33
O=C(NCC[C@@H]1CCCO1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875046065	GF	On-Demand	Anodyne	ETHR	40	33
CC(=O)C1CCN(C(=O)NCc2ccc(O)cc2)CC1	ZINC000875046074	CD	On-Demand	Anodyne	EPHX2	22	43
CC(=O)C1CCN(C(=O)NCc2ccc(O)cc2)CC1	ZINC000875046074	CD	On-Demand	Anodyne	NAMPT	30	42
O=C(NCc1ccc(O)cc1)NC1CC(Nc2ccccc2)C1	ZINC000875046078	DF	On-Demand	Anodyne	EPHX2	19	48
O=C(NCc1ccc(O)cc1)N1CC2(CC(=O)N2Cc2ccccc2)C1	ZINC000875046083	FE	On-Demand	Anodyne	FABI	45	34
O=C(NCc1ccc(O)cc1)N1CC2(CC(=O)N2Cc2ccccc2)C1	ZINC000875046083	FE	On-Demand	Anodyne	NPSR1	26	40
O=C(NCc1ccc(O)cc1)N1CC2(CC(=O)N2Cc2ccccc2)C1	ZINC000875046083	FE	On-Demand	Anodyne	NAMPT	30	44
CN1CCN(C(C)(C)CNC(=O)N2CCN(c3ccc(C#N)cc3)CC2)CC1	ZINC000875046084	GD	On-Demand	Mild	CTSK	18	42
O=C(NCc1ccc(O)cc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875046090	EF	On-Demand	Anodyne	F2	42	44
O=C(NCc1ccc(O)cc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875046090	EF	On-Demand	Anodyne	ACE	40	39
O=C(NCc1ccc(O)cc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875046090	EF	On-Demand	Anodyne	OPRM1	37	46
O=C(NCc1ccc(O)cc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875046090	EF	On-Demand	Anodyne	OPRD1	20	40
O=C(NCc1ccc(O)cc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875046090	EF	On-Demand	Anodyne	NPY1R	25	40
O=C(NCc1ccc(O)cc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875046090	EF	On-Demand	Anodyne	TRY1_BOVIN	39	43
O=C(NCc1ccc(O)cc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875046090	EF	On-Demand	Anodyne	DPP4	15	42
O=C(NCc1ccc(O)cc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875046090	EF	On-Demand	Anodyne	PREP	51	48
O=C(NCc1ccc(O)cc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875046090	EF	On-Demand	Anodyne	LNPEP	41	36
O=C(NCc1ccc(O)cc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875046090	EF	On-Demand	Anodyne	XIAP	40	38
O=C(NCc1ccc(O)cc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875046090	EF	On-Demand	Anodyne	TMPRSS11D	68	37
O=C(NCc1ccc(O)cc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875046091	EF	On-Demand	Anodyne	F2	42	44
O=C(NCc1ccc(O)cc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875046091	EF	On-Demand	Anodyne	ACE	40	39
O=C(NCc1ccc(O)cc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875046091	EF	On-Demand	Anodyne	OPRM1	37	46
O=C(NCc1ccc(O)cc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875046091	EF	On-Demand	Anodyne	OPRD1	20	40
O=C(NCc1ccc(O)cc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875046091	EF	On-Demand	Anodyne	NPY1R	25	40
O=C(NCc1ccc(O)cc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875046091	EF	On-Demand	Anodyne	TRY1_BOVIN	39	43
O=C(NCc1ccc(O)cc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875046091	EF	On-Demand	Anodyne	DPP4	15	42
O=C(NCc1ccc(O)cc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875046091	EF	On-Demand	Anodyne	PREP	51	48
O=C(NCc1ccc(O)cc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875046091	EF	On-Demand	Anodyne	LNPEP	41	36
O=C(NCc1ccc(O)cc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875046091	EF	On-Demand	Anodyne	XIAP	40	38
O=C(NCc1ccc(O)cc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875046091	EF	On-Demand	Anodyne	TMPRSS11D	68	37
O=C(NCc1ccc(O)cc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875046092	EF	On-Demand	Anodyne	F2	42	44
O=C(NCc1ccc(O)cc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875046092	EF	On-Demand	Anodyne	ACE	40	39
O=C(NCc1ccc(O)cc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875046092	EF	On-Demand	Anodyne	OPRM1	37	46
O=C(NCc1ccc(O)cc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875046092	EF	On-Demand	Anodyne	OPRD1	20	40
O=C(NCc1ccc(O)cc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875046092	EF	On-Demand	Anodyne	NPY1R	25	40
O=C(NCc1ccc(O)cc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875046092	EF	On-Demand	Anodyne	TRY1_BOVIN	39	43
O=C(NCc1ccc(O)cc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875046092	EF	On-Demand	Anodyne	DPP4	15	42
O=C(NCc1ccc(O)cc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875046092	EF	On-Demand	Anodyne	PREP	51	48
O=C(NCc1ccc(O)cc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875046092	EF	On-Demand	Anodyne	LNPEP	41	36
O=C(NCc1ccc(O)cc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875046092	EF	On-Demand	Anodyne	XIAP	40	38
O=C(NCc1ccc(O)cc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875046092	EF	On-Demand	Anodyne	TMPRSS11D	68	37
O=C(NCc1ccc(O)cc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875046093	EF	On-Demand	Anodyne	F2	42	44
O=C(NCc1ccc(O)cc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875046093	EF	On-Demand	Anodyne	ACE	40	39
O=C(NCc1ccc(O)cc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875046093	EF	On-Demand	Anodyne	OPRM1	37	46
O=C(NCc1ccc(O)cc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875046093	EF	On-Demand	Anodyne	OPRD1	20	40
O=C(NCc1ccc(O)cc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875046093	EF	On-Demand	Anodyne	NPY1R	25	40
O=C(NCc1ccc(O)cc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875046093	EF	On-Demand	Anodyne	TRY1_BOVIN	39	43
O=C(NCc1ccc(O)cc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875046093	EF	On-Demand	Anodyne	DPP4	15	42
O=C(NCc1ccc(O)cc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875046093	EF	On-Demand	Anodyne	PREP	51	48
O=C(NCc1ccc(O)cc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875046093	EF	On-Demand	Anodyne	LNPEP	41	36
O=C(NCc1ccc(O)cc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875046093	EF	On-Demand	Anodyne	XIAP	40	38
O=C(NCc1ccc(O)cc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875046093	EF	On-Demand	Anodyne	TMPRSS11D	68	37
CN1CCN(C(C)(C)CNC(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000875046101	FE	On-Demand	Anodyne	OXTR	52	36
CN1CCN(C(C)(C)CNC(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000875046101	FE	On-Demand	Anodyne	GHRHR	39	42
CN1CCN(C(C)(C)CNC(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000875046102	FE	On-Demand	Anodyne	OXTR	52	36
CN1CCN(C(C)(C)CNC(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000875046102	FE	On-Demand	Anodyne	GHRHR	39	42
O=C(NCc1ccc(O)cc1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875046104	FG	On-Demand	Anodyne	SMO	43	48
O=C(NCc1ccc(O)cc1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875046104	FG	On-Demand	Anodyne	ETHR	66	49
CN1CCN(C(C)(C)CNC(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)CC1	ZINC000875046107	GE	On-Demand	Anodyne	PRSS2	41	30
CN1CCN(C(C)(C)CNC(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)CC1	ZINC000875046107	GE	On-Demand	Anodyne	MLNR	19	43
CN1CCN(C(C)(C)CNC(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)CC1	ZINC000875046107	GE	On-Demand	Anodyne	EPHX2	27	48
CN1CCN(C(C)(C)CNC(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)CC1	ZINC000875046107	GE	On-Demand	Anodyne	LIPG	17	42
C[C@@H]1CN(C(=O)NCc2ccc(O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000875046121	EF	On-Demand	Anodyne	NPSR1	26	40
C[C@@H]1CN(C(=O)NCc2ccc(O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000875046122	EF	On-Demand	Anodyne	NPSR1	26	40
CONC(=O)C1CCN(C(=O)NCc2ccc(O)cc2)CC1	ZINC000875046128	DC	On-Demand	Anodyne	EPHX2	26	45
CONC(=O)C1CCN(C(=O)NCc2ccc(O)cc2)CC1	ZINC000875046128	DC	On-Demand	Anodyne	TPSAB1	16	43
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccnc(-n3cccn3)c2)C1	ZINC000875046136	FC	On-Demand	Anodyne	HCRTR1	20	43
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccnc(-n3cccn3)c2)C1	ZINC000875046136	FC	On-Demand	Anodyne	HCRTR2	33	41
O=C(NC1CCN(C(=O)NCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875046141	GF	On-Demand	Anodyne	DRD4	18	41
O=C(NC1CCN(C(=O)NCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875046141	GF	On-Demand	Anodyne	OPRM1	41	43
O=C(NC1CCN(C(=O)NCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875046141	GF	On-Demand	Anodyne	OPRD1	28	43
O=C(NC1CCN(C(=O)NCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875046141	GF	On-Demand	Anodyne	GRIN2B	56	43
O=C(NC1CCN(C(=O)NCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875046141	GF	On-Demand	Anodyne	SIGMAR1	19	41
O=C(NC1CCN(C(=O)NCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875046141	GF	On-Demand	Anodyne	CTSB	29	55
O=C(NC1CCN(C(=O)NCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875046141	GF	On-Demand	Anodyne	CTSK	29	55
O=C(NC1CCN(C(=O)NCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875046141	GF	On-Demand	Anodyne	CTSL	36	55
O=C(NC1CCN(C(=O)NCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875046141	GF	On-Demand	Anodyne	PREP	32	43
O=C(NC1CCN(C(=O)NCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875046141	GF	On-Demand	Anodyne	LNPEP	51	39
O=C(NC1CCN(C(=O)NCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875046141	GF	On-Demand	Anodyne	CAPN1	43	35
O=C(NC1CCN(C(=O)NCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875046141	GF	On-Demand	Anodyne	CAPN2	71	40
O=C(NC1CCN(C(=O)NCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875046141	GF	On-Demand	Anodyne	EPHX2	54	41
O=C(NC1CCN(C(=O)NCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875046141	GF	On-Demand	Anodyne	TGM2	43	46
O=C(NC1CCN(C(=O)NCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875046141	GF	On-Demand	Anodyne	TPSAB1	27	49
O=C(NC1CCN(C(=O)NCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875046141	GF	On-Demand	Anodyne	NPR	42	31
O=C(NC1CCN(C(=O)NCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875046141	GF	On-Demand	Anodyne	F13A1	29	46
O=C(NC1CCN(C(=O)NCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875046141	GF	On-Demand	Anodyne	NAAA	41	37
O=C(NC1CCN(C(=O)NCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875046141	GF	On-Demand	Anodyne	SLC12A5	48	33
O=C(NC1CCN(C(=O)NCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875046141	GF	On-Demand	Anodyne	TMPRSS11D	45	35
CC[C@@H](NC(=O)NCc1ccc(O)cc1)c1cccc(OC)c1OC	ZINC000875046146	EG	On-Demand	Anodyne	PDS	46	35
CCN(CCNC(=O)OC(C)(C)C)C(=O)NCc1ccc(O)cc1	ZINC000875046150	EE	On-Demand	Anodyne	PAPA1_CARPA	16	41
Cn1nnnc1C1CCN(C(=O)NCc2ccc(O)cc2)CC1	ZINC000875046158	DD	On-Demand	Anodyne	IL2RA	40	31
O=C(NCc1ccc(O)cc1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875046161	EE	On-Demand	Anodyne	FABI	50	35
O=C(NCc1ccc(O)cc1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875046161	EE	On-Demand	Anodyne	SIGMAR1	26	45
O=C(NCc1ccc(O)cc1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875046161	EE	On-Demand	Anodyne	FAAH	18	40
O=C(NCc1ccc(O)cc1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875046161	EE	On-Demand	Anodyne	NPFFR1	41	37
O=C(NCc1ccc(O)cc1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875046161	EE	On-Demand	Anodyne	NAMPT	25	43
COC(=O)c1ccc(OC)c2c1CCN(C(=O)NCc1ccc(O)cc1)C2	ZINC000875046169	FE	On-Demand	Anodyne	FABI	49	37
CN1CCN(C(C)(C)CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875046173	FD	On-Demand	Anodyne	FKBP1A	22	41
CN1CCN(C(C)(C)CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875046174	FD	On-Demand	Anodyne	FKBP1A	22	41
CN1CCN(C(C)(C)CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875046175	FD	On-Demand	Anodyne	FKBP1A	22	41
CN1CCN(C(C)(C)CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875046176	FD	On-Demand	Anodyne	FKBP1A	22	41
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCc1ccc(O)cc1)CC2	ZINC000875046186	FG	On-Demand	Anodyne	DRD1	20	40
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCc1ccc(O)cc1)CC2	ZINC000875046186	FG	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCc1ccc(O)cc1)CC2	ZINC000875046186	FG	On-Demand	Anodyne	HCRTR1	17	55
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCc1ccc(O)cc1)CC2	ZINC000875046186	FG	On-Demand	Anodyne	MTNR1B	18	48
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCc1ccc(O)cc1)CC2	ZINC000875046186	FG	On-Demand	Anodyne	ABCB1	15	43
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCc1ccc(O)cc1)CC2	ZINC000875046187	FG	On-Demand	Anodyne	DRD1	20	40
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCc1ccc(O)cc1)CC2	ZINC000875046187	FG	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCc1ccc(O)cc1)CC2	ZINC000875046187	FG	On-Demand	Anodyne	HCRTR1	17	55
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCc1ccc(O)cc1)CC2	ZINC000875046187	FG	On-Demand	Anodyne	MTNR1B	18	48
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCc1ccc(O)cc1)CC2	ZINC000875046187	FG	On-Demand	Anodyne	ABCB1	15	43
O=C(NCc1ccc(O)cc1)N1Cc2cccnc2N2C[C@H](O)C[C@H]2C1	ZINC000875046192	FD	On-Demand	Anodyne	NAMPT	24	45
CC[C@]1(C(=O)Nc2cc(C(=O)OC)ccc2Cl)CCNC1=O	ZINC000875046193	DD	On-Demand	Anodyne	DYRK1B	16	40
CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H]1CCCN2C(=O)NCc1ccc(O)cc1	ZINC000875046206	GG	On-Demand	Anodyne	PREP	33	40
CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H]1CCCN2C(=O)NCc1ccc(O)cc1	ZINC000875046206	GG	On-Demand	Anodyne	LGMN	45	34
CC(C)(C)OC(=O)N1CC[C@@H]2[C@H]1CCCN2C(=O)NCc1ccc(O)cc1	ZINC000875046207	GG	On-Demand	Anodyne	PREP	33	40
CC(C)(C)OC(=O)N1CC[C@@H]2[C@H]1CCCN2C(=O)NCc1ccc(O)cc1	ZINC000875046207	GG	On-Demand	Anodyne	LGMN	45	34
CC(C)(C)OC(=O)N1CC[C@H]2[C@@H]1CCCN2C(=O)NCc1ccc(O)cc1	ZINC000875046208	GG	On-Demand	Anodyne	PREP	33	40
CC(C)(C)OC(=O)N1CC[C@H]2[C@@H]1CCCN2C(=O)NCc1ccc(O)cc1	ZINC000875046208	GG	On-Demand	Anodyne	LGMN	45	34
CC(C)(C)OC(=O)N1CC[C@H]2[C@H]1CCCN2C(=O)NCc1ccc(O)cc1	ZINC000875046209	GG	On-Demand	Anodyne	PREP	33	40
CC(C)(C)OC(=O)N1CC[C@H]2[C@H]1CCCN2C(=O)NCc1ccc(O)cc1	ZINC000875046209	GG	On-Demand	Anodyne	LGMN	45	34
CN1CCN(C(C)(C)CNC(=O)N2CCN(c3ccc(C#N)nc3)CC2)CC1	ZINC000875046212	GC	On-Demand	Mild	CTSK	19	43
O=C(NCc1ccc(O)cc1)N1CCC(CO)(CO)CC1	ZINC000875046215	CC	On-Demand	Anodyne	NAMPT	24	44
CN1CCN(C(=O)NCc2ccc(O)cc2)Cc2cccnc21	ZINC000875046229	DD	On-Demand	Anodyne	NAMPT	31	50
O=CN1CCCN(C(=O)NCc2ccc(O)cc2)CC1	ZINC000875046230	CC	On-Demand	Anodyne	NAMPT	22	40
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(O)cc2)C1	ZINC000875046248	CD	On-Demand	Anodyne	OPRM1	16	41
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(O)cc2)C1	ZINC000875046248	CD	On-Demand	Anodyne	DPP7	69	37
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(O)cc2)C1	ZINC000875046249	CD	On-Demand	Anodyne	OPRM1	16	41
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(O)cc2)C1	ZINC000875046249	CD	On-Demand	Anodyne	DPP7	69	37
CN1CCN(C2CCN(C(=O)NCc3ccc(O)cc3)CC2)CC1	ZINC000875046250	ED	On-Demand	Anodyne	L3MBTL3	108	46
CN1CCN(C2CCN(C(=O)NCc3ccc(O)cc3)CC2)CC1	ZINC000875046250	ED	On-Demand	Anodyne	NAMPT	28	45
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCc1ccc(O)cc1)CC2	ZINC000875046258	EF	On-Demand	Anodyne	FABI	45	31
CN1CCN(C(C)(C)CNC(=O)NCc2ccc(O)c(Cl)c2)CC1	ZINC000875046263	FD	On-Demand	Anodyne	NCE103	15	43
CC(=O)Nc1cccc2c1CN(C(=O)NCc1ccc(O)cc1)CC2	ZINC000875046279	EF	On-Demand	Anodyne	FABI	49	34
CC(=O)Nc1cccc2c1CN(C(=O)NCc1ccc(O)cc1)CC2	ZINC000875046279	EF	On-Demand	Anodyne	NAMPT	23	41
CC[C@@H](NC(=O)NCc1ccc(O)cc1)[C@H](O)c1ccccc1	ZINC000875046310	DF	On-Demand	Anodyne	ACE	18	41
CC[C@@H](NC(=O)NCc1ccc(O)cc1)[C@H](O)c1ccccc1	ZINC000875046310	DF	On-Demand	Anodyne	MME	30	41
CC[C@@H](NC(=O)NCc1ccc(O)cc1)[C@H](O)c1ccccc1	ZINC000875046310	DF	On-Demand	Anodyne	ANPEP	20	47
CC[C@@H](NC(=O)NCc1ccc(O)cc1)[C@H](O)c1ccccc1	ZINC000875046310	DF	On-Demand	Anodyne	NPY1R	27	41
CC[C@@H](NC(=O)NCc1ccc(O)cc1)[C@H](O)c1ccccc1	ZINC000875046310	DF	On-Demand	Anodyne	TACR3	42	37
CC[C@@H](NC(=O)NCc1ccc(O)cc1)[C@H](O)c1ccccc1	ZINC000875046310	DF	On-Demand	Anodyne	GRIA1	42	33
CC[C@@H](NC(=O)NCc1ccc(O)cc1)[C@H](O)c1ccccc1	ZINC000875046310	DF	On-Demand	Anodyne	PDS	45	36
CC[C@@H](NC(=O)NCc1ccc(O)cc1)[C@@H](O)c1ccccc1	ZINC000875046312	DF	On-Demand	Anodyne	ACE	18	41
CC[C@@H](NC(=O)NCc1ccc(O)cc1)[C@@H](O)c1ccccc1	ZINC000875046312	DF	On-Demand	Anodyne	MME	30	41
CC[C@@H](NC(=O)NCc1ccc(O)cc1)[C@@H](O)c1ccccc1	ZINC000875046312	DF	On-Demand	Anodyne	ANPEP	20	47
CC[C@@H](NC(=O)NCc1ccc(O)cc1)[C@@H](O)c1ccccc1	ZINC000875046312	DF	On-Demand	Anodyne	NPY1R	27	41
CC[C@@H](NC(=O)NCc1ccc(O)cc1)[C@@H](O)c1ccccc1	ZINC000875046312	DF	On-Demand	Anodyne	TACR3	42	37
CC[C@@H](NC(=O)NCc1ccc(O)cc1)[C@@H](O)c1ccccc1	ZINC000875046312	DF	On-Demand	Anodyne	GRIA1	42	33
CC[C@@H](NC(=O)NCc1ccc(O)cc1)[C@@H](O)c1ccccc1	ZINC000875046312	DF	On-Demand	Anodyne	PDS	45	36
C[C@]1(NC(=O)C(F)(F)F)CCN(C(=O)NCc2ccc(O)cc2)C1	ZINC000875046326	ED	On-Demand	Anodyne	EPHX2	19	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(O)cc1	ZINC000875046343	DD	On-Demand	Anodyne	SLC6A4	34	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(O)cc1	ZINC000875046343	DD	On-Demand	Anodyne	SLC6A3	64	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(O)cc1	ZINC000875046344	DD	On-Demand	Anodyne	SLC6A4	34	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(O)cc1	ZINC000875046344	DD	On-Demand	Anodyne	SLC6A3	64	46
CN1CCN(C(C)(C)CNC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875046362	GE	On-Demand	Mild	MCHR1	17	40
CN1CCN(C(C)(C)CNC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875046363	GE	On-Demand	Mild	MCHR1	17	40
O=C(NCc1ccc(O)cc1)N1CCC2(CCNC2=O)CC1	ZINC000875046370	DD	On-Demand	Anodyne	NPSR1	26	40
O=C(NCc1ccc(O)cc1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875046371	GG	On-Demand	Anodyne	NAMPT	67	39
O=C(NCc1ccc(O)cc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875046379	EF	On-Demand	Anodyne	GRIN2B	35	49
O=C(NCc1ccc(O)cc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875046379	EF	On-Demand	Anodyne	CCR3	49	43
O=C(NCc1ccc(O)cc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875046379	EF	On-Demand	Anodyne	MLNR	30	46
O=C(NCc1ccc(O)cc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875046379	EF	On-Demand	Anodyne	EPHX2	30	56
O=C(NCc1ccc(O)cc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875046379	EF	On-Demand	Anodyne	NPSR1	25	42
CN1CCN(C(C)(C)CNC(=O)N2CCO[C@H](c3noc(C4CC4)n3)C2)CC1	ZINC000875046394	GD	On-Demand	Anodyne	SMO	33	50
CN1CCN(C(C)(C)CNC(=O)N2CCO[C@H](c3noc(C4CC4)n3)C2)CC1	ZINC000875046394	GD	On-Demand	Anodyne	ETHR	63	39
CN1CCN(C(C)(C)CNC(=O)N2CCO[C@@H](c3noc(C4CC4)n3)C2)CC1	ZINC000875046395	GD	On-Demand	Anodyne	SMO	33	50
CN1CCN(C(C)(C)CNC(=O)N2CCO[C@@H](c3noc(C4CC4)n3)C2)CC1	ZINC000875046395	GD	On-Demand	Anodyne	ETHR	63	39
O=C(NCc1ccc(O)cc1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875046399	EE	On-Demand	Anodyne	NAMPT	29	45
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2ccc(OC(C)C)cc2)C1	ZINC000875046412	FD	On-Demand	Anodyne	DPP7	41	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2ccc(OC(C)C)cc2)C1	ZINC000875046413	FD	On-Demand	Anodyne	DPP7	41	37
C[C@@H](CN(C)C(=O)NCc1ccc(O)cc1)NC(=O)OC(C)(C)C	ZINC000875046464	EE	On-Demand	Anodyne	PAPA1_CARPA	35	47
C[C@@H](CN(C)C(=O)NCc1ccc(O)cc1)NC(=O)OC(C)(C)C	ZINC000875046464	EE	On-Demand	Anodyne	FPR1	42	34
O=C(NCc1ccc(O)cc1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875046469	DG	On-Demand	Anodyne	GHRHR	20	41
O=C(NCc1ccc(O)cc1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875046469	DG	On-Demand	Anodyne	SLC18A3	16	40
O=C(NCc1ccc(O)cc1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875046469	DG	On-Demand	Anodyne	NAMPT	16	42
O=C(NCc1ccc(O)cc1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875046470	DG	On-Demand	Anodyne	GHRHR	20	41
O=C(NCc1ccc(O)cc1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875046470	DG	On-Demand	Anodyne	SLC18A3	16	40
O=C(NCc1ccc(O)cc1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875046470	DG	On-Demand	Anodyne	NAMPT	16	42
COc1cccc([C@H](O)C2CCN(C(=O)NCc3ccc(O)cc3)CC2)c1	ZINC000875046489	FG	On-Demand	Anodyne	DRD4	42	32
COc1cccc([C@H](O)C2CCN(C(=O)NCc3ccc(O)cc3)CC2)c1	ZINC000875046489	FG	On-Demand	Anodyne	OPRD1	16	45
COc1cccc([C@H](O)C2CCN(C(=O)NCc3ccc(O)cc3)CC2)c1	ZINC000875046489	FG	On-Demand	Anodyne	GRIN2B	22	41
C[C@H]1C[C@H](NC(=O)OC(C)(C)C)CN1C(=O)NCc1ccc(O)cc1	ZINC000875046525	EF	On-Demand	Anodyne	PAPA1_CARPA	16	40
C[C@@H]1C[C@H](NC(=O)OC(C)(C)C)CN1C(=O)NCc1ccc(O)cc1	ZINC000875046526	EF	On-Demand	Anodyne	PAPA1_CARPA	16	40
O=C(NCc1ccc(O)cc1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875046534	FG	On-Demand	Anodyne	LNPEP	51	37
C[S@](=N)(=O)N1CCN(C(=O)NCc2ccc(O)cc2)CC1	ZINC000875046543	DC	On-Demand	Anodyne	TPSAB1	16	42
C[S@](=N)(=O)N1CCN(C(=O)NCc2ccc(O)cc2)CC1	ZINC000875046543	DC	On-Demand	Anodyne	NAMPT	38	44
O=C(NCc1ccc(O)cc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875046554	EG	On-Demand	Anodyne	F2	34	41
O=C(NCc1ccc(O)cc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875046554	EG	On-Demand	Anodyne	FKBP1A	34	41
O=C(NCc1ccc(O)cc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875046554	EG	On-Demand	Anodyne	OPRM1	34	43
O=C(NCc1ccc(O)cc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875046554	EG	On-Demand	Anodyne	TRY1_BOVIN	32	41
O=C(NCc1ccc(O)cc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875046554	EG	On-Demand	Anodyne	CCR5	15	41
O=C(NCc1ccc(O)cc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875046554	EG	On-Demand	Anodyne	PREP	39	45
O=C(NCc1ccc(O)cc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875046554	EG	On-Demand	Anodyne	LNPEP	41	35
O=C(NCc1ccc(O)cc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875046554	EG	On-Demand	Anodyne	TMPRSS11D	65	35
O=C(NCc1ccc(O)cc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875046555	EG	On-Demand	Anodyne	F2	34	41
O=C(NCc1ccc(O)cc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875046555	EG	On-Demand	Anodyne	FKBP1A	34	41
O=C(NCc1ccc(O)cc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875046555	EG	On-Demand	Anodyne	OPRM1	34	43
O=C(NCc1ccc(O)cc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875046555	EG	On-Demand	Anodyne	TRY1_BOVIN	32	41
O=C(NCc1ccc(O)cc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875046555	EG	On-Demand	Anodyne	CCR5	15	41
O=C(NCc1ccc(O)cc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875046555	EG	On-Demand	Anodyne	PREP	39	45
O=C(NCc1ccc(O)cc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875046555	EG	On-Demand	Anodyne	LNPEP	41	35
O=C(NCc1ccc(O)cc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875046555	EG	On-Demand	Anodyne	TMPRSS11D	65	35
O=C(NCc1ccc(O)cc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875046556	EG	On-Demand	Anodyne	F2	34	41
O=C(NCc1ccc(O)cc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875046556	EG	On-Demand	Anodyne	FKBP1A	34	41
O=C(NCc1ccc(O)cc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875046556	EG	On-Demand	Anodyne	OPRM1	34	43
O=C(NCc1ccc(O)cc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875046556	EG	On-Demand	Anodyne	TRY1_BOVIN	32	41
O=C(NCc1ccc(O)cc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875046556	EG	On-Demand	Anodyne	CCR5	15	41
O=C(NCc1ccc(O)cc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875046556	EG	On-Demand	Anodyne	PREP	39	45
O=C(NCc1ccc(O)cc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875046556	EG	On-Demand	Anodyne	LNPEP	41	35
O=C(NCc1ccc(O)cc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875046556	EG	On-Demand	Anodyne	TMPRSS11D	65	35
O=C(NCc1ccc(O)cc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875046557	EG	On-Demand	Anodyne	F2	34	41
O=C(NCc1ccc(O)cc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875046557	EG	On-Demand	Anodyne	FKBP1A	34	41
O=C(NCc1ccc(O)cc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875046557	EG	On-Demand	Anodyne	OPRM1	34	43
O=C(NCc1ccc(O)cc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875046557	EG	On-Demand	Anodyne	TRY1_BOVIN	32	41
O=C(NCc1ccc(O)cc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875046557	EG	On-Demand	Anodyne	CCR5	15	41
O=C(NCc1ccc(O)cc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875046557	EG	On-Demand	Anodyne	PREP	39	45
O=C(NCc1ccc(O)cc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875046557	EG	On-Demand	Anodyne	LNPEP	41	35
O=C(NCc1ccc(O)cc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875046557	EG	On-Demand	Anodyne	TMPRSS11D	65	35
COc1ccc(N2CCN(C(=O)NCc3ccc(O)cc3)CC2)c(OC)c1	ZINC000875046558	FE	On-Demand	Clean	HTR1A	45	44
COc1ccc(N2CCN(C(=O)NCc3ccc(O)cc3)CC2)c(OC)c1	ZINC000875046558	FE	On-Demand	Clean	DRD2	39	45
COc1ccc(N2CCN(C(=O)NCc3ccc(O)cc3)CC2)c(OC)c1	ZINC000875046558	FE	On-Demand	Clean	DRD4	43	34
COc1ccc(N2CCN(C(=O)NCc3ccc(O)cc3)CC2)c(OC)c1	ZINC000875046558	FE	On-Demand	Clean	ADRA1D	28	40
COc1ccc(N2CCN(C(=O)NCc3ccc(O)cc3)CC2)c(OC)c1	ZINC000875046558	FE	On-Demand	Clean	HTR1B	18	44
COc1ccc(N2CCN(C(=O)NCc3ccc(O)cc3)CC2)c(OC)c1	ZINC000875046558	FE	On-Demand	Clean	ADRA1A	27	40
COc1ccc(N2CCN(C(=O)NCc3ccc(O)cc3)CC2)c(OC)c1	ZINC000875046558	FE	On-Demand	Clean	DRD3	54	45
COc1ccc(N2CCN(C(=O)NCc3ccc(O)cc3)CC2)c(OC)c1	ZINC000875046558	FE	On-Demand	Clean	PDGFRB	52	39
COc1ccc(N2CCN(C(=O)NCc3ccc(O)cc3)CC2)c(OC)c1	ZINC000875046558	FE	On-Demand	Clean	HTR7	40	44
COc1ccc(N2CCN(C(=O)NCc3ccc(O)cc3)CC2)c(OC)c1	ZINC000875046558	FE	On-Demand	Clean	MTNR1B	30	40
O=C(NCc1ccc(O)cc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875046568	DG	On-Demand	Anodyne	EPHX2	23	42
O=C(NCc1ccc(O)cc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875046569	DG	On-Demand	Anodyne	EPHX2	23	42
O=C(NCc1ccc(O)cc1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875046570	EF	On-Demand	Anodyne	EPHX2	15	54
O=C(NCc1ccc(O)cc1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875046570	EF	On-Demand	Anodyne	NPSR1	28	42
O=C(NCc1ccc(O)cc1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875046570	EF	On-Demand	Anodyne	SLC12A5	43	33
O=C(NCc1ccc(O)cc1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875046571	EF	On-Demand	Anodyne	EPHX2	15	54
O=C(NCc1ccc(O)cc1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875046571	EF	On-Demand	Anodyne	NPSR1	28	42
O=C(NCc1ccc(O)cc1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875046571	EF	On-Demand	Anodyne	SLC12A5	43	33
CN1CCC(CNC(=O)NCc2ccc(O)cc2)(c2ccccc2)CC1	ZINC000875046572	FF	On-Demand	Anodyne	OPRM1	18	42
CN1CCC(CNC(=O)NCc2ccc(O)cc2)(c2ccccc2)CC1	ZINC000875046572	FF	On-Demand	Anodyne	KCNA3	48	42
CN1CCC(CNC(=O)NCc2ccc(O)cc2)(c2ccccc2)CC1	ZINC000875046572	FF	On-Demand	Anodyne	SOAT1	17	45
CN1CCC(CNC(=O)NCc2ccc(O)cc2)(c2ccccc2)CC1	ZINC000875046572	FF	On-Demand	Anodyne	NPFFR1	28	44
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(O)cc1	ZINC000875046580	CD	On-Demand	Anodyne	ANPEP	18	45
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(O)cc1	ZINC000875046580	CD	On-Demand	Anodyne	GRIA1	40	32
CN1CCN(C(C)(C)CNC(=O)N[C@@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875046593	GF	On-Demand	Anodyne	C3AR1	41	41
CN1CCN(C(C)(C)CNC(=O)N[C@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875046594	GF	On-Demand	Anodyne	C3AR1	41	41
COc1ccc([C@@H]2CN(C(=O)NCc3ccc(O)cc3)CCO2)cc1	ZINC000875046614	EF	On-Demand	Anodyne	MMP13	23	45
COc1ccc([C@@H]2CN(C(=O)NCc3ccc(O)cc3)CCO2)cc1	ZINC000875046614	EF	On-Demand	Anodyne	MMP3	21	45
COc1ccc([C@@H]2CN(C(=O)NCc3ccc(O)cc3)CCO2)cc1	ZINC000875046614	EF	On-Demand	Anodyne	MMP9	18	45
COc1ccc([C@@H]2CN(C(=O)NCc3ccc(O)cc3)CCO2)cc1	ZINC000875046614	EF	On-Demand	Anodyne	MMP7	22	45
COc1ccc([C@@H]2CN(C(=O)NCc3ccc(O)cc3)CCO2)cc1	ZINC000875046614	EF	On-Demand	Anodyne	MMP1	22	45
CN1CCN(C(C)(C)CNC(=O)N2CCN(c3ccc(F)cc3F)CC2)CC1	ZINC000875046618	GD	On-Demand	Anodyne	HTR1B	16	42
CN1CCN(C(C)(C)CNC(=O)N2CCN(c3ccc(F)cc3F)CC2)CC1	ZINC000875046618	GD	On-Demand	Anodyne	NPY2R	54	40
CO[C@@H]1C[C@@H]2CN(C(=O)NCc3ccc(O)cc3)Cc3cccnc3N2C1	ZINC000875046621	FE	On-Demand	Anodyne	NAMPT	23	43
CO[C@H]1C[C@H]2CN(C(=O)NCc3ccc(O)cc3)Cc3cccnc3N2C1	ZINC000875046622	FE	On-Demand	Anodyne	NAMPT	23	43
O=C(NCc1ccc(O)cc1)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875046628	EG	On-Demand	Anodyne	C3AR1	39	40
O=C(NCc1ccc(O)cc1)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875046628	EG	On-Demand	Anodyne	NAMPT	65	44
O=C(NCc1ccc(O)cc1)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875046629	EG	On-Demand	Anodyne	C3AR1	39	40
O=C(NCc1ccc(O)cc1)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875046629	EG	On-Demand	Anodyne	NAMPT	65	44
Cc1cncc([C@@H]2CCCN2C(=O)NCc2ccc(O)cc2)c1	ZINC000875046637	DG	On-Demand	Anodyne	PREP	35	42
Cc1cncc([C@H]2CCCN2C(=O)NCc2ccc(O)cc2)c1	ZINC000875046638	DG	On-Demand	Anodyne	PREP	35	42
CN1CCN(C(C)(C)CNC(=O)NCc2nc(-c3ccncc3)cs2)CC1	ZINC000875046654	GE	On-Demand	Anodyne	ROCK1	23	41
CN1CCN(C(C)(C)CNC(=O)NCc2nc(-c3ccncc3)cs2)CC1	ZINC000875046654	GE	On-Demand	Anodyne	ROCK2	17	41
CN1CCN(C(C)(C)CNC(=O)NNC(=O)c2nc3ccccc3s2)CC1	ZINC000875046682	GD	On-Demand	Reactive	ST14	42	33
CN1CCN(C(C)(C)CNC(=O)NNC(=O)c2nc3ccccc3s2)CC1	ZINC000875046682	GD	On-Demand	Reactive	TMPRSS6	54	33
CN1CCN(C(C)(C)CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875046691	GD	On-Demand	Anodyne	PTGER4	17	40
CN1CCN(C(C)(C)CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875046692	GD	On-Demand	Anodyne	PTGER4	17	40
CCC1(CC)CCCN1C(=O)NCc1ccc(O)cc1	ZINC000875046710	CG	On-Demand	Anodyne	SLC12A5	67	36
C[C@]1(C(F)(F)F)CCN(C(=O)NCc2ccc(O)cc2)C1	ZINC000875046712	DF	On-Demand	Anodyne	EPHX2	22	42
CCCCCCCNC(=O)C(=O)NCc1ccnc(-n2cccn2)c1	ZINC000875046714	ED	On-Demand	Mild	ASAH1	76	37
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CN(C(=O)NCc1ccc(O)cc1)C2	ZINC000875046715	FF	On-Demand	Anodyne	GPR119	34	45
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(C)cc1Br	ZINC000875046729	EG	On-Demand	Anodyne	ANPEP	24	43
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(C)cc1Br	ZINC000875046729	EG	On-Demand	Anodyne	PAPA1_CARPA	41	35
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(C)cc1Br	ZINC000875046729	EG	On-Demand	Anodyne	HLA-DRB1	41	32
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(C)cc1Br	ZINC000875046729	EG	On-Demand	Anodyne	HPN	69	35
CN1CCN(C(C)(C)CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875046739	GD	On-Demand	Mild	ITK	18	48
CN1CCN(C(C)(C)CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875046739	GD	On-Demand	Mild	PANC	54	38
NC(=O)Cc1cccc2c1CCN(C(=O)NCc1ccc(O)cc1)C2	ZINC000875046758	ED	On-Demand	Anodyne	FABI	51	36
NC(=O)Cc1cccc2c1CCN(C(=O)NCc1ccc(O)cc1)C2	ZINC000875046758	ED	On-Demand	Anodyne	NAMPT	23	43
C[C@@H]1CN(C(=O)NCc2ccc(O)cc2)Cc2ccccc21	ZINC000875046766	CG	On-Demand	Anodyne	NPSR1	26	40
C[C@@H]1CN(C(=O)NCc2ccc(O)cc2)Cc2ccccc21	ZINC000875046766	CG	On-Demand	Anodyne	NAMPT	24	49
CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1CN2C(=O)NCc1ccc(O)cc1	ZINC000875046771	EE	On-Demand	Anodyne	GPR119	16	40
O=C(NCc1ccc(O)cc1)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875046781	EF	On-Demand	Anodyne	HTR7	17	42
O=C(NCc1ccc(O)cc1)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875046781	EF	On-Demand	Anodyne	NPSR1	25	42
O=C(NCC[C@H](O)C1CCCC1)NCc1ccc(O)cc1	ZINC000875046804	CE	On-Demand	Anodyne	PROC	45	38
O=C(NCC[C@@H](O)C1CCCC1)NCc1ccc(O)cc1	ZINC000875046805	CE	On-Demand	Anodyne	PROC	45	38
CCOC(=O)Nc1ccc(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cc1	ZINC000875046825	HJ	On-Demand	Anodyne	ITK	15	42
CCOC(=O)Nc1ccc(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cc1	ZINC000875046825	HJ	On-Demand	Anodyne	SCD1	48	60
CCOC(=O)Nc1ccc(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cc1	ZINC000875046825	HJ	On-Demand	Anodyne	SCD	42	60
C[C@H](NC(=O)NCCNC(=O)c1ccccc1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875046842	GD	On-Demand	Anodyne	FPR1	26	41
C[C@H](NC(=O)NCCNC(=O)c1ccccc1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875046842	GD	On-Demand	Anodyne	GPR119	20	45
C[C@@H](NC(=O)NCCNC(=O)c1ccccc1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875046843	GD	On-Demand	Anodyne	FPR1	26	41
C[C@@H](NC(=O)NCCNC(=O)c1ccccc1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875046843	GD	On-Demand	Anodyne	GPR119	20	45
COc1ncccc1CNC(=O)C(=O)N[C@@H](C)c1ccc(C(F)(F)F)nc1	ZINC000875046854	GD	On-Demand	Anodyne	TRPV1	100	39
COc1ncccc1CNC(=O)C(=O)N[C@H](C)c1ccc(C(F)(F)F)nc1	ZINC000875046855	GD	On-Demand	Anodyne	TRPV1	100	39
COc1ncccc1CNC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875046856	GB	On-Demand	Anodyne	L3MBTL3	43	37
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)NCCc1cccnc1	ZINC000875046965	CD	On-Demand	Anodyne	CHRNA7	44	35
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)c1C	ZINC000875046969	JK	On-Demand	Reactive	SCD1	35	44
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)c1C	ZINC000875046969	JK	On-Demand	Reactive	SCD	29	44
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)c1C	ZINC000875046972	JK	On-Demand	Reactive	SCD1	35	44
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)c1C	ZINC000875046972	JK	On-Demand	Reactive	SCD	29	44
O=C(NCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875046973	FD	On-Demand	Anodyne	HTR1A	36	58
O=C(NCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875046973	FD	On-Demand	Anodyne	DRD2	30	50
O=C(NCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875046973	FD	On-Demand	Anodyne	DRD4	17	46
O=C(NCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875046973	FD	On-Demand	Anodyne	HTR2A	26	43
O=C(NCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875046973	FD	On-Demand	Anodyne	HTR2C	16	43
O=C(NCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875046973	FD	On-Demand	Anodyne	DRD3	36	45
O=C(NCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875046974	FD	On-Demand	Anodyne	HTR1A	36	58
O=C(NCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875046974	FD	On-Demand	Anodyne	DRD2	30	50
O=C(NCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875046974	FD	On-Demand	Anodyne	DRD4	17	46
O=C(NCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875046974	FD	On-Demand	Anodyne	HTR2A	26	43
O=C(NCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875046974	FD	On-Demand	Anodyne	HTR2C	16	43
O=C(NCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875046974	FD	On-Demand	Anodyne	DRD3	36	45
O=C(NCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875046975	FD	On-Demand	Anodyne	HTR1A	36	58
O=C(NCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875046975	FD	On-Demand	Anodyne	DRD2	30	50
O=C(NCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875046975	FD	On-Demand	Anodyne	DRD4	17	46
O=C(NCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875046975	FD	On-Demand	Anodyne	HTR2A	26	43
O=C(NCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875046975	FD	On-Demand	Anodyne	HTR2C	16	43
O=C(NCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875046975	FD	On-Demand	Anodyne	DRD3	36	45
O=C(NCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875046976	FD	On-Demand	Anodyne	HTR1A	36	58
O=C(NCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875046976	FD	On-Demand	Anodyne	DRD2	30	50
O=C(NCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875046976	FD	On-Demand	Anodyne	DRD4	17	46
O=C(NCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875046976	FD	On-Demand	Anodyne	HTR2A	26	43
O=C(NCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875046976	FD	On-Demand	Anodyne	HTR2C	16	43
O=C(NCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875046976	FD	On-Demand	Anodyne	DRD3	36	45
CCOC(=O)[C@@H]1CN(C(=O)NCCNC(=O)c2ccccc2)CCC1(F)F	ZINC000875047011	GD	On-Demand	Anodyne	P2RY12	51	35
O=C(NCCc1cccnc1)N1OC2CCC1CC2	ZINC000875047014	CD	On-Demand	Anodyne	FKBP1A	15	42
O=C(NCCc1cccnc1)N1OC2CCC1CC2	ZINC000875047014	CD	On-Demand	Anodyne	PTAFR	28	40
O=C(NCCc1cccnc1)N1OC2CCC1CC2	ZINC000875047014	CD	On-Demand	Anodyne	CHRNA7	50	38
O=C(NCCc1cccnc1)N1OC2CCC1CC2	ZINC000875047014	CD	On-Demand	Anodyne	NAMPT	50	43
CC[C@H](NC(=O)c1c(Cl)nn(C)c1Cl)c1ccc(C)cc1	ZINC000875047028	EH	On-Demand	Anodyne	TACR3	51	42
CC[C@H](NC(=O)c1c(Cl)nn(C)c1Cl)c1ccc(C)cc1	ZINC000875047028	EH	On-Demand	Anodyne	UTS2	47	40
COc1ncccc1CNC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875047035	GD	On-Demand	Anodyne	HTR7	22	40
COc1ncccc1CNC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875047035	GD	On-Demand	Anodyne	P2RX7	19	42
COc1ncccc1CNC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875047035	GD	On-Demand	Anodyne	NPY2R	67	36
CCC[C@H](CCO)NC(=O)NCCc1cccnc1	ZINC000875047039	CD	On-Demand	Anodyne	PTAFR	32	43
CCC[C@H](CCO)NC(=O)NCCc1cccnc1	ZINC000875047039	CD	On-Demand	Anodyne	NAMPT	38	44
CCC[C@@H](CCO)NC(=O)NCCc1cccnc1	ZINC000875047040	CD	On-Demand	Anodyne	PTAFR	32	43
CCC[C@@H](CCO)NC(=O)NCCc1cccnc1	ZINC000875047040	CD	On-Demand	Anodyne	NAMPT	38	44
CC[C@H](C[C@H](C)O)NC(=O)NCCNC(=O)c1ccccc1Cl	ZINC000875047042	ED	On-Demand	Anodyne	ECR	42	37
COc1ncccc1CNC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875047048	FD	On-Demand	Anodyne	SIRT3	53	35
COc1ncccc1CNC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875047048	FD	On-Demand	Anodyne	SIRT2	54	35
COc1ncccc1CNC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875047048	FD	On-Demand	Anodyne	SIRT1	53	35
O=C(NCCc1cccnc1)NCCC1(O)CCN(c2ccccc2)CC1	ZINC000875047063	FE	On-Demand	Anodyne	PTAFR	21	40
O=C(NCCc1cccnc1)NCCC1(O)CCN(c2ccccc2)CC1	ZINC000875047063	FE	On-Demand	Anodyne	NAMPT	39	45
COC(=O)[C@@]1(C)CN(C(=O)NCCc2cccnc2)C[C@@H]1C	ZINC000875047064	DD	On-Demand	Anodyne	CHRNA7	45	36
COC(=O)[C@@]1(C)CN(C(=O)NCCc2cccnc2)C[C@@H]1C	ZINC000875047064	DD	On-Demand	Anodyne	NAMPT	40	38
O=C(NCCc1cccnc1)N[C@@H]1COCC[C@H]1O	ZINC000875047065	CC	On-Demand	Anodyne	CHRNA7	48	39
O=C(NCCc1cccnc1)N[C@@H]1COCC[C@H]1O	ZINC000875047065	CC	On-Demand	Anodyne	NAMPT	42	44
CC(=O)C1CCN(C(=O)C(=O)NCc2cccnc2Oc2cccc(F)c2)CC1	ZINC000875047066	GE	On-Demand	Anodyne	P2RY1	25	40
Cc1nnc(NNC(=O)NCCc2cccnc2)n1C	ZINC000875047067	CC	On-Demand	Reactive	PTAFR	31	41
Cc1nnc(NNC(=O)NCCc2cccnc2)n1C	ZINC000875047067	CC	On-Demand	Reactive	NAMPT	37	42
CC[C@H](C[C@H](C)O)NC(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000875047072	FC	On-Demand	Anodyne	HTR1A	43	53
CC[C@H](C[C@H](C)O)NC(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000875047072	FC	On-Demand	Anodyne	DRD2	42	43
CC[C@H](C[C@H](C)O)NC(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000875047072	FC	On-Demand	Anodyne	DRD4	21	42
CC[C@H](C[C@H](C)O)NC(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000875047072	FC	On-Demand	Anodyne	HTR2A	35	43
CC[C@H](C[C@H](C)O)NC(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000875047072	FC	On-Demand	Anodyne	HTR2C	28	43
CC[C@H](C[C@H](C)O)NC(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000875047072	FC	On-Demand	Anodyne	DRD3	55	41
O=C(NCCc1cccnc1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875047073	DE	On-Demand	Anodyne	TBXAS1	40	44
O=C(NCCc1cccnc1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875047073	DE	On-Demand	Anodyne	PTAFR	27	40
O=C(NCCc1cccnc1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875047073	DE	On-Demand	Anodyne	CHRNA7	41	38
C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCCN2C(=O)NCCc2cccnc2)C1	ZINC000875047074	EF	On-Demand	Anodyne	FKBP1A	37	47
C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCCN2C(=O)NCCc2cccnc2)C1	ZINC000875047074	EF	On-Demand	Anodyne	TBXAS1	18	40
C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCCN2C(=O)NCCc2cccnc2)C1	ZINC000875047074	EF	On-Demand	Anodyne	CHRNA7	45	36
C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCCN2C(=O)NCCc2cccnc2)C1	ZINC000875047074	EF	On-Demand	Anodyne	C3AR1	39	41
C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCCN2C(=O)NCCc2cccnc2)C1	ZINC000875047074	EF	On-Demand	Anodyne	NAMPT	36	42
C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCCN2C(=O)NCCc2cccnc2)C1	ZINC000875047075	EF	On-Demand	Anodyne	FKBP1A	37	47
C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCCN2C(=O)NCCc2cccnc2)C1	ZINC000875047075	EF	On-Demand	Anodyne	TBXAS1	18	40
C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCCN2C(=O)NCCc2cccnc2)C1	ZINC000875047075	EF	On-Demand	Anodyne	CHRNA7	45	36
C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCCN2C(=O)NCCc2cccnc2)C1	ZINC000875047075	EF	On-Demand	Anodyne	C3AR1	39	41
C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCCN2C(=O)NCCc2cccnc2)C1	ZINC000875047075	EF	On-Demand	Anodyne	NAMPT	36	42
C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCCN2C(=O)NCCc2cccnc2)C1	ZINC000875047076	EF	On-Demand	Anodyne	FKBP1A	37	47
C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCCN2C(=O)NCCc2cccnc2)C1	ZINC000875047076	EF	On-Demand	Anodyne	TBXAS1	18	40
C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCCN2C(=O)NCCc2cccnc2)C1	ZINC000875047076	EF	On-Demand	Anodyne	CHRNA7	45	36
C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCCN2C(=O)NCCc2cccnc2)C1	ZINC000875047076	EF	On-Demand	Anodyne	C3AR1	39	41
C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCCN2C(=O)NCCc2cccnc2)C1	ZINC000875047076	EF	On-Demand	Anodyne	NAMPT	36	42
C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCCN2C(=O)NCCc2cccnc2)C1	ZINC000875047077	EF	On-Demand	Anodyne	FKBP1A	37	47
C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCCN2C(=O)NCCc2cccnc2)C1	ZINC000875047077	EF	On-Demand	Anodyne	TBXAS1	18	40
C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCCN2C(=O)NCCc2cccnc2)C1	ZINC000875047077	EF	On-Demand	Anodyne	CHRNA7	45	36
C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCCN2C(=O)NCCc2cccnc2)C1	ZINC000875047077	EF	On-Demand	Anodyne	C3AR1	39	41
C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCCN2C(=O)NCCc2cccnc2)C1	ZINC000875047077	EF	On-Demand	Anodyne	NAMPT	36	42
COC(=O)c1ccc(OC)c2c1CCN(C(=O)NCCc1cccnc1)C2	ZINC000875047078	FE	On-Demand	Anodyne	PTAFR	34	42
CCn1c(S)nc2cc(C(=O)Nc3ncc(Cc4cc(F)cc(F)c4)s3)ccc2c1=O	ZINC000875047079	JI	On-Demand	Anodyne	SCD1	43	53
CCn1c(S)nc2cc(C(=O)Nc3ncc(Cc4cc(F)cc(F)c4)s3)ccc2c1=O	ZINC000875047079	JI	On-Demand	Anodyne	SCD	36	53
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2cccnc2)C1	ZINC000875047080	DD	On-Demand	Anodyne	FKBP1A	15	44
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2cccnc2)C1	ZINC000875047080	DD	On-Demand	Anodyne	PTAFR	43	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2cccnc2)C1	ZINC000875047080	DD	On-Demand	Anodyne	CHRNA7	47	36
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2cccnc2)C1	ZINC000875047080	DD	On-Demand	Anodyne	C3AR1	38	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCNC(=O)c2ccccc2Cl)C1	ZINC000875047086	GD	On-Demand	Anodyne	ECR	44	33
CCOC(=O)[C@H](C)C1CN(C(=O)NCCNC(=O)c2ccccc2Cl)C1	ZINC000875047086	GD	On-Demand	Anodyne	HCN1	55	31
CCOC(=O)[C@H](C)C1CN(C(=O)NCCNC(=O)c2ccccc2Cl)C1	ZINC000875047086	GD	On-Demand	Anodyne	HCN4	47	31
O=C(NCCc1cccnc1)N1C[C@@H](O)C[C@H]1C1CC1	ZINC000875047092	CD	On-Demand	Anodyne	FKBP1A	15	40
O=C(NCCc1cccnc1)N1C[C@@H](O)C[C@H]1C1CC1	ZINC000875047092	CD	On-Demand	Anodyne	CHRNA7	50	39
O=C(NCCc1cccnc1)N1C[C@@H](O)C[C@H]1C1CC1	ZINC000875047092	CD	On-Demand	Anodyne	ACHP_LYMST	24	40
O=C(NCCc1cccnc1)N1C[C@@H](O)C[C@H]1C1CC1	ZINC000875047092	CD	On-Demand	Anodyne	NAMPT	45	42
O=C(NCCc1cccnc1)N1C[C@H](O)C[C@H]1C1CC1	ZINC000875047093	CD	On-Demand	Anodyne	FKBP1A	15	40
O=C(NCCc1cccnc1)N1C[C@H](O)C[C@H]1C1CC1	ZINC000875047093	CD	On-Demand	Anodyne	CHRNA7	50	39
O=C(NCCc1cccnc1)N1C[C@H](O)C[C@H]1C1CC1	ZINC000875047093	CD	On-Demand	Anodyne	ACHP_LYMST	24	40
O=C(NCCc1cccnc1)N1C[C@H](O)C[C@H]1C1CC1	ZINC000875047093	CD	On-Demand	Anodyne	NAMPT	45	42
O=C(NCCc1cccnc1)N1C[C@@H](O)C[C@@H]1C1CC1	ZINC000875047094	CD	On-Demand	Anodyne	FKBP1A	15	40
O=C(NCCc1cccnc1)N1C[C@@H](O)C[C@@H]1C1CC1	ZINC000875047094	CD	On-Demand	Anodyne	CHRNA7	50	39
O=C(NCCc1cccnc1)N1C[C@@H](O)C[C@@H]1C1CC1	ZINC000875047094	CD	On-Demand	Anodyne	ACHP_LYMST	24	40
O=C(NCCc1cccnc1)N1C[C@@H](O)C[C@@H]1C1CC1	ZINC000875047094	CD	On-Demand	Anodyne	NAMPT	45	42
O=C(NCCc1cccnc1)N1C[C@H](O)C[C@@H]1C1CC1	ZINC000875047096	CD	On-Demand	Anodyne	FKBP1A	15	40
O=C(NCCc1cccnc1)N1C[C@H](O)C[C@@H]1C1CC1	ZINC000875047096	CD	On-Demand	Anodyne	CHRNA7	50	39
O=C(NCCc1cccnc1)N1C[C@H](O)C[C@@H]1C1CC1	ZINC000875047096	CD	On-Demand	Anodyne	ACHP_LYMST	24	40
O=C(NCCc1cccnc1)N1C[C@H](O)C[C@@H]1C1CC1	ZINC000875047096	CD	On-Demand	Anodyne	NAMPT	45	42
O=C(N[C@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2cccnc2)C1	ZINC000875047100	FD	On-Demand	Anodyne	FKBP1A	18	44
O=C(N[C@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2cccnc2)C1	ZINC000875047100	FD	On-Demand	Anodyne	CHRNA7	48	38
O=C(N[C@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2cccnc2)C1	ZINC000875047100	FD	On-Demand	Anodyne	C3AR1	44	42
O=C(N[C@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2cccnc2)C1	ZINC000875047100	FD	On-Demand	Anodyne	EPHX2	15	43
O=C(N[C@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2cccnc2)C1	ZINC000875047100	FD	On-Demand	Anodyne	GPBAR1	19	41
O=C(N[C@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2cccnc2)C1	ZINC000875047100	FD	On-Demand	Anodyne	NAMPT	36	44
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2cccnc2)C1	ZINC000875047102	FD	On-Demand	Anodyne	FKBP1A	18	44
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2cccnc2)C1	ZINC000875047102	FD	On-Demand	Anodyne	CHRNA7	48	38
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2cccnc2)C1	ZINC000875047102	FD	On-Demand	Anodyne	C3AR1	44	42
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2cccnc2)C1	ZINC000875047102	FD	On-Demand	Anodyne	EPHX2	15	43
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2cccnc2)C1	ZINC000875047102	FD	On-Demand	Anodyne	GPBAR1	19	41
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2cccnc2)C1	ZINC000875047102	FD	On-Demand	Anodyne	NAMPT	36	44
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2cccnc2)C1	ZINC000875047104	FD	On-Demand	Anodyne	FKBP1A	18	44
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2cccnc2)C1	ZINC000875047104	FD	On-Demand	Anodyne	CHRNA7	48	38
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2cccnc2)C1	ZINC000875047104	FD	On-Demand	Anodyne	C3AR1	44	42
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2cccnc2)C1	ZINC000875047104	FD	On-Demand	Anodyne	EPHX2	15	43
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2cccnc2)C1	ZINC000875047104	FD	On-Demand	Anodyne	GPBAR1	19	41
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2cccnc2)C1	ZINC000875047104	FD	On-Demand	Anodyne	NAMPT	36	44
O=C(N[C@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2cccnc2)C1	ZINC000875047106	FD	On-Demand	Anodyne	FKBP1A	18	44
O=C(N[C@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2cccnc2)C1	ZINC000875047106	FD	On-Demand	Anodyne	CHRNA7	48	38
O=C(N[C@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2cccnc2)C1	ZINC000875047106	FD	On-Demand	Anodyne	C3AR1	44	42
O=C(N[C@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2cccnc2)C1	ZINC000875047106	FD	On-Demand	Anodyne	EPHX2	15	43
O=C(N[C@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2cccnc2)C1	ZINC000875047106	FD	On-Demand	Anodyne	GPBAR1	19	41
O=C(N[C@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2cccnc2)C1	ZINC000875047106	FD	On-Demand	Anodyne	NAMPT	36	44
O=C(CCC/N=C1/NS(=O)(=O)c2ccccc21)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875047117	JG	On-Demand	Mild	SCD1	32	40
O=C(CCC/N=C1/NS(=O)(=O)c2ccccc21)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875047117	JG	On-Demand	Mild	SCD	27	40
CNC(=O)NC[C@H]1COCCN1C(=O)NCCc1cccnc1	ZINC000875047121	DB	On-Demand	Anodyne	CHRNA7	48	36
CNC(=O)NC[C@H]1COCCN1C(=O)NCCc1cccnc1	ZINC000875047121	DB	On-Demand	Anodyne	NAMPT	40	40
CN(C[C@@H]1C[C@H](O)C1)C(=O)NCCc1cccnc1	ZINC000875047122	CD	On-Demand	Anodyne	TBXAS1	34	40
CN(C[C@@H]1C[C@H](O)C1)C(=O)NCCc1cccnc1	ZINC000875047122	CD	On-Demand	Anodyne	KCNA5	15	41
CN(C[C@@H]1C[C@H](O)C1)C(=O)NCCc1cccnc1	ZINC000875047122	CD	On-Demand	Anodyne	CHRNA7	43	37
O=C(NNc1cccc(F)c1Br)NC1CCN(C(=O)C2CC2)CC1	ZINC000875047123	GF	On-Demand	Reactive	EPHX2	37	47
CC(=O)NC[C@@H]1CCCCN1C(=O)NCCc1cccnc1	ZINC000875047124	DD	On-Demand	Anodyne	FKBP1A	42	49
CC(=O)NC[C@@H]1CCCCN1C(=O)NCCc1cccnc1	ZINC000875047124	DD	On-Demand	Anodyne	TBXAS1	26	41
CC(=O)NC[C@@H]1CCCCN1C(=O)NCCc1cccnc1	ZINC000875047124	DD	On-Demand	Anodyne	CHRNA7	54	37
CC(=O)NC[C@@H]1CCCCN1C(=O)NCCc1cccnc1	ZINC000875047124	DD	On-Demand	Anodyne	C3AR1	40	41
CC(=O)NC[C@@H]1CCCCN1C(=O)NCCc1cccnc1	ZINC000875047124	DD	On-Demand	Anodyne	PREP	27	40
CC(=O)NC[C@@H]1CCCCN1C(=O)NCCc1cccnc1	ZINC000875047124	DD	On-Demand	Anodyne	NAMPT	47	44
O=C(NCCNC(=O)c1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000875047129	CC	On-Demand	Anodyne	GRIN2B	16	43
O=C(NCCNC(=O)c1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000875047129	CC	On-Demand	Anodyne	EPHX2	15	44
O=C(NCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccc(Cl)cc1	ZINC000875047145	GG	On-Demand	Anodyne	PLD1	42	40
O=C(NCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccc(Cl)cc1	ZINC000875047145	GG	On-Demand	Anodyne	EPHX2	29	48
O=C(NCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccc(Cl)cc1	ZINC000875047145	GG	On-Demand	Anodyne	PLD2	34	40
O=C(NCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccc(Cl)cc1	ZINC000875047145	GG	On-Demand	Anodyne	CACNA1I	48	32
O=C(NCCNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccc(Cl)cc1	ZINC000875047146	GG	On-Demand	Anodyne	PLD1	42	40
O=C(NCCNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccc(Cl)cc1	ZINC000875047146	GG	On-Demand	Anodyne	EPHX2	29	48
O=C(NCCNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccc(Cl)cc1	ZINC000875047146	GG	On-Demand	Anodyne	PLD2	34	40
O=C(NCCNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccc(Cl)cc1	ZINC000875047146	GG	On-Demand	Anodyne	CACNA1I	48	32
O=C(NCc1cccc(CN2CCOCC2)c1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875047147	GD	On-Demand	Anodyne	CHRM3	17	42
COCCN(CC1CCN(C)CC1)C(=O)NCc1cc(OC)ccc1OC	ZINC000875047150	GE	On-Demand	Anodyne	AVPR1B	40	34
COCCN(CC1CCN(C)CC1)C(=O)NCc1cc(OC)ccc1OC	ZINC000875047150	GE	On-Demand	Anodyne	ACKR3	69	34
O=C(NC1CCN(C(=O)c2ccoc2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875047162	GG	On-Demand	Anodyne	L3MBTL3	46	36
O=C(NC1CCN(C(=O)c2ccoc2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875047163	GG	On-Demand	Anodyne	L3MBTL3	46	36
O=C(C[C@@H]1C=CS(=O)(=O)C1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875047164	GF	On-Demand	Anodyne	SCD1	34	44
O=C(C[C@@H]1C=CS(=O)(=O)C1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875047164	GF	On-Demand	Anodyne	SCD	28	44
O=C(C[C@H]1C=CS(=O)(=O)C1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875047165	GF	On-Demand	Anodyne	SCD1	34	44
O=C(C[C@H]1C=CS(=O)(=O)C1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875047165	GF	On-Demand	Anodyne	SCD	28	44
O=C(Nn1cnc2ccccc2c1=O)[C@H](Cc1cccnc1)C1CCCC1	ZINC000875047173	FF	On-Demand	Anodyne	C3AR1	46	44
O=C(Nn1cnc2ccccc2c1=O)[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875047174	FF	On-Demand	Anodyne	C3AR1	46	44
O=C(NC1CCN(C(=O)C2CC2)CC1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875047177	FF	On-Demand	Anodyne	EPHX2	35	53
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3cc(OC)ccc3OC)C[C@@H]1C2	ZINC000875047179	ED	On-Demand	Anodyne	MTNR1B	28	41
O=C(NCC[C@H](O)C1CCCC1)NC1CCN(C(=O)C2CC2)CC1	ZINC000875047183	ED	On-Demand	Anodyne	EPHX2	27	44
O=C(NCC[C@@H](O)C1CCCC1)NC1CCN(C(=O)C2CC2)CC1	ZINC000875047184	ED	On-Demand	Anodyne	EPHX2	27	44
CCC1(CC)CCCN1C(=O)NC1CCN(C(=O)C2CC2)CC1	ZINC000875047189	DF	On-Demand	Anodyne	EPHX2	19	42
O=C(C1CC1)N1CCC(NC(=O)N2C[C@@H]3C[C@H]2CN3c2ccccc2)CC1	ZINC000875047192	FE	On-Demand	Anodyne	EPHX2	21	40
O=C(NCCCCC1CC1)C(=O)NCc1cccc(CN2CCOCC2)c1	ZINC000875047196	FD	On-Demand	Anodyne	ACHE	45	41
O=C(NCCCCC1CC1)C(=O)NCc1cccc(CN2CCOCC2)c1	ZINC000875047196	FD	On-Demand	Anodyne	HRH2	31	40
O=C(NCCCCC1CC1)C(=O)NCc1cccc(CN2CCOCC2)c1	ZINC000875047196	FD	On-Demand	Anodyne	CHRM3	18	40
O=C(NC1CCN(C(=O)C2CC2)CC1)N1Cc2cccc(O)c2C1	ZINC000875047202	ED	On-Demand	Clean	EPHX2	31	43
CCCCCCCNC(=O)C(=O)NCc1cccnc1N1CCOCC1	ZINC000875047210	FD	On-Demand	Mild	SCN10A	22	49
CCCCCCCNC(=O)C(=O)NCc1cccnc1N1CCOCC1	ZINC000875047210	FD	On-Demand	Mild	ASAH1	67	44
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)[C@@H](O)[C@@H](O)c1nc2ccccc2s1	ZINC000875047243	IH	On-Demand	Anodyne	SCD1	34	43
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)[C@@H](O)[C@@H](O)c1nc2ccccc2s1	ZINC000875047243	IH	On-Demand	Anodyne	SCD	29	43
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)[C@H](O)[C@@H](O)c1nc2ccccc2s1	ZINC000875047244	IH	On-Demand	Anodyne	SCD1	34	43
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)[C@H](O)[C@@H](O)c1nc2ccccc2s1	ZINC000875047244	IH	On-Demand	Anodyne	SCD	29	43
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)[C@@H](O)[C@H](O)c1nc2ccccc2s1	ZINC000875047245	IH	On-Demand	Anodyne	SCD1	34	43
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)[C@@H](O)[C@H](O)c1nc2ccccc2s1	ZINC000875047245	IH	On-Demand	Anodyne	SCD	29	43
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)[C@H](O)[C@H](O)c1nc2ccccc2s1	ZINC000875047246	IH	On-Demand	Anodyne	SCD1	34	43
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)[C@H](O)[C@H](O)c1nc2ccccc2s1	ZINC000875047246	IH	On-Demand	Anodyne	SCD	29	43
CC(=O)C1CCN(C(=O)C(=O)NCc2cccnc2OCC(F)(F)F)CC1	ZINC000875047283	GD	On-Demand	Anodyne	EPHX2	15	40
CC(=O)C1CCN(C(=O)C(=O)NCc2cccnc2OCC(F)(F)F)CC1	ZINC000875047283	GD	On-Demand	Anodyne	SCN10A	17	46
O=C(Cn1c(S)nc2ccccc2c1=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875047305	IH	On-Demand	Anodyne	SCD1	33	41
O=C(Cn1c(S)nc2ccccc2c1=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875047305	IH	On-Demand	Anodyne	SCD	28	41
O=CN1CCCN(C(=O)NCCNC(=O)c2ccccc2)CC1	ZINC000875047311	DC	On-Demand	Anodyne	DPP7	30	50
COCCn1c(C)cc(/C=C(\C#N)C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)c1C	ZINC000875047317	JJ	On-Demand	Reactive	SCD1	37	46
COCCn1c(C)cc(/C=C(\C#N)C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)c1C	ZINC000875047317	JJ	On-Demand	Reactive	SCD	31	46
COCCn1c(C)cc(/C=C(/C#N)C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)c1C	ZINC000875047318	JJ	On-Demand	Reactive	SCD1	37	46
COCCn1c(C)cc(/C=C(/C#N)C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)c1C	ZINC000875047318	JJ	On-Demand	Reactive	SCD	31	46
O=C(NCCc1cccnc1)N1CC(OCC(F)F)C1	ZINC000875047322	CD	On-Demand	Anodyne	PTAFR	40	38
O=C(NCCc1cccnc1)N1CC(OCC(F)F)C1	ZINC000875047322	CD	On-Demand	Anodyne	CHRNA7	48	37
O=C(NCCc1cccnc1)N1CC(OCC(F)F)C1	ZINC000875047322	CD	On-Demand	Anodyne	NAMPT	39	40
O=CN1CCCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)CC1	ZINC000875047323	GB	On-Demand	Anodyne	HTR1A	57	55
O=CN1CCCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)CC1	ZINC000875047323	GB	On-Demand	Anodyne	DRD2	58	46
O=CN1CCCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)CC1	ZINC000875047323	GB	On-Demand	Anodyne	DRD4	30	43
O=CN1CCCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)CC1	ZINC000875047323	GB	On-Demand	Anodyne	ADRA1D	25	44
O=CN1CCCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)CC1	ZINC000875047323	GB	On-Demand	Anodyne	HTR2A	42	47
O=CN1CCCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)CC1	ZINC000875047323	GB	On-Demand	Anodyne	HTR2C	27	47
O=CN1CCCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)CC1	ZINC000875047323	GB	On-Demand	Anodyne	ADRA1A	31	44
O=CN1CCCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)CC1	ZINC000875047323	GB	On-Demand	Anodyne	DRD3	68	43
O=CN1CCCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)CC1	ZINC000875047323	GB	On-Demand	Anodyne	HTR7	50	41
O=C(NCCCN1CCN(c2ncccn2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875047329	EC	On-Demand	Anodyne	HTR1A	50	63
O=C(NCCCN1CCN(c2ncccn2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875047329	EC	On-Demand	Anodyne	DRD2	49	52
O=C(NCCCN1CCN(c2ncccn2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875047329	EC	On-Demand	Anodyne	DRD4	27	47
O=C(NCCCN1CCN(c2ncccn2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875047329	EC	On-Demand	Anodyne	ADRA1D	20	40
O=C(NCCCN1CCN(c2ncccn2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875047329	EC	On-Demand	Anodyne	HTR2A	41	46
O=C(NCCCN1CCN(c2ncccn2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875047329	EC	On-Demand	Anodyne	HTR2C	30	46
O=C(NCCCN1CCN(c2ncccn2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875047329	EC	On-Demand	Anodyne	ADRA1A	22	40
O=C(NCCCN1CCN(c2ncccn2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875047329	EC	On-Demand	Anodyne	DRD3	64	42
O=C(NCCCN1CCN(c2ncccn2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875047329	EC	On-Demand	Anodyne	HTR7	23	40
CN(CCNC(=O)NCCc1cccnc1)CC(F)F	ZINC000875047332	CD	On-Demand	Anodyne	TBXAS1	39	41
CN(CCNC(=O)NCCc1cccnc1)CC(F)F	ZINC000875047332	CD	On-Demand	Anodyne	PTAFR	33	40
CN(CCNC(=O)NCCc1cccnc1)CC(F)F	ZINC000875047332	CD	On-Demand	Anodyne	KCNA5	16	46
CN(CCNC(=O)NCCc1cccnc1)CC(F)F	ZINC000875047332	CD	On-Demand	Anodyne	NAMPT	34	42
O=C1CCN(C(=O)NCCc2cccnc2)CCCCCCN1	ZINC000875047337	DD	On-Demand	Anodyne	TBXAS1	19	40
O=C1CCN(C(=O)NCCc2cccnc2)CCCCCCN1	ZINC000875047337	DD	On-Demand	Anodyne	CHRNA7	43	34
O=C1CCN(C(=O)NCCc2cccnc2)CCCCCCN1	ZINC000875047337	DD	On-Demand	Anodyne	NAMPT	44	47
O=C(NCCc1cccnc1)NCC1(OCCO)CCC(F)(F)CC1	ZINC000875047338	FD	On-Demand	Anodyne	NAMPT	32	40
O=C(NCCc1cccnc1)N[C@@H]1CCO[C@H]1c1cc[nH]n1	ZINC000875047339	DD	On-Demand	Anodyne	CHRNA7	46	37
O=C(NCCc1cccnc1)N[C@@H]1CCO[C@H]1c1cc[nH]n1	ZINC000875047339	DD	On-Demand	Anodyne	NAMPT	33	41
CO[C@H]1CCN([C@@H]2CCC[C@@H]2N(C)C(=O)NCCc2cccnc2)C1	ZINC000875047343	ED	On-Demand	Anodyne	FKBP1A	20	40
CO[C@H]1CCN([C@@H]2CCC[C@@H]2N(C)C(=O)NCCc2cccnc2)C1	ZINC000875047343	ED	On-Demand	Anodyne	CHRNA7	46	38
Cc1ccc(CNC(=O)C(=O)N2CCN([S@](C)(=N)=O)CC2)c(C)c1	ZINC000875047344	FC	On-Demand	Anodyne	EPHX2	19	40
Cc1ccc(CNC(=O)C(=O)N2CCN([S@@](C)(=N)=O)CC2)c(C)c1	ZINC000875047345	FC	On-Demand	Anodyne	EPHX2	19	40
COC(=O)[C@@]1(OC)CCN(C(=O)NCCc2cccnc2)C1	ZINC000875047349	DC	On-Demand	Anodyne	CHRNA7	46	36
COC(=O)[C@@]1(OC)CCN(C(=O)NCCc2cccnc2)C1	ZINC000875047349	DC	On-Demand	Anodyne	NAMPT	38	40
C=C1c2ccccc2C(=O)N1CCC(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875047350	II	On-Demand	Anodyne	SCD1	33	42
C=C1c2ccccc2C(=O)N1CCC(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875047350	II	On-Demand	Anodyne	SCD	28	42
Cc1cncc([C@H]2CCCN2C(=O)NCCNC(=O)c2ccccc2Cl)c1	ZINC000875047352	GG	On-Demand	Anodyne	SSTR5	26	40
Cc1cncc([C@H]2CCCN2C(=O)NCCNC(=O)c2ccccc2Cl)c1	ZINC000875047352	GG	On-Demand	Anodyne	PREP	42	40
Cc1cncc([C@@H]2CCCN2C(=O)NCCNC(=O)c2ccccc2Cl)c1	ZINC000875047353	GG	On-Demand	Anodyne	SSTR5	26	40
Cc1cncc([C@@H]2CCCN2C(=O)NCCNC(=O)c2ccccc2Cl)c1	ZINC000875047353	GG	On-Demand	Anodyne	PREP	42	40
O=C(NCCc1cccnc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875047360	DF	On-Demand	Anodyne	FKBP1A	19	42
O=C(NCCc1cccnc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875047360	DF	On-Demand	Anodyne	CHRNA7	53	39
O=C(NCCc1cccnc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875047360	DF	On-Demand	Anodyne	C3AR1	44	44
O=C(NCCc1cccnc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875047360	DF	On-Demand	Anodyne	EPHX2	22	49
O=C(NCCc1cccnc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875047360	DF	On-Demand	Anodyne	SCD	19	42
O=C(NCCc1cccnc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875047360	DF	On-Demand	Anodyne	NAMPT	52	43
O=C(NCCc1cccnc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875047361	DF	On-Demand	Anodyne	FKBP1A	19	42
O=C(NCCc1cccnc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875047361	DF	On-Demand	Anodyne	CHRNA7	53	39
O=C(NCCc1cccnc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875047361	DF	On-Demand	Anodyne	C3AR1	44	44
O=C(NCCc1cccnc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875047361	DF	On-Demand	Anodyne	EPHX2	22	49
O=C(NCCc1cccnc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875047361	DF	On-Demand	Anodyne	SCD	19	42
O=C(NCCc1cccnc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875047361	DF	On-Demand	Anodyne	NAMPT	52	43
COc1ccccc1[C@@H]1CSCCCN1C(=O)NCCc1cccnc1	ZINC000875047363	FH	On-Demand	Anodyne	FKBP1A	28	40
COc1ccccc1[C@@H]1CSCCCN1C(=O)NCCc1cccnc1	ZINC000875047363	FH	On-Demand	Anodyne	PTAFR	30	41
COc1ccccc1[C@@H]1CSCCCN1C(=O)NCCc1cccnc1	ZINC000875047363	FH	On-Demand	Anodyne	CHRNA7	45	41
CC[C@@](C)(NC(=O)NCCc1cccnc1)c1ccc(F)cc1	ZINC000875047366	DG	On-Demand	Anodyne	TBXAS1	46	44
CC[C@@](C)(NC(=O)NCCc1cccnc1)c1ccc(F)cc1	ZINC000875047366	DG	On-Demand	Anodyne	PTAFR	24	45
CC[C@@](C)(NC(=O)NCCc1cccnc1)c1ccc(F)cc1	ZINC000875047366	DG	On-Demand	Anodyne	NAMPT	37	40
CN(C[C@H](O)COc1cc(Cl)cc(Cl)c1)C(=O)NCCc1cccnc1	ZINC000875047378	GG	On-Demand	Anodyne	ADRB1	25	41
CN(C[C@H](O)COc1cc(Cl)cc(Cl)c1)C(=O)NCCc1cccnc1	ZINC000875047378	GG	On-Demand	Anodyne	GRIN1	24	44
CN(C[C@H](O)COc1cc(Cl)cc(Cl)c1)C(=O)NCCc1cccnc1	ZINC000875047378	GG	On-Demand	Anodyne	ADRB3	27	40
CN(C[C@H](O)COc1cc(Cl)cc(Cl)c1)C(=O)NCCc1cccnc1	ZINC000875047378	GG	On-Demand	Anodyne	PDS	60	40
CN(C[C@@H](O)COc1cc(Cl)cc(Cl)c1)C(=O)NCCc1cccnc1	ZINC000875047379	GG	On-Demand	Anodyne	ADRB1	25	41
CN(C[C@@H](O)COc1cc(Cl)cc(Cl)c1)C(=O)NCCc1cccnc1	ZINC000875047379	GG	On-Demand	Anodyne	GRIN1	24	44
CN(C[C@@H](O)COc1cc(Cl)cc(Cl)c1)C(=O)NCCc1cccnc1	ZINC000875047379	GG	On-Demand	Anodyne	ADRB3	27	40
CN(C[C@@H](O)COc1cc(Cl)cc(Cl)c1)C(=O)NCCc1cccnc1	ZINC000875047379	GG	On-Demand	Anodyne	PDS	60	40
COC(=O)N(C)NC(=O)NCCNC(=O)c1ccccc1Cl	ZINC000875047380	EC	On-Demand	Reactive	ECR	69	45
COC(=O)N(C)NC(=O)NCCNC(=O)c1ccccc1Cl	ZINC000875047380	EC	On-Demand	Reactive	E3UJZ5_SPOLI	39	40
CO[C@H]1CCN([C@@H]2CCC[C@@H]2NC(=O)NCCc2cccnc2)C1	ZINC000875047397	ED	On-Demand	Anodyne	CHRNA7	50	42
CO[C@H]1CCN([C@@H]2CCC[C@@H]2NC(=O)NCCc2cccnc2)C1	ZINC000875047397	ED	On-Demand	Anodyne	ACHP_LYMST	24	40
CO[C@H]1CCN([C@@H]2CCC[C@@H]2NC(=O)NCCc2cccnc2)C1	ZINC000875047397	ED	On-Demand	Anodyne	NAMPT	33	42
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(C(=O)C2CC2)CC1	ZINC000875047398	GD	On-Demand	Anodyne	SIGMAR1	15	46
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(C(=O)C2CC2)CC1	ZINC000875047398	GD	On-Demand	Anodyne	EPHX2	43	50
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(C(=O)C2CC2)CC1	ZINC000875047398	GD	On-Demand	Anodyne	ST14	32	40
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(C(=O)C2CC2)CC1	ZINC000875047398	GD	On-Demand	Anodyne	TMPRSS6	22	40
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(C(=O)C2CC2)CC1	ZINC000875047400	GD	On-Demand	Anodyne	SIGMAR1	15	46
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(C(=O)C2CC2)CC1	ZINC000875047400	GD	On-Demand	Anodyne	EPHX2	43	50
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(C(=O)C2CC2)CC1	ZINC000875047400	GD	On-Demand	Anodyne	ST14	32	40
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(C(=O)C2CC2)CC1	ZINC000875047400	GD	On-Demand	Anodyne	TMPRSS6	22	40
O=C(NCCc1cccnc1)N[C@@]12CCCC[C@H]1C2	ZINC000875047405	CE	On-Demand	Anodyne	NAMPT	39	44
O=C(NCCc1cccnc1)N[C@]12CCCC[C@@H]1C2	ZINC000875047406	CE	On-Demand	Anodyne	NAMPT	39	44
O=C(NCCc1cccnc1)N[C@@]12CCCC[C@@H]1C2	ZINC000875047407	CE	On-Demand	Anodyne	NAMPT	39	44
O=C(NCCc1cccnc1)N[C@]12CCCC[C@H]1C2	ZINC000875047409	CE	On-Demand	Anodyne	NAMPT	39	44
CN1CCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)CCC1(C)C	ZINC000875047421	GD	On-Demand	Anodyne	HTR1A	46	53
CN1CCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)CCC1(C)C	ZINC000875047421	GD	On-Demand	Anodyne	DRD2	45	48
CN1CCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)CCC1(C)C	ZINC000875047421	GD	On-Demand	Anodyne	DRD4	24	42
CN1CCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)CCC1(C)C	ZINC000875047421	GD	On-Demand	Anodyne	ADRA1D	38	44
CN1CCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)CCC1(C)C	ZINC000875047421	GD	On-Demand	Anodyne	HTR2A	35	44
CN1CCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)CCC1(C)C	ZINC000875047421	GD	On-Demand	Anodyne	HTR2C	28	44
CN1CCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)CCC1(C)C	ZINC000875047421	GD	On-Demand	Anodyne	ADRA1A	56	39
CN1CCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)CCC1(C)C	ZINC000875047421	GD	On-Demand	Anodyne	ADRA1B	28	41
CN1CCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)CCC1(C)C	ZINC000875047421	GD	On-Demand	Anodyne	DRD3	58	44
C#CC[C@H](COC)NC(=O)C(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875047443	FD	On-Demand	Mild	HRH2	36	45
C#CC[C@@H](COC)NC(=O)C(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875047444	FD	On-Demand	Mild	HRH2	36	45
CC[C@@H]1COCCN1CCNC(=O)NCCNC(=O)c1ccccc1	ZINC000875047453	EC	On-Demand	Anodyne	DRD4	42	33
CC[C@@H]1COCCN1CCNC(=O)NCCNC(=O)c1ccccc1	ZINC000875047453	EC	On-Demand	Anodyne	HPGDS	23	40
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875047464	FD	On-Demand	Mild	HRH2	36	44
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875047464	FD	On-Demand	Mild	CHRM3	16	41
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875047465	FD	On-Demand	Mild	HRH2	36	44
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875047465	FD	On-Demand	Mild	CHRM3	16	41
O=C(NCC[C@H]1CCSC1)C(=O)NCc1cccnc1N1CCOCC1	ZINC000875047473	GC	On-Demand	Anodyne	SCN10A	20	45
O=C(NCC[C@H]1CCSC1)C(=O)NCc1cccnc1N1CCOCC1	ZINC000875047473	GC	On-Demand	Anodyne	SIRT3	40	31
O=C(NCC[C@H]1CCSC1)C(=O)NCc1cccnc1N1CCOCC1	ZINC000875047473	GC	On-Demand	Anodyne	SIRT2	44	31
O=C(NCC[C@H]1CCSC1)C(=O)NCc1cccnc1N1CCOCC1	ZINC000875047473	GC	On-Demand	Anodyne	SIRT1	40	31
O=C(NCC[C@@H]1CCSC1)C(=O)NCc1cccnc1N1CCOCC1	ZINC000875047474	GC	On-Demand	Anodyne	SCN10A	20	45
O=C(NCC[C@@H]1CCSC1)C(=O)NCc1cccnc1N1CCOCC1	ZINC000875047474	GC	On-Demand	Anodyne	SIRT3	40	31
O=C(NCC[C@@H]1CCSC1)C(=O)NCc1cccnc1N1CCOCC1	ZINC000875047474	GC	On-Demand	Anodyne	SIRT2	44	31
O=C(NCC[C@@H]1CCSC1)C(=O)NCc1cccnc1N1CCOCC1	ZINC000875047474	GC	On-Demand	Anodyne	SIRT1	40	31
CCC1(CC)CCCN1C(=O)NC1CCN(C(=O)c2ccoc2)CC1	ZINC000875047499	EG	On-Demand	Anodyne	L3MBTL3	47	32
O=C(C1CC1)N1CCC(NC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875047504	GF	On-Demand	Anodyne	EPHX2	22	40
O=C(C1CC1)N1CCC(NC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875047504	GF	On-Demand	Anodyne	SFRP1	53	35
O=C(C1CC1)N1CCC(NC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875047504	GF	On-Demand	Anodyne	WNT3	56	35
O=C(C1CC1)N1CCC(NC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875047505	GF	On-Demand	Anodyne	EPHX2	22	40
O=C(C1CC1)N1CCC(NC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875047505	GF	On-Demand	Anodyne	SFRP1	53	35
O=C(C1CC1)N1CCC(NC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875047505	GF	On-Demand	Anodyne	WNT3	56	35
O=C(C1CC1)N1CCC(NC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875047506	GF	On-Demand	Anodyne	EPHX2	22	40
O=C(C1CC1)N1CCC(NC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875047506	GF	On-Demand	Anodyne	SFRP1	53	35
O=C(C1CC1)N1CCC(NC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875047506	GF	On-Demand	Anodyne	WNT3	56	35
O=C(C1CC1)N1CCC(NC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875047507	GF	On-Demand	Anodyne	EPHX2	22	40
O=C(C1CC1)N1CCC(NC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875047507	GF	On-Demand	Anodyne	SFRP1	53	35
O=C(C1CC1)N1CCC(NC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875047507	GF	On-Demand	Anodyne	WNT3	56	35
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(OC)ccc1OC	ZINC000875047508	ED	On-Demand	Anodyne	SLC6A4	29	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(OC)ccc1OC	ZINC000875047508	ED	On-Demand	Anodyne	SLC6A3	47	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(OC)ccc1OC	ZINC000875047508	ED	On-Demand	Anodyne	MTNR1B	27	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(OC)ccc1OC	ZINC000875047509	ED	On-Demand	Anodyne	SLC6A4	29	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(OC)ccc1OC	ZINC000875047509	ED	On-Demand	Anodyne	SLC6A3	47	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(OC)ccc1OC	ZINC000875047509	ED	On-Demand	Anodyne	MTNR1B	27	40
CCC(CC)[C@H](CNC(=O)N1CCC(N2CCN(C)CC2)CC1)N1CCCC1	ZINC000875047513	GE	On-Demand	Anodyne	L3MBTL3	54	42
CCC(CC)[C@@H](CNC(=O)N1CCC(N2CCN(C)CC2)CC1)N1CCCC1	ZINC000875047514	GE	On-Demand	Anodyne	L3MBTL3	54	42
O=C(CN1C(=O)CCOc2ccccc21)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875047525	IH	On-Demand	Anodyne	SCD1	33	41
O=C(CN1C(=O)CCOc2ccccc21)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875047525	IH	On-Demand	Anodyne	SCD	28	41
CN1CCN(C(=O)NCCNC(=O)c2ccccc2)CCC1(C)C	ZINC000875047548	ED	On-Demand	Anodyne	DRD4	42	33
O=C(NCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000875047593	FF	On-Demand	Anodyne	PREP	36	42
O=C(NCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000875047593	FF	On-Demand	Anodyne	EPHX2	35	42
O=C(NCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000875047593	FF	On-Demand	Anodyne	DPP7	22	46
O=C(NCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000875047593	FF	On-Demand	Anodyne	SCD1	18	44
O=C(NCCNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000875047594	FF	On-Demand	Anodyne	PREP	36	42
O=C(NCCNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000875047594	FF	On-Demand	Anodyne	EPHX2	35	42
O=C(NCCNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000875047594	FF	On-Demand	Anodyne	DPP7	22	46
O=C(NCCNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000875047594	FF	On-Demand	Anodyne	SCD1	18	44
COC(=O)N(C)NC(=O)NCCNC(=O)c1ccccc1	ZINC000875047599	CC	On-Demand	Reactive	DRD4	40	32
COC(=O)N(C)NC(=O)NCCNC(=O)c1ccccc1	ZINC000875047599	CC	On-Demand	Reactive	ECR	48	41
COC(=O)N(C)NC(=O)NCCNC(=O)c1ccccc1	ZINC000875047599	CC	On-Demand	Reactive	CTSG	17	41
COC(=O)N(C)NC(=O)NCCNC(=O)c1ccccc1	ZINC000875047599	CC	On-Demand	Reactive	CTRB1	30	41
COC(=O)N(C)NC(=O)NCCNC(=O)c1ccccc1	ZINC000875047599	CC	On-Demand	Reactive	ITGAV	25	40
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(C)cc2C)CC1	ZINC000875047613	DD	On-Demand	Anodyne	EPHX2	37	43
O=C(NCc1cccc(CN2CCCC2)c1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875047617	GC	On-Demand	Anodyne	HRH2	32	47
O=C(NCc1cccc(CN2CCCC2)c1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875047617	GC	On-Demand	Anodyne	CHRM3	21	41
O=C(NCc1cccc(CN2CCCC2)c1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875047617	GC	On-Demand	Anodyne	SIGMAR1	29	42
O=C(NCc1cccc(CN2CCCC2)c1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875047617	GC	On-Demand	Anodyne	NPFFR2	34	40
O=C(NCc1cccc(CN2CCCC2)c1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875047617	GC	On-Demand	Anodyne	NPFFR1	47	40
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(CN3CCOCC3)c2)CC1	ZINC000875047620	GC	On-Demand	Anodyne	CHRM3	19	43
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(CN3CCOCC3)c2)CC1	ZINC000875047620	GC	On-Demand	Anodyne	SIGMAR1	20	43
O=C(NCCc1cccnc1)N1CC[C@H]2CC[C@@H](C1)S2(=O)=O	ZINC000875047638	DC	On-Demand	Anodyne	FKBP1A	18	41
O=C(NCCc1cccnc1)N1CC[C@H]2CC[C@@H](C1)S2(=O)=O	ZINC000875047638	DC	On-Demand	Anodyne	CHRNA7	53	38
O=C(NCCc1cccnc1)N1CC[C@H]2CC[C@@H](C1)S2(=O)=O	ZINC000875047638	DC	On-Demand	Anodyne	C3AR1	45	45
O=C(NCCc1cccnc1)N1CC[C@H]2CC[C@@H](C1)S2(=O)=O	ZINC000875047638	DC	On-Demand	Anodyne	NAMPT	53	45
CC[C@@H]1COCCN1CCNC(=O)NCc1cc(OC)ccc1OC	ZINC000875047644	FD	On-Demand	Anodyne	MTNR1A	45	37
COc1ccccc1[C@H]1CCCN(C(=O)NCCC(=O)NC(C)C)CC1	ZINC000875047645	FF	On-Demand	Anodyne	DRD2	16	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCCC(=O)NC(C)C)CC1	ZINC000875047647	FF	On-Demand	Anodyne	DRD2	16	43
O=C(NCCc1cccnc1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875047651	DE	On-Demand	Anodyne	NAMPT	35	41
O=C(NCCc1cccnc1)NC1([C@H]2CCCCO2)CCC1	ZINC000875047652	DE	On-Demand	Anodyne	NAMPT	35	41
O=C(NCCc1cccnc1)NC1(c2c(F)cccc2F)CCC1	ZINC000875047653	EG	On-Demand	Anodyne	NAMPT	37	47
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)c(C)c1	ZINC000875047663	FF	On-Demand	Anodyne	SIRT3	52	32
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)c(C)c1	ZINC000875047663	FF	On-Demand	Anodyne	SIRT2	53	33
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)c(C)c1	ZINC000875047663	FF	On-Demand	Anodyne	SIRT1	52	32
O=C(NCCNC(=O)c1ccc(Cl)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875047668	ED	On-Demand	Anodyne	CACNA1I	51	34
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccoc3)CC2)C1	ZINC000875047670	ED	On-Demand	Anodyne	EPHX2	17	43
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccoc3)CC2)C1	ZINC000875047670	ED	On-Demand	Anodyne	L3MBTL3	75	39
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccoc3)CC2)C1	ZINC000875047672	ED	On-Demand	Anodyne	EPHX2	17	43
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccoc3)CC2)C1	ZINC000875047672	ED	On-Demand	Anodyne	L3MBTL3	75	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cccnc1	ZINC000875047676	DD	On-Demand	Anodyne	FKBP1A	19	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cccnc1	ZINC000875047676	DD	On-Demand	Anodyne	SLC6A4	22	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cccnc1	ZINC000875047676	DD	On-Demand	Anodyne	SLC6A3	43	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cccnc1	ZINC000875047676	DD	On-Demand	Anodyne	CHRNA7	46	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cccnc1	ZINC000875047677	DD	On-Demand	Anodyne	FKBP1A	19	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cccnc1	ZINC000875047677	DD	On-Demand	Anodyne	SLC6A4	22	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cccnc1	ZINC000875047677	DD	On-Demand	Anodyne	SLC6A3	43	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cccnc1	ZINC000875047677	DD	On-Demand	Anodyne	CHRNA7	46	37
C[C@]1(C(F)(F)F)CN(C(=O)NCCNC(=O)c2ccccc2Cl)CCO1	ZINC000875047679	GE	On-Demand	Anodyne	ECR	45	36
C[C@]1(C(F)(F)F)CN(C(=O)NCCNC(=O)c2ccccc2Cl)CCO1	ZINC000875047679	GE	On-Demand	Anodyne	EPHX2	19	44
O=C(NCCc1cccnc1)N[C@@H]1CCOC[C@@H]1O	ZINC000875047680	CC	On-Demand	Anodyne	CHRNA7	46	38
O=C(NCCc1cccnc1)N[C@@H]1CCOC[C@@H]1O	ZINC000875047680	CC	On-Demand	Anodyne	NAMPT	41	43
O=C(NCCc1cccnc1)N[C@H]1CCOC[C@H]1O	ZINC000875047681	CC	On-Demand	Anodyne	CHRNA7	46	38
O=C(NCCc1cccnc1)N[C@H]1CCOC[C@H]1O	ZINC000875047681	CC	On-Demand	Anodyne	NAMPT	41	43
O=C(NCCc1cccnc1)N[C@H]1CCOC[C@@H]1O	ZINC000875047682	CC	On-Demand	Anodyne	CHRNA7	46	38
O=C(NCCc1cccnc1)N[C@H]1CCOC[C@@H]1O	ZINC000875047682	CC	On-Demand	Anodyne	NAMPT	41	43
O=C(NCCc1cccnc1)N[C@@H]1CCOC[C@H]1O	ZINC000875047683	CC	On-Demand	Anodyne	CHRNA7	46	38
O=C(NCCc1cccnc1)N[C@@H]1CCOC[C@H]1O	ZINC000875047683	CC	On-Demand	Anodyne	NAMPT	41	43
CC[C@@H](NC(=O)NC1CCN(C(=O)C2CC2)CC1)[C@@H](O)c1ccccc1	ZINC000875047687	FE	On-Demand	Anodyne	EPHX2	41	47
CC[C@@H](NC(=O)NC1CCN(C(=O)C2CC2)CC1)[C@@H](O)c1ccccc1	ZINC000875047687	FE	On-Demand	Anodyne	XIAP	41	36
CC[C@@H](NC(=O)NC1CCN(C(=O)C2CC2)CC1)[C@H](O)c1ccccc1	ZINC000875047689	FE	On-Demand	Anodyne	EPHX2	41	47
CC[C@@H](NC(=O)NC1CCN(C(=O)C2CC2)CC1)[C@H](O)c1ccccc1	ZINC000875047689	FE	On-Demand	Anodyne	XIAP	41	36
CN1CCN(C(=O)NCCNC(=O)c2ccccc2Cl)Cc2cccnc21	ZINC000875047710	GE	On-Demand	Anodyne	ECR	44	36
CN1CCN(C(=O)NCCNC(=O)c2ccccc2Cl)Cc2cccnc21	ZINC000875047710	GE	On-Demand	Anodyne	G2YM83_BOTF4	52	33
CCOC(=O)[C@@H]1CN(C(=O)NCCc2cccnc2)CCC1(F)F	ZINC000875047714	ED	On-Demand	Anodyne	FKBP1A	17	41
CCOC(=O)[C@@H]1CN(C(=O)NCCc2cccnc2)CCC1(F)F	ZINC000875047714	ED	On-Demand	Anodyne	CHRNA7	41	34
COC(=O)[C@@]12C[C@@H](NC(=O)NCCc3cccnc3)C[C@@H]1C2	ZINC000875047715	DD	On-Demand	Anodyne	CHRNA7	47	39
COC(=O)[C@@]12C[C@@H](NC(=O)NCCc3cccnc3)C[C@@H]1C2	ZINC000875047715	DD	On-Demand	Anodyne	NAMPT	34	41
O=C(NCCc1cccnc1)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875047716	DF	On-Demand	Anodyne	FKBP1A	17	40
O=C(NCCc1cccnc1)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875047716	DF	On-Demand	Anodyne	CHRNA7	56	44
O=C(NCCc1cccnc1)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875047716	DF	On-Demand	Anodyne	C3AR1	44	44
O=C(NCCc1cccnc1)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875047716	DF	On-Demand	Anodyne	NAMPT	62	43
O=C(NCCc1cccnc1)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875047717	DF	On-Demand	Anodyne	FKBP1A	17	40
O=C(NCCc1cccnc1)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875047717	DF	On-Demand	Anodyne	CHRNA7	56	44
O=C(NCCc1cccnc1)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875047717	DF	On-Demand	Anodyne	C3AR1	44	44
O=C(NCCc1cccnc1)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875047717	DF	On-Demand	Anodyne	NAMPT	62	43
O=C(NCCc1cccnc1)NC[C@@H](O)[C@H]1CCCO1	ZINC000875047720	CC	On-Demand	Anodyne	NAMPT	36	43
O=C(NCCc1cccnc1)NC[C@@H](O)[C@@H]1CCCO1	ZINC000875047721	CC	On-Demand	Anodyne	NAMPT	36	43
O=C(NCCc1cccnc1)NC[C@H](O)[C@H]1CCCO1	ZINC000875047722	CC	On-Demand	Anodyne	NAMPT	36	43
O=C(NCCc1cccnc1)NC[C@H](O)[C@@H]1CCCO1	ZINC000875047723	CC	On-Demand	Anodyne	NAMPT	36	43
C[C@@H](NC(=O)NC1CCN(C(=O)c2ccoc2)CC1)c1ccccc1O	ZINC000875047725	FF	On-Demand	Clean	EPHX2	28	42
C[C@H](NC(=O)NC1CCN(C(=O)c2ccoc2)CC1)c1ccccc1O	ZINC000875047726	FF	On-Demand	Clean	EPHX2	28	42
CN1CCN(C(=O)NCCc2cccnc2)CCC1(C)C	ZINC000875047728	CD	On-Demand	Anodyne	CHRNA7	42	33
CN1CCN(C(=O)NCCc2cccnc2)CCC1(C)C	ZINC000875047728	CD	On-Demand	Anodyne	C3AR1	36	40
CN1CCN(C(=O)NCCc2cccnc2)CCC1(C)C	ZINC000875047728	CD	On-Demand	Anodyne	NAMPT	44	42
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(S(=O)(=O)CC)CC1	ZINC000875047742	EC	On-Demand	Anodyne	EPHX2	21	45
O=C(NCCc1cccnc1)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875047750	CD	On-Demand	Anodyne	CHRNA7	52	39
O=C(NCCc1cccnc1)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875047750	CD	On-Demand	Anodyne	NAMPT	36	40
O=C(NCCc1cccnc1)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875047753	CD	On-Demand	Anodyne	CHRNA7	52	39
O=C(NCCc1cccnc1)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875047753	CD	On-Demand	Anodyne	NAMPT	36	40
O=C(NCCc1cccnc1)N[C@@H]1C[C@H](CO)C1	ZINC000875047766	BC	On-Demand	Anodyne	TBXAS1	34	42
O=C(NCCc1cccnc1)N[C@@H]1C[C@H](CO)C1	ZINC000875047766	BC	On-Demand	Anodyne	PTAFR	21	40
O=C(NCCc1cccnc1)N[C@@H]1C[C@H](CO)C1	ZINC000875047766	BC	On-Demand	Anodyne	CHRNA7	44	38
O=C(NCCc1cccnc1)N[C@@H]1C[C@H](CO)C1	ZINC000875047766	BC	On-Demand	Anodyne	NAMPT	41	45
O=C(NCCNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)c1ccco1	ZINC000875047771	FD	On-Demand	Anodyne	SIGMAR1	17	42
COc1ncccc1CNC(=O)C(=O)N1CCN(c2ccc(F)cc2C#N)CC1	ZINC000875047780	GD	On-Demand	Mild	ADRA1A	15	40
O=C(NNc1cccc(F)c1Cl)NC1CCN(C(=O)C2CC2)CC1	ZINC000875047783	FF	On-Demand	Reactive	EPHX2	37	47
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCNC(=O)c2ccccc2Cl)C1	ZINC000875047784	FE	On-Demand	Anodyne	P2RX7	16	41
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCNC(=O)c2ccccc2Cl)C1	ZINC000875047784	FE	On-Demand	Anodyne	KCNA3	44	37
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCNC(=O)c2ccccc2Cl)C1	ZINC000875047784	FE	On-Demand	Anodyne	PLD1	17	41
O=C(NC1CCN(C(=O)c2ccoc2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875047790	GF	On-Demand	Anodyne	EPHX2	41	48
O=C(NC1CCN(C(=O)c2ccoc2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875047790	GF	On-Demand	Anodyne	L3MBTL3	40	38
CCOc1cc(CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)ccc1OC(F)F	ZINC000875047794	GE	On-Demand	Anodyne	SSTR5	40	33
CCOc1cc(CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)ccc1OC(F)F	ZINC000875047796	GE	On-Demand	Anodyne	SSTR5	40	33
CCn1c(=O)c2ccccc2n(CC(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)c1=O	ZINC000875047797	JG	On-Demand	Anodyne	SCD1	35	44
CCn1c(=O)c2ccccc2n(CC(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)c1=O	ZINC000875047797	JG	On-Demand	Anodyne	SCD	30	44
COCCN(CC1CCN(C)CC1)C(=O)NCCNC(=O)c1ccccc1	ZINC000875047799	GD	On-Demand	Anodyne	DRD2	17	41
COCCN(CC1CCN(C)CC1)C(=O)NCCNC(=O)c1ccccc1	ZINC000875047799	GD	On-Demand	Anodyne	DRD4	43	33
COCCN(CC1CCN(C)CC1)C(=O)NCCNC(=O)c1ccccc1	ZINC000875047799	GD	On-Demand	Anodyne	ACHE	19	46
COCCN(CC1CCN(C)CC1)C(=O)NCCNC(=O)c1ccccc1	ZINC000875047799	GD	On-Demand	Anodyne	CACNA1I	59	38
COCCN(CC1CCN(C)CC1)C(=O)NCCNC(=O)c1ccccc1	ZINC000875047799	GD	On-Demand	Anodyne	ACKR3	67	36
O=C(NCCCN1CCN(c2ncccn2)CC1)NCC[C@@H](O)C1CCCC1	ZINC000875047808	GD	On-Demand	Anodyne	HTR1A	47	57
O=C(NCCCN1CCN(c2ncccn2)CC1)NCC[C@@H](O)C1CCCC1	ZINC000875047808	GD	On-Demand	Anodyne	DRD2	39	51
O=C(NCCCN1CCN(c2ncccn2)CC1)NCC[C@@H](O)C1CCCC1	ZINC000875047808	GD	On-Demand	Anodyne	DRD4	20	44
O=C(NCCCN1CCN(c2ncccn2)CC1)NCC[C@@H](O)C1CCCC1	ZINC000875047808	GD	On-Demand	Anodyne	HTR2A	32	44
O=C(NCCCN1CCN(c2ncccn2)CC1)NCC[C@@H](O)C1CCCC1	ZINC000875047808	GD	On-Demand	Anodyne	HTR2C	21	44
O=C(NCCCN1CCN(c2ncccn2)CC1)NCC[C@@H](O)C1CCCC1	ZINC000875047808	GD	On-Demand	Anodyne	ADRA1A	20	41
O=C(NCCCN1CCN(c2ncccn2)CC1)NCC[C@@H](O)C1CCCC1	ZINC000875047808	GD	On-Demand	Anodyne	DRD3	49	42
O=C(NCCCN1CCN(c2ncccn2)CC1)NCC[C@@H](O)C1CCCC1	ZINC000875047808	GD	On-Demand	Anodyne	CCR3	24	40
O=C(NCCCN1CCN(c2ncccn2)CC1)NCC[C@H](O)C1CCCC1	ZINC000875047810	GD	On-Demand	Anodyne	HTR1A	47	57
O=C(NCCCN1CCN(c2ncccn2)CC1)NCC[C@H](O)C1CCCC1	ZINC000875047810	GD	On-Demand	Anodyne	DRD2	39	51
O=C(NCCCN1CCN(c2ncccn2)CC1)NCC[C@H](O)C1CCCC1	ZINC000875047810	GD	On-Demand	Anodyne	DRD4	20	44
O=C(NCCCN1CCN(c2ncccn2)CC1)NCC[C@H](O)C1CCCC1	ZINC000875047810	GD	On-Demand	Anodyne	HTR2A	32	44
O=C(NCCCN1CCN(c2ncccn2)CC1)NCC[C@H](O)C1CCCC1	ZINC000875047810	GD	On-Demand	Anodyne	HTR2C	21	44
O=C(NCCCN1CCN(c2ncccn2)CC1)NCC[C@H](O)C1CCCC1	ZINC000875047810	GD	On-Demand	Anodyne	ADRA1A	20	41
O=C(NCCCN1CCN(c2ncccn2)CC1)NCC[C@H](O)C1CCCC1	ZINC000875047810	GD	On-Demand	Anodyne	DRD3	49	42
O=C(NCCCN1CCN(c2ncccn2)CC1)NCC[C@H](O)C1CCCC1	ZINC000875047810	GD	On-Demand	Anodyne	CCR3	24	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2cccnc2N2CCOCC2)C1	ZINC000875047814	FC	On-Demand	Anodyne	SCN10A	20	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2cccnc2N2CCOCC2)C1	ZINC000875047815	FC	On-Demand	Anodyne	SCN10A	20	44
O=CN1CCCN(C(=O)NCCNC(=O)c2ccc(Cl)cc2)CC1	ZINC000875047816	FC	On-Demand	Anodyne	EPHX2	17	41
O=CN1CCCN(C(=O)NCCNC(=O)c2ccc(Cl)cc2)CC1	ZINC000875047816	FC	On-Demand	Anodyne	DPP7	42	39
O=CN1CCCN(C(=O)NCCNC(=O)c2ccc(Cl)cc2)CC1	ZINC000875047816	FC	On-Demand	Anodyne	CXCR3	18	43
CC[C@@H](C(=O)Oc1cc(OC)cc(OC)c1)c1ccccc1	ZINC000875047818	DH	On-Demand	Anodyne	KCNQ2	41	42
CC[C@@H](C(=O)Oc1cc(OC)cc(OC)c1)c1ccccc1	ZINC000875047818	DH	On-Demand	Anodyne	SOAT1	20	40
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NC1CCN(C(=O)C2CC2)CC1	ZINC000875047820	GE	On-Demand	Anodyne	EPHX2	37	50
O=C(NC1CCN(C(=O)C2CC2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875047825	GD	On-Demand	Anodyne	CHRM2	18	43
O=C(NC1CCN(C(=O)C2CC2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875047825	GD	On-Demand	Anodyne	DRD4	36	51
O=C(NC1CCN(C(=O)C2CC2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875047825	GD	On-Demand	Anodyne	ACHE	24	42
O=C(NC1CCN(C(=O)C2CC2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875047825	GD	On-Demand	Anodyne	CHRM3	21	43
O=C(NC1CCN(C(=O)C2CC2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875047825	GD	On-Demand	Anodyne	SIGMAR1	45	52
O=C(NC1CCN(C(=O)C2CC2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875047825	GD	On-Demand	Anodyne	CCR3	24	46
O=C(NC1CCN(C(=O)C2CC2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875047825	GD	On-Demand	Anodyne	EPHX2	41	46
O=C(NC1CCN(C(=O)C2CC2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875047825	GD	On-Demand	Anodyne	MCHR1	23	43
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1cccnc1OC)CC2	ZINC000875047834	GD	On-Demand	Anodyne	HCRTR1	15	47
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1cccnc1OC)CC2	ZINC000875047836	GD	On-Demand	Anodyne	HCRTR1	15	47
CS(=O)(=O)NC1CN(C(=O)NCCc2cccnc2)C1	ZINC000875047921	CB	On-Demand	Anodyne	TBXAS1	46	42
CS(=O)(=O)NC1CN(C(=O)NCCc2cccnc2)C1	ZINC000875047921	CB	On-Demand	Anodyne	CHRNA7	44	34
CS(=O)(=O)NC1CN(C(=O)NCCc2cccnc2)C1	ZINC000875047921	CB	On-Demand	Anodyne	C3AR1	38	41
CS(=O)(=O)NC1CN(C(=O)NCCc2cccnc2)C1	ZINC000875047921	CB	On-Demand	Anodyne	NAMPT	67	45
O=C(NCc1ncc(Cl)s1)C(=O)NCc1cccnc1N1CCOCC1	ZINC000875047925	GC	On-Demand	Anodyne	SCN2A	17	43
O=C(NCc1ncc(Cl)s1)C(=O)NCc1cccnc1N1CCOCC1	ZINC000875047925	GC	On-Demand	Anodyne	SCN10A	29	55
O=C(NCc1ncc(Cl)s1)C(=O)NCc1cccnc1N1CCOCC1	ZINC000875047925	GC	On-Demand	Anodyne	STAT6	44	36
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NCCc1cccnc1	ZINC000875047928	EF	On-Demand	Anodyne	TBXAS1	46	42
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NCCc1cccnc1	ZINC000875047928	EF	On-Demand	Anodyne	PTAFR	15	42
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NCCc1cccnc1	ZINC000875047928	EF	On-Demand	Anodyne	NAMPT	28	41
CCOC(=O)[C@@]1(C)CN(C(=O)NCCc2cccnc2)CCO1	ZINC000875047930	DC	On-Demand	Anodyne	FKBP1A	15	41
CCOC(=O)[C@@]1(C)CN(C(=O)NCCc2cccnc2)CCO1	ZINC000875047930	DC	On-Demand	Anodyne	CHRNA7	45	37
COC(=O)C1(O)CN(C(=O)NCc2cc(OC)ccc2OC)C1	ZINC000875047941	DC	On-Demand	Anodyne	MTNR1A	57	37
COC(=O)C1(O)CN(C(=O)NCc2cc(OC)ccc2OC)C1	ZINC000875047941	DC	On-Demand	Anodyne	MTNR1B	46	44
CN1CC[C@H]2CN(C(=O)NC3CCN(C(=O)c4ccoc4)CC3)CC[C@H]21	ZINC000875047944	FD	On-Demand	Anodyne	L3MBTL3	58	34
CN1CC[C@H]2CN(C(=O)NC3CCN(C(=O)c4ccoc4)CC3)CC[C@@H]21	ZINC000875047945	FD	On-Demand	Anodyne	L3MBTL3	58	34
O=C(NC[C@H]1CC(C(F)(F)F)=NO1)NC1CCN(C(=O)C2CC2)CC1	ZINC000875047947	FD	On-Demand	Anodyne	EPHX2	28	48
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)NC1CCN(C(=O)C2CC2)CC1	ZINC000875047948	FD	On-Demand	Anodyne	EPHX2	28	48
O=C(NCCc1cccnc1)NCCN1CC[C@@H](O)C1	ZINC000875047954	CB	On-Demand	Anodyne	CCR3	15	42
O=C(NCCc1cccnc1)NCCN1CC[C@@H](O)C1	ZINC000875047954	CB	On-Demand	Anodyne	CHRNA7	52	42
O=C(NCCc1cccnc1)NCCN1CC[C@@H](O)C1	ZINC000875047954	CB	On-Demand	Anodyne	ACHP_LYMST	27	42
O=C(NCCc1cccnc1)NCCN1CC[C@@H](O)C1	ZINC000875047954	CB	On-Demand	Anodyne	NAMPT	44	47
O=C(NCCc1cccnc1)NCCN1CC[C@H](O)C1	ZINC000875047957	CB	On-Demand	Anodyne	CCR3	15	42
O=C(NCCc1cccnc1)NCCN1CC[C@H](O)C1	ZINC000875047957	CB	On-Demand	Anodyne	CHRNA7	52	42
O=C(NCCc1cccnc1)NCCN1CC[C@H](O)C1	ZINC000875047957	CB	On-Demand	Anodyne	ACHP_LYMST	27	42
O=C(NCCc1cccnc1)NCCN1CC[C@H](O)C1	ZINC000875047957	CB	On-Demand	Anodyne	NAMPT	44	47
O=C(NCCNC(=O)N1CCC2(CCNC2=O)CC1)c1ccccc1Cl	ZINC000875047959	GD	On-Demand	Anodyne	ECR	48	39
CCC1(CC)CCCN1C(=O)NC1CCN(S(=O)(=O)CC)CC1	ZINC000875047962	EE	On-Demand	Anodyne	EPHX2	17	42
O=C(NCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)c1ccco1	ZINC000875047963	FD	On-Demand	Anodyne	TMPRSS11D	45	33
O=C(NCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)c1ccco1	ZINC000875047964	FD	On-Demand	Anodyne	TMPRSS11D	45	33
O=C(NCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)c1ccco1	ZINC000875047967	FD	On-Demand	Anodyne	TMPRSS11D	45	33
O=C(NCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)c1ccco1	ZINC000875047969	FD	On-Demand	Anodyne	TMPRSS11D	45	33
O=C(NCc1cccnc1N1CCOCC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875047979	FC	On-Demand	Anodyne	SCN10A	21	47
O=C(C1CC1)N1CCC(NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875047980	FE	On-Demand	Anodyne	PREP	42	39
O=C(C1CC1)N1CCC(NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875047980	FE	On-Demand	Anodyne	EPHX2	18	40
O=C(C1CC1)N1CCC(NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875047980	FE	On-Demand	Anodyne	SFRP1	63	36
O=C(C1CC1)N1CCC(NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875047980	FE	On-Demand	Anodyne	WNT3	69	36
O=C(C1CC1)N1CCC(NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875047981	FE	On-Demand	Anodyne	PREP	42	39
O=C(C1CC1)N1CCC(NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875047981	FE	On-Demand	Anodyne	EPHX2	18	40
O=C(C1CC1)N1CCC(NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875047981	FE	On-Demand	Anodyne	SFRP1	63	36
O=C(C1CC1)N1CCC(NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875047981	FE	On-Demand	Anodyne	WNT3	69	36
O=C(C1CC1)N1CCC(NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875047982	FE	On-Demand	Anodyne	PREP	42	39
O=C(C1CC1)N1CCC(NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875047982	FE	On-Demand	Anodyne	EPHX2	18	40
O=C(C1CC1)N1CCC(NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875047982	FE	On-Demand	Anodyne	SFRP1	63	36
O=C(C1CC1)N1CCC(NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875047982	FE	On-Demand	Anodyne	WNT3	69	36
O=C(C1CC1)N1CCC(NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875047983	FE	On-Demand	Anodyne	PREP	42	39
O=C(C1CC1)N1CCC(NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875047983	FE	On-Demand	Anodyne	EPHX2	18	40
O=C(C1CC1)N1CCC(NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875047983	FE	On-Demand	Anodyne	SFRP1	63	36
O=C(C1CC1)N1CCC(NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875047983	FE	On-Demand	Anodyne	WNT3	69	36
CCOC(=O)[C@H](C)C1CN(C(=O)NCCC(=O)NC(C)C)C1	ZINC000875047991	DC	On-Demand	Anodyne	NOD1	46	33
O=C1CCN(C(=O)NC2CCN(C(=O)c3ccoc3)CC2)CCCCCCN1	ZINC000875047992	GD	On-Demand	Anodyne	L3MBTL3	45	34
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2cccnc2N2CCOCC2)C1	ZINC000875048004	GC	On-Demand	Anodyne	SCN10A	19	43
CC(=O)[C@@H]1CCCN(C(=O)NCCNC(=O)c2ccccc2Cl)C1	ZINC000875048013	FE	On-Demand	Anodyne	SLC6A1	97	38
CC(=O)[C@@H]1CCCN(C(=O)NCCNC(=O)c2ccccc2Cl)C1	ZINC000875048013	FE	On-Demand	Anodyne	P2RX7	16	44
CC(=O)[C@@H]1CCCN(C(=O)NCCNC(=O)c2ccccc2Cl)C1	ZINC000875048013	FE	On-Demand	Anodyne	ECR	46	38
CC(=O)[C@@H]1CCCN(C(=O)NCCNC(=O)c2ccccc2Cl)C1	ZINC000875048013	FE	On-Demand	Anodyne	EPHX2	18	40
CC(=O)[C@@H]1CCCN(C(=O)NCCNC(=O)c2ccccc2Cl)C1	ZINC000875048013	FE	On-Demand	Anodyne	DPP7	51	40
CC(=O)[C@@H]1CCCN(C(=O)NCCNC(=O)c2ccccc2Cl)C1	ZINC000875048013	FE	On-Demand	Anodyne	HCN1	67	34
CC(=O)[C@@H]1CCCN(C(=O)NCCNC(=O)c2ccccc2Cl)C1	ZINC000875048013	FE	On-Demand	Anodyne	HCN4	52	34
CN1N=C(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)CCC1=O	ZINC000875048016	FF	On-Demand	Anodyne	SCD1	39	49
CN1N=C(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)CCC1=O	ZINC000875048016	FF	On-Demand	Anodyne	SCD	32	49
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1ccnc(Cl)c1	ZINC000875048018	FI	On-Demand	Anodyne	SCD1	49	60
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1ccnc(Cl)c1	ZINC000875048018	FI	On-Demand	Anodyne	SCD	41	60
CC(=O)[C@H]1CCCN(C(=O)NCCNC(=O)c2ccccc2Cl)C1	ZINC000875048021	FE	On-Demand	Anodyne	SLC6A1	97	38
CC(=O)[C@H]1CCCN(C(=O)NCCNC(=O)c2ccccc2Cl)C1	ZINC000875048021	FE	On-Demand	Anodyne	P2RX7	16	44
CC(=O)[C@H]1CCCN(C(=O)NCCNC(=O)c2ccccc2Cl)C1	ZINC000875048021	FE	On-Demand	Anodyne	ECR	46	38
CC(=O)[C@H]1CCCN(C(=O)NCCNC(=O)c2ccccc2Cl)C1	ZINC000875048021	FE	On-Demand	Anodyne	EPHX2	18	40
CC(=O)[C@H]1CCCN(C(=O)NCCNC(=O)c2ccccc2Cl)C1	ZINC000875048021	FE	On-Demand	Anodyne	DPP7	51	40
CC(=O)[C@H]1CCCN(C(=O)NCCNC(=O)c2ccccc2Cl)C1	ZINC000875048021	FE	On-Demand	Anodyne	HCN1	67	34
CC(=O)[C@H]1CCCN(C(=O)NCCNC(=O)c2ccccc2Cl)C1	ZINC000875048021	FE	On-Demand	Anodyne	HCN4	52	34
O=C(C1CC1)N1CCC(NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)CC1	ZINC000875048030	GF	On-Demand	Anodyne	EPHX2	25	41
O=C(C1CC1)N1CCC(NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)CC1	ZINC000875048030	GF	On-Demand	Anodyne	SFRP1	50	33
O=C(C1CC1)N1CCC(NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)CC1	ZINC000875048030	GF	On-Demand	Anodyne	WNT3	47	33
CN1CC[C@H]2CN(C(=O)NCCNC(=O)c3ccccc3Cl)CC[C@@H]21	ZINC000875048042	FD	On-Demand	Anodyne	ECR	40	36
CN1CC[C@H]2CN(C(=O)NCCNC(=O)c3ccccc3Cl)CC[C@@H]21	ZINC000875048042	FD	On-Demand	Anodyne	PLD1	39	43
CN1CC[C@H]2CN(C(=O)NCCNC(=O)c3ccccc3Cl)CC[C@@H]21	ZINC000875048042	FD	On-Demand	Anodyne	NR2E3	51	32
CN1CC[C@H]2CN(C(=O)NCCNC(=O)c3ccccc3Cl)CC[C@H]21	ZINC000875048050	FD	On-Demand	Anodyne	ECR	40	36
CN1CC[C@H]2CN(C(=O)NCCNC(=O)c3ccccc3Cl)CC[C@H]21	ZINC000875048050	FD	On-Demand	Anodyne	PLD1	39	43
CN1CC[C@H]2CN(C(=O)NCCNC(=O)c3ccccc3Cl)CC[C@H]21	ZINC000875048050	FD	On-Demand	Anodyne	NR2E3	51	32
C[C@H]1CCC[C@@H](C2CN(C(=O)NC3CCN(C(=O)c4ccoc4)CC3)C2)C1	ZINC000875048051	FG	On-Demand	Anodyne	L3MBTL3	55	35
O=C(NC1CCN(C(=O)C2CC2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875048053	FE	On-Demand	Anodyne	EPHX2	57	53
O=C(NC1CCN(C(=O)C2CC2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875048053	FE	On-Demand	Anodyne	SFRP1	61	35
O=C(NC1CCN(C(=O)C2CC2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875048053	FE	On-Demand	Anodyne	WNT3	63	35
O=C(NC1CCN(C(=O)c2ccoc2)CC1)N1CCC[C@](F)(c2ccccc2)C1	ZINC000875048055	GH	On-Demand	Anodyne	EPHX2	25	42
O=C(NC1CCN(C(=O)c2ccoc2)CC1)N1CCC[C@@](F)(c2ccccc2)C1	ZINC000875048056	GH	On-Demand	Anodyne	EPHX2	25	42
O=CN1CCCN(C(=O)NCCNC(=O)c2ccccc2Cl)CC1	ZINC000875048058	FC	On-Demand	Anodyne	ECR	41	37
O=C(NCCc1cccnc1)N[C@@H](CCO)c1cc(Cl)cc(Cl)c1	ZINC000875048065	FG	On-Demand	Anodyne	TBXAS1	41	41
O=C(NCCc1cccnc1)N[C@@H](CCO)c1cc(Cl)cc(Cl)c1	ZINC000875048065	FG	On-Demand	Anodyne	PTAFR	30	40
O=C(NCCc1cccnc1)N[C@@H](CCO)c1cc(Cl)cc(Cl)c1	ZINC000875048065	FG	On-Demand	Anodyne	NAMPT	29	40
O=C(NCCc1cccnc1)N[C@H](CCO)c1cc(Cl)cc(Cl)c1	ZINC000875048067	FG	On-Demand	Anodyne	TBXAS1	41	41
O=C(NCCc1cccnc1)N[C@H](CCO)c1cc(Cl)cc(Cl)c1	ZINC000875048067	FG	On-Demand	Anodyne	PTAFR	30	40
O=C(NCCc1cccnc1)N[C@H](CCO)c1cc(Cl)cc(Cl)c1	ZINC000875048067	FG	On-Demand	Anodyne	NAMPT	29	40
O=C(NCCc1cccnc1)NC1CN(c2ccncn2)C1	ZINC000875048069	CC	On-Demand	Anodyne	TBXAS1	40	40
O=C(NCCc1cccnc1)NC1CN(c2ccncn2)C1	ZINC000875048069	CC	On-Demand	Anodyne	PTAFR	35	40
O=C(NCCc1cccnc1)NC1CN(c2ccncn2)C1	ZINC000875048069	CC	On-Demand	Anodyne	CHRNA7	47	38
O=C(NCCc1cccnc1)NC1CN(c2ccncn2)C1	ZINC000875048069	CC	On-Demand	Anodyne	C3AR1	39	40
O=C(NCCc1cccnc1)NC1CN(c2ccncn2)C1	ZINC000875048069	CC	On-Demand	Anodyne	NAMPT	38	43
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1ccc(N2CCOCC2)nc1	ZINC000875048071	HG	On-Demand	Anodyne	ITK	17	43
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1ccc(N2CCOCC2)nc1	ZINC000875048071	HG	On-Demand	Anodyne	SCD1	43	54
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1ccc(N2CCOCC2)nc1	ZINC000875048071	HG	On-Demand	Anodyne	SCD	36	54
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1ccc(N2CCOCC2)nc1	ZINC000875048071	HG	On-Demand	Anodyne	DGAT1	25	44
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1ccc(N2CCOCC2)nc1	ZINC000875048071	HG	On-Demand	Anodyne	HPGDS	22	48
O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1ccc(N2CCOCC2)nc1	ZINC000875048071	HG	On-Demand	Anodyne	SLC27A1	43	37
O=C(NCCNC(=O)N1CCC[C@@](O)(c2ccccc2)C1)c1ccccc1	ZINC000875048081	FE	On-Demand	Anodyne	CCR1	18	41
O=C(NCCNC(=O)N1CCC[C@@](O)(c2ccccc2)C1)c1ccccc1	ZINC000875048081	FE	On-Demand	Anodyne	EPHX2	17	48
O=C(NCCNC(=O)N1CCC[C@@](O)(c2ccccc2)C1)c1ccccc1	ZINC000875048081	FE	On-Demand	Anodyne	DPP7	16	47
O=C(NCCc1cccnc1)N(CCO)CCOCCO	ZINC000875048082	CB	On-Demand	Anodyne	TBXAS1	30	40
O=C(NCCc1cccnc1)N(CCO)CCOCCO	ZINC000875048082	CB	On-Demand	Anodyne	PTAFR	27	40
O=C(NCCNC(=O)N1CCC[C@](O)(c2ccccc2)C1)c1ccccc1	ZINC000875048085	FE	On-Demand	Anodyne	CCR1	18	41
O=C(NCCNC(=O)N1CCC[C@](O)(c2ccccc2)C1)c1ccccc1	ZINC000875048085	FE	On-Demand	Anodyne	EPHX2	17	48
O=C(NCCNC(=O)N1CCC[C@](O)(c2ccccc2)C1)c1ccccc1	ZINC000875048085	FE	On-Demand	Anodyne	DPP7	16	47
O=C(NCCc1cccnc1)N(Cc1cccc(O)c1)[C@@H]1CC[C@@H](O)CC1	ZINC000875048095	FF	On-Demand	Anodyne	CHRNA7	43	37
Cc1ccc(CNC(=O)C(=O)N[C@@H](C)C2CN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000875048098	GE	On-Demand	Anodyne	CCR2	29	40
Cc1ccc(CNC(=O)C(=O)N[C@@H](C)C2CN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000875048098	GE	On-Demand	Anodyne	GPR119	18	40
Cc1ccc(CNC(=O)C(=O)N[C@H](C)C2CN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000875048101	GE	On-Demand	Anodyne	CCR2	29	40
Cc1ccc(CNC(=O)C(=O)N[C@H](C)C2CN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000875048101	GE	On-Demand	Anodyne	GPR119	18	40
C[C@@H]1CC(C)(C)C[C@](C)(NC(=O)NC2CCN(C(=O)C3CC3)CC2)C1	ZINC000875048113	EG	On-Demand	Anodyne	EPHX2	25	45
O=C(NCc1cccnc1N1CCOCC1)C(=O)N[C@H]1CC12CCC2	ZINC000875048116	EC	On-Demand	Anodyne	SCN10A	21	46
O=C(NCc1cccnc1N1CCOCC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875048118	EC	On-Demand	Anodyne	SCN10A	21	46
CN1CC[C@H]2CN(C(=O)C(=O)NCc3cccc(CN4CCCC4)c3)CC[C@@H]21	ZINC000875048131	GD	On-Demand	Anodyne	CHRM3	18	41
O=C(NCCNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1Cl	ZINC000875048132	GG	On-Demand	Anodyne	EPHX2	28	44
O=C(NCCNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1Cl	ZINC000875048132	GG	On-Demand	Anodyne	SCD1	19	44
O=C(NCCNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1Cl	ZINC000875048132	GG	On-Demand	Anodyne	SCD	18	43
O=C(NCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1Cl	ZINC000875048134	GG	On-Demand	Anodyne	EPHX2	28	44
O=C(NCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1Cl	ZINC000875048134	GG	On-Demand	Anodyne	SCD1	19	44
O=C(NCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1Cl	ZINC000875048134	GG	On-Demand	Anodyne	SCD	18	43
CO[C@H](CNC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1	ZINC000875048145	EC	On-Demand	Anodyne	EPHX2	19	43
O=C(NCCc1cccnc1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875048147	GG	On-Demand	Anodyne	CHRNA7	49	36
O=C(NCCc1cccnc1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875048147	GG	On-Demand	Anodyne	NAMPT	40	39
O=C(NCCc1cccnc1)N(C1CC1)C1CC1	ZINC000875048153	BD	On-Demand	Anodyne	FKBP1A	15	42
O=C(NCCc1cccnc1)N(C1CC1)C1CC1	ZINC000875048153	BD	On-Demand	Anodyne	TBXAS1	42	43
O=C(NCCc1cccnc1)N(C1CC1)C1CC1	ZINC000875048153	BD	On-Demand	Anodyne	PTAFR	28	43
O=C(NCCc1cccnc1)N(C1CC1)C1CC1	ZINC000875048153	BD	On-Demand	Anodyne	CHRNA7	49	38
O=C(NCCc1cccnc1)N(C1CC1)C1CC1	ZINC000875048153	BD	On-Demand	Anodyne	NAMPT	48	43
O=C(NCCc1cccnc1)N1CCCC(F)(F)CC1	ZINC000875048154	CE	On-Demand	Anodyne	CHRNA7	40	35
O=C(NCCc1cccnc1)N1CCCC(F)(F)CC1	ZINC000875048154	CE	On-Demand	Anodyne	C3AR1	38	44
O=C(NCCc1cccnc1)N1CCCC(F)(F)CC1	ZINC000875048154	CE	On-Demand	Anodyne	NAMPT	49	45
O=C(CCn1c(S)nnc1-c1cccs1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875048200	JJ	On-Demand	Anodyne	SCD1	33	42
O=C(CCn1c(S)nnc1-c1cccs1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875048200	JJ	On-Demand	Anodyne	SCD	28	42
O=C1CCN(C(=O)NCCNC(=O)c2ccccc2)CCCCCCN1	ZINC000875048212	FD	On-Demand	Anodyne	PLD2	52	34
O=C1CCN(C(=O)NCCNC(=O)c2ccccc2)CCCCCCN1	ZINC000875048212	FD	On-Demand	Anodyne	DPP7	34	50
CN1CC[C@H]2CN(C(=O)C(=O)NCc3cccc(CN4CCCC4)c3)CC[C@H]21	ZINC000875048214	GD	On-Demand	Anodyne	CHRM3	18	41
CN(C(=O)NCCc1cccnc1)[C@H]1C[C@@H](C(N)=O)C1	ZINC000875048225	CC	On-Demand	Anodyne	FKBP1A	15	40
CN(C(=O)NCCc1cccnc1)[C@H]1C[C@@H](C(N)=O)C1	ZINC000875048225	CC	On-Demand	Anodyne	NAMPT	36	40
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O	ZINC000875048226	EF	On-Demand	Anodyne	FKBP1A	36	49
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O	ZINC000875048226	EF	On-Demand	Anodyne	TBXAS1	21	41
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O	ZINC000875048226	EF	On-Demand	Anodyne	CHRNA7	50	37
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O	ZINC000875048226	EF	On-Demand	Anodyne	C3AR1	43	44
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O	ZINC000875048226	EF	On-Demand	Anodyne	NAMPT	44	45
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O	ZINC000875048227	EF	On-Demand	Anodyne	FKBP1A	36	49
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O	ZINC000875048227	EF	On-Demand	Anodyne	TBXAS1	21	41
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O	ZINC000875048227	EF	On-Demand	Anodyne	CHRNA7	50	37
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O	ZINC000875048227	EF	On-Demand	Anodyne	C3AR1	43	44
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O	ZINC000875048227	EF	On-Demand	Anodyne	NAMPT	44	45
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@H]1CCCC[C@H]1O	ZINC000875048228	EF	On-Demand	Anodyne	FKBP1A	36	49
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@H]1CCCC[C@H]1O	ZINC000875048228	EF	On-Demand	Anodyne	TBXAS1	21	41
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@H]1CCCC[C@H]1O	ZINC000875048228	EF	On-Demand	Anodyne	CHRNA7	50	37
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@H]1CCCC[C@H]1O	ZINC000875048228	EF	On-Demand	Anodyne	C3AR1	43	44
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@H]1CCCC[C@H]1O	ZINC000875048228	EF	On-Demand	Anodyne	NAMPT	44	45
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O	ZINC000875048229	EF	On-Demand	Anodyne	FKBP1A	36	49
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O	ZINC000875048229	EF	On-Demand	Anodyne	TBXAS1	21	41
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O	ZINC000875048229	EF	On-Demand	Anodyne	CHRNA7	50	37
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O	ZINC000875048229	EF	On-Demand	Anodyne	C3AR1	43	44
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O	ZINC000875048229	EF	On-Demand	Anodyne	NAMPT	44	45
CC[C@H](C[C@H](C)O)NC(=O)NCCc1cccnc1	ZINC000875048244	CD	On-Demand	Anodyne	PTAFR	32	40
CC[C@H](C[C@H](C)O)NC(=O)NCCc1cccnc1	ZINC000875048244	CD	On-Demand	Anodyne	KCNA5	16	44
CC[C@H](C[C@H](C)O)NC(=O)NCCc1cccnc1	ZINC000875048244	CD	On-Demand	Anodyne	NAMPT	34	42
O=C(NCCc1cccnc1)N1CCc2nc(C3CC3)ncc2C1	ZINC000875048247	DE	On-Demand	Anodyne	CHRNA7	46	34
O=C(NCCc1cccnc1)N[C@@H]1Cc2cncn2C1	ZINC000875048248	CC	On-Demand	Anodyne	CHRNA7	43	36
O=C(NCCc1cccnc1)N[C@@H]1Cc2cncn2C1	ZINC000875048248	CC	On-Demand	Anodyne	NAMPT	35	45
O=C(NCCc1cccnc1)N[C@H]1Cc2cncn2C1	ZINC000875048249	CC	On-Demand	Anodyne	CHRNA7	43	36
O=C(NCCc1cccnc1)N[C@H]1Cc2cncn2C1	ZINC000875048249	CC	On-Demand	Anodyne	NAMPT	35	45
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875048254	EF	On-Demand	Anodyne	FKBP1A	53	49
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875048254	EF	On-Demand	Anodyne	ADRB3	48	39
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875048254	EF	On-Demand	Anodyne	TBXAS1	31	40
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875048254	EF	On-Demand	Anodyne	KCNA5	19	41
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875048254	EF	On-Demand	Anodyne	CHRNA7	47	40
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875048254	EF	On-Demand	Anodyne	CPT1A	57	37
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875048254	EF	On-Demand	Anodyne	C3AR1	47	48
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875048254	EF	On-Demand	Anodyne	PREP	64	37
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875048254	EF	On-Demand	Anodyne	ACHP_LYMST	25	40
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875048254	EF	On-Demand	Anodyne	NAMPT	40	43
O=C(NCCc1cccnc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875048256	EF	On-Demand	Anodyne	FKBP1A	53	49
O=C(NCCc1cccnc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875048256	EF	On-Demand	Anodyne	ADRB3	48	39
O=C(NCCc1cccnc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875048256	EF	On-Demand	Anodyne	TBXAS1	31	40
O=C(NCCc1cccnc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875048256	EF	On-Demand	Anodyne	KCNA5	19	41
O=C(NCCc1cccnc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875048256	EF	On-Demand	Anodyne	CHRNA7	47	40
O=C(NCCc1cccnc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875048256	EF	On-Demand	Anodyne	CPT1A	57	37
O=C(NCCc1cccnc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875048256	EF	On-Demand	Anodyne	C3AR1	47	48
O=C(NCCc1cccnc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875048256	EF	On-Demand	Anodyne	PREP	64	37
O=C(NCCc1cccnc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875048256	EF	On-Demand	Anodyne	ACHP_LYMST	25	40
O=C(NCCc1cccnc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875048256	EF	On-Demand	Anodyne	NAMPT	40	43
O=C(NCCc1cccnc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875048258	EF	On-Demand	Anodyne	FKBP1A	53	49
O=C(NCCc1cccnc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875048258	EF	On-Demand	Anodyne	ADRB3	48	39
O=C(NCCc1cccnc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875048258	EF	On-Demand	Anodyne	TBXAS1	31	40
O=C(NCCc1cccnc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875048258	EF	On-Demand	Anodyne	KCNA5	19	41
O=C(NCCc1cccnc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875048258	EF	On-Demand	Anodyne	CHRNA7	47	40
O=C(NCCc1cccnc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875048258	EF	On-Demand	Anodyne	CPT1A	57	37
O=C(NCCc1cccnc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875048258	EF	On-Demand	Anodyne	C3AR1	47	48
O=C(NCCc1cccnc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875048258	EF	On-Demand	Anodyne	PREP	64	37
O=C(NCCc1cccnc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875048258	EF	On-Demand	Anodyne	ACHP_LYMST	25	40
O=C(NCCc1cccnc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875048258	EF	On-Demand	Anodyne	NAMPT	40	43
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875048259	EF	On-Demand	Anodyne	FKBP1A	53	49
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875048259	EF	On-Demand	Anodyne	ADRB3	48	39
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875048259	EF	On-Demand	Anodyne	TBXAS1	31	40
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875048259	EF	On-Demand	Anodyne	KCNA5	19	41
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875048259	EF	On-Demand	Anodyne	CHRNA7	47	40
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875048259	EF	On-Demand	Anodyne	CPT1A	57	37
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875048259	EF	On-Demand	Anodyne	C3AR1	47	48
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875048259	EF	On-Demand	Anodyne	PREP	64	37
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875048259	EF	On-Demand	Anodyne	ACHP_LYMST	25	40
O=C(NCCc1cccnc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875048259	EF	On-Demand	Anodyne	NAMPT	40	43
CC(=O)C1CCN(C(=O)C(=O)NCc2cccnc2N2CCOCC2)CC1	ZINC000875048268	FC	On-Demand	Anodyne	SCN10A	22	49
COCC(C)(C)CCNC(=O)C(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875048271	GE	On-Demand	Anodyne	DRD2	17	43
COCC(C)(C)CCNC(=O)C(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875048271	GE	On-Demand	Anodyne	DRD4	40	32
COCC(C)(C)CCNC(=O)C(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875048271	GE	On-Demand	Anodyne	HRH2	37	44
COCC(C)(C)CCNC(=O)C(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875048271	GE	On-Demand	Anodyne	CHRM3	17	43
CCOC(=O)[C@H](C)C1CN(C(=O)NCCNC(=O)c2ccccc2)C1	ZINC000875048273	ED	On-Demand	Anodyne	P2RY12	60	37
CCOC(=O)[C@H](C)C1CN(C(=O)NCCNC(=O)c2ccccc2)C1	ZINC000875048273	ED	On-Demand	Anodyne	DPP7	20	45
CCOC(=O)[C@H](C)C1CN(C(=O)NCCNC(=O)c2ccccc2)C1	ZINC000875048273	ED	On-Demand	Anodyne	CTRB_BOVIN	45	32
COc1ncccc1CNC(=O)C(=O)N1CCN(c2ccc(C#N)cc2)CC1	ZINC000875048290	GC	On-Demand	Mild	MAPKAPK2	18	40
O=C(NCCc1cccnc1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875048319	EE	On-Demand	Anodyne	TBXAS1	37	40
O=C(NCCc1cccnc1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875048319	EE	On-Demand	Anodyne	PTAFR	32	41
O=C(NCCc1cccnc1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875048319	EE	On-Demand	Anodyne	EPHX2	17	69
O=C(NCCc1cccnc1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875048319	EE	On-Demand	Anodyne	NAMPT	41	43
O=C(NCCc1cccnc1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875048321	EE	On-Demand	Anodyne	TBXAS1	37	40
O=C(NCCc1cccnc1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875048321	EE	On-Demand	Anodyne	PTAFR	32	41
O=C(NCCc1cccnc1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875048321	EE	On-Demand	Anodyne	EPHX2	17	69
O=C(NCCc1cccnc1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875048321	EE	On-Demand	Anodyne	NAMPT	41	43
O=C(NCCc1cccnc1)NC[C@H]1C[C@H](O)C1	ZINC000875048325	BC	On-Demand	Anodyne	TBXAS1	38	42
O=C(NCCc1cccnc1)NC[C@H]1C[C@H](O)C1	ZINC000875048325	BC	On-Demand	Anodyne	PTAFR	24	40
O=C(NCCc1cccnc1)NC[C@H]1C[C@H](O)C1	ZINC000875048325	BC	On-Demand	Anodyne	CHRNA7	45	38
O=C(NCCc1cccnc1)NC[C@H]1C[C@H](O)C1	ZINC000875048325	BC	On-Demand	Anodyne	NAMPT	42	46
O=C(NCCc1cccnc1)NC[C@@H]1C[C@H](O)C1	ZINC000875048326	BC	On-Demand	Anodyne	TBXAS1	38	42
O=C(NCCc1cccnc1)NC[C@@H]1C[C@H](O)C1	ZINC000875048326	BC	On-Demand	Anodyne	PTAFR	24	40
O=C(NCCc1cccnc1)NC[C@@H]1C[C@H](O)C1	ZINC000875048326	BC	On-Demand	Anodyne	CHRNA7	45	38
O=C(NCCc1cccnc1)NC[C@@H]1C[C@H](O)C1	ZINC000875048326	BC	On-Demand	Anodyne	NAMPT	42	46
O=C(NCCc1cccnc1)NCC1CC(O)C1	ZINC000875048328	BC	On-Demand	Anodyne	TBXAS1	38	42
O=C(NCCc1cccnc1)NCC1CC(O)C1	ZINC000875048328	BC	On-Demand	Anodyne	PTAFR	24	40
O=C(NCCc1cccnc1)NCC1CC(O)C1	ZINC000875048328	BC	On-Demand	Anodyne	CHRNA7	45	38
O=C(NCCc1cccnc1)NCC1CC(O)C1	ZINC000875048328	BC	On-Demand	Anodyne	NAMPT	42	46
CN(C(=O)c1cccs1)c1ccccc1C(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875048333	JK	On-Demand	Anodyne	SCD1	37	46
CN(C(=O)c1cccs1)c1ccccc1C(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875048333	JK	On-Demand	Anodyne	SCD	32	46
O=C(NCCNC(=O)c1ccccc1)NCC[C@H](O)C1CCCC1	ZINC000875048334	ED	On-Demand	Anodyne	EPHX2	15	55
O=C(NCCNC(=O)c1ccccc1)NCC[C@@H](O)C1CCCC1	ZINC000875048335	ED	On-Demand	Anodyne	EPHX2	15	55
O=C(NCc1cccc(CN2CCCC2)c1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875048336	GE	On-Demand	Anodyne	SIGMAR1	17	40
O=C(NCc1cccc(CN2CCCC2)c1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875048337	GE	On-Demand	Anodyne	SIGMAR1	17	40
O=C(NCc1cccc(CN2CCCC2)c1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875048339	GE	On-Demand	Anodyne	SIGMAR1	17	40
O=C(NCc1cccc(CN2CCCC2)c1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875048341	GE	On-Demand	Anodyne	SIGMAR1	17	40
N#Cc1cccc([C@H](NC(=O)NC2CCN(C(=O)C3CC3)CC2)C(F)(F)F)c1	ZINC000875048342	GF	On-Demand	Mild	EPHX2	35	48
N#Cc1cccc([C@H](NC(=O)NC2CCN(C(=O)C3CC3)CC2)C(F)(F)F)c1	ZINC000875048342	GF	On-Demand	Mild	MCHR1	17	41
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cc1	ZINC000875048343	JK	On-Demand	Anodyne	SCD1	48	57
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cc1	ZINC000875048343	JK	On-Demand	Anodyne	SCD	42	57
N#Cc1cccc([C@@H](NC(=O)NC2CCN(C(=O)C3CC3)CC2)C(F)(F)F)c1	ZINC000875048344	GF	On-Demand	Mild	EPHX2	35	48
N#Cc1cccc([C@@H](NC(=O)NC2CCN(C(=O)C3CC3)CC2)C(F)(F)F)c1	ZINC000875048344	GF	On-Demand	Mild	MCHR1	17	41
O=C(NCCc1cccnc1)N1CC2(CCCO2)C1	ZINC000875048378	CD	On-Demand	Anodyne	TBXAS1	34	40
O=C(NCCc1cccnc1)N1CC2(CCCO2)C1	ZINC000875048378	CD	On-Demand	Anodyne	NAMPT	44	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCNC(=O)c1ccccc1	ZINC000875048381	ED	On-Demand	Anodyne	SLC6A4	30	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCNC(=O)c1ccccc1	ZINC000875048381	ED	On-Demand	Anodyne	OPRM1	17	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCNC(=O)c1ccccc1	ZINC000875048381	ED	On-Demand	Anodyne	SLC6A3	57	47
COC(=O)C1=NO[C@@]2(CCN(C(=O)NCCc3cccnc3)C2)C1	ZINC000875048383	EC	On-Demand	Anodyne	CHRNA7	42	35
COC(=O)C1=NO[C@]2(CCN(C(=O)NCCc3cccnc3)C2)C1	ZINC000875048385	EC	On-Demand	Anodyne	CHRNA7	42	35
O=C(NCCc1cccnc1)N[C@H]1COC[C@H]1O	ZINC000875048387	CB	On-Demand	Anodyne	PTAFR	20	40
O=C(NCCc1cccnc1)N[C@H]1COC[C@H]1O	ZINC000875048387	CB	On-Demand	Anodyne	CHRNA7	45	38
O=C(NCCc1cccnc1)N[C@H]1COC[C@H]1O	ZINC000875048387	CB	On-Demand	Anodyne	NAMPT	41	45
COc1ccc(-c2nnc(S)n2CC(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cc1	ZINC000875048394	JI	On-Demand	Anodyne	SCD1	40	51
COc1ccc(-c2nnc(S)n2CC(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cc1	ZINC000875048394	JI	On-Demand	Anodyne	SCD	35	51
CC(=O)C1CCN(C(=O)NCCNC(=O)c2ccccc2Cl)CC1	ZINC000875048400	FE	On-Demand	Anodyne	HTR4	41	34
CC(=O)C1CCN(C(=O)NCCNC(=O)c2ccccc2Cl)CC1	ZINC000875048400	FE	On-Demand	Anodyne	P2RX7	19	46
CC(=O)C1CCN(C(=O)NCCNC(=O)c2ccccc2Cl)CC1	ZINC000875048400	FE	On-Demand	Anodyne	ECR	48	40
CC(=O)C1CCN(C(=O)NCCNC(=O)c2ccccc2Cl)CC1	ZINC000875048400	FE	On-Demand	Anodyne	EPHX2	28	44
CC(=O)C1CCN(C(=O)NCCNC(=O)c2ccccc2Cl)CC1	ZINC000875048400	FE	On-Demand	Anodyne	SCD	22	40
CC(=O)C1CCN(C(=O)NCCNC(=O)c2ccccc2Cl)CC1	ZINC000875048400	FE	On-Demand	Anodyne	HCN1	61	32
CC(=O)C1CCN(C(=O)NCCNC(=O)c2ccccc2Cl)CC1	ZINC000875048400	FE	On-Demand	Anodyne	HCN4	40	31
C=CC(C)(C)CCCNC(=O)C(=O)NCc1cccnc1N1CCOCC1	ZINC000875048406	FD	On-Demand	Mild	SCN10A	20	46
COCCN(CC1CCN(C)CC1)C(=O)NCCc1cccnc1	ZINC000875048412	ED	On-Demand	Anodyne	FKBP1A	19	41
COCCN(CC1CCN(C)CC1)C(=O)NCCc1cccnc1	ZINC000875048412	ED	On-Demand	Anodyne	CHRNA7	51	40
COCCN(CC1CCN(C)CC1)C(=O)NCCc1cccnc1	ZINC000875048412	ED	On-Demand	Anodyne	NAMPT	38	40
O=C(NCc1cccc(CN2CCCC2)c1)C(=O)N[C@H]1CC12CCC2	ZINC000875048420	ED	On-Demand	Anodyne	HRH2	31	43
O=C(NCc1cccc(CN2CCCC2)c1)C(=O)N[C@H]1CC12CCC2	ZINC000875048420	ED	On-Demand	Anodyne	SIGMAR1	22	40
O=C(NCc1cccc(CN2CCCC2)c1)C(=O)N[C@H]1CC12CCC2	ZINC000875048420	ED	On-Demand	Anodyne	MCHR2	42	34
CCCCCCCNC(=O)C(=O)NCc1cccnc1OC	ZINC000875048421	DD	On-Demand	Mild	FAAH	23	43
CCCCCCCNC(=O)C(=O)NCc1cccnc1OC	ZINC000875048421	DD	On-Demand	Mild	ASAH1	80	33
O=C(NCc1cccc(CN2CCCC2)c1)C(=O)N[C@@H]1CC12CCC2	ZINC000875048423	ED	On-Demand	Anodyne	HRH2	31	43
O=C(NCc1cccc(CN2CCCC2)c1)C(=O)N[C@@H]1CC12CCC2	ZINC000875048423	ED	On-Demand	Anodyne	SIGMAR1	22	40
O=C(NCc1cccc(CN2CCCC2)c1)C(=O)N[C@@H]1CC12CCC2	ZINC000875048423	ED	On-Demand	Anodyne	MCHR2	42	34
O=C(NCCc1cccnc1)N1CCC[C@H](C2CCC2)CC1	ZINC000875048428	DG	On-Demand	Anodyne	FKBP1A	19	44
O=C(NCCc1cccnc1)N1CCC[C@H](C2CCC2)CC1	ZINC000875048428	DG	On-Demand	Anodyne	TBXAS1	30	40
O=C(NCCc1cccnc1)N1CCC[C@H](C2CCC2)CC1	ZINC000875048428	DG	On-Demand	Anodyne	CHRNA7	61	43
O=C(NCCc1cccnc1)N1CCC[C@H](C2CCC2)CC1	ZINC000875048428	DG	On-Demand	Anodyne	C3AR1	46	46
O=C(NCCc1cccnc1)N1CCC[C@H](C2CCC2)CC1	ZINC000875048428	DG	On-Demand	Anodyne	ACHP_LYMST	29	44
O=C(NCCc1cccnc1)N1CCC[C@H](C2CCC2)CC1	ZINC000875048428	DG	On-Demand	Anodyne	NAMPT	60	50
O=C(NCCc1cccnc1)N1CCC[C@@H](C2CCC2)CC1	ZINC000875048431	DG	On-Demand	Anodyne	FKBP1A	19	44
O=C(NCCc1cccnc1)N1CCC[C@@H](C2CCC2)CC1	ZINC000875048431	DG	On-Demand	Anodyne	TBXAS1	30	40
O=C(NCCc1cccnc1)N1CCC[C@@H](C2CCC2)CC1	ZINC000875048431	DG	On-Demand	Anodyne	CHRNA7	61	43
O=C(NCCc1cccnc1)N1CCC[C@@H](C2CCC2)CC1	ZINC000875048431	DG	On-Demand	Anodyne	C3AR1	46	46
O=C(NCCc1cccnc1)N1CCC[C@@H](C2CCC2)CC1	ZINC000875048431	DG	On-Demand	Anodyne	ACHP_LYMST	29	44
O=C(NCCc1cccnc1)N1CCC[C@@H](C2CCC2)CC1	ZINC000875048431	DG	On-Demand	Anodyne	NAMPT	60	50
COC(=O)N(C)NC(=O)NCCNC(=O)c1ccc(Cl)cc1	ZINC000875048446	EC	On-Demand	Reactive	ECR	36	40
COC(=O)N(C)NC(=O)NCCNC(=O)c1ccc(Cl)cc1	ZINC000875048446	EC	On-Demand	Reactive	UTS2	47	37
COC(=O)N(C)NC(=O)NCCNC(=O)c1ccc(Cl)cc1	ZINC000875048446	EC	On-Demand	Reactive	E3UJZ5_SPOLI	33	40
O=C(NCCCCC1CC1)C(=O)NCc1cccnc1N1CCOCC1	ZINC000875048449	FD	On-Demand	Anodyne	SCN10A	21	48
O=C(NC1CCN(C(=O)c2ccoc2)CC1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875048461	GG	On-Demand	Anodyne	EPHX2	35	40
O=C(CC/N=C1/NS(=O)(=O)c2ccccc21)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875048465	JG	On-Demand	Mild	SCD1	33	41
O=C(CC/N=C1/NS(=O)(=O)c2ccccc21)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875048465	JG	On-Demand	Mild	SCD	28	41
CN(C)C[C@@H]1CN(C(=O)NCCc2cccnc2)C[C@H]1CN(C)C	ZINC000875048468	ED	On-Demand	Anodyne	TBXAS1	35	40
CN(C)C[C@@H]1CN(C(=O)NCCc2cccnc2)C[C@H]1CN(C)C	ZINC000875048468	ED	On-Demand	Anodyne	CHRNA7	46	39
CN(C)C[C@@H]1CN(C(=O)NCCc2cccnc2)C[C@H]1CN(C)C	ZINC000875048468	ED	On-Demand	Anodyne	NAMPT	50	41
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2cccnc2OCC(F)(F)F)C1	ZINC000875048477	GD	On-Demand	Anodyne	TRPV1	53	35
CONC(=O)C1CCN(C(=O)NCCNC(=O)c2ccccc2Cl)CC1	ZINC000875048482	GD	On-Demand	Anodyne	ECR	42	36
CONC(=O)C1CCN(C(=O)NCCNC(=O)c2ccccc2Cl)CC1	ZINC000875048482	GD	On-Demand	Anodyne	EPHX2	33	49
COCC(C)(C)CCNC(=O)C(=O)NCc1cccnc1N1CCOCC1	ZINC000875048491	GC	On-Demand	Anodyne	SCN10A	24	48
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2cccc(CN3CCOCC3)c2)C1	ZINC000875048496	GD	On-Demand	Anodyne	CHRM3	15	42
CC[C@@H](NC(=O)NC1CCN(S(=O)(=O)CC)CC1)[C@H](O)c1ccccc1	ZINC000875048499	GD	On-Demand	Anodyne	CCR5	31	42
CC[C@@H](NC(=O)NC1CCN(S(=O)(=O)CC)CC1)[C@H](O)c1ccccc1	ZINC000875048499	GD	On-Demand	Anodyne	EPHX2	40	47
CC[C@@H](NC(=O)NC1CCN(S(=O)(=O)CC)CC1)[C@H](O)c1ccccc1	ZINC000875048499	GD	On-Demand	Anodyne	XIAP	47	37
CC[C@@H](NC(=O)NC1CCN(S(=O)(=O)CC)CC1)[C@@H](O)c1ccccc1	ZINC000875048502	GD	On-Demand	Anodyne	CCR5	31	42
CC[C@@H](NC(=O)NC1CCN(S(=O)(=O)CC)CC1)[C@@H](O)c1ccccc1	ZINC000875048502	GD	On-Demand	Anodyne	EPHX2	40	47
CC[C@@H](NC(=O)NC1CCN(S(=O)(=O)CC)CC1)[C@@H](O)c1ccccc1	ZINC000875048502	GD	On-Demand	Anodyne	XIAP	47	37
CCN(CC)Cc1cccc(CNC(=O)C(=O)NCc2ncc(Cl)s2)c1	ZINC000875048503	GF	On-Demand	Anodyne	CCR4	40	35
NC(=O)C[C@H](NC(=O)c1ccccc1Cl)C(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875048504	JG	On-Demand	Anodyne	SCD1	38	45
NC(=O)C[C@H](NC(=O)c1ccccc1Cl)C(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875048504	JG	On-Demand	Anodyne	SCD	31	45
NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875048506	JG	On-Demand	Anodyne	SCD1	38	45
NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875048506	JG	On-Demand	Anodyne	SCD	31	45
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1cccnc1N1CCOCC1	ZINC000875048508	FC	On-Demand	Mild	SCN10A	20	45
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1cccnc1N1CCOCC1	ZINC000875048509	FC	On-Demand	Mild	SCN10A	20	45
CC[C@@H](NC(=O)NC1CCN(C(=O)c2ccoc2)CC1)[C@@H](O)c1ccccc1	ZINC000875048538	GF	On-Demand	Anodyne	EPHX2	27	41
CC[C@@H](NC(=O)NC1CCN(C(=O)c2ccoc2)CC1)[C@H](O)c1ccccc1	ZINC000875048545	GF	On-Demand	Anodyne	EPHX2	27	41
O=C(NCC[C@H]1CCSC1)C(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875048546	GE	On-Demand	Anodyne	ACHE	30	43
O=C(NCC[C@H]1CCSC1)C(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875048546	GE	On-Demand	Anodyne	HRH2	31	41
O=C(NCC[C@H]1CCSC1)C(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875048546	GE	On-Demand	Anodyne	SIGMAR1	18	41
O=C(NCC[C@@H]1CCSC1)C(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875048547	GE	On-Demand	Anodyne	ACHE	30	43
O=C(NCC[C@@H]1CCSC1)C(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875048547	GE	On-Demand	Anodyne	HRH2	31	41
O=C(NCC[C@@H]1CCSC1)C(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875048547	GE	On-Demand	Anodyne	SIGMAR1	18	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2cccc(CN3CCOCC3)c2)C1	ZINC000875048576	GC	On-Demand	Anodyne	CHRM3	16	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2cccc(CN3CCOCC3)c2)C1	ZINC000875048579	GC	On-Demand	Anodyne	CHRM3	16	43
CC1(C)CCC[C@](O)(CNC(=O)NCCc2cccnc2)CC1	ZINC000875048580	DF	On-Demand	Anodyne	PTAFR	30	40
CC1(C)CCC[C@](O)(CNC(=O)NCCc2cccnc2)CC1	ZINC000875048580	DF	On-Demand	Anodyne	C3AR1	36	40
CC1(C)CCC[C@](O)(CNC(=O)NCCc2cccnc2)CC1	ZINC000875048580	DF	On-Demand	Anodyne	NAMPT	38	44
CC1(C)CCC[C@@](O)(CNC(=O)NCCc2cccnc2)CC1	ZINC000875048583	DF	On-Demand	Anodyne	PTAFR	30	40
CC1(C)CCC[C@@](O)(CNC(=O)NCCc2cccnc2)CC1	ZINC000875048583	DF	On-Demand	Anodyne	C3AR1	36	40
CC1(C)CCC[C@@](O)(CNC(=O)NCCc2cccnc2)CC1	ZINC000875048583	DF	On-Demand	Anodyne	NAMPT	38	44
O=C(NCCNC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1ccco1	ZINC000875048594	ED	On-Demand	Anodyne	RBP4	21	43
O=C(NCCc1cccnc1)NC1CC(Nc2ccccc2)C1	ZINC000875048596	DF	On-Demand	Anodyne	TBXAS1	39	44
O=C(NCCc1cccnc1)NC1CC(Nc2ccccc2)C1	ZINC000875048596	DF	On-Demand	Anodyne	PTAFR	27	42
O=C(NCCc1cccnc1)NC1CC(Nc2ccccc2)C1	ZINC000875048596	DF	On-Demand	Anodyne	CHRNA7	48	44
O=C(NCCc1cccnc1)NC1CC(Nc2ccccc2)C1	ZINC000875048596	DF	On-Demand	Anodyne	C3AR1	39	40
O=C(NCCc1cccnc1)NC1CC(Nc2ccccc2)C1	ZINC000875048596	DF	On-Demand	Anodyne	ACHP_LYMST	24	44
O=C(NCCc1cccnc1)NC1CC(Nc2ccccc2)C1	ZINC000875048596	DF	On-Demand	Anodyne	NAMPT	49	45
O=C(NCCNC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1ccco1	ZINC000875048597	ED	On-Demand	Anodyne	RBP4	21	43
COC(=O)C1(O)CN(C(=O)NCCc2cccnc2)C1	ZINC000875048610	CB	On-Demand	Anodyne	TBXAS1	38	40
COC(=O)C1(O)CN(C(=O)NCCc2cccnc2)C1	ZINC000875048610	CB	On-Demand	Anodyne	PTAFR	41	42
COC(=O)C1(O)CN(C(=O)NCCc2cccnc2)C1	ZINC000875048610	CB	On-Demand	Anodyne	CHRNA7	48	38
COC(=O)C1(O)CN(C(=O)NCCc2cccnc2)C1	ZINC000875048610	CB	On-Demand	Anodyne	NAMPT	45	42
COC(=O)N(C)NC(=O)NCc1cc(OC)ccc1OC	ZINC000875048625	CD	On-Demand	Reactive	MTNR1A	85	40
COC(=O)N(C)NC(=O)NCc1cc(OC)ccc1OC	ZINC000875048625	CD	On-Demand	Reactive	MTNR1B	70	48
COC(=O)N(C)NC(=O)NCc1cc(OC)ccc1OC	ZINC000875048625	CD	On-Demand	Reactive	MT-ND1	25	54
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cc(OC)ccc2OC)C1	ZINC000875048637	FE	On-Demand	Anodyne	MTNR1A	47	38
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cc(OC)ccc2OC)C1	ZINC000875048637	FE	On-Demand	Anodyne	MTNR1B	42	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCNC(=O)c1ccccc1Cl	ZINC000875048643	GD	On-Demand	Anodyne	SLC6A3	51	39
CN1CCCC[C@H](N(C)C(=O)NCCc2cccnc2)C1=O	ZINC000875048650	DD	On-Demand	Anodyne	FKBP1A	32	45
CN1CCCC[C@H](N(C)C(=O)NCCc2cccnc2)C1=O	ZINC000875048650	DD	On-Demand	Anodyne	CHRNA7	47	37
CN1CCCC[C@H](N(C)C(=O)NCCc2cccnc2)C1=O	ZINC000875048650	DD	On-Demand	Anodyne	C3AR1	40	40
CN1CCCC[C@H](N(C)C(=O)NCCc2cccnc2)C1=O	ZINC000875048650	DD	On-Demand	Anodyne	NAMPT	45	43
CN1CCCC[C@@H](N(C)C(=O)NCCc2cccnc2)C1=O	ZINC000875048653	DD	On-Demand	Anodyne	FKBP1A	32	45
CN1CCCC[C@@H](N(C)C(=O)NCCc2cccnc2)C1=O	ZINC000875048653	DD	On-Demand	Anodyne	CHRNA7	47	37
CN1CCCC[C@@H](N(C)C(=O)NCCc2cccnc2)C1=O	ZINC000875048653	DD	On-Demand	Anodyne	C3AR1	40	40
CN1CCCC[C@@H](N(C)C(=O)NCCc2cccnc2)C1=O	ZINC000875048653	DD	On-Demand	Anodyne	NAMPT	45	43
O=C(NCCc1cccnc1)N1CCO[C@@H](C(F)F)CC1	ZINC000875048656	CD	On-Demand	Anodyne	CHRNA7	45	36
O=C(NCCc1cccnc1)N1CCO[C@@H](C(F)F)CC1	ZINC000875048656	CD	On-Demand	Anodyne	C3AR1	43	42
O=C(NCCc1cccnc1)N1CCO[C@@H](C(F)F)CC1	ZINC000875048656	CD	On-Demand	Anodyne	NAMPT	44	39
O=C(NCCc1cccnc1)N1CCO[C@H](C(F)F)CC1	ZINC000875048658	CD	On-Demand	Anodyne	CHRNA7	45	36
O=C(NCCc1cccnc1)N1CCO[C@H](C(F)F)CC1	ZINC000875048658	CD	On-Demand	Anodyne	C3AR1	43	42
O=C(NCCc1cccnc1)N1CCO[C@H](C(F)F)CC1	ZINC000875048658	CD	On-Demand	Anodyne	NAMPT	44	39
C[C@@H](NC(=O)NCCc1cccnc1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875048661	EE	On-Demand	Anodyne	NAMPT	29	40
O=C(NCCc1cccnc1)NCC[C@H](O)C(F)F	ZINC000875048667	CC	On-Demand	Anodyne	TBXAS1	42	43
O=C(NCCc1cccnc1)NCC[C@H](O)C(F)F	ZINC000875048667	CC	On-Demand	Anodyne	PTAFR	34	43
O=C(NCCc1cccnc1)NCC[C@H](O)C(F)F	ZINC000875048667	CC	On-Demand	Anodyne	NAMPT	38	44
O=C(NCCc1cccnc1)NCC[C@@H](O)C(F)F	ZINC000875048669	CC	On-Demand	Anodyne	TBXAS1	42	43
O=C(NCCc1cccnc1)NCC[C@@H](O)C(F)F	ZINC000875048669	CC	On-Demand	Anodyne	PTAFR	34	43
O=C(NCCc1cccnc1)NCC[C@@H](O)C(F)F	ZINC000875048669	CC	On-Demand	Anodyne	NAMPT	38	44
CN1CC[C@H]2CN(C(=O)C(=O)NCc3cccnc3N3CCOCC3)CC[C@H]21	ZINC000875048670	GC	On-Demand	Anodyne	SCN10A	20	45
CN1CC[C@H]2CN(C(=O)C(=O)NCc3cccnc3N3CCOCC3)CC[C@@H]21	ZINC000875048673	GC	On-Demand	Anodyne	SCN10A	20	45
Cc1ccc(CNC(=O)C(=O)N2CCc3c(CC(N)=O)cccc3C2)c(C)c1	ZINC000875048689	GD	On-Demand	Anodyne	AVPR2	17	40
O=C(NCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)c1ccccc1	ZINC000875048691	FE	On-Demand	Anodyne	ACE	37	44
O=C(NCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)c1ccccc1	ZINC000875048691	FE	On-Demand	Anodyne	DPP4	15	50
O=C(NCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)c1ccccc1	ZINC000875048691	FE	On-Demand	Anodyne	PREP	51	46
O=C(NCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)c1ccccc1	ZINC000875048691	FE	On-Demand	Anodyne	TMPRSS11D	55	33
O=C(NCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)c1ccccc1	ZINC000875048692	FE	On-Demand	Anodyne	ACE	37	44
O=C(NCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)c1ccccc1	ZINC000875048692	FE	On-Demand	Anodyne	DPP4	15	50
O=C(NCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)c1ccccc1	ZINC000875048692	FE	On-Demand	Anodyne	PREP	51	46
O=C(NCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)c1ccccc1	ZINC000875048692	FE	On-Demand	Anodyne	TMPRSS11D	55	33
O=C(NNc1cccc(F)c1Cl)NC1CCN(C(=O)c2ccoc2)CC1	ZINC000875048693	GG	On-Demand	Reactive	EPHX2	22	42
O=C(NCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)c1ccccc1	ZINC000875048694	FE	On-Demand	Anodyne	ACE	37	44
O=C(NCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)c1ccccc1	ZINC000875048694	FE	On-Demand	Anodyne	DPP4	15	50
O=C(NCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)c1ccccc1	ZINC000875048694	FE	On-Demand	Anodyne	PREP	51	46
O=C(NCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)c1ccccc1	ZINC000875048694	FE	On-Demand	Anodyne	TMPRSS11D	55	33
Cn1cc(/C=C\C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)c(=O)n(C)c1=O	ZINC000875048696	HE	On-Demand	Anodyne	SCD1	37	47
Cn1cc(/C=C\C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)c(=O)n(C)c1=O	ZINC000875048696	HE	On-Demand	Anodyne	SCD	32	47
O=C(NCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)c1ccccc1	ZINC000875048697	FE	On-Demand	Anodyne	ACE	37	44
O=C(NCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)c1ccccc1	ZINC000875048697	FE	On-Demand	Anodyne	DPP4	15	50
O=C(NCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)c1ccccc1	ZINC000875048697	FE	On-Demand	Anodyne	PREP	51	46
O=C(NCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)c1ccccc1	ZINC000875048697	FE	On-Demand	Anodyne	TMPRSS11D	55	33
O=C(NCCNC(=O)c1ccccc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875048698	GD	On-Demand	Anodyne	CTSL	18	51
O=C(NCCNC(=O)c1ccccc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875048698	GD	On-Demand	Anodyne	CTRB1	17	40
O=C(NCCNC(=O)c1ccccc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875048698	GD	On-Demand	Anodyne	CTSV	38	51
O=C(NCCNC(=O)c1ccccc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875048698	GD	On-Demand	Anodyne	KCNK3	24	40
O=C(NCCNC(=O)c1ccccc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875048698	GD	On-Demand	Anodyne	PDS	40	37
Cn1cc(/C=C/C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)c(=O)n(C)c1=O	ZINC000875048699	HE	On-Demand	Anodyne	SCD1	37	47
Cn1cc(/C=C/C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)c(=O)n(C)c1=O	ZINC000875048699	HE	On-Demand	Anodyne	SCD	32	47
O=C(NCCNC(=O)c1ccccc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875048701	GD	On-Demand	Anodyne	CTSL	18	51
O=C(NCCNC(=O)c1ccccc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875048701	GD	On-Demand	Anodyne	CTRB1	17	40
O=C(NCCNC(=O)c1ccccc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875048701	GD	On-Demand	Anodyne	CTSV	38	51
O=C(NCCNC(=O)c1ccccc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875048701	GD	On-Demand	Anodyne	KCNK3	24	40
O=C(NCCNC(=O)c1ccccc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875048701	GD	On-Demand	Anodyne	PDS	40	37
Cc1ccc(CNC(=O)C(=O)NCc2cc(C(F)(F)F)cc(Cl)n2)c(C)c1	ZINC000875048702	GG	On-Demand	Anodyne	P2RX7	32	42
Cc1ccc(CNC(=O)C(=O)NCc2cc(C(F)(F)F)cc(Cl)n2)c(C)c1	ZINC000875048702	GG	On-Demand	Anodyne	CCR2	35	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCNC(=O)c1ccc(Cl)cc1	ZINC000875048703	GD	On-Demand	Anodyne	SLC6A4	30	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCNC(=O)c1ccc(Cl)cc1	ZINC000875048703	GD	On-Demand	Anodyne	SLC6A3	55	43
C[C@@]1(CO)CN(C(=O)NCCc2cccnc2)C[C@]1(C)CO	ZINC000875048730	DC	On-Demand	Anodyne	TBXAS1	57	43
C[C@@]1(CO)CN(C(=O)NCCc2cccnc2)C[C@]1(C)CO	ZINC000875048730	DC	On-Demand	Anodyne	PTAFR	41	44
C[C@@]1(CO)CN(C(=O)NCCc2cccnc2)C[C@]1(C)CO	ZINC000875048730	DC	On-Demand	Anodyne	CHRNA7	47	37
C[C@@]1(CO)CN(C(=O)NCCc2cccnc2)C[C@]1(C)CO	ZINC000875048730	DC	On-Demand	Anodyne	C3AR1	37	41
C[C@@]1(CO)CN(C(=O)NCCc2cccnc2)C[C@]1(C)CO	ZINC000875048730	DC	On-Demand	Anodyne	NAMPT	62	44
COc1ncccc1CNC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875048732	GE	On-Demand	Anodyne	C3AR1	38	41
COc1ncccc1CNC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875048735	GE	On-Demand	Anodyne	C3AR1	38	41
O=C(NCCc1cccnc1)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875048736	CD	On-Demand	Anodyne	FKBP1A	19	42
O=C(NCCc1cccnc1)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875048736	CD	On-Demand	Anodyne	TBXAS1	36	40
O=C(NCCc1cccnc1)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875048736	CD	On-Demand	Anodyne	CHRNA7	61	44
O=C(NCCc1cccnc1)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875048736	CD	On-Demand	Anodyne	ACHP_LYMST	29	46
O=C(NCCc1cccnc1)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875048736	CD	On-Demand	Anodyne	NAMPT	52	48
O=C(NCCc1cccnc1)N1O[C@H]2C=C[C@H]1CC2	ZINC000875048742	CD	On-Demand	Anodyne	CHRNA7	46	37
O=C(NCCc1cccnc1)N1O[C@H]2C=C[C@H]1CC2	ZINC000875048742	CD	On-Demand	Anodyne	NAMPT	42	42
CC[C@H](C[C@H](C)O)NC(=O)NCCNC(=O)c1ccc(Cl)cc1	ZINC000875048745	ED	On-Demand	Anodyne	UTS2	43	34
CC[C@@H](NC(=O)NCCNC(=O)c1ccccc1Cl)[C@@H](O)c1ccccc1	ZINC000875048746	GF	On-Demand	Anodyne	ECR	43	36
CC[C@@H](NC(=O)NCCNC(=O)c1ccccc1Cl)[C@H](O)c1ccccc1	ZINC000875048749	GF	On-Demand	Anodyne	ECR	43	36
O=C(NCCc1cccnc1)N1CC(Cc2cccs2)C1	ZINC000875048764	DF	On-Demand	Anodyne	CHRNA7	44	42
O=C(NCCc1cccnc1)N1CC(Cc2cccs2)C1	ZINC000875048764	DF	On-Demand	Anodyne	ACHP_LYMST	22	42
O=C(NCCNC(=O)N1CC(CNC(=O)C(F)(F)F)C1)c1ccccc1	ZINC000875048765	FC	On-Demand	Anodyne	CACNA1I	41	33
CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H]1CCCN2C(=O)NCCc1cccnc1	ZINC000875048777	FF	On-Demand	Anodyne	FKBP1A	44	50
CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H]1CCCN2C(=O)NCCc1cccnc1	ZINC000875048777	FF	On-Demand	Anodyne	CHRNA7	48	36
CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H]1CCCN2C(=O)NCCc1cccnc1	ZINC000875048777	FF	On-Demand	Anodyne	PREP	48	40
CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H]1CCCN2C(=O)NCCc1cccnc1	ZINC000875048777	FF	On-Demand	Anodyne	NAMPT	30	40
CC(C)(C)OC(=O)N1CC[C@@H]2[C@H]1CCCN2C(=O)NCCc1cccnc1	ZINC000875048780	FF	On-Demand	Anodyne	FKBP1A	44	50
CC(C)(C)OC(=O)N1CC[C@@H]2[C@H]1CCCN2C(=O)NCCc1cccnc1	ZINC000875048780	FF	On-Demand	Anodyne	CHRNA7	48	36
CC(C)(C)OC(=O)N1CC[C@@H]2[C@H]1CCCN2C(=O)NCCc1cccnc1	ZINC000875048780	FF	On-Demand	Anodyne	PREP	48	40
CC(C)(C)OC(=O)N1CC[C@@H]2[C@H]1CCCN2C(=O)NCCc1cccnc1	ZINC000875048780	FF	On-Demand	Anodyne	NAMPT	30	40
CC(C)(C)OC(=O)N1CC[C@H]2[C@@H]1CCCN2C(=O)NCCc1cccnc1	ZINC000875048782	FF	On-Demand	Anodyne	FKBP1A	44	50
CC(C)(C)OC(=O)N1CC[C@H]2[C@@H]1CCCN2C(=O)NCCc1cccnc1	ZINC000875048782	FF	On-Demand	Anodyne	CHRNA7	48	36
CC(C)(C)OC(=O)N1CC[C@H]2[C@@H]1CCCN2C(=O)NCCc1cccnc1	ZINC000875048782	FF	On-Demand	Anodyne	PREP	48	40
CC(C)(C)OC(=O)N1CC[C@H]2[C@@H]1CCCN2C(=O)NCCc1cccnc1	ZINC000875048782	FF	On-Demand	Anodyne	NAMPT	30	40
CC(C)(C)OC(=O)N1CC[C@H]2[C@H]1CCCN2C(=O)NCCc1cccnc1	ZINC000875048784	FF	On-Demand	Anodyne	FKBP1A	44	50
CC(C)(C)OC(=O)N1CC[C@H]2[C@H]1CCCN2C(=O)NCCc1cccnc1	ZINC000875048784	FF	On-Demand	Anodyne	CHRNA7	48	36
CC(C)(C)OC(=O)N1CC[C@H]2[C@H]1CCCN2C(=O)NCCc1cccnc1	ZINC000875048784	FF	On-Demand	Anodyne	PREP	48	40
CC(C)(C)OC(=O)N1CC[C@H]2[C@H]1CCCN2C(=O)NCCc1cccnc1	ZINC000875048784	FF	On-Demand	Anodyne	NAMPT	30	40
O=C(NCCc1cccnc1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875048785	EE	On-Demand	Anodyne	CHRNA7	40	36
O=C(NCCc1cccnc1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875048785	EE	On-Demand	Anodyne	NAMPT	43	39
O=C(NCCc1cccnc1)N1CC[C@@H](O)[C@H]1c1ccc(Br)cc1	ZINC000875048790	GF	On-Demand	Anodyne	FKBP1A	16	41
O=C(NCCc1cccnc1)N1CC[C@@H](O)[C@H]1c1ccc(Br)cc1	ZINC000875048790	GF	On-Demand	Anodyne	PTAFR	18	45
O=C(NCCc1cccnc1)N1CC[C@@H](O)[C@H]1c1ccc(Br)cc1	ZINC000875048790	GF	On-Demand	Anodyne	CHRNA7	53	44
O=C(NCCc1cccnc1)N1CC[C@@H](O)[C@H]1c1ccc(Br)cc1	ZINC000875048790	GF	On-Demand	Anodyne	ACHP_LYMST	24	44
O=C(NCCc1cccnc1)N1CC[C@@H](O)[C@H]1c1ccc(Br)cc1	ZINC000875048790	GF	On-Demand	Anodyne	NAMPT	49	40
O=C(NCCc1cccnc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875048791	EF	On-Demand	Anodyne	F2	35	42
O=C(NCCc1cccnc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875048791	EF	On-Demand	Anodyne	ACE	32	40
O=C(NCCc1cccnc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875048791	EF	On-Demand	Anodyne	FKBP1A	43	46
O=C(NCCc1cccnc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875048791	EF	On-Demand	Anodyne	ADRB3	51	40
O=C(NCCc1cccnc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875048791	EF	On-Demand	Anodyne	PTAFR	35	40
O=C(NCCc1cccnc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875048791	EF	On-Demand	Anodyne	KCNA5	20	41
O=C(NCCc1cccnc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875048791	EF	On-Demand	Anodyne	CHRNA7	48	41
O=C(NCCc1cccnc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875048791	EF	On-Demand	Anodyne	C3AR1	47	46
O=C(NCCc1cccnc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875048791	EF	On-Demand	Anodyne	PREP	72	39
O=C(NCCc1cccnc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875048791	EF	On-Demand	Anodyne	ACHP_LYMST	27	41
O=C(NCCc1cccnc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875048791	EF	On-Demand	Anodyne	NAMPT	36	41
O=C(NCCc1cccnc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875048792	EF	On-Demand	Anodyne	F2	35	42
O=C(NCCc1cccnc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875048792	EF	On-Demand	Anodyne	ACE	32	40
O=C(NCCc1cccnc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875048792	EF	On-Demand	Anodyne	FKBP1A	43	46
O=C(NCCc1cccnc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875048792	EF	On-Demand	Anodyne	ADRB3	51	40
O=C(NCCc1cccnc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875048792	EF	On-Demand	Anodyne	PTAFR	35	40
O=C(NCCc1cccnc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875048792	EF	On-Demand	Anodyne	KCNA5	20	41
O=C(NCCc1cccnc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875048792	EF	On-Demand	Anodyne	CHRNA7	48	41
O=C(NCCc1cccnc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875048792	EF	On-Demand	Anodyne	C3AR1	47	46
O=C(NCCc1cccnc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875048792	EF	On-Demand	Anodyne	PREP	72	39
O=C(NCCc1cccnc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875048792	EF	On-Demand	Anodyne	ACHP_LYMST	27	41
O=C(NCCc1cccnc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875048792	EF	On-Demand	Anodyne	NAMPT	36	41
O=C(NCCc1cccnc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875048793	EF	On-Demand	Anodyne	F2	35	42
O=C(NCCc1cccnc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875048793	EF	On-Demand	Anodyne	ACE	32	40
O=C(NCCc1cccnc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875048793	EF	On-Demand	Anodyne	FKBP1A	43	46
O=C(NCCc1cccnc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875048793	EF	On-Demand	Anodyne	ADRB3	51	40
O=C(NCCc1cccnc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875048793	EF	On-Demand	Anodyne	PTAFR	35	40
O=C(NCCc1cccnc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875048793	EF	On-Demand	Anodyne	KCNA5	20	41
O=C(NCCc1cccnc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875048793	EF	On-Demand	Anodyne	CHRNA7	48	41
O=C(NCCc1cccnc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875048793	EF	On-Demand	Anodyne	C3AR1	47	46
O=C(NCCc1cccnc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875048793	EF	On-Demand	Anodyne	PREP	72	39
O=C(NCCc1cccnc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875048793	EF	On-Demand	Anodyne	ACHP_LYMST	27	41
O=C(NCCc1cccnc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875048793	EF	On-Demand	Anodyne	NAMPT	36	41
O=C(NCCc1cccnc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875048794	EF	On-Demand	Anodyne	F2	35	42
O=C(NCCc1cccnc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875048794	EF	On-Demand	Anodyne	ACE	32	40
O=C(NCCc1cccnc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875048794	EF	On-Demand	Anodyne	FKBP1A	43	46
O=C(NCCc1cccnc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875048794	EF	On-Demand	Anodyne	ADRB3	51	40
O=C(NCCc1cccnc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875048794	EF	On-Demand	Anodyne	PTAFR	35	40
O=C(NCCc1cccnc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875048794	EF	On-Demand	Anodyne	KCNA5	20	41
O=C(NCCc1cccnc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875048794	EF	On-Demand	Anodyne	CHRNA7	48	41
O=C(NCCc1cccnc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875048794	EF	On-Demand	Anodyne	C3AR1	47	46
O=C(NCCc1cccnc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875048794	EF	On-Demand	Anodyne	PREP	72	39
O=C(NCCc1cccnc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875048794	EF	On-Demand	Anodyne	ACHP_LYMST	27	41
O=C(NCCc1cccnc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875048794	EF	On-Demand	Anodyne	NAMPT	36	41
Cc1ccc(CNC(=O)C(=O)N2CCn3c(nnc3-c3cn(C)cn3)C2)c(C)c1	ZINC000875048807	GC	On-Demand	Anodyne	P2RX7	24	41
Cc1ccc(CNC(=O)C(=O)N[C@H](C)c2ccc(C(F)(F)F)nc2)c(C)c1	ZINC000875048808	GG	On-Demand	Anodyne	TRPV1	97	37
Cc1ccc(CNC(=O)C(=O)N[C@H](C)c2ccc(C(F)(F)F)nc2)c(C)c1	ZINC000875048808	GG	On-Demand	Anodyne	CCR2	33	43
Cc1ccc(CNC(=O)C(=O)N[C@@H](C)c2ccc(C(F)(F)F)nc2)c(C)c1	ZINC000875048809	GG	On-Demand	Anodyne	TRPV1	97	37
Cc1ccc(CNC(=O)C(=O)N[C@@H](C)c2ccc(C(F)(F)F)nc2)c(C)c1	ZINC000875048809	GG	On-Demand	Anodyne	CCR2	33	43
O=C(NCCc1cccnc1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875048810	EE	On-Demand	Anodyne	TBXAS1	49	42
O=C(NCCc1cccnc1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875048810	EE	On-Demand	Anodyne	PTAFR	35	44
O=C(NCCc1cccnc1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875048810	EE	On-Demand	Anodyne	FAAH	26	51
O=C(NCCc1cccnc1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875048810	EE	On-Demand	Anodyne	NAMPT	50	41
C=CC(C)(C)CCCNC(=O)C(=O)NCc1cccc(CN2CCOCC2)c1	ZINC000875048814	GE	On-Demand	Mild	CHRM3	15	40
CCOc1ccccc1C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875048822	DG	On-Demand	Anodyne	HCN1	53	36
CCOc1ccccc1C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875048822	DG	On-Demand	Anodyne	HCN4	44	34
CCOc1ccccc1C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875048822	DG	On-Demand	Anodyne	KCNK3	56	51
CCOc1ccccc1C(=O)Oc1cc(OC)cc(OC)c1	ZINC000875048822	DG	On-Demand	Anodyne	KCNK9	42	51
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1cccnc1OCC	ZINC000875048829	EC	On-Demand	Mild	SCN10A	18	42
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1cccnc1OCC	ZINC000875048830	EC	On-Demand	Mild	SCN10A	18	42
CCOc1ccccc1Oc1ccc(CNC(=O)C(=O)N[C@@H]2CC23CCC3)cn1	ZINC000875048835	GF	On-Demand	Anodyne	HCN1	49	34
CCOc1ccccc1Oc1ccc(CNC(=O)C(=O)N[C@@H]2CC23CCC3)cn1	ZINC000875048835	GF	On-Demand	Anodyne	HCN4	43	34
CCOc1ccccc1Oc1ccc(CNC(=O)C(=O)N[C@H]2CC23CCC3)cn1	ZINC000875048837	GF	On-Demand	Anodyne	HCN1	49	34
CCOc1ccccc1Oc1ccc(CNC(=O)C(=O)N[C@H]2CC23CCC3)cn1	ZINC000875048837	GF	On-Demand	Anodyne	HCN4	43	34
O=C(NCc1cccnc1N1CCOCC1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875048841	GC	On-Demand	Anodyne	SCN10A	19	44
O=C(NCc1cccnc1N1CCOCC1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875048842	GC	On-Demand	Anodyne	SCN10A	19	44
O=C(NCc1cccnc1N1CCOCC1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875048844	GC	On-Demand	Anodyne	SCN10A	19	44
O=C(NCc1cccnc1N1CCOCC1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875048845	GC	On-Demand	Anodyne	SCN10A	19	44
O=C(NC1CCN(C(=O)c2ccoc2)CC1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875048848	FE	On-Demand	Anodyne	L3MBTL3	44	34
O=C(NC1CCN(C(=O)c2ccoc2)CC1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875048850	FE	On-Demand	Anodyne	L3MBTL3	44	34
O=C(NC1CCN(C(=O)c2ccoc2)CC1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875048851	FE	On-Demand	Anodyne	L3MBTL3	44	34
O=C(NC1CCN(C(=O)c2ccoc2)CC1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875048852	FE	On-Demand	Anodyne	L3MBTL3	44	34
O=C(NC1CCN(C(=O)C2CC2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875048855	FD	On-Demand	Anodyne	EPHX2	18	44
O=C(NC1CCN(C(=O)C2CC2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875048857	FD	On-Demand	Anodyne	EPHX2	18	44
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCN(C(=O)C3CC3)CC2)CC1	ZINC000875048863	GG	On-Demand	Anodyne	EPHX2	38	41
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCN(C(=O)C3CC3)CC2)CC1	ZINC000875048863	GG	On-Demand	Anodyne	RBP4	32	41
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCN(C(=O)C3CC3)CC2)CC1	ZINC000875048863	GG	On-Demand	Anodyne	SFRP1	41	32
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCN(C(=O)C3CC3)CC2)CC1	ZINC000875048863	GG	On-Demand	Anodyne	WNT3	40	32
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCN(C(=O)C3CC3)CC2)CC1	ZINC000875048864	GG	On-Demand	Anodyne	EPHX2	38	41
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCN(C(=O)C3CC3)CC2)CC1	ZINC000875048864	GG	On-Demand	Anodyne	RBP4	32	41
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCN(C(=O)C3CC3)CC2)CC1	ZINC000875048864	GG	On-Demand	Anodyne	SFRP1	41	32
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCN(C(=O)C3CC3)CC2)CC1	ZINC000875048864	GG	On-Demand	Anodyne	WNT3	40	32
CC[C@H](C[C@H](C)O)NC(=O)NCc1cc(OC)ccc1OC	ZINC000875048868	DE	On-Demand	Anodyne	MTNR1A	50	38
CC[C@H](C[C@H](C)O)NC(=O)NCc1cc(OC)ccc1OC	ZINC000875048868	DE	On-Demand	Anodyne	MTNR1B	42	44
O=C(NCCNC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1ccc(Cl)cc1	ZINC000875048885	GE	On-Demand	Anodyne	EPHX2	21	42
O=C(NCCNC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1ccc(Cl)cc1	ZINC000875048885	GE	On-Demand	Anodyne	CACNA1I	51	32
O=C(NCCNC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1ccc(Cl)cc1	ZINC000875048886	GE	On-Demand	Anodyne	EPHX2	21	42
O=C(NCCNC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1ccc(Cl)cc1	ZINC000875048886	GE	On-Demand	Anodyne	CACNA1I	51	32
O=C(NC1CCN(C(=O)c2ccoc2)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875048891	GF	On-Demand	Anodyne	EPHX2	25	42
O=C(NC1CCN(C(=O)c2ccoc2)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875048892	GF	On-Demand	Anodyne	EPHX2	25	42
O=C(NCCc1cccnc1)N1CC(Cc2ccccc2Br)C1	ZINC000875048894	FG	On-Demand	Anodyne	CHRNA7	48	39
Cc1nc(S)sc1CC(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875048906	GI	On-Demand	Anodyne	SCD1	36	46
Cc1nc(S)sc1CC(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875048906	GI	On-Demand	Anodyne	SCD	30	46
O=C(NCCc1cccnc1)N1Cc2cccc(O)c2C1	ZINC000875048909	CE	On-Demand	Clean	TBXAS1	38	42
O=C(NCCc1cccnc1)N1Cc2cccc(O)c2C1	ZINC000875048909	CE	On-Demand	Clean	PTAFR	30	41
O=C(NCCc1cccnc1)N1Cc2cccc(O)c2C1	ZINC000875048909	CE	On-Demand	Clean	NAMPT	60	41
O=C(NC1CCN(C(=O)c2ccoc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875048916	EE	On-Demand	Anodyne	EPHX2	25	40
O=C(NC1CCN(C(=O)c2ccoc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875048917	EE	On-Demand	Anodyne	EPHX2	25	40
O=C(NCCc1cccnc1)NCC[C@@H](O)COCc1ccccc1	ZINC000875048918	ED	On-Demand	Anodyne	TBXAS1	40	41
O=C(NCCc1cccnc1)NCC[C@@H](O)COCc1ccccc1	ZINC000875048918	ED	On-Demand	Anodyne	PTAFR	35	43
O=C(NCCc1cccnc1)NCC[C@@H](O)COCc1ccccc1	ZINC000875048918	ED	On-Demand	Anodyne	KCNA5	17	45
O=C(NCCc1cccnc1)NCC[C@@H](O)COCc1ccccc1	ZINC000875048918	ED	On-Demand	Anodyne	NAMPT	24	41
O=C(NC1CCN(C(=O)c2ccoc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875048920	EE	On-Demand	Anodyne	EPHX2	25	40
O=C(NC1CCN(C(=O)c2ccoc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875048921	EE	On-Demand	Anodyne	EPHX2	25	40
CN1CCO[C@H](CN(C)C(=O)NCCc2cccnc2)C1	ZINC000875048922	CC	On-Demand	Anodyne	CHRNA7	46	38
CN1CCO[C@H](CN(C)C(=O)NCCc2cccnc2)C1	ZINC000875048922	CC	On-Demand	Anodyne	NAMPT	37	42
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(C(=O)C2CC2)CC1	ZINC000875048929	DD	On-Demand	Anodyne	EPHX2	27	45
COc1ccccc1[C@H]1CCCN(C(=O)NCCNC(=O)c2ccco2)CC1	ZINC000875048932	GF	On-Demand	Anodyne	HTR1A	18	51
COc1ccccc1[C@H]1CCCN(C(=O)NCCNC(=O)c2ccco2)CC1	ZINC000875048932	GF	On-Demand	Anodyne	DRD2	29	51
COc1ccccc1[C@H]1CCCN(C(=O)NCCNC(=O)c2ccco2)CC1	ZINC000875048932	GF	On-Demand	Anodyne	DRD4	22	44
COc1ccccc1[C@H]1CCCN(C(=O)NCCNC(=O)c2ccco2)CC1	ZINC000875048932	GF	On-Demand	Anodyne	RBP4	26	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCCNC(=O)c2ccco2)CC1	ZINC000875048934	GF	On-Demand	Anodyne	HTR1A	18	51
COc1ccccc1[C@@H]1CCCN(C(=O)NCCNC(=O)c2ccco2)CC1	ZINC000875048934	GF	On-Demand	Anodyne	DRD2	29	51
COc1ccccc1[C@@H]1CCCN(C(=O)NCCNC(=O)c2ccco2)CC1	ZINC000875048934	GF	On-Demand	Anodyne	DRD4	22	44
COc1ccccc1[C@@H]1CCCN(C(=O)NCCNC(=O)c2ccco2)CC1	ZINC000875048934	GF	On-Demand	Anodyne	RBP4	26	42
O=C(NC1CCN(C(=O)c2ccoc2)CC1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875048939	GF	On-Demand	Anodyne	EPHX2	19	42
O=C(NC1CCN(C(=O)c2ccoc2)CC1)NC1([C@H]2CCCCO2)CCC1	ZINC000875048942	GF	On-Demand	Anodyne	EPHX2	19	42
O=C(NCCc1cccnc1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875048953	DF	On-Demand	Anodyne	CHRNA7	40	36
O=C(NCCc1cccnc1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875048953	DF	On-Demand	Anodyne	NAMPT	32	42
O=C(NCCc1cccnc1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875048958	EC	On-Demand	Anodyne	CHRNA7	40	34
O=C(NCCc1cccnc1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875048958	EC	On-Demand	Anodyne	NAMPT	40	39
O=C(NCCc1cccnc1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875048959	FF	On-Demand	Anodyne	TBXAS1	32	40
O=C(NCCc1cccnc1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875048959	FF	On-Demand	Anodyne	PTAFR	22	40
O=C(NCCc1cccnc1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875048959	FF	On-Demand	Anodyne	CHRNA7	46	39
O=C(NCCc1cccnc1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875048959	FF	On-Demand	Anodyne	NAMPT	40	39
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCCc1cccnc1	ZINC000875048969	CD	On-Demand	Anodyne	CHRNA7	44	36
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCCc1cccnc1	ZINC000875048969	CD	On-Demand	Anodyne	NAMPT	41	40
C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCCc1cccnc1	ZINC000875048971	CD	On-Demand	Anodyne	CHRNA7	44	36
C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCCc1cccnc1	ZINC000875048971	CD	On-Demand	Anodyne	NAMPT	41	40
C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)NCCc1cccnc1	ZINC000875048972	CD	On-Demand	Anodyne	CHRNA7	44	36
C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)NCCc1cccnc1	ZINC000875048972	CD	On-Demand	Anodyne	NAMPT	41	40
CC[C@@H]1COCCN1CCNC(=O)NCCc1cccnc1	ZINC000875048979	DD	On-Demand	Anodyne	CHRNA7	43	35
CC[C@@H]1COCCN1CCNC(=O)NCCc1cccnc1	ZINC000875048979	DD	On-Demand	Anodyne	NAMPT	41	43
O=C(NCCc1cccnc1)N1CC(c2ccccc2)C1	ZINC000875048980	CE	On-Demand	Anodyne	FKBP1A	19	40
O=C(NCCc1cccnc1)N1CC(c2ccccc2)C1	ZINC000875048980	CE	On-Demand	Anodyne	TBXAS1	54	46
O=C(NCCc1cccnc1)N1CC(c2ccccc2)C1	ZINC000875048980	CE	On-Demand	Anodyne	PTAFR	58	44
O=C(NCCc1cccnc1)N1CC(c2ccccc2)C1	ZINC000875048980	CE	On-Demand	Anodyne	KCNA5	16	42
O=C(NCCc1cccnc1)N1CC(c2ccccc2)C1	ZINC000875048980	CE	On-Demand	Anodyne	CHRNA7	53	40
O=C(NCCc1cccnc1)N1CC(c2ccccc2)C1	ZINC000875048980	CE	On-Demand	Anodyne	C3AR1	42	43
O=C(NCCc1cccnc1)N1CC(c2ccccc2)C1	ZINC000875048980	CE	On-Demand	Anodyne	EPHX2	15	53
O=C(NCCc1cccnc1)N1CC(c2ccccc2)C1	ZINC000875048980	CE	On-Demand	Anodyne	CYP2C9	15	40
O=C(NCCc1cccnc1)N1CC(c2ccccc2)C1	ZINC000875048980	CE	On-Demand	Anodyne	ACHP_LYMST	25	40
O=C(NCCc1cccnc1)N1CC(c2ccccc2)C1	ZINC000875048980	CE	On-Demand	Anodyne	NAMPT	81	44
CC(=O)C1CCN(C(=O)C(=O)NCc2cccnc2OC2CCCC2)CC1	ZINC000875048981	FD	On-Demand	Anodyne	EPHX2	17	40
N#Cc1ccccc1/C=C/C(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875048982	GJ	On-Demand	Mild	SCD1	36	45
N#Cc1ccccc1/C=C/C(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875048982	GJ	On-Demand	Mild	SCD	31	45
N#Cc1ccccc1/C=C\C(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875048983	GJ	On-Demand	Mild	SCD1	36	45
N#Cc1ccccc1/C=C\C(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875048983	GJ	On-Demand	Mild	SCD	31	45
CCC1(CC)CCCN1C(=O)NCCc1cccnc1	ZINC000875048984	CF	On-Demand	Anodyne	FKBP1A	15	42
CCC1(CC)CCCN1C(=O)NCCc1cccnc1	ZINC000875048984	CF	On-Demand	Anodyne	CHRNA7	43	35
CCC1(CC)CCCN1C(=O)NCCc1cccnc1	ZINC000875048984	CF	On-Demand	Anodyne	NAMPT	42	48
O=C(NC1CCN(C(=O)C2CC2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875048991	DD	On-Demand	Anodyne	EPHX2	25	43
O=C(NC1CCN(C(=O)C2CC2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875048994	DD	On-Demand	Anodyne	EPHX2	25	43
O=C(NC1CCN(C(=O)C2CC2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875048995	DD	On-Demand	Anodyne	EPHX2	25	43
O=C(NC1CCN(C(=O)C2CC2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875048996	DD	On-Demand	Anodyne	EPHX2	25	43
O=C(NCc1cccc(CN2CCCC2)c1)C(=O)NCc1ncc(Cl)s1	ZINC000875049001	GE	On-Demand	Anodyne	HRH2	33	45
O=C(NCc1cccc(CN2CCCC2)c1)C(=O)NCc1ncc(Cl)s1	ZINC000875049001	GE	On-Demand	Anodyne	CHRM3	15	43
O=C(NCc1cccc(CN2CCCC2)c1)C(=O)NCc1ncc(Cl)s1	ZINC000875049001	GE	On-Demand	Anodyne	SIGMAR1	25	42
O=C(NCc1cccc(CN2CCCC2)c1)C(=O)NCc1ncc(Cl)s1	ZINC000875049001	GE	On-Demand	Anodyne	CCR4	49	38
O=C(NCc1cccc(CN2CCCC2)c1)C(=O)NCc1ncc(Cl)s1	ZINC000875049001	GE	On-Demand	Anodyne	CXCR3	21	40
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(CN3CCCC3)c2)CC1	ZINC000875049009	FD	On-Demand	Anodyne	HRH2	33	42
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(CN3CCCC3)c2)CC1	ZINC000875049009	FD	On-Demand	Anodyne	CHRM3	22	44
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(CN3CCCC3)c2)CC1	ZINC000875049009	FD	On-Demand	Anodyne	HRH3	20	43
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(CN3CCCC3)c2)CC1	ZINC000875049009	FD	On-Demand	Anodyne	SIGMAR1	27	46
C#CC[C@@H](COC)NC(=O)C(=O)NCc1cccnc1N1CCOCC1	ZINC000875049010	FB	On-Demand	Mild	SCN10A	20	43
C#CC[C@H](COC)NC(=O)C(=O)NCc1cccnc1N1CCOCC1	ZINC000875049011	FB	On-Demand	Mild	SCN10A	20	43
C[C@H]1CCC[C@@H](C2CN(C(=O)NCCc3cccnc3)C2)C1	ZINC000875049035	DG	On-Demand	Anodyne	CHRNA7	49	38
C[C@H]1CCC[C@@H](C2CN(C(=O)NCCc3cccnc3)C2)C1	ZINC000875049035	DG	On-Demand	Anodyne	NAMPT	56	42
CCOc1cc(CNC(=O)C(=O)N2CCC(C(C)=O)CC2)ccc1OC(F)F	ZINC000875049040	GE	On-Demand	Anodyne	SSTR5	53	33
COC(=O)N(C)NC(=O)NCCc1cccnc1	ZINC000875049042	CC	On-Demand	Reactive	TBXAS1	40	40
COC(=O)N(C)NC(=O)NCCc1cccnc1	ZINC000875049042	CC	On-Demand	Reactive	PTAFR	35	42
COC(=O)N(C)NC(=O)NCCc1cccnc1	ZINC000875049042	CC	On-Demand	Reactive	KCNA5	18	44
COC(=O)N(C)NC(=O)NCCc1cccnc1	ZINC000875049042	CC	On-Demand	Reactive	NAMPT	37	44
COC(=O)c1cnc(C2CCN(C(=O)NCCc3cccnc3)CC2)s1	ZINC000875049057	FE	On-Demand	Anodyne	CHRNA7	51	38
COC(=O)c1cnc(C2CCN(C(=O)NCCc3cccnc3)CC2)s1	ZINC000875049057	FE	On-Demand	Anodyne	C3AR1	38	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccnc(OCc3ccccc3)c2)C1	ZINC000875049067	GE	On-Demand	Anodyne	PREP	52	38
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccnc(OCc3ccccc3)c2)C1	ZINC000875049069	GE	On-Demand	Anodyne	PREP	52	38
CC[C@@H](NC(=O)NCCc1cccnc1)[C@H](O)c1ccccc1	ZINC000875049072	DE	On-Demand	Anodyne	ADRB3	52	43
CC[C@@H](NC(=O)NCCc1cccnc1)[C@H](O)c1ccccc1	ZINC000875049072	DE	On-Demand	Anodyne	TBXAS1	44	44
CC[C@@H](NC(=O)NCCc1cccnc1)[C@H](O)c1ccccc1	ZINC000875049072	DE	On-Demand	Anodyne	PTAFR	39	43
CC[C@@H](NC(=O)NCCc1cccnc1)[C@H](O)c1ccccc1	ZINC000875049072	DE	On-Demand	Anodyne	KCNA5	23	49
CC[C@@H](NC(=O)NCCc1cccnc1)[C@H](O)c1ccccc1	ZINC000875049072	DE	On-Demand	Anodyne	NAMPT	32	40
CC[C@@H](NC(=O)NCCc1cccnc1)[C@@H](O)c1ccccc1	ZINC000875049075	DE	On-Demand	Anodyne	ADRB3	52	43
CC[C@@H](NC(=O)NCCc1cccnc1)[C@@H](O)c1ccccc1	ZINC000875049075	DE	On-Demand	Anodyne	TBXAS1	44	44
CC[C@@H](NC(=O)NCCc1cccnc1)[C@@H](O)c1ccccc1	ZINC000875049075	DE	On-Demand	Anodyne	PTAFR	39	43
CC[C@@H](NC(=O)NCCc1cccnc1)[C@@H](O)c1ccccc1	ZINC000875049075	DE	On-Demand	Anodyne	KCNA5	23	49
CC[C@@H](NC(=O)NCCc1cccnc1)[C@@H](O)c1ccccc1	ZINC000875049075	DE	On-Demand	Anodyne	NAMPT	32	40
O=C(NCCc1cccnc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875049092	EE	On-Demand	Anodyne	ADRB3	46	39
O=C(NCCc1cccnc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875049092	EE	On-Demand	Anodyne	TBXAS1	44	42
O=C(NCCc1cccnc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875049092	EE	On-Demand	Anodyne	PTAFR	21	45
O=C(NCCc1cccnc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875049092	EE	On-Demand	Anodyne	NAMPT	36	42
O=C(NCCc1cccnc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875049094	EE	On-Demand	Anodyne	ADRB3	46	39
O=C(NCCc1cccnc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875049094	EE	On-Demand	Anodyne	TBXAS1	44	42
O=C(NCCc1cccnc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875049094	EE	On-Demand	Anodyne	PTAFR	21	45
O=C(NCCc1cccnc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875049094	EE	On-Demand	Anodyne	NAMPT	36	42
O=C(NCCc1cccnc1)NCC[C@H](O)C1CCCC1	ZINC000875049097	CD	On-Demand	Anodyne	ADRB3	29	40
O=C(NCCc1cccnc1)NCC[C@H](O)C1CCCC1	ZINC000875049097	CD	On-Demand	Anodyne	TBXAS1	32	41
O=C(NCCc1cccnc1)NCC[C@H](O)C1CCCC1	ZINC000875049097	CD	On-Demand	Anodyne	PTAFR	34	40
O=C(NCCc1cccnc1)NCC[C@H](O)C1CCCC1	ZINC000875049097	CD	On-Demand	Anodyne	CHRNA7	43	36
O=C(NCCc1cccnc1)NCC[C@H](O)C1CCCC1	ZINC000875049097	CD	On-Demand	Anodyne	C3AR1	47	47
O=C(NCCc1cccnc1)NCC[C@H](O)C1CCCC1	ZINC000875049097	CD	On-Demand	Anodyne	NAMPT	39	46
O=C(NCCc1cccnc1)NCC[C@@H](O)C1CCCC1	ZINC000875049101	CD	On-Demand	Anodyne	ADRB3	29	40
O=C(NCCc1cccnc1)NCC[C@@H](O)C1CCCC1	ZINC000875049101	CD	On-Demand	Anodyne	TBXAS1	32	41
O=C(NCCc1cccnc1)NCC[C@@H](O)C1CCCC1	ZINC000875049101	CD	On-Demand	Anodyne	PTAFR	34	40
O=C(NCCc1cccnc1)NCC[C@@H](O)C1CCCC1	ZINC000875049101	CD	On-Demand	Anodyne	CHRNA7	43	36
O=C(NCCc1cccnc1)NCC[C@@H](O)C1CCCC1	ZINC000875049101	CD	On-Demand	Anodyne	C3AR1	47	47
O=C(NCCc1cccnc1)NCC[C@@H](O)C1CCCC1	ZINC000875049101	CD	On-Demand	Anodyne	NAMPT	39	46
CC(C)(C)OC(=O)NCCCC(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875049115	HI	On-Demand	Anodyne	SCD1	37	46
CC(C)(C)OC(=O)NCCCC(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875049115	HI	On-Demand	Anodyne	SCD	32	46
C[C@@H](NC(=O)NCCc1cccnc1)[C@@H](O)C(F)(F)F	ZINC000875049116	CD	On-Demand	Anodyne	TBXAS1	36	40
C[C@@H](NC(=O)NCCc1cccnc1)[C@@H](O)C(F)(F)F	ZINC000875049116	CD	On-Demand	Anodyne	PTAFR	35	44
C[C@@H](NC(=O)NCCc1cccnc1)[C@@H](O)C(F)(F)F	ZINC000875049116	CD	On-Demand	Anodyne	KCNA5	17	44
C[C@@H](NC(=O)NCCc1cccnc1)[C@@H](O)C(F)(F)F	ZINC000875049116	CD	On-Demand	Anodyne	NAMPT	34	42
C[C@@H](NC(=O)NCCc1cccnc1)[C@H](O)C(F)(F)F	ZINC000875049118	CD	On-Demand	Anodyne	TBXAS1	36	40
C[C@@H](NC(=O)NCCc1cccnc1)[C@H](O)C(F)(F)F	ZINC000875049118	CD	On-Demand	Anodyne	PTAFR	35	44
C[C@@H](NC(=O)NCCc1cccnc1)[C@H](O)C(F)(F)F	ZINC000875049118	CD	On-Demand	Anodyne	KCNA5	17	44
C[C@@H](NC(=O)NCCc1cccnc1)[C@H](O)C(F)(F)F	ZINC000875049118	CD	On-Demand	Anodyne	NAMPT	34	42
CC[C@@H]1COCCN1CCNC(=O)NC1CCN(C(=O)C2CC2)CC1	ZINC000875049139	FC	On-Demand	Anodyne	EPHX2	20	43
COc1ncccc1CNC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875049146	DC	On-Demand	Anodyne	MT-CYB	41	31
COc1ncccc1CNC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875049148	DC	On-Demand	Anodyne	MT-CYB	41	31
O=C(NCCC[C@H]1C=CCC1)C(=O)NCc1cccnc1N1CCOCC1	ZINC000875049151	FD	On-Demand	Anodyne	SCN10A	20	45
CC(C)(C)OC(=O)NCCC(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875049152	GH	On-Demand	Anodyne	SCD1	38	48
CC(C)(C)OC(=O)NCCC(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875049152	GH	On-Demand	Anodyne	SCD	33	48
O=C(NCCC[C@@H]1C=CCC1)C(=O)NCc1cccnc1N1CCOCC1	ZINC000875049153	FD	On-Demand	Anodyne	SCN10A	20	45
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccnc(OCC(F)(F)F)c2)C1	ZINC000875049157	GD	On-Demand	Anodyne	HCRTR1	19	42
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccnc(OCC(F)(F)F)c2)C1	ZINC000875049157	GD	On-Demand	Anodyne	HCRTR2	34	42
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(C(=O)C4CC4)CC3)C[C@@H]1C2	ZINC000875049166	ED	On-Demand	Anodyne	EPHX2	31	43
O=C(NC1CCN(C(=O)C2CC2)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875049181	FE	On-Demand	Anodyne	EPHX2	38	44
O=C(NC1CCN(C(=O)C2CC2)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875049181	FE	On-Demand	Anodyne	SFRP1	59	33
O=C(NC1CCN(C(=O)C2CC2)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875049181	FE	On-Demand	Anodyne	WNT3	62	33
O=C(NC1CCN(C(=O)C2CC2)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875049182	FE	On-Demand	Anodyne	EPHX2	38	44
O=C(NC1CCN(C(=O)C2CC2)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875049182	FE	On-Demand	Anodyne	SFRP1	59	33
O=C(NC1CCN(C(=O)C2CC2)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875049182	FE	On-Demand	Anodyne	WNT3	62	33
O=C(Nn1cnc2ccccc2c1=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875049196	ED	On-Demand	Anodyne	DRD4	34	40
O=C(Nn1cnc2ccccc2c1=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875049196	ED	On-Demand	Anodyne	ACHE	41	43
O=C(Nn1cnc2ccccc2c1=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875049196	ED	On-Demand	Anodyne	SIGMAR1	38	48
O=C(Nn1cnc2ccccc2c1=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875049197	ED	On-Demand	Anodyne	DRD4	34	40
O=C(Nn1cnc2ccccc2c1=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875049197	ED	On-Demand	Anodyne	ACHE	41	43
O=C(Nn1cnc2ccccc2c1=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875049197	ED	On-Demand	Anodyne	SIGMAR1	38	48
O=C1CCN(C(=O)NCCNC(=O)c2ccc(Cl)cc2)CCCCCCN1	ZINC000875049206	GE	On-Demand	Anodyne	PLD2	50	39
O=C1CCN(C(=O)NCCNC(=O)c2ccc(Cl)cc2)CCCCCCN1	ZINC000875049206	GE	On-Demand	Anodyne	CXCR3	15	40
C[C@@H](NC(=O)NC1CCN(C(=O)C2CC2)CC1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875049208	GD	On-Demand	Anodyne	EPHX2	20	40
C[C@H](NC(=O)NC1CCN(C(=O)C2CC2)CC1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875049209	GD	On-Demand	Anodyne	EPHX2	20	40
O=C(NCc1cccc(CN2CCCC2)c1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875049210	FE	On-Demand	Anodyne	HRH2	32	42
O=C(NCc1cccc(CN2CCCC2)c1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875049210	FE	On-Demand	Anodyne	CHRM3	18	40
O=C(NCc1cccc(CN2CCCC2)c1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875049210	FE	On-Demand	Anodyne	SIGMAR1	20	41
O=C(NCC[C@H]1CCSC1)C(=O)NCc1cccc(CN2CCOCC2)c1	ZINC000875049218	GD	On-Demand	Anodyne	ACHE	23	41
O=C(NCC[C@@H]1CCSC1)C(=O)NCc1cccc(CN2CCOCC2)c1	ZINC000875049219	GD	On-Demand	Anodyne	ACHE	23	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000875049222	FD	On-Demand	Anodyne	HRH2	33	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000875049222	FD	On-Demand	Anodyne	CHRM3	21	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000875049222	FD	On-Demand	Anodyne	HRH3	18	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000875049222	FD	On-Demand	Anodyne	SIGMAR1	23	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000875049222	FD	On-Demand	Anodyne	BDKRB1	42	38
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000875049223	FD	On-Demand	Anodyne	HRH2	33	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000875049223	FD	On-Demand	Anodyne	CHRM3	21	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000875049223	FD	On-Demand	Anodyne	HRH3	18	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000875049223	FD	On-Demand	Anodyne	SIGMAR1	23	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000875049223	FD	On-Demand	Anodyne	BDKRB1	42	38
O=C(NCCCN1CCN(c2ncccn2)CC1)N1Cc2cccc(O)c2C1	ZINC000875049226	GD	On-Demand	Clean	HTR1A	69	56
O=C(NCCCN1CCN(c2ncccn2)CC1)N1Cc2cccc(O)c2C1	ZINC000875049226	GD	On-Demand	Clean	DRD2	62	46
O=C(NCCCN1CCN(c2ncccn2)CC1)N1Cc2cccc(O)c2C1	ZINC000875049226	GD	On-Demand	Clean	DRD1	15	42
O=C(NCCCN1CCN(c2ncccn2)CC1)N1Cc2cccc(O)c2C1	ZINC000875049226	GD	On-Demand	Clean	DRD4	42	46
O=C(NCCCN1CCN(c2ncccn2)CC1)N1Cc2cccc(O)c2C1	ZINC000875049226	GD	On-Demand	Clean	ADRA1D	30	43
O=C(NCCCN1CCN(c2ncccn2)CC1)N1Cc2cccc(O)c2C1	ZINC000875049226	GD	On-Demand	Clean	HTR2A	47	46
O=C(NCCCN1CCN(c2ncccn2)CC1)N1Cc2cccc(O)c2C1	ZINC000875049226	GD	On-Demand	Clean	HTR2C	31	45
O=C(NCCCN1CCN(c2ncccn2)CC1)N1Cc2cccc(O)c2C1	ZINC000875049226	GD	On-Demand	Clean	ADRA1A	37	43
O=C(NCCCN1CCN(c2ncccn2)CC1)N1Cc2cccc(O)c2C1	ZINC000875049226	GD	On-Demand	Clean	ADRA1B	17	42
O=C(NCCCN1CCN(c2ncccn2)CC1)N1Cc2cccc(O)c2C1	ZINC000875049226	GD	On-Demand	Clean	DRD3	79	42
O=C(NCCCN1CCN(c2ncccn2)CC1)N1Cc2cccc(O)c2C1	ZINC000875049226	GD	On-Demand	Clean	HTR7	52	40
C=C1c2ccccc2C(=O)N1[C@H](C)C(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875049237	II	On-Demand	Anodyne	SCD1	35	44
C=C1c2ccccc2C(=O)N1[C@H](C)C(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875049237	II	On-Demand	Anodyne	SCD	30	44
C=C1c2ccccc2C(=O)N1[C@@H](C)C(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875049238	II	On-Demand	Anodyne	SCD1	35	44
C=C1c2ccccc2C(=O)N1[C@@H](C)C(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875049238	II	On-Demand	Anodyne	SCD	30	44
CC1(C)[C@@H](c2cccc(F)c2)CCN1C(=O)NCCc1cccnc1	ZINC000875049242	EH	On-Demand	Anodyne	PTAFR	25	42
CC1(C)[C@@H](c2cccc(F)c2)CCN1C(=O)NCCc1cccnc1	ZINC000875049242	EH	On-Demand	Anodyne	CHRNA7	48	44
CC1(C)[C@@H](c2cccc(F)c2)CCN1C(=O)NCCc1cccnc1	ZINC000875049242	EH	On-Demand	Anodyne	NAMPT	54	40
O=C(NCCc1cccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875049246	CD	On-Demand	Anodyne	TBXAS1	33	40
O=C(NCCc1cccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875049246	CD	On-Demand	Anodyne	CHRNA7	45	38
O=C(NCCc1cccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875049246	CD	On-Demand	Anodyne	NAMPT	38	45
O=C(NCCc1cccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875049247	CD	On-Demand	Anodyne	TBXAS1	33	40
O=C(NCCc1cccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875049247	CD	On-Demand	Anodyne	CHRNA7	45	38
O=C(NCCc1cccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875049247	CD	On-Demand	Anodyne	NAMPT	38	45
O=C(NCCc1cccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875049248	CD	On-Demand	Anodyne	TBXAS1	33	40
O=C(NCCc1cccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875049248	CD	On-Demand	Anodyne	CHRNA7	45	38
O=C(NCCc1cccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875049248	CD	On-Demand	Anodyne	NAMPT	38	45
O=C(NCCc1cccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875049249	CD	On-Demand	Anodyne	TBXAS1	33	40
O=C(NCCc1cccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875049249	CD	On-Demand	Anodyne	CHRNA7	45	38
O=C(NCCc1cccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875049249	CD	On-Demand	Anodyne	NAMPT	38	45
CC(C)(C)OC(=O)N1CC[C@@]2(NC(=O)NCCc3cccnc3)CCC[C@H]12	ZINC000875049251	FF	On-Demand	Anodyne	FKBP1A	21	42
CC(C)(C)OC(=O)N1CC[C@@]2(NC(=O)NCCc3cccnc3)CCC[C@H]12	ZINC000875049251	FF	On-Demand	Anodyne	NAMPT	33	41
CC(C)(C)OC(=O)N1CC[C@]2(NC(=O)NCCc3cccnc3)CCC[C@H]12	ZINC000875049252	FF	On-Demand	Anodyne	FKBP1A	21	42
CC(C)(C)OC(=O)N1CC[C@]2(NC(=O)NCCc3cccnc3)CCC[C@H]12	ZINC000875049252	FF	On-Demand	Anodyne	NAMPT	33	41
CC(C)(C)OC(=O)N1CC[C@]2(NC(=O)NCCc3cccnc3)CCC[C@@H]12	ZINC000875049253	FF	On-Demand	Anodyne	FKBP1A	21	42
CC(C)(C)OC(=O)N1CC[C@]2(NC(=O)NCCc3cccnc3)CCC[C@@H]12	ZINC000875049253	FF	On-Demand	Anodyne	NAMPT	33	41
CC(C)(C)OC(=O)N1CC[C@@]2(NC(=O)NCCc3cccnc3)CCC[C@@H]12	ZINC000875049254	FF	On-Demand	Anodyne	FKBP1A	21	42
CC(C)(C)OC(=O)N1CC[C@@]2(NC(=O)NCCc3cccnc3)CCC[C@@H]12	ZINC000875049254	FF	On-Demand	Anodyne	NAMPT	33	41
C[C@]1(C(F)(F)F)CCN(C(=O)NCCNC(=O)c2ccccc2Cl)C1	ZINC000875049256	GG	On-Demand	Anodyne	ECR	50	38
C[C@]1(C(F)(F)F)CCN(C(=O)NCCNC(=O)c2ccccc2Cl)C1	ZINC000875049256	GG	On-Demand	Anodyne	EPHX2	25	42
O=C(NCCc1cccnc1)N[C@H]1[C@@H]2c3ccc(Cl)cc3C[C@H]21	ZINC000875049263	EF	On-Demand	Anodyne	CHRNA7	40	41
O=C(NCCc1cccnc1)N[C@H]1[C@@H]2c3ccc(Cl)cc3C[C@H]21	ZINC000875049263	EF	On-Demand	Anodyne	NAMPT	24	40
O=C(NCCc1cccnc1)N[C@@H]1[C@H]2Cc3cc(Cl)ccc3[C@H]21	ZINC000875049264	EF	On-Demand	Anodyne	CHRNA7	40	41
O=C(NCCc1cccnc1)N[C@@H]1[C@H]2Cc3cc(Cl)ccc3[C@H]21	ZINC000875049264	EF	On-Demand	Anodyne	NAMPT	24	40
O=C(NCCc1cccnc1)N[C@@H]1[C@@H]2Cc3cc(Cl)ccc3[C@@H]21	ZINC000875049265	EF	On-Demand	Anodyne	CHRNA7	40	41
O=C(NCCc1cccnc1)N[C@@H]1[C@@H]2Cc3cc(Cl)ccc3[C@@H]21	ZINC000875049265	EF	On-Demand	Anodyne	NAMPT	24	40
O=C(NCCc1cccnc1)N[C@@H]1[C@H]2Cc3cc(Cl)ccc3[C@@H]21	ZINC000875049266	EF	On-Demand	Anodyne	CHRNA7	40	41
O=C(NCCc1cccnc1)N[C@@H]1[C@H]2Cc3cc(Cl)ccc3[C@@H]21	ZINC000875049266	EF	On-Demand	Anodyne	NAMPT	24	40
O=C(NCCc1cccnc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875049269	DD	On-Demand	Anodyne	FKBP1A	15	41
O=C(NCCc1cccnc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875049269	DD	On-Demand	Anodyne	CHRNA7	46	37
O=C(NCCc1cccnc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875049269	DD	On-Demand	Anodyne	C3AR1	41	41
O=C(NCCc1cccnc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875049269	DD	On-Demand	Anodyne	NAMPT	48	40
O=C(NCCc1cccnc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875049270	DD	On-Demand	Anodyne	FKBP1A	15	41
O=C(NCCc1cccnc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875049270	DD	On-Demand	Anodyne	CHRNA7	46	37
O=C(NCCc1cccnc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875049270	DD	On-Demand	Anodyne	C3AR1	41	41
O=C(NCCc1cccnc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875049270	DD	On-Demand	Anodyne	NAMPT	48	40
COc1ccccc1C[C@@](C)(CO)NC(=O)NCCc1cccnc1	ZINC000875049280	ED	On-Demand	Anodyne	PTAFR	28	43
COc1ccccc1C[C@](C)(CO)NC(=O)NCCc1cccnc1	ZINC000875049281	ED	On-Demand	Anodyne	PTAFR	28	43
O=C(NCCc1cccnc1)N1CCCC2(CC1)CC2	ZINC000875049282	CF	On-Demand	Anodyne	CHRNA7	40	34
O=C(NCCc1cccnc1)N1CCCC2(CC1)CC2	ZINC000875049282	CF	On-Demand	Anodyne	NAMPT	49	45
O=C(NCCc1cccnc1)N1CC(Cc2ccco2)C1	ZINC000875049285	CE	On-Demand	Anodyne	CHRNA7	44	37
O=C(NCCc1cccnc1)N1CC(Cc2ccco2)C1	ZINC000875049285	CE	On-Demand	Anodyne	NAMPT	40	41
CN1CCN(C(=O)NCCNC(=O)c2ccccc2Cl)CCC1(C)C	ZINC000875049287	FE	On-Demand	Anodyne	ECR	42	37
CN1CCN(C(=O)NCCNC(=O)c2ccccc2Cl)CCC1(C)C	ZINC000875049287	FE	On-Demand	Anodyne	SLC6A9	40	40
CN1CCN(C(=O)NCCNC(=O)c2ccccc2Cl)CCC1(C)C	ZINC000875049287	FE	On-Demand	Anodyne	HCN1	49	35
O=C(NCCc1cccnc1)N1CC=CC1	ZINC000875049288	BD	On-Demand	Anodyne	TBXAS1	50	44
O=C(NCCc1cccnc1)N1CC=CC1	ZINC000875049288	BD	On-Demand	Anodyne	PTAFR	42	44
O=C(NCCc1cccnc1)N1CC=CC1	ZINC000875049288	BD	On-Demand	Anodyne	CHRNA7	50	38
O=C(NCCc1cccnc1)N1CC=CC1	ZINC000875049288	BD	On-Demand	Anodyne	C3AR1	39	41
O=C(NCCc1cccnc1)N1CC=CC1	ZINC000875049288	BD	On-Demand	Anodyne	NAMPT	69	47
COc1ccccc1[C@@H]1CCCN(C(=O)NCCc2cccnc2)CC1	ZINC000875049291	FH	On-Demand	Anodyne	DRD2	15	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCCc2cccnc2)CC1	ZINC000875049291	FH	On-Demand	Anodyne	FKBP1A	29	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCCc2cccnc2)CC1	ZINC000875049291	FH	On-Demand	Anodyne	PTAFR	33	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCCc2cccnc2)CC1	ZINC000875049291	FH	On-Demand	Anodyne	CHRNA7	54	45
COc1ccccc1[C@@H]1CCCN(C(=O)NCCc2cccnc2)CC1	ZINC000875049291	FH	On-Demand	Anodyne	C3AR1	41	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCCc2cccnc2)CC1	ZINC000875049291	FH	On-Demand	Anodyne	NAMPT	40	41
COc1ccccc1[C@H]1CCCN(C(=O)NCCc2cccnc2)CC1	ZINC000875049292	FH	On-Demand	Anodyne	DRD2	15	41
COc1ccccc1[C@H]1CCCN(C(=O)NCCc2cccnc2)CC1	ZINC000875049292	FH	On-Demand	Anodyne	FKBP1A	29	41
COc1ccccc1[C@H]1CCCN(C(=O)NCCc2cccnc2)CC1	ZINC000875049292	FH	On-Demand	Anodyne	PTAFR	33	43
COc1ccccc1[C@H]1CCCN(C(=O)NCCc2cccnc2)CC1	ZINC000875049292	FH	On-Demand	Anodyne	CHRNA7	54	45
COc1ccccc1[C@H]1CCCN(C(=O)NCCc2cccnc2)CC1	ZINC000875049292	FH	On-Demand	Anodyne	C3AR1	41	42
COc1ccccc1[C@H]1CCCN(C(=O)NCCc2cccnc2)CC1	ZINC000875049292	FH	On-Demand	Anodyne	NAMPT	40	41
O=C(NCCc1cccnc1)N1C[C@@H]2CCC[C@]2(CO)C1	ZINC000875049306	CD	On-Demand	Anodyne	CHRNA7	42	35
O=C(NCCc1cccnc1)N1C[C@@H]2CCC[C@]2(CO)C1	ZINC000875049306	CD	On-Demand	Anodyne	NAMPT	43	39
O=C(NCCc1cccnc1)N1CCC(CCO)(CCO)CC1	ZINC000875049308	DD	On-Demand	Anodyne	CHRNA7	41	35
O=C(NCCc1cccnc1)N1CCC(CCO)(CCO)CC1	ZINC000875049308	DD	On-Demand	Anodyne	NAMPT	46	43
Cc1ccc(CNC(=O)C(=O)NCc2ncc(Cl)s2)c(C)c1	ZINC000875049310	EE	On-Demand	Anodyne	P2RX7	15	45
C[C@@](CO)(Cc1ccc(F)cc1)NC(=O)NCCc1cccnc1	ZINC000875049314	EE	On-Demand	Anodyne	PTAFR	16	42
O=C(NCCc1cccnc1)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875049317	DD	On-Demand	Anodyne	CHRNA7	51	40
O=C(NCCc1cccnc1)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875049317	DD	On-Demand	Anodyne	C3AR1	43	42
O=C(NCCc1cccnc1)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875049317	DD	On-Demand	Anodyne	NAMPT	53	42
O=C(NCCc1cccnc1)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875049318	DD	On-Demand	Anodyne	CHRNA7	51	40
O=C(NCCc1cccnc1)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875049318	DD	On-Demand	Anodyne	C3AR1	43	42
O=C(NCCc1cccnc1)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875049318	DD	On-Demand	Anodyne	NAMPT	53	42
COc1ccc2c(C)c(CCC(=O)Nc3ncc(Cc4cc(F)cc(F)c4)s3)c(=O)oc2c1	ZINC000875049321	JK	On-Demand	Anodyne	MAOB	35	45
COc1ccc2c(C)c(CCC(=O)Nc3ncc(Cc4cc(F)cc(F)c4)s3)c(=O)oc2c1	ZINC000875049321	JK	On-Demand	Anodyne	NQO1	16	40
COc1ccc2c(C)c(CCC(=O)Nc3ncc(Cc4cc(F)cc(F)c4)s3)c(=O)oc2c1	ZINC000875049321	JK	On-Demand	Anodyne	SCD1	38	47
COc1ccc2c(C)c(CCC(=O)Nc3ncc(Cc4cc(F)cc(F)c4)s3)c(=O)oc2c1	ZINC000875049321	JK	On-Demand	Anodyne	SCD	32	47
O=C(NCCc1cccnc1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875049323	DD	On-Demand	Anodyne	CHRNA7	43	36
O=C(NCCc1cccnc1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875049323	DD	On-Demand	Anodyne	NAMPT	35	40
O=C(Cc1csc(C2CC2)n1)Oc1ccc(Cl)cc1F	ZINC000875049342	DH	On-Demand	Anodyne	PTGER1	21	41
COCC(C)(C)CCNC(=O)C(=O)NCc1ccc(OC)c(O)c1	ZINC000875049350	ED	On-Demand	Anodyne	TRPV1	24	44
COCC(C)(C)CCNC(=O)C(=O)NCc1ccc(OC)c(O)c1	ZINC000875049350	ED	On-Demand	Anodyne	MT-ND1	24	42
C[C@]1(C(F)(F)F)CCN(C(=O)NCCNS(=O)(=O)c2ccccc2)C1	ZINC000875049351	GD	On-Demand	Anodyne	EPHX2	29	40
C[C@]1(C(F)(F)F)CCN(C(=O)NCCNS(=O)(=O)c2ccccc2)C1	ZINC000875049351	GD	On-Demand	Anodyne	SFRP1	130	39
C[C@]1(C(F)(F)F)CCN(C(=O)NCCNS(=O)(=O)c2ccccc2)C1	ZINC000875049351	GD	On-Demand	Anodyne	WNT3	88	39
CC(=O)C1CCN(C(=O)C(=O)NCc2c(C)cc(C)cc2C)CC1	ZINC000875049360	EE	On-Demand	Anodyne	EPHX2	18	43
O=C(NCCNS(=O)(=O)c1ccccc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875049392	ED	On-Demand	Anodyne	TBXA2R	15	40
O=C(NCCNS(=O)(=O)c1ccccc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875049393	ED	On-Demand	Anodyne	TBXA2R	15	40
O=C(NCCNS(=O)(=O)c1ccccc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875049394	ED	On-Demand	Anodyne	TBXA2R	15	40
O=C(NCCNS(=O)(=O)c1ccccc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875049395	ED	On-Demand	Anodyne	TBXA2R	15	40
CC(=O)N[C@H](CC(C)C)C(=O)Oc1c(F)cccc1F	ZINC000875049405	CE	On-Demand	Anodyne	ANPEP	33	46
CC(=O)N[C@H](CC(C)C)C(=O)Oc1c(F)cccc1F	ZINC000875049405	CE	On-Demand	Anodyne	CTSB	30	40
CC(=O)N[C@H](CC(C)C)C(=O)Oc1c(F)cccc1F	ZINC000875049405	CE	On-Demand	Anodyne	CPA1	21	40
CC(=O)N[C@H](CC(C)C)C(=O)Oc1c(F)cccc1F	ZINC000875049405	CE	On-Demand	Anodyne	CAPNS1	55	33
CC(=O)N[C@H](CC(C)C)C(=O)Oc1c(F)cccc1F	ZINC000875049405	CE	On-Demand	Anodyne	CAPN1	87	44
CC(=O)N[C@H](CC(C)C)C(=O)Oc1c(F)cccc1F	ZINC000875049405	CE	On-Demand	Anodyne	CAPN2	99	35
CC(=O)N[C@H](CC(C)C)C(=O)Oc1c(F)cccc1F	ZINC000875049405	CE	On-Demand	Anodyne	ACE2	15	40
CC(=O)N[C@H](CC(C)C)C(=O)Oc1c(F)cccc1F	ZINC000875049405	CE	On-Demand	Anodyne	FPR1	43	36
CC(=O)N[C@H](CC(C)C)C(=O)Oc1c(F)cccc1F	ZINC000875049405	CE	On-Demand	Anodyne	NPR	75	37
CC(=O)N[C@H](CC(C)C)C(=O)Oc1c(F)cccc1F	ZINC000875049405	CE	On-Demand	Anodyne	HPN	69	35
CC(=O)C1CCN(C(=O)C(=O)NC2CCC(c3ccccc3)CC2)CC1	ZINC000875049409	FF	On-Demand	Anodyne	SIGMAR1	15	40
CC(=O)C1CCN(C(=O)C(=O)NC2CCC(c3ccccc3)CC2)CC1	ZINC000875049409	FF	On-Demand	Anodyne	EPHX2	36	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](OC)c1ccccc1	ZINC000875049445	EE	On-Demand	Anodyne	SLC6A4	29	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](OC)c1ccccc1	ZINC000875049445	EE	On-Demand	Anodyne	SLC6A3	70	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](OC)c1ccccc1	ZINC000875049446	EE	On-Demand	Anodyne	SLC6A4	29	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](OC)c1ccccc1	ZINC000875049446	EE	On-Demand	Anodyne	SLC6A3	70	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](OC)c1ccccc1	ZINC000875049447	EE	On-Demand	Anodyne	SLC6A4	29	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](OC)c1ccccc1	ZINC000875049447	EE	On-Demand	Anodyne	SLC6A3	70	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](OC)c1ccccc1	ZINC000875049448	EE	On-Demand	Anodyne	SLC6A4	29	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](OC)c1ccccc1	ZINC000875049448	EE	On-Demand	Anodyne	SLC6A3	70	44
CC(=O)N[C@@H](C(=O)Oc1c(F)cccc1F)C(C)C	ZINC000875049519	CE	On-Demand	Anodyne	PAPA1_CARPA	25	41
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NC2CCC(c3ccccc3)CC2)CC1	ZINC000875049521	GD	On-Demand	Anodyne	EPHX2	26	40
O=C(NCCNS(=O)(=O)c1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875049524	GE	On-Demand	Anodyne	SFRP1	115	36
O=C(NCCNS(=O)(=O)c1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875049524	GE	On-Demand	Anodyne	WNT3	82	35
O=C(NCCNS(=O)(=O)c1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875049525	GE	On-Demand	Anodyne	SFRP1	115	36
O=C(NCCNS(=O)(=O)c1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875049525	GE	On-Demand	Anodyne	WNT3	82	35
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](OC)c1ccccc1	ZINC000875049527	CE	On-Demand	Anodyne	CAPN2	50	37
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](OC)c1ccccc1	ZINC000875049528	CE	On-Demand	Anodyne	CAPN2	50	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCNC(=O)c1ccc(C)c(F)c1	ZINC000875049531	GD	On-Demand	Anodyne	SLC6A4	18	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCNC(=O)c1ccc(C)c(F)c1	ZINC000875049531	GD	On-Demand	Anodyne	SLC6A3	35	46
Cc1cncc([C@H]2CCCN2C(=O)NCCNS(=O)(=O)c2ccccc2)c1	ZINC000875049549	GE	On-Demand	Anodyne	SFRP1	102	38
Cc1cncc([C@H]2CCCN2C(=O)NCCNS(=O)(=O)c2ccccc2)c1	ZINC000875049549	GE	On-Demand	Anodyne	WNT3	82	38
Cc1cncc([C@@H]2CCCN2C(=O)NCCNS(=O)(=O)c2ccccc2)c1	ZINC000875049550	GE	On-Demand	Anodyne	SFRP1	102	38
Cc1cncc([C@@H]2CCCN2C(=O)NCCNS(=O)(=O)c2ccccc2)c1	ZINC000875049550	GE	On-Demand	Anodyne	WNT3	82	38
O=C(NCCNS(=O)(=O)c1ccccc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875049599	GD	On-Demand	Anodyne	RBP4	28	40
O=C(NCCNS(=O)(=O)c1ccccc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875049599	GD	On-Demand	Anodyne	SFRP1	128	38
O=C(NCCNS(=O)(=O)c1ccccc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875049599	GD	On-Demand	Anodyne	WNT3	88	38
O=C(NCCNS(=O)(=O)c1ccccc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875049600	GD	On-Demand	Anodyne	RBP4	28	40
O=C(NCCNS(=O)(=O)c1ccccc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875049600	GD	On-Demand	Anodyne	SFRP1	128	38
O=C(NCCNS(=O)(=O)c1ccccc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875049600	GD	On-Demand	Anodyne	WNT3	88	38
O=CN1CCCN(C(=O)NCCNS(=O)(=O)c2cccc(Cl)c2)CC1	ZINC000875049620	GC	On-Demand	Anodyne	HTR7	18	41
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(Cl)cc1F	ZINC000875049621	DF	On-Demand	Anodyne	MC4R	20	41
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(Cl)cc1F	ZINC000875049621	DF	On-Demand	Anodyne	CAPN1	40	39
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(Cl)cc1F	ZINC000875049621	DF	On-Demand	Anodyne	CAPN2	53	33
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(Cl)cc1F	ZINC000875049621	DF	On-Demand	Anodyne	HPN	40	32
O=C(NCCNS(=O)(=O)c1ccccc1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875049636	FD	On-Demand	Anodyne	SFRP1	90	34
O=C(NCCNS(=O)(=O)c1ccccc1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875049636	FD	On-Demand	Anodyne	WNT3	56	32
O=C(NCCNS(=O)(=O)c1ccccc1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875049637	FD	On-Demand	Anodyne	SFRP1	90	34
O=C(NCCNS(=O)(=O)c1ccccc1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875049637	FD	On-Demand	Anodyne	WNT3	56	32
O=C(NCCNS(=O)(=O)c1ccccc1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875049638	FD	On-Demand	Anodyne	SFRP1	90	34
O=C(NCCNS(=O)(=O)c1ccccc1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875049638	FD	On-Demand	Anodyne	WNT3	56	32
O=C(NCCNS(=O)(=O)c1ccccc1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875049639	FD	On-Demand	Anodyne	SFRP1	90	34
O=C(NCCNS(=O)(=O)c1ccccc1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875049639	FD	On-Demand	Anodyne	WNT3	56	32
C=CC(C)(C)CCCNC(=O)C(=O)NCc1ccc(OC)c(O)c1	ZINC000875049653	EE	On-Demand	Mild	TRPV1	22	42
C=CC(C)(C)CCCNC(=O)C(=O)NCc1ccc(OC)c(O)c1	ZINC000875049653	EE	On-Demand	Mild	MT-ND1	23	40
Cc1nc(O)nc(O)c1CCC(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875049682	HG	On-Demand	Anodyne	SCD1	34	44
Cc1nc(O)nc(O)c1CCC(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875049682	HG	On-Demand	Anodyne	SCD	29	44
O=C(Oc1c(F)cccc1F)c1ccnc(N2CCOCC2)n1	ZINC000875049711	DD	On-Demand	Anodyne	PIK3CA	32	46
O=C(Oc1c(F)cccc1F)c1ccnc(N2CCOCC2)n1	ZINC000875049711	DD	On-Demand	Anodyne	MTOR	17	42
Cc1ncc2c(n1)CC[C@H](NC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1)C2	ZINC000875049751	GF	On-Demand	Anodyne	CPT1A	76	35
Cc1ncc2c(n1)CC[C@H](NC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1)C2	ZINC000875049752	GF	On-Demand	Anodyne	CPT1A	76	35
Cc1ncc2c(n1)CC[C@H](NC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1)C2	ZINC000875049753	GF	On-Demand	Anodyne	CPT1A	76	35
Cc1ncc2c(n1)CC[C@H](NC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1)C2	ZINC000875049754	GF	On-Demand	Anodyne	CPT1A	76	35
C[C@@H]1C[C@H]1c1ccc(CNC(=O)C(=O)N2CCC(N3CCN(C)CC3)CC2)o1	ZINC000875049759	GD	On-Demand	Anodyne	L3MBTL3	41	38
C[C@H]1C[C@H]1c1ccc(CNC(=O)C(=O)N2CCC(N3CCN(C)CC3)CC2)o1	ZINC000875049760	GD	On-Demand	Anodyne	L3MBTL3	41	38
C[C@H]1C[C@H](NC(=O)OC(C)(C)C)CN1C(=O)C(=O)NCc1ccsc1	ZINC000875049785	FD	On-Demand	Anodyne	PAPA1_CARPA	28	45
C[C@@H]1C[C@H](NC(=O)OC(C)(C)C)CN1C(=O)C(=O)NCc1ccsc1	ZINC000875049788	FD	On-Demand	Anodyne	PAPA1_CARPA	28	45
CN1CCN(C2CCN(C(=O)C(=O)NCc3ccsc3)CC2)CC1	ZINC000875049795	FC	On-Demand	Anodyne	L3MBTL3	68	42
O=C(O)c1ccc(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)s1	ZINC000875049812	GI	On-Demand	Anodyne	SCD1	43	55
O=C(O)c1ccc(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)s1	ZINC000875049812	GI	On-Demand	Anodyne	SCD	36	55
COc1ccc([C@@H]2CN(C(=O)C(=O)NCc3ccsc3)CCO2)cc1	ZINC000875049823	FD	On-Demand	Anodyne	NPBWR1	68	31
CC(C)c1ccc(CNC(=O)C(=O)NCc2ncc(Cl)s2)cc1	ZINC000875049825	FF	On-Demand	Anodyne	FFAR2	23	41
CC(=O)C1CCN(C(=O)NCCNS(=O)(=O)c2ccccc2)CC1	ZINC000875049896	FC	On-Demand	Anodyne	TBXA2R	18	41
CC(=O)C1CCN(C(=O)NCCNS(=O)(=O)c2ccccc2)CC1	ZINC000875049896	FC	On-Demand	Anodyne	HTR7	16	49
CC(=O)C1CCN(C(=O)NCCNS(=O)(=O)c2ccccc2)CC1	ZINC000875049896	FC	On-Demand	Anodyne	EPHX2	29	41
CC(=O)C1CCN(C(=O)NCCNS(=O)(=O)c2ccccc2)CC1	ZINC000875049896	FC	On-Demand	Anodyne	SFRP1	127	38
CC(=O)C1CCN(C(=O)NCCNS(=O)(=O)c2ccccc2)CC1	ZINC000875049896	FC	On-Demand	Anodyne	WNT3	87	38
C[C@]1(C(F)(F)F)CN(C(=O)NCCNS(=O)(=O)c2ccccc2)CCO1	ZINC000875049908	GD	On-Demand	Anodyne	SFRP1	69	34
CCCCCCCNC(=O)C(=O)NCc1ccc(OC)c(O)c1	ZINC000875049911	DE	On-Demand	Mild	INHA	112	46
CCCCCCCNC(=O)C(=O)NCc1ccc(OC)c(O)c1	ZINC000875049911	DE	On-Demand	Mild	CNR2	41	38
CCCCCCCNC(=O)C(=O)NCc1ccc(OC)c(O)c1	ZINC000875049911	DE	On-Demand	Mild	TRPV1	26	59
CCCCCCCNC(=O)C(=O)NCc1ccc(OC)c(O)c1	ZINC000875049911	DE	On-Demand	Mild	LPAR2	57	44
CCCCCCCNC(=O)C(=O)NCc1ccc(OC)c(O)c1	ZINC000875049911	DE	On-Demand	Mild	S1PR3	22	47
CCCCCCCNC(=O)C(=O)NCc1ccc(OC)c(O)c1	ZINC000875049911	DE	On-Demand	Mild	MTNR1B	19	44
CCCCCCCNC(=O)C(=O)NCc1ccc(OC)c(O)c1	ZINC000875049911	DE	On-Demand	Mild	S1PR2	64	47
CCCCCCCNC(=O)C(=O)NCc1ccc(OC)c(O)c1	ZINC000875049911	DE	On-Demand	Mild	MT-ND1	23	40
CCCCCCCNC(=O)C(=O)NCc1ccc(OC)c(O)c1	ZINC000875049911	DE	On-Demand	Mild	ASAH1	80	36
O=C(NCCOCC(F)(F)F)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875049978	FE	On-Demand	Anodyne	PDS	46	39
O=C(NCCOCC(F)(F)F)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875049979	FE	On-Demand	Anodyne	PDS	46	39
CCCCCCCNC(=O)C(=O)NCc1ccsc1	ZINC000875049980	CE	On-Demand	Mild	GRIA1	43	37
CCCCCCCNC(=O)C(=O)NCc1ccsc1	ZINC000875049980	CE	On-Demand	Mild	S1PR2	42	36
CCCCCCCNC(=O)C(=O)NCc1ccsc1	ZINC000875049980	CE	On-Demand	Mild	ASAH1	95	38
Cn1nc(Cl)c(C(=O)N2CCCSc3ccccc32)c1Cl	ZINC000875049983	EH	On-Demand	Anodyne	AVPR2	20	47
CC(C)(C(=O)Oc1c(F)cccc1F)[C@H]1CCCCO1	ZINC000875050036	CG	On-Demand	Anodyne	AMY2	42	29
CC(C)(C(=O)Oc1c(F)cccc1F)[C@@H]1CCCCO1	ZINC000875050037	CG	On-Demand	Anodyne	AMY2	42	29
CO[C@H](CNC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875050067	DF	On-Demand	Anodyne	FKBP1A	27	41
CO[C@H](CNC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875050067	DF	On-Demand	Anodyne	AMY2	49	34
CO[C@H](CNC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875050067	DF	On-Demand	Anodyne	REN	18	44
CO[C@H](CNC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875050068	DF	On-Demand	Anodyne	FKBP1A	27	41
CO[C@H](CNC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875050068	DF	On-Demand	Anodyne	AMY2	49	34
CO[C@H](CNC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875050068	DF	On-Demand	Anodyne	REN	18	44
CC(=O)N1CCC[C@@H]1C(=O)Oc1c(F)cccc1F	ZINC000875050074	CD	On-Demand	Anodyne	FKBP1A	53	36
CC(=O)N1CCC[C@@H]1C(=O)Oc1c(F)cccc1F	ZINC000875050074	CD	On-Demand	Anodyne	PREP	72	41
CC(=O)N1CCC[C@@H]1C(=O)Oc1c(F)cccc1F	ZINC000875050074	CD	On-Demand	Anodyne	LGMN	42	34
CC[C@@H]1COCCN1CCNC(=O)NCCNC(=O)c1ccc(C)c(F)c1	ZINC000875050078	GD	On-Demand	Anodyne	PLD2	40	34
O=CN1CCCN(C(=O)NCCNS(=O)(=O)c2ccccc2)CC1	ZINC000875050100	FB	On-Demand	Anodyne	TBXA2R	15	41
CC(=O)[C@H]1CCCN(C(=O)NCCNS(=O)(=O)c2ccccc2)C1	ZINC000875050101	FC	On-Demand	Anodyne	SLC6A1	55	32
CC(=O)[C@H]1CCCN(C(=O)NCCNS(=O)(=O)c2ccccc2)C1	ZINC000875050101	FC	On-Demand	Anodyne	SFRP1	124	37
CC(=O)[C@H]1CCCN(C(=O)NCCNS(=O)(=O)c2ccccc2)C1	ZINC000875050101	FC	On-Demand	Anodyne	WNT3	88	37
CC(=O)[C@@H]1CCCN(C(=O)NCCNS(=O)(=O)c2ccccc2)C1	ZINC000875050102	FC	On-Demand	Anodyne	SLC6A1	55	32
CC(=O)[C@@H]1CCCN(C(=O)NCCNS(=O)(=O)c2ccccc2)C1	ZINC000875050102	FC	On-Demand	Anodyne	SFRP1	124	37
CC(=O)[C@@H]1CCCN(C(=O)NCCNS(=O)(=O)c2ccccc2)C1	ZINC000875050102	FC	On-Demand	Anodyne	WNT3	88	37
CN1CC[C@H]2CN(C(=O)NCCNS(=O)(=O)c3ccccc3)CC[C@H]21	ZINC000875050116	FC	On-Demand	Anodyne	CCR8	41	34
CN1CC[C@H]2CN(C(=O)NCCNS(=O)(=O)c3ccccc3)CC[C@H]21	ZINC000875050116	FC	On-Demand	Anodyne	SFRP1	96	34
CN1CC[C@H]2CN(C(=O)NCCNS(=O)(=O)c3ccccc3)CC[C@H]21	ZINC000875050116	FC	On-Demand	Anodyne	WNT3	64	34
CN1CC[C@H]2CN(C(=O)NCCNS(=O)(=O)c3ccccc3)CC[C@@H]21	ZINC000875050117	FC	On-Demand	Anodyne	CCR8	41	34
CN1CC[C@H]2CN(C(=O)NCCNS(=O)(=O)c3ccccc3)CC[C@@H]21	ZINC000875050117	FC	On-Demand	Anodyne	SFRP1	96	34
CN1CC[C@H]2CN(C(=O)NCCNS(=O)(=O)c3ccccc3)CC[C@@H]21	ZINC000875050117	FC	On-Demand	Anodyne	WNT3	64	34
COc1ccc(OCCC(=O)Oc2cc(OC)cc(OC)c2)cc1	ZINC000875050156	EG	On-Demand	Anodyne	LTA4H	16	40
COc1ccc(OCCC(=O)Oc2cc(OC)cc(OC)c2)cc1	ZINC000875050156	EG	On-Demand	Anodyne	AHR	17	43
COc1ccc(OCCC(=O)Oc2cc(OC)cc(OC)c2)cc1	ZINC000875050156	EG	On-Demand	Anodyne	MTNR1A	37	41
COc1ccc(OCCC(=O)Oc2cc(OC)cc(OC)c2)cc1	ZINC000875050156	EG	On-Demand	Anodyne	MTNR1B	31	41
COc1ccc(OCCC(=O)Oc2cc(OC)cc(OC)c2)cc1	ZINC000875050156	EG	On-Demand	Anodyne	PLA2G4B	65	34
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccsc3)CC2)c(OC)c1	ZINC000875050162	GD	On-Demand	Clean	HTR1A	29	47
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccsc3)CC2)c(OC)c1	ZINC000875050162	GD	On-Demand	Clean	DRD4	40	32
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccsc3)CC2)c(OC)c1	ZINC000875050162	GD	On-Demand	Clean	DRD3	43	38
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccsc3)CC2)c(OC)c1	ZINC000875050162	GD	On-Demand	Clean	NPBWR1	75	32
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NCc3ccsc3)C2)c1	ZINC000875050174	GD	On-Demand	Anodyne	CHRM3	16	40
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NCc3ccsc3)C2)c1	ZINC000875050175	GD	On-Demand	Anodyne	CHRM3	16	40
O=C(NCc1ccsc1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875050204	EE	On-Demand	Anodyne	GHRHR	35	42
O=C(NCc1ccsc1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875050205	EE	On-Demand	Anodyne	GHRHR	35	42
O=C(CN1C(=O)COc2ccc(Cl)cc21)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875050206	II	On-Demand	Anodyne	SCD1	32	42
O=C(CN1C(=O)COc2ccc(Cl)cc21)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875050206	II	On-Demand	Anodyne	SCD	28	42
O=C(O)c1cc(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cc([N+](=O)[O-])c1	ZINC000875050236	HH	On-Demand	Bother	SCD1	41	51
O=C(O)c1cc(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cc([N+](=O)[O-])c1	ZINC000875050236	HH	On-Demand	Bother	SCD	35	51
O=C(Oc1ccc(Cl)c(C(F)(F)F)c1)c1ccnc(N2CCOCC2)n1	ZINC000875050269	GG	On-Demand	Anodyne	RAF1	19	43
O=C(Oc1ccc(Cl)c(C(F)(F)F)c1)c1cn2c(n1)COCC2	ZINC000875050310	EG	On-Demand	Anodyne	RAF1	16	41
CN1CCN(C(=O)NCCNS(=O)(=O)c2ccccc2)Cc2cccnc21	ZINC000875050315	GD	On-Demand	Anodyne	HTR7	20	46
CN1CCN(C(=O)NCCNS(=O)(=O)c2ccccc2)Cc2cccnc21	ZINC000875050315	GD	On-Demand	Anodyne	NAMPT	18	46
O=C(Cn1cc(C(=O)O)c2ccccc21)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875050329	II	On-Demand	Anodyne	CDK5	27	40
O=C(Cn1cc(C(=O)O)c2ccccc21)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875050329	II	On-Demand	Anodyne	SCD1	33	42
O=C(Cn1cc(C(=O)O)c2ccccc21)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000875050329	II	On-Demand	Anodyne	SCD	29	42
N#Cc1ccc(Cn2cc(NC(=O)NCCOCC(F)(F)F)cn2)cc1	ZINC000875050413	FF	On-Demand	Mild	ITK	15	49
N#Cc1ccc(Cn2cc(NC(=O)NCCOCC(F)(F)F)cn2)cc1	ZINC000875050413	FF	On-Demand	Mild	PANC	41	35
CN1CC[C@@H](C(=O)Oc2ccc(Cl)cc2F)[C@H](c2cnn(C)c2)C1	ZINC000875050428	FF	On-Demand	Anodyne	SLC6A3	19	43
CN1CC[C@@H](C(=O)Oc2ccc(Cl)cc2F)[C@@H](c2cnn(C)c2)C1	ZINC000875050430	FF	On-Demand	Anodyne	SLC6A3	19	43
CCC1CCC(NC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)CC1	ZINC000875050445	GG	On-Demand	Anodyne	ETHR	60	48
CO[C@H](CNC(=O)N(C)CCN1CC2(CCOCC2)C1)c1ccccc1	ZINC000875050447	FE	On-Demand	Anodyne	CASR	50	39
O=C(CCc1ccc(N2CCCS2(=O)=O)cc1)Oc1c(F)cccc1F	ZINC000875050457	GG	On-Demand	Anodyne	CDK1	17	42
C[C@@H](CN(C)C(=O)C(=O)NCc1ccsc1)NC(=O)OC(C)(C)C	ZINC000875050529	FD	On-Demand	Anodyne	PAPA1_CARPA	35	48
C[C@@H](CN(C)C(=O)C(=O)NCc1ccsc1)NC(=O)OC(C)(C)C	ZINC000875050529	FD	On-Demand	Anodyne	FPR1	40	35
C=CCc1cc(OC)ccc1OC(=O)[C@H]1CCCN1C(C)=O	ZINC000875050534	DE	On-Demand	Mild	FKBP1A	58	46
CCCCCCCNC(=O)C(=O)NCc1cccc(C#N)c1	ZINC000875050540	DE	On-Demand	Mild	ASAH1	76	34
CCCCCCCNC(=O)C(=O)NCc1cccc(C#N)c1	ZINC000875050540	DE	On-Demand	Mild	PDS	19	43
CS(=O)(=O)NCCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875050541	FC	On-Demand	Anodyne	FKBP1A	27	40
CS(=O)(=O)NCCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875050542	FC	On-Demand	Anodyne	FKBP1A	27	40
CS(=O)(=O)NCCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875050543	FC	On-Demand	Anodyne	FKBP1A	27	40
CS(=O)(=O)NCCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875050544	FC	On-Demand	Anodyne	FKBP1A	27	40
COc1cccc(/C=C(/C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)n2nnnc2C)c1	ZINC000875050545	JH	On-Demand	Anodyne	SCD1	38	48
COc1cccc(/C=C(/C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)n2nnnc2C)c1	ZINC000875050545	JH	On-Demand	Anodyne	SCD	33	48
COc1cccc(/C=C(\C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)n2nnnc2C)c1	ZINC000875050546	JH	On-Demand	Anodyne	SCD1	38	48
COc1cccc(/C=C(\C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)n2nnnc2C)c1	ZINC000875050546	JH	On-Demand	Anodyne	SCD	33	48
C=CCc1cc(OC)ccc1OC(=O)C(C)(C)NC(=O)C(C)(C)NC(C)=O	ZINC000875050553	GE	On-Demand	Mild	MTNR1B	30	40
Cn1nc(Cl)c(C(=O)Nc2ccccc2N2CCCC2)c1Cl	ZINC000875050600	EH	On-Demand	Anodyne	CNR1	40	30
Cn1nc(Cl)c(C(=O)Nc2ccccc2N2CCCC2)c1Cl	ZINC000875050600	EH	On-Demand	Anodyne	KCNQ2	94	50
Cn1nc(Cl)c(C(=O)Nc2ccccc2N2CCCC2)c1Cl	ZINC000875050600	EH	On-Demand	Anodyne	CSF1R	18	50
Cn1nc(Cl)c(C(=O)Nc2ccccc2N2CCCC2)c1Cl	ZINC000875050600	EH	On-Demand	Anodyne	EPHB3	56	40
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NCCNS(C)(=O)=O	ZINC000875050609	GD	On-Demand	Anodyne	SIGMAR1	17	46
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1ccsc1)CC2	ZINC000875050635	FF	On-Demand	Anodyne	SLC18A2	45	33
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1ccsc1)CC2	ZINC000875050635	FF	On-Demand	Anodyne	HCRTR1	15	46
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1ccsc1)CC2	ZINC000875050636	FF	On-Demand	Anodyne	SLC18A2	45	33
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1ccsc1)CC2	ZINC000875050636	FF	On-Demand	Anodyne	HCRTR1	15	46
COCC(C)(C)CCNC(=O)C(=O)NCc1ccc(C(C)C)cc1	ZINC000875050760	EF	On-Demand	Anodyne	TRPV1	16	40
CS(=O)(=O)NCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875050804	EC	On-Demand	Anodyne	F2	40	42
CS(=O)(=O)NCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875050804	EC	On-Demand	Anodyne	TRY1_BOVIN	48	42
CS(=O)(=O)NCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875050804	EC	On-Demand	Anodyne	TMPRSS11D	61	34
CS(=O)(=O)NCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875050805	EC	On-Demand	Anodyne	F2	40	42
CS(=O)(=O)NCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875050805	EC	On-Demand	Anodyne	TRY1_BOVIN	48	42
CS(=O)(=O)NCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875050805	EC	On-Demand	Anodyne	TMPRSS11D	61	34
CS(=O)(=O)NCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875050806	EC	On-Demand	Anodyne	F2	40	42
CS(=O)(=O)NCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875050806	EC	On-Demand	Anodyne	TRY1_BOVIN	48	42
CS(=O)(=O)NCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875050806	EC	On-Demand	Anodyne	TMPRSS11D	61	34
CS(=O)(=O)NCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875050807	EC	On-Demand	Anodyne	F2	40	42
CS(=O)(=O)NCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875050807	EC	On-Demand	Anodyne	TRY1_BOVIN	48	42
CS(=O)(=O)NCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875050807	EC	On-Demand	Anodyne	TMPRSS11D	61	34
CC(C)c1ccc(CNC(=O)C(=O)N2CCC(N3CCN(C)CC3)CC2)cc1	ZINC000875050808	GD	On-Demand	Anodyne	L3MBTL3	71	43
Cc1ncc2c(n1)CC[C@H](NC(=O)NCC1(c3ccccc3)CCN(C)CC1)C2	ZINC000875050830	GF	On-Demand	Anodyne	KCNA3	44	38
Cc1ncc2c(n1)CC[C@@H](NC(=O)NCC1(c3ccccc3)CCN(C)CC1)C2	ZINC000875050831	GF	On-Demand	Anodyne	KCNA3	44	38
Cc1ncc2c(n1)CC[C@H](NC(=O)N1CCC[C@](O)(c3ccccc3)C1)C2	ZINC000875050849	FE	On-Demand	Anodyne	EPHX2	15	41
Cc1ncc2c(n1)CC[C@@H](NC(=O)N1CCC[C@@](O)(c3ccccc3)C1)C2	ZINC000875050850	FE	On-Demand	Anodyne	EPHX2	15	41
Cc1ncc2c(n1)CC[C@H](NC(=O)N1CCC[C@@](O)(c3ccccc3)C1)C2	ZINC000875050851	FE	On-Demand	Anodyne	EPHX2	15	41
Cc1ncc2c(n1)CC[C@@H](NC(=O)N1CCC[C@](O)(c3ccccc3)C1)C2	ZINC000875050852	FE	On-Demand	Anodyne	EPHX2	15	41
O=C(NCc1ccsc1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875050880	EE	On-Demand	Anodyne	TMPRSS11D	57	33
O=C(NCc1ccsc1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875050881	EE	On-Demand	Anodyne	TMPRSS11D	57	33
O=C(NCc1ccsc1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875050882	EE	On-Demand	Anodyne	TMPRSS11D	57	33
O=C(NCc1ccsc1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875050883	EE	On-Demand	Anodyne	TMPRSS11D	57	33
O=C(NCc1ccsc1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875050886	FE	On-Demand	Anodyne	ETHR	67	46
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(C(C)C)cc2)C1	ZINC000875050941	EE	On-Demand	Anodyne	DPP7	62	38
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(C(C)C)cc2)C1	ZINC000875050942	EE	On-Demand	Anodyne	DPP7	62	38
COc1ccccc1[C@H]1CCCN(C(=O)NCCNS(C)(=O)=O)CC1	ZINC000875050950	FD	On-Demand	Anodyne	DRD2	20	44
COc1ccccc1[C@H]1CCCN(C(=O)NCCNS(C)(=O)=O)CC1	ZINC000875050950	FD	On-Demand	Anodyne	RBP4	29	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCCNS(C)(=O)=O)CC1	ZINC000875050951	FD	On-Demand	Anodyne	DRD2	20	44
COc1ccccc1[C@@H]1CCCN(C(=O)NCCNS(C)(=O)=O)CC1	ZINC000875050951	FD	On-Demand	Anodyne	RBP4	29	40
CCN(CCNC(=O)OC(C)(C)C)C(=O)C(=O)NCc1ccsc1	ZINC000875050956	FD	On-Demand	Anodyne	PAPA1_CARPA	16	43
CC(C)c1ccc(CNC(=O)C(=O)NCc2ncc(Br)s2)cc1	ZINC000875050957	GF	On-Demand	Anodyne	FFAR2	19	40
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC(=O)C(=O)NCc2ccsc2)CC1	ZINC000875050959	GF	On-Demand	Anodyne	PAPA1_CARPA	15	42
N#CCc1ccsc1C(=O)Nc1ccccc1N1CCCC1	ZINC000875050980	DH	On-Demand	Mild	KCNQ2	89	51
N#CCc1ccsc1C(=O)Nc1ccccc1N1CCCC1	ZINC000875050980	DH	On-Demand	Mild	CSF1R	26	53
N#Cc1cccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875050993	FD	On-Demand	Mild	F2	32	44
N#Cc1cccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875050993	FD	On-Demand	Mild	CCR3	16	40
N#Cc1cccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875050993	FD	On-Demand	Mild	DPP4	26	46
N#Cc1cccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875050993	FD	On-Demand	Mild	PREP	42	41
N#Cc1cccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875050993	FD	On-Demand	Mild	DPP8	19	41
N#Cc1cccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875050993	FD	On-Demand	Mild	TMPRSS11D	61	39
N#Cc1cccc(CNC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875050994	FD	On-Demand	Mild	F2	32	44
N#Cc1cccc(CNC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875050994	FD	On-Demand	Mild	CCR3	16	40
N#Cc1cccc(CNC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875050994	FD	On-Demand	Mild	DPP4	26	46
N#Cc1cccc(CNC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875050994	FD	On-Demand	Mild	PREP	42	41
N#Cc1cccc(CNC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875050994	FD	On-Demand	Mild	DPP8	19	41
N#Cc1cccc(CNC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875050994	FD	On-Demand	Mild	TMPRSS11D	61	39
N#Cc1cccc(CNC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875050995	FD	On-Demand	Mild	F2	32	44
N#Cc1cccc(CNC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875050995	FD	On-Demand	Mild	CCR3	16	40
N#Cc1cccc(CNC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875050995	FD	On-Demand	Mild	DPP4	26	46
N#Cc1cccc(CNC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875050995	FD	On-Demand	Mild	PREP	42	41
N#Cc1cccc(CNC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875050995	FD	On-Demand	Mild	DPP8	19	41
N#Cc1cccc(CNC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875050995	FD	On-Demand	Mild	TMPRSS11D	61	39
N#Cc1cccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875050996	FD	On-Demand	Mild	F2	32	44
N#Cc1cccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875050996	FD	On-Demand	Mild	CCR3	16	40
N#Cc1cccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875050996	FD	On-Demand	Mild	DPP4	26	46
N#Cc1cccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875050996	FD	On-Demand	Mild	PREP	42	41
N#Cc1cccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875050996	FD	On-Demand	Mild	DPP8	19	41
N#Cc1cccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875050996	FD	On-Demand	Mild	TMPRSS11D	61	39
Cc1ncc2c(n1)CC[C@H](NC(=O)N1CCC(c3nc(C4CCC4)no3)CC1)C2	ZINC000875051005	GF	On-Demand	Anodyne	SMO	35	44
Cc1ncc2c(n1)CC[C@H](NC(=O)N1CCC(c3nc(C4CCC4)no3)CC1)C2	ZINC000875051005	GF	On-Demand	Anodyne	ETHR	36	41
Cc1ncc2c(n1)CC[C@@H](NC(=O)N1CCC(c3nc(C4CCC4)no3)CC1)C2	ZINC000875051006	GF	On-Demand	Anodyne	SMO	35	44
Cc1ncc2c(n1)CC[C@@H](NC(=O)N1CCC(c3nc(C4CCC4)no3)CC1)C2	ZINC000875051006	GF	On-Demand	Anodyne	ETHR	36	41
CC(C)c1ccc(CNC(=O)C(=O)N[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000875051017	FG	On-Demand	Anodyne	NAMPT	41	41
CC(C)c1ccc(CNC(=O)C(=O)N[C@H](C)c2cc3cnccc3o2)cc1	ZINC000875051018	FG	On-Demand	Anodyne	NAMPT	41	41
O=C(NCCOCC(F)(F)F)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875051023	EE	On-Demand	Anodyne	EPHX2	19	45
O=C(NCCOCC(F)(F)F)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875051024	EE	On-Demand	Anodyne	EPHX2	19	45
O=C(NCc1ccsc1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875051027	FF	On-Demand	Anodyne	C3AR1	36	45
O=C(NCc1ccsc1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875051028	FF	On-Demand	Anodyne	C3AR1	36	45
C#CC[C@@H](COC)NC(=O)C(=O)NCc1cccc(C#N)c1	ZINC000875051061	CC	On-Demand	Mild	PDS	19	42
C#CC[C@H](COC)NC(=O)C(=O)NCc1cccc(C#N)c1	ZINC000875051062	CC	On-Demand	Mild	PDS	19	42
Cc1ncc2c(n1)CC[C@@H](NC(=O)N1CC[C@H](Oc3ccc(F)cc3)C1)C2	ZINC000875051134	FF	On-Demand	Anodyne	EPHX2	20	41
Cc1ncc2c(n1)CC[C@H](NC(=O)N1CC[C@H](Oc3ccc(F)cc3)C1)C2	ZINC000875051135	FF	On-Demand	Anodyne	EPHX2	20	41
NC(=O)c1cc(NC(=O)NCC[C@@H]2CCSC2)ccc1F	ZINC000875051147	DE	On-Demand	Anodyne	PRMT3	34	44
NC(=O)c1cc(NC(=O)NCC[C@H]2CCSC2)ccc1F	ZINC000875051148	DE	On-Demand	Anodyne	PRMT3	34	44
NC(=O)c1cc(NC(=O)NC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)ccc1F	ZINC000875051149	DE	On-Demand	Anodyne	PRMT3	46	32
NC(=O)c1cc(NC(=O)NC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)ccc1F	ZINC000875051150	DE	On-Demand	Anodyne	PRMT3	46	32
NC(=O)c1cc(NC(=O)NC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)ccc1F	ZINC000875051151	DE	On-Demand	Anodyne	PRMT3	46	32
NC(=O)c1cc(NC(=O)NC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)ccc1F	ZINC000875051152	DE	On-Demand	Anodyne	PRMT3	46	32
Cc1nnc(NNC(=O)NCc2ccc(F)cc2C(F)(F)F)n1C	ZINC000875051153	EE	On-Demand	Reactive	P2RX7	57	48
CCOCCNC(=O)N(Cc1ccccc1)[C@H](CC)CO	ZINC000875051165	CE	On-Demand	Anodyne	PDS	43	33
CN1CCC(CNC(=O)Nc2ccc(F)c(C(N)=O)c2)(c2ccccc2)CC1	ZINC000875051172	GF	On-Demand	Anodyne	KCNA3	44	37
CN1CCC(CNC(=O)Nc2ccc(F)c(C(N)=O)c2)(c2ccccc2)CC1	ZINC000875051172	GF	On-Demand	Anodyne	SOAT1	18	43
CN1CCC(CNC(=O)Nc2ccc(F)c(C(N)=O)c2)(c2ccccc2)CC1	ZINC000875051172	GF	On-Demand	Anodyne	EPHX2	24	42
CN1CCC(CNC(=O)Nc2ccc(F)c(C(N)=O)c2)(c2ccccc2)CC1	ZINC000875051172	GF	On-Demand	Anodyne	MCHR1	24	57
CN1CCC(CNC(=O)Nc2ccc(F)c(C(N)=O)c2)(c2ccccc2)CC1	ZINC000875051172	GF	On-Demand	Anodyne	STAT6	57	37
CN1CCC(CNC(=O)Nc2ccc(F)c(C(N)=O)c2)(c2ccccc2)CC1	ZINC000875051172	GF	On-Demand	Anodyne	NPFFR1	22	40
CCOCCNC(=O)NNc1cccc(C)n1	ZINC000875051173	BD	On-Demand	Reactive	GRM5	19	43
CCCOc1ccc([C@H](C)NC(=O)C(=O)N[C@@H](C)c2ccnn2C)cc1	ZINC000875051176	FE	On-Demand	Anodyne	ACACA	27	52
CCCOc1ccc([C@H](C)NC(=O)C(=O)N[C@@H](C)c2ccnn2C)cc1	ZINC000875051176	FE	On-Demand	Anodyne	ACACB	28	52
CCCOc1ccc([C@H](C)NC(=O)C(=O)N[C@@H](C)c2ccnn2C)cc1	ZINC000875051176	FE	On-Demand	Anodyne	PLA2G4B	62	33
CCCOc1ccc([C@@H](C)NC(=O)C(=O)N[C@@H](C)c2ccnn2C)cc1	ZINC000875051177	FE	On-Demand	Anodyne	ACACA	27	52
CCCOc1ccc([C@@H](C)NC(=O)C(=O)N[C@@H](C)c2ccnn2C)cc1	ZINC000875051177	FE	On-Demand	Anodyne	ACACB	28	52
CCCOc1ccc([C@@H](C)NC(=O)C(=O)N[C@@H](C)c2ccnn2C)cc1	ZINC000875051177	FE	On-Demand	Anodyne	PLA2G4B	62	33
CCCOc1ccc([C@H](C)NC(=O)C(=O)N[C@H](C)c2ccnn2C)cc1	ZINC000875051178	FE	On-Demand	Anodyne	ACACA	27	52
CCCOc1ccc([C@H](C)NC(=O)C(=O)N[C@H](C)c2ccnn2C)cc1	ZINC000875051178	FE	On-Demand	Anodyne	ACACB	28	52
CCCOc1ccc([C@H](C)NC(=O)C(=O)N[C@H](C)c2ccnn2C)cc1	ZINC000875051178	FE	On-Demand	Anodyne	PLA2G4B	62	33
CCCOc1ccc([C@@H](C)NC(=O)C(=O)N[C@H](C)c2ccnn2C)cc1	ZINC000875051179	FE	On-Demand	Anodyne	ACACA	27	52
CCCOc1ccc([C@@H](C)NC(=O)C(=O)N[C@H](C)c2ccnn2C)cc1	ZINC000875051179	FE	On-Demand	Anodyne	ACACB	28	52
CCCOc1ccc([C@@H](C)NC(=O)C(=O)N[C@H](C)c2ccnn2C)cc1	ZINC000875051179	FE	On-Demand	Anodyne	PLA2G4B	62	33
CN1CCN(C(=O)Nc2ccc(F)c(C(N)=O)c2)CCC1(C)C	ZINC000875051193	DD	On-Demand	Anodyne	CACNA1H	42	41
CC(=O)Nc1cccc(CNC(=O)NC2(C)CC(F)(F)C2)c1	ZINC000875051198	DF	On-Demand	Anodyne	ROCK2	21	47
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)c1ccc(OCCC)cc1	ZINC000875051200	ED	On-Demand	Mild	ACACA	30	54
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)c1ccc(OCCC)cc1	ZINC000875051200	ED	On-Demand	Mild	ACACB	29	54
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)c1ccc(OCCC)cc1	ZINC000875051201	ED	On-Demand	Mild	ACACA	30	54
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)c1ccc(OCCC)cc1	ZINC000875051201	ED	On-Demand	Mild	ACACB	29	54
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](C)c1ccc(OCCC)cc1	ZINC000875051202	ED	On-Demand	Mild	ACACA	30	54
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](C)c1ccc(OCCC)cc1	ZINC000875051202	ED	On-Demand	Mild	ACACB	29	54
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](C)c1ccc(OCCC)cc1	ZINC000875051203	ED	On-Demand	Mild	ACACA	30	54
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](C)c1ccc(OCCC)cc1	ZINC000875051203	ED	On-Demand	Mild	ACACB	29	54
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875051209	FE	On-Demand	Anodyne	HCN1	63	38
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875051209	FE	On-Demand	Anodyne	HCN4	55	38
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875051210	FE	On-Demand	Anodyne	HCN1	63	38
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875051210	FE	On-Demand	Anodyne	HCN4	55	38
CC(=O)C1CCN(C(=O)C(=O)NC(Cc2ccccc2)Cc2ccccc2)CC1	ZINC000875051213	GF	On-Demand	Anodyne	ACE	70	43
CC(=O)C1CCN(C(=O)C(=O)NC(Cc2ccccc2)Cc2ccccc2)CC1	ZINC000875051213	GF	On-Demand	Anodyne	OPRM1	45	42
CC(=O)C1CCN(C(=O)C(=O)NC(Cc2ccccc2)Cc2ccccc2)CC1	ZINC000875051213	GF	On-Demand	Anodyne	MME	106	43
CC(=O)C1CCN(C(=O)C(=O)NC(Cc2ccccc2)Cc2ccccc2)CC1	ZINC000875051213	GF	On-Demand	Anodyne	SIGMAR1	26	41
CC(=O)C1CCN(C(=O)C(=O)NC(Cc2ccccc2)Cc2ccccc2)CC1	ZINC000875051213	GF	On-Demand	Anodyne	PREP	23	40
CC(=O)C1CCN(C(=O)C(=O)NC(Cc2ccccc2)Cc2ccccc2)CC1	ZINC000875051213	GF	On-Demand	Anodyne	CAPNS1	72	36
CC(=O)C1CCN(C(=O)C(=O)NC(Cc2ccccc2)Cc2ccccc2)CC1	ZINC000875051213	GF	On-Demand	Anodyne	CAPN1	66	46
CC(=O)C1CCN(C(=O)C(=O)NC(Cc2ccccc2)Cc2ccccc2)CC1	ZINC000875051213	GF	On-Demand	Anodyne	CAPN2	40	34
CC(=O)C1CCN(C(=O)C(=O)NC(Cc2ccccc2)Cc2ccccc2)CC1	ZINC000875051213	GF	On-Demand	Anodyne	ACE2	53	36
CC(=O)C1CCN(C(=O)C(=O)NC(Cc2ccccc2)Cc2ccccc2)CC1	ZINC000875051213	GF	On-Demand	Anodyne	AMP1_PLAFQ	27	42
NC(=O)c1cc(NC(=O)NC[C@@H]2C[C@H]2C2CCOCC2)ccc1F	ZINC000875051218	EE	On-Demand	Anodyne	PRMT3	45	32
CCCOc1ccc([C@H](C)NC(=O)C(=O)NCc2cccc3ncccc23)cc1	ZINC000875051222	GH	On-Demand	Anodyne	ACACA	25	50
CCCOc1ccc([C@H](C)NC(=O)C(=O)NCc2cccc3ncccc23)cc1	ZINC000875051222	GH	On-Demand	Anodyne	ACACB	26	50
CCCOc1ccc([C@@H](C)NC(=O)C(=O)NCc2cccc3ncccc23)cc1	ZINC000875051223	GH	On-Demand	Anodyne	ACACA	25	50
CCCOc1ccc([C@@H](C)NC(=O)C(=O)NCc2cccc3ncccc23)cc1	ZINC000875051223	GH	On-Demand	Anodyne	ACACB	26	50
CCCOc1ccc([C@H](C)NC(=O)C(=O)N2CC[C@H]3[C@@H](CCN3C)C2)cc1	ZINC000875051234	FE	On-Demand	Anodyne	ACACA	18	48
CCCOc1ccc([C@H](C)NC(=O)C(=O)N2CC[C@H]3[C@@H](CCN3C)C2)cc1	ZINC000875051234	FE	On-Demand	Anodyne	ACACB	19	48
CCCOc1ccc([C@H](C)NC(=O)C(=O)N2CC[C@@H]3[C@H](CCN3C)C2)cc1	ZINC000875051235	FE	On-Demand	Anodyne	ACACA	18	48
CCCOc1ccc([C@H](C)NC(=O)C(=O)N2CC[C@@H]3[C@H](CCN3C)C2)cc1	ZINC000875051235	FE	On-Demand	Anodyne	ACACB	19	48
CCCOc1ccc([C@H](C)NC(=O)C(=O)N2CC[C@@H]3[C@@H](CCN3C)C2)cc1	ZINC000875051236	FE	On-Demand	Anodyne	ACACA	18	48
CCCOc1ccc([C@H](C)NC(=O)C(=O)N2CC[C@@H]3[C@@H](CCN3C)C2)cc1	ZINC000875051236	FE	On-Demand	Anodyne	ACACB	19	48
CCCOc1ccc([C@H](C)NC(=O)C(=O)N2CC[C@H]3[C@H](CCN3C)C2)cc1	ZINC000875051237	FE	On-Demand	Anodyne	ACACA	18	48
CCCOc1ccc([C@H](C)NC(=O)C(=O)N2CC[C@H]3[C@H](CCN3C)C2)cc1	ZINC000875051237	FE	On-Demand	Anodyne	ACACB	19	48
CCCOc1ccc([C@H](C)NC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875051246	FE	On-Demand	Anodyne	ACACA	27	55
CCCOc1ccc([C@H](C)NC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875051246	FE	On-Demand	Anodyne	ACACB	27	55
CC(=O)Nc1cccc(CNC(=O)NCC[C@H](O)C2CCCC2)c1	ZINC000875051250	EE	On-Demand	Anodyne	ROCK2	17	43
CC(=O)Nc1cccc(CNC(=O)NCC[C@@H](O)C2CCCC2)c1	ZINC000875051251	EE	On-Demand	Anodyne	ROCK2	17	43
C#CC[C@H](CCOC)NC(=O)NCc1ccc(O)c(OC)c1	ZINC000875051259	DD	On-Demand	Mild	TRPV1	19	46
C#CC[C@@H](CCOC)NC(=O)NCc1ccc(O)c(OC)c1	ZINC000875051260	DD	On-Demand	Mild	TRPV1	19	46
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCc2cccc(F)c2)[C@@H](O)C1	ZINC000875051267	FD	On-Demand	Anodyne	GPR119	44	58
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NCc2cccc(F)c2)[C@@H](O)C1	ZINC000875051268	FD	On-Demand	Anodyne	GPR119	44	58
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCc2cccc(F)c2)[C@H](O)C1	ZINC000875051269	FD	On-Demand	Anodyne	GPR119	44	58
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NCc2cccc(F)c2)[C@H](O)C1	ZINC000875051270	FD	On-Demand	Anodyne	GPR119	44	58
CC[C@@H](NC(=O)C(=O)N1CCN([S@@](C)(=N)=O)CC1)c1cccc(Cl)c1	ZINC000875051280	GD	On-Demand	Anodyne	KCNQ2	18	40
CC[C@@H](NC(=O)C(=O)N1CCN([S@](C)(=N)=O)CC1)c1cccc(Cl)c1	ZINC000875051282	GD	On-Demand	Anodyne	KCNQ2	18	40
COc1cc(CNC(=O)N2CCC(NC(=O)c3cccc(C)c3)CC2)ccc1O	ZINC000875051284	GF	On-Demand	Anodyne	DRD2	22	48
COc1cc(CNC(=O)N2CCC(NC(=O)c3cccc(C)c3)CC2)ccc1O	ZINC000875051284	GF	On-Demand	Anodyne	DRD4	42	35
COc1cc(CNC(=O)N2CCC(NC(=O)c3cccc(C)c3)CC2)ccc1O	ZINC000875051284	GF	On-Demand	Anodyne	DRD3	23	40
COc1cc(CNC(=O)N2CCC(NC(=O)c3cccc(C)c3)CC2)ccc1O	ZINC000875051284	GF	On-Demand	Anodyne	MAPK14	15	44
COc1cc(CNC(=O)N2CCC(NC(=O)c3cccc(C)c3)CC2)ccc1O	ZINC000875051284	GF	On-Demand	Anodyne	SSTR5	49	43
COc1cc(CNC(=O)N2CCC(NC(=O)c3cccc(C)c3)CC2)ccc1O	ZINC000875051284	GF	On-Demand	Anodyne	CCR2	23	49
COc1cc(CNC(=O)N2CCC(NC(=O)c3cccc(C)c3)CC2)ccc1O	ZINC000875051284	GF	On-Demand	Anodyne	EPHX2	20	41
COc1cc(CNC(=O)N2CCC(NC(=O)c3cccc(C)c3)CC2)ccc1O	ZINC000875051284	GF	On-Demand	Anodyne	MCHR1	23	45
COc1cc(CNC(=O)N2CCC(NC(=O)c3cccc(C)c3)CC2)ccc1O	ZINC000875051284	GF	On-Demand	Anodyne	KCNK3	47	37
COc1cc(CNC(=O)N2CCC(NC(=O)c3cccc(C)c3)CC2)ccc1O	ZINC000875051284	GF	On-Demand	Anodyne	KCNK9	40	37
C[C@H](NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)c1ccc(C#N)cc1	ZINC000875051286	GE	On-Demand	Mild	DPP4	18	41
C[C@H](NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)c1ccc(C#N)cc1	ZINC000875051287	GE	On-Demand	Mild	DPP4	18	41
C[C@H](NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)c1ccc(C#N)cc1	ZINC000875051288	GE	On-Demand	Mild	DPP4	18	41
C[C@H](NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)c1ccc(C#N)cc1	ZINC000875051289	GE	On-Demand	Mild	DPP4	18	41
C[C@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccc(C#N)cc1	ZINC000875051292	GC	On-Demand	Mild	L3MBTL3	50	41
CC(=O)Nc1cccc(CNC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875051299	FF	On-Demand	Anodyne	HTR1D	20	40
CC(=O)Nc1cccc(CNC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875051299	FF	On-Demand	Anodyne	HTR1B	21	40
CC(=O)Nc1cccc(CNC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875051299	FF	On-Demand	Anodyne	PTGIR	16	42
CC(=O)Nc1cccc(CNC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875051299	FF	On-Demand	Anodyne	ROCK2	15	43
CC(=O)Nc1cccc(CNC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875051299	FF	On-Demand	Anodyne	MCHR1	24	44
O=C(NCc1cccc(F)c1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875051311	GH	On-Demand	Anodyne	NAMPT	51	35
CN1CC[C@H]2CN(C(=O)C(=O)NCc3cccc(C#N)c3)CC[C@@H]21	ZINC000875051318	EC	On-Demand	Mild	CCR3	15	40
CN1CC[C@H]2CN(C(=O)C(=O)NCc3cccc(C#N)c3)CC[C@H]21	ZINC000875051320	EC	On-Demand	Mild	CCR3	15	40
COc1cc(CNC(=O)N2CCC[C@@H](C(C)=O)C2)ccc1O	ZINC000875051323	DD	On-Demand	Anodyne	TRPV1	17	47
C#CC[C@H](COC)NC(=O)NCc1ccc(O)c(OC)c1	ZINC000875051334	CD	On-Demand	Mild	TRPV1	23	47
C#CC[C@@H](COC)NC(=O)NCc1ccc(O)c(OC)c1	ZINC000875051335	CD	On-Demand	Mild	TRPV1	23	47
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2cccc(C#N)c2)C1	ZINC000875051343	DD	On-Demand	Mild	DPP7	27	52
CCCOc1ccc([C@@H](C)NC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875051344	FE	On-Demand	Anodyne	ACACA	27	55
CCCOc1ccc([C@@H](C)NC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875051344	FE	On-Demand	Anodyne	ACACB	27	55
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875051345	ED	On-Demand	Anodyne	NOS2	64	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2cccc(C#N)c2)C1	ZINC000875051346	DD	On-Demand	Mild	DPP7	27	52
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875051347	ED	On-Demand	Anodyne	NOS2	64	33
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875051348	FG	On-Demand	Anodyne	F2	39	44
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875051348	FG	On-Demand	Anodyne	TSHR	44	33
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875051348	FG	On-Demand	Anodyne	PREP	35	43
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875051348	FG	On-Demand	Anodyne	MCHR1	24	40
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875051348	FG	On-Demand	Anodyne	TMPRSS11D	54	34
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875051349	ED	On-Demand	Anodyne	NOS2	64	33
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875051350	FG	On-Demand	Anodyne	F2	39	44
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875051350	FG	On-Demand	Anodyne	TSHR	44	33
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875051350	FG	On-Demand	Anodyne	PREP	35	43
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875051350	FG	On-Demand	Anodyne	MCHR1	24	40
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875051350	FG	On-Demand	Anodyne	TMPRSS11D	54	34
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875051351	ED	On-Demand	Anodyne	NOS2	64	33
CCCOc1ccc([C@@H](C)NC(=O)C(=O)NCc2ncc(Cl)s2)cc1	ZINC000875051352	GG	On-Demand	Anodyne	ACACA	30	47
CCCOc1ccc([C@@H](C)NC(=O)C(=O)NCc2ncc(Cl)s2)cc1	ZINC000875051352	GG	On-Demand	Anodyne	ACACB	32	47
CCCOc1ccc([C@H](C)NC(=O)C(=O)NCc2ncc(Cl)s2)cc1	ZINC000875051353	GG	On-Demand	Anodyne	ACACA	30	47
CCCOc1ccc([C@H](C)NC(=O)C(=O)NCc2ncc(Cl)s2)cc1	ZINC000875051353	GG	On-Demand	Anodyne	ACACB	32	47
CCCOc1ccc([C@@H](C)NC(=O)C(=O)NCc2nn(C)cc2C(F)F)cc1	ZINC000875051361	GF	On-Demand	Anodyne	ACACA	18	44
CCCOc1ccc([C@@H](C)NC(=O)C(=O)NCc2nn(C)cc2C(F)F)cc1	ZINC000875051361	GF	On-Demand	Anodyne	ACACB	20	44
CCCOc1ccc([C@H](C)NC(=O)C(=O)NCc2nn(C)cc2C(F)F)cc1	ZINC000875051362	GF	On-Demand	Anodyne	ACACA	18	44
CCCOc1ccc([C@H](C)NC(=O)C(=O)NCc2nn(C)cc2C(F)F)cc1	ZINC000875051362	GF	On-Demand	Anodyne	ACACB	20	44
CCOCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875051363	EF	On-Demand	Reactive	ALOX5	15	46
CCOCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875051363	EF	On-Demand	Reactive	TSHR	41	32
CCOCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875051363	EF	On-Demand	Reactive	MAOB	28	41
CCOCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875051363	EF	On-Demand	Reactive	LTA4H	40	48
CCOCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875051363	EF	On-Demand	Reactive	SCN2A	20	45
CCOCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875051363	EF	On-Demand	Reactive	FFAR1	43	42
CCOc1ccccc1[C@H](C)NC(=O)C(=O)NCC1(OC(C)C)CCC1	ZINC000875051373	FF	On-Demand	Anodyne	HCN1	71	41
CCOc1ccccc1[C@H](C)NC(=O)C(=O)NCC1(OC(C)C)CCC1	ZINC000875051373	FF	On-Demand	Anodyne	HCN4	58	41
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)NCC1(OC(C)C)CCC1	ZINC000875051374	FF	On-Demand	Anodyne	HCN1	71	41
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)NCC1(OC(C)C)CCC1	ZINC000875051374	FF	On-Demand	Anodyne	HCN4	58	41
COC(=O)C1(O)CN(C(=O)NCc2ccc(F)cc2C(F)(F)F)C1	ZINC000875051400	FD	On-Demand	Anodyne	P2RX7	46	50
CCOCCNC(=O)N[C@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875051401	ED	On-Demand	Anodyne	MTNR1A	51	44
CCOCCNC(=O)N[C@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875051401	ED	On-Demand	Anodyne	MTNR1B	43	44
CCOCCNC(=O)N[C@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875051402	ED	On-Demand	Anodyne	MTNR1A	51	44
CCOCCNC(=O)N[C@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875051402	ED	On-Demand	Anodyne	MTNR1B	43	44
CCOCCNC(=O)N[C@@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875051403	ED	On-Demand	Anodyne	MTNR1A	51	44
CCOCCNC(=O)N[C@@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875051403	ED	On-Demand	Anodyne	MTNR1B	43	44
CCOCCNC(=O)N[C@@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875051404	ED	On-Demand	Anodyne	MTNR1A	51	44
CCOCCNC(=O)N[C@@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875051404	ED	On-Demand	Anodyne	MTNR1B	43	44
CCCOc1ccc([C@@H](C)NC(=O)C(=O)NCC[C@H]2CCSC2)cc1	ZINC000875051405	FF	On-Demand	Anodyne	ACACA	21	49
CCCOc1ccc([C@@H](C)NC(=O)C(=O)NCC[C@H]2CCSC2)cc1	ZINC000875051405	FF	On-Demand	Anodyne	ACACB	22	49
CCCOc1ccc([C@H](C)NC(=O)C(=O)NCC[C@H]2CCSC2)cc1	ZINC000875051407	FF	On-Demand	Anodyne	ACACA	21	49
CCCOc1ccc([C@H](C)NC(=O)C(=O)NCC[C@H]2CCSC2)cc1	ZINC000875051407	FF	On-Demand	Anodyne	ACACB	22	49
CCCOc1ccc([C@@H](C)NC(=O)C(=O)NCC[C@@H]2CCSC2)cc1	ZINC000875051409	FF	On-Demand	Anodyne	ACACA	21	49
CCCOc1ccc([C@@H](C)NC(=O)C(=O)NCC[C@@H]2CCSC2)cc1	ZINC000875051409	FF	On-Demand	Anodyne	ACACB	22	49
CCCOc1ccc([C@H](C)NC(=O)C(=O)NCC[C@@H]2CCSC2)cc1	ZINC000875051411	FF	On-Demand	Anodyne	ACACA	21	49
CCCOc1ccc([C@H](C)NC(=O)C(=O)NCC[C@@H]2CCSC2)cc1	ZINC000875051411	FF	On-Demand	Anodyne	ACACB	22	49
CC[C@H](C[C@H](C)O)NC(=O)NCCCn1cncn1	ZINC000875051423	CC	On-Demand	Anodyne	HIS3	76	37
CCOCCNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875051432	DD	On-Demand	Mild	ITK	19	52
CCOCCNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875051432	DD	On-Demand	Mild	PANC	45	35
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(C(=O)C(C)(C)C)CC3)C[C@@H]1C2	ZINC000875051443	FD	On-Demand	Anodyne	EPHX2	27	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC(C)C)cc1	ZINC000875051455	EF	On-Demand	Anodyne	SLC6A4	32	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC(C)C)cc1	ZINC000875051455	EF	On-Demand	Anodyne	SLC6A3	63	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC(C)C)cc1	ZINC000875051457	EF	On-Demand	Anodyne	SLC6A4	32	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC(C)C)cc1	ZINC000875051457	EF	On-Demand	Anodyne	SLC6A3	63	42
COc1ccccc1[C@H]1CCCN(C(=O)Nc2ccc(OCC(N)=O)cc2)CC1	ZINC000875051473	GG	On-Demand	Anodyne	TSHR	49	33
COc1ccccc1[C@H]1CCCN(C(=O)Nc2ccc(OCC(N)=O)cc2)CC1	ZINC000875051473	GG	On-Demand	Anodyne	PDGFRB	53	43
COc1ccccc1[C@H]1CCCN(C(=O)Nc2ccc(OCC(N)=O)cc2)CC1	ZINC000875051473	GG	On-Demand	Anodyne	EPHX2	27	41
COc1ccccc1[C@H]1CCCN(C(=O)Nc2ccc(OCC(N)=O)cc2)CC1	ZINC000875051473	GG	On-Demand	Anodyne	RBP4	34	42
COc1ccccc1[C@@H]1CCCN(C(=O)Nc2ccc(OCC(N)=O)cc2)CC1	ZINC000875051474	GG	On-Demand	Anodyne	TSHR	49	33
COc1ccccc1[C@@H]1CCCN(C(=O)Nc2ccc(OCC(N)=O)cc2)CC1	ZINC000875051474	GG	On-Demand	Anodyne	PDGFRB	53	43
COc1ccccc1[C@@H]1CCCN(C(=O)Nc2ccc(OCC(N)=O)cc2)CC1	ZINC000875051474	GG	On-Demand	Anodyne	EPHX2	27	41
COc1ccccc1[C@@H]1CCCN(C(=O)Nc2ccc(OCC(N)=O)cc2)CC1	ZINC000875051474	GG	On-Demand	Anodyne	RBP4	34	42
CCO[C@@H](C(=O)Nc1cc(S(C)(=O)=O)ccc1F)C1CCOCC1	ZINC000875051479	FD	On-Demand	Anodyne	LEF	18	43
NC(=O)COc1ccc(NC(=O)N2CCC[C@@](F)(c3ccccc3)C2)cc1	ZINC000875051482	FG	On-Demand	Anodyne	EPHX2	46	53
NC(=O)COc1ccc(NC(=O)N2CCC[C@](F)(c3ccccc3)C2)cc1	ZINC000875051483	FG	On-Demand	Anodyne	EPHX2	46	53
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCn1cncn1	ZINC000875051493	DC	On-Demand	Anodyne	SLC6A3	40	38
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@]12CCC[C@@]1(OC)OCC2	ZINC000875051502	EE	On-Demand	Bother	KCNMA1	21	48
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1cc([N+](=O)[O-])ccc1OC	ZINC000875051532	EG	On-Demand	Bother	CA14	19	43
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1cc([N+](=O)[O-])ccc1OC	ZINC000875051532	EG	On-Demand	Bother	KCNMA1	21	48
NC(=O)COc1ccc(NC(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)cc1	ZINC000875051546	FF	On-Demand	Anodyne	EPHX2	48	44
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875051547	FG	On-Demand	Anodyne	F2	39	44
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875051547	FG	On-Demand	Anodyne	TSHR	44	33
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875051547	FG	On-Demand	Anodyne	PREP	35	43
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875051547	FG	On-Demand	Anodyne	MCHR1	24	40
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875051547	FG	On-Demand	Anodyne	TMPRSS11D	54	34
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875051548	FG	On-Demand	Anodyne	F2	39	44
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875051548	FG	On-Demand	Anodyne	TSHR	44	33
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875051548	FG	On-Demand	Anodyne	PREP	35	43
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875051548	FG	On-Demand	Anodyne	MCHR1	24	40
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875051548	FG	On-Demand	Anodyne	TMPRSS11D	54	34
CCC(CC)(CNC(=O)NCc1ccc(O)c(OC)c1)C(F)(F)F	ZINC000875051549	EH	On-Demand	Anodyne	TRPV1	27	53
CCC(CC)(CNC(=O)NCc1ccc(O)c(OC)c1)C(F)(F)F	ZINC000875051549	EH	On-Demand	Anodyne	MT-ND1	18	40
CCOC1CC2(C1)C[C@@H]2NC(=O)NCc1ccc(O)c(OC)c1	ZINC000875051563	DE	On-Demand	Anodyne	TRPV1	15	52
CCOC1CC2(C1)C[C@H]2NC(=O)NCc1ccc(O)c(OC)c1	ZINC000875051564	DE	On-Demand	Anodyne	TRPV1	15	52
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H](C)c1ccc(C#N)cc1	ZINC000875051569	ED	On-Demand	Mild	CTRB_BOVIN	44	32
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H](C)c1ccc(C#N)cc1	ZINC000875051570	ED	On-Demand	Mild	CTRB_BOVIN	44	32
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](C)c1ccc(C#N)cc1	ZINC000875051571	ED	On-Demand	Mild	CTRB_BOVIN	44	32
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](C)c1ccc(C#N)cc1	ZINC000875051572	ED	On-Demand	Mild	CTRB_BOVIN	44	32
CC[C@@H](NC(=O)C(=O)NCc1ncc(Cl)s1)c1cccc(Cl)c1	ZINC000875051573	FG	On-Demand	Anodyne	PDS	67	39
CC[C@@H](NC(=O)NCc1ccc(O)c(OC)c1)[C@H](O)c1ccccc1	ZINC000875051575	EF	On-Demand	Anodyne	TRPV1	19	48
CC[C@@H](NC(=O)NCc1ccc(O)c(OC)c1)[C@H](O)c1ccccc1	ZINC000875051575	EF	On-Demand	Anodyne	NCE103	15	40
CC[C@@H](NC(=O)NCc1ccc(O)c(OC)c1)[C@H](O)c1ccccc1	ZINC000875051575	EF	On-Demand	Anodyne	MTCA1	15	40
CC[C@@H](NC(=O)NCc1ccc(O)c(OC)c1)[C@H](O)c1ccccc1	ZINC000875051575	EF	On-Demand	Anodyne	PDS	42	34
CC[C@@H](NC(=O)NCc1ccc(O)c(OC)c1)[C@@H](O)c1ccccc1	ZINC000875051577	EF	On-Demand	Anodyne	TRPV1	19	48
CC[C@@H](NC(=O)NCc1ccc(O)c(OC)c1)[C@@H](O)c1ccccc1	ZINC000875051577	EF	On-Demand	Anodyne	NCE103	15	40
CC[C@@H](NC(=O)NCc1ccc(O)c(OC)c1)[C@@H](O)c1ccccc1	ZINC000875051577	EF	On-Demand	Anodyne	MTCA1	15	40
CC[C@@H](NC(=O)NCc1ccc(O)c(OC)c1)[C@@H](O)c1ccccc1	ZINC000875051577	EF	On-Demand	Anodyne	PDS	42	34
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(O)c(OC)c1	ZINC000875051584	ED	On-Demand	Anodyne	SLC6A3	48	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(O)c(OC)c1	ZINC000875051585	ED	On-Demand	Anodyne	SLC6A3	48	38
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)c1	ZINC000875051598	FF	On-Demand	Anodyne	EPHX2	18	50
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)c1	ZINC000875051598	FF	On-Demand	Anodyne	SLC12A5	54	33
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@](O)(c3ccccc3)C2)c1	ZINC000875051599	FF	On-Demand	Anodyne	EPHX2	18	50
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@](O)(c3ccccc3)C2)c1	ZINC000875051599	FF	On-Demand	Anodyne	SLC12A5	54	33
COc1cc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)ccc1O	ZINC000875051616	DE	On-Demand	Anodyne	TRPV1	22	48
COc1cc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)ccc1O	ZINC000875051620	FG	On-Demand	Anodyne	FKBP1A	81	38
COc1cc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)ccc1O	ZINC000875051620	FG	On-Demand	Anodyne	PDE4A	16	40
COc1cc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)ccc1O	ZINC000875051620	FG	On-Demand	Anodyne	BCHE	19	46
COc1cc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)ccc1O	ZINC000875051620	FG	On-Demand	Anodyne	CCR5	16	41
COc1cc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)ccc1O	ZINC000875051620	FG	On-Demand	Anodyne	MTNR1B	15	40
COc1cc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)ccc1O	ZINC000875051621	FG	On-Demand	Anodyne	FKBP1A	81	38
COc1cc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)ccc1O	ZINC000875051621	FG	On-Demand	Anodyne	PDE4A	16	40
COc1cc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)ccc1O	ZINC000875051621	FG	On-Demand	Anodyne	BCHE	19	46
COc1cc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)ccc1O	ZINC000875051621	FG	On-Demand	Anodyne	CCR5	16	41
COc1cc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)ccc1O	ZINC000875051621	FG	On-Demand	Anodyne	MTNR1B	15	40
COc1cc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)ccc1O	ZINC000875051622	FG	On-Demand	Anodyne	FKBP1A	81	38
COc1cc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)ccc1O	ZINC000875051622	FG	On-Demand	Anodyne	PDE4A	16	40
COc1cc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)ccc1O	ZINC000875051622	FG	On-Demand	Anodyne	BCHE	19	46
COc1cc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)ccc1O	ZINC000875051622	FG	On-Demand	Anodyne	CCR5	16	41
COc1cc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)ccc1O	ZINC000875051622	FG	On-Demand	Anodyne	MTNR1B	15	40
COc1cc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)ccc1O	ZINC000875051623	FG	On-Demand	Anodyne	FKBP1A	81	38
COc1cc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)ccc1O	ZINC000875051623	FG	On-Demand	Anodyne	PDE4A	16	40
COc1cc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)ccc1O	ZINC000875051623	FG	On-Demand	Anodyne	BCHE	19	46
COc1cc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)ccc1O	ZINC000875051623	FG	On-Demand	Anodyne	CCR5	16	41
COc1cc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)ccc1O	ZINC000875051623	FG	On-Demand	Anodyne	MTNR1B	15	40
CCOC(=O)[C@@H]1CN(C(=O)NCc2ccc(O)c(OC)c2)C[C@H]1C(F)(F)F	ZINC000875051624	GE	On-Demand	Anodyne	TRPV1	20	44
CC(=O)Nc1cccc(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000875051630	GF	On-Demand	Anodyne	ROCK2	16	45
CC(=O)Nc1cccc(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000875051630	GF	On-Demand	Anodyne	PDS	48	38
CC(=O)Nc1cccc(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000875051631	GF	On-Demand	Anodyne	ROCK2	16	45
CC(=O)Nc1cccc(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000875051631	GF	On-Demand	Anodyne	PDS	48	38
COCCN(CC1CCN(C)CC1)C(=O)NCc1cccc(F)c1	ZINC000875051633	EE	On-Demand	Anodyne	ACKR3	65	36
COc1cc(CNC(=O)N2CCC(C(C)=O)CC2)ccc1O	ZINC000875051639	DD	On-Demand	Anodyne	TRPV1	17	48
COc1cc(CNC(=O)N2CCC(C(C)=O)CC2)ccc1O	ZINC000875051639	DD	On-Demand	Anodyne	MTNR1B	17	46
COc1cc(CNC(=O)N2CCC(C(C)=O)CC2)ccc1O	ZINC000875051639	DD	On-Demand	Anodyne	EPHX2	17	41
CC(=O)Nc1cccc(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)c1	ZINC000875051641	DE	On-Demand	Anodyne	ROCK2	15	44
CC(=O)Nc1cccc(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)c1	ZINC000875051643	DE	On-Demand	Anodyne	ROCK2	15	44
CC(=O)Nc1cccc(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)c1	ZINC000875051645	DE	On-Demand	Anodyne	ROCK2	15	44
CC(=O)Nc1cccc(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)c1	ZINC000875051646	DE	On-Demand	Anodyne	ROCK2	15	44
CC(=O)Nc1cccc(CNC(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)c1	ZINC000875051647	FG	On-Demand	Anodyne	ROCK2	15	43
O=C(NCc1cccc(F)c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875051648	EG	On-Demand	Anodyne	F2	39	44
O=C(NCc1cccc(F)c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875051648	EG	On-Demand	Anodyne	DPP4	16	42
O=C(NCc1cccc(F)c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875051648	EG	On-Demand	Anodyne	PREP	40	45
O=C(NCc1cccc(F)c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875051648	EG	On-Demand	Anodyne	TMPRSS11D	60	34
O=C(NCc1cccc(F)c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875051649	EG	On-Demand	Anodyne	F2	39	44
O=C(NCc1cccc(F)c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875051649	EG	On-Demand	Anodyne	DPP4	16	42
O=C(NCc1cccc(F)c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875051649	EG	On-Demand	Anodyne	PREP	40	45
O=C(NCc1cccc(F)c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875051649	EG	On-Demand	Anodyne	TMPRSS11D	60	34
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)CCc2ccc3c(c2)OCO3)CC1	ZINC000875051665	FD	On-Demand	Anodyne	BMP1	48	37
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)CCc2ccc3c(c2)OCO3)CC1	ZINC000875051665	FD	On-Demand	Anodyne	NOS2	96	38
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)CCc2ccc3c(c2)OCO3)CC1	ZINC000875051665	FD	On-Demand	Anodyne	MCHR1	22	41
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)CCc2ccc3c(c2)OCO3)CC1	ZINC000875051666	FD	On-Demand	Anodyne	BMP1	48	37
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)CCc2ccc3c(c2)OCO3)CC1	ZINC000875051666	FD	On-Demand	Anodyne	NOS2	96	38
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)CCc2ccc3c(c2)OCO3)CC1	ZINC000875051666	FD	On-Demand	Anodyne	MCHR1	22	41
NC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875051669	CD	On-Demand	Anodyne	HRH2	19	46
NC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875051669	CD	On-Demand	Anodyne	SCNN1A	79	45
NC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875051669	CD	On-Demand	Anodyne	MME	15	40
NC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875051669	CD	On-Demand	Anodyne	SIGMAR1	19	50
NC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875051669	CD	On-Demand	Anodyne	SCN2A	19	48
NC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875051669	CD	On-Demand	Anodyne	NPFFR2	45	33
NC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875051669	CD	On-Demand	Anodyne	S1PR3	19	45
NC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875051669	CD	On-Demand	Anodyne	MTNR1A	22	42
NC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875051669	CD	On-Demand	Anodyne	MTNR1B	25	42
NC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875051669	CD	On-Demand	Anodyne	GRIA1	18	48
NC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875051669	CD	On-Demand	Anodyne	HDAC1	15	45
NC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875051669	CD	On-Demand	Anodyne	FAAH	77	47
NC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875051669	CD	On-Demand	Anodyne	FURIN	43	36
NC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875051669	CD	On-Demand	Anodyne	S1PR2	23	45
NC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875051669	CD	On-Demand	Anodyne	SLC6A5	22	42
NC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875051669	CD	On-Demand	Anodyne	CES1	78	45
NC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875051669	CD	On-Demand	Anodyne	EPHX2	16	46
NC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875051669	CD	On-Demand	Anodyne	AMP1_PLAFQ	31	48
NC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875051669	CD	On-Demand	Anodyne	POLG_WNV	42	34
NC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875051669	CD	On-Demand	Anodyne	PAO	15	41
NC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875051669	CD	On-Demand	Anodyne	NPFFR1	62	33
NC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875051669	CD	On-Demand	Anodyne	CES1D	45	32
CCOCCNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875051674	DD	On-Demand	Anodyne	FAAH	17	41
C[Si](C)(C)c1ccc(CCNC(=O)NCCC(N)=O)cc1	ZINC000875051677	DC	On-Demand	Anodyne	CA1	15	40
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)NCc1ncc(Cl)s1	ZINC000875051678	GE	On-Demand	Anodyne	NOS2	96	37
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)NCc1ncc(Cl)s1	ZINC000875051679	GE	On-Demand	Anodyne	NOS2	96	37
CNC(=O)CNC(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875051690	DD	On-Demand	Anodyne	CCR2	43	37
O=C(NCc1ccc(F)cc1C(F)(F)F)N1CCC(CO)(CO)CC1	ZINC000875051698	FE	On-Demand	Anodyne	P2RX7	38	49
O=C(NCc1ccc(F)cc1C(F)(F)F)N1CCC(CO)(CO)CC1	ZINC000875051698	FE	On-Demand	Anodyne	EPHX2	17	43
COc1ccc([C@@H]2CN(C(=O)Nc3ccc(F)c(C(N)=O)c3)CCO2)cc1	ZINC000875051699	FF	On-Demand	Anodyne	STAT6	44	33
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875051701	ED	On-Demand	Anodyne	HCN1	61	38
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875051701	ED	On-Demand	Anodyne	HCN4	50	37
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875051702	ED	On-Demand	Anodyne	HCN1	61	38
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875051702	ED	On-Demand	Anodyne	HCN4	50	37
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875051703	ED	On-Demand	Anodyne	HCN1	61	38
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875051703	ED	On-Demand	Anodyne	HCN4	50	37
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875051704	ED	On-Demand	Anodyne	HCN1	61	38
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875051704	ED	On-Demand	Anodyne	HCN4	50	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(NC(C)=O)c1	ZINC000875051728	ED	On-Demand	Anodyne	SLC6A3	53	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(NC(C)=O)c1	ZINC000875051730	ED	On-Demand	Anodyne	SLC6A3	53	42
O=C(NCCCn1cncn1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875051733	ED	On-Demand	Anodyne	FAAH	15	40
CN1CCN(c2ccccc2NC(=O)c2c(Cl)nn(C)c2Cl)CC1	ZINC000875051755	FF	On-Demand	Anodyne	DRD1	47	38
CN1CCN(c2ccccc2NC(=O)c2c(Cl)nn(C)c2Cl)CC1	ZINC000875051755	FF	On-Demand	Anodyne	KCNQ2	76	42
CN1CCN(c2ccccc2NC(=O)c2c(Cl)nn(C)c2Cl)CC1	ZINC000875051755	FF	On-Demand	Anodyne	CSF1R	18	50
CN1CCN(c2ccccc2NC(=O)c2c(Cl)nn(C)c2Cl)CC1	ZINC000875051755	FF	On-Demand	Anodyne	CHEK1	15	41
COc1ccc([N+](=O)[O-])cc1NC(=O)C1(OC(C)C)CCC1	ZINC000875051775	DF	On-Demand	Bother	KCNMA1	22	51
CCC[C@H](CC)C(=O)Nc1cc([N+](=O)[O-])ccc1OC	ZINC000875051785	CG	On-Demand	Bother	KCNMA1	23	54
CCC[C@@H](CC)C(=O)Nc1cc([N+](=O)[O-])ccc1OC	ZINC000875051786	CG	On-Demand	Bother	KCNMA1	23	54
C[C@H](NC(=O)C(=O)N1CCC(CO)(CO)CC1)c1cc(F)ccc1F	ZINC000875051788	FC	On-Demand	Anodyne	CACNA1H	40	36
Cc1cncc([C@@H]2CCCN2C(=O)Nc2ccc(OCC(N)=O)cc2)c1	ZINC000875051806	FF	On-Demand	Anodyne	UL80	30	40
Cc1cncc([C@@H]2CCCN2C(=O)Nc2ccc(OCC(N)=O)cc2)c1	ZINC000875051806	FF	On-Demand	Anodyne	CPT1A	88	40
Cc1cncc([C@H]2CCCN2C(=O)Nc2ccc(OCC(N)=O)cc2)c1	ZINC000875051807	FF	On-Demand	Anodyne	UL80	30	40
Cc1cncc([C@H]2CCCN2C(=O)Nc2ccc(OCC(N)=O)cc2)c1	ZINC000875051807	FF	On-Demand	Anodyne	CPT1A	88	40
CN1CCN(C(=O)Nc2ccc(OCC(N)=O)cc2)CCC1(C)C	ZINC000875051808	ED	On-Demand	Anodyne	PDGFRB	53	38
CN1CCN(C(=O)Nc2ccc(OCC(N)=O)cc2)CCC1(C)C	ZINC000875051808	ED	On-Demand	Anodyne	EPHX2	38	40
NC(=O)COc1ccc(NC(=O)NCC[C@@H]2CCSC2)cc1	ZINC000875051813	DD	On-Demand	Anodyne	PRMT3	24	40
NC(=O)COc1ccc(NC(=O)NCC[C@H]2CCSC2)cc1	ZINC000875051814	DD	On-Demand	Anodyne	PRMT3	24	40
COc1ccc([N+](=O)[O-])cc1NC(=O)C1([C@@H]2CCCCO2)CCOCC1	ZINC000875051819	FF	On-Demand	Bother	KCNMA1	20	45
COc1ccc([N+](=O)[O-])cc1NC(=O)C1([C@H]2CCCCO2)CCOCC1	ZINC000875051820	FF	On-Demand	Bother	KCNMA1	20	45
CC(C)(C)C(=O)N1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)CC1	ZINC000875051839	EE	On-Demand	Anodyne	EPHX2	28	41
CC(C)(C)C(=O)N1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)CC1	ZINC000875051840	EE	On-Demand	Anodyne	EPHX2	28	41
CC(C)(C)C(=O)N1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)CC1	ZINC000875051841	EE	On-Demand	Anodyne	EPHX2	28	41
CC(C)(C)C(=O)N1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)CC1	ZINC000875051842	EE	On-Demand	Anodyne	EPHX2	28	41
NC(=O)COc1ccc(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)cc1	ZINC000875051843	GD	On-Demand	Anodyne	LTA4H	39	41
NC(=O)COc1ccc(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)cc1	ZINC000875051843	GD	On-Demand	Anodyne	PLA2G2A	45	33
NC(=O)COc1ccc(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)cc1	ZINC000875051843	GD	On-Demand	Anodyne	FAAH	33	51
NC(=O)COc1ccc(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)cc1	ZINC000875051843	GD	On-Demand	Anodyne	NOD2	41	38
O=C(NCc1cccc(F)c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875051847	EG	On-Demand	Anodyne	F2	39	44
O=C(NCc1cccc(F)c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875051847	EG	On-Demand	Anodyne	DPP4	16	42
O=C(NCc1cccc(F)c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875051847	EG	On-Demand	Anodyne	PREP	40	45
O=C(NCc1cccc(F)c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875051847	EG	On-Demand	Anodyne	TMPRSS11D	60	34
O=C(NCc1cccc(F)c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875051848	EG	On-Demand	Anodyne	F2	39	44
O=C(NCc1cccc(F)c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875051848	EG	On-Demand	Anodyne	DPP4	16	42
O=C(NCc1cccc(F)c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875051848	EG	On-Demand	Anodyne	PREP	40	45
O=C(NCc1cccc(F)c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875051848	EG	On-Demand	Anodyne	TMPRSS11D	60	34
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](CC)c1cccc(Cl)c1	ZINC000875051849	EE	On-Demand	Mild	PDS	58	42
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](CC)c1cccc(Cl)c1	ZINC000875051850	EE	On-Demand	Mild	PDS	58	42
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](CC)c1cccc(Cl)c1	ZINC000875051851	EE	On-Demand	Mild	PDS	58	42
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](CC)c1cccc(Cl)c1	ZINC000875051852	EE	On-Demand	Mild	PDS	58	42
COCC(C)(C)CCNC(=O)NCc1ccc(O)c(OC)c1	ZINC000875051862	DE	On-Demand	Anodyne	TRPV1	30	53
COCC(C)(C)CCNC(=O)NCc1ccc(O)c(OC)c1	ZINC000875051862	DE	On-Demand	Anodyne	MT-ND1	23	40
COCC(C)(C)CCNC(=O)NCc1ccc(O)c(OC)c1	ZINC000875051862	DE	On-Demand	Anodyne	NCE103	15	40
COc1cc(CNC(=O)N2CC3(CC(=O)N3Cc3ccccc3)C2)ccc1O	ZINC000875051863	GE	On-Demand	Anodyne	TSHR	49	33
COc1cc(CNC(=O)N2CCCN(C=O)CC2)ccc1O	ZINC000875051864	DC	On-Demand	Anodyne	BCHE	16	45
CC(=O)Nc1cccc(CNC(=O)N(C)OCC(F)(F)F)c1	ZINC000875051875	DE	On-Demand	Anodyne	ROCK2	17	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(F)c1	ZINC000875051881	CE	On-Demand	Anodyne	ANPEP	21	62
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(F)c1	ZINC000875051881	CE	On-Demand	Anodyne	PDS	57	44
O=C(NCCO)C1CCN(C(=O)NCc2cccc(F)c2)CC1	ZINC000875051885	DC	On-Demand	Anodyne	EPHX2	27	45
O=C(NCCO)C1CCN(C(=O)NCc2cccc(F)c2)CC1	ZINC000875051885	DC	On-Demand	Anodyne	CACNA1G	37	46
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CC[C@H]2[C@H](CCN2C)C1	ZINC000875051949	FD	On-Demand	Anodyne	HCN1	51	34
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CC[C@H]2[C@H](CCN2C)C1	ZINC000875051949	FD	On-Demand	Anodyne	HCN4	43	34
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CC[C@@H]2[C@@H](CCN2C)C1	ZINC000875051950	FD	On-Demand	Anodyne	HCN1	51	34
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CC[C@@H]2[C@@H](CCN2C)C1	ZINC000875051950	FD	On-Demand	Anodyne	HCN4	43	34
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CC[C@@H]2[C@H](CCN2C)C1	ZINC000875051951	FD	On-Demand	Anodyne	HCN1	51	34
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CC[C@@H]2[C@H](CCN2C)C1	ZINC000875051951	FD	On-Demand	Anodyne	HCN4	43	34
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CC[C@H]2[C@@H](CCN2C)C1	ZINC000875051952	FD	On-Demand	Anodyne	HCN1	51	34
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CC[C@H]2[C@@H](CCN2C)C1	ZINC000875051952	FD	On-Demand	Anodyne	HCN4	43	34
CCOCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875051956	DG	On-Demand	Anodyne	DRD2	26	46
CCOCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875051956	DG	On-Demand	Anodyne	RBP4	29	40
CCOCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875051957	DG	On-Demand	Anodyne	DRD2	26	46
CCOCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875051957	DG	On-Demand	Anodyne	RBP4	29	40
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(F)cc1C(F)(F)F	ZINC000875051961	EG	On-Demand	Anodyne	P2RX7	34	46
CCC1(CC)CCCN1C(=O)NCc1cccc(NC(C)=O)c1	ZINC000875051966	DH	On-Demand	Anodyne	MCHR1	25	40
CCC1(CC)CCCN1C(=O)NCc1cccc(NC(C)=O)c1	ZINC000875051966	DH	On-Demand	Anodyne	SLC12A5	62	34
CCOc1ccccc1[C@H](C)NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1	ZINC000875051969	GF	On-Demand	Anodyne	HCN1	49	34
CCOc1ccccc1[C@H](C)NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1	ZINC000875051969	GF	On-Demand	Anodyne	HCN4	43	34
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1	ZINC000875051970	GF	On-Demand	Anodyne	HCN1	49	34
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1	ZINC000875051970	GF	On-Demand	Anodyne	HCN4	43	34
O=CN1CCCN(C(=O)NCc2ccc(F)cc2C(F)(F)F)CC1	ZINC000875051973	EE	On-Demand	Anodyne	P2RX7	29	48
O=CN1CCCN(C(=O)NCc2ccc(F)cc2C(F)(F)F)CC1	ZINC000875051973	EE	On-Demand	Anodyne	EPHX2	15	42
O=C(NCc1ccc(F)cc1C(F)(F)F)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875051986	FH	On-Demand	Anodyne	P2RX7	44	52
CCOCCNC(=O)NC1CC(C(=O)OC)C1	ZINC000875051990	BC	On-Demand	Anodyne	EPHX2	15	50
CN1CCC(CNC(=O)NCCC(N)=O)(c2ccccc2)CC1	ZINC000875051993	DC	On-Demand	Anodyne	KCNA3	49	40
CN1CCC(CNC(=O)NCCC(N)=O)(c2ccccc2)CC1	ZINC000875051993	DC	On-Demand	Anodyne	SOAT1	18	45
CN1CCC(CNC(=O)NCCC(N)=O)(c2ccccc2)CC1	ZINC000875051993	DC	On-Demand	Anodyne	NPFFR1	39	47
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)NC[C@H]1c2ccccc2CN1C	ZINC000875052000	GF	On-Demand	Anodyne	HCN1	56	38
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)NC[C@H]1c2ccccc2CN1C	ZINC000875052000	GF	On-Demand	Anodyne	HCN4	42	35
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)NC[C@@H]1c2ccccc2CN1C	ZINC000875052001	GF	On-Demand	Anodyne	HCN1	56	38
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)NC[C@@H]1c2ccccc2CN1C	ZINC000875052001	GF	On-Demand	Anodyne	HCN4	42	35
CCOc1ccccc1[C@H](C)NC(=O)C(=O)NC[C@@H]1c2ccccc2CN1C	ZINC000875052002	GF	On-Demand	Anodyne	HCN1	56	38
CCOc1ccccc1[C@H](C)NC(=O)C(=O)NC[C@@H]1c2ccccc2CN1C	ZINC000875052002	GF	On-Demand	Anodyne	HCN4	42	35
CCOc1ccccc1[C@H](C)NC(=O)C(=O)NC[C@H]1c2ccccc2CN1C	ZINC000875052003	GF	On-Demand	Anodyne	HCN1	56	38
CCOc1ccccc1[C@H](C)NC(=O)C(=O)NC[C@H]1c2ccccc2CN1C	ZINC000875052003	GF	On-Demand	Anodyne	HCN4	42	35
CC(=O)Nc1cccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875052004	DD	On-Demand	Anodyne	CCR3	42	38
CC(=O)Nc1cccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875052004	DD	On-Demand	Anodyne	EPHX2	23	40
CC(=O)Nc1cccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875052005	DD	On-Demand	Anodyne	CCR3	42	38
CC(=O)Nc1cccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875052005	DD	On-Demand	Anodyne	EPHX2	23	40
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875052006	EF	On-Demand	Anodyne	HCN1	48	34
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875052006	EF	On-Demand	Anodyne	HCN4	40	34
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875052007	EF	On-Demand	Anodyne	HCN1	48	34
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875052007	EF	On-Demand	Anodyne	HCN4	40	34
COC(=O)N(C)NC(=O)NCc1ccc(F)cc1C(F)(F)F	ZINC000875052017	DE	On-Demand	Reactive	P2RX7	43	47
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875052021	FC	On-Demand	Anodyne	HCN1	69	40
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875052021	FC	On-Demand	Anodyne	HCN4	55	40
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875052022	FC	On-Demand	Anodyne	HCN1	69	40
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875052022	FC	On-Demand	Anodyne	HCN4	55	40
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875052026	GG	On-Demand	Anodyne	HCN1	51	35
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875052026	GG	On-Demand	Anodyne	HCN4	44	35
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875052027	GG	On-Demand	Anodyne	HCN1	51	35
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875052027	GG	On-Demand	Anodyne	HCN4	44	35
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875052028	GG	On-Demand	Anodyne	HCN1	51	35
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875052028	GG	On-Demand	Anodyne	HCN4	44	35
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875052029	GG	On-Demand	Anodyne	HCN1	51	35
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875052029	GG	On-Demand	Anodyne	HCN4	44	35
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875052034	DE	On-Demand	Anodyne	HCN1	60	37
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875052034	DE	On-Demand	Anodyne	HCN4	53	37
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875052035	DE	On-Demand	Anodyne	HCN1	60	37
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875052035	DE	On-Demand	Anodyne	HCN4	53	37
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875052036	DE	On-Demand	Anodyne	HCN1	60	37
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875052036	DE	On-Demand	Anodyne	HCN4	53	37
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875052037	DE	On-Demand	Anodyne	HCN1	60	37
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875052037	DE	On-Demand	Anodyne	HCN4	53	37
CCO[C@@H](C(=O)Nc1cc(S(C)(=O)=O)ccc1F)C1CCCC1	ZINC000875052046	EF	On-Demand	Anodyne	TRPV1	48	34
CCO[C@@H](C(=O)Nc1cc(S(C)(=O)=O)ccc1F)C1CCCC1	ZINC000875052046	EF	On-Demand	Anodyne	LEF	23	41
NC(=O)COc1ccc(NC(=O)NCC[C@H]2CCCS2)cc1	ZINC000875052050	DD	On-Demand	Anodyne	PRMT3	24	40
NC(=O)COc1ccc(NC(=O)NCC[C@@H]2CCCS2)cc1	ZINC000875052051	DD	On-Demand	Anodyne	PRMT3	24	40
COc1ccc([N+](=O)[O-])cc1NC(=O)c1cnn(C(C)C)c1Br	ZINC000875052070	GG	On-Demand	Bother	KCNMA1	30	58
COc1ccc([N+](=O)[O-])cc1NC(=O)c1cnn(C(C)C)c1Br	ZINC000875052070	GG	On-Demand	Bother	WDR5	34	41
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C	ZINC000875052076	CF	On-Demand	Bother	KCNMA1	28	53
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C	ZINC000875052077	CF	On-Demand	Bother	KCNMA1	28	53
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C	ZINC000875052078	CF	On-Demand	Bother	KCNMA1	28	53
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1C[C@@H]1[C@H]1C[C@H]1C	ZINC000875052079	CF	On-Demand	Bother	KCNMA1	28	53
COc1ccc([N+](=O)[O-])cc1NC(=O)C1(F)CCOCC1	ZINC000875052085	CE	On-Demand	Bother	KCNMA1	22	52
COc1ccc([N+](=O)[O-])cc1NC(=O)C1(F)CCOCC1	ZINC000875052085	CE	On-Demand	Bother	WDR5	31	40
CN1CCN(c2ccccc2NC(=O)[C@]2(C3CCCC3)CCNC2=O)CC1	ZINC000875052090	FE	On-Demand	Anodyne	KCNQ2	70	41
CN1CCN(c2ccccc2NC(=O)[C@@]2(C3CCCC3)CCNC2=O)CC1	ZINC000875052091	FE	On-Demand	Anodyne	KCNQ2	70	41
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@]12CCCC[C@@H]1C2	ZINC000875052111	CG	On-Demand	Bother	KCNMA1	22	49
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@]12CCCC[C@H]1C2	ZINC000875052112	CG	On-Demand	Bother	KCNMA1	22	49
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@]12CCCC[C@@H]1C2	ZINC000875052113	CG	On-Demand	Bother	KCNMA1	22	49
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@]12CCCC[C@H]1C2	ZINC000875052114	CG	On-Demand	Bother	KCNMA1	22	49
CC(=O)Nc1cccc(CNC(=O)N2CCCCCCNC(=O)CC2)c1	ZINC000875052138	FE	On-Demand	Anodyne	P2RY14	47	36
COc1cc(CNC(=O)N2CCC(N3CCN(C)CC3)CC2)ccc1O	ZINC000875052156	FD	On-Demand	Anodyne	L3MBTL3	72	40
CCC1(CC)CCCN1C(=O)NCc1ccc(O)c(OC)c1	ZINC000875052157	DG	On-Demand	Anodyne	SLC12A5	45	34
CCO[C@@H](C(=O)Nc1cc(S(C)(=O)=O)ccc1F)[C@H]1CCOC1	ZINC000875052168	ED	On-Demand	Anodyne	LEF	16	45
CCO[C@@H](C(=O)Nc1cc(S(C)(=O)=O)ccc1F)[C@@H]1CCOC1	ZINC000875052169	ED	On-Demand	Anodyne	LEF	16	45
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875052192	ED	On-Demand	Anodyne	HCN1	49	34
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875052192	ED	On-Demand	Anodyne	HCN4	42	34
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875052194	ED	On-Demand	Anodyne	HCN1	49	34
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875052194	ED	On-Demand	Anodyne	HCN4	42	34
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875052196	ED	On-Demand	Anodyne	HCN1	49	34
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875052196	ED	On-Demand	Anodyne	HCN4	42	34
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1ccc(C#N)cc1	ZINC000875052197	DF	On-Demand	Mild	CTRB_BOVIN	49	37
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1ccc(C#N)cc1	ZINC000875052197	DF	On-Demand	Mild	ASAH1	86	36
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875052198	ED	On-Demand	Anodyne	HCN1	49	34
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875052198	ED	On-Demand	Anodyne	HCN4	42	34
CCCCCCCNC(=O)C(=O)N[C@H](C)c1ccc(C#N)cc1	ZINC000875052199	DF	On-Demand	Mild	CTRB_BOVIN	49	37
CCCCCCCNC(=O)C(=O)N[C@H](C)c1ccc(C#N)cc1	ZINC000875052199	DF	On-Demand	Mild	ASAH1	86	36
COc1cc(CNC(=O)N2CC(CNC(=O)C(F)(F)F)C2)ccc1O	ZINC000875052201	FD	On-Demand	Anodyne	TRPV1	15	45
CCOCCNC(=O)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875052204	FE	On-Demand	Anodyne	CALCRL	32	40
CC(=O)Nc1cccc(CNC(=O)N[C@@H]2CC(C)(C)CC[C@H]2O)c1	ZINC000875052213	EE	On-Demand	Anodyne	ROCK2	15	44
O=C(NCCO)C1CCN(C(=O)NCc2ccc(F)cc2C(F)(F)F)CC1	ZINC000875052214	GD	On-Demand	Anodyne	P2RX7	43	52
O=C(NCCO)C1CCN(C(=O)NCc2ccc(F)cc2C(F)(F)F)CC1	ZINC000875052214	GD	On-Demand	Anodyne	EPHX2	29	54
NC(=O)c1cc(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)ccc1F	ZINC000875052216	GG	On-Demand	Anodyne	DRD2	19	46
NC(=O)c1cc(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)ccc1F	ZINC000875052216	GG	On-Demand	Anodyne	DRD4	41	46
NC(=O)c1cc(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)ccc1F	ZINC000875052216	GG	On-Demand	Anodyne	ACHE	61	59
NC(=O)c1cc(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)ccc1F	ZINC000875052216	GG	On-Demand	Anodyne	HRH2	27	42
NC(=O)c1cc(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)ccc1F	ZINC000875052216	GG	On-Demand	Anodyne	SLC6A3	15	45
NC(=O)c1cc(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)ccc1F	ZINC000875052216	GG	On-Demand	Anodyne	SIGMAR1	45	48
NC(=O)c1cc(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)ccc1F	ZINC000875052216	GG	On-Demand	Anodyne	BCHE	17	49
NC(=O)c1cc(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)ccc1F	ZINC000875052216	GG	On-Demand	Anodyne	CCR3	107	47
NC(=O)c1cc(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)ccc1F	ZINC000875052216	GG	On-Demand	Anodyne	F2R	53	33
NC(=O)c1cc(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)ccc1F	ZINC000875052216	GG	On-Demand	Anodyne	EPHX2	20	43
NC(=O)c1cc(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)ccc1F	ZINC000875052216	GG	On-Demand	Anodyne	ST14	48	42
NC(=O)c1cc(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)ccc1F	ZINC000875052216	GG	On-Demand	Anodyne	MCHR1	51	40
NC(=O)c1cc(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)ccc1F	ZINC000875052216	GG	On-Demand	Anodyne	CACNA1G	30	40
NC(=O)c1cc(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)ccc1F	ZINC000875052216	GG	On-Demand	Anodyne	PRMT3	17	40
NC(=O)c1cc(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)ccc1F	ZINC000875052216	GG	On-Demand	Anodyne	NPFFR1	42	39
COc1ccccc1[C@H]1CCCN(C(=O)Nc2ccc(F)c(C(N)=O)c2)CC1	ZINC000875052228	GH	On-Demand	Anodyne	HTR1D	18	47
COc1ccccc1[C@H]1CCCN(C(=O)Nc2ccc(F)c(C(N)=O)c2)CC1	ZINC000875052228	GH	On-Demand	Anodyne	HTR1B	18	48
COc1ccccc1[C@H]1CCCN(C(=O)Nc2ccc(F)c(C(N)=O)c2)CC1	ZINC000875052228	GH	On-Demand	Anodyne	RBP4	61	49
COc1ccccc1[C@@H]1CCCN(C(=O)Nc2ccc(F)c(C(N)=O)c2)CC1	ZINC000875052229	GH	On-Demand	Anodyne	HTR1D	18	47
COc1ccccc1[C@@H]1CCCN(C(=O)Nc2ccc(F)c(C(N)=O)c2)CC1	ZINC000875052229	GH	On-Demand	Anodyne	HTR1B	18	48
COc1ccccc1[C@@H]1CCCN(C(=O)Nc2ccc(F)c(C(N)=O)c2)CC1	ZINC000875052229	GH	On-Demand	Anodyne	RBP4	61	49
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)NCc1cnn(CC)n1	ZINC000875052232	ED	On-Demand	Anodyne	HCN1	53	36
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)NCc1cnn(CC)n1	ZINC000875052232	ED	On-Demand	Anodyne	HCN4	41	36
CCOc1ccccc1[C@H](C)NC(=O)C(=O)NCc1cnn(CC)n1	ZINC000875052233	ED	On-Demand	Anodyne	HCN1	53	36
CCOc1ccccc1[C@H](C)NC(=O)C(=O)NCc1cnn(CC)n1	ZINC000875052233	ED	On-Demand	Anodyne	HCN4	41	36
CCCOc1ccc([C@@H](C)NC(=O)C(=O)NC2CCC(C)(N(C)C)CC2)cc1	ZINC000875052240	GG	On-Demand	Anodyne	ACACA	23	51
CCCOc1ccc([C@@H](C)NC(=O)C(=O)NC2CCC(C)(N(C)C)CC2)cc1	ZINC000875052240	GG	On-Demand	Anodyne	ACACB	24	51
CCCOc1ccc([C@H](C)NC(=O)C(=O)NC2CCC(C)(N(C)C)CC2)cc1	ZINC000875052243	GG	On-Demand	Anodyne	ACACA	23	51
CCCOc1ccc([C@H](C)NC(=O)C(=O)NC2CCC(C)(N(C)C)CC2)cc1	ZINC000875052243	GG	On-Demand	Anodyne	ACACB	24	51
CCOC(=O)[C@@H]1CN(C(=O)NCc2cccc(NC(C)=O)c2)CCC1(F)F	ZINC000875052266	GE	On-Demand	Anodyne	P2RY14	42	32
CCOc1ccccc1[C@H](C)NC(=O)C(=O)NCCCCC1CC1	ZINC000875052269	EF	On-Demand	Anodyne	HCN1	49	33
CCOc1ccccc1[C@H](C)NC(=O)C(=O)NCCCCC1CC1	ZINC000875052269	EF	On-Demand	Anodyne	HCN4	43	33
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)NCCCCC1CC1	ZINC000875052271	EF	On-Demand	Anodyne	HCN1	49	33
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)NCCCCC1CC1	ZINC000875052271	EF	On-Demand	Anodyne	HCN4	43	33
O=C(NCc1cccc(F)c1)N1CCC(CO)(CO)CC1	ZINC000875052280	CD	On-Demand	Anodyne	CACNA1H	57	36
CC[C@@H](NC(=O)C(=O)N[C@H](C)c1ccnn1C)c1cccc(Cl)c1	ZINC000875052281	EF	On-Demand	Anodyne	TACR3	41	36
CC[C@@H](NC(=O)C(=O)N[C@H](C)c1ccnn1C)c1cccc(Cl)c1	ZINC000875052281	EF	On-Demand	Anodyne	PDS	27	44
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OC(C)C)cc1	ZINC000875052285	DF	On-Demand	Anodyne	ANPEP	19	47
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OC(C)C)cc1	ZINC000875052285	DF	On-Demand	Anodyne	PDS	49	36
CC[C@@H](NC(=O)C(=O)N[C@@H](C)c1ccnn1C)c1cccc(Cl)c1	ZINC000875052286	EF	On-Demand	Anodyne	TACR3	41	36
CC[C@@H](NC(=O)C(=O)N[C@@H](C)c1ccnn1C)c1cccc(Cl)c1	ZINC000875052286	EF	On-Demand	Anodyne	PDS	27	44
N#Cc1cccc(CNC(=O)C(=O)NCCCCC2CC2)c1	ZINC000875052288	CD	On-Demand	Mild	CCR3	20	47
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875052302	FD	On-Demand	Anodyne	BMP1	54	35
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875052302	FD	On-Demand	Anodyne	NOS2	96	38
CC(=O)Nc1cccc(CNC(=O)N2Cc3cccnc3N3C[C@H](O)C[C@H]3C2)c1	ZINC000875052303	GD	On-Demand	Anodyne	NAMPT	23	40
COC(=O)N(C)NC(=O)NCc1cccc(F)c1	ZINC000875052304	CD	On-Demand	Reactive	ROCK2	28	46
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875052310	FD	On-Demand	Anodyne	BMP1	54	35
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875052310	FD	On-Demand	Anodyne	NOS2	96	38
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875052311	FD	On-Demand	Anodyne	BMP1	54	35
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875052311	FD	On-Demand	Anodyne	NOS2	96	38
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)CCc1ccc2c(c1)OCO2	ZINC000875052314	FD	On-Demand	Mild	BMP1	61	42
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)CCc1ccc2c(c1)OCO2	ZINC000875052314	FD	On-Demand	Mild	NOS2	48	32
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](C)CCc1ccc2c(c1)OCO2	ZINC000875052315	FD	On-Demand	Mild	BMP1	61	42
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](C)CCc1ccc2c(c1)OCO2	ZINC000875052315	FD	On-Demand	Mild	NOS2	48	32
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)CCc1ccc2c(c1)OCO2	ZINC000875052316	FD	On-Demand	Mild	BMP1	61	42
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)CCc1ccc2c(c1)OCO2	ZINC000875052316	FD	On-Demand	Mild	NOS2	48	32
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](C)CCc1ccc2c(c1)OCO2	ZINC000875052317	FD	On-Demand	Mild	BMP1	61	42
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](C)CCc1ccc2c(c1)OCO2	ZINC000875052317	FD	On-Demand	Mild	NOS2	48	32
CCCOc1ccc([C@H](C)NC(=O)C(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875052329	GD	On-Demand	Anodyne	ACACA	27	50
CCCOc1ccc([C@H](C)NC(=O)C(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875052329	GD	On-Demand	Anodyne	ACACB	28	50
CCCOc1ccc([C@H](C)NC(=O)C(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875052329	GD	On-Demand	Anodyne	PLA2G4B	44	32
CCCOc1ccc([C@@H](C)NC(=O)C(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875052330	GD	On-Demand	Anodyne	ACACA	27	50
CCCOc1ccc([C@@H](C)NC(=O)C(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875052330	GD	On-Demand	Anodyne	ACACB	28	50
CCCOc1ccc([C@@H](C)NC(=O)C(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875052330	GD	On-Demand	Anodyne	PLA2G4B	44	32
COCCN(CC1CCN(C)CC1)C(=O)Nc1ccc(F)c(C(N)=O)c1	ZINC000875052332	FD	On-Demand	Anodyne	ACKR3	44	31
NC(=O)c1cc(NC(=O)NC[C@H]2CCC23CCOCC3)ccc1F	ZINC000875052333	EE	On-Demand	Anodyne	STAT6	45	35
NC(=O)c1cc(NC(=O)NC[C@@H]2CCC23CCOCC3)ccc1F	ZINC000875052334	EE	On-Demand	Anodyne	STAT6	45	35
CCOCCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875052344	DE	On-Demand	Anodyne	FKBP1A	48	42
CCOCCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875052344	DE	On-Demand	Anodyne	CPT1A	53	34
CCOCCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875052345	DE	On-Demand	Anodyne	FKBP1A	48	42
CCOCCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875052345	DE	On-Demand	Anodyne	CPT1A	53	34
CCOCCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875052346	DE	On-Demand	Anodyne	FKBP1A	48	42
CCOCCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875052346	DE	On-Demand	Anodyne	CPT1A	53	34
COC(=O)N(C)NC(=O)NCc1c(OC)ccc2ccccc12	ZINC000875052348	DE	On-Demand	Reactive	MTNR1A	32	42
COC(=O)N(C)NC(=O)NCc1c(OC)ccc2ccccc12	ZINC000875052348	DE	On-Demand	Reactive	MTNR1B	27	41
COC(=O)N(C)NC(=O)NCc1c(OC)ccc2ccccc12	ZINC000875052348	DE	On-Demand	Reactive	NCEH1	50	44
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Cn1ccc(C)n1	ZINC000875052353	DE	On-Demand	Bother	KCNMA1	20	48
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Cn1ccc(C)n1	ZINC000875052354	DE	On-Demand	Bother	KCNMA1	20	48
CCO[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1OC)C1CCOCC1	ZINC000875052356	EE	On-Demand	Bother	CACNA1D	42	33
CCO[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1OC)C1CCOCC1	ZINC000875052356	EE	On-Demand	Bother	KCNMA1	20	46
COc1ccc([N+](=O)[O-])cc1NC(=O)Cc1csc(C2CC2)n1	ZINC000875052365	EG	On-Demand	Bother	KCNMA1	21	45
COc1ccc([N+](=O)[O-])cc1NC(=O)C1(C)CC(F)(F)C1	ZINC000875052366	DF	On-Demand	Bother	CACNA1D	59	32
COc1ccc([N+](=O)[O-])cc1NC(=O)C1(C)CC(F)(F)C1	ZINC000875052366	DF	On-Demand	Bother	KCNMA1	23	55
COc1ccc([N+](=O)[O-])cc1NC(=O)C1(C)CC(F)(F)C1	ZINC000875052366	DF	On-Demand	Bother	WDR5	32	42
C#C[C@@H]1CC[C@@H](NC(=O)Nc2ccc(OCC(N)=O)cc2)CC1	ZINC000875052397	DD	On-Demand	Mild	CA1	24	40
C#C[C@@H]1CC[C@@H](NC(=O)Nc2ccc(OCC(N)=O)cc2)CC1	ZINC000875052397	DD	On-Demand	Mild	EPHX2	60	46
COc1ccc([N+](=O)[O-])cc1NC(=O)CC(F)(F)C(F)(F)F	ZINC000875052401	EG	On-Demand	Bother	KCNMA1	23	55
COc1ccc([N+](=O)[O-])cc1NC(=O)CC(F)(F)C(F)(F)F	ZINC000875052401	EG	On-Demand	Bother	WDR5	31	40
CS[C@@H]1C[C@@H](NC(=O)Nc2ccc(OCC(N)=O)cc2)C1	ZINC000875052402	DD	On-Demand	Anodyne	EPHX2	51	43
CC[C@@H](NC(=O)NCCCn1cncn1)[C@@H](O)c1ccccc1	ZINC000875052411	DD	On-Demand	Anodyne	HIS3	63	36
CC[C@@H](NC(=O)NCCCn1cncn1)[C@H](O)c1ccccc1	ZINC000875052413	DD	On-Demand	Anodyne	HIS3	63	36
CN1CCN(c2ccccc2NC(=O)c2ccsc2C(F)(F)F)CC1	ZINC000875052415	FH	On-Demand	Anodyne	KCNQ2	74	40
CN1CCN(c2ccccc2NC(=O)c2ccsc2C(F)(F)F)CC1	ZINC000875052415	FH	On-Demand	Anodyne	CSF1R	17	48
CN1CCN(c2ccccc2NC(=O)c2ccsc2C(F)(F)F)CC1	ZINC000875052415	FH	On-Demand	Anodyne	WDR5	36	42
CC[C@@H](NC(=O)C(=O)N1CCC(CO)(CO)CC1)c1cccc(Cl)c1	ZINC000875052417	FD	On-Demand	Anodyne	CACNA1H	39	45
CC[C@@H](NC(=O)C(=O)N1CCC(CO)(CO)CC1)c1cccc(Cl)c1	ZINC000875052417	FD	On-Demand	Anodyne	KCNQ2	26	40
CC[C@@H](NC(=O)C(=O)N1CCC(CO)(CO)CC1)c1cccc(Cl)c1	ZINC000875052417	FD	On-Demand	Anodyne	PDS	27	41
CN(C[C@H](O)CN(C)C(=O)OC(C)(C)C)C(=O)NCc1cccc(F)c1	ZINC000875052420	FE	On-Demand	Anodyne	PAPA1_CARPA	16	45
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(C#N)c2)CC1	ZINC000875052422	DD	On-Demand	Mild	MCHR1	16	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(O)c(OC)c2)C1	ZINC000875052442	ED	On-Demand	Anodyne	TRPV1	23	49
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1C[C@H]1C(C)(C)C	ZINC000875052465	CG	On-Demand	Bother	KCNMA1	24	54
COc1ccc([N+](=O)[O-])cc1NC(=O)C1([C@@H]2CCCCO2)CCC1	ZINC000875052467	EG	On-Demand	Bother	KCNMA1	20	46
COc1ccc([N+](=O)[O-])cc1NC(=O)C1([C@H]2CCCCO2)CCC1	ZINC000875052470	EG	On-Demand	Bother	KCNMA1	20	46
CCCOc1ccc([C@H](C)NC(=O)C(=O)N[C@H]2CC23CCC3)cc1	ZINC000875052495	EF	On-Demand	Anodyne	ACACA	26	50
CCCOc1ccc([C@H](C)NC(=O)C(=O)N[C@H]2CC23CCC3)cc1	ZINC000875052495	EF	On-Demand	Anodyne	ACACB	26	50
CC[C@@H](NC(=O)NCc1cccc(F)c1)[C@H](O)c1ccccc1	ZINC000875052496	DG	On-Demand	Anodyne	ANPEP	17	54
CC[C@@H](NC(=O)NCc1cccc(F)c1)[C@H](O)c1ccccc1	ZINC000875052496	DG	On-Demand	Anodyne	TACR3	32	40
CC[C@@H](NC(=O)NCc1cccc(F)c1)[C@H](O)c1ccccc1	ZINC000875052496	DG	On-Demand	Anodyne	BACE1	41	39
CC[C@@H](NC(=O)NCc1cccc(F)c1)[C@H](O)c1ccccc1	ZINC000875052496	DG	On-Demand	Anodyne	PDS	66	45
CCCOc1ccc([C@@H](C)NC(=O)C(=O)N[C@H]2CC23CCC3)cc1	ZINC000875052497	EF	On-Demand	Anodyne	ACACA	26	50
CCCOc1ccc([C@@H](C)NC(=O)C(=O)N[C@H]2CC23CCC3)cc1	ZINC000875052497	EF	On-Demand	Anodyne	ACACB	26	50
CC[C@@H](NC(=O)NCc1cccc(F)c1)[C@@H](O)c1ccccc1	ZINC000875052499	DG	On-Demand	Anodyne	ANPEP	17	54
CC[C@@H](NC(=O)NCc1cccc(F)c1)[C@@H](O)c1ccccc1	ZINC000875052499	DG	On-Demand	Anodyne	TACR3	32	40
CC[C@@H](NC(=O)NCc1cccc(F)c1)[C@@H](O)c1ccccc1	ZINC000875052499	DG	On-Demand	Anodyne	BACE1	41	39
CC[C@@H](NC(=O)NCc1cccc(F)c1)[C@@H](O)c1ccccc1	ZINC000875052499	DG	On-Demand	Anodyne	PDS	66	45
CCCOc1ccc([C@@H](C)NC(=O)C(=O)N[C@@H]2CC23CCC3)cc1	ZINC000875052500	EF	On-Demand	Anodyne	ACACA	26	50
CCCOc1ccc([C@@H](C)NC(=O)C(=O)N[C@@H]2CC23CCC3)cc1	ZINC000875052500	EF	On-Demand	Anodyne	ACACB	26	50
CCCOc1ccc([C@H](C)NC(=O)C(=O)N[C@@H]2CC23CCC3)cc1	ZINC000875052502	EF	On-Demand	Anodyne	ACACA	26	50
CCCOc1ccc([C@H](C)NC(=O)C(=O)N[C@@H]2CC23CCC3)cc1	ZINC000875052502	EF	On-Demand	Anodyne	ACACB	26	50
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCc2cccc(C#N)c2)c1	ZINC000875052515	EE	On-Demand	Mild	DPP4	18	43
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCc2cccc(C#N)c2)c1	ZINC000875052515	EE	On-Demand	Mild	PREP	41	36
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCc2cccc(C#N)c2)c1	ZINC000875052516	EE	On-Demand	Mild	DPP4	18	43
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCc2cccc(C#N)c2)c1	ZINC000875052516	EE	On-Demand	Mild	PREP	41	36
COC(=O)C1(O)CN(C(=O)NCc2cccc(F)c2)C1	ZINC000875052517	CC	On-Demand	Anodyne	ROCK2	15	43
O=C(NCc1cccc(F)c1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875052532	EG	On-Demand	Anodyne	EPHX2	19	50
O=C(NCc1cccc(F)c1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875052532	EG	On-Demand	Anodyne	NPSR1	27	41
O=C(NCc1cccc(F)c1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875052532	EG	On-Demand	Anodyne	SLC12A5	55	35
O=C(NCc1cccc(F)c1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875052533	EG	On-Demand	Anodyne	EPHX2	19	50
O=C(NCc1cccc(F)c1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875052533	EG	On-Demand	Anodyne	NPSR1	27	41
O=C(NCc1cccc(F)c1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875052533	EG	On-Demand	Anodyne	SLC12A5	55	35
CN1CCN(C(=O)NCc2cccc(F)c2)CCC1(C)C	ZINC000875052534	CE	On-Demand	Anodyne	CACNA1H	50	35
COC(=O)N(C)NC(=O)NCc1cccc(NC(C)=O)c1	ZINC000875052536	CD	On-Demand	Reactive	ROCK2	32	47
CCOCCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875052543	DE	On-Demand	Anodyne	FKBP1A	48	42
CCOCCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875052543	DE	On-Demand	Anodyne	CPT1A	53	34
NC(=O)c1cc(NC(=O)N[C@@H]2C[C@H]2C2CCOCC2)ccc1F	ZINC000875052572	DD	On-Demand	Anodyne	EPHX2	15	43
NC(=O)c1cc(NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)ccc1F	ZINC000875052573	FF	On-Demand	Anodyne	NPY2R	44	33
NC(=O)c1cc(NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)ccc1F	ZINC000875052574	FF	On-Demand	Anodyne	NPY2R	44	33
NC(=O)c1cc(NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)ccc1F	ZINC000875052575	FF	On-Demand	Anodyne	NPY2R	44	33
NC(=O)c1cc(NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)ccc1F	ZINC000875052576	FF	On-Demand	Anodyne	NPY2R	44	33
CC[C@@H](NC(=O)NCc1cccc(NC(C)=O)c1)[C@@H](O)c1ccccc1	ZINC000875052577	FF	On-Demand	Anodyne	ANPEP	19	42
CC[C@@H](NC(=O)NCc1cccc(NC(C)=O)c1)[C@@H](O)c1ccccc1	ZINC000875052577	FF	On-Demand	Anodyne	ROCK2	17	46
CC[C@@H](NC(=O)NCc1cccc(NC(C)=O)c1)[C@@H](O)c1ccccc1	ZINC000875052577	FF	On-Demand	Anodyne	PDS	56	36
CC[C@@H](NC(=O)NCc1cccc(NC(C)=O)c1)[C@H](O)c1ccccc1	ZINC000875052580	FF	On-Demand	Anodyne	ANPEP	19	42
CC[C@@H](NC(=O)NCc1cccc(NC(C)=O)c1)[C@H](O)c1ccccc1	ZINC000875052580	FF	On-Demand	Anodyne	ROCK2	17	46
CC[C@@H](NC(=O)NCc1cccc(NC(C)=O)c1)[C@H](O)c1ccccc1	ZINC000875052580	FF	On-Demand	Anodyne	PDS	56	36
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](C)CCc1ccc2c(c1)OCO2	ZINC000875052585	FD	On-Demand	Mild	BMP1	62	42
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](C)CCc1ccc2c(c1)OCO2	ZINC000875052585	FD	On-Demand	Mild	NOS2	48	32
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](C)CCc1ccc2c(c1)OCO2	ZINC000875052586	FD	On-Demand	Mild	BMP1	62	42
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](C)CCc1ccc2c(c1)OCO2	ZINC000875052586	FD	On-Demand	Mild	NOS2	48	32
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H](C)CCc1ccc2c(c1)OCO2	ZINC000875052587	FD	On-Demand	Mild	BMP1	62	42
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H](C)CCc1ccc2c(c1)OCO2	ZINC000875052587	FD	On-Demand	Mild	NOS2	48	32
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H](C)CCc1ccc2c(c1)OCO2	ZINC000875052588	FD	On-Demand	Mild	BMP1	62	42
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H](C)CCc1ccc2c(c1)OCO2	ZINC000875052588	FD	On-Demand	Mild	NOS2	48	32
CCCOc1ccc([C@@H](C)NC(=O)C(=O)N[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000875052593	GH	On-Demand	Anodyne	ACACA	29	49
CCCOc1ccc([C@@H](C)NC(=O)C(=O)N[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000875052593	GH	On-Demand	Anodyne	ACACB	31	49
CCCOc1ccc([C@H](C)NC(=O)C(=O)N[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000875052594	GH	On-Demand	Anodyne	ACACA	29	49
CCCOc1ccc([C@H](C)NC(=O)C(=O)N[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000875052594	GH	On-Demand	Anodyne	ACACB	31	49
CCCOc1ccc([C@@H](C)NC(=O)C(=O)N[C@H](C)c2cc3cnccc3o2)cc1	ZINC000875052595	GH	On-Demand	Anodyne	ACACA	29	49
CCCOc1ccc([C@@H](C)NC(=O)C(=O)N[C@H](C)c2cc3cnccc3o2)cc1	ZINC000875052595	GH	On-Demand	Anodyne	ACACB	31	49
CCCOc1ccc([C@H](C)NC(=O)C(=O)N[C@H](C)c2cc3cnccc3o2)cc1	ZINC000875052596	GH	On-Demand	Anodyne	ACACA	29	49
CCCOc1ccc([C@H](C)NC(=O)C(=O)N[C@H](C)c2cc3cnccc3o2)cc1	ZINC000875052596	GH	On-Demand	Anodyne	ACACB	31	49
CCOCCNC(=O)N(CC)[C@@H](C)[C@@H](O)c1ccccc1	ZINC000875052605	CE	On-Demand	Anodyne	NPY5R	27	43
CCOCCNC(=O)N(CC)[C@H](C)[C@H](O)c1ccccc1	ZINC000875052606	CE	On-Demand	Anodyne	NPY5R	27	43
CCOCCNC(=O)N(CC)[C@H](C)[C@@H](O)c1ccccc1	ZINC000875052607	CE	On-Demand	Anodyne	NPY5R	27	43
CCOCCNC(=O)N(CC)[C@@H](C)[C@H](O)c1ccccc1	ZINC000875052608	CE	On-Demand	Anodyne	NPY5R	27	43
CCOCCNC(=O)NC1CC(Nc2ccccc2)C1	ZINC000875052613	CD	On-Demand	Anodyne	EPHX2	22	43
CCOCCNC(=O)N[C@@H]1C[C@H]2C[C@@]2(C(=O)OC)C1	ZINC000875052616	CC	On-Demand	Anodyne	EPHX2	15	49
CCOCCNC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875052617	CD	On-Demand	Anodyne	EPHX2	15	48
CCOCCNC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875052618	CD	On-Demand	Anodyne	EPHX2	15	48
O=C(NCc1ccccc1[N+](=O)[O-])N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875052622	FF	On-Demand	Bother	COLA	69	33
CC[C@@H]1COCCN1CCNC(=O)NCc1cccc(NC(C)=O)c1	ZINC000875052626	ED	On-Demand	Anodyne	CCR3	26	40
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N1CC[C@@H]2[C@H](CCN2C)C1	ZINC000875052631	GD	On-Demand	Anodyne	NOS2	88	35
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N1CC[C@@H]2[C@H](CCN2C)C1	ZINC000875052631	GD	On-Demand	Anodyne	MCHR1	19	40
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N1CC[C@@H]2[C@@H](CCN2C)C1	ZINC000875052632	GD	On-Demand	Anodyne	NOS2	88	35
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N1CC[C@@H]2[C@@H](CCN2C)C1	ZINC000875052632	GD	On-Demand	Anodyne	MCHR1	19	40
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N1CC[C@H]2[C@H](CCN2C)C1	ZINC000875052633	GD	On-Demand	Anodyne	NOS2	88	35
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N1CC[C@H]2[C@H](CCN2C)C1	ZINC000875052633	GD	On-Demand	Anodyne	MCHR1	19	40
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N1CC[C@H]2[C@@H](CCN2C)C1	ZINC000875052634	GD	On-Demand	Anodyne	NOS2	88	35
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N1CC[C@H]2[C@@H](CCN2C)C1	ZINC000875052634	GD	On-Demand	Anodyne	MCHR1	19	40
COCC1CC(NC(=O)NCc2ccc(O)c(OC)c2)C1	ZINC000875052654	CD	On-Demand	Anodyne	TRPV1	19	58
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3cccc(NC(C)=O)c3)C[C@@H]1C2	ZINC000875052678	ED	On-Demand	Anodyne	ROCK2	18	41
CC(=O)Nc1cccc(CNC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875052689	CD	On-Demand	Anodyne	ROCK2	19	47
CC(=O)Nc1cccc(CNC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875052689	CD	On-Demand	Anodyne	EPHX2	19	42
C[C@]1(C(F)(F)F)CN(C(=O)Nc2ccc(OCC(N)=O)cc2)CCO1	ZINC000875052726	FD	On-Demand	Anodyne	EPHX2	57	48
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)Nc1ccc(F)c(C(N)=O)c1)CC2	ZINC000875052733	GG	On-Demand	Anodyne	SLC18A2	44	32
COc1cc2c(cc1OC)[C@H](C)N(C(=O)Nc1ccc(F)c(C(N)=O)c1)CC2	ZINC000875052734	GG	On-Demand	Anodyne	SLC18A2	44	32
CCO[C@H]1COCC[C@@H]1CC(=O)Nc1cc([N+](=O)[O-])ccc1OC	ZINC000875052735	EE	On-Demand	Bother	KCNMA1	20	44
CCO[C@H]1COCC[C@H]1CC(=O)Nc1cc([N+](=O)[O-])ccc1OC	ZINC000875052737	EE	On-Demand	Bother	KCNMA1	20	44
CN1CCN(C2CCN(C(=O)Nc3ccc(OCC(N)=O)cc3)CC2)CC1	ZINC000875052749	GC	On-Demand	Anodyne	PDGFRB	46	36
CN1CCN(C2CCN(C(=O)Nc3ccc(OCC(N)=O)cc3)CC2)CC1	ZINC000875052749	GC	On-Demand	Anodyne	HRH3	20	43
CN1CCN(C2CCN(C(=O)Nc3ccc(OCC(N)=O)cc3)CC2)CC1	ZINC000875052749	GC	On-Demand	Anodyne	EPHX2	40	34
CN1CCN(C2CCN(C(=O)Nc3ccc(OCC(N)=O)cc3)CC2)CC1	ZINC000875052749	GC	On-Demand	Anodyne	L3MBTL3	65	40
CC(=O)Nc1cccc(CNC(=O)N[C@H](C)C2CN(C(=O)OC(C)(C)C)C2)c1	ZINC000875052752	GF	On-Demand	Anodyne	ROCK2	15	41
CC(=O)Nc1cccc(CNC(=O)N[C@H](C)C2CN(C(=O)OC(C)(C)C)C2)c1	ZINC000875052752	GF	On-Demand	Anodyne	GPR119	16	42
CC(=O)Nc1cccc(CNC(=O)N[C@@H](C)C2CN(C(=O)OC(C)(C)C)C2)c1	ZINC000875052754	GF	On-Demand	Anodyne	ROCK2	15	41
CC(=O)Nc1cccc(CNC(=O)N[C@@H](C)C2CN(C(=O)OC(C)(C)C)C2)c1	ZINC000875052754	GF	On-Demand	Anodyne	GPR119	16	42
O=C(N[C@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCc2cccc(F)c2)C1	ZINC000875052756	GE	On-Demand	Anodyne	BIRC2	17	42
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCc2cccc(F)c2)C1	ZINC000875052758	GE	On-Demand	Anodyne	BIRC2	17	42
CCO[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1OC)C1CCCC1	ZINC000875052759	DG	On-Demand	Bother	CACNA1C	44	37
CCO[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1OC)C1CCCC1	ZINC000875052759	DG	On-Demand	Bother	CACNA1D	71	36
CCO[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1OC)C1CCCC1	ZINC000875052759	DG	On-Demand	Bother	KCNMA1	21	48
CCC(CC)(CNC(=O)Nc1ccc(OCC(N)=O)cc1)C(F)(F)F	ZINC000875052760	FG	On-Demand	Anodyne	EPHX2	29	42
CCC(CC)(CNC(=O)Nc1ccc(OCC(N)=O)cc1)C(F)(F)F	ZINC000875052760	FG	On-Demand	Anodyne	ACR	41	36
CCC(CC)(CNC(=O)Nc1ccc(OCC(N)=O)cc1)C(F)(F)F	ZINC000875052760	FG	On-Demand	Anodyne	CA12	18	40
CCC(CC)(CNC(=O)Nc1ccc(OCC(N)=O)cc1)C(F)(F)F	ZINC000875052760	FG	On-Demand	Anodyne	CA9	19	40
O=C(N[C@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCc2cccc(F)c2)C1	ZINC000875052761	GE	On-Demand	Anodyne	BIRC2	17	42
C[C@H]1CN(C(=O)Nc2ccc(OCC(N)=O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000875052762	GE	On-Demand	Anodyne	EPHX2	58	38
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCc2cccc(F)c2)C1	ZINC000875052763	GE	On-Demand	Anodyne	BIRC2	17	42
C[C@H]1CN(C(=O)Nc2ccc(OCC(N)=O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000875052764	GE	On-Demand	Anodyne	EPHX2	58	38
C[C@@H]1CN(C(=O)Nc2ccc(OCC(N)=O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000875052766	GE	On-Demand	Anodyne	EPHX2	58	38
C[C@@H]1CN(C(=O)Nc2ccc(OCC(N)=O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000875052767	GE	On-Demand	Anodyne	EPHX2	58	38
C[C@@H]1C[C@]1(C(=O)Nc1cc(S(C)(=O)=O)ccc1F)C(=O)OC(C)(C)C	ZINC000875052769	FF	On-Demand	Anodyne	GPR119	24	41
O=C(NCc1cccc(F)c1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875052778	DF	On-Demand	Anodyne	EPHX2	15	40
O=C(NCc1cccc(F)c1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875052779	DF	On-Demand	Anodyne	EPHX2	15	40
C[C@H](CCc1ccc(F)cc1)C(=O)Nc1cc(S(C)(=O)=O)ccc1F	ZINC000875052817	FH	On-Demand	Anodyne	PTGS2	25	42
C[C@H](CCc1ccc(F)cc1)C(=O)Nc1cc(S(C)(=O)=O)ccc1F	ZINC000875052817	FH	On-Demand	Anodyne	LEF	66	36
C[C@@H](CCc1ccc(F)cc1)C(=O)Nc1cc(S(C)(=O)=O)ccc1F	ZINC000875052818	FH	On-Demand	Anodyne	PTGS2	25	42
C[C@@H](CCc1ccc(F)cc1)C(=O)Nc1cc(S(C)(=O)=O)ccc1F	ZINC000875052818	FH	On-Demand	Anodyne	LEF	66	36
COCCN(CC1CCN(C)CC1)C(=O)NCc1c(OC)ccc2ccccc12	ZINC000875052823	GG	On-Demand	Anodyne	DRD2	19	42
COCCN(CC1CCN(C)CC1)C(=O)NCc1c(OC)ccc2ccccc12	ZINC000875052823	GG	On-Demand	Anodyne	ACKR3	65	34
NC(=O)c1ccccc1OCC(=O)OCC(=O)N1CCN(Cc2cccc3ccccc23)CC1	ZINC000875052826	JE	On-Demand	Anodyne	PLA2G1B	29	40
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875052851	EE	On-Demand	Anodyne	HCN1	66	41
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875052851	EE	On-Demand	Anodyne	HCN4	53	39
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875052852	EE	On-Demand	Anodyne	HCN1	66	41
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875052852	EE	On-Demand	Anodyne	HCN4	53	39
O=C(NCc1ccc(F)cc1C(F)(F)F)NC[C@H]1C[C@H](O)C1	ZINC000875052856	DE	On-Demand	Anodyne	P2RX7	42	50
NC(=O)CCNC(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875052858	DD	On-Demand	Anodyne	C3AR1	41	42
NC(=O)CCNC(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875052859	DD	On-Demand	Anodyne	C3AR1	41	42
CC(=O)C1CCN(C(=O)Nc2ccc(F)c(C(N)=O)c2)CC1	ZINC000875052860	DD	On-Demand	Anodyne	CACNA1H	36	41
CC(=O)C1CCN(C(=O)Nc2ccc(F)c(C(N)=O)c2)CC1	ZINC000875052860	DD	On-Demand	Anodyne	EPHX2	28	40
NC(=O)c1cc(NC(=O)NC[C@@H]2CCCN2CC(F)F)ccc1F	ZINC000875052863	ED	On-Demand	Anodyne	CCR3	44	38
NC(=O)c1cc(NC(=O)NC[C@@H]2CCCN2CC(F)F)ccc1F	ZINC000875052863	ED	On-Demand	Anodyne	EPHX2	16	42
NC(=O)c1cc(NC(=O)NC[C@H]2CCCN2CC(F)F)ccc1F	ZINC000875052864	ED	On-Demand	Anodyne	CCR3	44	38
NC(=O)c1cc(NC(=O)NC[C@H]2CCCN2CC(F)F)ccc1F	ZINC000875052864	ED	On-Demand	Anodyne	EPHX2	16	42
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875052867	GD	On-Demand	Anodyne	BMP1	42	40
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875052867	GD	On-Demand	Anodyne	NOS2	96	37
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875052867	GD	On-Demand	Anodyne	MCHR1	21	40
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875052868	GD	On-Demand	Anodyne	BMP1	42	40
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875052868	GD	On-Demand	Anodyne	NOS2	96	37
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875052868	GD	On-Demand	Anodyne	MCHR1	21	40
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875052869	GD	On-Demand	Anodyne	BMP1	42	40
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875052869	GD	On-Demand	Anodyne	NOS2	96	37
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875052869	GD	On-Demand	Anodyne	MCHR1	21	40
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875052870	GD	On-Demand	Anodyne	BMP1	42	40
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875052870	GD	On-Demand	Anodyne	NOS2	96	37
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875052870	GD	On-Demand	Anodyne	MCHR1	21	40
NC(=O)c1cc(NC(=O)N2CCC[C@@](F)(c3ccccc3)C2)ccc1F	ZINC000875052873	FG	On-Demand	Anodyne	EPHX2	34	53
NC(=O)c1cc(NC(=O)N2CCC[C@](F)(c3ccccc3)C2)ccc1F	ZINC000875052874	FG	On-Demand	Anodyne	EPHX2	34	53
CCCOc1ccc([C@@H](C)NC(=O)C(=O)NCc2cnn(CC)n2)cc1	ZINC000875052878	FD	On-Demand	Anodyne	ACACA	30	50
CCCOc1ccc([C@@H](C)NC(=O)C(=O)NCc2cnn(CC)n2)cc1	ZINC000875052878	FD	On-Demand	Anodyne	ACACB	33	50
CCCOc1ccc([C@H](C)NC(=O)C(=O)NCc2cnn(CC)n2)cc1	ZINC000875052879	FD	On-Demand	Anodyne	ACACA	30	50
CCCOc1ccc([C@H](C)NC(=O)C(=O)NCc2cnn(CC)n2)cc1	ZINC000875052879	FD	On-Demand	Anodyne	ACACB	33	50
C[C@H](NC(=O)C(=O)N1CCC(CO)(CO)CC1)c1cc(Cl)ccc1Cl	ZINC000875052883	GD	On-Demand	Anodyne	CACNA1H	42	34
C[C@H](NC(=O)C(=O)N1CCC(CO)(CO)CC1)c1cc(Cl)ccc1Cl	ZINC000875052883	GD	On-Demand	Anodyne	CCR1	40	34
C[C@]1(C(F)(F)F)CN(C(=O)Nc2ccc(F)c(C(N)=O)c2)CCO1	ZINC000875052884	EE	On-Demand	Anodyne	EPHX2	38	44
COCC1CC(NC(=O)Nc2ccc(F)c(C(N)=O)c2)C1	ZINC000875052886	CD	On-Demand	Anodyne	EPHX2	44	37
CCOCCNC(=O)NNc1ccc(OC)cc1Br	ZINC000875052887	EE	On-Demand	Reactive	MTNR1A	56	40
CCOCCNC(=O)NNc1ccc(OC)cc1Br	ZINC000875052887	EE	On-Demand	Reactive	MTNR1B	43	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)CCc2ccc3c(c2)OCO3)C1	ZINC000875052888	FD	On-Demand	Anodyne	NOS2	94	37
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)CCc2ccc3c(c2)OCO3)C1	ZINC000875052888	FD	On-Demand	Anodyne	SSTR3	20	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)CCc2ccc3c(c2)OCO3)C1	ZINC000875052889	FD	On-Demand	Anodyne	NOS2	94	37
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)CCc2ccc3c(c2)OCO3)C1	ZINC000875052889	FD	On-Demand	Anodyne	SSTR3	20	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)CCc2ccc3c(c2)OCO3)C1	ZINC000875052890	FD	On-Demand	Anodyne	NOS2	94	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)CCc2ccc3c(c2)OCO3)C1	ZINC000875052890	FD	On-Demand	Anodyne	SSTR3	20	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)CCc2ccc3c(c2)OCO3)C1	ZINC000875052891	FD	On-Demand	Anodyne	NOS2	94	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)CCc2ccc3c(c2)OCO3)C1	ZINC000875052891	FD	On-Demand	Anodyne	SSTR3	20	40
NC(=O)c1cc(NC(=O)NCC[C@@H]2CCCS2)ccc1F	ZINC000875052892	DE	On-Demand	Anodyne	PRMT3	41	44
NC(=O)c1cc(NC(=O)NCC[C@H]2CCCS2)ccc1F	ZINC000875052893	DE	On-Demand	Anodyne	PRMT3	41	44
NC(=O)c1cc(NC(=O)N2C[C@H]3CC=CC[C@H]3C2)ccc1F	ZINC000875052899	DE	On-Demand	Anodyne	RBP4	45	33
CC(=O)Nc1cccc(CNC(=O)NC2CC(Nc3ccccc3)C2)c1	ZINC000875052904	FG	On-Demand	Anodyne	PTGIR	16	43
CC(=O)Nc1cccc(CNC(=O)NC2CC(Nc3ccccc3)C2)c1	ZINC000875052904	FG	On-Demand	Anodyne	ROCK2	20	46
CC(=O)Nc1cccc(CNC(=O)NC2CC(Nc3ccccc3)C2)c1	ZINC000875052904	FG	On-Demand	Anodyne	EPHX2	33	44
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875052912	FE	On-Demand	Anodyne	HCN1	48	33
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875052912	FE	On-Demand	Anodyne	HCN4	41	33
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875052913	FE	On-Demand	Anodyne	HCN1	48	33
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875052913	FE	On-Demand	Anodyne	HCN4	41	33
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875052914	FE	On-Demand	Anodyne	HCN1	48	33
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875052914	FE	On-Demand	Anodyne	HCN4	41	33
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875052915	FE	On-Demand	Anodyne	HCN1	48	33
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875052915	FE	On-Demand	Anodyne	HCN4	41	33
NC(=O)c1cc(NC(=O)N2CCO[C@@H](C(F)(F)F)CC2)ccc1F	ZINC000875052920	EE	On-Demand	Anodyne	EPHX2	28	44
NC(=O)c1cc(NC(=O)N2CCO[C@H](C(F)(F)F)CC2)ccc1F	ZINC000875052921	EE	On-Demand	Anodyne	EPHX2	28	44
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875052930	EE	On-Demand	Anodyne	HCN1	63	41
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875052930	EE	On-Demand	Anodyne	HCN4	56	41
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875052931	EE	On-Demand	Anodyne	HCN1	63	41
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875052931	EE	On-Demand	Anodyne	HCN4	56	41
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875052932	EE	On-Demand	Anodyne	HCN1	63	41
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875052932	EE	On-Demand	Anodyne	HCN4	56	41
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875052933	EE	On-Demand	Anodyne	HCN1	63	41
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875052933	EE	On-Demand	Anodyne	HCN4	56	41
O=C(NCc1ccc(F)cc1C(F)(F)F)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875052944	GH	On-Demand	Mild	P2RX7	31	50
O=C(NCc1ccc(F)cc1C(F)(F)F)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875052944	GH	On-Demand	Mild	EPHX2	19	46
O=C(NCc1ccc(F)cc1C(F)(F)F)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875052945	GH	On-Demand	Mild	P2RX7	31	50
O=C(NCc1ccc(F)cc1C(F)(F)F)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875052945	GH	On-Demand	Mild	EPHX2	19	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(F)c1	ZINC000875052957	DE	On-Demand	Anodyne	SLC6A4	35	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(F)c1	ZINC000875052957	DE	On-Demand	Anodyne	SLC6A3	65	50
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(F)c1	ZINC000875052958	DE	On-Demand	Anodyne	SLC6A4	35	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(F)c1	ZINC000875052958	DE	On-Demand	Anodyne	SLC6A3	65	50
C#C[C@@H]1CC[C@@H](NC(=O)NCc2ccc(O)c(OC)c2)CC1	ZINC000875052978	DE	On-Demand	Mild	TRPV1	15	55
CN1CCN(C2CCN(C(=O)C(=O)NCc3cccc(C#N)c3)CC2)CC1	ZINC000875052980	FC	On-Demand	Mild	HRH3	18	41
CN1CCN(C2CCN(C(=O)C(=O)NCc3cccc(C#N)c3)CC2)CC1	ZINC000875052980	FC	On-Demand	Mild	L3MBTL3	60	38
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccc(F)c2)C1	ZINC000875052993	DE	On-Demand	Anodyne	CCR5	72	33
COc1cc(CNC(=O)N2CCC(C)(N3CCCCC3)CC2)ccc1O	ZINC000875052997	FF	On-Demand	Anodyne	HCN1	50	35
COc1cc(CNC(=O)N2CCC(C)(N3CCCCC3)CC2)ccc1O	ZINC000875052997	FF	On-Demand	Anodyne	HCN4	48	35
CC[C@@H](NC(=O)NCc1ccc(O)c(OC)c1)c1cccc(OC)c1OC	ZINC000875053000	FG	On-Demand	Anodyne	TRPV1	23	50
CC(=O)Nc1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875053002	ED	On-Demand	Anodyne	DRD4	26	43
CC(=O)Nc1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875053002	ED	On-Demand	Anodyne	CHRM3	19	40
CC(=O)Nc1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875053002	ED	On-Demand	Anodyne	CCR3	65	41
CC(=O)Nc1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875053002	ED	On-Demand	Anodyne	CCR2	23	43
CC(=O)Nc1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875053002	ED	On-Demand	Anodyne	EPHX2	30	41
CC(=O)Nc1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875053002	ED	On-Demand	Anodyne	CXCR3	21	44
CC(=O)Nc1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875053002	ED	On-Demand	Anodyne	MCHR1	35	43
C[C@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)c1cc(F)ccc1F	ZINC000875053014	GD	On-Demand	Anodyne	L3MBTL3	56	41
CC[C@@H](NC(=O)C(=O)N1CCC(C(C)=O)CC1)c1cccc(Cl)c1	ZINC000875053026	FF	On-Demand	Anodyne	KCNQ2	26	41
CC[C@@H](NC(=O)C(=O)N1CCC(C(C)=O)CC1)c1cccc(Cl)c1	ZINC000875053026	FF	On-Demand	Anodyne	CCR5	19	43
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1C[C@]1(C)Br	ZINC000875053031	EF	On-Demand	Bother	CACNA1D	50	32
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1C[C@]1(C)Br	ZINC000875053031	EF	On-Demand	Bother	KCNMA1	24	55
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1C[C@]1(C)Br	ZINC000875053031	EF	On-Demand	Bother	WDR5	31	40
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1C[C@@]1(C)Br	ZINC000875053032	EF	On-Demand	Bother	CACNA1D	50	32
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1C[C@@]1(C)Br	ZINC000875053032	EF	On-Demand	Bother	KCNMA1	24	55
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1C[C@@]1(C)Br	ZINC000875053032	EF	On-Demand	Bother	WDR5	31	40
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1C[C@@]1(C)Br	ZINC000875053033	EF	On-Demand	Bother	CACNA1D	50	32
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1C[C@@]1(C)Br	ZINC000875053033	EF	On-Demand	Bother	KCNMA1	24	55
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1C[C@@]1(C)Br	ZINC000875053033	EF	On-Demand	Bother	WDR5	31	40
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1C[C@]1(C)Br	ZINC000875053035	EF	On-Demand	Bother	CACNA1D	50	32
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1C[C@]1(C)Br	ZINC000875053035	EF	On-Demand	Bother	KCNMA1	24	55
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1C[C@]1(C)Br	ZINC000875053035	EF	On-Demand	Bother	WDR5	31	40
NC(=O)COc1ccc(NC(=O)NC[C@@H]2CCN2C2CCCCCC2)cc1	ZINC000875053041	FE	On-Demand	Anodyne	EPHX2	22	42
NC(=O)COc1ccc(NC(=O)NC[C@H]2CCN2C2CCCCCC2)cc1	ZINC000875053044	FE	On-Demand	Anodyne	EPHX2	22	42
COc1cc(CNC(=O)N2CCC3(CCN(C)CC3)CC2)ccc1O	ZINC000875053045	EE	On-Demand	Anodyne	TRPV1	21	48
COc1ccc([N+](=O)[O-])cc1NC(=O)Cc1csc(C2CCCC2)n1	ZINC000875053046	FH	On-Demand	Bother	KCNMA1	20	44
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NC1CCC2(CC1)OCCO2	ZINC000875053057	FE	On-Demand	Anodyne	TIMP3	48	36
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NC1CCC2(CC1)OCCO2	ZINC000875053057	FE	On-Demand	Anodyne	MMP3	16	40
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NC1CCC2(CC1)OCCO2	ZINC000875053057	FE	On-Demand	Anodyne	C5AR1	31	46
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NC1CCC2(CC1)OCCO2	ZINC000875053058	FE	On-Demand	Anodyne	TIMP3	48	36
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NC1CCC2(CC1)OCCO2	ZINC000875053058	FE	On-Demand	Anodyne	MMP3	16	40
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NC1CCC2(CC1)OCCO2	ZINC000875053058	FE	On-Demand	Anodyne	C5AR1	31	46
NC(=O)COc1ccc(NC(=O)N[C@@H]2CCCC[C@@H]2F)cc1	ZINC000875053065	DD	On-Demand	Anodyne	CCR3	22	41
NC(=O)COc1ccc(NC(=O)N[C@@H]2CCCC[C@@H]2F)cc1	ZINC000875053065	DD	On-Demand	Anodyne	EPHX2	51	49
NC(=O)COc1ccc(NC(=O)N[C@@H]2CCCC[C@@H]2F)cc1	ZINC000875053065	DD	On-Demand	Anodyne	CA12	17	43
NC(=O)COc1ccc(NC(=O)N[C@@H]2CCCC[C@@H]2F)cc1	ZINC000875053065	DD	On-Demand	Anodyne	CA9	18	43
NC(=O)COc1ccc(NC(=O)N[C@@H]2CCCC[C@@H]2F)cc1	ZINC000875053065	DD	On-Demand	Anodyne	NCE103	15	42
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)c2c(Cl)ccc(F)c2Cl)CC1	ZINC000875053067	GG	On-Demand	Anodyne	CCR1	41	36
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)c2c(Cl)ccc(F)c2Cl)CC1	ZINC000875053067	GG	On-Demand	Anodyne	MET	17	40
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)c2c(Cl)ccc(F)c2Cl)CC1	ZINC000875053068	GG	On-Demand	Anodyne	CCR1	41	36
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)c2c(Cl)ccc(F)c2Cl)CC1	ZINC000875053068	GG	On-Demand	Anodyne	MET	17	40
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875053100	EE	On-Demand	Anodyne	CCR3	46	40
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875053100	EE	On-Demand	Anodyne	P2RY14	41	33
NC(=O)COc1ccc(NC(=O)N2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000875053101	FF	On-Demand	Anodyne	EPHX2	50	35
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875053102	EE	On-Demand	Anodyne	CCR3	46	40
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875053102	EE	On-Demand	Anodyne	P2RY14	41	33
NC(=O)COc1ccc(NC(=O)N2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000875053103	FF	On-Demand	Anodyne	EPHX2	50	35
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(O)c(OC)c1	ZINC000875053106	FD	On-Demand	Anodyne	ACKR3	62	32
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875053122	FG	On-Demand	Anodyne	CCR3	31	42
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875053122	FG	On-Demand	Anodyne	EPHX2	32	43
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875053122	FG	On-Demand	Anodyne	TPSAB1	18	45
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875053122	FG	On-Demand	Anodyne	P2RY14	43	33
Cc1cccc(CN2CCO[C@@H](CNC(=O)NCCC(N)=O)C2)c1	ZINC000875053124	EC	On-Demand	Anodyne	DRD4	25	40
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875053125	FG	On-Demand	Anodyne	CCR3	31	42
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875053125	FG	On-Demand	Anodyne	EPHX2	32	43
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875053125	FG	On-Demand	Anodyne	TPSAB1	18	45
CC(=O)Nc1cccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875053125	FG	On-Demand	Anodyne	P2RY14	43	33
Cc1cccc(CN2CCO[C@H](CNC(=O)NCCC(N)=O)C2)c1	ZINC000875053126	EC	On-Demand	Anodyne	DRD4	25	40
COc1ccccc1[C@H]1CCCN(C(=O)NCCCn2cncn2)CC1	ZINC000875053127	FF	On-Demand	Anodyne	DRD2	24	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCn2cncn2)CC1	ZINC000875053129	FF	On-Demand	Anodyne	DRD2	24	41
C[C@]1(C(F)(F)F)CCN(C(=O)Nc2ccc(F)c(C(N)=O)c2)C1	ZINC000875053140	EF	On-Demand	Anodyne	CACNA1H	39	41
C[C@]1(C(F)(F)F)CCN(C(=O)Nc2ccc(F)c(C(N)=O)c2)C1	ZINC000875053140	EF	On-Demand	Anodyne	EPHX2	37	46
NC(=O)COc1ccc(NC(=O)N[C@@H]2CC23CCC3)cc1	ZINC000875053155	CD	On-Demand	Anodyne	EPHX2	30	43
NC(=O)COc1ccc(NC(=O)N[C@H]2CC23CCC3)cc1	ZINC000875053157	CD	On-Demand	Anodyne	EPHX2	30	43
CC(=O)[C@H]1CCCN(C(=O)Nc2ccc(F)c(C(N)=O)c2)C1	ZINC000875053164	DD	On-Demand	Anodyne	EPHX2	19	42
CC(=O)[C@@H]1CCCN(C(=O)Nc2ccc(F)c(C(N)=O)c2)C1	ZINC000875053165	DD	On-Demand	Anodyne	EPHX2	19	42
NC(=O)c1cc(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)ccc1F	ZINC000875053179	FE	On-Demand	Anodyne	FAAH	23	50
NC(=O)c1cc(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)ccc1F	ZINC000875053179	FE	On-Demand	Anodyne	EPHX2	22	40
NC(=O)c1cc(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)ccc1F	ZINC000875053179	FE	On-Demand	Anodyne	STAT6	48	31
NC(=O)c1cc(NC(=O)N2CC[C@@]3(CCc4ccccc43)C2)ccc1F	ZINC000875053189	FG	On-Demand	Anodyne	CACNA1H	41	36
NC(=O)c1cc(NC(=O)N2CC[C@@]3(CCc4ccccc43)C2)ccc1F	ZINC000875053189	FG	On-Demand	Anodyne	NPY5R	31	44
NC(=O)c1cc(NC(=O)N2CC[C@@]3(CCc4ccccc43)C2)ccc1F	ZINC000875053189	FG	On-Demand	Anodyne	EPHX2	31	41
NC(=O)c1cc(NC(=O)N2CC[C@]3(CCc4ccccc43)C2)ccc1F	ZINC000875053190	FG	On-Demand	Anodyne	CACNA1H	41	36
NC(=O)c1cc(NC(=O)N2CC[C@]3(CCc4ccccc43)C2)ccc1F	ZINC000875053190	FG	On-Demand	Anodyne	NPY5R	31	44
NC(=O)c1cc(NC(=O)N2CC[C@]3(CCc4ccccc43)C2)ccc1F	ZINC000875053190	FG	On-Demand	Anodyne	EPHX2	31	41
NC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875053199	ED	On-Demand	Anodyne	CHRM2	20	42
NC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875053199	ED	On-Demand	Anodyne	DRD2	26	50
NC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875053199	ED	On-Demand	Anodyne	DRD4	54	47
NC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875053199	ED	On-Demand	Anodyne	ACHE	71	68
NC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875053199	ED	On-Demand	Anodyne	DRD3	19	47
NC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875053199	ED	On-Demand	Anodyne	SLC6A3	20	53
NC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875053199	ED	On-Demand	Anodyne	HTR4	28	42
NC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875053199	ED	On-Demand	Anodyne	CHRM3	23	42
NC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875053199	ED	On-Demand	Anodyne	SIGMAR1	75	49
NC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875053199	ED	On-Demand	Anodyne	BCHE	20	53
NC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875053199	ED	On-Demand	Anodyne	CCR3	58	46
NC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875053199	ED	On-Demand	Anodyne	NPFFR2	39	41
NC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875053199	ED	On-Demand	Anodyne	FAAH	15	47
NC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875053199	ED	On-Demand	Anodyne	MCHR1	29	42
NC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875053199	ED	On-Demand	Anodyne	CACNA1G	33	43
NC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875053199	ED	On-Demand	Anodyne	CACNA1I	44	39
NC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875053199	ED	On-Demand	Anodyne	SIRT3	41	32
NC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875053199	ED	On-Demand	Anodyne	SIRT2	45	33
NC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875053199	ED	On-Demand	Anodyne	SIRT1	42	36
NC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875053199	ED	On-Demand	Anodyne	CYP2J2	42	29
NC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875053199	ED	On-Demand	Anodyne	NPFFR1	50	48
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)NCC[C@@H]1CCSC1	ZINC000875053201	GE	On-Demand	Anodyne	NOS2	81	35
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)NCC[C@H]1CCSC1	ZINC000875053202	GE	On-Demand	Anodyne	NOS2	81	35
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)NCC[C@@H]1CCSC1	ZINC000875053203	GE	On-Demand	Anodyne	NOS2	81	35
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)NCC[C@H]1CCSC1	ZINC000875053204	GE	On-Demand	Anodyne	NOS2	81	35
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CCCCCCNC(=O)CC1	ZINC000875053220	GE	On-Demand	Anodyne	HCN1	54	36
CCOc1ccccc1[C@H](C)NC(=O)C(=O)N1CCCCCCNC(=O)CC1	ZINC000875053220	GE	On-Demand	Anodyne	HCN4	50	36
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)N1CCCCCCNC(=O)CC1	ZINC000875053221	GE	On-Demand	Anodyne	HCN1	54	36
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)N1CCCCCCNC(=O)CC1	ZINC000875053221	GE	On-Demand	Anodyne	HCN4	50	36
CN1CCN(C2CCN(C(=O)Nc3ccc(F)c(C(N)=O)c3)CC2)CC1	ZINC000875053228	FD	On-Demand	Anodyne	HTR1D	18	43
CN1CCN(C2CCN(C(=O)Nc3ccc(F)c(C(N)=O)c3)CC2)CC1	ZINC000875053228	FD	On-Demand	Anodyne	HTR1B	17	43
CN1CCN(C2CCN(C(=O)Nc3ccc(F)c(C(N)=O)c3)CC2)CC1	ZINC000875053228	FD	On-Demand	Anodyne	EPHX2	17	45
CN1CCN(C2CCN(C(=O)Nc3ccc(F)c(C(N)=O)c3)CC2)CC1	ZINC000875053228	FD	On-Demand	Anodyne	L3MBTL3	74	40
NC(=O)c1cc(NC(=O)N[C@@H]2CCCC[C@@H]2F)ccc1F	ZINC000875053231	CE	On-Demand	Anodyne	CCR3	25	46
NC(=O)c1cc(NC(=O)N[C@@H]2CCCC[C@@H]2F)ccc1F	ZINC000875053231	CE	On-Demand	Anodyne	EPHX2	20	40
CCOCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875053232	CD	On-Demand	Anodyne	ACE	38	42
CCOCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875053233	CD	On-Demand	Anodyne	ACE	38	42
CCOCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875053234	CD	On-Demand	Anodyne	ACE	38	42
CCOCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875053235	CD	On-Demand	Anodyne	ACE	38	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(F)cc2C(F)(F)F)C1	ZINC000875053240	GG	On-Demand	Anodyne	TACR1	31	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(F)cc2C(F)(F)F)C1	ZINC000875053240	GG	On-Demand	Anodyne	P2RX7	53	51
C[C@H](NC(=O)C(=O)NC(Cc1ccccc1)Cc1ccccc1)c1ccnn1C	ZINC000875053245	GF	On-Demand	Anodyne	ACE	43	40
C[C@H](NC(=O)C(=O)NC(Cc1ccccc1)Cc1ccccc1)c1ccnn1C	ZINC000875053245	GF	On-Demand	Anodyne	MME	108	43
C[C@H](NC(=O)C(=O)NC(Cc1ccccc1)Cc1ccccc1)c1ccnn1C	ZINC000875053245	GF	On-Demand	Anodyne	ANPEP	58	35
C[C@H](NC(=O)C(=O)NC(Cc1ccccc1)Cc1ccccc1)c1ccnn1C	ZINC000875053245	GF	On-Demand	Anodyne	FCER2	71	35
C[C@H](NC(=O)C(=O)NC(Cc1ccccc1)Cc1ccccc1)c1ccnn1C	ZINC000875053245	GF	On-Demand	Anodyne	CYSP_TRYCR	49	35
C[C@H](NC(=O)C(=O)NC(Cc1ccccc1)Cc1ccccc1)c1ccnn1C	ZINC000875053245	GF	On-Demand	Anodyne	CPA1	40	40
C[C@H](NC(=O)C(=O)NC(Cc1ccccc1)Cc1ccccc1)c1ccnn1C	ZINC000875053245	GF	On-Demand	Anodyne	CAPNS1	64	37
C[C@H](NC(=O)C(=O)NC(Cc1ccccc1)Cc1ccccc1)c1ccnn1C	ZINC000875053245	GF	On-Demand	Anodyne	MMP8	15	44
C[C@H](NC(=O)C(=O)NC(Cc1ccccc1)Cc1ccccc1)c1ccnn1C	ZINC000875053245	GF	On-Demand	Anodyne	HLA-DRB1	47	32
C[C@H](NC(=O)C(=O)NC(Cc1ccccc1)Cc1ccccc1)c1ccnn1C	ZINC000875053245	GF	On-Demand	Anodyne	CAPN1	81	39
C[C@H](NC(=O)C(=O)NC(Cc1ccccc1)Cc1ccccc1)c1ccnn1C	ZINC000875053245	GF	On-Demand	Anodyne	MMP9	15	44
C[C@H](NC(=O)C(=O)NC(Cc1ccccc1)Cc1ccccc1)c1ccnn1C	ZINC000875053245	GF	On-Demand	Anodyne	CAPN2	51	36
C[C@H](NC(=O)C(=O)NC(Cc1ccccc1)Cc1ccccc1)c1ccnn1C	ZINC000875053245	GF	On-Demand	Anodyne	ACE2	70	40
C[C@H](NC(=O)C(=O)NC(Cc1ccccc1)Cc1ccccc1)c1ccnn1C	ZINC000875053245	GF	On-Demand	Anodyne	FPR1	49	39
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1cccc(C#N)c1)CC2	ZINC000875053253	GE	On-Demand	Mild	HCRTR1	15	46
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1cccc(C#N)c1)CC2	ZINC000875053254	GE	On-Demand	Mild	HCRTR1	15	46
COc1ccc([C@@H]2CN(C(=O)NCc3ccc(O)c(OC)c3)CCO2)cc1	ZINC000875053255	FF	On-Demand	Anodyne	MMP13	18	40
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(O)c(OC)c1	ZINC000875053267	CD	On-Demand	Anodyne	TRPV1	26	51
CC(=O)Nc1cccc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)c1	ZINC000875053282	GF	On-Demand	Anodyne	PTGIR	15	41
CC(=O)Nc1cccc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)c1	ZINC000875053282	GF	On-Demand	Anodyne	FAAH	22	47
CC(=O)Nc1cccc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)c1	ZINC000875053282	GF	On-Demand	Anodyne	P2RY14	43	33
CC(=O)Nc1cccc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)c1	ZINC000875053282	GF	On-Demand	Anodyne	NPFFR1	40	35
C=CC(C)(C)CCCNC(=O)NCc1ccc(O)c(OC)c1	ZINC000875053291	DG	On-Demand	Mild	TRPV1	29	52
CC[C@@H](NC(=O)C(=O)NCc1cnn(CC)n1)c1cccc(Cl)c1	ZINC000875053305	ED	On-Demand	Anodyne	PDS	45	37
O=C(NCc1cccc(F)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875053314	DG	On-Demand	Anodyne	GRIN2B	18	44
O=C(NCc1cccc(F)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875053314	DG	On-Demand	Anodyne	EPHX2	26	45
O=C(NCc1cccc(F)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875053315	DG	On-Demand	Anodyne	GRIN2B	18	44
O=C(NCc1cccc(F)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875053315	DG	On-Demand	Anodyne	EPHX2	26	45
COc1cc(CNC(=O)N(C)OCC(F)(F)F)ccc1O	ZINC000875053331	DE	On-Demand	Anodyne	TRPV1	23	50
COc1cc(CNC(=O)N(C)OCC(F)(F)F)ccc1O	ZINC000875053331	DE	On-Demand	Anodyne	MT-ND1	23	40
COCC(C)(C)CCNC(=O)C(=O)N[C@H](C)c1ccc(C#N)cc1	ZINC000875053332	ED	On-Demand	Mild	CTRB_BOVIN	44	32
COCC(C)(C)CCNC(=O)C(=O)N[C@@H](C)c1ccc(C#N)cc1	ZINC000875053333	ED	On-Demand	Mild	CTRB_BOVIN	44	32
CC(=O)Nc1cccc(CNC(=O)NC(C)(C)[C@@H]2CCCCO2)c1	ZINC000875053335	EF	On-Demand	Anodyne	ROCK2	15	41
CC(=O)Nc1cccc(CNC(=O)NC(C)(C)[C@H]2CCCCO2)c1	ZINC000875053336	EF	On-Demand	Anodyne	ROCK2	15	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1c(OC)ccc2ccccc12	ZINC000875053346	EG	On-Demand	Anodyne	ANPEP	17	42
CC[C@H](C[C@H](C)O)NC(=O)NCc1c(OC)ccc2ccccc12	ZINC000875053346	EG	On-Demand	Anodyne	MTNR1A	26	40
NC(=O)COc1ccc(NC(=O)N2CC[C@@]3(CCc4ccccc43)C2)cc1	ZINC000875053352	FF	On-Demand	Anodyne	NPY5R	37	49
NC(=O)COc1ccc(NC(=O)N2CC[C@@]3(CCc4ccccc43)C2)cc1	ZINC000875053352	FF	On-Demand	Anodyne	EPHX2	38	41
NC(=O)COc1ccc(NC(=O)N2CC[C@]3(CCc4ccccc43)C2)cc1	ZINC000875053353	FF	On-Demand	Anodyne	NPY5R	37	49
NC(=O)COc1ccc(NC(=O)N2CC[C@]3(CCc4ccccc43)C2)cc1	ZINC000875053353	FF	On-Demand	Anodyne	EPHX2	38	41
O=C(NC[C@@H]1CCS(=O)(=O)C1)NNc1ccc(OCc2ccccc2)cc1	ZINC000875053354	GE	On-Demand	Reactive	LTA4H	21	43
O=C(NC[C@H]1CCS(=O)(=O)C1)NNc1ccc(OCc2ccccc2)cc1	ZINC000875053355	GE	On-Demand	Reactive	LTA4H	21	43
NC(=O)COc1ccc(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1	ZINC000875053365	DD	On-Demand	Anodyne	EPHX2	25	41
NC(=O)COc1ccc(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1	ZINC000875053366	DD	On-Demand	Anodyne	EPHX2	25	41
NC(=O)COc1ccc(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1	ZINC000875053367	DD	On-Demand	Anodyne	EPHX2	25	41
NC(=O)COc1ccc(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1	ZINC000875053368	DD	On-Demand	Anodyne	EPHX2	25	41
CCCOc1ccc([C@@H](C)NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875053371	FE	On-Demand	Anodyne	ACACA	21	50
CCCOc1ccc([C@@H](C)NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875053371	FE	On-Demand	Anodyne	ACACB	21	50
CCCOc1ccc([C@H](C)NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875053372	FE	On-Demand	Anodyne	ACACA	21	50
CCCOc1ccc([C@H](C)NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875053372	FE	On-Demand	Anodyne	ACACB	21	50
CCCOc1ccc([C@H](C)NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875053373	FE	On-Demand	Anodyne	ACACA	21	50
CCCOc1ccc([C@H](C)NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875053373	FE	On-Demand	Anodyne	ACACB	21	50
CCCOc1ccc([C@@H](C)NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875053374	FE	On-Demand	Anodyne	ACACA	21	50
CCCOc1ccc([C@@H](C)NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875053374	FE	On-Demand	Anodyne	ACACB	21	50
CN1CCN(c2ccccc2NC(=O)c2sccc2CC#N)CC1	ZINC000875053396	EF	On-Demand	Mild	HTR1A	17	40
CN1CCN(c2ccccc2NC(=O)c2sccc2CC#N)CC1	ZINC000875053396	EF	On-Demand	Mild	KCNQ2	75	41
CN1CCN(c2ccccc2NC(=O)c2sccc2CC#N)CC1	ZINC000875053396	EF	On-Demand	Mild	CSF1R	27	47
CN1CCN(c2ccccc2NC(=O)c2sccc2CC#N)CC1	ZINC000875053396	EF	On-Demand	Mild	WDR5	33	41
COc1ccc([N+](=O)[O-])cc1NC(=O)CCCOC1CCOCC1	ZINC000875053398	EF	On-Demand	Bother	KCNMA1	21	47
COc1ccc([N+](=O)[O-])cc1NC(=O)CCCCCCSC	ZINC000875053418	EH	On-Demand	Bother	KCNMA1	22	52
CCOc1ccccc1[C@H](C)NC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875053468	GF	On-Demand	Anodyne	SIRT3	40	31
CCOc1ccccc1[C@H](C)NC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875053468	GF	On-Demand	Anodyne	SIRT2	44	31
CCOc1ccccc1[C@H](C)NC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875053468	GF	On-Demand	Anodyne	SIRT1	40	31
CCOc1ccccc1[C@H](C)NC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875053468	GF	On-Demand	Anodyne	HCN1	70	44
CCOc1ccccc1[C@H](C)NC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875053468	GF	On-Demand	Anodyne	HCN4	55	43
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875053470	GF	On-Demand	Anodyne	SIRT3	40	31
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875053470	GF	On-Demand	Anodyne	SIRT2	44	31
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875053470	GF	On-Demand	Anodyne	SIRT1	40	31
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875053470	GF	On-Demand	Anodyne	HCN1	70	44
CCOc1ccccc1[C@@H](C)NC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875053470	GF	On-Demand	Anodyne	HCN4	55	43
C[C@H](NC(=O)C(=O)N1CCN(C)C(C)(C)CC1)c1cc(F)ccc1F	ZINC000875053479	FE	On-Demand	Anodyne	CCR1	42	34
CCOCCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875053489	DD	On-Demand	Anodyne	PDS	63	38
CCOCCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875053490	DD	On-Demand	Anodyne	PDS	63	38
C[C@@H](NC(=O)NCCC(N)=O)c1ccc(C(F)(F)F)nc1	ZINC000875053491	DD	On-Demand	Anodyne	TRPV1	70	34
C[C@H](NC(=O)NCCC(N)=O)c1ccc(C(F)(F)F)nc1	ZINC000875053492	DD	On-Demand	Anodyne	TRPV1	70	34
NC(=O)c1cc(NC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)ccc1F	ZINC000875053524	FG	On-Demand	Anodyne	NPY2R	43	36
NC(=O)c1cc(NC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)ccc1F	ZINC000875053525	FG	On-Demand	Anodyne	NPY2R	43	36
NC(=O)c1cc(NC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)ccc1F	ZINC000875053526	FG	On-Demand	Anodyne	NPY2R	43	36
NC(=O)c1cc(NC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)ccc1F	ZINC000875053527	FG	On-Demand	Anodyne	NPY2R	43	36
CC[C@@H](NC(=O)C(=O)NCCC(C)(C)COC)c1cccc(Cl)c1	ZINC000875053547	FG	On-Demand	Anodyne	PDS	58	39
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(NC(C)=O)c1	ZINC000875053566	DD	On-Demand	Anodyne	ANPEP	26	46
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(NC(C)=O)c1	ZINC000875053566	DD	On-Demand	Anodyne	ROCK2	19	48
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(NC(C)=O)c1	ZINC000875053566	DD	On-Demand	Anodyne	PDS	49	33
CC(=O)Nc1cccc(CNC(=O)NC[C@H]2CC(C(F)(F)F)=NO2)c1	ZINC000875053575	FE	On-Demand	Anodyne	ROCK2	15	42
CC(=O)Nc1cccc(CNC(=O)NC[C@@H]2CC(C(F)(F)F)=NO2)c1	ZINC000875053576	FE	On-Demand	Anodyne	ROCK2	15	42
CC(=O)Nc1cccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875053590	GG	On-Demand	Anodyne	F2	24	40
CC(=O)Nc1cccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875053590	GG	On-Demand	Anodyne	TSHR	41	31
CC(=O)Nc1cccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875053590	GG	On-Demand	Anodyne	FKBP1A	41	39
CC(=O)Nc1cccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875053590	GG	On-Demand	Anodyne	CPT1A	25	44
CC(=O)Nc1cccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875053590	GG	On-Demand	Anodyne	PREP	27	40
CC(=O)Nc1cccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875053591	GG	On-Demand	Anodyne	F2	24	40
CC(=O)Nc1cccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875053591	GG	On-Demand	Anodyne	TSHR	41	31
CC(=O)Nc1cccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875053591	GG	On-Demand	Anodyne	FKBP1A	41	39
CC(=O)Nc1cccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875053591	GG	On-Demand	Anodyne	CPT1A	25	44
CC(=O)Nc1cccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875053591	GG	On-Demand	Anodyne	PREP	27	40
CC(=O)Nc1cccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875053592	GG	On-Demand	Anodyne	F2	24	40
CC(=O)Nc1cccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875053592	GG	On-Demand	Anodyne	TSHR	41	31
CC(=O)Nc1cccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875053592	GG	On-Demand	Anodyne	FKBP1A	41	39
CC(=O)Nc1cccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875053592	GG	On-Demand	Anodyne	CPT1A	25	44
CC(=O)Nc1cccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875053592	GG	On-Demand	Anodyne	PREP	27	40
CC(=O)Nc1cccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875053593	GG	On-Demand	Anodyne	F2	24	40
CC(=O)Nc1cccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875053593	GG	On-Demand	Anodyne	TSHR	41	31
CC(=O)Nc1cccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875053593	GG	On-Demand	Anodyne	FKBP1A	41	39
CC(=O)Nc1cccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875053593	GG	On-Demand	Anodyne	CPT1A	25	44
CC(=O)Nc1cccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875053593	GG	On-Demand	Anodyne	PREP	27	40
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cccc(NC(C)=O)c2)CC1	ZINC000875053594	GI	On-Demand	Anodyne	HTR1A	17	43
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cccc(NC(C)=O)c2)CC1	ZINC000875053594	GI	On-Demand	Anodyne	DRD2	20	46
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cccc(NC(C)=O)c2)CC1	ZINC000875053594	GI	On-Demand	Anodyne	TSHR	64	35
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cccc(NC(C)=O)c2)CC1	ZINC000875053594	GI	On-Demand	Anodyne	DRD4	20	51
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cccc(NC(C)=O)c2)CC1	ZINC000875053594	GI	On-Demand	Anodyne	HTR1D	18	43
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cccc(NC(C)=O)c2)CC1	ZINC000875053594	GI	On-Demand	Anodyne	HTR1B	19	43
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cccc(NC(C)=O)c2)CC1	ZINC000875053594	GI	On-Demand	Anodyne	NPY1R	22	40
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cccc(NC(C)=O)c2)CC1	ZINC000875053594	GI	On-Demand	Anodyne	CCR3	31	44
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cccc(NC(C)=O)c2)CC1	ZINC000875053594	GI	On-Demand	Anodyne	EPHX2	20	41
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cccc(NC(C)=O)c2)CC1	ZINC000875053594	GI	On-Demand	Anodyne	RBP4	31	41
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cccc(NC(C)=O)c2)CC1	ZINC000875053594	GI	On-Demand	Anodyne	MCHR1	30	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cccc(NC(C)=O)c2)CC1	ZINC000875053595	GI	On-Demand	Anodyne	HTR1A	17	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cccc(NC(C)=O)c2)CC1	ZINC000875053595	GI	On-Demand	Anodyne	DRD2	20	46
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cccc(NC(C)=O)c2)CC1	ZINC000875053595	GI	On-Demand	Anodyne	TSHR	64	35
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cccc(NC(C)=O)c2)CC1	ZINC000875053595	GI	On-Demand	Anodyne	DRD4	20	51
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cccc(NC(C)=O)c2)CC1	ZINC000875053595	GI	On-Demand	Anodyne	HTR1D	18	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cccc(NC(C)=O)c2)CC1	ZINC000875053595	GI	On-Demand	Anodyne	HTR1B	19	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cccc(NC(C)=O)c2)CC1	ZINC000875053595	GI	On-Demand	Anodyne	NPY1R	22	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cccc(NC(C)=O)c2)CC1	ZINC000875053595	GI	On-Demand	Anodyne	CCR3	31	44
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cccc(NC(C)=O)c2)CC1	ZINC000875053595	GI	On-Demand	Anodyne	EPHX2	20	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cccc(NC(C)=O)c2)CC1	ZINC000875053595	GI	On-Demand	Anodyne	RBP4	31	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cccc(NC(C)=O)c2)CC1	ZINC000875053595	GI	On-Demand	Anodyne	MCHR1	30	41
CCCOc1ccc([C@H](C)NC(=O)C(=O)N[C@@H](C2CCC2)[C@@H]2CCOC2)cc1	ZINC000875053614	GF	On-Demand	Anodyne	ACACA	24	49
CCCOc1ccc([C@H](C)NC(=O)C(=O)N[C@@H](C2CCC2)[C@@H]2CCOC2)cc1	ZINC000875053614	GF	On-Demand	Anodyne	ACACB	25	49
CCCOc1ccc([C@H](C)NC(=O)C(=O)N[C@H](C2CCC2)[C@@H]2CCOC2)cc1	ZINC000875053615	GF	On-Demand	Anodyne	ACACA	24	49
CCCOc1ccc([C@H](C)NC(=O)C(=O)N[C@H](C2CCC2)[C@@H]2CCOC2)cc1	ZINC000875053615	GF	On-Demand	Anodyne	ACACB	25	49
CCCOc1ccc([C@H](C)NC(=O)C(=O)N[C@@H](C2CCC2)[C@H]2CCOC2)cc1	ZINC000875053616	GF	On-Demand	Anodyne	ACACA	24	49
CCCOc1ccc([C@H](C)NC(=O)C(=O)N[C@@H](C2CCC2)[C@H]2CCOC2)cc1	ZINC000875053616	GF	On-Demand	Anodyne	ACACB	25	49
CCCOc1ccc([C@H](C)NC(=O)C(=O)N[C@H](C2CCC2)[C@H]2CCOC2)cc1	ZINC000875053617	GF	On-Demand	Anodyne	ACACA	24	49
CCCOc1ccc([C@H](C)NC(=O)C(=O)N[C@H](C2CCC2)[C@H]2CCOC2)cc1	ZINC000875053617	GF	On-Demand	Anodyne	ACACB	25	49
NC(=O)c1cc(NC(=O)NCCCCC2CC2)ccc1F	ZINC000875053620	CF	On-Demand	Anodyne	CCR3	42	43
NC(=O)c1cc(NC(=O)NCCCCC2CC2)ccc1F	ZINC000875053620	CF	On-Demand	Anodyne	EPHX2	16	40
NC(=O)c1cc(NC(=O)NCCCCC2CC2)ccc1F	ZINC000875053620	CF	On-Demand	Anodyne	PRMT3	33	42
COc1ccc([N+](=O)[O-])cc1NC(=O)c1c(C(F)F)nc2n1CCCC2	ZINC000875053627	FG	On-Demand	Bother	KCNMA1	20	47
COc1ccc([N+](=O)[O-])cc1NC(=O)c1c(C(F)F)nc2n1CCCC2	ZINC000875053627	FG	On-Demand	Bother	WDR5	33	41
NC(=O)COc1ccc(NC(=O)N2CCN(c3ccc(F)cc3F)CC2)cc1	ZINC000875053629	GE	On-Demand	Anodyne	HTR1D	15	43
NC(=O)COc1ccc(NC(=O)N2CCN(c3ccc(F)cc3F)CC2)cc1	ZINC000875053629	GE	On-Demand	Anodyne	PDGFRB	55	48
NC(=O)COc1ccc(NC(=O)N2CCN(c3ccc(F)cc3F)CC2)cc1	ZINC000875053629	GE	On-Demand	Anodyne	NPY2R	78	38
NC(=O)COc1ccc(NC(=O)N2CCN(c3ccc(F)cc3F)CC2)cc1	ZINC000875053629	GE	On-Demand	Anodyne	FAAH	19	40
NC(=O)COc1ccc(NC(=O)NCC2CCC3(CC2)CC3)cc1	ZINC000875053638	EF	On-Demand	Anodyne	EPHX2	22	44
COc1ccc([N+](=O)[O-])cc1NC(=O)c1cnn(C(C)C)c1Cl	ZINC000875053646	EG	On-Demand	Bother	KCNMA1	32	58
COc1ccc([N+](=O)[O-])cc1NC(=O)c1cnn(C(C)C)c1Cl	ZINC000875053646	EG	On-Demand	Bother	WDR5	36	41
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1OCCO[C@@H]1C(F)(F)F	ZINC000875053647	FD	On-Demand	Bother	KCNMA1	22	49
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1OCCO[C@@H]1C(F)(F)F	ZINC000875053647	FD	On-Demand	Bother	WDR5	30	40
NC(=O)COc1ccc(NC(=O)N2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000875053665	FD	On-Demand	Anodyne	EPHX2	61	41
NC(=O)COc1ccc(NC(=O)N2CCO[C@H](C(F)(F)F)CC2)cc1	ZINC000875053667	FD	On-Demand	Anodyne	EPHX2	61	41
COC(=O)N(C)NC(=O)NCCc1ccc(C(C)(C)C)cc1	ZINC000875053681	DE	On-Demand	Reactive	TRPV1	25	46
COC(=O)N(C)NC(=O)NCCc1ccc(C(C)(C)C)cc1	ZINC000875053681	DE	On-Demand	Reactive	MT-ND1	28	43
COCC(C)(C)CCNC(=O)C(=O)N[C@@H](C)CCc1ccc2c(c1)OCO2	ZINC000875053685	GE	On-Demand	Anodyne	BMP1	63	38
COCC(C)(C)CCNC(=O)C(=O)N[C@@H](C)CCc1ccc2c(c1)OCO2	ZINC000875053685	GE	On-Demand	Anodyne	NOS2	76	33
COCC(C)(C)CCNC(=O)C(=O)N[C@H](C)CCc1ccc2c(c1)OCO2	ZINC000875053686	GE	On-Demand	Anodyne	BMP1	63	38
COCC(C)(C)CCNC(=O)C(=O)N[C@H](C)CCc1ccc2c(c1)OCO2	ZINC000875053686	GE	On-Demand	Anodyne	NOS2	76	33
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCC2(CC1)OCCO2	ZINC000875053694	GF	On-Demand	Anodyne	SIGMAR1	20	40
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCC2(CC1)OCCO2	ZINC000875053694	GF	On-Demand	Anodyne	MTNR1A	24	40
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCC2(CC1)OCCO2	ZINC000875053694	GF	On-Demand	Anodyne	MTNR1B	24	40
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCC2(CC1)OCCO2	ZINC000875053694	GF	On-Demand	Anodyne	CES1	52	38
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCC2(CC1)OCCO2	ZINC000875053694	GF	On-Demand	Anodyne	C5AR1	31	40
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCC2(CC1)OCCO2	ZINC000875053694	GF	On-Demand	Anodyne	AMP1_PLAFQ	19	42
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875053708	GE	On-Demand	Anodyne	NOS2	92	35
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875053710	GE	On-Demand	Anodyne	NOS2	92	35
NC(=O)COc1ccc(NC(=O)NCCCCC2CC2)cc1	ZINC000875053711	DE	On-Demand	Anodyne	CA2	15	41
NC(=O)COc1ccc(NC(=O)NCCCCC2CC2)cc1	ZINC000875053711	DE	On-Demand	Anodyne	ADRB1	18	41
NC(=O)COc1ccc(NC(=O)NCCCCC2CC2)cc1	ZINC000875053711	DE	On-Demand	Anodyne	CA1	45	40
NC(=O)COc1ccc(NC(=O)NCCCCC2CC2)cc1	ZINC000875053711	DE	On-Demand	Anodyne	CA12	25	41
NC(=O)COc1ccc(NC(=O)NCCCCC2CC2)cc1	ZINC000875053711	DE	On-Demand	Anodyne	CA9	26	41
NC(=O)COc1ccc(NC(=O)NCCCCC2CC2)cc1	ZINC000875053711	DE	On-Demand	Anodyne	NCE103	20	40
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875053712	GE	On-Demand	Anodyne	NOS2	92	35
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875053714	GE	On-Demand	Anodyne	NOS2	92	35
Cc1csc([C@H]2CCN(C(=O)Nc3ccc(F)c(C(N)=O)c3)C2)n1	ZINC000875053716	EF	On-Demand	Anodyne	TRPC6	44	35
Cc1csc([C@H]2CCN(C(=O)Nc3ccc(F)c(C(N)=O)c3)C2)n1	ZINC000875053716	EF	On-Demand	Anodyne	TRPC3	42	35
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)NC[C@H]1CCS(=O)(=O)C1	ZINC000875053717	GG	On-Demand	Anodyne	MDM2	40	32
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)NC[C@H]1CCS(=O)(=O)C1	ZINC000875053717	GG	On-Demand	Anodyne	CACNA1I	50	39
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)NC[C@@H]1CCS(=O)(=O)C1	ZINC000875053719	GG	On-Demand	Anodyne	MDM2	40	32
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)NC[C@@H]1CCS(=O)(=O)C1	ZINC000875053719	GG	On-Demand	Anodyne	CACNA1I	50	39
O=C(NCCCn1cncn1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875053750	ED	On-Demand	Anodyne	HIS3	46	34
O=C(NCCCn1cncn1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875053751	ED	On-Demand	Anodyne	HIS3	46	34
O=C(NCCCn1cncn1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875053752	ED	On-Demand	Anodyne	HIS3	46	34
O=C(NCCCn1cncn1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875053753	ED	On-Demand	Anodyne	HIS3	46	34
CCOC1CC2(C1)C[C@H]2C(=O)Nc1cc([N+](=O)[O-])ccc1OC	ZINC000875053754	DF	On-Demand	Bother	CACNA1D	51	33
CCOC1CC2(C1)C[C@H]2C(=O)Nc1cc([N+](=O)[O-])ccc1OC	ZINC000875053754	DF	On-Demand	Bother	KCNMA1	21	48
COc1cccc(C(C)(C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)c1	ZINC000875053769	EH	On-Demand	Bother	CACNA1D	57	34
COc1cccc(C(C)(C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)c1	ZINC000875053769	EH	On-Demand	Bother	KCNMA1	23	54
COc1cccc(C(C)(C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)c1	ZINC000875053769	EH	On-Demand	Bother	TAAR1	26	47
COc1cccc(C(C)(C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)c1	ZINC000875053769	EH	On-Demand	Bother	AKR1C2	22	42
C#C[C@@H]1CC[C@@H](NC(=O)Nc2ccc(F)c(C(N)=O)c2)CC1	ZINC000875053772	DE	On-Demand	Mild	EPHX2	44	42
CCO[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1OC)[C@H]1CCOC1	ZINC000875053777	DD	On-Demand	Bother	KCNMA1	20	45
CCO[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1OC)[C@@H]1CCOC1	ZINC000875053778	DD	On-Demand	Bother	KCNMA1	20	45
COc1ccc([N+](=O)[O-])cc1NC(=O)c1ncc2n1CCCC2	ZINC000875053780	DE	On-Demand	Bother	KCNMA1	22	51
COc1ccc([N+](=O)[O-])cc1NC(=O)c1ncc2n1CCCC2	ZINC000875053780	DE	On-Demand	Bother	WDR5	33	44
O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccnn1CC1CCC1	ZINC000875053799	EG	On-Demand	Bother	TAAR1	21	42
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875053804	FC	On-Demand	Mild	SIGMAR1	21	41
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875053804	FC	On-Demand	Mild	SSTR5	54	37
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875053804	FC	On-Demand	Mild	PDK1	33	40
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875053804	FC	On-Demand	Mild	MCHR1	31	40
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875053805	FC	On-Demand	Mild	SIGMAR1	21	41
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875053805	FC	On-Demand	Mild	SSTR5	54	37
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875053805	FC	On-Demand	Mild	PDK1	33	40
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875053805	FC	On-Demand	Mild	MCHR1	31	40
O=C(COCC(F)F)Nc1cc([N+](=O)[O-])ccc1F	ZINC000875053813	CD	On-Demand	Bother	KCNMA1	19	40
CN1CCC(CNC(=O)Nc2ccc(OCC(N)=O)cc2)(c2ccccc2)CC1	ZINC000875053818	GE	On-Demand	Anodyne	KCNA3	48	40
CN1CCC(CNC(=O)Nc2ccc(OCC(N)=O)cc2)(c2ccccc2)CC1	ZINC000875053818	GE	On-Demand	Anodyne	NMBR	57	35
CN1CCC(CNC(=O)Nc2ccc(OCC(N)=O)cc2)(c2ccccc2)CC1	ZINC000875053818	GE	On-Demand	Anodyne	SOAT1	19	44
CN1CCC(CNC(=O)Nc2ccc(OCC(N)=O)cc2)(c2ccccc2)CC1	ZINC000875053818	GE	On-Demand	Anodyne	EPHX2	31	45
CN1CCC(CNC(=O)Nc2ccc(OCC(N)=O)cc2)(c2ccccc2)CC1	ZINC000875053818	GE	On-Demand	Anodyne	MCHR1	18	55
CN1CCC(CNC(=O)Nc2ccc(OCC(N)=O)cc2)(c2ccccc2)CC1	ZINC000875053818	GE	On-Demand	Anodyne	NPFFR1	22	41
O=C(NCCCn1cncn1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875053819	ED	On-Demand	Anodyne	HIS3	45	34
O=C(NCCCn1cncn1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875053820	ED	On-Demand	Anodyne	HIS3	45	34
O=C(NCCCn1cncn1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875053821	ED	On-Demand	Anodyne	HIS3	45	34
O=C(NCCCn1cncn1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875053822	ED	On-Demand	Anodyne	HIS3	45	34
O=C(Nc1ccc([N+](=O)[O-])cc1)[C@]12CCCC[C@H]1C2	ZINC000875053826	CG	On-Demand	Bother	NMBR	47	32
O=C(Nc1ccc([N+](=O)[O-])cc1)[C@@]12CCCC[C@H]1C2	ZINC000875053827	CG	On-Demand	Bother	NMBR	47	32
O=C(Nc1ccc([N+](=O)[O-])cc1)[C@@]12CCCC[C@@H]1C2	ZINC000875053828	CG	On-Demand	Bother	NMBR	47	32
O=C(Nc1ccc([N+](=O)[O-])cc1)[C@]12CCCC[C@@H]1C2	ZINC000875053829	CG	On-Demand	Bother	NMBR	47	32
CCO[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C1CC1	ZINC000875053835	CG	On-Demand	Bother	TAAR1	21	46
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(C)c1	ZINC000875053840	CE	On-Demand	Anodyne	ANPEP	25	61
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(C)c1	ZINC000875053840	CE	On-Demand	Anodyne	PDS	55	43
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875053847	FC	On-Demand	Mild	DRD4	22	40
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875053847	FC	On-Demand	Mild	SIGMAR1	22	40
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875053847	FC	On-Demand	Mild	SSTR5	52	38
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875053847	FC	On-Demand	Mild	PDK1	42	42
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875053847	FC	On-Demand	Mild	MCHR1	36	41
C[C@]1(C(F)(F)F)CCN(C(=O)Nc2ccc(OCC(N)=O)cc2)C1	ZINC000875053849	EE	On-Demand	Anodyne	EPHX2	61	50
C[C@]1(C(F)(F)F)CCN(C(=O)Nc2ccc(OCC(N)=O)cc2)C1	ZINC000875053849	EE	On-Demand	Anodyne	ACR	53	35
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875053850	FC	On-Demand	Mild	DRD4	22	40
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875053850	FC	On-Demand	Mild	SIGMAR1	22	40
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875053850	FC	On-Demand	Mild	SSTR5	52	38
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875053850	FC	On-Demand	Mild	PDK1	42	42
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875053850	FC	On-Demand	Mild	MCHR1	36	41
Cc1csc([C@H]2CCN(C(=O)Nc3ccc(OCC(N)=O)cc3)C2)n1	ZINC000875053878	FE	On-Demand	Anodyne	CPT1A	30	44
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NC[C@@H]1CCS(=O)(=O)C1	ZINC000875053879	FD	On-Demand	Anodyne	CACNA1I	42	32
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NC[C@H]1CCS(=O)(=O)C1	ZINC000875053880	FD	On-Demand	Anodyne	CACNA1I	42	32
O=C(NC[C@@H]1CCS(=O)(=O)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875053888	FC	On-Demand	Anodyne	ACHE	19	40
O=C(NC[C@H]1CCS(=O)(=O)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875053889	FC	On-Demand	Anodyne	ACHE	19	40
O=C(Nc1cc([N+](=O)[O-])ccc1F)c1cnn(CC2CC2)c1	ZINC000875053895	DF	On-Demand	Bother	WDR5	35	43
Cc1cccc(CNC(=O)N2CCC[C@@H](C(=O)N[C@H]3CCC[C@@H](O)C3)C2)c1	ZINC000875053913	FE	On-Demand	Anodyne	EPHX2	30	45
Cc1cccc(CNC(=O)N2CCC[C@@H](C(=O)N[C@@H]3CCC[C@@H](O)C3)C2)c1	ZINC000875053914	FE	On-Demand	Anodyne	EPHX2	30	45
Cc1cccc(CNC(=O)N2CCC[C@@H](C(=O)N[C@@H]3CCC[C@H](O)C3)C2)c1	ZINC000875053915	FE	On-Demand	Anodyne	EPHX2	30	45
Cc1cccc(CNC(=O)N2CCC[C@@H](C(=O)N[C@H]3CCC[C@H](O)C3)C2)c1	ZINC000875053916	FE	On-Demand	Anodyne	EPHX2	30	45
COC(=O)N(C)NC(=O)NCc1cccc(C)c1	ZINC000875053945	CD	On-Demand	Reactive	ROCK2	28	46
COC(=O)N(C)NC(=O)NCc1cccc(C)c1	ZINC000875053945	CD	On-Demand	Reactive	FBP1	15	40
COC(=O)N(C)NC(=O)NCc1cccc(C)c1	ZINC000875053945	CD	On-Demand	Reactive	HSD17B2	25	40
C#CC[C@@H](CCOC)NC(=O)NC1CCN(c2ccc(C(F)(F)F)cn2)CC1	ZINC000875053952	GF	On-Demand	Mild	HPGDS	31	42
COc1ccc([N+](=O)[O-])cc1NC(=O)c1nc(C(C)(C)C)cs1	ZINC000875053958	EH	On-Demand	Bother	KCNMA1	29	54
C#CC[C@H](CCOC)NC(=O)NC1CCN(c2ccc(C(F)(F)F)cn2)CC1	ZINC000875053960	GF	On-Demand	Mild	HPGDS	31	42
COCCCn1cc(C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cn1	ZINC000875053961	EF	On-Demand	Bother	TAAR1	26	48
COCCCn1cc(C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cn1	ZINC000875053961	EF	On-Demand	Bother	USP47	45	36
O=C(Nc1cc([N+](=O)[O-])ccc1F)c1ccnn1CC1CCC1	ZINC000875053978	DF	On-Demand	Bother	WDR5	36	41
O=C(NCC[C@H]1CCSC1)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875053979	GD	On-Demand	Anodyne	ACHE	23	50
O=C(NCC[C@H]1CCSC1)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875053979	GD	On-Demand	Anodyne	SIGMAR1	20	42
O=C(NCC[C@H]1CCSC1)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875053979	GD	On-Demand	Anodyne	SSTR5	41	36
O=C(NCC[C@@H]1CCSC1)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875053980	GD	On-Demand	Anodyne	ACHE	23	50
O=C(NCC[C@@H]1CCSC1)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875053980	GD	On-Demand	Anodyne	SIGMAR1	20	42
O=C(NCC[C@@H]1CCSC1)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875053980	GD	On-Demand	Anodyne	SSTR5	41	36
CCOC1CC2(C1)C[C@H]2C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000875053998	CF	On-Demand	Bother	TIMP3	47	31
CCOC1CC2(C1)C[C@H]2C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000875053998	CF	On-Demand	Bother	NMBR	47	31
CCOC1CC2(C1)C[C@H]2C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000875053998	CF	On-Demand	Bother	SLC27A4	45	35
O=C(Nc1cc([N+](=O)[O-])ccc1F)c1cc(C2CC2)[nH]c1C1CC1	ZINC000875054000	EI	On-Demand	Bother	KCNMA1	31	44
O=C(Nc1cc([N+](=O)[O-])ccc1F)c1cc(C2CC2)[nH]c1C1CC1	ZINC000875054000	EI	On-Demand	Bother	WDR5	36	43
CC(=O)CC(C)(C)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000875054001	DH	On-Demand	Bother	TAAR1	17	45
CC(=O)CC(C)(C)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000875054001	DH	On-Demand	Bother	IMDH_CRYPV	33	48
Cc1cccc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875054003	CF	On-Demand	Anodyne	F2	15	45
Cc1cccc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875054003	CF	On-Demand	Anodyne	CHRM3	18	43
Cc1cccc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875054003	CF	On-Demand	Anodyne	EPHX2	18	47
Cc1cccc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875054004	CF	On-Demand	Anodyne	F2	15	45
Cc1cccc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875054004	CF	On-Demand	Anodyne	CHRM3	18	43
Cc1cccc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875054004	CF	On-Demand	Anodyne	EPHX2	18	47
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875054009	GD	On-Demand	Anodyne	DRD4	27	42
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875054009	GD	On-Demand	Anodyne	ACHE	21	43
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875054009	GD	On-Demand	Anodyne	SIGMAR1	23	42
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875054009	GD	On-Demand	Anodyne	SSTR5	55	40
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875054009	GD	On-Demand	Anodyne	PDK1	41	41
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875054009	GD	On-Demand	Anodyne	MCHR1	45	43
O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1ccnn1CC1CCC1	ZINC000875054021	DF	On-Demand	Bother	TAAR1	16	40
O=C(Nc1cc([N+](=O)[O-])ccc1F)C12CC(C1)C2	ZINC000875054033	CE	On-Demand	Bother	KCNMA1	19	40
O=C(Nc1cc([N+](=O)[O-])ccc1F)C12CC(C1)C2	ZINC000875054033	CE	On-Demand	Bother	WDR5	37	43
COC1CC(C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1	ZINC000875054035	CF	On-Demand	Bother	TAAR1	21	47
CCO[C@H]1COCC[C@H]1CC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000875054038	DE	On-Demand	Bother	SLC27A4	45	33
CCO[C@H]1COCC[C@@H]1CC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000875054039	DE	On-Demand	Bother	SLC27A4	45	33
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccc(OC(F)(F)F)cc1	ZINC000875054051	FF	On-Demand	Anodyne	CTSS	17	42
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccc(OC(F)(F)F)cc1	ZINC000875054051	FF	On-Demand	Anodyne	EPHX2	41	38
CCO[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1F)C(C)C	ZINC000875054056	CF	On-Demand	Bother	KCNMA1	25	40
O=C(COCC(F)F)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000875054066	CE	On-Demand	Bother	TAAR1	15	44
O=C(COCC(F)F)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000875054066	CE	On-Demand	Bother	IMDH_CRYPV	31	43
COc1cccc(C(C)(C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)c1	ZINC000875054069	EH	On-Demand	Bother	CACNA1C	50	36
COc1cccc(C(C)(C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)c1	ZINC000875054069	EH	On-Demand	Bother	CACNA1D	81	36
COc1cccc(C(C)(C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)c1	ZINC000875054069	EH	On-Demand	Bother	KCNMA1	24	41
COc1cccc(C(C)(C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)c1	ZINC000875054069	EH	On-Demand	Bother	TAAR1	26	47
COc1cccc(C(C)(C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)c1	ZINC000875054069	EH	On-Demand	Bother	AKR1C2	21	42
Cc1cccc(CNC(=O)N[C@@H](C)C2CN(C(=O)OC(C)(C)C)C2)c1	ZINC000875054070	EG	On-Demand	Anodyne	GPR119	21	46
Cc1cccc(CNC(=O)N[C@H](C)C2CN(C(=O)OC(C)(C)C)C2)c1	ZINC000875054071	EG	On-Demand	Anodyne	GPR119	21	46
O=C(Nc1cc([N+](=O)[O-])ccc1F)c1ncc2n1CCCC2	ZINC000875054073	DF	On-Demand	Bother	WDR5	36	42
Cc1cccc(CNC(=O)N2CCC(C(=O)NCCO)CC2)c1	ZINC000875054075	DD	On-Demand	Anodyne	EPHX2	43	47
Cc1cccc(CNC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875054087	DG	On-Demand	Anodyne	FBP1	15	40
Cc1cccc(CNC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875054087	DG	On-Demand	Anodyne	EPHX2	17	41
COC1CC(C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)C1	ZINC000875054094	CE	On-Demand	Bother	TAAR1	21	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(C)c1	ZINC000875054109	DE	On-Demand	Anodyne	SLC6A4	36	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(C)c1	ZINC000875054109	DE	On-Demand	Anodyne	SLC6A3	68	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(C)c1	ZINC000875054110	DE	On-Demand	Anodyne	SLC6A4	36	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(C)c1	ZINC000875054110	DE	On-Demand	Anodyne	SLC6A3	68	40
COCCCn1cc(C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)cn1	ZINC000875054134	DE	On-Demand	Bother	TAAR1	27	48
O=C(Nc1ccc(F)c([N+](=O)[O-])c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875054138	EG	On-Demand	Bother	DRD4	39	41
O=C(Nc1ccc(F)c([N+](=O)[O-])c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875054138	EG	On-Demand	Bother	ACHE	38	49
O=C(Nc1ccc(F)c([N+](=O)[O-])c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875054138	EG	On-Demand	Bother	SIGMAR1	44	55
O=C(Nc1ccc(F)c([N+](=O)[O-])c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875054138	EG	On-Demand	Bother	CCR3	56	39
O=C(Nc1ccc(F)c([N+](=O)[O-])c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875054138	EG	On-Demand	Bother	MAPK1	22	43
O=C(Nc1ccc(F)c([N+](=O)[O-])c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875054138	EG	On-Demand	Bother	MCHR1	34	40
O=C(Nc1ccc(F)c([N+](=O)[O-])c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875054138	EG	On-Demand	Bother	CACNA1G	38	41
O=C(Nc1ccc(F)c([N+](=O)[O-])c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875054139	EG	On-Demand	Bother	DRD4	39	41
O=C(Nc1ccc(F)c([N+](=O)[O-])c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875054139	EG	On-Demand	Bother	ACHE	38	49
O=C(Nc1ccc(F)c([N+](=O)[O-])c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875054139	EG	On-Demand	Bother	SIGMAR1	44	55
O=C(Nc1ccc(F)c([N+](=O)[O-])c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875054139	EG	On-Demand	Bother	CCR3	56	39
O=C(Nc1ccc(F)c([N+](=O)[O-])c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875054139	EG	On-Demand	Bother	MAPK1	22	43
O=C(Nc1ccc(F)c([N+](=O)[O-])c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875054139	EG	On-Demand	Bother	MCHR1	34	40
O=C(Nc1ccc(F)c([N+](=O)[O-])c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875054139	EG	On-Demand	Bother	CACNA1G	38	41
O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)C12CC(C1)C2	ZINC000875054140	CF	On-Demand	Bother	ENV	41	36
CCO[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1F)C1CC1	ZINC000875054141	CE	On-Demand	Bother	CACNA1C	42	36
CCO[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1F)C1CC1	ZINC000875054141	CE	On-Demand	Bother	CACNA1D	64	36
CCO[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1F)C1CC1	ZINC000875054141	CE	On-Demand	Bother	SLC27A4	42	32
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(Cc4ccncc4)CC3)CC[C@@H]21	ZINC000875054144	GC	On-Demand	Anodyne	DRD4	21	41
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(Cc4ccncc4)CC3)CC[C@@H]21	ZINC000875054144	GC	On-Demand	Anodyne	SIGMAR1	21	43
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(Cc4ccncc4)CC3)CC[C@@H]21	ZINC000875054144	GC	On-Demand	Anodyne	SSTR5	48	37
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(Cc4ccncc4)CC3)CC[C@H]21	ZINC000875054147	GC	On-Demand	Anodyne	DRD4	21	41
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(Cc4ccncc4)CC3)CC[C@H]21	ZINC000875054147	GC	On-Demand	Anodyne	SIGMAR1	21	43
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(Cc4ccncc4)CC3)CC[C@H]21	ZINC000875054147	GC	On-Demand	Anodyne	SSTR5	48	37
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875054152	FD	On-Demand	Anodyne	DRD2	16	42
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875054152	FD	On-Demand	Anodyne	DRD4	23	41
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875054152	FD	On-Demand	Anodyne	ACHE	39	51
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875054152	FD	On-Demand	Anodyne	SIGMAR1	26	44
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875054152	FD	On-Demand	Anodyne	SSTR5	49	38
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875054152	FD	On-Demand	Anodyne	PDK1	33	40
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875054152	FD	On-Demand	Anodyne	MCHR1	41	43
O=C(Nc1cc([N+](=O)[O-])ccc1F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875054161	EG	On-Demand	Bother	DRD4	41	44
O=C(Nc1cc([N+](=O)[O-])ccc1F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875054161	EG	On-Demand	Bother	ACHE	40	49
O=C(Nc1cc([N+](=O)[O-])ccc1F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875054161	EG	On-Demand	Bother	SLC6A1	49	32
O=C(Nc1cc([N+](=O)[O-])ccc1F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875054161	EG	On-Demand	Bother	SIGMAR1	47	52
O=C(Nc1cc([N+](=O)[O-])ccc1F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875054161	EG	On-Demand	Bother	CCR3	47	42
O=C(Nc1cc([N+](=O)[O-])ccc1F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875054161	EG	On-Demand	Bother	SLC18A3	21	41
O=C(Nc1cc([N+](=O)[O-])ccc1F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875054161	EG	On-Demand	Bother	CACNA1G	43	42
O=C(Nc1cc([N+](=O)[O-])ccc1F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875054162	EG	On-Demand	Bother	DRD4	41	44
O=C(Nc1cc([N+](=O)[O-])ccc1F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875054162	EG	On-Demand	Bother	ACHE	40	49
O=C(Nc1cc([N+](=O)[O-])ccc1F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875054162	EG	On-Demand	Bother	SLC6A1	49	32
O=C(Nc1cc([N+](=O)[O-])ccc1F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875054162	EG	On-Demand	Bother	SIGMAR1	47	52
O=C(Nc1cc([N+](=O)[O-])ccc1F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875054162	EG	On-Demand	Bother	CCR3	47	42
O=C(Nc1cc([N+](=O)[O-])ccc1F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875054162	EG	On-Demand	Bother	SLC18A3	21	41
O=C(Nc1cc([N+](=O)[O-])ccc1F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875054162	EG	On-Demand	Bother	CACNA1G	43	42
Cc1cccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875054173	DH	On-Demand	Anodyne	GRIN2B	17	41
Cc1cccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875054173	DH	On-Demand	Anodyne	EPHX2	28	45
Cc1cccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875054173	DH	On-Demand	Anodyne	TPSAB1	23	42
Cc1cccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875054174	DH	On-Demand	Anodyne	GRIN2B	17	41
Cc1cccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875054174	DH	On-Demand	Anodyne	EPHX2	28	45
Cc1cccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875054174	DH	On-Demand	Anodyne	TPSAB1	23	42
CCO[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1F)C1CCCC1	ZINC000875054188	DG	On-Demand	Bother	CACNA1D	55	35
O=C(Nc1cc([N+](=O)[O-])ccc1F)C1CCC=CCC1	ZINC000875054196	CG	On-Demand	Bother	WDR5	34	40
C[C@@]1(Br)C[C@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000875054202	CF	On-Demand	Bother	SLC27A4	43	32
C[C@@]1(Br)C[C@@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000875054204	CF	On-Demand	Bother	SLC27A4	43	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(CN3CCCC3=O)cc2)C1	ZINC000875054206	GD	On-Demand	Anodyne	DPP7	40	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(CN3CCCC3=O)cc2)C1	ZINC000875054207	GD	On-Demand	Anodyne	DPP7	40	35
C[C@@H]1C[C@]1(C(=O)Nc1ccc([N+](=O)[O-])cc1)C(=O)OC(C)(C)C	ZINC000875054208	DF	On-Demand	Bother	NMBR	52	30
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C)s1	ZINC000875054210	DE	On-Demand	Anodyne	SLC6A2	15	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C)s1	ZINC000875054210	DE	On-Demand	Anodyne	SLC6A4	39	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C)s1	ZINC000875054210	DE	On-Demand	Anodyne	SLC6A3	76	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C)s1	ZINC000875054211	DE	On-Demand	Anodyne	SLC6A2	15	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C)s1	ZINC000875054211	DE	On-Demand	Anodyne	SLC6A4	39	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C)s1	ZINC000875054211	DE	On-Demand	Anodyne	SLC6A3	76	42
CCCCCCCNC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875054212	FE	On-Demand	Mild	DRD4	27	42
CCCCCCCNC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875054212	FE	On-Demand	Mild	ACHE	22	44
CCCCCCCNC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875054212	FE	On-Demand	Mild	HTR4	24	40
CCCCCCCNC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875054212	FE	On-Demand	Mild	SIGMAR1	25	44
CCCCCCCNC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875054212	FE	On-Demand	Mild	SSTR5	76	42
CCCCCCCNC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875054212	FE	On-Demand	Mild	EPHX2	15	44
CCCCCCCNC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875054212	FE	On-Demand	Mild	PDK1	26	40
CCCCCCCNC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875054212	FE	On-Demand	Mild	CXCR3	26	40
CCCCCCCNC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875054212	FE	On-Demand	Mild	MCHR1	46	41
CCCCCCCNC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875054212	FE	On-Demand	Mild	ASAH1	59	33
O=C(Nc1cc([N+](=O)[O-])ccc1F)c1ccc(C2CCOCC2)cc1	ZINC000875054224	EH	On-Demand	Bother	WDR5	36	45
O=C(CC(F)(F)C(F)(F)F)Nc1ccc([N+](=O)[O-])cc1	ZINC000875054225	CG	On-Demand	Bother	MMP2	15	45
O=C(CC(F)(F)C(F)(F)F)Nc1ccc([N+](=O)[O-])cc1	ZINC000875054225	CG	On-Demand	Bother	MMP8	30	45
O=C(CC(F)(F)C(F)(F)F)Nc1ccc([N+](=O)[O-])cc1	ZINC000875054225	CG	On-Demand	Bother	MMP9	16	45
O=C(CC(F)(F)C(F)(F)F)Nc1ccc([N+](=O)[O-])cc1	ZINC000875054225	CG	On-Demand	Bother	MMP1	23	45
C#CC[C@@H](COC)NC(=O)NC1CCN(c2ccc(C(F)(F)F)cn2)CC1	ZINC000875054235	GE	On-Demand	Mild	HPGDS	30	41
C#CC[C@H](COC)NC(=O)NC1CCN(c2ccc(C(F)(F)F)cn2)CC1	ZINC000875054236	GE	On-Demand	Mild	HPGDS	30	41
CCO[C@@H](C(=O)Nc1ccc(F)c([N+](=O)[O-])c1)C1CCOCC1	ZINC000875054274	EF	On-Demand	Bother	TAAR1	18	43
CCO[C@@H](C(=O)Nc1ccc(F)c([N+](=O)[O-])c1)C1CC1	ZINC000875054277	CE	On-Demand	Bother	TAAR1	22	46
Cc1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875054287	DD	On-Demand	Anodyne	DRD4	29	49
Cc1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875054287	DD	On-Demand	Anodyne	CHRM3	23	46
Cc1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875054287	DD	On-Demand	Anodyne	CCR2	27	41
Cc1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875054287	DD	On-Demand	Anodyne	EPHX2	19	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2c(OC)ccc3ccccc23)C1	ZINC000875054296	FG	On-Demand	Anodyne	XIAP	48	38
C[C@@H]1CCn2cc(C(=O)Nc3cc([N+](=O)[O-])ccc3F)nc2C1	ZINC000875054304	DF	On-Demand	Bother	WDR5	39	44
Cc1cccc(CNC(=O)N2CCC(c3nccc(-c4cccnc4)n3)CC2)c1	ZINC000875054311	GH	On-Demand	Anodyne	ABL1	15	44
Cc1cccc(CNC(=O)N2CCC(c3nccc(-c4cccnc4)n3)CC2)c1	ZINC000875054311	GH	On-Demand	Anodyne	C3AR1	35	40
Cc1cccc(CNC(=O)N2CCC(c3nccc(-c4cccnc4)n3)CC2)c1	ZINC000875054311	GH	On-Demand	Anodyne	ROCK1	15	40
Cc1cccc(CNC(=O)N2CCC(c3nccc(-c4cccnc4)n3)CC2)c1	ZINC000875054311	GH	On-Demand	Anodyne	ROCK2	15	40
Cc1cccc(CNC(=O)N2CCC(c3nccc(-c4cccnc4)n3)CC2)c1	ZINC000875054311	GH	On-Demand	Anodyne	NAMPT	54	35
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3cccc(C)c3)C[C@@H]1C2	ZINC000875054317	DE	On-Demand	Anodyne	EPHX2	15	41
Cc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875054319	DG	On-Demand	Anodyne	F2	44	44
Cc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875054319	DG	On-Demand	Anodyne	ACE	41	39
Cc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875054319	DG	On-Demand	Anodyne	TRY1_BOVIN	43	39
Cc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875054319	DG	On-Demand	Anodyne	PREP	47	45
Cc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875054319	DG	On-Demand	Anodyne	TMPRSS11D	63	35
Cc1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875054320	DG	On-Demand	Anodyne	F2	44	44
Cc1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875054320	DG	On-Demand	Anodyne	ACE	41	39
Cc1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875054320	DG	On-Demand	Anodyne	TRY1_BOVIN	43	39
Cc1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875054320	DG	On-Demand	Anodyne	PREP	47	45
Cc1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875054320	DG	On-Demand	Anodyne	TMPRSS11D	63	35
Cc1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875054321	DG	On-Demand	Anodyne	F2	44	44
Cc1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875054321	DG	On-Demand	Anodyne	ACE	41	39
Cc1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875054321	DG	On-Demand	Anodyne	TRY1_BOVIN	43	39
Cc1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875054321	DG	On-Demand	Anodyne	PREP	47	45
Cc1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875054321	DG	On-Demand	Anodyne	TMPRSS11D	63	35
Cc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875054322	DG	On-Demand	Anodyne	F2	44	44
Cc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875054322	DG	On-Demand	Anodyne	ACE	41	39
Cc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875054322	DG	On-Demand	Anodyne	TRY1_BOVIN	43	39
Cc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875054322	DG	On-Demand	Anodyne	PREP	47	45
Cc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875054322	DG	On-Demand	Anodyne	TMPRSS11D	63	35
CC(=O)CC(C)(C)CC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000875054323	CG	On-Demand	Bother	WDR5	34	40
CCO[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C1CCOCC1	ZINC000875054338	EG	On-Demand	Bother	TAAR1	19	43
O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)c1cnn(CC2CC2)c1	ZINC000875054339	DG	On-Demand	Bother	TAAR1	22	43
CCO[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[C@H]1CCOC1	ZINC000875054341	CD	On-Demand	Bother	SLC27A4	44	33
CCO[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[C@@H]1CCOC1	ZINC000875054343	CD	On-Demand	Bother	SLC27A4	44	33
CC(=O)CC(C)(C)CC(=O)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000875054357	CG	On-Demand	Bother	TAAR1	17	45
O=C(NC1CCN(Cc2ccncc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875054385	ED	On-Demand	Anodyne	DRD4	21	43
O=C(NC1CCN(Cc2ccncc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875054385	ED	On-Demand	Anodyne	SIGMAR1	24	45
O=C(NC1CCN(Cc2ccncc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875054385	ED	On-Demand	Anodyne	SSTR5	46	37
O=C(NC1CCN(Cc2ccncc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875054385	ED	On-Demand	Anodyne	CXCR3	19	40
O=C(NC1CCN(Cc2ccncc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875054386	ED	On-Demand	Anodyne	DRD4	21	43
O=C(NC1CCN(Cc2ccncc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875054386	ED	On-Demand	Anodyne	SIGMAR1	24	45
O=C(NC1CCN(Cc2ccncc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875054386	ED	On-Demand	Anodyne	SSTR5	46	37
O=C(NC1CCN(Cc2ccncc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875054386	ED	On-Demand	Anodyne	CXCR3	19	40
O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1ccc(C2CCOCC2)cc1	ZINC000875054390	EH	On-Demand	Bother	TAAR1	27	49
COC(=O)N(C)NC(=O)NC1CCN(c2ccc(C(F)(F)F)cn2)CC1	ZINC000875054393	GD	On-Demand	Reactive	EPHX2	31	41
COC(=O)N(C)NC(=O)NC1CCN(c2ccc(C(F)(F)F)cn2)CC1	ZINC000875054393	GD	On-Demand	Reactive	LIPG	45	38
COC(=O)N(C)NC(=O)NC1CCN(c2ccc(C(F)(F)F)cn2)CC1	ZINC000875054393	GD	On-Demand	Reactive	HPGDS	24	41
O=C(NCCC[C@H]1C=CCC1)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875054416	FE	On-Demand	Anodyne	SIGMAR1	18	41
O=C(NCCC[C@H]1C=CCC1)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875054416	FE	On-Demand	Anodyne	SSTR5	40	36
O=C(NCCC[C@@H]1C=CCC1)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875054417	FE	On-Demand	Anodyne	SIGMAR1	18	41
O=C(NCCC[C@@H]1C=CCC1)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875054417	FE	On-Demand	Anodyne	SSTR5	40	36
Cc1cccc(CNC(=O)NC2(C)CC(F)(F)C2)c1	ZINC000875054427	CF	On-Demand	Anodyne	ROCK2	15	44
Cc1cccc(CNC(=O)NC2(C)CC(F)(F)C2)c1	ZINC000875054427	CF	On-Demand	Anodyne	FBP1	15	40
C=CC(C)(C)CCCNC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875054433	FE	On-Demand	Mild	SIGMAR1	19	40
C=CC(C)(C)CCCNC(=O)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875054433	FE	On-Demand	Mild	SSTR5	47	37
O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccn(C2CCOCC2)n1	ZINC000875054436	FG	On-Demand	Bother	TAAR1	16	42
O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1cnn(CC2CC2)c1	ZINC000875054440	DF	On-Demand	Bother	TAAR1	19	43
CCO[C@@H](C(=O)Nc1ccc(F)c([N+](=O)[O-])c1)C(C)C	ZINC000875054445	CF	On-Demand	Bother	COLA	50	38
CCO[C@@H](C(=O)Nc1ccc(F)c([N+](=O)[O-])c1)C(C)C	ZINC000875054445	CF	On-Demand	Bother	TAAR1	21	46
CCO[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)C1CCOCC1	ZINC000875054468	DE	On-Demand	Bother	SLC27A4	50	34
O=C(NC1CCN(Cc2ccncc2)CC1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875054472	GD	On-Demand	Anodyne	DRD4	16	40
O=C(NC1CCN(Cc2ccncc2)CC1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875054472	GD	On-Demand	Anodyne	SIGMAR1	20	45
O=C(NC1CCN(Cc2ccncc2)CC1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875054473	GD	On-Demand	Anodyne	DRD4	16	40
O=C(NC1CCN(Cc2ccncc2)CC1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875054473	GD	On-Demand	Anodyne	SIGMAR1	20	45
O=C(NC1CCN(Cc2ccncc2)CC1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875054474	GD	On-Demand	Anodyne	DRD4	16	40
O=C(NC1CCN(Cc2ccncc2)CC1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875054474	GD	On-Demand	Anodyne	SIGMAR1	20	45
O=C(NC1CCN(Cc2ccncc2)CC1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875054475	GD	On-Demand	Anodyne	DRD4	16	40
O=C(NC1CCN(Cc2ccncc2)CC1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875054475	GD	On-Demand	Anodyne	SIGMAR1	20	45
COCCCn1cc(C(=O)Nc2cc([N+](=O)[O-])ccc2F)cn1	ZINC000875054476	DE	On-Demand	Bother	WDR5	37	46
O=C(NCc1ncc(Cl)s1)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875054479	GD	On-Demand	Anodyne	DRD4	18	40
O=C(NCc1ncc(Cl)s1)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875054479	GD	On-Demand	Anodyne	SIGMAR1	21	43
O=C(NCc1ncc(Cl)s1)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875054479	GD	On-Demand	Anodyne	SSTR5	49	40
O=C(NCc1ncc(Cl)s1)C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875054479	GD	On-Demand	Anodyne	MCHR1	35	41
COc1cccc(C(C)(C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1	ZINC000875054511	EH	On-Demand	Bother	TAAR1	28	44
COc1cccc(C(C)(C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1	ZINC000875054511	EH	On-Demand	Bother	AKR1C2	18	42
COC1CC(C(=O)Nc2cc([N+](=O)[O-])ccc2F)C1	ZINC000875054524	CE	On-Demand	Bother	KCNMA1	22	45
COC1CC(C(=O)Nc2cc([N+](=O)[O-])ccc2F)C1	ZINC000875054524	CE	On-Demand	Bother	WDR5	36	43
O=C(CCCOC1CCOCC1)Nc1ccc([N+](=O)[O-])cc1	ZINC000875054531	DF	On-Demand	Bother	SLC27A4	44	33
Cc1cccc(CNC(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)C[C@@H]2O)c1	ZINC000875054532	FE	On-Demand	Anodyne	EPHX2	15	40
Cc1cccc(CNC(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)C[C@@H]2O)c1	ZINC000875054532	FE	On-Demand	Anodyne	GPR119	38	48
Cc1cccc(CNC(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)C[C@@H]2O)c1	ZINC000875054533	FE	On-Demand	Anodyne	EPHX2	15	40
Cc1cccc(CNC(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)C[C@@H]2O)c1	ZINC000875054533	FE	On-Demand	Anodyne	GPR119	38	48
Cc1cccc(CNC(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)C[C@H]2O)c1	ZINC000875054534	FE	On-Demand	Anodyne	EPHX2	15	40
Cc1cccc(CNC(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)C[C@H]2O)c1	ZINC000875054534	FE	On-Demand	Anodyne	GPR119	38	48
Cc1cccc(CNC(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)C[C@H]2O)c1	ZINC000875054535	FE	On-Demand	Anodyne	EPHX2	15	40
Cc1cccc(CNC(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)C[C@H]2O)c1	ZINC000875054535	FE	On-Demand	Anodyne	GPR119	38	48
Cc1cccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875054570	CE	On-Demand	Anodyne	CHRM3	17	42
Cc1cccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875054570	CE	On-Demand	Anodyne	GRIN2B	22	45
Cc1cccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875054570	CE	On-Demand	Anodyne	EPHX2	21	40
Cc1cccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875054571	CE	On-Demand	Anodyne	CHRM3	17	42
Cc1cccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875054571	CE	On-Demand	Anodyne	GRIN2B	22	45
Cc1cccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875054571	CE	On-Demand	Anodyne	EPHX2	21	40
Cc1ccn(C[C@H](C)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)n1	ZINC000875054579	DG	On-Demand	Bother	COLA	18	41
Cc1cccc(CNC(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875054580	CD	On-Demand	Anodyne	FBP1	15	40
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000875054581	FD	On-Demand	Anodyne	SIGMAR1	21	44
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000875054581	FD	On-Demand	Anodyne	SSTR5	75	39
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000875054581	FD	On-Demand	Anodyne	MCHR1	33	40
C[C@@]1(Br)C[C@@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000875054591	DF	On-Demand	Bother	KCNMA1	19	40
C[C@@]1(Br)C[C@@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000875054591	DF	On-Demand	Bother	WDR5	35	41
C[C@@]1(Br)C[C@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000875054592	DF	On-Demand	Bother	KCNMA1	19	40
C[C@@]1(Br)C[C@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000875054592	DF	On-Demand	Bother	WDR5	35	41
O=C(COCC(F)F)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000875054598	CD	On-Demand	Bother	TAAR1	16	45
CCC(=O)Nc1cccc(CNC(=O)N2CC[C@@H]3[C@@H](CCN3C)C2)c1	ZINC000875054612	EE	On-Demand	Anodyne	HTR1D	24	42
CCC(=O)Nc1cccc(CNC(=O)N2CC[C@@H]3[C@@H](CCN3C)C2)c1	ZINC000875054612	EE	On-Demand	Anodyne	HTR1B	25	42
CCC(=O)Nc1cccc(CNC(=O)N2CC[C@@H]3[C@H](CCN3C)C2)c1	ZINC000875054613	EE	On-Demand	Anodyne	HTR1D	24	42
CCC(=O)Nc1cccc(CNC(=O)N2CC[C@@H]3[C@H](CCN3C)C2)c1	ZINC000875054613	EE	On-Demand	Anodyne	HTR1B	25	42
CCC(=O)Nc1cccc(CNC(=O)N2CC[C@H]3[C@@H](CCN3C)C2)c1	ZINC000875054614	EE	On-Demand	Anodyne	HTR1D	24	42
CCC(=O)Nc1cccc(CNC(=O)N2CC[C@H]3[C@@H](CCN3C)C2)c1	ZINC000875054614	EE	On-Demand	Anodyne	HTR1B	25	42
CCC(=O)Nc1cccc(CNC(=O)N2CC[C@H]3[C@H](CCN3C)C2)c1	ZINC000875054615	EE	On-Demand	Anodyne	HTR1D	24	42
CCC(=O)Nc1cccc(CNC(=O)N2CC[C@H]3[C@H](CCN3C)C2)c1	ZINC000875054615	EE	On-Demand	Anodyne	HTR1B	25	42
O=C(NCc1cccnc1-n1ccnc1)C(=O)N[C@H]1CO[C@H](C2CC2)C1	ZINC000875054623	FC	On-Demand	Anodyne	NOS2	58	31
O=C(NCc1cccnc1-n1ccnc1)C(=O)N[C@@H]1CO[C@H](C2CC2)C1	ZINC000875054624	FC	On-Demand	Anodyne	NOS2	58	31
O=C(NCc1cccnc1-n1ccnc1)C(=O)N[C@H]1CO[C@@H](C2CC2)C1	ZINC000875054625	FC	On-Demand	Anodyne	NOS2	58	31
O=C(NCc1cccnc1-n1ccnc1)C(=O)N[C@@H]1CO[C@@H](C2CC2)C1	ZINC000875054627	FC	On-Demand	Anodyne	NOS2	58	31
CCC(=O)Nc1cccc(CNC(=O)N2CCc3cccc(NC(C)=O)c3C2)c1	ZINC000875054634	GG	On-Demand	Anodyne	P2RY14	51	39
O=C(NCc1ccnc(F)c1)NC1CCN(c2ccc(C(F)(F)F)cn2)CC1	ZINC000875054702	GG	On-Demand	Anodyne	CCR2	48	36
O=C(NCc1ccnc(F)c1)NC1CCN(c2ccc(C(F)(F)F)cn2)CC1	ZINC000875054702	GG	On-Demand	Anodyne	CXCR3	19	44
O=C(NCc1ccnc(F)c1)NC1CCN(c2ccc(C(F)(F)F)cn2)CC1	ZINC000875054702	GG	On-Demand	Anodyne	MCHR1	15	45
O=C(NCc1ccnc(F)c1)NC1CCN(c2ccc(C(F)(F)F)cn2)CC1	ZINC000875054702	GG	On-Demand	Anodyne	HPGDS	31	42
O=CN1CCCN(C(=O)NC2CCN(c3ccc(C(F)(F)F)cn3)CC2)CC1	ZINC000875054712	GD	On-Demand	Anodyne	DGAT1	19	46
O=CN1CCCN(C(=O)NC2CCN(c3ccc(C(F)(F)F)cn3)CC2)CC1	ZINC000875054712	GD	On-Demand	Anodyne	HPGDS	19	43
CCC[C@@H](NC(=O)c1c(Cl)nn(C)c1Cl)c1ccccc1	ZINC000875054716	EH	On-Demand	Anodyne	TACR3	55	46
CCC[C@@H](NC(=O)c1c(Cl)nn(C)c1Cl)c1ccccc1	ZINC000875054716	EH	On-Demand	Anodyne	SOAT1	35	42
CCC[C@@H](NC(=O)c1c(Cl)nn(C)c1Cl)c1ccccc1	ZINC000875054716	EH	On-Demand	Anodyne	UTS2	61	38
CCC[C@H](NC(=O)c1c(Cl)nn(C)c1Cl)c1ccccc1	ZINC000875054718	EH	On-Demand	Anodyne	TACR3	55	46
CCC[C@H](NC(=O)c1c(Cl)nn(C)c1Cl)c1ccccc1	ZINC000875054718	EH	On-Demand	Anodyne	SOAT1	35	42
CCC[C@H](NC(=O)c1c(Cl)nn(C)c1Cl)c1ccccc1	ZINC000875054718	EH	On-Demand	Anodyne	UTS2	61	38
CCO[C@@H](C(=O)Nc1ccc(F)c([N+](=O)[O-])c1)C1CCCC1	ZINC000875054726	DG	On-Demand	Bother	TAAR1	20	44
CCC(=O)Nc1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875054728	FD	On-Demand	Anodyne	DRD4	24	41
CCC(=O)Nc1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875054728	FD	On-Demand	Anodyne	CCR3	50	40
CCC(=O)Nc1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875054728	FD	On-Demand	Anodyne	CCR2	25	40
CCC(=O)Nc1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875054728	FD	On-Demand	Anodyne	EPHX2	26	41
CCC(=O)Nc1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875054728	FD	On-Demand	Anodyne	CXCR3	18	40
CCC(=O)Nc1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875054728	FD	On-Demand	Anodyne	MCHR1	18	41
CCC(=O)Nc1cccc(CNC(=O)N[C@H](CC)c2cccc(OC)c2OC)c1	ZINC000875054752	GI	On-Demand	Anodyne	MTNR1B	15	41
CCC(=O)Nc1cccc(CNC(=O)N[C@H](CC)c2cccc(OC)c2OC)c1	ZINC000875054752	GI	On-Demand	Anodyne	KCNK3	49	38
CCC(=O)Nc1cccc(CNC(=O)N[C@H](CC)c2cccc(OC)c2OC)c1	ZINC000875054752	GI	On-Demand	Anodyne	KCNK9	41	38
CCC(=O)Nc1cccc(CNC(=O)N[C@H](CC)c2cccc(OC)c2OC)c1	ZINC000875054752	GI	On-Demand	Anodyne	PDS	45	34
CCC(=O)Nc1cccc(CNC(=O)N[C@@H](CC)c2cccc(OC)c2OC)c1	ZINC000875054754	GI	On-Demand	Anodyne	MTNR1B	15	41
CCC(=O)Nc1cccc(CNC(=O)N[C@@H](CC)c2cccc(OC)c2OC)c1	ZINC000875054754	GI	On-Demand	Anodyne	KCNK3	49	38
CCC(=O)Nc1cccc(CNC(=O)N[C@@H](CC)c2cccc(OC)c2OC)c1	ZINC000875054754	GI	On-Demand	Anodyne	KCNK9	41	38
CCC(=O)Nc1cccc(CNC(=O)N[C@@H](CC)c2cccc(OC)c2OC)c1	ZINC000875054754	GI	On-Demand	Anodyne	PDS	45	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000875054766	FC	On-Demand	Anodyne	DRD4	21	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000875054766	FC	On-Demand	Anodyne	SIGMAR1	22	45
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000875054766	FC	On-Demand	Anodyne	SSTR5	47	37
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000875054766	FC	On-Demand	Anodyne	MCHR1	34	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000875054766	FC	On-Demand	Anodyne	CACNA1G	17	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000875054767	FC	On-Demand	Anodyne	DRD4	21	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000875054767	FC	On-Demand	Anodyne	SIGMAR1	22	45
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000875054767	FC	On-Demand	Anodyne	SSTR5	47	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000875054767	FC	On-Demand	Anodyne	MCHR1	34	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000875054767	FC	On-Demand	Anodyne	CACNA1G	17	41
O=C(NC1CCN(Cc2ccncc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875054768	FD	On-Demand	Anodyne	DRD4	20	43
O=C(NC1CCN(Cc2ccncc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875054768	FD	On-Demand	Anodyne	SIGMAR1	24	48
O=C(NC1CCN(Cc2ccncc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875054768	FD	On-Demand	Anodyne	SSTR5	50	37
O=C(NC1CCN(Cc2ccncc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875054768	FD	On-Demand	Anodyne	MCHR1	33	40
CCC(=O)Nc1cccc(CNC(=O)N2CCC(C(C)=O)CC2)c1	ZINC000875054772	EF	On-Demand	Anodyne	HTR1D	23	41
CCC(=O)Nc1cccc(CNC(=O)N2CCC(C(C)=O)CC2)c1	ZINC000875054772	EF	On-Demand	Anodyne	HTR1B	23	41
CCC(=O)Nc1cccc(CNC(=O)N2CCC(C(C)=O)CC2)c1	ZINC000875054772	EF	On-Demand	Anodyne	EPHX2	30	40
CCC(=O)Nc1cccc(CNC(=O)N2CCC(C(C)=O)CC2)c1	ZINC000875054772	EF	On-Demand	Anodyne	P2RY14	42	32
O=C(NCc1cccnc1-n1ccnc1)C(=O)NCC1CC=CC1	ZINC000875054776	EC	On-Demand	Anodyne	NOS2	84	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2cccnc2-n2ccnc2)C1	ZINC000875054777	FC	On-Demand	Anodyne	NOS2	94	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2cccnc2-n2ccnc2)C1	ZINC000875054778	FC	On-Demand	Anodyne	NOS2	94	35
CCC(=O)Nc1cccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875054781	EE	On-Demand	Anodyne	HTR1D	18	40
CCC(=O)Nc1cccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875054781	EE	On-Demand	Anodyne	HTR1B	17	40
CCC(=O)Nc1cccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875054781	EE	On-Demand	Anodyne	ST14	42	34
CCC(=O)Nc1cccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875054782	EE	On-Demand	Anodyne	HTR1D	18	40
CCC(=O)Nc1cccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875054782	EE	On-Demand	Anodyne	HTR1B	17	40
CCC(=O)Nc1cccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875054782	EE	On-Demand	Anodyne	ST14	42	34
COc1ccccc1[C@@H]1CSCCCN1C(=O)NCCCn1cccn1	ZINC000875054784	FG	On-Demand	Anodyne	DRD2	20	40
COc1ccccc1[C@@H]1CSCCCN1C(=O)NCCCn1cccn1	ZINC000875054784	FG	On-Demand	Anodyne	DRD3	30	40
CCC(=O)Nc1cccc(CNC(=O)N2C[C@H]3C(=O)N(C)C(=O)[C@H]3C2)c1	ZINC000875054786	FC	On-Demand	Anodyne	HTR1D	19	41
CCC(=O)Nc1cccc(CNC(=O)N2C[C@H]3C(=O)N(C)C(=O)[C@H]3C2)c1	ZINC000875054786	FC	On-Demand	Anodyne	HTR1B	15	41
CCC(=O)Nc1cccc(CNC(=O)N2CCCN(C=O)CC2)c1	ZINC000875054791	ED	On-Demand	Anodyne	HTR1B	16	40
CCC(=O)Nc1cccc(CNC(=O)N2CCCN(C=O)CC2)c1	ZINC000875054791	ED	On-Demand	Anodyne	P2RY14	44	34
CCC(=O)Nc1cccc(CNC(=O)N2CCO[C@H](c3ccccc3OC)C2)c1	ZINC000875054792	GG	On-Demand	Anodyne	DRD4	19	44
CCC(=O)Nc1cccc(CNC(=O)N2CCO[C@@H](c3ccccc3OC)C2)c1	ZINC000875054793	GG	On-Demand	Anodyne	DRD4	19	44
O=C(NCc1cccnc1-n1ccnc1)C(=O)NC[C@@H]1CCN1C1CCCC1	ZINC000875054797	GD	On-Demand	Anodyne	NOS2	93	36
O=C(NCc1cccnc1-n1ccnc1)C(=O)NC[C@H]1CCN1C1CCCC1	ZINC000875054798	GD	On-Demand	Anodyne	NOS2	93	36
CCC(=O)Nc1cccc(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000875054811	GG	On-Demand	Anodyne	ROCK2	15	43
CCC(=O)Nc1cccc(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000875054811	GG	On-Demand	Anodyne	PDS	53	38
CCC(=O)Nc1cccc(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000875054812	GG	On-Demand	Anodyne	ROCK2	15	43
CCC(=O)Nc1cccc(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000875054812	GG	On-Demand	Anodyne	PDS	53	38
O=C(NCc1cccc(NC(=O)c2ccccc2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875054824	FF	On-Demand	Anodyne	PRNP	25	41
O=C(NCc1cccc(NC(=O)c2ccccc2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875054824	FF	On-Demand	Anodyne	ROCK2	20	43
O=C(NCc1cccc(NC(=O)c2ccccc2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875054824	FF	On-Demand	Anodyne	EPHX2	19	40
O=C(NCc1cccc(NC(=O)c2ccccc2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875054824	FF	On-Demand	Anodyne	KCNK3	106	44
O=C(NCc1cccc(NC(=O)c2ccccc2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875054824	FF	On-Demand	Anodyne	KCNK9	57	42
CC(=O)C1CCN(C(=O)C(=O)NCc2cccnc2-n2ccnc2)CC1	ZINC000875054825	FC	On-Demand	Anodyne	NOS2	93	35
COc1ccccc1[C@H]1CCCN(C(=O)NCCCn2cccn2)CC1	ZINC000875054826	FG	On-Demand	Anodyne	HTR1A	29	40
COc1ccccc1[C@H]1CCCN(C(=O)NCCCn2cccn2)CC1	ZINC000875054826	FG	On-Demand	Anodyne	DRD2	31	44
COc1ccccc1[C@H]1CCCN(C(=O)NCCCn2cccn2)CC1	ZINC000875054826	FG	On-Demand	Anodyne	DRD4	15	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCn2cccn2)CC1	ZINC000875054827	FG	On-Demand	Anodyne	HTR1A	29	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCn2cccn2)CC1	ZINC000875054827	FG	On-Demand	Anodyne	DRD2	31	44
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCn2cccn2)CC1	ZINC000875054827	FG	On-Demand	Anodyne	DRD4	15	41
C/C=C/C[C@H]1CCCN(C(=O)C(=O)NCc2cccnc2-n2ccnc2)C1	ZINC000875054832	FE	On-Demand	Anodyne	NOS2	75	32
C/C=C\C[C@@H]1CCCN(C(=O)C(=O)NCc2cccnc2-n2ccnc2)C1	ZINC000875054833	FE	On-Demand	Anodyne	NOS2	75	32
C/C=C/C[C@@H]1CCCN(C(=O)C(=O)NCc2cccnc2-n2ccnc2)C1	ZINC000875054834	FE	On-Demand	Anodyne	NOS2	75	32
C/C=C\C[C@H]1CCCN(C(=O)C(=O)NCc2cccnc2-n2ccnc2)C1	ZINC000875054835	FE	On-Demand	Anodyne	NOS2	75	32
CCC(=O)Nc1cccc(CNC(=O)N2CCN(C)C(C)(C)CC2)c1	ZINC000875054849	EF	On-Demand	Anodyne	HTR1D	22	41
CCC(=O)Nc1cccc(CNC(=O)N2CCN(C)C(C)(C)CC2)c1	ZINC000875054849	EF	On-Demand	Anodyne	HTR1B	24	41
CCC(=O)Nc1cccc(CNC(=O)NCc2ccc(N(C)C(C)=O)cc2)c1	ZINC000875054857	GG	On-Demand	Anodyne	ROCK2	21	42
O=C(Nc1cccc(CNC(=O)N2Cc3cccc(O)c3C2)c1)C1CCC1	ZINC000875054866	FG	On-Demand	Clean	NAMPT	25	41
CCC(=O)Nc1cccc(CNC(=O)N2CCc3ccc(NC(C)=O)cc3C2)c1	ZINC000875054874	GG	On-Demand	Anodyne	P2RY14	48	36
CCC(=O)Nc1cccc(CNC(=O)N[C@@H](CC)[C@H](O)c2ccccc2)c1	ZINC000875054878	FG	On-Demand	Anodyne	ANPEP	15	41
CCC(=O)Nc1cccc(CNC(=O)N[C@@H](CC)[C@H](O)c2ccccc2)c1	ZINC000875054878	FG	On-Demand	Anodyne	PDS	47	36
CCC(=O)Nc1cccc(CNC(=O)N[C@@H](CC)[C@@H](O)c2ccccc2)c1	ZINC000875054879	FG	On-Demand	Anodyne	ANPEP	15	41
CCC(=O)Nc1cccc(CNC(=O)N[C@@H](CC)[C@@H](O)c2ccccc2)c1	ZINC000875054879	FG	On-Demand	Anodyne	PDS	47	36
CCC(=O)Nc1cccc(CNC(=O)N[C@H](CC)[C@@H](O)c2ccccc2)c1	ZINC000875054880	FG	On-Demand	Anodyne	ANPEP	15	41
CCC(=O)Nc1cccc(CNC(=O)N[C@H](CC)[C@@H](O)c2ccccc2)c1	ZINC000875054880	FG	On-Demand	Anodyne	PDS	47	36
CCC(=O)Nc1cccc(CNC(=O)N[C@H](CC)[C@H](O)c2ccccc2)c1	ZINC000875054881	FG	On-Demand	Anodyne	ANPEP	15	41
CCC(=O)Nc1cccc(CNC(=O)N[C@H](CC)[C@H](O)c2ccccc2)c1	ZINC000875054881	FG	On-Demand	Anodyne	PDS	47	36
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875054897	EF	On-Demand	Anodyne	P2RY14	42	33
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875054898	EF	On-Demand	Anodyne	P2RY14	42	33
CCC[C@H](NC(=O)c1sccc1CC#N)c1ccccc1	ZINC000875054899	CI	On-Demand	Mild	TACR3	32	42
CCC[C@H](NC(=O)c1sccc1CC#N)c1ccccc1	ZINC000875054899	CI	On-Demand	Mild	UTS2	68	35
CCC[C@@H](NC(=O)c1sccc1CC#N)c1ccccc1	ZINC000875054900	CI	On-Demand	Mild	TACR3	32	42
CCC[C@@H](NC(=O)c1sccc1CC#N)c1ccccc1	ZINC000875054900	CI	On-Demand	Mild	UTS2	68	35
O=C(NCc1cccnc1-n1ccnc1)C(=O)NC[C@H]1CCN1C1CCCCC1	ZINC000875054905	GD	On-Demand	Anodyne	NOS2	92	35
O=C(NCc1cccnc1-n1ccnc1)C(=O)NC[C@@H]1CCN1C1CCCCC1	ZINC000875054906	GD	On-Demand	Anodyne	NOS2	92	35
CCC(=O)Nc1cccc(CNC(=O)N2CCC(C(=O)NOC)CC2)c1	ZINC000875054909	FD	On-Demand	Anodyne	EPHX2	26	41
O=C(NCCCn1cccn1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875054924	EF	On-Demand	Anodyne	FKBP1A	22	41
O=C(NCCCn1cccn1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875054925	EF	On-Demand	Anodyne	FKBP1A	22	41
O=C(NCCCn1cccn1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875054926	EF	On-Demand	Anodyne	FKBP1A	22	41
O=C(NCCCn1cccn1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875054927	EF	On-Demand	Anodyne	FKBP1A	22	41
CCC(=O)Nc1cccc(CNC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)c1	ZINC000875054929	FE	On-Demand	Anodyne	SLC6A4	26	41
CCC(=O)Nc1cccc(CNC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)c1	ZINC000875054929	FE	On-Demand	Anodyne	SLC6A3	46	46
CCC(=O)Nc1cccc(CNC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)c1	ZINC000875054930	FE	On-Demand	Anodyne	SLC6A4	26	41
CCC(=O)Nc1cccc(CNC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)c1	ZINC000875054930	FE	On-Demand	Anodyne	SLC6A3	46	46
CCC(=O)Nc1cccc(CNC(=O)N[C@H](C)c2ccccc2O)c1	ZINC000875054938	EG	On-Demand	Clean	ANPEP	20	41
CCC(=O)Nc1cccc(CNC(=O)N[C@H](C)c2ccccc2O)c1	ZINC000875054938	EG	On-Demand	Clean	ROCK2	16	40
CCC(=O)Nc1cccc(CNC(=O)N[C@@H](C)c2ccccc2O)c1	ZINC000875054939	EG	On-Demand	Clean	ANPEP	20	41
CCC(=O)Nc1cccc(CNC(=O)N[C@@H](C)c2ccccc2O)c1	ZINC000875054939	EG	On-Demand	Clean	ROCK2	16	40
CCCCCCCNC(=O)C(=O)NCc1ccc(-n2nc(C)cc2C)nc1	ZINC000875054957	FF	On-Demand	Mild	ASAH1	54	33
CCCN(Cc1ccc(C)cc1)C(=O)[C@@]1(C#N)CCCOC1	ZINC000875054962	DG	On-Demand	Mild	FFAR2	40	35
CCCN(Cc1ccc(C)cc1)C(=O)[C@]1(C#N)CCCOC1	ZINC000875054963	DG	On-Demand	Mild	FFAR2	40	35
CCC(=O)Nc1cccc(CNC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875054964	FG	On-Demand	Anodyne	CACNA1H	47	32
CCC(=O)Nc1cccc(CNC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875054964	FG	On-Demand	Anodyne	HTR1D	23	43
CCC(=O)Nc1cccc(CNC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875054964	FG	On-Demand	Anodyne	HTR1B	26	43
CCC(=O)Nc1cccc(CNC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875054964	FG	On-Demand	Anodyne	CCKBR	15	41
CCC(=O)Nc1cccc(CNC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875054964	FG	On-Demand	Anodyne	P2RY14	42	32
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1cccnc1-n1ccnc1	ZINC000875054978	GE	On-Demand	Anodyne	NOS2	68	33
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1cccnc1-n1ccnc1	ZINC000875054979	GE	On-Demand	Anodyne	NOS2	68	33
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(NC(=O)c2ccccc2)c1	ZINC000875054993	FG	On-Demand	Anodyne	ANPEP	33	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(NC(=O)c2ccccc2)c1	ZINC000875054993	FG	On-Demand	Anodyne	ROCK2	25	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(NC(=O)c2ccccc2)c1	ZINC000875054993	FG	On-Demand	Anodyne	KCNK3	116	42
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(NC(=O)c2ccccc2)c1	ZINC000875054993	FG	On-Demand	Anodyne	KCNK9	75	42
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(NC(=O)c2ccccc2)c1	ZINC000875054993	FG	On-Demand	Anodyne	PDS	54	35
CC1(C)CCC[C@H]1CCNC(=O)C(=O)NCc1cccnc1-n1ccnc1	ZINC000875054996	FE	On-Demand	Anodyne	NOS2	89	33
CC(=O)Nc1cccc([C@H](C)NC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875055009	GI	On-Demand	Anodyne	CPT1A	22	43
CC(=O)Nc1cccc([C@H](C)NC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875055010	GI	On-Demand	Anodyne	CPT1A	22	43
CC(=O)Nc1cccc([C@H](C)NC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875055011	GI	On-Demand	Anodyne	CPT1A	22	43
CC(=O)Nc1cccc([C@H](C)NC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875055012	GI	On-Demand	Anodyne	CPT1A	22	43
CCC(=O)Nc1cccc(CNC(=O)N2CCN(c3ccc(C#N)cc3)CC2)c1	ZINC000875055028	GF	On-Demand	Mild	HTR1D	18	41
CCC(=O)Nc1cccc(CNC(=O)N2CCN(c3ccc(C#N)cc3)CC2)c1	ZINC000875055028	GF	On-Demand	Mild	HTR1B	22	41
CCC(=O)Nc1cccc(CNC(=O)N2CCN(c3ccc(C#N)cc3)CC2)c1	ZINC000875055028	GF	On-Demand	Mild	P2RY12	15	44
O=C(NCc1cccnc1-n1ccnc1)C(=O)NCC1([C@@H]2CCCCO2)CCC1	ZINC000875055036	GD	On-Demand	Anodyne	NOS2	78	34
O=C(NCc1cccnc1-n1ccnc1)C(=O)NCC1([C@H]2CCCCO2)CCC1	ZINC000875055037	GD	On-Demand	Anodyne	NOS2	78	34
CCC(=O)Nc1cccc(CNC(=O)NN(C)C(=O)OC)c1	ZINC000875055055	DD	On-Demand	Reactive	MTNR1A	19	42
CCC(=O)Nc1cccc(CNC(=O)NN(C)C(=O)OC)c1	ZINC000875055055	DD	On-Demand	Reactive	MTNR1B	17	42
CCC(=O)Nc1cccc(CNC(=O)NN(C)C(=O)OC)c1	ZINC000875055055	DD	On-Demand	Reactive	ROCK2	27	41
CC[C@@H]1COCCN1CCNC(=O)NCc1cccc(NC(=O)C2CCC2)c1	ZINC000875055063	GE	On-Demand	Anodyne	EPHX2	15	42
O=C(NCc1cccnc1-n1ccnc1)C(=O)NC[C@@H]1CC[C@@H]2C[C@@H]2C1	ZINC000875055065	FD	On-Demand	Anodyne	NOS2	93	34
O=C(NCc1cccnc1-n1ccnc1)C(=O)NC[C@@H]1CC[C@@H]2C[C@H]2C1	ZINC000875055066	FD	On-Demand	Anodyne	NOS2	93	34
O=C(NCc1cccnc1-n1ccnc1)C(=O)NC[C@@H]1CC[C@H]2C[C@H]2C1	ZINC000875055067	FD	On-Demand	Anodyne	NOS2	93	34
O=C(NCc1cccnc1-n1ccnc1)C(=O)NC[C@@H]1CC[C@H]2C[C@@H]2C1	ZINC000875055068	FD	On-Demand	Anodyne	NOS2	93	34
CCC(=O)Nc1cccc(CNC(=O)N2CC[C@H](c3nc(C)cs3)C2)c1	ZINC000875055075	FG	On-Demand	Anodyne	HTR1D	25	42
CCC(=O)Nc1cccc(CNC(=O)N2CC[C@H](c3nc(C)cs3)C2)c1	ZINC000875055075	FG	On-Demand	Anodyne	HTR1B	23	42
CCC(=O)Nc1cccc(CNC(=O)N2CC[C@H](c3nc(C)cs3)C2)c1	ZINC000875055075	FG	On-Demand	Anodyne	P2RY14	43	32
CCC(=O)Nc1cccc(CNC(=O)N2CC[C@@H](c3nc(C)cs3)C2)c1	ZINC000875055076	FG	On-Demand	Anodyne	HTR1D	25	42
CCC(=O)Nc1cccc(CNC(=O)N2CC[C@@H](c3nc(C)cs3)C2)c1	ZINC000875055076	FG	On-Demand	Anodyne	HTR1B	23	42
CCC(=O)Nc1cccc(CNC(=O)N2CC[C@@H](c3nc(C)cs3)C2)c1	ZINC000875055076	FG	On-Demand	Anodyne	P2RY14	43	32
CCC(=O)Nc1cccc(CNC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875055077	DD	On-Demand	Anodyne	ROCK2	17	40
CCC(=O)Nc1cccc(CNC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875055077	DD	On-Demand	Anodyne	EPHX2	15	40
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1cccnc1-n1ccnc1	ZINC000875055080	FC	On-Demand	Mild	NOS2	47	33
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1cccnc1-n1ccnc1	ZINC000875055081	FC	On-Demand	Mild	NOS2	47	33
O=CN1CCCN(C(=O)NCc2cccc(NC(=O)c3ccccc3)c2)CC1	ZINC000875055086	GE	On-Demand	Anodyne	P2RY14	40	34
O=CN1CCCN(C(=O)NCc2cccc(NC(=O)c3ccccc3)c2)CC1	ZINC000875055086	GE	On-Demand	Anodyne	KCNK3	95	42
O=CN1CCCN(C(=O)NCc2cccc(NC(=O)c3ccccc3)c2)CC1	ZINC000875055086	GE	On-Demand	Anodyne	KCNK9	46	39
O=C(NCCCn1cccn1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875055098	ED	On-Demand	Anodyne	FAAH	19	45
CCC(=O)Nc1cccc(CNC(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000875055114	FF	On-Demand	Anodyne	HTR1D	22	40
CCC(=O)Nc1cccc(CNC(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000875055114	FF	On-Demand	Anodyne	HTR1B	24	40
CCC(=O)Nc1cccc(CNC(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000875055114	FF	On-Demand	Anodyne	P2RY14	46	35
CCC(=O)Nc1cccc(CNC(=O)N2CCN(C)c3ncccc3C2)c1	ZINC000875055114	FF	On-Demand	Anodyne	NAMPT	28	41
CN1CC[C@H]2CN(C(=O)C(=O)NCc3cccnc3-n3ccnc3)CC[C@@H]21	ZINC000875055124	FC	On-Demand	Anodyne	NOS2	84	33
CN1CC[C@H]2CN(C(=O)C(=O)NCc3cccnc3-n3ccnc3)CC[C@H]21	ZINC000875055126	FC	On-Demand	Anodyne	NOS2	84	33
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@@H](CCC(=O)OC)C2)c1	ZINC000875055127	GF	On-Demand	Anodyne	HTR1D	19	40
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@@H](CCC(=O)OC)C2)c1	ZINC000875055127	GF	On-Demand	Anodyne	HTR1B	20	40
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@@H](CCC(=O)OC)C2)c1	ZINC000875055127	GF	On-Demand	Anodyne	CCR3	34	45
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@H](CCC(=O)OC)C2)c1	ZINC000875055128	GF	On-Demand	Anodyne	HTR1D	19	40
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@H](CCC(=O)OC)C2)c1	ZINC000875055128	GF	On-Demand	Anodyne	HTR1B	20	40
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@H](CCC(=O)OC)C2)c1	ZINC000875055128	GF	On-Demand	Anodyne	CCR3	34	45
CCC(=O)Nc1cccc(CNC(=O)N2C[C@H]3CC=CC[C@H]3C2)c1	ZINC000875055129	EG	On-Demand	Anodyne	HTR1D	18	41
CCC(=O)Nc1cccc(CNC(=O)N2C[C@H]3CC=CC[C@H]3C2)c1	ZINC000875055129	EG	On-Demand	Anodyne	HTR1B	15	41
Cc1ccc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)nc1	ZINC000875055141	EI	On-Demand	Anodyne	F10	21	42
Cc1ccc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)nc1	ZINC000875055141	EI	On-Demand	Anodyne	GCK	39	41
Cc1ccc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)nc1	ZINC000875055141	EI	On-Demand	Anodyne	LUCI_LUCLA	44	42
Cc1ccc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)nc1	ZINC000875055141	EI	On-Demand	Anodyne	KCNK3	63	37
Cc1ccc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)nc1	ZINC000875055141	EI	On-Demand	Anodyne	KCNK9	42	35
O=C(NCc1cccnc1-n1ccnc1)C(=O)NCC(C1CCC1)C1CCC1	ZINC000875055155	GE	On-Demand	Anodyne	NOS2	76	33
O=C(NCc1cccnc1-n1ccnc1)C(=O)N1CCC(CCF)CC1	ZINC000875055165	FD	On-Demand	Anodyne	NOS2	81	32
O=C(NCCCCC1CC1)C(=O)NCc1cccnc1-n1ccnc1	ZINC000875055175	ED	On-Demand	Anodyne	NOS2	59	32
O=C(NCC[C@@H]1CCSC1)C(=O)NCc1cccnc1-n1ccnc1	ZINC000875055178	FD	On-Demand	Anodyne	NOS2	40	31
O=C(NCC[C@H]1CCSC1)C(=O)NCc1cccnc1-n1ccnc1	ZINC000875055179	FD	On-Demand	Anodyne	NOS2	40	31
CCC(=O)Nc1cccc(CNC(=O)N(Cc2ccccc2)[C@H](CC)CO)c1	ZINC000875055182	GH	On-Demand	Anodyne	PDS	50	32
O=C(NCc1cccnc1-n1ccnc1)C(=O)N1CCCC2(CC1)CC2	ZINC000875055188	FD	On-Demand	Anodyne	NOS2	80	32
O=C(NCCCn1cccn1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875055189	EE	On-Demand	Anodyne	TRY1_BOVIN	47	35
O=C(NCCCn1cccn1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875055190	EE	On-Demand	Anodyne	TRY1_BOVIN	47	35
O=C(NCCCn1cccn1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875055191	EE	On-Demand	Anodyne	TRY1_BOVIN	47	35
O=C(NCCCn1cccn1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875055192	EE	On-Demand	Anodyne	TRY1_BOVIN	47	35
CCC(=O)Nc1cccc(CNC(=O)N[C@H](CC)C[C@H](C)O)c1	ZINC000875055195	DE	On-Demand	Anodyne	ANPEP	20	43
CCC(=O)Nc1cccc(CNC(=O)N[C@H](CC)C[C@H](C)O)c1	ZINC000875055195	DE	On-Demand	Anodyne	ROCK2	19	40
CCC(=O)Nc1cccc(CNC(=O)N[C@H](CC)C[C@H](C)O)c1	ZINC000875055195	DE	On-Demand	Anodyne	PDS	48	33
CCC(=O)Nc1cccc(CNC(=O)N[C@@H](CC)C[C@H](C)O)c1	ZINC000875055196	DE	On-Demand	Anodyne	ANPEP	20	43
CCC(=O)Nc1cccc(CNC(=O)N[C@@H](CC)C[C@H](C)O)c1	ZINC000875055196	DE	On-Demand	Anodyne	ROCK2	19	40
CCC(=O)Nc1cccc(CNC(=O)N[C@@H](CC)C[C@H](C)O)c1	ZINC000875055196	DE	On-Demand	Anodyne	PDS	48	33
CCC(=O)Nc1cccc(CNC(=O)N[C@@H](CC)C[C@@H](C)O)c1	ZINC000875055197	DE	On-Demand	Anodyne	ANPEP	20	43
CCC(=O)Nc1cccc(CNC(=O)N[C@@H](CC)C[C@@H](C)O)c1	ZINC000875055197	DE	On-Demand	Anodyne	ROCK2	19	40
CCC(=O)Nc1cccc(CNC(=O)N[C@@H](CC)C[C@@H](C)O)c1	ZINC000875055197	DE	On-Demand	Anodyne	PDS	48	33
CCC(=O)Nc1cccc(CNC(=O)N[C@H](CC)C[C@@H](C)O)c1	ZINC000875055198	DE	On-Demand	Anodyne	ANPEP	20	43
CCC(=O)Nc1cccc(CNC(=O)N[C@H](CC)C[C@@H](C)O)c1	ZINC000875055198	DE	On-Demand	Anodyne	ROCK2	19	40
CCC(=O)Nc1cccc(CNC(=O)N[C@H](CC)C[C@@H](C)O)c1	ZINC000875055198	DE	On-Demand	Anodyne	PDS	48	33
CCC(=O)Nc1cccc(CNC(=O)N2CCO[C@H](c3ccc(OC)cc3)C2)c1	ZINC000875055235	GG	On-Demand	Anodyne	MMP13	20	41
CCC(=O)Nc1cccc(CNC(=O)N2CCO[C@H](c3ccc(OC)cc3)C2)c1	ZINC000875055235	GG	On-Demand	Anodyne	MTNR1A	24	40
CCC(=O)Nc1cccc(CNC(=O)N2CCO[C@H](c3ccc(OC)cc3)C2)c1	ZINC000875055235	GG	On-Demand	Anodyne	MTNR1B	28	40
CCC(=O)Nc1cccc(CNC(=O)N2CCO[C@@H](c3ccc(OC)cc3)C2)c1	ZINC000875055236	GG	On-Demand	Anodyne	MMP13	20	41
CCC(=O)Nc1cccc(CNC(=O)N2CCO[C@@H](c3ccc(OC)cc3)C2)c1	ZINC000875055236	GG	On-Demand	Anodyne	MTNR1A	24	40
CCC(=O)Nc1cccc(CNC(=O)N2CCO[C@@H](c3ccc(OC)cc3)C2)c1	ZINC000875055236	GG	On-Demand	Anodyne	MTNR1B	28	40
CCC(=O)Nc1cccc(CNC(=O)NC2(C)CC(F)(F)C2)c1	ZINC000875055237	EG	On-Demand	Anodyne	ROCK2	18	40
CCC(=O)Nc1cccc(CNC(=O)NC2CC(C(=O)OC)C2)c1	ZINC000875055238	ED	On-Demand	Anodyne	MTNR1A	19	40
CCC(=O)Nc1cccc(CNC(=O)NC2CC(C(=O)OC)C2)c1	ZINC000875055238	ED	On-Demand	Anodyne	MTNR1B	21	40
CCC(=O)Nc1cccc(CNC(=O)NC2CC(C(=O)OC)C2)c1	ZINC000875055238	ED	On-Demand	Anodyne	ROCK2	23	42
CCC(=O)Nc1cccc(CNC(=O)NC2CC(C(=O)OC)C2)c1	ZINC000875055238	ED	On-Demand	Anodyne	EPHX2	33	40
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@](O)(c3ccccc3)C2)c1	ZINC000875055239	GG	On-Demand	Anodyne	EPHX2	18	49
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@](O)(c3ccccc3)C2)c1	ZINC000875055239	GG	On-Demand	Anodyne	P2RY14	40	34
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)c1	ZINC000875055240	GG	On-Demand	Anodyne	EPHX2	18	49
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)c1	ZINC000875055240	GG	On-Demand	Anodyne	P2RY14	40	34
O=C(NCC[C@@H]1CCCOC1)C(=O)NCc1cccnc1-n1ccnc1	ZINC000875055241	FC	On-Demand	Anodyne	NOS2	55	34
O=C(NCC[C@H]1CCCOC1)C(=O)NCc1cccnc1-n1ccnc1	ZINC000875055242	FC	On-Demand	Anodyne	NOS2	55	34
CC(=O)Nc1cccc([C@@H](C)NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875055243	FD	On-Demand	Anodyne	EPHX2	19	40
CC(=O)Nc1cccc([C@H](C)NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875055244	FD	On-Demand	Anodyne	EPHX2	19	40
O=C(NCc1cccnc1-n1ccnc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875055252	GD	On-Demand	Anodyne	NOS2	76	34
O=C(NCc1cccnc1-n1ccnc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875055253	GD	On-Demand	Anodyne	NOS2	76	34
CCCCCCCNC(=O)C(=O)NCc1ccc(-n2ccnc2C)nc1	ZINC000875055276	FE	On-Demand	Mild	ASAH1	89	41
COC[C@@]1(C)CN(C(=O)C(=O)NCc2cccnc2-n2ccnc2)CCO1	ZINC000875055285	FC	On-Demand	Anodyne	NOS2	95	36
COC[C@]1(C)CN(C(=O)C(=O)NCc2cccnc2-n2ccnc2)CCO1	ZINC000875055286	FC	On-Demand	Anodyne	NOS2	95	36
O=C(NCc1cccnc1-n1ccnc1)C(=O)N1CCO[C@@H](CCF)C1	ZINC000875055303	FC	On-Demand	Anodyne	NOS2	99	36
O=C(NCc1cccnc1-n1ccnc1)C(=O)N1CCO[C@H](CCF)C1	ZINC000875055304	FC	On-Demand	Anodyne	NOS2	99	36
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875055314	FH	On-Demand	Anodyne	CCR3	18	40
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875055314	FH	On-Demand	Anodyne	TPSAB1	19	45
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875055314	FH	On-Demand	Anodyne	P2RY14	43	33
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875055315	FH	On-Demand	Anodyne	CCR3	18	40
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875055315	FH	On-Demand	Anodyne	TPSAB1	19	45
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875055315	FH	On-Demand	Anodyne	P2RY14	43	33
CCCCCCCNC(=O)C(=O)NCc1cccnc1-n1ccnc1	ZINC000875055358	ED	On-Demand	Mild	ASAH1	60	35
CCC(=O)Nc1cccc(CNC(=O)N2CCC(N3CCN(C)CC3)CC2)c1	ZINC000875055366	GD	On-Demand	Anodyne	HTR1D	23	41
CCC(=O)Nc1cccc(CNC(=O)N2CCC(N3CCN(C)CC3)CC2)c1	ZINC000875055366	GD	On-Demand	Anodyne	HTR1B	28	41
CCC(=O)Nc1cccc(CNC(=O)N2CCC(N3CCN(C)CC3)CC2)c1	ZINC000875055366	GD	On-Demand	Anodyne	L3MBTL3	65	38
CCC(=O)Nc1cccc(CNC(=O)N2CC[C@@H]3CS(=O)(=O)C[C@@H]3C2)c1	ZINC000875055367	GD	On-Demand	Anodyne	HTR1D	17	41
CCC(=O)Nc1cccc(CNC(=O)N2CC[C@H]3CS(=O)(=O)C[C@@H]3C2)c1	ZINC000875055368	GD	On-Demand	Anodyne	HTR1D	17	41
CCC(=O)Nc1cccc(CNC(=O)N2CC[C@@H]3CS(=O)(=O)C[C@H]3C2)c1	ZINC000875055369	GD	On-Demand	Anodyne	HTR1D	17	41
CCC(=O)Nc1cccc(CNC(=O)N2CC[C@H]3CS(=O)(=O)C[C@H]3C2)c1	ZINC000875055370	GD	On-Demand	Anodyne	HTR1D	17	41
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2cccnc2-n2ccnc2)C1	ZINC000875055373	FC	On-Demand	Anodyne	NOS2	56	33
CCC(=O)Nc1cccc(CNC(=O)N(C)C[C@H](C)NC(=O)OC(C)(C)C)c1	ZINC000875055375	GG	On-Demand	Anodyne	FPR1	40	33
CCC(=O)Nc1cccc(CNC(=O)N(C)C[C@@H](C)NC(=O)OC(C)(C)C)c1	ZINC000875055376	GG	On-Demand	Anodyne	FPR1	40	33
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875055384	GG	On-Demand	Anodyne	F2	36	43
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875055384	GG	On-Demand	Anodyne	PREP	32	41
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875055384	GG	On-Demand	Anodyne	TMPRSS11D	48	33
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875055385	GG	On-Demand	Anodyne	F2	36	43
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875055385	GG	On-Demand	Anodyne	PREP	32	41
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875055385	GG	On-Demand	Anodyne	TMPRSS11D	48	33
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875055386	GG	On-Demand	Anodyne	F2	36	43
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875055386	GG	On-Demand	Anodyne	PREP	32	41
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875055386	GG	On-Demand	Anodyne	TMPRSS11D	48	33
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875055387	GG	On-Demand	Anodyne	F2	36	43
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875055387	GG	On-Demand	Anodyne	PREP	32	41
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875055387	GG	On-Demand	Anodyne	TMPRSS11D	48	33
CCOC[C@H]1CN(C(=O)C(=O)NCc2cccnc2-n2ccnc2)CCO1	ZINC000875055389	FC	On-Demand	Anodyne	NOS2	99	36
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@H]2c2cncc(C)c2)c1	ZINC000875055397	FH	On-Demand	Anodyne	HTR1D	20	42
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@H]2c2cncc(C)c2)c1	ZINC000875055397	FH	On-Demand	Anodyne	HTR1B	16	42
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@@H]2c2cncc(C)c2)c1	ZINC000875055398	FH	On-Demand	Anodyne	HTR1D	20	42
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@@H]2c2cncc(C)c2)c1	ZINC000875055398	FH	On-Demand	Anodyne	HTR1B	16	42
CCC(=O)Nc1cccc(CNC(=O)N(CC)[C@@H](C)[C@@H](O)c2ccccc2)c1	ZINC000875055399	GH	On-Demand	Anodyne	CASR	21	40
CCC(=O)Nc1cccc(CNC(=O)N(CC)[C@@H](C)[C@@H](O)c2ccccc2)c1	ZINC000875055399	GH	On-Demand	Anodyne	NPY5R	31	45
CCC(=O)Nc1cccc(CNC(=O)N(CC)[C@H](C)[C@H](O)c2ccccc2)c1	ZINC000875055400	GH	On-Demand	Anodyne	CASR	21	40
CCC(=O)Nc1cccc(CNC(=O)N(CC)[C@H](C)[C@H](O)c2ccccc2)c1	ZINC000875055400	GH	On-Demand	Anodyne	NPY5R	31	45
CCC(=O)Nc1cccc(CNC(=O)N(CC)[C@H](C)[C@@H](O)c2ccccc2)c1	ZINC000875055401	GH	On-Demand	Anodyne	CASR	21	40
CCC(=O)Nc1cccc(CNC(=O)N(CC)[C@H](C)[C@@H](O)c2ccccc2)c1	ZINC000875055401	GH	On-Demand	Anodyne	NPY5R	31	45
CCC(=O)Nc1cccc(CNC(=O)N(CC)[C@@H](C)[C@H](O)c2ccccc2)c1	ZINC000875055402	GH	On-Demand	Anodyne	CASR	21	40
CCC(=O)Nc1cccc(CNC(=O)N(CC)[C@@H](C)[C@H](O)c2ccccc2)c1	ZINC000875055402	GH	On-Demand	Anodyne	NPY5R	31	45
CCC(=O)Nc1cccc(CNC(=O)N[C@@](C)(CO)Cc2ccc(OC)cc2)c1	ZINC000875055403	GF	On-Demand	Anodyne	ROCK1	16	40
CCC(=O)Nc1cccc(CNC(=O)N[C@@](C)(CO)Cc2ccc(OC)cc2)c1	ZINC000875055403	GF	On-Demand	Anodyne	MTNR1A	33	43
CCC(=O)Nc1cccc(CNC(=O)N[C@@](C)(CO)Cc2ccc(OC)cc2)c1	ZINC000875055403	GF	On-Demand	Anodyne	MTNR1B	31	43
CCC(=O)Nc1cccc(CNC(=O)N[C@@](C)(CO)Cc2ccc(OC)cc2)c1	ZINC000875055403	GF	On-Demand	Anodyne	ROCK2	31	42
CCC(=O)Nc1cccc(CNC(=O)N[C@](C)(CO)Cc2ccc(OC)cc2)c1	ZINC000875055404	GF	On-Demand	Anodyne	ROCK1	16	40
CCC(=O)Nc1cccc(CNC(=O)N[C@](C)(CO)Cc2ccc(OC)cc2)c1	ZINC000875055404	GF	On-Demand	Anodyne	MTNR1A	33	43
CCC(=O)Nc1cccc(CNC(=O)N[C@](C)(CO)Cc2ccc(OC)cc2)c1	ZINC000875055404	GF	On-Demand	Anodyne	MTNR1B	31	43
CCC(=O)Nc1cccc(CNC(=O)N[C@](C)(CO)Cc2ccc(OC)cc2)c1	ZINC000875055404	GF	On-Demand	Anodyne	ROCK2	31	42
CCC(=O)Nc1cccc(CNC(=O)NC(C)(C)C(O)(CC)CC)c1	ZINC000875055405	EG	On-Demand	Anodyne	ROCK2	17	41
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCc2cccnc2-n2ccnc2)c1	ZINC000875055412	GD	On-Demand	Anodyne	SSTR5	24	40
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCc2cccnc2-n2ccnc2)c1	ZINC000875055412	GD	On-Demand	Anodyne	NOS2	76	35
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCc2cccnc2-n2ccnc2)c1	ZINC000875055413	GD	On-Demand	Anodyne	SSTR5	24	40
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCc2cccnc2-n2ccnc2)c1	ZINC000875055413	GD	On-Demand	Anodyne	NOS2	76	35
CC(=O)Nc1cccc([C@H](C)NC(=O)N(C)CCN2CC3(CCOCC3)C2)c1	ZINC000875055416	GE	On-Demand	Anodyne	CASR	48	41
CC(=O)Nc1cccc([C@@H](C)NC(=O)N(C)CCN2CC3(CCOCC3)C2)c1	ZINC000875055417	GE	On-Demand	Anodyne	CASR	48	41
CCC1(N(C)C)CCN(C(=O)C(=O)NCc2cccnc2-n2ccnc2)CC1	ZINC000875055436	GD	On-Demand	Anodyne	NOS2	81	33
CCC(=O)Nc1cccc(CNC(=O)N2CCCCCCNC(=O)CC2)c1	ZINC000875055441	FF	On-Demand	Anodyne	P2RY14	48	36
CCC(=O)Nc1cccc(CNC(=O)NCc2cc(C)ccc2O)c1	ZINC000875055450	EG	On-Demand	Clean	ROCK2	15	41
CCC(=O)Nc1cccc(CNC(=O)NCc2cc(C)ccc2O)c1	ZINC000875055450	EG	On-Demand	Clean	KCNK3	42	34
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@H](C(C)=O)C2)c1	ZINC000875055461	EF	On-Demand	Anodyne	P2RY14	43	32
CCC(=O)Nc1cccc(CNC(=O)N2CCC[C@@H](C(C)=O)C2)c1	ZINC000875055462	EF	On-Demand	Anodyne	P2RY14	43	32
O=C(NCc1cccnc1-n1ccnc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875055468	EC	On-Demand	Anodyne	NOS2	84	33
O=C(NCc1cccnc1-n1ccnc1)C(=O)N[C@H]1CC12CCC2	ZINC000875055469	EC	On-Demand	Anodyne	NOS2	84	33
O=C(NCc1cccnc1-n1ccnc1)C(=O)NC[C@@H]1CCCN1CC(F)F	ZINC000875055470	GC	On-Demand	Anodyne	NOS2	90	36
O=C(NCc1cccnc1-n1ccnc1)C(=O)NC[C@H]1CCCN1CC(F)F	ZINC000875055471	GC	On-Demand	Anodyne	NOS2	90	36
CCC(=O)Nc1cccc(CNC(=O)N2CCCN(C(=O)CC(C)C)CC2)c1	ZINC000875055482	GF	On-Demand	Anodyne	P2RY14	42	32
CCC(=O)Nc1cccc(CNC(=O)N2CCC3(CCNC3=O)CC2)c1	ZINC000875055512	FD	On-Demand	Anodyne	CACNA1H	54	37
CCC(=O)Nc1cccc(CNC(=O)N2CCC3(CCNC3=O)CC2)c1	ZINC000875055512	FD	On-Demand	Anodyne	HTR1D	19	41
CCC(=O)Nc1cccc(CNC(=O)N2CCC3(CCNC3=O)CC2)c1	ZINC000875055512	FD	On-Demand	Anodyne	HTR1B	16	41
CCC(=O)Nc1cccc(CNC(=O)N2CCC3(CCNC3=O)CC2)c1	ZINC000875055512	FD	On-Demand	Anodyne	P2RY14	43	32
CCCN(Cc1ccc(C)cc1)C(=O)[C@]1(C)CCC(=O)N1	ZINC000875055514	CE	On-Demand	Anodyne	FFAR2	41	35
O=C(NCc1cccnc1-n1ccnc1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875055515	FD	On-Demand	Anodyne	NOS2	84	33
O=C(NCc1cccnc1-n1ccnc1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875055518	FD	On-Demand	Anodyne	NOS2	81	32
O=C(NCc1cccnc1-n1ccnc1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875055519	FD	On-Demand	Anodyne	NOS2	81	32
O=C(NCc1cccnc1-n1ccnc1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875055520	FD	On-Demand	Anodyne	NOS2	81	32
O=C(NCc1cccnc1-n1ccnc1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875055521	FD	On-Demand	Anodyne	NOS2	81	32
CCC(=O)Nc1cccc(CNC(=O)N2CC[C@](C)(C(F)(F)F)C2)c1	ZINC000875055524	FH	On-Demand	Anodyne	HTR1D	17	40
CCC(=O)Nc1cccc(CNC(=O)N2CC[C@](C)(C(F)(F)F)C2)c1	ZINC000875055524	FH	On-Demand	Anodyne	HTR1B	15	40
CCC(=O)Nc1cccc(CNC(=O)N2CC[C@@](C)(C(F)(F)F)C2)c1	ZINC000875055525	FH	On-Demand	Anodyne	HTR1D	17	40
CCC(=O)Nc1cccc(CNC(=O)N2CC[C@@](C)(C(F)(F)F)C2)c1	ZINC000875055525	FH	On-Demand	Anodyne	HTR1B	15	40
CCC(=O)Nc1cccc(CNC(=O)N2Cc3cccc(O)c3C2)c1	ZINC000875055549	EF	On-Demand	Clean	P2RY14	46	35
CCC(=O)Nc1cccc(CNC(=O)N2Cc3cccc(O)c3C2)c1	ZINC000875055549	EF	On-Demand	Clean	NAMPT	24	40
O=C(CN1CCCCC(=O)C1=O)Nc1ccc(-c2nc3ccccc3s2)cn1	ZINC000875055557	GF	On-Demand	Anodyne	SLC27A1	30	40
CCCN(Cc1ccc(C)cc1)C(=O)[C@]1(CC)CCNC1=O	ZINC000875055561	DF	On-Demand	Anodyne	FFAR2	40	35
CCCN(Cc1ccc(C)cc1)C(=O)[C@@]1(CC)CCNC1=O	ZINC000875055562	DF	On-Demand	Anodyne	FFAR2	40	35
Cc1ccccc1CN1CCC(NC(=O)NC2(C)CC(F)(F)C2)CC1	ZINC000875055566	FG	On-Demand	Anodyne	CHRM1	16	40
Cc1ccccc1CN1CCC(NC(=O)NC2(C)CC(F)(F)C2)CC1	ZINC000875055566	FG	On-Demand	Anodyne	DRD4	21	55
Cc1ccccc1CN1CCC(NC(=O)NC2(C)CC(F)(F)C2)CC1	ZINC000875055566	FG	On-Demand	Anodyne	SIGMAR1	20	47
Cc1ccccc1CN1CCC(NC(=O)NC2(C)CC(F)(F)C2)CC1	ZINC000875055566	FG	On-Demand	Anodyne	EPHX2	37	46
Cc1ccccc1CN1CCC(NC(=O)NC2(C)CC(F)(F)C2)CC1	ZINC000875055566	FG	On-Demand	Anodyne	MCHR1	30	42
CC(=O)Nc1ccc2c(c1)CN(C(=O)NC1CCN(CCN(C)C)CC1)CC2	ZINC000875055568	GD	On-Demand	Anodyne	MCHR1	28	40
O=C(NC1CCN(Cc2ccccn2)CC1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875055624	GD	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NC1CCN(Cc2ccccn2)CC1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875055624	GD	On-Demand	Anodyne	MCHR1	24	40
CC[C@@H](NC(=O)NC1CCN(Cc2ccccn2)CC1)[C@H](O)c1ccccc1	ZINC000875055630	GF	On-Demand	Anodyne	DRD4	15	52
CC[C@@H](NC(=O)NC1CCN(Cc2ccccn2)CC1)[C@H](O)c1ccccc1	ZINC000875055630	GF	On-Demand	Anodyne	SIGMAR1	18	40
CC[C@@H](NC(=O)NC1CCN(Cc2ccccn2)CC1)[C@H](O)c1ccccc1	ZINC000875055630	GF	On-Demand	Anodyne	SSTR5	44	36
CC[C@@H](NC(=O)NC1CCN(Cc2ccccn2)CC1)[C@H](O)c1ccccc1	ZINC000875055630	GF	On-Demand	Anodyne	EPHX2	18	40
CC[C@@H](NC(=O)NC1CCN(Cc2ccccn2)CC1)[C@H](O)c1ccccc1	ZINC000875055630	GF	On-Demand	Anodyne	MCHR1	16	44
CC[C@@H](NC(=O)NC1CCN(Cc2ccccn2)CC1)[C@@H](O)c1ccccc1	ZINC000875055631	GF	On-Demand	Anodyne	DRD4	15	52
CC[C@@H](NC(=O)NC1CCN(Cc2ccccn2)CC1)[C@@H](O)c1ccccc1	ZINC000875055631	GF	On-Demand	Anodyne	SIGMAR1	18	40
CC[C@@H](NC(=O)NC1CCN(Cc2ccccn2)CC1)[C@@H](O)c1ccccc1	ZINC000875055631	GF	On-Demand	Anodyne	SSTR5	44	36
CC[C@@H](NC(=O)NC1CCN(Cc2ccccn2)CC1)[C@@H](O)c1ccccc1	ZINC000875055631	GF	On-Demand	Anodyne	EPHX2	18	40
CC[C@@H](NC(=O)NC1CCN(Cc2ccccn2)CC1)[C@@H](O)c1ccccc1	ZINC000875055631	GF	On-Demand	Anodyne	MCHR1	16	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875055646	GF	On-Demand	Anodyne	DRD4	24	51
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875055646	GF	On-Demand	Anodyne	SLC6A4	15	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875055646	GF	On-Demand	Anodyne	SLC6A3	35	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875055646	GF	On-Demand	Anodyne	SIGMAR1	22	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875055646	GF	On-Demand	Anodyne	SSTR5	43	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875055646	GF	On-Demand	Anodyne	MCHR1	19	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875055646	GF	On-Demand	Anodyne	CCR8	47	38
O=C(NC1CCN(Cc2ccccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875055666	EE	On-Demand	Anodyne	DRD4	17	54
O=C(NC1CCN(Cc2ccccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875055666	EE	On-Demand	Anodyne	SIGMAR1	17	42
O=C(NC1CCN(Cc2ccccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875055667	EE	On-Demand	Anodyne	DRD4	17	54
O=C(NC1CCN(Cc2ccccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875055667	EE	On-Demand	Anodyne	SIGMAR1	17	42
O=C(NC1CCN(Cc2ccccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875055668	EE	On-Demand	Anodyne	DRD4	17	54
O=C(NC1CCN(Cc2ccccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875055668	EE	On-Demand	Anodyne	SIGMAR1	17	42
O=C(NC1CCN(Cc2ccccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875055669	EE	On-Demand	Anodyne	DRD4	17	54
O=C(NC1CCN(Cc2ccccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875055669	EE	On-Demand	Anodyne	SIGMAR1	17	42
CC[C@@H](NC(=O)C1(C)CC(F)(F)C1)c1ccc(OC)cc1	ZINC000875055678	CH	On-Demand	Anodyne	PSMB8	40	31
O=C(NNc1cccc(F)c1Cl)NC1CCN(Cc2ccccn2)CC1	ZINC000875055682	GG	On-Demand	Reactive	DRD4	19	51
O=C(NNc1cccc(F)c1Cl)NC1CCN(Cc2ccccn2)CC1	ZINC000875055682	GG	On-Demand	Reactive	SIGMAR1	19	46
O=C(NNc1cccc(F)c1Cl)NC1CCN(Cc2ccccn2)CC1	ZINC000875055682	GG	On-Demand	Reactive	SCN5A	42	41
O=C(NNc1cccc(F)c1Cl)NC1CCN(Cc2ccccn2)CC1	ZINC000875055682	GG	On-Demand	Reactive	MCHR1	25	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(Cc3ccccc3C)CC2)C1	ZINC000875055690	GF	On-Demand	Anodyne	CHRM1	21	40
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(Cc3ccccc3C)CC2)C1	ZINC000875055690	GF	On-Demand	Anodyne	DRD4	22	52
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(Cc3ccccc3C)CC2)C1	ZINC000875055690	GF	On-Demand	Anodyne	CHRM3	16	48
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(Cc3ccccc3C)CC2)C1	ZINC000875055690	GF	On-Demand	Anodyne	SIGMAR1	21	44
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(Cc3ccccc3C)CC2)C1	ZINC000875055690	GF	On-Demand	Anodyne	SSTR5	48	37
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(Cc3ccccc3C)CC2)C1	ZINC000875055690	GF	On-Demand	Anodyne	CCR8	48	37
Cc1ccccc1CN1CCC(NC(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875055691	FF	On-Demand	Anodyne	CHRM1	19	43
Cc1ccccc1CN1CCC(NC(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875055691	FF	On-Demand	Anodyne	DRD4	25	56
Cc1ccccc1CN1CCC(NC(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875055691	FF	On-Demand	Anodyne	CHRM3	20	43
Cc1ccccc1CN1CCC(NC(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875055691	FF	On-Demand	Anodyne	SIGMAR1	20	45
Cc1ccccc1CN1CCC(NC(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875055691	FF	On-Demand	Anodyne	SSTR5	27	40
Cc1ccccc1CN1CCC(NC(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875055691	FF	On-Demand	Anodyne	MCHR1	30	41
Cc1ccccc1CN1CCC(NC(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875055691	FF	On-Demand	Anodyne	CCR8	74	36
Cc1ccccc1CN1CCC(NC(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875055692	FF	On-Demand	Anodyne	CHRM1	19	43
Cc1ccccc1CN1CCC(NC(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875055692	FF	On-Demand	Anodyne	DRD4	25	56
Cc1ccccc1CN1CCC(NC(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875055692	FF	On-Demand	Anodyne	CHRM3	20	43
Cc1ccccc1CN1CCC(NC(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875055692	FF	On-Demand	Anodyne	SIGMAR1	20	45
Cc1ccccc1CN1CCC(NC(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875055692	FF	On-Demand	Anodyne	SSTR5	27	40
Cc1ccccc1CN1CCC(NC(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875055692	FF	On-Demand	Anodyne	MCHR1	30	41
Cc1ccccc1CN1CCC(NC(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875055692	FF	On-Demand	Anodyne	CCR8	74	36
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(CCN(C)C)CC1	ZINC000875055698	DC	On-Demand	Anodyne	EPHX2	15	43
O=C(NC1CCN(Cc2ccccn2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875055707	GF	On-Demand	Anodyne	DRD4	28	57
O=C(NC1CCN(Cc2ccccn2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875055707	GF	On-Demand	Anodyne	LTA4H	26	41
O=C(NC1CCN(Cc2ccccn2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875055707	GF	On-Demand	Anodyne	SIGMAR1	26	47
O=C(NC1CCN(Cc2ccccn2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875055707	GF	On-Demand	Anodyne	SSTR5	44	36
O=C(NC1CCN(Cc2ccccn2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875055707	GF	On-Demand	Anodyne	EPHX2	33	49
O=CN1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)CC1	ZINC000875055721	FD	On-Demand	Anodyne	CHRM1	19	40
O=CN1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)CC1	ZINC000875055721	FD	On-Demand	Anodyne	DRD2	20	45
O=CN1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)CC1	ZINC000875055721	FD	On-Demand	Anodyne	DRD4	26	54
O=CN1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)CC1	ZINC000875055721	FD	On-Demand	Anodyne	HTR2A	20	54
O=CN1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)CC1	ZINC000875055721	FD	On-Demand	Anodyne	OPRM1	15	46
O=CN1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)CC1	ZINC000875055721	FD	On-Demand	Anodyne	CHRM3	20	40
O=CN1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)CC1	ZINC000875055721	FD	On-Demand	Anodyne	LTA4H	17	42
O=CN1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)CC1	ZINC000875055721	FD	On-Demand	Anodyne	SIGMAR1	58	63
O=CN1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)CC1	ZINC000875055721	FD	On-Demand	Anodyne	CCR3	29	53
O=CN1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)CC1	ZINC000875055721	FD	On-Demand	Anodyne	EPHX2	23	43
O=CN1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)CC1	ZINC000875055721	FD	On-Demand	Anodyne	MCHR1	19	42
O=CN1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)CC1	ZINC000875055721	FD	On-Demand	Anodyne	CACNA1G	23	40
O=CN1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)CC1	ZINC000875055721	FD	On-Demand	Anodyne	BIRC2	39	44
O=C(NCC[C@H](O)C1CCCC1)NC1CCN(Cc2ccccn2)CC1	ZINC000875055736	FE	On-Demand	Anodyne	DRD4	18	56
O=C(NCC[C@H](O)C1CCCC1)NC1CCN(Cc2ccccn2)CC1	ZINC000875055736	FE	On-Demand	Anodyne	SIGMAR1	16	43
O=C(NCC[C@H](O)C1CCCC1)NC1CCN(Cc2ccccn2)CC1	ZINC000875055736	FE	On-Demand	Anodyne	SSTR5	43	35
O=C(NCC[C@H](O)C1CCCC1)NC1CCN(Cc2ccccn2)CC1	ZINC000875055736	FE	On-Demand	Anodyne	EPHX2	22	44
O=C(NCC[C@@H]1CCCS1)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875055737	GG	On-Demand	Anodyne	EPHX2	34	40
O=C(NCC[C@@H]1CCCS1)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875055737	GG	On-Demand	Anodyne	CCR8	51	33
O=C(NCC[C@@H]1CCCS1)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875055737	GG	On-Demand	Anodyne	SCD1	21	41
O=C(NCC[C@@H]1CCCS1)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875055737	GG	On-Demand	Anodyne	SCD	19	41
O=C(NCC[C@@H](O)C1CCCC1)NC1CCN(Cc2ccccn2)CC1	ZINC000875055738	FE	On-Demand	Anodyne	DRD4	18	56
O=C(NCC[C@@H](O)C1CCCC1)NC1CCN(Cc2ccccn2)CC1	ZINC000875055738	FE	On-Demand	Anodyne	SIGMAR1	16	43
O=C(NCC[C@@H](O)C1CCCC1)NC1CCN(Cc2ccccn2)CC1	ZINC000875055738	FE	On-Demand	Anodyne	SSTR5	43	35
O=C(NCC[C@@H](O)C1CCCC1)NC1CCN(Cc2ccccn2)CC1	ZINC000875055738	FE	On-Demand	Anodyne	EPHX2	22	44
O=C(NC1CCN(Cc2ccccn2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875055739	GE	On-Demand	Anodyne	DRD4	17	53
O=C(NC1CCN(Cc2ccccn2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875055739	GE	On-Demand	Anodyne	SSTR5	41	34
O=C(NC1CCN(Cc2ccccn2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875055739	GE	On-Demand	Anodyne	EPHX2	22	43
O=C(NC1CCN(Cc2ccccn2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875055739	GE	On-Demand	Anodyne	MCHR1	32	42
O=C(NCC[C@H]1CCCS1)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875055740	GG	On-Demand	Anodyne	EPHX2	34	40
O=C(NCC[C@H]1CCCS1)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875055740	GG	On-Demand	Anodyne	CCR8	51	33
O=C(NCC[C@H]1CCCS1)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875055740	GG	On-Demand	Anodyne	SCD1	21	41
O=C(NCC[C@H]1CCCS1)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875055740	GG	On-Demand	Anodyne	SCD	19	41
C[C@H](NC(=O)NC1CCN(C(=O)c2ccccc2F)CC1)c1ccccc1O	ZINC000875055741	GG	On-Demand	Clean	EPHX2	36	43
O=C(NC1CCN(Cc2ccccn2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875055742	GE	On-Demand	Anodyne	DRD4	17	53
O=C(NC1CCN(Cc2ccccn2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875055742	GE	On-Demand	Anodyne	SSTR5	41	34
O=C(NC1CCN(Cc2ccccn2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875055742	GE	On-Demand	Anodyne	EPHX2	22	43
O=C(NC1CCN(Cc2ccccn2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875055742	GE	On-Demand	Anodyne	MCHR1	32	42
C[C@@H](NC(=O)NC1CCN(C(=O)c2ccccc2F)CC1)c1ccccc1O	ZINC000875055744	GG	On-Demand	Clean	EPHX2	36	43
C#C[C@@H]1CC[C@@H](NC(=O)NC2CCN(C(=O)c3ccccc3F)CC2)CC1	ZINC000875055762	FF	On-Demand	Mild	EPHX2	36	45
C#C[C@@H]1CC[C@@H](NC(=O)NC2CCN(C(=O)c3ccccc3F)CC2)CC1	ZINC000875055762	FF	On-Demand	Mild	L3MBTL3	39	41
C[C@@H](NC(=O)NC1CCN(C(=O)c2ccccc2F)CC1)c1ccnn1C	ZINC000875055764	FE	On-Demand	Anodyne	EPHX2	31	41
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875055765	DC	On-Demand	Reactive	DRD4	28	58
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875055765	DC	On-Demand	Reactive	SIGMAR1	25	45
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875055765	DC	On-Demand	Reactive	SSTR5	60	39
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875055765	DC	On-Demand	Reactive	EPHX2	24	44
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875055765	DC	On-Demand	Reactive	MCHR1	37	43
C[C@H](NC(=O)NC1CCN(C(=O)c2ccccc2F)CC1)c1ccnn1C	ZINC000875055766	FE	On-Demand	Anodyne	EPHX2	31	41
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(CCN(C)C)CC3)C[C@@H]1C2	ZINC000875055779	FC	On-Demand	Anodyne	SLC6A5	17	43
O=C(NC1CCN(Cc2ccccn2)CC1)N1Cc2cccc(O)c2C1	ZINC000875055802	FE	On-Demand	Clean	DRD4	18	58
O=C(NC1CCN(Cc2ccccn2)CC1)N1Cc2cccc(O)c2C1	ZINC000875055802	FE	On-Demand	Clean	SIGMAR1	16	40
O=C(NC1CCN(Cc2ccccn2)CC1)N1Cc2cccc(O)c2C1	ZINC000875055802	FE	On-Demand	Clean	SSTR5	40	34
O=C(NC1CCN(Cc2ccccn2)CC1)N1Cc2cccc(O)c2C1	ZINC000875055802	FE	On-Demand	Clean	MCHR1	17	40
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(C(=O)C(C)C)CC3)C[C@@H]1C2	ZINC000875055805	FD	On-Demand	Anodyne	EPHX2	26	44
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)NC1CCN(CCc2ccccc2)CC1	ZINC000875055807	GF	On-Demand	Anodyne	DRD4	18	45
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)NC1CCN(CCc2ccccc2)CC1	ZINC000875055807	GF	On-Demand	Anodyne	SIGMAR1	31	45
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)NC1CCN(CCc2ccccc2)CC1	ZINC000875055807	GF	On-Demand	Anodyne	MCHR1	19	41
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)NC1CCN(CCc2ccccc2)CC1	ZINC000875055807	GF	On-Demand	Anodyne	CACNA1G	25	41
O=C(NC[C@H]1CC(C(F)(F)F)=NO1)NC1CCN(CCc2ccccc2)CC1	ZINC000875055808	GF	On-Demand	Anodyne	DRD4	18	45
O=C(NC[C@H]1CC(C(F)(F)F)=NO1)NC1CCN(CCc2ccccc2)CC1	ZINC000875055808	GF	On-Demand	Anodyne	SIGMAR1	31	45
O=C(NC[C@H]1CC(C(F)(F)F)=NO1)NC1CCN(CCc2ccccc2)CC1	ZINC000875055808	GF	On-Demand	Anodyne	MCHR1	19	41
O=C(NC[C@H]1CC(C(F)(F)F)=NO1)NC1CCN(CCc2ccccc2)CC1	ZINC000875055808	GF	On-Demand	Anodyne	CACNA1G	25	41
O=C(NCc1ncc(Cl)s1)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875055814	GG	On-Demand	Anodyne	EPHX2	37	41
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875055823	GD	On-Demand	Anodyne	CHRM1	21	41
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875055823	GD	On-Demand	Anodyne	DRD2	21	45
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875055823	GD	On-Demand	Anodyne	DRD4	29	56
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875055823	GD	On-Demand	Anodyne	ACHE	15	47
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875055823	GD	On-Demand	Anodyne	HTR2A	21	56
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875055823	GD	On-Demand	Anodyne	OPRM1	23	45
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875055823	GD	On-Demand	Anodyne	OPRD1	19	45
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875055823	GD	On-Demand	Anodyne	GHRHR	40	32
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875055823	GD	On-Demand	Anodyne	LTA4H	16	43
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875055823	GD	On-Demand	Anodyne	SIGMAR1	69	65
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875055823	GD	On-Demand	Anodyne	CCR3	31	48
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875055823	GD	On-Demand	Anodyne	NPFFR2	15	40
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875055823	GD	On-Demand	Anodyne	EPHX2	33	42
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875055823	GD	On-Demand	Anodyne	MCHR1	22	51
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875055823	GD	On-Demand	Anodyne	CACNA1G	22	41
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875055823	GD	On-Demand	Anodyne	CYP2J2	44	32
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875055823	GD	On-Demand	Anodyne	BIRC2	31	43
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875055824	GH	On-Demand	Anodyne	CHRM1	22	41
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875055824	GH	On-Demand	Anodyne	DRD2	19	42
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875055824	GH	On-Demand	Anodyne	DRD4	26	52
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875055824	GH	On-Demand	Anodyne	HTR2A	17	52
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875055824	GH	On-Demand	Anodyne	CHRM3	24	41
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875055824	GH	On-Demand	Anodyne	GRIN2B	47	35
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875055824	GH	On-Demand	Anodyne	LTA4H	26	45
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875055824	GH	On-Demand	Anodyne	SIGMAR1	55	60
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875055824	GH	On-Demand	Anodyne	CCR3	33	47
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875055824	GH	On-Demand	Anodyne	PREP	49	39
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875055824	GH	On-Demand	Anodyne	EPHX2	38	45
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875055824	GH	On-Demand	Anodyne	MCHR1	19	41
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875055824	GH	On-Demand	Anodyne	BIRC2	51	45
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875055825	GH	On-Demand	Anodyne	CHRM1	22	41
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875055825	GH	On-Demand	Anodyne	DRD2	19	42
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875055825	GH	On-Demand	Anodyne	DRD4	26	52
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875055825	GH	On-Demand	Anodyne	HTR2A	17	52
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875055825	GH	On-Demand	Anodyne	CHRM3	24	41
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875055825	GH	On-Demand	Anodyne	GRIN2B	47	35
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875055825	GH	On-Demand	Anodyne	LTA4H	26	45
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875055825	GH	On-Demand	Anodyne	SIGMAR1	55	60
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875055825	GH	On-Demand	Anodyne	CCR3	33	47
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875055825	GH	On-Demand	Anodyne	PREP	49	39
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875055825	GH	On-Demand	Anodyne	EPHX2	38	45
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875055825	GH	On-Demand	Anodyne	MCHR1	19	41
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875055825	GH	On-Demand	Anodyne	BIRC2	51	45
CC(=O)C1CCN(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)CC1	ZINC000875055847	GE	On-Demand	Anodyne	CCR3	18	44
CC(=O)C1CCN(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)CC1	ZINC000875055847	GE	On-Demand	Anodyne	EPHX2	47	64
CC(=O)C1CCN(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)CC1	ZINC000875055847	GE	On-Demand	Anodyne	L3MBTL3	50	42
O=C(NC1CCN(C(=O)c2ccccc2F)CC1)N1CCC(CO)(CO)CC1	ZINC000875055848	GD	On-Demand	Anodyne	CCR3	15	42
O=C(NC1CCN(C(=O)c2ccccc2F)CC1)N1CCC(CO)(CO)CC1	ZINC000875055848	GD	On-Demand	Anodyne	EPHX2	48	42
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875055867	EF	On-Demand	Anodyne	DRD4	15	53
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875055867	EF	On-Demand	Anodyne	SIGMAR1	19	45
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccccc3C)CC2)C1	ZINC000875055870	FC	On-Demand	Anodyne	DRD4	24	54
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccccc3C)CC2)C1	ZINC000875055870	FC	On-Demand	Anodyne	SIGMAR1	26	45
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccccc3C)CC2)C1	ZINC000875055870	FC	On-Demand	Anodyne	SSTR5	42	41
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccccc3C)CC2)C1	ZINC000875055870	FC	On-Demand	Anodyne	MCHR1	24	40
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccccc3C)CC2)C1	ZINC000875055870	FC	On-Demand	Anodyne	CCR8	46	39
Cc1ccccc1CN1CCC(NC(=O)N(C)OCC(F)(F)F)CC1	ZINC000875055903	FG	On-Demand	Anodyne	DRD4	19	53
Cc1ccccc1CN1CCC(NC(=O)N(C)OCC(F)(F)F)CC1	ZINC000875055903	FG	On-Demand	Anodyne	SIGMAR1	20	47
Cc1ccccc1CN1CCC(NC(=O)N(C)OCC(F)(F)F)CC1	ZINC000875055903	FG	On-Demand	Anodyne	SSTR5	40	38
Cc1ccccc1CN1CCC(NC(=O)N(C)OCC(F)(F)F)CC1	ZINC000875055903	FG	On-Demand	Anodyne	CCR2	17	47
O=C(NC[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875055906	GG	On-Demand	Anodyne	EPHX2	31	40
O=C(NC[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875055907	GG	On-Demand	Anodyne	EPHX2	31	40
Cc1ccccc1CN1CCC(NC(=O)N2CCCN(C=O)CC2)CC1	ZINC000875055908	FD	On-Demand	Anodyne	DRD4	21	55
Cc1ccccc1CN1CCC(NC(=O)N2CCCN(C=O)CC2)CC1	ZINC000875055908	FD	On-Demand	Anodyne	SIGMAR1	21	44
Cc1ccccc1CN1CCC(NC(=O)N2CCCN(C=O)CC2)CC1	ZINC000875055908	FD	On-Demand	Anodyne	CCR3	28	48
Cc1ccccc1CN1CCC(NC(=O)N2CCCN(C=O)CC2)CC1	ZINC000875055908	FD	On-Demand	Anodyne	CCR8	51	35
O=C(NC[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875055909	GG	On-Demand	Anodyne	EPHX2	31	40
O=C(NC[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875055910	GG	On-Demand	Anodyne	EPHX2	31	40
O=C(NC1CCN(C(=O)c2ccccc2F)CC1)N[C@H]1CCCC[C@H]1F	ZINC000875055911	FG	On-Demand	Anodyne	EPHX2	39	49
O=C(NC1CCN(C(=O)c2ccccc2F)CC1)N[C@H]1CCCC[C@H]1F	ZINC000875055911	FG	On-Demand	Anodyne	L3MBTL3	36	40
COCC(C)(C)CCNC(=O)NC1CCN(CCN(C)C)CC1	ZINC000875055922	ED	On-Demand	Anodyne	SLC6A5	17	44
CC[C@@H](NC(=O)C1(F)CCOCC1)c1ccc(OC)cc1	ZINC000875055928	CF	On-Demand	Anodyne	MMP13	17	40
C#CC[C@@H](CCOC)NC(=O)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875055929	GE	On-Demand	Mild	EPHX2	27	42
C#CC[C@H](CCOC)NC(=O)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875055931	GE	On-Demand	Mild	EPHX2	27	42
C[C@@H]1[C@H](C(=O)NNC(=O)NC2CCN(CCN(C)C)CC2)CCCN1C	ZINC000875055941	FC	On-Demand	Reactive	SLC6A5	16	42
C#C[C@@H]1CC[C@@H](NC(=O)NC2CCN(CCN(C)C)CC2)CC1	ZINC000875055953	DD	On-Demand	Mild	EPHX2	17	42
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccccn2)CC1	ZINC000875055957	DD	On-Demand	Anodyne	DRD4	15	56
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccccn2)CC1	ZINC000875055957	DD	On-Demand	Anodyne	SIGMAR1	21	41
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccccn2)CC1	ZINC000875055957	DD	On-Demand	Anodyne	SSTR5	42	33
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccccn2)CC1	ZINC000875055957	DD	On-Demand	Anodyne	EPHX2	22	44
CCN(CCNC(=O)OC(C)(C)C)C(=O)NC1CCN(CCN(C)C)CC1	ZINC000875055967	GD	On-Demand	Anodyne	SLC6A5	17	43
CN1CCN(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)CCC1(C)C	ZINC000875055987	GF	On-Demand	Anodyne	EPHX2	29	52
O=C(NC1CCN(C(=O)c2ccccc2F)CC1)N[C@H]1CC12CCC2	ZINC000875055993	EF	On-Demand	Anodyne	EPHX2	37	45
COC(=O)[C@@]12C[C@@H](NC(=O)NCCc3cccc(OC)c3)C[C@@H]1C2	ZINC000875055994	ED	On-Demand	Anodyne	DRD4	41	31
COC(=O)[C@@]12C[C@@H](NC(=O)NCCc3cccc(OC)c3)C[C@@H]1C2	ZINC000875055994	ED	On-Demand	Anodyne	HRH2	22	40
COC(=O)[C@@]12C[C@@H](NC(=O)NCCc3cccc(OC)c3)C[C@@H]1C2	ZINC000875055994	ED	On-Demand	Anodyne	MTNR1A	64	45
COC(=O)[C@@]12C[C@@H](NC(=O)NCCc3cccc(OC)c3)C[C@@H]1C2	ZINC000875055994	ED	On-Demand	Anodyne	MTNR1B	59	45
O=C(NC1CCN(C(=O)c2ccccc2F)CC1)N[C@@H]1CC12CCC2	ZINC000875055995	EF	On-Demand	Anodyne	EPHX2	37	45
CC[C@H](C[C@H](C)O)NC(=O)NCCc1cccc(OC)c1	ZINC000875055996	CE	On-Demand	Anodyne	HRH2	18	42
CC[C@H](C[C@H](C)O)NC(=O)NCCc1cccc(OC)c1	ZINC000875055996	CE	On-Demand	Anodyne	NQO2	26	41
CC[C@H](C[C@H](C)O)NC(=O)NCCc1cccc(OC)c1	ZINC000875055996	CE	On-Demand	Anodyne	MTNR1A	86	53
CC[C@H](C[C@H](C)O)NC(=O)NCCc1cccc(OC)c1	ZINC000875055996	CE	On-Demand	Anodyne	MTNR1B	76	53
CC[C@H](C[C@H](C)O)NC(=O)NCCc1cccc(OC)c1	ZINC000875055996	CE	On-Demand	Anodyne	CAPN2	27	49
CC[C@H](C[C@H](C)O)NC(=O)NCCc1cccc(OC)c1	ZINC000875055996	CE	On-Demand	Anodyne	PLM1_PLAFA	18	43
CC[C@H](C[C@H](C)O)NC(=O)NCCc1cccc(OC)c1	ZINC000875055996	CE	On-Demand	Anodyne	PLM2_PLAFA	19	43
CC[C@H](C[C@H](C)O)NC(=O)NCCc1cccc(OC)c1	ZINC000875055996	CE	On-Demand	Anodyne	PDS	62	42
O=C(NC1CCN(Cc2ccccn2)CC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875056013	GF	On-Demand	Anodyne	DRD4	15	52
O=C(NC1CCN(Cc2ccccn2)CC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875056013	GF	On-Demand	Anodyne	SIGMAR1	17	41
O=C(NC1CCN(Cc2ccccn2)CC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875056015	GF	On-Demand	Anodyne	DRD4	15	52
O=C(NC1CCN(Cc2ccccn2)CC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875056015	GF	On-Demand	Anodyne	SIGMAR1	17	41
O=C(NC1CCN(Cc2ccccn2)CC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875056017	GF	On-Demand	Anodyne	DRD4	15	52
O=C(NC1CCN(Cc2ccccn2)CC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875056017	GF	On-Demand	Anodyne	SIGMAR1	17	41
O=C(NC1CCN(Cc2ccccn2)CC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875056019	GF	On-Demand	Anodyne	DRD4	15	52
O=C(NC1CCN(Cc2ccccn2)CC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875056019	GF	On-Demand	Anodyne	SIGMAR1	17	41
COC(=O)C1(O)CN(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)C1	ZINC000875056040	GC	On-Demand	Anodyne	EPHX2	31	45
O=C(NCCCCC1CC1)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875056041	FG	On-Demand	Anodyne	CCR3	23	41
O=C(NCCCCC1CC1)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875056041	FG	On-Demand	Anodyne	EPHX2	42	53
O=C(NCCCCC1CC1)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875056041	FG	On-Demand	Anodyne	SCD1	22	51
O=C(NCCCCC1CC1)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875056041	FG	On-Demand	Anodyne	SCD	20	51
CC[C@@H]1COCCN1CCNC(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875056057	GD	On-Demand	Anodyne	SSTR5	51	37
COC(=O)[C@@H]1CO[C@H](CCC(=O)Nc2nc3cc(OC)c(OC)cc3s2)C1	ZINC000875056112	GF	On-Demand	Anodyne	CSNK1D	44	43
CN(C)CCOc1ccc(CNC(=O)N(C)OCC(F)(F)F)cc1	ZINC000875056121	EE	On-Demand	Anodyne	LTA4H	16	42
CN(C)CCOc1ccc(CNC(=O)N(C)OCC(F)(F)F)cc1	ZINC000875056121	EE	On-Demand	Anodyne	ESRRG	43	32
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875056131	ED	On-Demand	Anodyne	SIGMAR1	16	41
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875056131	ED	On-Demand	Anodyne	SSTR5	50	35
Cc1ccccc1CN1CCC(NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)CC1	ZINC000875056138	GG	On-Demand	Anodyne	DRD4	20	53
Cc1ccccc1CN1CCC(NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)CC1	ZINC000875056138	GG	On-Demand	Anodyne	SIGMAR1	21	43
Cc1ccccc1CN1CCC(NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)CC1	ZINC000875056138	GG	On-Demand	Anodyne	CCR8	49	32
CC[C@H](NC(=O)c1c(Cl)nn(C)c1Cl)c1ccc(OC)cc1	ZINC000875056141	EH	On-Demand	Anodyne	TACR3	51	44
CC[C@H](NC(=O)c1c(Cl)nn(C)c1Cl)c1ccc(OC)cc1	ZINC000875056141	EH	On-Demand	Anodyne	UTS2	42	42
C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCc2ccccc2)cc1	ZINC000875056156	GH	On-Demand	Anodyne	MAOB	16	43
C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCc2ccccc2)cc1	ZINC000875056156	GH	On-Demand	Anodyne	LTA4H	43	44
C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCc2ccccc2)cc1	ZINC000875056156	GH	On-Demand	Anodyne	ADAM17	50	41
C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCc2ccccc2)cc1	ZINC000875056156	GH	On-Demand	Anodyne	NAAA	15	41
O=C(NC1CCN(Cc2ccccn2)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875056157	GF	On-Demand	Anodyne	DRD4	17	51
O=C(NC1CCN(Cc2ccccn2)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875056157	GF	On-Demand	Anodyne	EPHX2	21	41
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCc2ccccc2)cc1	ZINC000875056158	GH	On-Demand	Anodyne	MAOB	16	43
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCc2ccccc2)cc1	ZINC000875056158	GH	On-Demand	Anodyne	LTA4H	43	44
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCc2ccccc2)cc1	ZINC000875056158	GH	On-Demand	Anodyne	ADAM17	50	41
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCc2ccccc2)cc1	ZINC000875056158	GH	On-Demand	Anodyne	NAAA	15	41
O=C(NC1CCN(Cc2ccccn2)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875056159	GF	On-Demand	Anodyne	DRD4	17	51
O=C(NC1CCN(Cc2ccccn2)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875056159	GF	On-Demand	Anodyne	EPHX2	21	41
C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCc2ccccc2)cc1	ZINC000875056161	GH	On-Demand	Anodyne	MAOB	16	43
C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCc2ccccc2)cc1	ZINC000875056161	GH	On-Demand	Anodyne	LTA4H	43	44
C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCc2ccccc2)cc1	ZINC000875056161	GH	On-Demand	Anodyne	ADAM17	50	41
C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCc2ccccc2)cc1	ZINC000875056161	GH	On-Demand	Anodyne	NAAA	15	41
C[C@H]1CN(Cc2ccc(CNC(=O)N3CCC([C@H](C)O)CC3)cc2)C[C@H](C)O1	ZINC000875056163	GF	On-Demand	Anodyne	MLNR	52	37
CN(C)CCOc1ccc(CNC(=O)NC[C@H]2C[C@H](O)C2)cc1	ZINC000875056171	DD	On-Demand	Anodyne	LTA4H	15	41
CN(C)CCOc1ccc(CNC(=O)NC[C@H]2C[C@H](O)C2)cc1	ZINC000875056171	DD	On-Demand	Anodyne	ESRRG	42	32
COC(=O)C1(O)CN(C(=O)NCc2ccc(CN3CCC(C)CC3)cc2)C1	ZINC000875056173	GD	On-Demand	Anodyne	SIGMAR1	28	43
COC(=O)C1(O)CN(C(=O)NCc2ccc(CN3CCC(C)CC3)cc2)C1	ZINC000875056173	GD	On-Demand	Anodyne	MCHR1	16	43
O=C(CCCOC1CCOCC1)Nc1nc2c(C(F)(F)F)cccc2s1	ZINC000875056175	GI	On-Demand	Anodyne	CSNK1D	41	37
CCOC1CC2(C1)C[C@H]2C(=O)Nc1ccc(C(=O)c2nccn2C)cc1	ZINC000875056183	FF	On-Demand	Anodyne	TIMP3	46	29
CCC(CC)(CNC(=O)NC1CCN(CCN(C)C)CC1)C(F)(F)F	ZINC000875056198	FF	On-Demand	Anodyne	SLC6A5	22	46
CCC(CC)(CNC(=O)NC1CCN(CCN(C)C)CC1)C(F)(F)F	ZINC000875056198	FF	On-Demand	Anodyne	EPHX2	28	41
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(Cc4ccccc4C)CC3)C[C@@H]1C2	ZINC000875056201	GF	On-Demand	Anodyne	DRD4	24	52
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(Cc4ccccc4C)CC3)C[C@@H]1C2	ZINC000875056201	GF	On-Demand	Anodyne	SIGMAR1	27	46
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(Cc4ccccc4C)CC3)C[C@@H]1C2	ZINC000875056201	GF	On-Demand	Anodyne	EPHX2	26	46
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(Cc4ccccc4C)CC3)C[C@@H]1C2	ZINC000875056201	GF	On-Demand	Anodyne	MCHR1	18	42
C[C@H]1CN(Cc2ccc(CNC(=O)N3Cc4cccc(O)c4C3)cc2)C[C@@H](C)O1	ZINC000875056210	GG	On-Demand	Clean	NAMPT	25	43
C[C@@H]1CN(Cc2ccc(CNC(=O)N3Cc4cccc(O)c4C3)cc2)C[C@@H](C)O1	ZINC000875056212	GG	On-Demand	Clean	NAMPT	25	43
C[C@@H](NC(=O)NC1CCN(CCN(C)C)CC1)c1ccnn1C	ZINC000875056213	DC	On-Demand	Anodyne	SLC6A5	16	42
C[C@H]1CN(Cc2ccc(CNC(=O)N3Cc4cccc(O)c4C3)cc2)C[C@H](C)O1	ZINC000875056214	GG	On-Demand	Clean	NAMPT	25	43
C[C@H](NC(=O)NC1CCN(CCN(C)C)CC1)c1ccnn1C	ZINC000875056215	DC	On-Demand	Anodyne	SLC6A5	16	42
COC(=O)C1(O)CN(C(=O)NCc2ccc(OCCN(C)C)cc2)C1	ZINC000875056219	FC	On-Demand	Anodyne	LTA4H	17	40
COC(=O)C1(O)CN(C(=O)NCCc2cccc(OC)c2)C1	ZINC000875056224	DC	On-Demand	Anodyne	DRD4	44	34
COC(=O)C1(O)CN(C(=O)NCCc2cccc(OC)c2)C1	ZINC000875056224	DC	On-Demand	Anodyne	HRH2	21	40
COC(=O)C1(O)CN(C(=O)NCCc2cccc(OC)c2)C1	ZINC000875056224	DC	On-Demand	Anodyne	MTNR1A	103	51
COC(=O)C1(O)CN(C(=O)NCCc2cccc(OC)c2)C1	ZINC000875056224	DC	On-Demand	Anodyne	MTNR1B	94	51
COC(=O)C1(O)CN(C(=O)NCCc2cccc(OC)c2)C1	ZINC000875056224	DC	On-Demand	Anodyne	ROCK2	44	36
COCCN(CC1CCN(C)CC1)C(=O)NCCc1cccc(OC)c1	ZINC000875056229	FE	On-Demand	Anodyne	FKBP1A	17	43
COCCN(CC1CCN(C)CC1)C(=O)NCCc1cccc(OC)c1	ZINC000875056229	FE	On-Demand	Anodyne	DRD4	46	35
COCCN(CC1CCN(C)CC1)C(=O)NCCc1cccc(OC)c1	ZINC000875056229	FE	On-Demand	Anodyne	ACHE	16	42
COCCN(CC1CCN(C)CC1)C(=O)NCCc1cccc(OC)c1	ZINC000875056229	FE	On-Demand	Anodyne	CCR3	15	41
COCCN(CC1CCN(C)CC1)C(=O)NCCc1cccc(OC)c1	ZINC000875056229	FE	On-Demand	Anodyne	MTNR1A	54	44
COCCN(CC1CCN(C)CC1)C(=O)NCCc1cccc(OC)c1	ZINC000875056229	FE	On-Demand	Anodyne	MTNR1B	49	44
COCCN(CC1CCN(C)CC1)C(=O)NCCc1cccc(OC)c1	ZINC000875056229	FE	On-Demand	Anodyne	CRTM	46	34
COCCN(CC1CCN(C)CC1)C(=O)NCCc1cccc(OC)c1	ZINC000875056229	FE	On-Demand	Anodyne	ACKR3	65	33
O=C(NC1CCN(Cc2ccccn2)CC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875056255	GF	On-Demand	Anodyne	DRD4	19	54
O=C(NC1CCN(Cc2ccccn2)CC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875056255	GF	On-Demand	Anodyne	SIGMAR1	16	40
O=C(NC1CCN(C(=O)c2ccccc2F)CC1)N[C@@H]1C[C@H]1C1CCOCC1	ZINC000875056256	GF	On-Demand	Anodyne	EPHX2	31	41
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875056268	GI	On-Demand	Anodyne	MTTP	56	33
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875056268	GI	On-Demand	Anodyne	TAAR1	35	40
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875056268	GI	On-Demand	Anodyne	KCNK3	125	47
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875056268	GI	On-Demand	Anodyne	KCNK9	83	40
O=C(NCCC[C@H]1CCOC1=O)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875056284	GE	On-Demand	Anodyne	EPHX2	25	48
O=C(NCCC[C@@H]1CCOC1=O)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875056285	GE	On-Demand	Anodyne	EPHX2	25	48
C[C@@H](NC(=O)NC1CCN(C(=O)c2ccccc2F)CC1)c1ccns1	ZINC000875056303	GF	On-Demand	Anodyne	EPHX2	27	41
C[C@H](NC(=O)NC1CCN(C(=O)c2ccccc2F)CC1)c1ccns1	ZINC000875056304	GF	On-Demand	Anodyne	EPHX2	27	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056309	GF	On-Demand	Anodyne	CHRM2	18	40
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056309	GF	On-Demand	Anodyne	CHRM1	36	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056309	GF	On-Demand	Anodyne	ACE	51	44
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056309	GF	On-Demand	Anodyne	DRD2	24	40
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056309	GF	On-Demand	Anodyne	DRD4	31	49
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056309	GF	On-Demand	Anodyne	HTR2A	21	49
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056309	GF	On-Demand	Anodyne	OPRM1	24	47
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056309	GF	On-Demand	Anodyne	OPRD1	17	47
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056309	GF	On-Demand	Anodyne	GHRHR	48	33
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056309	GF	On-Demand	Anodyne	HTR4	47	42
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056309	GF	On-Demand	Anodyne	CHRM3	29	40
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056309	GF	On-Demand	Anodyne	LTA4H	18	43
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056309	GF	On-Demand	Anodyne	HTR7	15	43
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056309	GF	On-Demand	Anodyne	SIGMAR1	51	57
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056309	GF	On-Demand	Anodyne	SSTR5	48	38
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056309	GF	On-Demand	Anodyne	CCR5	63	38
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056309	GF	On-Demand	Anodyne	MCHR1	27	42
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056309	GF	On-Demand	Anodyne	BIRC2	65	49
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875056311	EF	On-Demand	Anodyne	CHRM1	21	40
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875056311	EF	On-Demand	Anodyne	DRD2	19	45
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875056311	EF	On-Demand	Anodyne	DRD4	26	50
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875056311	EF	On-Demand	Anodyne	HTR2A	19	50
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875056311	EF	On-Demand	Anodyne	OPRM1	17	45
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875056311	EF	On-Demand	Anodyne	HTR4	19	41
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875056311	EF	On-Demand	Anodyne	SIGMAR1	48	61
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875056311	EF	On-Demand	Anodyne	CCR5	35	40
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875056311	EF	On-Demand	Anodyne	CAPN2	68	36
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875056311	EF	On-Demand	Anodyne	EPHX2	25	41
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875056311	EF	On-Demand	Anodyne	MCHR1	21	41
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875056311	EF	On-Demand	Anodyne	CACNA1G	23	40
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875056311	EF	On-Demand	Anodyne	BIRC2	59	48
CC[C@@H](NC(=O)NCc1cccc(NC(=O)COC)c1)[C@@H](O)c1ccccc1	ZINC000875056325	GF	On-Demand	Anodyne	PDS	44	35
CC[C@@H](NC(=O)NCc1cccc(NC(=O)COC)c1)[C@H](O)c1ccccc1	ZINC000875056327	GF	On-Demand	Anodyne	PDS	44	35
C[C@@H](NC(=O)N1C[C@H]2C(=O)OC[C@H]2C1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875056333	GF	On-Demand	Anodyne	KCNK3	85	38
C[C@H](NC(=O)N1C[C@H]2C(=O)OC[C@H]2C1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875056335	GF	On-Demand	Anodyne	KCNK3	85	38
CC[C@@H](NC(=O)c1sccc1CC#N)c1ccc(OC)cc1	ZINC000875056347	DH	On-Demand	Mild	UTS2	18	40
CN(C)CCOc1ccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875056380	GD	On-Demand	Anodyne	LTA4H	28	45
CN(C)CCOc1ccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875056380	GD	On-Demand	Anodyne	HRH3	16	40
CN(C)CCOc1ccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875056380	GD	On-Demand	Anodyne	CCR3	17	47
CN(C)CCOc1ccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875056380	GD	On-Demand	Anodyne	SLC6A5	34	45
CN(C)CCOc1ccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875056380	GD	On-Demand	Anodyne	MCHR1	15	45
CCC[C@H](CCO)NC(=O)NC1CCN(S(=O)(=O)CCC)CC1	ZINC000875056401	ED	On-Demand	Anodyne	EPHX2	19	49
CCC[C@@H](CCO)NC(=O)NC1CCN(S(=O)(=O)CCC)CC1	ZINC000875056403	ED	On-Demand	Anodyne	EPHX2	19	49
CCC1(CC)CCCN1C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875056426	EG	On-Demand	Anodyne	DRD4	21	55
CCC1(CC)CCCN1C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875056426	EG	On-Demand	Anodyne	SIGMAR1	17	42
CCC1(CC)CCCN1C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875056426	EG	On-Demand	Anodyne	SSTR5	50	38
CN1CCN(C(=O)NC2CCN(Cc3ccccn3)CC2)CCC1(C)C	ZINC000875056428	FE	On-Demand	Anodyne	DRD4	15	52
CN1CCN(C(=O)NC2CCN(Cc3ccccn3)CC2)CCC1(C)C	ZINC000875056428	FE	On-Demand	Anodyne	SSTR5	44	36
Cc1ccccc1CN1CCC(NC(=O)N2CCC[C@H](C(C)(C)O)C2)CC1	ZINC000875056435	FG	On-Demand	Anodyne	CHRM1	21	46
Cc1ccccc1CN1CCC(NC(=O)N2CCC[C@H](C(C)(C)O)C2)CC1	ZINC000875056435	FG	On-Demand	Anodyne	DRD4	23	54
Cc1ccccc1CN1CCC(NC(=O)N2CCC[C@H](C(C)(C)O)C2)CC1	ZINC000875056435	FG	On-Demand	Anodyne	CHRM3	21	46
Cc1ccccc1CN1CCC(NC(=O)N2CCC[C@H](C(C)(C)O)C2)CC1	ZINC000875056435	FG	On-Demand	Anodyne	SIGMAR1	19	43
Cc1ccccc1CN1CCC(NC(=O)N2CCC[C@H](C(C)(C)O)C2)CC1	ZINC000875056435	FG	On-Demand	Anodyne	CCR3	29	41
Cc1ccccc1CN1CCC(NC(=O)N2CCC[C@H](C(C)(C)O)C2)CC1	ZINC000875056435	FG	On-Demand	Anodyne	MCHR1	28	40
Cc1ccccc1CN1CCC(NC(=O)N2CCC[C@H](C(C)(C)O)C2)CC1	ZINC000875056435	FG	On-Demand	Anodyne	CCR8	63	33
Cc1ccccc1CN1CCC(NC(=O)N2CCC[C@@H](C(C)(C)O)C2)CC1	ZINC000875056438	FG	On-Demand	Anodyne	CHRM1	21	46
Cc1ccccc1CN1CCC(NC(=O)N2CCC[C@@H](C(C)(C)O)C2)CC1	ZINC000875056438	FG	On-Demand	Anodyne	DRD4	23	54
Cc1ccccc1CN1CCC(NC(=O)N2CCC[C@@H](C(C)(C)O)C2)CC1	ZINC000875056438	FG	On-Demand	Anodyne	CHRM3	21	46
Cc1ccccc1CN1CCC(NC(=O)N2CCC[C@@H](C(C)(C)O)C2)CC1	ZINC000875056438	FG	On-Demand	Anodyne	SIGMAR1	19	43
Cc1ccccc1CN1CCC(NC(=O)N2CCC[C@@H](C(C)(C)O)C2)CC1	ZINC000875056438	FG	On-Demand	Anodyne	CCR3	29	41
Cc1ccccc1CN1CCC(NC(=O)N2CCC[C@@H](C(C)(C)O)C2)CC1	ZINC000875056438	FG	On-Demand	Anodyne	MCHR1	28	40
Cc1ccccc1CN1CCC(NC(=O)N2CCC[C@@H](C(C)(C)O)C2)CC1	ZINC000875056438	FG	On-Demand	Anodyne	CCR8	63	33
Cc1ccccc1CN1CCC(NC(=O)NC[C@H]2C[C@H](O)C2)CC1	ZINC000875056461	EE	On-Demand	Anodyne	DRD4	23	56
Cc1ccccc1CN1CCC(NC(=O)NC[C@H]2C[C@H](O)C2)CC1	ZINC000875056461	EE	On-Demand	Anodyne	SIGMAR1	23	46
Cc1ccccc1CN1CCC(NC(=O)NC[C@H]2C[C@H](O)C2)CC1	ZINC000875056461	EE	On-Demand	Anodyne	CCR3	33	40
Cc1ccccc1CN1CCC(NC(=O)NC[C@H]2C[C@H](O)C2)CC1	ZINC000875056461	EE	On-Demand	Anodyne	EPHX2	30	42
Cc1ccccc1CN1CCC(NC(=O)NC[C@H]2C[C@H](O)C2)CC1	ZINC000875056461	EE	On-Demand	Anodyne	MCHR1	28	43
Cc1ccccc1CN1CCC(NC(=O)NC[C@H]2C[C@H](O)C2)CC1	ZINC000875056461	EE	On-Demand	Anodyne	CCR8	46	32
COc1ccc([C@@H]2CN(C(=O)NC3CCN(CCN(C)C)CC3)CCO2)cc1	ZINC000875056465	GD	On-Demand	Anodyne	SLC6A5	17	43
COc1ccc([C@@H]2CN(C(=O)NC3CCN(CCN(C)C)CC3)CCO2)cc1	ZINC000875056465	GD	On-Demand	Anodyne	MCHR1	27	42
O=C(Nc1nc2c(C(F)(F)F)cccc2s1)C1(F)CCOCC1	ZINC000875056492	EH	On-Demand	Anodyne	TRPV1	18	42
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(Cc4ccccn4)CC3)C[C@@H]1C2	ZINC000875056510	FD	On-Demand	Anodyne	DRD4	20	52
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(Cc4ccccn4)CC3)C[C@@H]1C2	ZINC000875056510	FD	On-Demand	Anodyne	SIGMAR1	21	43
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(Cc4ccccn4)CC3)C[C@@H]1C2	ZINC000875056510	FD	On-Demand	Anodyne	SSTR5	44	36
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(Cc4ccccn4)CC3)C[C@@H]1C2	ZINC000875056510	FD	On-Demand	Anodyne	EPHX2	26	47
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(Cc4ccccn4)CC3)C[C@@H]1C2	ZINC000875056510	FD	On-Demand	Anodyne	MCHR1	18	40
C[C@H]1CCCCN1Cc1ccc(CNC(=O)N[C@@H]2CCOC[C@H]2O)cc1	ZINC000875056517	FE	On-Demand	Anodyne	HRH3	24	41
C[C@@H](NC(=O)NC1CCN(CCN(C)C)CC1)c1ccc(C(F)(F)F)nc1	ZINC000875056533	GE	On-Demand	Anodyne	SLC6A5	31	49
C[C@@H](NC(=O)NC1CCN(CCN(C)C)CC1)c1ccc(C(F)(F)F)nc1	ZINC000875056533	GE	On-Demand	Anodyne	EPHX2	38	40
C[C@H](NC(=O)NC1CCN(CCN(C)C)CC1)c1ccc(C(F)(F)F)nc1	ZINC000875056534	GE	On-Demand	Anodyne	SLC6A5	31	49
C[C@H](NC(=O)NC1CCN(CCN(C)C)CC1)c1ccc(C(F)(F)F)nc1	ZINC000875056534	GE	On-Demand	Anodyne	EPHX2	38	40
Cc1ccccc1CN1CCC(NC(=O)N2Cc3cccc(O)c3C2)CC1	ZINC000875056538	FG	On-Demand	Clean	DRD4	28	58
Cc1ccccc1CN1CCC(NC(=O)N2Cc3cccc(O)c3C2)CC1	ZINC000875056538	FG	On-Demand	Clean	SIGMAR1	20	46
Cc1ccccc1CN1CCC(NC(=O)N2Cc3cccc(O)c3C2)CC1	ZINC000875056538	FG	On-Demand	Clean	MCHR1	18	40
Cc1ccccc1CN1CCC(NC(=O)N2Cc3cccc(O)c3C2)CC1	ZINC000875056538	FG	On-Demand	Clean	CCR8	43	31
O=C(NC1CCN(Cc2ccccn2)CC1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875056542	GG	On-Demand	Anodyne	DRD4	17	56
O=C(NC1CCN(Cc2ccccn2)CC1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875056542	GG	On-Demand	Anodyne	SIGMAR1	18	44
O=C(NC1CCN(Cc2ccccn2)CC1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875056542	GG	On-Demand	Anodyne	SSTR5	40	34
O=C(NC1CCN(Cc2ccccn2)CC1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875056542	GG	On-Demand	Anodyne	SLC6A5	28	40
O=C(NC1CCN(Cc2ccccn2)CC1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875056542	GG	On-Demand	Anodyne	EPHX2	26	44
CCOCc1ccc(CNC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875056570	GF	On-Demand	Anodyne	F2	48	41
CCOCc1ccc(CNC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875056570	GF	On-Demand	Anodyne	ACE	36	40
CCOCc1ccc(CNC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875056570	GF	On-Demand	Anodyne	CTRA_BOVIN	47	32
CCOCc1ccc(CNC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875056570	GF	On-Demand	Anodyne	TRY1_BOVIN	64	41
CCOCc1ccc(CNC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875056570	GF	On-Demand	Anodyne	PREP	42	37
CCOCc1ccc(CNC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875056570	GF	On-Demand	Anodyne	LGMN	60	35
CCOCc1ccc(CNC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875056570	GF	On-Demand	Anodyne	TMPRSS11D	68	37
CCOCc1ccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875056571	GF	On-Demand	Anodyne	F2	48	41
CCOCc1ccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875056571	GF	On-Demand	Anodyne	ACE	36	40
CCOCc1ccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875056571	GF	On-Demand	Anodyne	CTRA_BOVIN	47	32
CCOCc1ccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875056571	GF	On-Demand	Anodyne	TRY1_BOVIN	64	41
CCOCc1ccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875056571	GF	On-Demand	Anodyne	PREP	42	37
CCOCc1ccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875056571	GF	On-Demand	Anodyne	LGMN	60	35
CCOCc1ccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875056571	GF	On-Demand	Anodyne	TMPRSS11D	68	37
CCOCc1ccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875056572	GF	On-Demand	Anodyne	F2	48	41
CCOCc1ccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875056572	GF	On-Demand	Anodyne	ACE	36	40
CCOCc1ccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875056572	GF	On-Demand	Anodyne	CTRA_BOVIN	47	32
CCOCc1ccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875056572	GF	On-Demand	Anodyne	TRY1_BOVIN	64	41
CCOCc1ccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875056572	GF	On-Demand	Anodyne	PREP	42	37
CCOCc1ccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875056572	GF	On-Demand	Anodyne	LGMN	60	35
CCOCc1ccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875056572	GF	On-Demand	Anodyne	TMPRSS11D	68	37
CCOCc1ccc(CNC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875056573	GF	On-Demand	Anodyne	F2	48	41
CCOCc1ccc(CNC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875056573	GF	On-Demand	Anodyne	ACE	36	40
CCOCc1ccc(CNC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875056573	GF	On-Demand	Anodyne	CTRA_BOVIN	47	32
CCOCc1ccc(CNC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875056573	GF	On-Demand	Anodyne	TRY1_BOVIN	64	41
CCOCc1ccc(CNC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875056573	GF	On-Demand	Anodyne	PREP	42	37
CCOCc1ccc(CNC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875056573	GF	On-Demand	Anodyne	LGMN	60	35
CCOCc1ccc(CNC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875056573	GF	On-Demand	Anodyne	TMPRSS11D	68	37
CC[C@@H](NC(=O)[C@@H](NC=O)C(C)C)c1ccc(OC)cc1	ZINC000875056578	CE	On-Demand	Anodyne	MMP1	15	40
CC[C@H](NC(=O)[C@@H](NC=O)C(C)C)c1ccc(OC)cc1	ZINC000875056580	CE	On-Demand	Anodyne	MMP1	15	40
Cc1ccccc1CN1CCC(NC(=O)NC[C@@H]2CC(C(F)(F)F)=NO2)CC1	ZINC000875056581	GF	On-Demand	Anodyne	SIGMAR1	15	47
Cc1ccccc1CN1CCC(NC(=O)NC[C@H]2CC(C(F)(F)F)=NO2)CC1	ZINC000875056583	GF	On-Demand	Anodyne	SIGMAR1	15	47
COCC(C)(C)CCNC(=O)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875056588	GF	On-Demand	Anodyne	EPHX2	41	46
O=CN1CCCN(C(=O)NC2CCN(Cc3ccccn3)CC2)CC1	ZINC000875056592	EC	On-Demand	Anodyne	DRD4	16	55
O=CN1CCCN(C(=O)NC2CCN(Cc3ccccn3)CC2)CC1	ZINC000875056592	EC	On-Demand	Anodyne	SIGMAR1	17	42
O=CN1CCCN(C(=O)NC2CCN(Cc3ccccn3)CC2)CC1	ZINC000875056592	EC	On-Demand	Anodyne	EPHX2	15	41
CS[C@@H]1C[C@@H](NC(=O)NC2CCN(CCN(C)C)CC2)C1	ZINC000875056593	DD	On-Demand	Anodyne	EPHX2	19	45
CC[C@@H](NC(=O)NC1CCN(CCN(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000875056594	FD	On-Demand	Anodyne	CCR5	60	48
CC[C@@H](NC(=O)NC1CCN(CCN(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000875056594	FD	On-Demand	Anodyne	SLC6A5	20	42
CC[C@@H](NC(=O)NC1CCN(CCN(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000875056594	FD	On-Demand	Anodyne	EPHX2	27	40
CC[C@@H](NC(=O)NC1CCN(CCN(C)C)CC1)[C@H](O)c1ccccc1	ZINC000875056598	FD	On-Demand	Anodyne	CCR5	60	48
CC[C@@H](NC(=O)NC1CCN(CCN(C)C)CC1)[C@H](O)c1ccccc1	ZINC000875056598	FD	On-Demand	Anodyne	SLC6A5	20	42
CC[C@@H](NC(=O)NC1CCN(CCN(C)C)CC1)[C@H](O)c1ccccc1	ZINC000875056598	FD	On-Demand	Anodyne	EPHX2	27	40
CCOCc1ccc(CNC(=O)C(=O)N2CCC[C@H]2c2cncc(C)c2)cc1	ZINC000875056605	GF	On-Demand	Anodyne	SSTR5	28	40
CCOCc1ccc(CNC(=O)C(=O)N2CCC[C@@H]2c2cncc(C)c2)cc1	ZINC000875056607	GF	On-Demand	Anodyne	SSTR5	28	40
C=CC(C)(C)CCCNC(=O)NC1CCN(CCN(C)C)CC1	ZINC000875056638	DE	On-Demand	Mild	SLC6A5	16	41
COC(=O)C1(O)CN(C(=O)NC2CCN(CCN(C)C)CC2)C1	ZINC000875056654	EA	On-Demand	Anodyne	SLC6A5	16	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875056656	FD	On-Demand	Anodyne	DRD4	22	51
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875056656	FD	On-Demand	Anodyne	SIGMAR1	19	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000875056656	FD	On-Demand	Anodyne	SSTR5	51	36
COC(=O)N(C)NC(=O)NCCc1cccc(OC)c1	ZINC000875056667	CD	On-Demand	Reactive	DRD4	42	32
COC(=O)N(C)NC(=O)NCCc1cccc(OC)c1	ZINC000875056667	CD	On-Demand	Reactive	NQO2	40	45
COC(=O)N(C)NC(=O)NCCc1cccc(OC)c1	ZINC000875056667	CD	On-Demand	Reactive	ROCK1	33	44
COC(=O)N(C)NC(=O)NCCc1cccc(OC)c1	ZINC000875056667	CD	On-Demand	Reactive	MTNR1A	130	54
COC(=O)N(C)NC(=O)NCCc1cccc(OC)c1	ZINC000875056667	CD	On-Demand	Reactive	MTNR1B	110	54
COC(=O)N(C)NC(=O)NCCc1cccc(OC)c1	ZINC000875056667	CD	On-Demand	Reactive	ROCK2	42	39
COC(=O)N(C)NC(=O)NCCc1cccc(OC)c1	ZINC000875056667	CD	On-Demand	Reactive	HSD17B2	27	46
COC(=O)N(C)NC(=O)NCCc1cccc(OC)c1	ZINC000875056667	CD	On-Demand	Reactive	CRTM	58	38
O=C(NC1CCN(Cc2ccccn2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875056675	GG	On-Demand	Anodyne	DRD4	17	53
O=C(NC1CCN(Cc2ccccn2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875056675	GG	On-Demand	Anodyne	SIGMAR1	16	40
O=C(NC1CCN(Cc2ccccn2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875056675	GG	On-Demand	Anodyne	SSTR5	50	35
O=C(NC1CCN(Cc2ccccn2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875056675	GG	On-Demand	Anodyne	SCN5A	35	40
O=C(NC1CCN(Cc2ccccn2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875056675	GG	On-Demand	Anodyne	EPHX2	26	45
O=C(NC1CCN(Cc2ccccn2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875056675	GG	On-Demand	Anodyne	MCHR1	19	40
O=C(NC1CCN(Cc2ccccn2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875056677	GG	On-Demand	Anodyne	DRD4	17	53
O=C(NC1CCN(Cc2ccccn2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875056677	GG	On-Demand	Anodyne	SIGMAR1	16	40
O=C(NC1CCN(Cc2ccccn2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875056677	GG	On-Demand	Anodyne	SSTR5	50	35
O=C(NC1CCN(Cc2ccccn2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875056677	GG	On-Demand	Anodyne	SCN5A	35	40
O=C(NC1CCN(Cc2ccccn2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875056677	GG	On-Demand	Anodyne	EPHX2	26	45
O=C(NC1CCN(Cc2ccccn2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875056677	GG	On-Demand	Anodyne	MCHR1	19	40
CC[C@@H](NC(=O)NC1CCN(CCN(C)C)CC1)c1cccc(OC)c1OC	ZINC000875056689	GE	On-Demand	Anodyne	DRD2	20	46
CC[C@@H](NC(=O)NC1CCN(CCN(C)C)CC1)c1cccc(OC)c1OC	ZINC000875056689	GE	On-Demand	Anodyne	DRD3	15	44
CC[C@@H](NC(=O)NC1CCN(CCN(C)C)CC1)c1cccc(OC)c1OC	ZINC000875056689	GE	On-Demand	Anodyne	HTR7	18	40
CC[C@@H](NC(=O)NC1CCN(CCN(C)C)CC1)c1cccc(OC)c1OC	ZINC000875056689	GE	On-Demand	Anodyne	SLC6A5	17	41
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(C(=O)C(C)C)CC1	ZINC000875056691	DD	On-Demand	Anodyne	EPHX2	25	52
O=C(NCc1ccnc(F)c1)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875056738	FE	On-Demand	Anodyne	CCR3	21	42
O=C(NCc1ccnc(F)c1)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875056738	FE	On-Demand	Anodyne	EPHX2	37	52
O=C(NCc1ccc(COCc2ccccc2)cc1)C(=O)N[C@H]1CC12CCC2	ZINC000875056751	GG	On-Demand	Anodyne	SLC12A5	60	32
O=C(NCc1ccc(COCc2ccccc2)cc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875056753	GG	On-Demand	Anodyne	SLC12A5	60	32
COC(=O)N(C)NC(=O)NCc1ccccc1CN1CCC(C)CC1	ZINC000875056758	EE	On-Demand	Reactive	SIGMAR1	22	40
COC(=O)N(C)NC(=O)NCc1ccccc1CN1CCC(C)CC1	ZINC000875056758	EE	On-Demand	Reactive	CCR3	22	40
C[C@@]1(CO)CN(C(=O)NCc2ccc(OCc3ccccc3)cc2)C[C@]1(C)CO	ZINC000875056766	GF	On-Demand	Anodyne	MAOB	27	49
C[C@@]1(CO)CN(C(=O)NCc2ccc(OCc3ccccc3)cc2)C[C@]1(C)CO	ZINC000875056766	GF	On-Demand	Anodyne	LTA4H	39	43
C[C@@]1(CO)CN(C(=O)NCc2ccc(OCc3ccccc3)cc2)C[C@]1(C)CO	ZINC000875056766	GF	On-Demand	Anodyne	MMP13	24	42
C[C@@]1(CO)CN(C(=O)NCc2ccc(OCc3ccccc3)cc2)C[C@]1(C)CO	ZINC000875056766	GF	On-Demand	Anodyne	ADAM17	57	45
C[C@@]1(CO)CN(C(=O)NCc2ccc(OCc3ccccc3)cc2)C[C@]1(C)CO	ZINC000875056766	GF	On-Demand	Anodyne	FAAH	18	44
C[C@@]1(CO)CN(C(=O)NCc2ccc(OCc3ccccc3)cc2)C[C@]1(C)CO	ZINC000875056766	GF	On-Demand	Anodyne	DPP7	15	45
C[C@@]1(CO)CN(C(=O)NCc2ccc(OCc3ccccc3)cc2)C[C@]1(C)CO	ZINC000875056766	GF	On-Demand	Anodyne	MMP10	15	40
C[C@@]1(CO)CN(C(=O)NCc2ccc(OCc3ccccc3)cc2)C[C@]1(C)CO	ZINC000875056766	GF	On-Demand	Anodyne	FFAR1	46	45
C[C@@]1(CO)CN(C(=O)NCc2ccc(OCc3ccccc3)cc2)C[C@]1(C)CO	ZINC000875056766	GF	On-Demand	Anodyne	FFAR4	45	37
C[C@@]1(CO)CN(C(=O)NCc2ccc(OCc3ccccc3)cc2)C[C@]1(C)CO	ZINC000875056766	GF	On-Demand	Anodyne	SLC12A5	42	33
C[C@@]1(CO)CN(C(=O)NCc2ccc(OCc3ccccc3)cc2)C[C@]1(C)CO	ZINC000875056766	GF	On-Demand	Anodyne	NAMPT	23	41
C[C@@]1(CO)CN(C(=O)NCc2ccc(OCc3ccccc3)cc2)C[C@]1(C)CO	ZINC000875056766	GF	On-Demand	Anodyne	PDS	59	42
Cc1nccnc1[C@H](C)NC(=O)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875056771	GF	On-Demand	Anodyne	EPHX2	33	44
Cc1nccnc1[C@@H](C)NC(=O)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875056774	GF	On-Demand	Anodyne	EPHX2	33	44
O=C1CC[C@H](C(=O)Nc2nc3c(C(F)(F)F)cccc3s2)O1	ZINC000875056810	EF	On-Demand	Anodyne	TRPV1	17	41
CCCCCCCNC(=O)C(=O)NCCC(=O)N1CCN(C)CC1	ZINC000875056829	EC	On-Demand	Mild	ASAH1	80	35
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCOC[C@@H]1O	ZINC000875056830	FE	On-Demand	Anodyne	MAOB	16	42
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCOC[C@@H]1O	ZINC000875056830	FE	On-Demand	Anodyne	ADAM17	41	40
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCOC[C@@H]1O	ZINC000875056830	FE	On-Demand	Anodyne	FAAH	15	40
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCOC[C@@H]1O	ZINC000875056830	FE	On-Demand	Anodyne	NAAA	23	44
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCOC[C@@H]1O	ZINC000875056830	FE	On-Demand	Anodyne	FFAR1	34	41
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@H]1CCOC[C@@H]1O	ZINC000875056831	FE	On-Demand	Anodyne	MAOB	16	42
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@H]1CCOC[C@@H]1O	ZINC000875056831	FE	On-Demand	Anodyne	ADAM17	41	40
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@H]1CCOC[C@@H]1O	ZINC000875056831	FE	On-Demand	Anodyne	FAAH	15	40
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@H]1CCOC[C@@H]1O	ZINC000875056831	FE	On-Demand	Anodyne	NAAA	23	44
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@H]1CCOC[C@@H]1O	ZINC000875056831	FE	On-Demand	Anodyne	FFAR1	34	41
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@H]1CCOC[C@H]1O	ZINC000875056832	FE	On-Demand	Anodyne	MAOB	16	42
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@H]1CCOC[C@H]1O	ZINC000875056832	FE	On-Demand	Anodyne	ADAM17	41	40
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@H]1CCOC[C@H]1O	ZINC000875056832	FE	On-Demand	Anodyne	FAAH	15	40
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@H]1CCOC[C@H]1O	ZINC000875056832	FE	On-Demand	Anodyne	NAAA	23	44
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@H]1CCOC[C@H]1O	ZINC000875056832	FE	On-Demand	Anodyne	FFAR1	34	41
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCOC[C@H]1O	ZINC000875056833	FE	On-Demand	Anodyne	MAOB	16	42
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCOC[C@H]1O	ZINC000875056833	FE	On-Demand	Anodyne	ADAM17	41	40
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCOC[C@H]1O	ZINC000875056833	FE	On-Demand	Anodyne	FAAH	15	40
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCOC[C@H]1O	ZINC000875056833	FE	On-Demand	Anodyne	NAAA	23	44
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCOC[C@H]1O	ZINC000875056833	FE	On-Demand	Anodyne	FFAR1	34	41
CN(C)CCOc1ccc(CNC(=O)NC2(C)CC(F)(F)C2)cc1	ZINC000875056851	EF	On-Demand	Anodyne	ESRRG	42	32
CN(C)CCOc1ccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875056852	ED	On-Demand	Anodyne	HRH3	18	43
CN(C)CCOc1ccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875056853	ED	On-Demand	Anodyne	HRH3	18	43
CN(C)CCOc1ccc(CNC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875056859	ED	On-Demand	Anodyne	LTA4H	29	41
CN(C)CCOc1ccc(CNC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875056859	ED	On-Demand	Anodyne	ESRRG	43	32
C[C@H](NC(=O)NC1CCN(CCN(C)C)CC1)c1ccccc1O	ZINC000875056863	ED	On-Demand	Clean	CHRM1	16	40
C[C@H](NC(=O)NC1CCN(CCN(C)C)CC1)c1ccccc1O	ZINC000875056863	ED	On-Demand	Clean	SIGMAR1	15	41
C[C@H](NC(=O)NC1CCN(CCN(C)C)CC1)c1ccccc1O	ZINC000875056863	ED	On-Demand	Clean	CCR5	34	42
C[C@H](NC(=O)NC1CCN(CCN(C)C)CC1)c1ccccc1O	ZINC000875056863	ED	On-Demand	Clean	SLC6A5	21	44
C[C@@H](NC(=O)NC1CCN(CCN(C)C)CC1)c1ccccc1O	ZINC000875056864	ED	On-Demand	Clean	CHRM1	16	40
C[C@@H](NC(=O)NC1CCN(CCN(C)C)CC1)c1ccccc1O	ZINC000875056864	ED	On-Demand	Clean	SIGMAR1	15	41
C[C@@H](NC(=O)NC1CCN(CCN(C)C)CC1)c1ccccc1O	ZINC000875056864	ED	On-Demand	Clean	CCR5	34	42
C[C@@H](NC(=O)NC1CCN(CCN(C)C)CC1)c1ccccc1O	ZINC000875056864	ED	On-Demand	Clean	SLC6A5	21	44
O=C1CCN(C(=O)NC2CCN(Cc3ccccn3)CC2)CCCCCCN1	ZINC000875056870	GE	On-Demand	Anodyne	SIGMAR1	17	44
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)NC1CCN(Cc2ccccn2)CC1	ZINC000875056871	GE	On-Demand	Anodyne	EPHX2	15	42
O=C(NC[C@H]1CC(C(F)(F)F)=NO1)NC1CCN(Cc2ccccn2)CC1	ZINC000875056872	GE	On-Demand	Anodyne	EPHX2	15	42
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000875056876	FD	On-Demand	Anodyne	CHRM1	16	47
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000875056876	FD	On-Demand	Anodyne	DRD4	20	50
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000875056876	FD	On-Demand	Anodyne	SSTR5	59	39
CC[C@@H](NC(=O)c1scnc1C(F)F)c1ccc(OC)cc1	ZINC000875056894	EH	On-Demand	Anodyne	TACR3	43	39
Cc1nnc(NNC(=O)NC2CCN(CCc3ccccc3)CC2)n1C	ZINC000875056901	FD	On-Demand	Reactive	DRD2	18	44
Cc1nnc(NNC(=O)NC2CCN(CCc3ccccc3)CC2)n1C	ZINC000875056901	FD	On-Demand	Reactive	DRD4	27	49
Cc1nnc(NNC(=O)NC2CCN(CCc3ccccc3)CC2)n1C	ZINC000875056901	FD	On-Demand	Reactive	HTR2A	17	49
Cc1nnc(NNC(=O)NC2CCN(CCc3ccccc3)CC2)n1C	ZINC000875056901	FD	On-Demand	Reactive	OPRM1	15	43
Cc1nnc(NNC(=O)NC2CCN(CCc3ccccc3)CC2)n1C	ZINC000875056901	FD	On-Demand	Reactive	SIGMAR1	45	57
Cc1nnc(NNC(=O)NC2CCN(CCc3ccccc3)CC2)n1C	ZINC000875056901	FD	On-Demand	Reactive	BIRC2	36	41
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)C1	ZINC000875056902	GE	On-Demand	Anodyne	SLC6A1	51	38
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)C1	ZINC000875056902	GE	On-Demand	Anodyne	CCR3	18	43
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)C1	ZINC000875056902	GE	On-Demand	Anodyne	EPHX2	27	62
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)C1	ZINC000875056902	GE	On-Demand	Anodyne	SFRP1	47	36
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)C1	ZINC000875056902	GE	On-Demand	Anodyne	L3MBTL3	55	42
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)C1	ZINC000875056903	GE	On-Demand	Anodyne	SLC6A1	51	38
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)C1	ZINC000875056903	GE	On-Demand	Anodyne	CCR3	18	43
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)C1	ZINC000875056903	GE	On-Demand	Anodyne	EPHX2	27	62
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)C1	ZINC000875056903	GE	On-Demand	Anodyne	SFRP1	47	36
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)C1	ZINC000875056903	GE	On-Demand	Anodyne	L3MBTL3	55	42
COC(=O)C1(O)CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056905	FC	On-Demand	Anodyne	DRD2	26	45
COC(=O)C1(O)CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056905	FC	On-Demand	Anodyne	DRD4	34	52
COC(=O)C1(O)CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056905	FC	On-Demand	Anodyne	ACHE	17	46
COC(=O)C1(O)CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056905	FC	On-Demand	Anodyne	HTR2A	23	52
COC(=O)C1(O)CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056905	FC	On-Demand	Anodyne	OPRM1	20	46
COC(=O)C1(O)CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056905	FC	On-Demand	Anodyne	DRD3	17	42
COC(=O)C1(O)CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056905	FC	On-Demand	Anodyne	OPRD1	15	46
COC(=O)C1(O)CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056905	FC	On-Demand	Anodyne	SLC6A3	18	46
COC(=O)C1(O)CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056905	FC	On-Demand	Anodyne	HTR4	29	40
COC(=O)C1(O)CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056905	FC	On-Demand	Anodyne	CHRM3	25	40
COC(=O)C1(O)CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056905	FC	On-Demand	Anodyne	LTA4H	24	48
COC(=O)C1(O)CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056905	FC	On-Demand	Anodyne	HRH3	16	40
COC(=O)C1(O)CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056905	FC	On-Demand	Anodyne	SIGMAR1	70	60
COC(=O)C1(O)CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056905	FC	On-Demand	Anodyne	CCR3	34	41
COC(=O)C1(O)CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056905	FC	On-Demand	Anodyne	EPHX2	23	40
COC(=O)C1(O)CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056905	FC	On-Demand	Anodyne	MCHR1	25	44
COC(=O)C1(O)CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056905	FC	On-Demand	Anodyne	CCR8	18	40
COC(=O)C1(O)CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056905	FC	On-Demand	Anodyne	CYP2J2	46	34
COC(=O)C1(O)CN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000875056905	FC	On-Demand	Anodyne	BIRC2	36	43
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875056913	FG	On-Demand	Anodyne	PRNP	41	38
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875056913	FG	On-Demand	Anodyne	F7	18	42
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875056913	FG	On-Demand	Anodyne	KCNK3	115	41
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875056913	FG	On-Demand	Anodyne	KCNK9	74	41
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875056914	FG	On-Demand	Anodyne	PRNP	41	38
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875056914	FG	On-Demand	Anodyne	F7	18	42
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875056914	FG	On-Demand	Anodyne	KCNK3	115	41
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875056914	FG	On-Demand	Anodyne	KCNK9	74	41
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875056915	GG	On-Demand	Anodyne	DRD2	16	42
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875056915	GG	On-Demand	Anodyne	DRD4	28	52
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875056915	GG	On-Demand	Anodyne	HTR2A	17	52
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875056915	GG	On-Demand	Anodyne	SIGMAR1	42	43
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875056915	GG	On-Demand	Anodyne	CCR3	23	43
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875056915	GG	On-Demand	Anodyne	MCHR1	31	46
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875056915	GG	On-Demand	Anodyne	CACNA1G	25	41
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875056915	GG	On-Demand	Anodyne	CYP2J2	45	33
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875056916	GG	On-Demand	Anodyne	DRD2	16	42
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875056916	GG	On-Demand	Anodyne	DRD4	28	52
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875056916	GG	On-Demand	Anodyne	HTR2A	17	52
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875056916	GG	On-Demand	Anodyne	SIGMAR1	42	43
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875056916	GG	On-Demand	Anodyne	CCR3	23	43
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875056916	GG	On-Demand	Anodyne	MCHR1	31	46
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875056916	GG	On-Demand	Anodyne	CACNA1G	25	41
O=C(NC1CCN(CCc2ccccc2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875056916	GG	On-Demand	Anodyne	CYP2J2	45	33
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875056918	GH	On-Demand	Anodyne	NPY2R	69	41
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875056918	GH	On-Demand	Anodyne	PRNP	51	37
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875056918	GH	On-Demand	Anodyne	NR1H4	15	42
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875056918	GH	On-Demand	Anodyne	KCNK3	107	41
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875056918	GH	On-Demand	Anodyne	KCNK9	63	40
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875056921	GH	On-Demand	Anodyne	NPY2R	69	41
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875056921	GH	On-Demand	Anodyne	PRNP	51	37
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875056921	GH	On-Demand	Anodyne	NR1H4	15	42
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875056921	GH	On-Demand	Anodyne	KCNK3	107	41
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875056921	GH	On-Demand	Anodyne	KCNK9	63	40
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(NC(=O)COC)c1	ZINC000875056967	ED	On-Demand	Anodyne	ANPEP	17	42
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(NC(=O)COC)c1	ZINC000875056967	ED	On-Demand	Anodyne	PDS	48	33
CCOC1CC2(C1)C[C@H]2NC(=O)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875056971	GF	On-Demand	Anodyne	EPHX2	51	48
CCOC1CC2(C1)C[C@@H]2NC(=O)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875056972	GF	On-Demand	Anodyne	EPHX2	51	48
CO[C@@H]1CC[C@@H](C)N(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)C1	ZINC000875056981	GF	On-Demand	Anodyne	EPHX2	15	50
CC[C@@H](NC(=O)NC1CCN(C(=O)C(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000875056985	FE	On-Demand	Anodyne	EPHX2	38	48
CC[C@@H](NC(=O)NC1CCN(C(=O)C(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000875056985	FE	On-Demand	Anodyne	XIAP	56	36
CC[C@@H](NC(=O)NC1CCN(C(=O)C(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000875056985	FE	On-Demand	Anodyne	BIRC8	46	34
CC[C@@H](NC(=O)NC1CCN(C(=O)C(C)C)CC1)[C@H](O)c1ccccc1	ZINC000875056986	FE	On-Demand	Anodyne	EPHX2	38	48
CC[C@@H](NC(=O)NC1CCN(C(=O)C(C)C)CC1)[C@H](O)c1ccccc1	ZINC000875056986	FE	On-Demand	Anodyne	XIAP	56	36
CC[C@@H](NC(=O)NC1CCN(C(=O)C(C)C)CC1)[C@H](O)c1ccccc1	ZINC000875056986	FE	On-Demand	Anodyne	BIRC8	46	34
COC(=O)N(C)NC(=O)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875056990	FD	On-Demand	Reactive	EPHX2	42	48
O=C(NC1CCN(C(=O)c2ccccc2F)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875056995	FF	On-Demand	Anodyne	EPHX2	35	42
O=C(NC1CCN(C(=O)c2ccccc2F)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875056996	FF	On-Demand	Anodyne	EPHX2	35	42
O=C(NC1CCN(C(=O)c2ccccc2F)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875056997	FF	On-Demand	Anodyne	EPHX2	35	42
O=C(NC1CCN(C(=O)c2ccccc2F)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875056998	FF	On-Demand	Anodyne	EPHX2	35	42
CC(=O)Nc1cccc([C@@H](C)NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000875056999	GG	On-Demand	Anodyne	ADRB3	24	42
CC(=O)Nc1cccc([C@@H](C)NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000875056999	GG	On-Demand	Anodyne	F7	16	41
CC(=O)Nc1cccc([C@H](C)NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000875057000	GG	On-Demand	Anodyne	ADRB3	24	42
CC(=O)Nc1cccc([C@H](C)NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000875057000	GG	On-Demand	Anodyne	F7	16	41
CC(=O)Nc1cccc([C@H](C)NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000875057001	GG	On-Demand	Anodyne	ADRB3	24	42
CC(=O)Nc1cccc([C@H](C)NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000875057001	GG	On-Demand	Anodyne	F7	16	41
CC(=O)Nc1cccc([C@@H](C)NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000875057002	GG	On-Demand	Anodyne	ADRB3	24	42
CC(=O)Nc1cccc([C@@H](C)NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000875057002	GG	On-Demand	Anodyne	F7	16	41
Cc1nccnc1[C@H](C)NC(=O)NC1CCN(CCN(C)C)CC1	ZINC000875057003	ED	On-Demand	Anodyne	SLC6A5	17	43
Cc1nccnc1[C@@H](C)NC(=O)NC1CCN(CCN(C)C)CC1	ZINC000875057005	ED	On-Demand	Anodyne	SLC6A5	17	43
CN(C)CCOc1ccc(CNC(=O)N2CCC(C(=O)NCCO)CC2)cc1	ZINC000875057018	GC	On-Demand	Anodyne	LTA4H	18	41
CN(C)CCOc1ccc(CNC(=O)N2CCC(C(=O)NCCO)CC2)cc1	ZINC000875057018	GC	On-Demand	Anodyne	EPHX2	15	46
C[C@H](NC(=O)NC1CCN(CCN(C)C)CC1)c1cc2cnccc2o1	ZINC000875057031	FE	On-Demand	Anodyne	PDK1	44	33
C[C@@H](NC(=O)NC1CCN(CCN(C)C)CC1)c1cc2cnccc2o1	ZINC000875057032	FE	On-Demand	Anodyne	PDK1	44	33
CN(C[C@@H]1C[C@H](O)C1)C(=O)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057038	FG	On-Demand	Anodyne	MAOB	19	46
CN(C[C@@H]1C[C@H](O)C1)C(=O)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057038	FG	On-Demand	Anodyne	LTA4H	52	40
CN(C[C@@H]1C[C@H](O)C1)C(=O)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057038	FG	On-Demand	Anodyne	CACNA1B	26	40
CN(C[C@@H]1C[C@H](O)C1)C(=O)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057038	FG	On-Demand	Anodyne	ADAM17	30	43
CN(C[C@@H]1C[C@H](O)C1)C(=O)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057038	FG	On-Demand	Anodyne	FFAR1	37	42
CN(C[C@@H]1C[C@H](O)C1)C(=O)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057038	FG	On-Demand	Anodyne	PDS	54	39
COC(=O)N(C)NC(=O)NC1CCN(CCN(C)C)CC1	ZINC000875057050	DB	On-Demand	Reactive	SLC6A5	17	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1CN(C)C(C)C	ZINC000875057053	FF	On-Demand	Anodyne	SLC6A3	52	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1CN(C)C(C)C	ZINC000875057055	FF	On-Demand	Anodyne	SLC6A3	52	39
CCCCCCCNC(=O)C(=O)NC[C@H](C)N1CCOCC1	ZINC000875057057	DC	On-Demand	Mild	ASAH1	62	43
CCCCCCCNC(=O)C(=O)NC[C@@H](C)N1CCOCC1	ZINC000875057059	DC	On-Demand	Mild	ASAH1	62	43
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000875057060	EB	On-Demand	Anodyne	DRD4	21	53
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000875057060	EB	On-Demand	Anodyne	SSTR5	52	38
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000875057060	EB	On-Demand	Anodyne	MCHR1	23	40
Cc1ccccc1CN1CCC(NC(=O)N2CCO[C@@H](C(F)(F)F)CC2)CC1	ZINC000875057062	GG	On-Demand	Anodyne	DRD4	21	53
Cc1ccccc1CN1CCC(NC(=O)N2CCO[C@@H](C(F)(F)F)CC2)CC1	ZINC000875057062	GG	On-Demand	Anodyne	SIGMAR1	17	43
Cc1ccccc1CN1CCC(NC(=O)N2CCO[C@@H](C(F)(F)F)CC2)CC1	ZINC000875057062	GG	On-Demand	Anodyne	MCHR1	35	42
Cc1ccccc1CN1CCC(NC(=O)N2CCO[C@H](C(F)(F)F)CC2)CC1	ZINC000875057065	GG	On-Demand	Anodyne	DRD4	21	53
Cc1ccccc1CN1CCC(NC(=O)N2CCO[C@H](C(F)(F)F)CC2)CC1	ZINC000875057065	GG	On-Demand	Anodyne	SIGMAR1	17	43
Cc1ccccc1CN1CCC(NC(=O)N2CCO[C@H](C(F)(F)F)CC2)CC1	ZINC000875057065	GG	On-Demand	Anodyne	MCHR1	35	42
Cc1nnc(NNC(=O)NCc2ccc(CN3CCC(C)CC3)cc2)n1C	ZINC000875057068	FE	On-Demand	Reactive	SIGMAR1	19	44
Cc1cncc([C@@H]2CCCN2C(=O)NC2CCN(CCN(C)C)CC2)c1	ZINC000875057078	FE	On-Demand	Anodyne	SSTR5	31	41
COC(=O)N(C)NC(=O)NCc1ccc(CN2CCCC[C@@H]2C)cc1	ZINC000875057081	EE	On-Demand	Reactive	HRH3	25	43
COC(=O)N(C)NC(=O)NCc1ccc(CN2CCCC[C@H]2C)cc1	ZINC000875057082	EE	On-Demand	Reactive	HRH3	25	43
Cc1cncc([C@H]2CCCN2C(=O)NC2CCN(CCN(C)C)CC2)c1	ZINC000875057085	FE	On-Demand	Anodyne	SSTR5	31	41
C[C@@H](NC(=O)NC1CCN(CCN(C)C)CC1)c1ccns1	ZINC000875057087	ED	On-Demand	Anodyne	SLC6A5	16	42
C[C@H](NC(=O)NC1CCN(CCN(C)C)CC1)c1ccns1	ZINC000875057089	ED	On-Demand	Anodyne	SLC6A5	16	42
Cc1ccccc1CN1CCC(NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CC1	ZINC000875057093	GE	On-Demand	Anodyne	CHRM1	19	41
Cc1ccccc1CN1CCC(NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CC1	ZINC000875057093	GE	On-Demand	Anodyne	DRD4	29	59
Cc1ccccc1CN1CCC(NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CC1	ZINC000875057093	GE	On-Demand	Anodyne	ACHE	17	48
Cc1ccccc1CN1CCC(NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CC1	ZINC000875057093	GE	On-Demand	Anodyne	CHRM3	21	57
Cc1ccccc1CN1CCC(NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CC1	ZINC000875057093	GE	On-Demand	Anodyne	SIGMAR1	25	47
Cc1ccccc1CN1CCC(NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CC1	ZINC000875057093	GE	On-Demand	Anodyne	SSTR5	28	40
Cc1ccccc1CN1CCC(NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CC1	ZINC000875057093	GE	On-Demand	Anodyne	CCR3	33	40
Cc1ccccc1CN1CCC(NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CC1	ZINC000875057093	GE	On-Demand	Anodyne	CCR2	15	49
Cc1ccccc1CN1CCC(NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CC1	ZINC000875057093	GE	On-Demand	Anodyne	EPHX2	30	42
Cc1ccccc1CN1CCC(NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CC1	ZINC000875057093	GE	On-Demand	Anodyne	MCHR1	28	41
Cc1ccccc1CN1CCC(NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CC1	ZINC000875057093	GE	On-Demand	Anodyne	CCR8	63	34
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cccc(OC)c1	ZINC000875057098	ED	On-Demand	Anodyne	DRD4	41	32
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cccc(OC)c1	ZINC000875057098	ED	On-Demand	Anodyne	SLC6A4	25	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cccc(OC)c1	ZINC000875057098	ED	On-Demand	Anodyne	SLC6A3	46	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cccc(OC)c1	ZINC000875057098	ED	On-Demand	Anodyne	MTNR1A	79	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cccc(OC)c1	ZINC000875057098	ED	On-Demand	Anodyne	MTNR1B	70	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cccc(OC)c1	ZINC000875057100	ED	On-Demand	Anodyne	DRD4	41	32
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cccc(OC)c1	ZINC000875057100	ED	On-Demand	Anodyne	SLC6A4	25	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cccc(OC)c1	ZINC000875057100	ED	On-Demand	Anodyne	SLC6A3	46	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cccc(OC)c1	ZINC000875057100	ED	On-Demand	Anodyne	MTNR1A	79	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cccc(OC)c1	ZINC000875057100	ED	On-Demand	Anodyne	MTNR1B	70	46
CC(=O)C1CCN(C(=O)NCc2ccc(OCc3cccc(F)c3)cc2)CC1	ZINC000875057102	GH	On-Demand	Anodyne	MAOB	26	52
CC(=O)C1CCN(C(=O)NCc2ccc(OCc3cccc(F)c3)cc2)CC1	ZINC000875057102	GH	On-Demand	Anodyne	GRIN2B	24	46
CC(=O)C1CCN(C(=O)NCc2ccc(OCc3cccc(F)c3)cc2)CC1	ZINC000875057102	GH	On-Demand	Anodyne	HRH3	15	46
CC(=O)C1CCN(C(=O)NCc2ccc(OCc3cccc(F)c3)cc2)CC1	ZINC000875057102	GH	On-Demand	Anodyne	MMP13	16	41
CC(=O)C1CCN(C(=O)NCc2ccc(OCc3cccc(F)c3)cc2)CC1	ZINC000875057102	GH	On-Demand	Anodyne	ADAM17	30	45
CC(=O)C1CCN(C(=O)NCc2ccc(OCc3cccc(F)c3)cc2)CC1	ZINC000875057102	GH	On-Demand	Anodyne	GYS1	61	36
CC(=O)C1CCN(C(=O)NCc2ccc(OCc3cccc(F)c3)cc2)CC1	ZINC000875057102	GH	On-Demand	Anodyne	FFAR1	40	34
O=C(NC1CCN(Cc2ccccn2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875057107	FE	On-Demand	Anodyne	DRD4	15	53
O=C(NCc1ccc(OCc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875057121	GF	On-Demand	Anodyne	MAOB	19	47
O=C(NCc1ccc(OCc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875057121	GF	On-Demand	Anodyne	LTA4H	38	42
O=C(NCc1ccc(OCc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875057121	GF	On-Demand	Anodyne	MMP13	18	44
O=C(NCc1ccc(OCc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875057121	GF	On-Demand	Anodyne	ADAM17	51	44
O=C(NCc1ccc(OCc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875057121	GF	On-Demand	Anodyne	FAAH	16	42
O=C(NCc1ccc(OCc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875057121	GF	On-Demand	Anodyne	EPHX2	19	41
O=C(NCc1ccc(OCc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875057121	GF	On-Demand	Anodyne	DPP7	15	47
O=C(NCc1ccc(OCc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875057121	GF	On-Demand	Anodyne	FFAR1	36	44
O=C(NCc1ccc(OCc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875057121	GF	On-Demand	Anodyne	NPSR1	25	40
O=C(NCc1ccc(OCc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875057121	GF	On-Demand	Anodyne	SLC12A5	46	34
O=C(NCc1ccc(OCc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875057121	GF	On-Demand	Anodyne	NAMPT	19	43
O=C(NCc1ccc(OCc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875057121	GF	On-Demand	Anodyne	PDS	47	36
CC[C@@H]1COCCN1CCNC(=O)NCCc1cccc(OC)c1	ZINC000875057129	ED	On-Demand	Anodyne	DRD4	47	37
CC[C@@H]1COCCN1CCNC(=O)NCCc1cccc(OC)c1	ZINC000875057129	ED	On-Demand	Anodyne	MTNR1A	79	44
CC[C@@H]1COCCN1CCNC(=O)NCCc1cccc(OC)c1	ZINC000875057129	ED	On-Demand	Anodyne	MTNR1B	71	44
COc1ccccc1[C@@H]1CN(C(=O)NC2CCN(CCN(C)C)CC2)CCO1	ZINC000875057165	GD	On-Demand	Anodyne	HTR1A	33	40
COc1ccccc1[C@@H]1CN(C(=O)NC2CCN(CCN(C)C)CC2)CCO1	ZINC000875057165	GD	On-Demand	Anodyne	DRD2	34	42
COc1ccccc1[C@@H]1CN(C(=O)NC2CCN(CCN(C)C)CC2)CCO1	ZINC000875057165	GD	On-Demand	Anodyne	DRD4	35	41
COc1ccccc1[C@@H]1CN(C(=O)NC2CCN(CCN(C)C)CC2)CCO1	ZINC000875057165	GD	On-Demand	Anodyne	MCHR1	19	40
COc1ccccc1[C@H]1CN(C(=O)NC2CCN(CCN(C)C)CC2)CCO1	ZINC000875057166	GD	On-Demand	Anodyne	HTR1A	33	40
COc1ccccc1[C@H]1CN(C(=O)NC2CCN(CCN(C)C)CC2)CCO1	ZINC000875057166	GD	On-Demand	Anodyne	DRD2	34	42
COc1ccccc1[C@H]1CN(C(=O)NC2CCN(CCN(C)C)CC2)CCO1	ZINC000875057166	GD	On-Demand	Anodyne	DRD4	35	41
COc1ccccc1[C@H]1CN(C(=O)NC2CCN(CCN(C)C)CC2)CCO1	ZINC000875057166	GD	On-Demand	Anodyne	MCHR1	19	40
CC[C@H](NC(=O)c1c(C(F)(F)F)coc1C)c1ccc(OC)cc1	ZINC000875057167	EI	On-Demand	Anodyne	TACR3	48	42
COC(=O)C1=NO[C@]2(CCN(C(=O)NCCc3cccc(OC)c3)C2)C1	ZINC000875057170	FD	On-Demand	Anodyne	DRD4	42	32
COC(=O)C1=NO[C@]2(CCN(C(=O)NCCc3cccc(OC)c3)C2)C1	ZINC000875057170	FD	On-Demand	Anodyne	MTNR1A	39	41
COC(=O)C1=NO[C@]2(CCN(C(=O)NCCc3cccc(OC)c3)C2)C1	ZINC000875057170	FD	On-Demand	Anodyne	MTNR1B	36	41
COC(=O)C1=NO[C@@]2(CCN(C(=O)NCCc3cccc(OC)c3)C2)C1	ZINC000875057171	FD	On-Demand	Anodyne	DRD4	42	32
COC(=O)C1=NO[C@@]2(CCN(C(=O)NCCc3cccc(OC)c3)C2)C1	ZINC000875057171	FD	On-Demand	Anodyne	MTNR1A	39	41
COC(=O)C1=NO[C@@]2(CCN(C(=O)NCCc3cccc(OC)c3)C2)C1	ZINC000875057171	FD	On-Demand	Anodyne	MTNR1B	36	41
Cc1ccccc1CN1CCC(NC(=O)NNc2nnc(C)n2C)CC1	ZINC000875057177	FD	On-Demand	Reactive	DRD4	15	52
Cc1ccccc1CN1CCC(NC(=O)NNc2nnc(C)n2C)CC1	ZINC000875057177	FD	On-Demand	Reactive	SIGMAR1	18	44
Cc1ccccc1CN1CCC(NC(=O)NNc2nnc(C)n2C)CC1	ZINC000875057177	FD	On-Demand	Reactive	CCR8	46	32
CCOCc1ccc(CNC(=O)C(=O)NC[C@H]2c3ccccc3CN2C)cc1	ZINC000875057180	GE	On-Demand	Anodyne	ADAM9	41	31
CCOCc1ccc(CNC(=O)C(=O)NC[C@@H]2c3ccccc3CN2C)cc1	ZINC000875057181	GE	On-Demand	Anodyne	ADAM9	41	31
CCOC(=O)c1cc(CNC(=O)NC2CCN(CCN(C)C)CC2)on1	ZINC000875057188	FC	On-Demand	Anodyne	HTR4	47	35
Cc1ccccc1CN1CCC(NC(=O)N2CCC(CO)(CO)CC2)CC1	ZINC000875057189	GD	On-Demand	Anodyne	DRD4	26	56
Cc1ccccc1CN1CCC(NC(=O)N2CCC(CO)(CO)CC2)CC1	ZINC000875057189	GD	On-Demand	Anodyne	CHRM3	16	54
Cc1ccccc1CN1CCC(NC(=O)N2CCC(CO)(CO)CC2)CC1	ZINC000875057189	GD	On-Demand	Anodyne	SIGMAR1	26	47
Cc1ccccc1CN1CCC(NC(=O)N2CCC(CO)(CO)CC2)CC1	ZINC000875057189	GD	On-Demand	Anodyne	CCR3	33	45
Cc1ccccc1CN1CCC(NC(=O)N2CCC(CO)(CO)CC2)CC1	ZINC000875057189	GD	On-Demand	Anodyne	EPHX2	26	40
Cc1ccccc1CN1CCC(NC(=O)N2CCC(CO)(CO)CC2)CC1	ZINC000875057189	GD	On-Demand	Anodyne	MCHR1	25	45
Cc1ccccc1CN1CCC(NC(=O)N2CCC(CO)(CO)CC2)CC1	ZINC000875057189	GD	On-Demand	Anodyne	CCR8	61	38
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875057199	ED	On-Demand	Reactive	DRD4	31	59
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875057199	ED	On-Demand	Reactive	ACHE	15	50
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875057199	ED	On-Demand	Reactive	HTR4	15	41
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875057199	ED	On-Demand	Reactive	CHRM3	17	54
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875057199	ED	On-Demand	Reactive	SIGMAR1	29	49
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875057199	ED	On-Demand	Reactive	SSTR5	40	40
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875057199	ED	On-Demand	Reactive	CCR3	39	42
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875057199	ED	On-Demand	Reactive	EPHX2	24	42
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875057199	ED	On-Demand	Reactive	CXCR3	16	40
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875057199	ED	On-Demand	Reactive	MCHR1	39	44
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000875057199	ED	On-Demand	Reactive	CCR8	31	42
CC[C@@H]1COCCN1CCNC(=O)NC1CCN(C(=O)C(C)C)CC1	ZINC000875057239	FD	On-Demand	Anodyne	EPHX2	18	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057244	GE	On-Demand	Anodyne	DRD2	24	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057244	GE	On-Demand	Anodyne	DRD4	31	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057244	GE	On-Demand	Anodyne	HTR2A	19	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057244	GE	On-Demand	Anodyne	SLC6A4	37	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057244	GE	On-Demand	Anodyne	OPRM1	18	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057244	GE	On-Demand	Anodyne	SLC6A3	76	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057244	GE	On-Demand	Anodyne	HTR4	45	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057244	GE	On-Demand	Anodyne	LTA4H	28	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057244	GE	On-Demand	Anodyne	SIGMAR1	54	57
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057244	GE	On-Demand	Anodyne	SSTR5	41	36
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057244	GE	On-Demand	Anodyne	MCHR1	19	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057244	GE	On-Demand	Anodyne	BIRC2	53	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057244	GE	On-Demand	Anodyne	ACHP_LYMST	21	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057244	GE	On-Demand	Anodyne	Q8WSF8_APLCA	19	40
O=C(NC1CCN(CCc2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875057246	FG	On-Demand	Clean	HTR1A	16	40
O=C(NC1CCN(CCc2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875057246	FG	On-Demand	Clean	CHRM1	18	42
O=C(NC1CCN(CCc2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875057246	FG	On-Demand	Clean	DRD2	26	44
O=C(NC1CCN(CCc2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875057246	FG	On-Demand	Clean	DRD4	31	57
O=C(NC1CCN(CCc2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875057246	FG	On-Demand	Clean	HTR2A	24	57
O=C(NC1CCN(CCc2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875057246	FG	On-Demand	Clean	OPRM1	22	44
O=C(NC1CCN(CCc2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875057246	FG	On-Demand	Clean	DRD3	18	41
O=C(NC1CCN(CCc2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875057246	FG	On-Demand	Clean	OPRD1	16	44
O=C(NC1CCN(CCc2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875057246	FG	On-Demand	Clean	LTA4H	15	41
O=C(NC1CCN(CCc2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875057246	FG	On-Demand	Clean	SIGMAR1	55	60
O=C(NC1CCN(CCc2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875057246	FG	On-Demand	Clean	CCR3	28	43
O=C(NC1CCN(CCc2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875057246	FG	On-Demand	Clean	EPHX2	20	40
O=C(NC1CCN(CCc2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875057246	FG	On-Demand	Clean	MCHR1	21	40
O=C(NC1CCN(CCc2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875057246	FG	On-Demand	Clean	CACNA1G	24	41
O=C(NC1CCN(CCc2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875057246	FG	On-Demand	Clean	CYP2J2	44	32
O=C(NC1CCN(CCc2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875057246	FG	On-Demand	Clean	BIRC2	30	41
CN1CC[C@H]2CN(C(=O)NC3CCN(C(=O)c4ccccc4F)CC3)CC[C@H]21	ZINC000875057271	GE	On-Demand	Anodyne	CCR8	49	32
CN1CC[C@H]2CN(C(=O)NC3CCN(C(=O)c4ccccc4F)CC3)CC[C@@H]21	ZINC000875057272	GE	On-Demand	Anodyne	CCR8	49	32
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875057275	GH	On-Demand	Anodyne	F7	15	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875057275	GH	On-Demand	Anodyne	KCNK3	120	43
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875057275	GH	On-Demand	Anodyne	KCNK9	76	43
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875057278	GH	On-Demand	Anodyne	F7	15	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875057278	GH	On-Demand	Anodyne	KCNK3	120	43
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875057278	GH	On-Demand	Anodyne	KCNK9	76	43
O=C(NCC[C@H](O)C1CCCC1)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875057281	GF	On-Demand	Anodyne	EPHX2	37	56
O=C(NCC[C@@H](O)C1CCCC1)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875057282	GF	On-Demand	Anodyne	EPHX2	37	56
CC(=O)N(C)c1ccc(CNC(=O)NC2CCN(CCN(C)C)CC2)cc1	ZINC000875057290	GD	On-Demand	Anodyne	CCR5	15	49
CC(=O)N(C)c1ccc(CNC(=O)NC2CCN(CCN(C)C)CC2)cc1	ZINC000875057290	GD	On-Demand	Anodyne	SLC6A5	26	47
CC(=O)N(C)c1ccc(CNC(=O)NC2CCN(CCN(C)C)CC2)cc1	ZINC000875057290	GD	On-Demand	Anodyne	MCHR1	16	48
C[C@H](NC(=O)NC1CCN(C(=O)c2ccccc2F)CC1)[C@@]12CCCC[C@@H]1C2	ZINC000875057295	GH	On-Demand	Anodyne	EPHX2	31	43
C[C@H](NC(=O)NC1CCN(C(=O)c2ccccc2F)CC1)[C@]12CCCC[C@H]1C2	ZINC000875057296	GH	On-Demand	Anodyne	EPHX2	31	43
C[C@H](NC(=O)NC1CCN(C(=O)c2ccccc2F)CC1)[C@@]12CCCC[C@H]1C2	ZINC000875057297	GH	On-Demand	Anodyne	EPHX2	31	43
C[C@H](NC(=O)NC1CCN(C(=O)c2ccccc2F)CC1)[C@]12CCCC[C@@H]1C2	ZINC000875057298	GH	On-Demand	Anodyne	EPHX2	31	43
C#CC[C@@H](COC)NC(=O)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875057310	FD	On-Demand	Mild	EPHX2	30	43
C#CC[C@H](COC)NC(=O)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875057311	FD	On-Demand	Mild	EPHX2	30	43
O=C(NCc1ccc(OCc2ccccc2)cc1)NC[C@@H]1C[C@H](O)C1	ZINC000875057326	EF	On-Demand	Anodyne	MAOB	22	46
O=C(NCc1ccc(OCc2ccccc2)cc1)NC[C@@H]1C[C@H](O)C1	ZINC000875057326	EF	On-Demand	Anodyne	LTA4H	35	42
O=C(NCc1ccc(OCc2ccccc2)cc1)NC[C@@H]1C[C@H](O)C1	ZINC000875057326	EF	On-Demand	Anodyne	ADAM17	36	46
O=C(NCc1ccc(OCc2ccccc2)cc1)NC[C@@H]1C[C@H](O)C1	ZINC000875057326	EF	On-Demand	Anodyne	EPHX2	17	52
O=C(NCc1ccc(OCc2ccccc2)cc1)NC[C@@H]1C[C@H](O)C1	ZINC000875057326	EF	On-Demand	Anodyne	FFAR1	39	45
O=C(NCc1ccc(OCc2ccccc2)cc1)NC[C@@H]1C[C@H](O)C1	ZINC000875057326	EF	On-Demand	Anodyne	PDS	54	39
O=C(NCc1ccc(OCc2ccccc2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875057327	EF	On-Demand	Anodyne	MAOB	22	46
O=C(NCc1ccc(OCc2ccccc2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875057327	EF	On-Demand	Anodyne	LTA4H	35	42
O=C(NCc1ccc(OCc2ccccc2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875057327	EF	On-Demand	Anodyne	ADAM17	36	46
O=C(NCc1ccc(OCc2ccccc2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875057327	EF	On-Demand	Anodyne	EPHX2	17	52
O=C(NCc1ccc(OCc2ccccc2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875057327	EF	On-Demand	Anodyne	FFAR1	39	45
O=C(NCc1ccc(OCc2ccccc2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875057327	EF	On-Demand	Anodyne	PDS	54	39
O=C(NCc1ccc(OCc2ccccc2)cc1)NCC1CC(O)C1	ZINC000875057328	EF	On-Demand	Anodyne	MAOB	22	46
O=C(NCc1ccc(OCc2ccccc2)cc1)NCC1CC(O)C1	ZINC000875057328	EF	On-Demand	Anodyne	LTA4H	35	42
O=C(NCc1ccc(OCc2ccccc2)cc1)NCC1CC(O)C1	ZINC000875057328	EF	On-Demand	Anodyne	ADAM17	36	46
O=C(NCc1ccc(OCc2ccccc2)cc1)NCC1CC(O)C1	ZINC000875057328	EF	On-Demand	Anodyne	EPHX2	17	52
O=C(NCc1ccc(OCc2ccccc2)cc1)NCC1CC(O)C1	ZINC000875057328	EF	On-Demand	Anodyne	FFAR1	39	45
O=C(NCc1ccc(OCc2ccccc2)cc1)NCC1CC(O)C1	ZINC000875057328	EF	On-Demand	Anodyne	PDS	54	39
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@@H]1C[C@H](CO)C1	ZINC000875057343	EF	On-Demand	Anodyne	MAOB	22	48
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@@H]1C[C@H](CO)C1	ZINC000875057343	EF	On-Demand	Anodyne	LTA4H	37	43
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@@H]1C[C@H](CO)C1	ZINC000875057343	EF	On-Demand	Anodyne	ADAM17	32	46
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@@H]1C[C@H](CO)C1	ZINC000875057343	EF	On-Demand	Anodyne	SLC6A5	36	41
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@@H]1C[C@H](CO)C1	ZINC000875057343	EF	On-Demand	Anodyne	EPHX2	21	49
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@@H]1C[C@H](CO)C1	ZINC000875057343	EF	On-Demand	Anodyne	FFAR1	39	45
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@@H]1C[C@H](CO)C1	ZINC000875057343	EF	On-Demand	Anodyne	PDS	51	37
O=CN1CCCN(C(=O)NCc2ccc(OCc3cccc(F)c3)cc2)CC1	ZINC000875057365	GF	On-Demand	Anodyne	MAOB	17	48
O=CN1CCCN(C(=O)NCc2ccc(OCc3cccc(F)c3)cc2)CC1	ZINC000875057365	GF	On-Demand	Anodyne	DPP7	15	43
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@@H]1COCC[C@H]1O	ZINC000875057381	FE	On-Demand	Anodyne	MAOB	18	43
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@@H]1COCC[C@H]1O	ZINC000875057381	FE	On-Demand	Anodyne	LTA4H	27	40
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@@H]1COCC[C@H]1O	ZINC000875057381	FE	On-Demand	Anodyne	ADAM17	41	41
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@@H]1COCC[C@H]1O	ZINC000875057381	FE	On-Demand	Anodyne	FAAH	15	41
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@@H]1COCC[C@H]1O	ZINC000875057381	FE	On-Demand	Anodyne	EPHX2	16	47
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@@H]1COCC[C@H]1O	ZINC000875057381	FE	On-Demand	Anodyne	NAAA	25	45
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@@H]1COCC[C@H]1O	ZINC000875057381	FE	On-Demand	Anodyne	FFAR1	35	42
C[C@@H]1CCCCN1Cc1ccc(CNC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875057387	FE	On-Demand	Anodyne	HRH3	22	42
C[C@H]1CCCCN1Cc1ccc(CNC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875057388	FE	On-Demand	Anodyne	HRH3	22	42
O=C1N[C@H](C(=O)Nc2nc3c(C(F)(F)F)cccc3s2)CO1	ZINC000875057389	EE	On-Demand	Anodyne	TRPV1	18	41
CN(C)CCOc1ccc(CNC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875057390	FF	On-Demand	Clean	LTA4H	22	40
CN(C)CCOc1ccc(CNC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875057390	FF	On-Demand	Clean	ESRRG	47	35
CN(C)CCOc1ccc(CNC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875057390	FF	On-Demand	Clean	NAMPT	22	43
Cc1cc(OCC(=O)Nc2ncc(Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)s2)no1	ZINC000875057391	JK	On-Demand	Anodyne	SCD1	38	50
Cc1cc(OCC(=O)Nc2ncc(Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)s2)no1	ZINC000875057391	JK	On-Demand	Anodyne	SCD	37	50
CN(C)CCOc1ccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000875057394	GG	On-Demand	Anodyne	LTA4H	33	40
CN(C)CCOc1ccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000875057394	GG	On-Demand	Anodyne	HRH3	21	44
CN(C)CCOc1ccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000875057394	GG	On-Demand	Anodyne	EPHX2	20	41
CN(C)CCOc1ccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000875057395	GG	On-Demand	Anodyne	LTA4H	33	40
CN(C)CCOc1ccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000875057395	GG	On-Demand	Anodyne	HRH3	21	44
CN(C)CCOc1ccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000875057395	GG	On-Demand	Anodyne	EPHX2	20	41
COCC1CC(NC(=O)NC2CCN(C(=O)c3ccccc3F)CC2)C1	ZINC000875057429	FE	On-Demand	Anodyne	SIGMAR1	15	47
COCC1CC(NC(=O)NC2CCN(C(=O)c3ccccc3F)CC2)C1	ZINC000875057429	FE	On-Demand	Anodyne	EPHX2	52	52
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(CCc4ccccc4)CC3)C[C@@H]1C2	ZINC000875057441	GE	On-Demand	Anodyne	DRD2	23	45
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(CCc4ccccc4)CC3)C[C@@H]1C2	ZINC000875057441	GE	On-Demand	Anodyne	DRD4	30	50
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(CCc4ccccc4)CC3)C[C@@H]1C2	ZINC000875057441	GE	On-Demand	Anodyne	HTR2A	18	50
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(CCc4ccccc4)CC3)C[C@@H]1C2	ZINC000875057441	GE	On-Demand	Anodyne	OPRM1	19	47
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(CCc4ccccc4)CC3)C[C@@H]1C2	ZINC000875057441	GE	On-Demand	Anodyne	DRD3	15	45
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(CCc4ccccc4)CC3)C[C@@H]1C2	ZINC000875057441	GE	On-Demand	Anodyne	OPRD1	17	47
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(CCc4ccccc4)CC3)C[C@@H]1C2	ZINC000875057441	GE	On-Demand	Anodyne	SLC6A3	15	40
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(CCc4ccccc4)CC3)C[C@@H]1C2	ZINC000875057441	GE	On-Demand	Anodyne	LTA4H	23	46
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(CCc4ccccc4)CC3)C[C@@H]1C2	ZINC000875057441	GE	On-Demand	Anodyne	SIGMAR1	61	58
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(CCc4ccccc4)CC3)C[C@@H]1C2	ZINC000875057441	GE	On-Demand	Anodyne	EPHX2	41	48
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(CCc4ccccc4)CC3)C[C@@H]1C2	ZINC000875057441	GE	On-Demand	Anodyne	MCHR1	21	42
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(CCc4ccccc4)CC3)C[C@@H]1C2	ZINC000875057441	GE	On-Demand	Anodyne	CACNA1G	26	40
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(CCc4ccccc4)CC3)C[C@@H]1C2	ZINC000875057441	GE	On-Demand	Anodyne	BIRC2	44	41
CCC1(CC)CCCN1C(=O)NC1CCN(C(=O)C(C)C)CC1	ZINC000875057465	DF	On-Demand	Anodyne	EPHX2	17	46
CS(=O)(=O)Nc1ccc(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)cc1	ZINC000875057478	ED	On-Demand	Anodyne	TRPV1	19	53
CS(=O)(=O)Nc1ccc(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)cc1	ZINC000875057479	ED	On-Demand	Anodyne	TRPV1	19	53
CS(=O)(=O)Nc1ccc(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)cc1	ZINC000875057480	ED	On-Demand	Anodyne	TRPV1	19	53
CS(=O)(=O)Nc1ccc(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)cc1	ZINC000875057481	ED	On-Demand	Anodyne	TRPV1	19	53
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875057484	GF	On-Demand	Anodyne	NPY2R	41	36
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875057484	GF	On-Demand	Anodyne	PRNP	52	37
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875057484	GF	On-Demand	Anodyne	TAAR1	30	40
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875057484	GF	On-Demand	Anodyne	KCNK3	106	40
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875057484	GF	On-Demand	Anodyne	KCNK9	64	40
CC(=O)C1CCN(C(=O)N[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)CC1	ZINC000875057492	GI	On-Demand	Anodyne	KCNQ2	44	31
CC(=O)C1CCN(C(=O)N[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)CC1	ZINC000875057492	GI	On-Demand	Anodyne	NPY2R	62	35
CC(=O)C1CCN(C(=O)N[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)CC1	ZINC000875057492	GI	On-Demand	Anodyne	PRNP	57	41
CC(=O)C1CCN(C(=O)N[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)CC1	ZINC000875057492	GI	On-Demand	Anodyne	TAAR1	30	41
CC(=O)C1CCN(C(=O)N[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)CC1	ZINC000875057492	GI	On-Demand	Anodyne	KCNK3	111	45
CC(=O)C1CCN(C(=O)N[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)CC1	ZINC000875057492	GI	On-Demand	Anodyne	KCNK9	65	41
CC(=O)C1CCN(C(=O)N[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)CC1	ZINC000875057493	GI	On-Demand	Anodyne	KCNQ2	44	31
CC(=O)C1CCN(C(=O)N[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)CC1	ZINC000875057493	GI	On-Demand	Anodyne	NPY2R	62	35
CC(=O)C1CCN(C(=O)N[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)CC1	ZINC000875057493	GI	On-Demand	Anodyne	PRNP	57	41
CC(=O)C1CCN(C(=O)N[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)CC1	ZINC000875057493	GI	On-Demand	Anodyne	TAAR1	30	41
CC(=O)C1CCN(C(=O)N[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)CC1	ZINC000875057493	GI	On-Demand	Anodyne	KCNK3	111	45
CC(=O)C1CCN(C(=O)N[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)CC1	ZINC000875057493	GI	On-Demand	Anodyne	KCNK9	65	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cccc(NC(C)=O)c1	ZINC000875057494	FE	On-Demand	Anodyne	SLC6A3	35	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cccc(NC(C)=O)c1	ZINC000875057495	FE	On-Demand	Anodyne	SLC6A3	35	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cccc(NC(C)=O)c1	ZINC000875057496	FE	On-Demand	Anodyne	SLC6A3	35	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cccc(NC(C)=O)c1	ZINC000875057497	FE	On-Demand	Anodyne	SLC6A3	35	41
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875057502	ED	On-Demand	Anodyne	EPHX2	45	44
O=C(NCC[C@H]1CCSC1)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875057513	GF	On-Demand	Anodyne	EPHX2	27	40
O=C(NCC[C@H]1CCSC1)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875057513	GF	On-Demand	Anodyne	SCD1	16	43
O=C(NCC[C@H]1CCSC1)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875057513	GF	On-Demand	Anodyne	SCD	15	43
O=C(NCC[C@@H]1CCSC1)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875057514	GF	On-Demand	Anodyne	EPHX2	27	40
O=C(NCC[C@@H]1CCSC1)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875057514	GF	On-Demand	Anodyne	SCD1	16	43
O=C(NCC[C@@H]1CCSC1)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875057514	GF	On-Demand	Anodyne	SCD	15	43
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875057521	FE	On-Demand	Anodyne	EPHX2	34	41
O=C(NCCN1CC[C@H](O)C1)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057546	FE	On-Demand	Anodyne	HRH2	35	45
O=C(NCCN1CC[C@H](O)C1)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057546	FE	On-Demand	Anodyne	OPRK1	22	43
O=C(NCCN1CC[C@H](O)C1)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057546	FE	On-Demand	Anodyne	KCNH2	18	41
O=C(NCCN1CC[C@H](O)C1)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057546	FE	On-Demand	Anodyne	LTA4H	53	55
O=C(NCCN1CC[C@H](O)C1)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057546	FE	On-Demand	Anodyne	HRH3	20	42
O=C(NCCN1CC[C@H](O)C1)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057546	FE	On-Demand	Anodyne	SIGMAR1	34	43
O=C(NCCN1CC[C@H](O)C1)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057546	FE	On-Demand	Anodyne	CACNA1B	22	42
O=C(NCCN1CC[C@H](O)C1)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057546	FE	On-Demand	Anodyne	CCR3	37	48
O=C(NCCN1CC[C@H](O)C1)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057546	FE	On-Demand	Anodyne	CCR5	15	40
O=C(NCCN1CC[C@H](O)C1)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057546	FE	On-Demand	Anodyne	ADAM17	47	45
O=C(NCCN1CC[C@H](O)C1)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057546	FE	On-Demand	Anodyne	SLC6A5	38	45
O=C(NCCN1CC[C@H](O)C1)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057546	FE	On-Demand	Anodyne	EPHX2	15	48
O=C(NCCN1CC[C@H](O)C1)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057546	FE	On-Demand	Anodyne	MCHR1	29	45
O=C(NCCN1CC[C@H](O)C1)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057546	FE	On-Demand	Anodyne	SLC12A5	49	35
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057547	FE	On-Demand	Anodyne	HRH2	35	45
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057547	FE	On-Demand	Anodyne	OPRK1	22	43
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057547	FE	On-Demand	Anodyne	KCNH2	18	41
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057547	FE	On-Demand	Anodyne	LTA4H	53	55
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057547	FE	On-Demand	Anodyne	HRH3	20	42
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057547	FE	On-Demand	Anodyne	SIGMAR1	34	43
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057547	FE	On-Demand	Anodyne	CACNA1B	22	42
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057547	FE	On-Demand	Anodyne	CCR3	37	48
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057547	FE	On-Demand	Anodyne	CCR5	15	40
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057547	FE	On-Demand	Anodyne	ADAM17	47	45
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057547	FE	On-Demand	Anodyne	SLC6A5	38	45
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057547	FE	On-Demand	Anodyne	EPHX2	15	48
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057547	FE	On-Demand	Anodyne	MCHR1	29	45
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc(OCc2ccccc2)cc1	ZINC000875057547	FE	On-Demand	Anodyne	SLC12A5	49	35
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2cccc(OC)c2)C1	ZINC000875057551	EE	On-Demand	Anodyne	DRD4	42	33
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2cccc(OC)c2)C1	ZINC000875057551	EE	On-Demand	Anodyne	MTNR1A	86	47
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2cccc(OC)c2)C1	ZINC000875057551	EE	On-Demand	Anodyne	MTNR1B	78	47
C[C@H]1CN(Cc2ccc(CNC(=O)N3CC[C@@H](C(C)(C)O)C3)cc2)C[C@@H](C)O1	ZINC000875057553	GF	On-Demand	Anodyne	MLNR	53	38
C[C@@H]1CN(Cc2ccc(CNC(=O)N3CC[C@H](C(C)(C)O)C3)cc2)C[C@@H](C)O1	ZINC000875057554	GF	On-Demand	Anodyne	MLNR	53	38
C[C@@H]1CN(Cc2ccc(CNC(=O)N3CC[C@@H](C(C)(C)O)C3)cc2)C[C@@H](C)O1	ZINC000875057555	GF	On-Demand	Anodyne	MLNR	53	38
C[C@H]1CN(Cc2ccc(CNC(=O)N3CC[C@H](C(C)(C)O)C3)cc2)C[C@@H](C)O1	ZINC000875057556	GF	On-Demand	Anodyne	MLNR	53	38
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@H]1COC[C@H]1O	ZINC000875057557	ED	On-Demand	Anodyne	MAOB	22	45
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@H]1COC[C@H]1O	ZINC000875057557	ED	On-Demand	Anodyne	LTA4H	32	42
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@H]1COC[C@H]1O	ZINC000875057557	ED	On-Demand	Anodyne	ADAM17	35	43
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@H]1COC[C@H]1O	ZINC000875057557	ED	On-Demand	Anodyne	FAAH	16	40
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@H]1COC[C@H]1O	ZINC000875057557	ED	On-Demand	Anodyne	NAAA	28	47
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@H]1COC[C@H]1O	ZINC000875057557	ED	On-Demand	Anodyne	FFAR1	42	44
O=C(NCc1ccc(OCc2ccccc2)cc1)N[C@H]1COC[C@H]1O	ZINC000875057557	ED	On-Demand	Anodyne	PDS	47	36
COC(=O)N(C)NC(=O)NCc1ccc(CN2CCC[C@H](C)C2)cc1	ZINC000875057562	EE	On-Demand	Reactive	HRH3	15	42
COC(=O)N(C)NC(=O)NCc1ccc(CN2CCC[C@H](C)C2)cc1	ZINC000875057562	EE	On-Demand	Reactive	MLNR	42	33
COC(=O)N(C)NC(=O)NCc1ccc(CN2CCC[C@@H](C)C2)cc1	ZINC000875057563	EE	On-Demand	Reactive	HRH3	15	42
COC(=O)N(C)NC(=O)NCc1ccc(CN2CCC[C@@H](C)C2)cc1	ZINC000875057563	EE	On-Demand	Reactive	MLNR	42	33
O=C(NCc1ccc(OCc2ccccc2)cc1)NC[C@H](O)[C@@H]1CCCO1	ZINC000875057574	FF	On-Demand	Anodyne	ALOX5	18	40
O=C(NCc1ccc(OCc2ccccc2)cc1)NC[C@H](O)[C@@H]1CCCO1	ZINC000875057574	FF	On-Demand	Anodyne	MAOB	15	43
O=C(NCc1ccc(OCc2ccccc2)cc1)NC[C@H](O)[C@@H]1CCCO1	ZINC000875057574	FF	On-Demand	Anodyne	ADAM17	24	40
O=C(NCc1ccc(OCc2ccccc2)cc1)NC[C@@H](O)[C@@H]1CCCO1	ZINC000875057575	FF	On-Demand	Anodyne	ALOX5	18	40
O=C(NCc1ccc(OCc2ccccc2)cc1)NC[C@@H](O)[C@@H]1CCCO1	ZINC000875057575	FF	On-Demand	Anodyne	MAOB	15	43
O=C(NCc1ccc(OCc2ccccc2)cc1)NC[C@@H](O)[C@@H]1CCCO1	ZINC000875057575	FF	On-Demand	Anodyne	ADAM17	24	40
O=C(NCc1ccc(OCc2ccccc2)cc1)NC[C@H](O)[C@H]1CCCO1	ZINC000875057576	FF	On-Demand	Anodyne	ALOX5	18	40
O=C(NCc1ccc(OCc2ccccc2)cc1)NC[C@H](O)[C@H]1CCCO1	ZINC000875057576	FF	On-Demand	Anodyne	MAOB	15	43
O=C(NCc1ccc(OCc2ccccc2)cc1)NC[C@H](O)[C@H]1CCCO1	ZINC000875057576	FF	On-Demand	Anodyne	ADAM17	24	40
O=C(NCc1ccc(OCc2ccccc2)cc1)NC[C@@H](O)[C@H]1CCCO1	ZINC000875057577	FF	On-Demand	Anodyne	ALOX5	18	40
O=C(NCc1ccc(OCc2ccccc2)cc1)NC[C@@H](O)[C@H]1CCCO1	ZINC000875057577	FF	On-Demand	Anodyne	MAOB	15	43
O=C(NCc1ccc(OCc2ccccc2)cc1)NC[C@@H](O)[C@H]1CCCO1	ZINC000875057577	FF	On-Demand	Anodyne	ADAM17	24	40
COC(=O)C1(O)CN(C(=O)NCc2ccc(CN3CCN(C)CC3)cc2)C1	ZINC000875057583	GB	On-Demand	Anodyne	NAMPT	22	40
COC(=O)C1(O)CN(C(=O)NCc2ccc(CN3CCCC[C@@H]3C)cc2)C1	ZINC000875057604	GD	On-Demand	Anodyne	HRH3	30	42
COC(=O)C1(O)CN(C(=O)NCc2ccc(CN3CCCC[C@H]3C)cc2)C1	ZINC000875057605	GD	On-Demand	Anodyne	HRH3	30	42
C[C@H](NC(=O)NC1(C)CC(F)(F)C1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875057623	GI	On-Demand	Anodyne	PRNP	41	39
C[C@H](NC(=O)NC1(C)CC(F)(F)C1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875057623	GI	On-Demand	Anodyne	KCNK3	125	45
C[C@H](NC(=O)NC1(C)CC(F)(F)C1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875057623	GI	On-Demand	Anodyne	KCNK9	79	45
C[C@@H](NC(=O)NC1(C)CC(F)(F)C1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875057624	GI	On-Demand	Anodyne	PRNP	41	39
C[C@@H](NC(=O)NC1(C)CC(F)(F)C1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875057624	GI	On-Demand	Anodyne	KCNK3	125	45
C[C@@H](NC(=O)NC1(C)CC(F)(F)C1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000875057624	GI	On-Demand	Anodyne	KCNK9	79	45
O=C(NC1CCN(CCc2ccccc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875057630	GG	On-Demand	Anodyne	DRD2	23	43
O=C(NC1CCN(CCc2ccccc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875057630	GG	On-Demand	Anodyne	DRD4	30	52
O=C(NC1CCN(CCc2ccccc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875057630	GG	On-Demand	Anodyne	ACHE	21	43
O=C(NC1CCN(CCc2ccccc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875057630	GG	On-Demand	Anodyne	HTR2A	20	52
O=C(NC1CCN(CCc2ccccc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875057630	GG	On-Demand	Anodyne	SLC6A3	19	42
O=C(NC1CCN(CCc2ccccc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875057630	GG	On-Demand	Anodyne	SLC18A2	42	38
O=C(NC1CCN(CCc2ccccc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875057630	GG	On-Demand	Anodyne	LTA4H	23	43
O=C(NC1CCN(CCc2ccccc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875057630	GG	On-Demand	Anodyne	SIGMAR1	54	60
O=C(NC1CCN(CCc2ccccc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875057630	GG	On-Demand	Anodyne	BIRC2	44	45
CCOC(=O)C1=CC[C@H](NC(=O)NC2CCN(CCN(C)C)CC2)C1	ZINC000875057631	FC	On-Demand	Anodyne	SLC6A5	17	43
CC[C@@H]1COCCN1CCNC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057647	GE	On-Demand	Anodyne	DRD4	21	48
CC[C@@H]1COCCN1CCNC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057647	GE	On-Demand	Anodyne	SIGMAR1	37	52
CC[C@@H]1COCCN1CCNC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057647	GE	On-Demand	Anodyne	EPHX2	24	45
O=C(NC1CCN(C(=O)c2ccccc2F)CC1)N1Cc2cccc(O)c2C1	ZINC000875057648	GF	On-Demand	Clean	EPHX2	21	55
Cc1nnc(NNC(=O)NC2CCN(CCN(C)C)CC2)n1C	ZINC000875057653	DB	On-Demand	Reactive	SLC6A5	16	43
CSCC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)O[C@@H](C)c1ccc(F)cc1	ZINC000875057655	HH	On-Demand	Anodyne	MMP13	17	42
CSCC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)O[C@@H](C)c1ccc(F)cc1	ZINC000875057655	HH	On-Demand	Anodyne	MMP2	21	42
CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)O[C@H](C)c1ccc(F)cc1	ZINC000875057656	HH	On-Demand	Anodyne	MMP13	17	42
CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)O[C@H](C)c1ccc(F)cc1	ZINC000875057656	HH	On-Demand	Anodyne	MMP2	21	42
CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)O[C@@H](C)c1ccc(F)cc1	ZINC000875057657	HH	On-Demand	Anodyne	MMP13	17	42
CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)O[C@@H](C)c1ccc(F)cc1	ZINC000875057657	HH	On-Demand	Anodyne	MMP2	21	42
CSCC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)O[C@H](C)c1ccc(F)cc1	ZINC000875057658	HH	On-Demand	Anodyne	MMP13	17	42
CSCC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)O[C@H](C)c1ccc(F)cc1	ZINC000875057658	HH	On-Demand	Anodyne	MMP2	21	42
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(C(=O)C(C)C)CC2)C1	ZINC000875057669	FD	On-Demand	Anodyne	EPHX2	17	44
O=C(NC[C@@H]1C[C@H]2CCC[C@@H]2O1)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875057683	GF	On-Demand	Anodyne	EPHX2	26	40
O=C(NC[C@@H]1C[C@@H]2CCC[C@@H]2O1)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875057684	GF	On-Demand	Anodyne	EPHX2	26	40
O=C(NC[C@@H]1C[C@H]2CCC[C@H]2O1)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875057685	GF	On-Demand	Anodyne	EPHX2	26	40
O=C(NC[C@@H]1C[C@@H]2CCC[C@H]2O1)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000875057686	GF	On-Demand	Anodyne	EPHX2	26	40
O=CN1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)CC1	ZINC000875057692	GD	On-Demand	Anodyne	EPHX2	22	57
O=CN1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)CC1	ZINC000875057692	GD	On-Demand	Anodyne	L3MBTL3	36	40
COC(=O)N(C)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057693	ED	On-Demand	Reactive	CHRM1	28	42
COC(=O)N(C)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057693	ED	On-Demand	Reactive	DRD2	33	48
COC(=O)N(C)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057693	ED	On-Demand	Reactive	DRD4	40	56
COC(=O)N(C)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057693	ED	On-Demand	Reactive	ACHE	21	48
COC(=O)N(C)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057693	ED	On-Demand	Reactive	HTR2A	24	56
COC(=O)N(C)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057693	ED	On-Demand	Reactive	HRH1	15	41
COC(=O)N(C)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057693	ED	On-Demand	Reactive	OPRM1	23	48
COC(=O)N(C)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057693	ED	On-Demand	Reactive	DRD3	21	48
COC(=O)N(C)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057693	ED	On-Demand	Reactive	OPRD1	18	48
COC(=O)N(C)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057693	ED	On-Demand	Reactive	SLC6A3	18	40
COC(=O)N(C)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057693	ED	On-Demand	Reactive	HTR4	35	41
COC(=O)N(C)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057693	ED	On-Demand	Reactive	GRIN2B	42	38
COC(=O)N(C)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057693	ED	On-Demand	Reactive	LTA4H	30	47
COC(=O)N(C)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057693	ED	On-Demand	Reactive	SIGMAR1	74	63
COC(=O)N(C)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057693	ED	On-Demand	Reactive	CCR3	48	43
COC(=O)N(C)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057693	ED	On-Demand	Reactive	CCR5	42	44
COC(=O)N(C)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057693	ED	On-Demand	Reactive	EPHX2	35	43
COC(=O)N(C)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057693	ED	On-Demand	Reactive	MCHR1	40	45
COC(=O)N(C)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057693	ED	On-Demand	Reactive	CACNA1G	32	40
COC(=O)N(C)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057693	ED	On-Demand	Reactive	CCR8	15	41
COC(=O)N(C)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000875057693	ED	On-Demand	Reactive	BIRC2	43	44
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1	ZINC000875057696	GI	On-Demand	Anodyne	KCNQ2	43	30
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1	ZINC000875057696	GI	On-Demand	Anodyne	NPY2R	52	38
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1	ZINC000875057696	GI	On-Demand	Anodyne	PRNP	54	39
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1	ZINC000875057696	GI	On-Demand	Anodyne	PREP	30	42
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1	ZINC000875057696	GI	On-Demand	Anodyne	CCKBR	16	42
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1	ZINC000875057696	GI	On-Demand	Anodyne	TAAR1	29	41
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1	ZINC000875057696	GI	On-Demand	Anodyne	KCNK3	103	50
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1	ZINC000875057696	GI	On-Demand	Anodyne	KCNK9	58	39
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1	ZINC000875057697	GI	On-Demand	Anodyne	KCNQ2	43	30
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1	ZINC000875057697	GI	On-Demand	Anodyne	NPY2R	52	38
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1	ZINC000875057697	GI	On-Demand	Anodyne	PRNP	54	39
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1	ZINC000875057697	GI	On-Demand	Anodyne	PREP	30	42
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1	ZINC000875057697	GI	On-Demand	Anodyne	CCKBR	16	42
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1	ZINC000875057697	GI	On-Demand	Anodyne	TAAR1	29	41
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1	ZINC000875057697	GI	On-Demand	Anodyne	KCNK3	103	50
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1	ZINC000875057697	GI	On-Demand	Anodyne	KCNK9	58	39
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1	ZINC000875057698	GI	On-Demand	Anodyne	KCNQ2	43	30
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1	ZINC000875057698	GI	On-Demand	Anodyne	NPY2R	52	38
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1	ZINC000875057698	GI	On-Demand	Anodyne	PRNP	54	39
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1	ZINC000875057698	GI	On-Demand	Anodyne	PREP	30	42
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1	ZINC000875057698	GI	On-Demand	Anodyne	CCKBR	16	42
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1	ZINC000875057698	GI	On-Demand	Anodyne	TAAR1	29	41
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1	ZINC000875057698	GI	On-Demand	Anodyne	KCNK3	103	50
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1	ZINC000875057698	GI	On-Demand	Anodyne	KCNK9	58	39
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1	ZINC000875057699	GI	On-Demand	Anodyne	KCNQ2	43	30
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1	ZINC000875057699	GI	On-Demand	Anodyne	NPY2R	52	38
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1	ZINC000875057699	GI	On-Demand	Anodyne	PRNP	54	39
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1	ZINC000875057699	GI	On-Demand	Anodyne	PREP	30	42
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1	ZINC000875057699	GI	On-Demand	Anodyne	CCKBR	16	42
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1	ZINC000875057699	GI	On-Demand	Anodyne	TAAR1	29	41
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1	ZINC000875057699	GI	On-Demand	Anodyne	KCNK3	103	50
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)C1	ZINC000875057699	GI	On-Demand	Anodyne	KCNK9	58	39
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(CCc2ccccc2)CC1	ZINC000875057725	ED	On-Demand	Anodyne	CHRM1	17	40
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(CCc2ccccc2)CC1	ZINC000875057725	ED	On-Demand	Anodyne	DRD2	24	48
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(CCc2ccccc2)CC1	ZINC000875057725	ED	On-Demand	Anodyne	DRD4	29	54
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(CCc2ccccc2)CC1	ZINC000875057725	ED	On-Demand	Anodyne	ACHE	21	45
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(CCc2ccccc2)CC1	ZINC000875057725	ED	On-Demand	Anodyne	HTR2A	18	54
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(CCc2ccccc2)CC1	ZINC000875057725	ED	On-Demand	Anodyne	OPRM1	17	46
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(CCc2ccccc2)CC1	ZINC000875057725	ED	On-Demand	Anodyne	DRD3	17	48
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(CCc2ccccc2)CC1	ZINC000875057725	ED	On-Demand	Anodyne	HTR4	30	45
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(CCc2ccccc2)CC1	ZINC000875057725	ED	On-Demand	Anodyne	GRIN2B	42	38
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(CCc2ccccc2)CC1	ZINC000875057725	ED	On-Demand	Anodyne	LTA4H	18	42
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(CCc2ccccc2)CC1	ZINC000875057725	ED	On-Demand	Anodyne	SIGMAR1	60	63
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(CCc2ccccc2)CC1	ZINC000875057725	ED	On-Demand	Anodyne	CCR3	50	43
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(CCc2ccccc2)CC1	ZINC000875057725	ED	On-Demand	Anodyne	EPHX2	34	48
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(CCc2ccccc2)CC1	ZINC000875057725	ED	On-Demand	Anodyne	MCHR1	23	41
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(CCc2ccccc2)CC1	ZINC000875057725	ED	On-Demand	Anodyne	CACNA1G	23	40
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(CCc2ccccc2)CC1	ZINC000875057725	ED	On-Demand	Anodyne	BIRC2	30	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCCN(C)C)cc1	ZINC000875057732	GD	On-Demand	Anodyne	SLC6A4	21	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCCN(C)C)cc1	ZINC000875057732	GD	On-Demand	Anodyne	SLC6A3	41	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCCN(C)C)cc1	ZINC000875057732	GD	On-Demand	Anodyne	LTA4H	21	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCCN(C)C)cc1	ZINC000875057733	GD	On-Demand	Anodyne	SLC6A4	21	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCCN(C)C)cc1	ZINC000875057733	GD	On-Demand	Anodyne	SLC6A3	41	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCCN(C)C)cc1	ZINC000875057733	GD	On-Demand	Anodyne	LTA4H	21	42
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1CN(C)C(C)C	ZINC000875057758	EF	On-Demand	Anodyne	ANPEP	20	42
Cc1nnc(NNC(=O)NCc2ccccc2CN2CCC[C@H](C)C2)n1C	ZINC000875057775	FE	On-Demand	Reactive	SLC6A1	41	32
Cc1nnc(NNC(=O)NCc2ccccc2CN2CCC[C@@H](C)C2)n1C	ZINC000875057776	FE	On-Demand	Reactive	SLC6A1	41	32
CN(C)CCOc1ccc(CNC(=O)N2CCC3(CCN(C)CC3)CC2)cc1	ZINC000875057802	GF	On-Demand	Anodyne	LTA4H	25	40
C[C@@H]1CCCCN1Cc1ccc(CNC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875057809	GE	On-Demand	Anodyne	HRH3	22	43
C[C@H]1CCCCN1Cc1ccc(CNC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875057810	GE	On-Demand	Anodyne	HRH3	22	43
CS[C@@H]1C[C@@H](NC(=O)NC2CCN(C(=O)c3ccccc3F)CC2)C1	ZINC000875057833	FF	On-Demand	Anodyne	EPHX2	41	47
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OCCN(C)C)cc1	ZINC000875057861	ED	On-Demand	Anodyne	PDS	45	37
O=C(NCc1ccc(OCc2cccc(F)c2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875057871	FF	On-Demand	Anodyne	MAOB	26	52
O=C(NCc1ccc(OCc2cccc(F)c2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875057871	FF	On-Demand	Anodyne	ADAM17	19	47
O=C(NCc1ccc(OCc2cccc(F)c2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875057871	FF	On-Demand	Anodyne	GYS1	44	33
O=C(NCc1ccc(OCc2cccc(F)c2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875057871	FF	On-Demand	Anodyne	PDS	42	39
CN(C)CCOc1ccc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875057874	FE	On-Demand	Anodyne	HRH3	21	43
CN(C)CCOc1ccc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875057875	FE	On-Demand	Anodyne	HRH3	21	43
C[C@@H]1CCCCN1Cc1ccc(CNC(=O)NC[C@H]2C[C@H](O)C2)cc1	ZINC000875057879	EF	On-Demand	Anodyne	HRH3	27	44
C[C@H]1CCCCN1Cc1ccc(CNC(=O)NC[C@H]2C[C@H](O)C2)cc1	ZINC000875057880	EF	On-Demand	Anodyne	HRH3	27	44
O=CN1CCCN(C(=O)NCc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875057903	FF	On-Demand	Anodyne	MAOB	19	44
O=CN1CCCN(C(=O)NCc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875057903	FF	On-Demand	Anodyne	LTA4H	39	43
O=CN1CCCN(C(=O)NCc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875057903	FF	On-Demand	Anodyne	PREP	24	42
O=CN1CCCN(C(=O)NCc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875057903	FF	On-Demand	Anodyne	FAAH	15	45
O=CN1CCCN(C(=O)NCc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875057903	FF	On-Demand	Anodyne	DPP7	26	52
O=CN1CCCN(C(=O)NCc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875057903	FF	On-Demand	Anodyne	FFAR1	27	42
COC(=O)N(C)NC(=O)NCc1ccc(CN2CCC(C)CC2)cc1	ZINC000875057904	EE	On-Demand	Reactive	ACHE	18	44
COC(=O)N(C)NC(=O)NCc1ccc(CN2CCC(C)CC2)cc1	ZINC000875057904	EE	On-Demand	Reactive	SIGMAR1	31	45
COC(=O)N(C)NC(=O)NCc1ccc(CN2CCC(C)CC2)cc1	ZINC000875057904	EE	On-Demand	Reactive	MCHR1	33	46
O=C(NCc1ccc(OCc2ccccc2)cc1)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875057923	FG	On-Demand	Anodyne	MAOB	20	42
O=C(NCc1ccc(OCc2ccccc2)cc1)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875057923	FG	On-Demand	Anodyne	LTA4H	30	41
O=C(NCc1ccc(OCc2ccccc2)cc1)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875057923	FG	On-Demand	Anodyne	ADAM17	42	44
O=C(NCc1ccc(OCc2ccccc2)cc1)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875057923	FG	On-Demand	Anodyne	NAAA	18	44
O=C(NCc1ccc(OCc2ccccc2)cc1)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875057923	FG	On-Demand	Anodyne	FFAR1	23	40
O=C(NCc1ccc(OCc2ccccc2)cc1)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875057923	FG	On-Demand	Anodyne	PDS	49	35
O=C(NCc1ccc(OCc2ccccc2)cc1)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875057924	FG	On-Demand	Anodyne	MAOB	20	42
O=C(NCc1ccc(OCc2ccccc2)cc1)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875057924	FG	On-Demand	Anodyne	LTA4H	30	41
O=C(NCc1ccc(OCc2ccccc2)cc1)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875057924	FG	On-Demand	Anodyne	ADAM17	42	44
O=C(NCc1ccc(OCc2ccccc2)cc1)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875057924	FG	On-Demand	Anodyne	NAAA	18	44
O=C(NCc1ccc(OCc2ccccc2)cc1)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875057924	FG	On-Demand	Anodyne	FFAR1	23	40
O=C(NCc1ccc(OCc2ccccc2)cc1)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875057924	FG	On-Demand	Anodyne	PDS	49	35
COC(=O)N(C)NC(=O)NCc1ccc(OCCN(C)C)cc1	ZINC000875057938	DD	On-Demand	Reactive	LTA4H	20	45
COC(=O)N(C)NC(=O)NCc1ccc(OCCN(C)C)cc1	ZINC000875057938	DD	On-Demand	Reactive	ESRRG	45	34
CN(C)CCOc1ccc(CNC(=O)N2CCCCCCNC(=O)CC2)cc1	ZINC000875057953	GE	On-Demand	Anodyne	HRH3	20	49
Cc1nnc(NNC(=O)NCc2ccc(OCCN(C)C)cc2)n1C	ZINC000875057958	EC	On-Demand	Reactive	ESRRG	43	32
CN(C)CCOc1ccc(CNC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875057959	FC	On-Demand	Anodyne	LTA4H	26	42
CN(C)CCOc1ccc(CNC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875057959	FC	On-Demand	Anodyne	ESRRG	45	34
CCO[C@H]1COCC[C@@H]1CC(=O)Nc1nc2cc(OC)c(OC)cc2s1	ZINC000875057965	GG	On-Demand	Anodyne	CSNK1D	43	41
CCO[C@H]1COCC[C@H]1CC(=O)Nc1nc2cc(OC)c(OC)cc2s1	ZINC000875057967	GG	On-Demand	Anodyne	CSNK1D	43	41
O=C1OC[C@H]2CN(C(=O)NCc3ccc(OCc4cccc(F)c4)cc3)C[C@@H]12	ZINC000875057989	GF	On-Demand	Anodyne	MAOB	17	46
O=C1OC[C@H]2CN(C(=O)NCc3ccc(OCc4cccc(F)c4)cc3)C[C@@H]12	ZINC000875057989	GF	On-Demand	Anodyne	GYS1	51	33
O=C(NCc1ccc(OCc2ccccc2)cc1)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875057994	GG	On-Demand	Anodyne	MAOB	16	43
O=C(NCc1ccc(OCc2ccccc2)cc1)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875057994	GG	On-Demand	Anodyne	LTA4H	40	41
O=C(NCc1ccc(OCc2ccccc2)cc1)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875057994	GG	On-Demand	Anodyne	MMP13	15	45
O=C(NCc1ccc(OCc2ccccc2)cc1)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875057994	GG	On-Demand	Anodyne	ADAM17	54	40
O=C(NCc1ccc(OCc2ccccc2)cc1)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875057994	GG	On-Demand	Anodyne	SLC6A5	38	44
O=C(NCc1ccc(OCc2ccccc2)cc1)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875057994	GG	On-Demand	Anodyne	DPP7	25	48
O=C(NCc1ccc(OCc2ccccc2)cc1)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875057994	GG	On-Demand	Anodyne	FFAR1	24	40
O=C(NCc1ccc(OCc2ccccc2)cc1)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875057994	GG	On-Demand	Anodyne	NPSR1	28	43
O=C(NCc1ccc(OCc2ccccc2)cc1)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875057995	GG	On-Demand	Anodyne	MAOB	16	43
O=C(NCc1ccc(OCc2ccccc2)cc1)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875057995	GG	On-Demand	Anodyne	LTA4H	40	41
O=C(NCc1ccc(OCc2ccccc2)cc1)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875057995	GG	On-Demand	Anodyne	MMP13	15	45
O=C(NCc1ccc(OCc2ccccc2)cc1)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875057995	GG	On-Demand	Anodyne	ADAM17	54	40
O=C(NCc1ccc(OCc2ccccc2)cc1)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875057995	GG	On-Demand	Anodyne	SLC6A5	38	44
O=C(NCc1ccc(OCc2ccccc2)cc1)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875057995	GG	On-Demand	Anodyne	DPP7	25	48
O=C(NCc1ccc(OCc2ccccc2)cc1)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875057995	GG	On-Demand	Anodyne	FFAR1	24	40
O=C(NCc1ccc(OCc2ccccc2)cc1)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875057995	GG	On-Demand	Anodyne	NPSR1	28	43
CC[C@@H](NC(=O)NCCc1cccc(OC)c1)[C@@H](O)c1ccccc1	ZINC000875058002	EG	On-Demand	Anodyne	CTSD	17	40
CC[C@@H](NC(=O)NCCc1cccc(OC)c1)[C@@H](O)c1ccccc1	ZINC000875058002	EG	On-Demand	Anodyne	CTSB	16	48
CC[C@@H](NC(=O)NCCc1cccc(OC)c1)[C@@H](O)c1ccccc1	ZINC000875058002	EG	On-Demand	Anodyne	MTNR1A	98	51
CC[C@@H](NC(=O)NCCc1cccc(OC)c1)[C@@H](O)c1ccccc1	ZINC000875058002	EG	On-Demand	Anodyne	MTNR1B	89	51
CC[C@@H](NC(=O)NCCc1cccc(OC)c1)[C@@H](O)c1ccccc1	ZINC000875058002	EG	On-Demand	Anodyne	CAPN1	16	48
CC[C@@H](NC(=O)NCCc1cccc(OC)c1)[C@@H](O)c1ccccc1	ZINC000875058002	EG	On-Demand	Anodyne	CAPN2	30	48
CC[C@@H](NC(=O)NCCc1cccc(OC)c1)[C@@H](O)c1ccccc1	ZINC000875058002	EG	On-Demand	Anodyne	BACE1	19	42
CC[C@@H](NC(=O)NCCc1cccc(OC)c1)[C@@H](O)c1ccccc1	ZINC000875058002	EG	On-Demand	Anodyne	PLM1_PLAFA	21	45
CC[C@@H](NC(=O)NCCc1cccc(OC)c1)[C@@H](O)c1ccccc1	ZINC000875058002	EG	On-Demand	Anodyne	PLM2_PLAFA	26	45
CC[C@@H](NC(=O)NCCc1cccc(OC)c1)[C@@H](O)c1ccccc1	ZINC000875058002	EG	On-Demand	Anodyne	CRTM	46	36
CC[C@@H](NC(=O)NCCc1cccc(OC)c1)[C@@H](O)c1ccccc1	ZINC000875058002	EG	On-Demand	Anodyne	PDS	69	43
CC[C@@H](NC(=O)NCCc1cccc(OC)c1)[C@H](O)c1ccccc1	ZINC000875058005	EG	On-Demand	Anodyne	CTSD	17	40
CC[C@@H](NC(=O)NCCc1cccc(OC)c1)[C@H](O)c1ccccc1	ZINC000875058005	EG	On-Demand	Anodyne	CTSB	16	48
CC[C@@H](NC(=O)NCCc1cccc(OC)c1)[C@H](O)c1ccccc1	ZINC000875058005	EG	On-Demand	Anodyne	MTNR1A	98	51
CC[C@@H](NC(=O)NCCc1cccc(OC)c1)[C@H](O)c1ccccc1	ZINC000875058005	EG	On-Demand	Anodyne	MTNR1B	89	51
CC[C@@H](NC(=O)NCCc1cccc(OC)c1)[C@H](O)c1ccccc1	ZINC000875058005	EG	On-Demand	Anodyne	CAPN1	16	48
CC[C@@H](NC(=O)NCCc1cccc(OC)c1)[C@H](O)c1ccccc1	ZINC000875058005	EG	On-Demand	Anodyne	CAPN2	30	48
CC[C@@H](NC(=O)NCCc1cccc(OC)c1)[C@H](O)c1ccccc1	ZINC000875058005	EG	On-Demand	Anodyne	BACE1	19	42
CC[C@@H](NC(=O)NCCc1cccc(OC)c1)[C@H](O)c1ccccc1	ZINC000875058005	EG	On-Demand	Anodyne	PLM1_PLAFA	21	45
CC[C@@H](NC(=O)NCCc1cccc(OC)c1)[C@H](O)c1ccccc1	ZINC000875058005	EG	On-Demand	Anodyne	PLM2_PLAFA	26	45
CC[C@@H](NC(=O)NCCc1cccc(OC)c1)[C@H](O)c1ccccc1	ZINC000875058005	EG	On-Demand	Anodyne	CRTM	46	36
CC[C@@H](NC(=O)NCCc1cccc(OC)c1)[C@H](O)c1ccccc1	ZINC000875058005	EG	On-Demand	Anodyne	PDS	69	43
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NCCN2CCc3ccccc3C2)CC1	ZINC000875058006	GB	On-Demand	Anodyne	NOD2	40	33
Cc1nnc(NNC(=O)NCc2cccc(OCCN(C)C)c2)n1C	ZINC000875058008	EC	On-Demand	Reactive	ROCK2	26	45
CN(C)CCOc1cccc(CNC(=O)NC2(C)CC(F)(F)C2)c1	ZINC000875058017	EF	On-Demand	Anodyne	HRH2	25	40
CN(C)CCOc1cccc(CNC(=O)NC2(C)CC(F)(F)C2)c1	ZINC000875058017	EF	On-Demand	Anodyne	ROCK2	21	44
CN(C)CCOc1cccc(CNC(=O)NC2(C)CC(F)(F)C2)c1	ZINC000875058017	EF	On-Demand	Anodyne	PDS	47	36
CN1CCN(C2CCN(C(=O)C(=O)NCc3ccc(N(C)C)nc3)CC2)CC1	ZINC000875058025	GC	On-Demand	Anodyne	L3MBTL3	48	38
O=C(NCCN1CCc2ccccc2C1)C(=O)NCc1cccc2ncccc12	ZINC000875058029	GE	On-Demand	Anodyne	HTR1A	18	48
O=C(NCCN1CCc2ccccc2C1)C(=O)NCc1cccc2ncccc12	ZINC000875058029	GE	On-Demand	Anodyne	HTR7	29	48
O=C(NCCN1CCc2ccccc2C1)C(=O)NCc1cccc2ncccc12	ZINC000875058029	GE	On-Demand	Anodyne	HNMT	60	36
COC(=O)C1(O)CN(C(=O)NCc2cccc(OCC(F)(F)F)c2)C1	ZINC000875058033	FD	On-Demand	Anodyne	PDS	65	38
CN(C)CCOc1cccc(CNC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875058034	DD	On-Demand	Anodyne	HRH2	25	42
CN(C)CCOc1cccc(CNC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875058034	DD	On-Demand	Anodyne	ROCK2	20	44
CN(C)CCOc1cccc(CNC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875058034	DD	On-Demand	Anodyne	PDS	56	34
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccc(OCCN(C)C)c2)C1	ZINC000875058044	GD	On-Demand	Anodyne	PDS	50	36
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058054	GD	On-Demand	Anodyne	HTR1A	18	43
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058054	GD	On-Demand	Anodyne	DRD4	40	31
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058054	GD	On-Demand	Anodyne	DRD3	20	52
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058054	GD	On-Demand	Anodyne	HTR7	24	43
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058054	GD	On-Demand	Anodyne	NOD2	43	36
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058055	GD	On-Demand	Anodyne	HTR1A	18	43
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058055	GD	On-Demand	Anodyne	DRD4	40	31
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058055	GD	On-Demand	Anodyne	DRD3	20	52
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058055	GD	On-Demand	Anodyne	HTR7	24	43
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058055	GD	On-Demand	Anodyne	NOD2	43	36
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(OCc2ccccn2)c1	ZINC000875058071	FG	On-Demand	Anodyne	ANPEP	15	44
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(OCc2ccccn2)c1	ZINC000875058071	FG	On-Demand	Anodyne	ROCK2	20	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(OCc2ccccn2)c1	ZINC000875058071	FG	On-Demand	Anodyne	CAPN2	32	40
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(OCc2ccccn2)c1	ZINC000875058071	FG	On-Demand	Anodyne	PDS	92	40
CN(C)CCOc1cccc(CNC(=O)N2CCCCCCNC(=O)CC2)c1	ZINC000875058088	GE	On-Demand	Anodyne	HRH2	35	43
COC(=O)N(C)NC(=O)NCc1cccc(OCC(F)(F)F)c1	ZINC000875058098	EE	On-Demand	Reactive	ROCK1	21	40
COC(=O)N(C)NC(=O)NCc1cccc(OCC(F)(F)F)c1	ZINC000875058098	EE	On-Demand	Reactive	ROCK2	29	40
COC(=O)N(C)NC(=O)NCc1cccc(OCC(F)(F)F)c1	ZINC000875058098	EE	On-Demand	Reactive	PDS	79	40
O=C(NCc1cccc(OCC(F)(F)F)c1)N1Cc2cccc(O)c2C1	ZINC000875058112	FH	On-Demand	Clean	NAMPT	21	41
O=C(NCc1cccc(OCC(F)(F)F)c1)N1Cc2cccc(O)c2C1	ZINC000875058112	FH	On-Demand	Clean	PDS	48	38
CN1CC[C@H]2CN(C(=O)C(=O)NCCNC(=O)c3cccnc3)CC[C@@H]21	ZINC000875058117	FB	On-Demand	Anodyne	CHRNA7	40	37
CN1CC[C@H]2CN(C(=O)C(=O)NCCNC(=O)c3cccnc3)CC[C@H]21	ZINC000875058119	FB	On-Demand	Anodyne	CHRNA7	40	37
CN(C)CCOc1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875058143	GD	On-Demand	Anodyne	HRH2	38	45
CN(C)CCOc1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875058143	GD	On-Demand	Anodyne	CCR3	23	47
CN(C)CCOc1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875058143	GD	On-Demand	Anodyne	ROCK2	20	40
CN(C)CCOc1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875058143	GD	On-Demand	Anodyne	MCHR1	18	48
COC(=O)N(C)NC(=O)NCc1ccc(OCC(F)(F)F)c(OC)c1	ZINC000875058159	FE	On-Demand	Reactive	MT-ND1	25	43
COC(=O)N(C)NC(=O)NCc1ccc(OCC(F)(F)F)c(OC)c1	ZINC000875058159	FE	On-Demand	Reactive	DRTS_TRYCR	43	30
C#CC[C@H](CCOC)NC(=O)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058164	FC	On-Demand	Mild	DRD2	16	46
C#CC[C@H](CCOC)NC(=O)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058164	FC	On-Demand	Mild	DRD4	42	34
C#CC[C@H](CCOC)NC(=O)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058164	FC	On-Demand	Mild	DRD3	30	46
C#CC[C@H](CCOC)NC(=O)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058164	FC	On-Demand	Mild	NOD2	44	39
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058165	FC	On-Demand	Mild	DRD2	16	46
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058165	FC	On-Demand	Mild	DRD4	42	34
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058165	FC	On-Demand	Mild	DRD3	30	46
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058165	FC	On-Demand	Mild	NOD2	44	39
O=C(NCc1cccc(OCC(F)(F)F)c1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875058166	GG	On-Demand	Anodyne	PDS	46	36
O=C(NCCCCC1CC1)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058169	ED	On-Demand	Anodyne	HTR1A	36	49
O=C(NCCCCC1CC1)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058169	ED	On-Demand	Anodyne	DRD2	37	55
O=C(NCCCCC1CC1)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058169	ED	On-Demand	Anodyne	DRD4	17	43
O=C(NCCCCC1CC1)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058169	ED	On-Demand	Anodyne	DRD3	61	54
O=C(NCCCCC1CC1)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058169	ED	On-Demand	Anodyne	HTR7	34	50
O=C(NCCCCC1CC1)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058169	ED	On-Demand	Anodyne	NOD2	41	34
CN1CCN(C(=O)c2ccc(CNC(=O)N3Cc4cccc(O)c4C3)cc2)CC1	ZINC000875058196	GE	On-Demand	Clean	FABI	44	33
CN1CCN(C(=O)c2ccc(CNC(=O)N3Cc4cccc(O)c4C3)cc2)CC1	ZINC000875058196	GE	On-Demand	Clean	HRH4	18	40
CN1CCN(C(=O)c2ccc(CNC(=O)N3Cc4cccc(O)c4C3)cc2)CC1	ZINC000875058196	GE	On-Demand	Clean	NAMPT	27	47
O=C(NCc1cccc(OCC(F)(F)F)c1)N1CCC(CO)(CO)CC1	ZINC000875058197	GD	On-Demand	Anodyne	HRH2	24	40
O=C(NCc1cccc(OCC(F)(F)F)c1)N1CCC(CO)(CO)CC1	ZINC000875058197	GD	On-Demand	Anodyne	EPHX2	15	46
O=C(NCc1cccc(OCC(F)(F)F)c1)N1CCC(CO)(CO)CC1	ZINC000875058197	GD	On-Demand	Anodyne	PDS	65	41
COc1cc(CNC(=O)N(C)OCC(F)(F)F)ccc1OCC(F)(F)F	ZINC000875058198	GG	On-Demand	Anodyne	MT-ND1	26	44
COc1cc(CNC(=O)N(C)OCC(F)(F)F)ccc1OCC(F)(F)F	ZINC000875058198	GG	On-Demand	Anodyne	DRTS_TRYCR	44	31
COCC(C)(C)CCNC(=O)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058199	FD	On-Demand	Anodyne	HTR1A	20	40
COCC(C)(C)CCNC(=O)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058199	FD	On-Demand	Anodyne	DRD2	18	48
COCC(C)(C)CCNC(=O)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058199	FD	On-Demand	Anodyne	DRD4	44	35
COCC(C)(C)CCNC(=O)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058199	FD	On-Demand	Anodyne	DRD3	30	52
COCC(C)(C)CCNC(=O)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058199	FD	On-Demand	Anodyne	HTR7	20	43
COCC(C)(C)CCNC(=O)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058199	FD	On-Demand	Anodyne	NOD1	17	41
COCC(C)(C)CCNC(=O)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058199	FD	On-Demand	Anodyne	NOD2	46	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(OCCN(C)C)c1	ZINC000875058206	GD	On-Demand	Anodyne	ROCK2	23	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(OCCN(C)C)c1	ZINC000875058207	GD	On-Demand	Anodyne	ROCK2	23	41
Cc1nnc(NNC(=O)NCc2cccc(OCC(F)(F)F)c2)n1C	ZINC000875058218	FD	On-Demand	Reactive	CARM1	50	35
Cc1nnc(NNC(=O)NCc2cccc(OCC(F)(F)F)c2)n1C	ZINC000875058218	FD	On-Demand	Reactive	PDS	56	39
CN(C)CCOc1cccc(CNC(=O)N(C)OCC(F)(F)F)c1	ZINC000875058219	EE	On-Demand	Anodyne	ROCK2	31	43
CN(C)CCOc1cccc(CNC(=O)N(C)OCC(F)(F)F)c1	ZINC000875058219	EE	On-Demand	Anodyne	PDS	66	44
O=C(C[C@@H]1C=CS(=O)(=O)C1)Nc1ncc(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)s1	ZINC000875058250	JJ	On-Demand	Anodyne	SCD1	34	46
O=C(C[C@@H]1C=CS(=O)(=O)C1)Nc1ncc(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)s1	ZINC000875058250	JJ	On-Demand	Anodyne	SCD	32	46
O=C(C[C@H]1C=CS(=O)(=O)C1)Nc1ncc(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)s1	ZINC000875058251	JJ	On-Demand	Anodyne	SCD1	34	46
O=C(C[C@H]1C=CS(=O)(=O)C1)Nc1ncc(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)s1	ZINC000875058251	JJ	On-Demand	Anodyne	SCD	32	46
CC[C@@H]1COCCN1CCNC(=O)NCc1cccc(OCCN(C)C)c1	ZINC000875058258	GD	On-Demand	Anodyne	HRH2	30	43
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3cccc(OCC(F)(F)F)c3)C[C@@H]1C2	ZINC000875058267	GF	On-Demand	Anodyne	PDS	54	35
CN(C)CCOc1cccc(CNC(=O)NCC[C@H](O)C2CCCC2)c1	ZINC000875058272	FE	On-Demand	Anodyne	HRH2	28	45
CN(C)CCOc1cccc(CNC(=O)NCC[C@H](O)C2CCCC2)c1	ZINC000875058272	FE	On-Demand	Anodyne	ROCK2	17	41
CN(C)CCOc1cccc(CNC(=O)NCC[C@H](O)C2CCCC2)c1	ZINC000875058272	FE	On-Demand	Anodyne	PDS	42	33
CN(C)CCOc1cccc(CNC(=O)NCC[C@@H](O)C2CCCC2)c1	ZINC000875058273	FE	On-Demand	Anodyne	HRH2	28	45
CN(C)CCOc1cccc(CNC(=O)NCC[C@@H](O)C2CCCC2)c1	ZINC000875058273	FE	On-Demand	Anodyne	ROCK2	17	41
CN(C)CCOc1cccc(CNC(=O)NCC[C@@H](O)C2CCCC2)c1	ZINC000875058273	FE	On-Demand	Anodyne	PDS	42	33
CN(C)CCOc1cccc(CNC(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)c1	ZINC000875058283	GG	On-Demand	Anodyne	ROCK2	16	41
CN(C)CCOc1cccc(CNC(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)c1	ZINC000875058283	GG	On-Demand	Anodyne	PDS	46	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCN2CCc3ccccc3C2)C1	ZINC000875058294	FC	On-Demand	Anodyne	SLC6A1	94	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCN2CCc3ccccc3C2)C1	ZINC000875058294	FC	On-Demand	Anodyne	HTR7	19	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCN2CCc3ccccc3C2)C1	ZINC000875058295	FC	On-Demand	Anodyne	SLC6A1	94	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCN2CCc3ccccc3C2)C1	ZINC000875058295	FC	On-Demand	Anodyne	HTR7	19	40
O=C(NCc1cccc(OCc2ccccn2)c1)N1CCC(CO)(CO)CC1	ZINC000875058297	GD	On-Demand	Anodyne	PDS	43	32
COCCCNC(=O)c1c(NC(=O)Cn2cncc2C)sc2c1CCCC2	ZINC000875058304	GF	On-Demand	Anodyne	QPCT	47	38
CN(C)CCOc1cccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875058351	ED	On-Demand	Anodyne	PDS	42	35
CN(C)CCOc1cccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875058352	ED	On-Demand	Anodyne	PDS	42	35
O=C(NCCN1CCc2ccccc2C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875058366	GB	On-Demand	Anodyne	NOD2	40	33
CC(=O)C1CCN(C(=O)C(=O)NCCN2CCc3ccccc3C2)CC1	ZINC000875058371	FC	On-Demand	Anodyne	HTR7	19	45
CC(=O)C1CCN(C(=O)C(=O)NCCN2CCc3ccccc3C2)CC1	ZINC000875058371	FC	On-Demand	Anodyne	NOD2	41	34
CC[C@@H](NC(=O)NCc1ccc(C(=O)N(CC)CC)cc1)[C@H](O)c1ccccc1	ZINC000875058380	GG	On-Demand	Anodyne	OPRD1	38	45
CC[C@@H](NC(=O)NCc1ccc(C(=O)N(CC)CC)cc1)[C@H](O)c1ccccc1	ZINC000875058380	GG	On-Demand	Anodyne	ANPEP	16	43
CC[C@@H](NC(=O)NCc1ccc(C(=O)N(CC)CC)cc1)[C@H](O)c1ccccc1	ZINC000875058380	GG	On-Demand	Anodyne	PDS	41	33
CC[C@@H](NC(=O)NCc1ccc(C(=O)N(CC)CC)cc1)[C@@H](O)c1ccccc1	ZINC000875058381	GG	On-Demand	Anodyne	OPRD1	38	45
CC[C@@H](NC(=O)NCc1ccc(C(=O)N(CC)CC)cc1)[C@@H](O)c1ccccc1	ZINC000875058381	GG	On-Demand	Anodyne	ANPEP	16	43
CC[C@@H](NC(=O)NCc1ccc(C(=O)N(CC)CC)cc1)[C@@H](O)c1ccccc1	ZINC000875058381	GG	On-Demand	Anodyne	PDS	41	33
CN(C)CCOc1cccc(CNC(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875058383	FC	On-Demand	Anodyne	HRH2	27	43
CN(C)CCOc1cccc(CNC(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875058383	FC	On-Demand	Anodyne	ROCK2	19	41
CN(C)CCOc1cccc(CNC(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875058383	FC	On-Demand	Anodyne	PDS	49	35
CC[C@@H]1COCCN1CCNC(=O)NCc1cccc(OCc2ccccn2)c1	ZINC000875058385	GF	On-Demand	Anodyne	HRH2	26	40
CN(C)CCOc1cccc(CNC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875058391	GF	On-Demand	Anodyne	HRH2	29	43
CN(C)CCOc1cccc(CNC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875058391	GF	On-Demand	Anodyne	ROCK2	23	41
CN1CCN(C(=O)c2ccc(CNC(=O)N3CC[C@@H](C(C)(C)O)C3)cc2)CC1	ZINC000875058400	GD	On-Demand	Anodyne	EPHX2	15	41
CN1CCN(C(=O)c2ccc(CNC(=O)N3CC[C@@H](C(C)(C)O)C3)cc2)CC1	ZINC000875058400	GD	On-Demand	Anodyne	TPSAB1	17	44
CN1CCN(C(=O)c2ccc(CNC(=O)N3CC[C@@H](C(C)(C)O)C3)cc2)CC1	ZINC000875058400	GD	On-Demand	Anodyne	CYP2J2	45	32
CN1CCN(C(=O)c2ccc(CNC(=O)N3CC[C@@H](C(C)(C)O)C3)cc2)CC1	ZINC000875058400	GD	On-Demand	Anodyne	L3MBTL3	73	44
CN1CCN(C(=O)c2ccc(CNC(=O)N3CC[C@H](C(C)(C)O)C3)cc2)CC1	ZINC000875058401	GD	On-Demand	Anodyne	EPHX2	15	41
CN1CCN(C(=O)c2ccc(CNC(=O)N3CC[C@H](C(C)(C)O)C3)cc2)CC1	ZINC000875058401	GD	On-Demand	Anodyne	TPSAB1	17	44
CN1CCN(C(=O)c2ccc(CNC(=O)N3CC[C@H](C(C)(C)O)C3)cc2)CC1	ZINC000875058401	GD	On-Demand	Anodyne	CYP2J2	45	32
CN1CCN(C(=O)c2ccc(CNC(=O)N3CC[C@H](C(C)(C)O)C3)cc2)CC1	ZINC000875058401	GD	On-Demand	Anodyne	L3MBTL3	73	44
CN1CCN(C2CCN(C(=O)C(=O)NCc3cccnc3N(C)C)CC2)CC1	ZINC000875058413	GC	On-Demand	Anodyne	L3MBTL3	41	37
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(C(=O)NC)cc1	ZINC000875058444	DD	On-Demand	Anodyne	ANPEP	16	42
COC(=O)N(C)NC(=O)NCc1cccc(OCCN(C)C)c1	ZINC000875058445	DD	On-Demand	Reactive	HRH2	25	40
COC(=O)N(C)NC(=O)NCc1cccc(OCCN(C)C)c1	ZINC000875058445	DD	On-Demand	Reactive	ROCK1	22	41
COC(=O)N(C)NC(=O)NCc1cccc(OCCN(C)C)c1	ZINC000875058445	DD	On-Demand	Reactive	ROCK2	36	49
COC(=O)N(C)NC(=O)NCc1cccc(OCCN(C)C)c1	ZINC000875058445	DD	On-Demand	Reactive	PDS	62	37
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccc(OCC(F)(F)F)c2)C1	ZINC000875058458	GF	On-Demand	Anodyne	PDS	69	39
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(C(=O)N(CC)CC)cc1	ZINC000875058462	EF	On-Demand	Anodyne	ANPEP	16	41
CN1CCN(C(=O)c2ccc(CNC(=O)NC[C@H]3C[C@H](O)C3)cc2)CC1	ZINC000875058471	FC	On-Demand	Anodyne	EPHX2	16	44
CN(C)CCOc1cccc(CNC(=O)NC[C@@H]2CC(C(F)(F)F)=NO2)c1	ZINC000875058492	GE	On-Demand	Anodyne	ROCK2	21	42
CN(C)CCOc1cccc(CNC(=O)NC[C@H]2CC(C(F)(F)F)=NO2)c1	ZINC000875058493	GE	On-Demand	Anodyne	ROCK2	21	42
CN(C)CCOc1cccc(CNC(=O)N2CCN(C)C(C)(C)CC2)c1	ZINC000875058495	FE	On-Demand	Anodyne	ROCK2	19	40
CN(C)CCOc1cccc(CNC(=O)N2CCCN(C=O)CC2)c1	ZINC000875058510	ED	On-Demand	Anodyne	HRH2	29	41
CN(C)CCOc1cccc(CNC(=O)N2CCCN(C=O)CC2)c1	ZINC000875058510	ED	On-Demand	Anodyne	PDS	45	34
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(N(C)C)nc2)CC1	ZINC000875058515	EC	On-Demand	Anodyne	NAMPT	19	42
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(OCCN(C)C)c1	ZINC000875058526	ED	On-Demand	Anodyne	HRH2	22	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(OCCN(C)C)c1	ZINC000875058526	ED	On-Demand	Anodyne	ROCK2	24	45
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(OCCN(C)C)c1	ZINC000875058526	ED	On-Demand	Anodyne	PDS	89	40
O=CN1CCCN(C(=O)NCc2cccc(OCc3ccccc3)c2)CC1	ZINC000875058553	FF	On-Demand	Anodyne	HRH2	25	42
O=CN1CCCN(C(=O)NCc2cccc(OCc3ccccc3)c2)CC1	ZINC000875058553	FF	On-Demand	Anodyne	FAAH	25	41
O=CN1CCCN(C(=O)NCc2cccc(OCc3ccccc3)c2)CC1	ZINC000875058553	FF	On-Demand	Anodyne	DPP7	23	42
O=CN1CCCN(C(=O)NCc2cccc(OCc3ccccc3)c2)CC1	ZINC000875058553	FF	On-Demand	Anodyne	FFAR1	18	41
O=CN1CCCN(C(=O)NCc2cccc(OCc3ccccc3)c2)CC1	ZINC000875058553	FF	On-Demand	Anodyne	PDS	54	35
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccc(OCc3ccccn3)c2)C1	ZINC000875058555	GG	On-Demand	Anodyne	PDS	50	36
CN(C)CCOc1cccc(CNC(=O)N2CCC(C(=O)NCCO)CC2)c1	ZINC000875058556	GC	On-Demand	Anodyne	HRH2	29	40
CN(C)CCOc1cccc(CNC(=O)N2CCC(C(=O)NCCO)CC2)c1	ZINC000875058556	GC	On-Demand	Anodyne	EPHX2	19	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(OCC(F)(F)F)c1	ZINC000875058559	GF	On-Demand	Anodyne	SLC6A3	40	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(OCC(F)(F)F)c1	ZINC000875058559	GF	On-Demand	Anodyne	PDS	50	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(OCC(F)(F)F)c1	ZINC000875058560	GF	On-Demand	Anodyne	SLC6A3	40	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(OCC(F)(F)F)c1	ZINC000875058560	GF	On-Demand	Anodyne	PDS	50	37
O=C(NCc1cccc(OCc2ccccc2)c1)N1CCC(CO)(CO)CC1	ZINC000875058561	GF	On-Demand	Anodyne	HRH2	25	44
O=C(NCc1cccc(OCc2ccccc2)c1)N1CCC(CO)(CO)CC1	ZINC000875058561	GF	On-Demand	Anodyne	MMP13	18	43
O=C(NCc1cccc(OCc2ccccc2)c1)N1CCC(CO)(CO)CC1	ZINC000875058561	GF	On-Demand	Anodyne	FAAH	30	40
O=C(NCc1cccc(OCc2ccccc2)c1)N1CCC(CO)(CO)CC1	ZINC000875058561	GF	On-Demand	Anodyne	EPHX2	16	42
O=C(NCc1cccc(OCc2ccccc2)c1)N1CCC(CO)(CO)CC1	ZINC000875058561	GF	On-Demand	Anodyne	FFAR1	27	43
O=C(NCc1cccc(OCc2ccccc2)c1)N1CCC(CO)(CO)CC1	ZINC000875058561	GF	On-Demand	Anodyne	PDS	58	36
CN(C)CCOc1cccc(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)c1	ZINC000875058567	EE	On-Demand	Anodyne	ROCK2	15	42
CN(C)CCOc1cccc(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)c1	ZINC000875058568	EE	On-Demand	Anodyne	ROCK2	15	42
CN(C)CCOc1cccc(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)c1	ZINC000875058569	EE	On-Demand	Anodyne	ROCK2	15	42
CN(C)CCOc1cccc(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)c1	ZINC000875058570	EE	On-Demand	Anodyne	ROCK2	15	42
O=C(NCc1cccc(OCC(F)(F)F)c1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875058578	GG	On-Demand	Anodyne	PDS	43	37
O=C(NCc1cccc(OCC(F)(F)F)c1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875058579	GG	On-Demand	Anodyne	PDS	43	37
CCCCCCCNC(=O)C(=O)NCc1ccc(N(C)C)nc1	ZINC000875058590	DD	On-Demand	Mild	LPAR2	41	34
CCCCCCCNC(=O)C(=O)NCc1ccc(N(C)C)nc1	ZINC000875058590	DD	On-Demand	Mild	S1PR2	49	35
CCCCCCCNC(=O)C(=O)NCc1ccc(N(C)C)nc1	ZINC000875058590	DD	On-Demand	Mild	ASAH1	75	34
O=C(NCc1cccc(OCc2ccccc2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875058594	EF	On-Demand	Anodyne	HRH2	24	44
O=C(NCc1cccc(OCc2ccccc2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875058594	EF	On-Demand	Anodyne	MAOB	28	41
O=C(NCc1cccc(OCc2ccccc2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875058594	EF	On-Demand	Anodyne	GRIN2B	26	44
O=C(NCc1cccc(OCc2ccccc2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875058594	EF	On-Demand	Anodyne	ADAM17	15	42
O=C(NCc1cccc(OCc2ccccc2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875058594	EF	On-Demand	Anodyne	FFAR1	29	44
O=C(NCc1cccc(OCc2ccccc2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875058594	EF	On-Demand	Anodyne	PDS	78	38
O=CN1CCCN(C(=O)NCc2cccc(OCC(F)(F)F)c2)CC1	ZINC000875058597	FE	On-Demand	Anodyne	PDS	60	39
CCCCCCCNC(=O)C(=O)NCc1cccnc1N(C)C	ZINC000875058712	DD	On-Demand	Mild	ASAH1	73	35
COC(=O)C1(O)CN(C(=O)NCc2cccc(OCCN(C)C)c2)C1	ZINC000875058771	FC	On-Demand	Anodyne	ROCK2	32	45
CCNC(=O)COc1ccc(CNC(=O)N(CC)OCC)cc1OC	ZINC000875058775	FD	On-Demand	Anodyne	PDE6A	42	33
CCNC(=O)COc1ccc(CNC(=O)N(CC)OCC)cc1OC	ZINC000875058775	FD	On-Demand	Anodyne	MT-ND1	19	40
CCNC(=O)COc1ccc(CNC(=O)N(CC)OCC)cc1OC	ZINC000875058775	FD	On-Demand	Anodyne	DRTS_TRYCR	44	32
CCNC(=O)CNC(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875058780	ED	On-Demand	Anodyne	CCR2	40	39
O=C(NCCN1CCc2ccccc2C1)C(=O)NCc1ncc(Cl)s1	ZINC000875058794	GD	On-Demand	Anodyne	HTR7	15	40
O=C(NCCN1CCc2ccccc2C1)C(=O)NCc1ncc(Cl)s1	ZINC000875058794	GD	On-Demand	Anodyne	NOD2	40	34
O=C(NCCNC(=O)c1cccnc1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875058798	FC	On-Demand	Anodyne	CHRNA7	40	37
O=C(NCCNC(=O)c1cccnc1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875058799	FC	On-Demand	Anodyne	CHRNA7	40	37
O=C(NCCNC(=O)c1cccnc1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875058800	FC	On-Demand	Anodyne	CHRNA7	40	37
O=C(NCCNC(=O)c1cccnc1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875058801	FC	On-Demand	Anodyne	CHRNA7	40	37
CN1CCN(C(=O)c2ccc(CNC(=O)N3CCCN(C=O)CC3)cc2)CC1	ZINC000875058802	GC	On-Demand	Anodyne	L3MBTL3	45	40
O=C(NCCN1CCc2ccccc2C1)C(=O)N[C@H]1CC12CCC2	ZINC000875058815	ED	On-Demand	Anodyne	HTR1A	16	42
O=C(NCCN1CCc2ccccc2C1)C(=O)N[C@H]1CC12CCC2	ZINC000875058815	ED	On-Demand	Anodyne	HTR7	25	42
O=C(NCCN1CCc2ccccc2C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875058816	ED	On-Demand	Anodyne	HTR1A	16	42
O=C(NCCN1CCc2ccccc2C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875058816	ED	On-Demand	Anodyne	HTR7	25	42
C#CC[C@@H](COC)NC(=O)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058834	EC	On-Demand	Mild	DRD4	40	32
C#CC[C@@H](COC)NC(=O)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058834	EC	On-Demand	Mild	DRD3	17	45
C#CC[C@@H](COC)NC(=O)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058834	EC	On-Demand	Mild	NOD2	42	37
C#CC[C@H](COC)NC(=O)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058835	EC	On-Demand	Mild	DRD4	40	32
C#CC[C@H](COC)NC(=O)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058835	EC	On-Demand	Mild	DRD3	17	45
C#CC[C@H](COC)NC(=O)C(=O)NCCN1CCc2ccccc2C1	ZINC000875058835	EC	On-Demand	Mild	NOD2	42	37
CN(C)CCOc1cccc(CNC(=O)N2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000875058839	GE	On-Demand	Anodyne	PDS	40	36
CN(C)CCOc1cccc(CNC(=O)N2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000875058840	GE	On-Demand	Anodyne	PDS	40	36
O=C(NCc1cccc(OCc2ccccn2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875058851	EE	On-Demand	Anodyne	PDS	49	33
O=C(NCCN1CCc2ccccc2C1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875058859	GE	On-Demand	Anodyne	HTR7	21	40
O=C(NCCN1CCc2ccccc2C1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875058860	GE	On-Demand	Anodyne	HTR7	21	40
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3cccc(OCCN(C)C)c3)C[C@@H]1C2	ZINC000875058902	GD	On-Demand	Anodyne	HRH2	24	41
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3cccc(OCCN(C)C)c3)C[C@@H]1C2	ZINC000875058902	GD	On-Demand	Anodyne	ROCK2	17	42
CN(C)CCOc1cccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875058908	GG	On-Demand	Anodyne	EPHX2	23	41
CN(C)CCOc1cccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875058909	GG	On-Demand	Anodyne	EPHX2	23	41
CN1CC[C@H]2CN(C(=O)C(=O)NCCN3CCc4ccccc4C3)CC[C@@H]21	ZINC000875058913	FC	On-Demand	Anodyne	PLD1	61	34
CN1CC[C@H]2CN(C(=O)C(=O)NCCN3CCc4ccccc4C3)CC[C@@H]21	ZINC000875058913	FC	On-Demand	Anodyne	PLD2	50	34
CN1CC[C@H]2CN(C(=O)C(=O)NCCN3CCc4ccccc4C3)CC[C@@H]21	ZINC000875058913	FC	On-Demand	Anodyne	NOD2	42	36
CN1CC[C@H]2CN(C(=O)C(=O)NCCN3CCc4ccccc4C3)CC[C@H]21	ZINC000875058914	FC	On-Demand	Anodyne	PLD1	61	34
CN1CC[C@H]2CN(C(=O)C(=O)NCCN3CCc4ccccc4C3)CC[C@H]21	ZINC000875058914	FC	On-Demand	Anodyne	PLD2	50	34
CN1CC[C@H]2CN(C(=O)C(=O)NCCN3CCc4ccccc4C3)CC[C@H]21	ZINC000875058914	FC	On-Demand	Anodyne	NOD2	42	36
CC[C@@H](NC(=O)C(=O)NCCN1CCC(C)CC1)c1cccc(OC)c1OC	ZINC000875059149	GE	On-Demand	Anodyne	HTR1A	47	43
CC[C@@H](NC(=O)C(=O)NCCN1CCC(C)CC1)c1cccc(OC)c1OC	ZINC000875059149	GE	On-Demand	Anodyne	DRD2	44	42
CC[C@@H](NC(=O)C(=O)NCCN1CCC(C)CC1)c1cccc(OC)c1OC	ZINC000875059149	GE	On-Demand	Anodyne	DRD4	44	34
CC[C@@H](NC(=O)C(=O)NCCN1CCC(C)CC1)c1cccc(OC)c1OC	ZINC000875059149	GE	On-Demand	Anodyne	DRD3	51	40
CC[C@@H](NC(=O)NCc1ccc(C(=O)NC)cc1)[C@@H](O)c1ccccc1	ZINC000875059632	FE	On-Demand	Anodyne	ANPEP	18	44
CC[C@@H](NC(=O)NCc1ccc(C(=O)NC)cc1)[C@@H](O)c1ccccc1	ZINC000875059632	FE	On-Demand	Anodyne	PDS	43	34
CC[C@@H](NC(=O)NCc1ccc(C(=O)NC)cc1)[C@H](O)c1ccccc1	ZINC000875059633	FE	On-Demand	Anodyne	ANPEP	18	44
CC[C@@H](NC(=O)NCc1ccc(C(=O)NC)cc1)[C@H](O)c1ccccc1	ZINC000875059633	FE	On-Demand	Anodyne	PDS	43	34
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccc(OCC)c2)C1	ZINC000875059741	EE	On-Demand	Anodyne	MMP13	18	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccc(OCC)c2)C1	ZINC000875059741	EE	On-Demand	Anodyne	CCKAR	46	33
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccc(OCC)c2)C1	ZINC000875059741	EE	On-Demand	Anodyne	ROCK2	16	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccc(OCC)c2)C1	ZINC000875059741	EE	On-Demand	Anodyne	PDS	89	42
COc1cc(CNC(=O)N(C)OCC(F)(F)F)ccc1OC(C)C	ZINC000875059759	FG	On-Demand	Anodyne	MT-ND1	24	42
O=C(NCc1ccc(N2CCCCC2)nc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875059780	GF	On-Demand	Anodyne	DGAT1	15	41
O=C(NCc1ccc(N2CCCCC2)nc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875059781	GF	On-Demand	Anodyne	DGAT1	15	41
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H](C)Cn1cccn1)CC2	ZINC000875059786	GD	On-Demand	Anodyne	SLC18A2	48	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H](C)Cn1cccn1)CC2	ZINC000875059787	GD	On-Demand	Anodyne	SLC18A2	48	34
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@@H](C)Cn1cccn1)CC2	ZINC000875059788	GD	On-Demand	Anodyne	SLC18A2	48	34
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@H](C)Cn1cccn1)CC2	ZINC000875059789	GD	On-Demand	Anodyne	SLC18A2	48	34
COc1cc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)ccc1OC(C)C	ZINC000875059813	GI	On-Demand	Anodyne	EPHX2	15	40
C[C@@H](Cn1cccn1)NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875059848	FD	On-Demand	Anodyne	OXTR	50	36
C[C@@H](Cn1cccn1)NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875059850	FD	On-Demand	Anodyne	OXTR	50	36
COc1cc(CNC(=O)N(C)[C@H]2C[C@@H](C(N)=O)C2)ccc1OC(C)C	ZINC000875059852	ED	On-Demand	Anodyne	MT-ND1	19	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(N3CCCCC3)nc2)C1	ZINC000875059873	FE	On-Demand	Anodyne	DGAT1	15	40
COc1cc(CNC(=O)N(C2CC2)C2CC2)ccc1OC(C)C	ZINC000875059914	DG	On-Demand	Anodyne	MT-ND1	24	42
N#Cc1ccc(Cc2cnc(NC(=O)/C=C/c3ccc([N+](=O)[O-])cc3)s2)cc1	ZINC000875059929	GI	On-Demand	Mild	SCD	16	47
N#Cc1ccc(Cc2cnc(NC(=O)/C=C\c3ccc([N+](=O)[O-])cc3)s2)cc1	ZINC000875059930	GI	On-Demand	Mild	SCD	16	47
CCCCCCCNC(=O)C(=O)N[C@H](C)Cn1cccn1	ZINC000875059940	CD	On-Demand	Mild	ASAH1	91	37
CCCCCCCNC(=O)C(=O)N[C@@H](C)Cn1cccn1	ZINC000875059941	CD	On-Demand	Mild	ASAH1	91	37
C[C@@H](Cn1cccn1)NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875059955	FD	On-Demand	Anodyne	C3AR1	41	41
C[C@@H](Cn1cccn1)NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875059957	FD	On-Demand	Anodyne	C3AR1	41	41
COc1cc(CNC(=O)N2CCCC[C@H]2CNC(C)=O)ccc1OC(C)C	ZINC000875059965	GF	On-Demand	Anodyne	FKBP1A	47	41
COc1cc(CNC(=O)N2CCCC[C@@H]2CNC(C)=O)ccc1OC(C)C	ZINC000875059966	GF	On-Demand	Anodyne	FKBP1A	47	41
N#Cc1ccc(Cc2cnc(NC(=O)c3ccc(Cl)c(S(=O)(=O)N4CCCC4)c3)s2)cc1	ZINC000875059971	JI	On-Demand	Mild	ITK	25	41
N#Cc1ccc(Cc2cnc(NC(=O)c3ccc(Cl)c(S(=O)(=O)N4CCCC4)c3)s2)cc1	ZINC000875059971	JI	On-Demand	Mild	SCD1	41	47
N#Cc1ccc(Cc2cnc(NC(=O)c3ccc(Cl)c(S(=O)(=O)N4CCCC4)c3)s2)cc1	ZINC000875059971	JI	On-Demand	Mild	SCD	32	47
C[C@@H](Cn1cccn1)NC(=O)C(=O)N1CCN(c2ccc(F)cc2C#N)CC1	ZINC000875060001	GC	On-Demand	Mild	NPY2R	25	40
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](CN2CCCCC2)c2ccccc2)CC1	ZINC000875060035	GE	On-Demand	Anodyne	CCR5	32	42
CC(=O)C1CCN(C(=O)C(=O)N[C@H](CN2CCCCC2)c2ccccc2)CC1	ZINC000875060036	GE	On-Demand	Anodyne	CCR5	32	42
O=C(NCc1ccnc(-n2cccn2)c1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875060110	GG	On-Demand	Anodyne	CPT1A	43	36
O=C(NCc1ccnc(-n2cccn2)c1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875060111	GG	On-Demand	Anodyne	CPT1A	43	36
O=C(NCc1ccnc(-n2cccn2)c1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875060112	GG	On-Demand	Anodyne	CPT1A	43	36
O=C(NCc1ccnc(-n2cccn2)c1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875060113	GG	On-Demand	Anodyne	CPT1A	43	36
C[C@H](CN1CCOCC1)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875060127	GC	On-Demand	Anodyne	CASR	26	42
C[C@H](CN1CCOCC1)NC(=O)C(=O)NCc1cn(C(F)F)c2ccccc12	ZINC000875060136	GD	On-Demand	Anodyne	PTGDS	50	40
Cc1cc(C(F)(F)F)nc(C(=O)Nc2cc(S(C)(=O)=O)ccc2C)n1	ZINC000875060139	FF	On-Demand	Anodyne	PTGS2	32	41
Cc1cc(C(F)(F)F)nc(C(=O)Nc2cc(S(C)(=O)=O)ccc2C)n1	ZINC000875060139	FF	On-Demand	Anodyne	TRPV1	42	32
C[C@H](CN1CCOCC1)NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875060143	GD	On-Demand	Anodyne	C3AR1	42	42
C[C@H](CN1CCOCC1)NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875060146	GD	On-Demand	Anodyne	C3AR1	42	42
CCO[C@@H](C(=O)Nc1cc(S(C)(=O)=O)ccc1C)[C@@H]1CCOC1	ZINC000875060328	ED	On-Demand	Anodyne	GCK	15	40
CCO[C@@H](C(=O)Nc1cc(S(C)(=O)=O)ccc1C)[C@H]1CCOC1	ZINC000875060329	ED	On-Demand	Anodyne	GCK	15	40
CCCCCCCNC(=O)C(=O)N[C@@H](C)CN1CCOCC1	ZINC000875060335	DC	On-Demand	Mild	ASAH1	57	42
CCCCCCCNC(=O)C(=O)N[C@@H](C)CN1CCOCC1	ZINC000875060335	DC	On-Demand	Mild	NOD1	67	40
CCCCCCCNC(=O)C(=O)N[C@H](C)CN1CCOCC1	ZINC000875060336	DC	On-Demand	Mild	ASAH1	57	42
CCCCCCCNC(=O)C(=O)N[C@H](C)CN1CCOCC1	ZINC000875060336	DC	On-Demand	Mild	NOD1	67	40
O=C(NCc1ccccc1Cn1cncn1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875060359	GF	On-Demand	Anodyne	EPHX2	21	48
O=C(NCc1ccccc1Cn1cncn1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875060360	GF	On-Demand	Anodyne	EPHX2	21	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1Cn1cncn1	ZINC000875060371	FD	On-Demand	Anodyne	SLC6A4	26	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1Cn1cncn1	ZINC000875060371	FD	On-Demand	Anodyne	SLC6A3	50	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1Cn1cncn1	ZINC000875060371	FD	On-Demand	Anodyne	HIS3	50	35
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1Cn1cncn1	ZINC000875060373	FD	On-Demand	Anodyne	SLC6A4	26	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1Cn1cncn1	ZINC000875060373	FD	On-Demand	Anodyne	SLC6A3	50	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1Cn1cncn1	ZINC000875060373	FD	On-Demand	Anodyne	HIS3	50	35
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCC(=O)N(C)Cc2ccccc2)c1	ZINC000875060385	GD	On-Demand	Anodyne	PREP	48	35
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCC(=O)N(C)Cc2ccccc2)c1	ZINC000875060386	GD	On-Demand	Anodyne	PREP	48	35
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccnc(-n2cccn2)c1	ZINC000875060414	FD	On-Demand	Anodyne	SLC6A3	41	35
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccnc(-n2cccn2)c1	ZINC000875060415	FD	On-Demand	Anodyne	SLC6A3	41	35
O=C(NCc1ccc(N2CCCCC2)nc1)N1CCC(CO)(CO)CC1	ZINC000875060506	FD	On-Demand	Anodyne	NAMPT	40	38
COC(=O)N(C)NC(=O)NCc1ccc(OC(C)C)c(OC)c1	ZINC000875060520	ED	On-Demand	Reactive	MT-ND1	24	42
C[C@@H](Cn1cccn1)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875060542	GD	On-Demand	Anodyne	DRD2	17	41
C[C@@H](Cn1cccn1)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875060542	GD	On-Demand	Anodyne	DRD4	37	41
C[C@@H](Cn1cccn1)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875060542	GD	On-Demand	Anodyne	ACHE	59	57
C[C@@H](Cn1cccn1)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875060542	GD	On-Demand	Anodyne	HTR4	34	45
C[C@@H](Cn1cccn1)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875060542	GD	On-Demand	Anodyne	SIGMAR1	42	45
C[C@@H](Cn1cccn1)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875060542	GD	On-Demand	Anodyne	MCHR1	21	42
C[C@@H](Cn1cccn1)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875060542	GD	On-Demand	Anodyne	CACNA1I	43	36
C[C@@H](Cn1cccn1)NC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875060560	GD	On-Demand	Anodyne	NPY2R	83	37
N#Cc1ccc(Cc2cnc(NC(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)s2)cc1	ZINC000875060575	HH	On-Demand	Mild	SCD1	40	41
N#Cc1ccc(Cc2cnc(NC(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)s2)cc1	ZINC000875060575	HH	On-Demand	Mild	SCD	34	41
N#Cc1ccc(Cc2cnc(NC(=O)c3ccc(F)c(S(=O)(=O)N4CCOCC4)c3)s2)cc1	ZINC000875060591	JG	On-Demand	Mild	SCD1	41	46
N#Cc1ccc(Cc2cnc(NC(=O)c3ccc(F)c(S(=O)(=O)N4CCOCC4)c3)s2)cc1	ZINC000875060591	JG	On-Demand	Mild	SCD	34	46
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(N3CCCCCC3)nc2)C1	ZINC000875060662	GF	On-Demand	Anodyne	DGAT1	15	40
O=C(NCCCN1CCc2ccccc2C1)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875060685	GD	On-Demand	Anodyne	HTR7	21	42
O=C(NCCCN1CCc2ccccc2C1)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875060688	GD	On-Demand	Anodyne	HTR7	21	42
O=C(NCCCN1CCc2ccccc2C1)C(=O)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875060690	GD	On-Demand	Anodyne	HTR7	21	42
O=C(NCCCN1CCc2ccccc2C1)C(=O)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875060692	GD	On-Demand	Anodyne	HTR7	21	42
C[C@H](NC(=O)C(=O)NCCN1CCC[C@@H](C)C1)c1ccnn1C	ZINC000875060719	DC	On-Demand	Anodyne	SLC6A1	106	33
C[C@H]1C[C@@H](C)CN(CCCNC(=O)C(=O)NCc2cccc3ncccc23)C1	ZINC000875060736	GE	On-Demand	Anodyne	HNMT	41	35
O=C(NCc1ccc(N2CCCC2)nc1)N1CCC(CO)(CO)CC1	ZINC000875060743	EC	On-Demand	Anodyne	NAMPT	42	38
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCCN1CCc2ccccc2C1	ZINC000875060756	FD	On-Demand	Mild	DRD2	31	44
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCCN1CCc2ccccc2C1	ZINC000875060756	FD	On-Demand	Mild	DRD4	21	41
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCCN1CCc2ccccc2C1	ZINC000875060756	FD	On-Demand	Mild	DRD3	58	45
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCCN1CCc2ccccc2C1	ZINC000875060756	FD	On-Demand	Mild	HTR7	24	42
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCCN1CCc2ccccc2C1	ZINC000875060756	FD	On-Demand	Mild	NOD2	42	37
C#CC[C@H](CCOC)NC(=O)C(=O)NCCCN1CCc2ccccc2C1	ZINC000875060757	FD	On-Demand	Mild	DRD2	31	44
C#CC[C@H](CCOC)NC(=O)C(=O)NCCCN1CCc2ccccc2C1	ZINC000875060757	FD	On-Demand	Mild	DRD4	21	41
C#CC[C@H](CCOC)NC(=O)C(=O)NCCCN1CCc2ccccc2C1	ZINC000875060757	FD	On-Demand	Mild	DRD3	58	45
C#CC[C@H](CCOC)NC(=O)C(=O)NCCCN1CCc2ccccc2C1	ZINC000875060757	FD	On-Demand	Mild	HTR7	24	42
C#CC[C@H](CCOC)NC(=O)C(=O)NCCCN1CCc2ccccc2C1	ZINC000875060757	FD	On-Demand	Mild	NOD2	42	37
C#CC[C@@H](COC)NC(=O)C(=O)NCCCN1CCc2ccccc21	ZINC000875060774	EC	On-Demand	Mild	DRD3	41	37
C#CC[C@H](COC)NC(=O)C(=O)NCCCN1CCc2ccccc21	ZINC000875060775	EC	On-Demand	Mild	DRD3	41	37
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCCN1CCc2ccccc21	ZINC000875060919	FD	On-Demand	Mild	DRD3	50	37
C#CC[C@H](CCOC)NC(=O)C(=O)NCCCN1CCc2ccccc21	ZINC000875060920	FD	On-Demand	Mild	DRD3	50	37
O=C(NCCCN1CCc2ccccc2C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875060932	GC	On-Demand	Anodyne	DRD3	17	53
O=C(NCCCN1CCc2ccccc2C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875060932	GC	On-Demand	Anodyne	HTR7	22	52
O=C(Nc1ncc(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)s1)c1ccc(-n2cccn2)nc1	ZINC000875060980	JK	On-Demand	Anodyne	SCD1	44	56
O=C(Nc1ncc(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)s1)c1ccc(-n2cccn2)nc1	ZINC000875060980	JK	On-Demand	Anodyne	SCD	42	56
N#Cc1ccc(Cc2cnc(NC(=O)/C=C/c3ccc(I)o3)s2)cc1	ZINC000875060983	JI	On-Demand	Mild	SCD	16	40
N#Cc1ccc(Cc2cnc(NC(=O)/C=C\c3ccc(I)o3)s2)cc1	ZINC000875060991	JI	On-Demand	Mild	SCD	16	40
N#Cc1ccc(Cc2cnc(NC(=O)/C=C\c3ccccc3)s2)cc1	ZINC000875061020	EI	On-Demand	Mild	CDK5	15	41
N#Cc1ccc(Cc2cnc(NC(=O)/C=C\c3ccccc3)s2)cc1	ZINC000875061020	EI	On-Demand	Mild	SCD	29	50
N#Cc1ccc(Cc2cnc(NC(=O)/C=C/c3ccccc3)s2)cc1	ZINC000875061021	EI	On-Demand	Mild	CDK5	15	41
N#Cc1ccc(Cc2cnc(NC(=O)/C=C/c3ccccc3)s2)cc1	ZINC000875061021	EI	On-Demand	Mild	SCD	29	50
O=C(NCc1ccc(N2CCCCC2)nc1)N1Cc2cccc(O)c2C1	ZINC000875061073	FG	On-Demand	Clean	NAMPT	40	43
N#Cc1ccc(Cc2cnc(NC(=O)/C=C/c3ccc(Br)o3)s2)cc1	ZINC000875061081	HJ	On-Demand	Mild	SCD	15	40
N#Cc1ccc(Cc2cnc(NC(=O)/C=C\c3ccc(Br)o3)s2)cc1	ZINC000875061082	HJ	On-Demand	Mild	SCD	15	40
O=C(NCCCN1CCc2ccccc21)C(=O)NCc1cccc2ncccc12	ZINC000875061092	GE	On-Demand	Anodyne	HTR1A	17	41
O=C(NCCCN1CCc2ccccc21)C(=O)NCc1cccc2ncccc12	ZINC000875061092	GE	On-Demand	Anodyne	DRD3	17	41
O=C(NCc1ccc(N2CCCCC2)nc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875061093	GG	On-Demand	Anodyne	F2	27	45
O=C(NCc1ccc(N2CCCCC2)nc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875061093	GG	On-Demand	Anodyne	PREP	43	42
O=C(NCc1ccc(N2CCCCC2)nc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875061093	GG	On-Demand	Anodyne	TMPRSS11D	50	32
O=C(NCc1ccc(N2CCCCC2)nc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875061094	GG	On-Demand	Anodyne	F2	27	45
O=C(NCc1ccc(N2CCCCC2)nc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875061094	GG	On-Demand	Anodyne	PREP	43	42
O=C(NCc1ccc(N2CCCCC2)nc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875061094	GG	On-Demand	Anodyne	TMPRSS11D	50	32
O=C(NCc1ccc(N2CCCCC2)nc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875061095	GG	On-Demand	Anodyne	F2	27	45
O=C(NCc1ccc(N2CCCCC2)nc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875061095	GG	On-Demand	Anodyne	PREP	43	42
O=C(NCc1ccc(N2CCCCC2)nc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875061095	GG	On-Demand	Anodyne	TMPRSS11D	50	32
O=C(NCc1ccc(N2CCCCC2)nc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875061096	GG	On-Demand	Anodyne	F2	27	45
O=C(NCc1ccc(N2CCCCC2)nc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875061096	GG	On-Demand	Anodyne	PREP	43	42
O=C(NCc1ccc(N2CCCCC2)nc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875061096	GG	On-Demand	Anodyne	TMPRSS11D	50	32
C[C@H](NC(=O)C(=O)NCCN1CCC[C@@H](C)C1)c1ccc(C(F)(F)F)nc1	ZINC000875061103	GE	On-Demand	Anodyne	TRPV1	54	43
CCC1(CC)CCCN1C(=O)NCc1ccc(N2CCCC2)nc1	ZINC000875061121	EH	On-Demand	Anodyne	SLC12A5	44	31
O=C(NCc1ccc(N2CCCC2)nc1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875061151	GF	On-Demand	Anodyne	NAMPT	36	42
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](CN2CCCC2)c2ccccc2)CC1	ZINC000875061196	FD	On-Demand	Anodyne	OPRK1	24	40
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](CN2CCCC2)c2ccccc2)CC1	ZINC000875061196	FD	On-Demand	Anodyne	CCR5	33	43
CC(=O)C1CCN(C(=O)C(=O)N[C@H](CN2CCCC2)c2ccccc2)CC1	ZINC000875061198	FD	On-Demand	Anodyne	OPRK1	24	40
CC(=O)C1CCN(C(=O)C(=O)N[C@H](CN2CCCC2)c2ccccc2)CC1	ZINC000875061198	FD	On-Demand	Anodyne	CCR5	33	43
O=C(NCc1ccc(N2CCCC2)nc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875061199	GG	On-Demand	Anodyne	F2	28	45
O=C(NCc1ccc(N2CCCC2)nc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875061199	GG	On-Demand	Anodyne	PREP	49	42
O=C(NCc1ccc(N2CCCC2)nc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875061199	GG	On-Demand	Anodyne	TMPRSS11D	55	33
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)ccc1Cl	ZINC000875061217	JJ	On-Demand	Mild	SCD1	43	48
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)ccc1Cl	ZINC000875061217	JJ	On-Demand	Mild	SCD	35	48
COc1cc(CNC(=O)N2CC=CC2)ccc1OC(C)C	ZINC000875061222	CF	On-Demand	Anodyne	MT-ND1	19	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](CN2CCCC2)c2ccccc2)C1	ZINC000875061303	FD	On-Demand	Anodyne	SLC6A1	117	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](CN2CCCC2)c2ccccc2)C1	ZINC000875061303	FD	On-Demand	Anodyne	CCR5	41	45
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](CN2CCCC2)c2ccccc2)C1	ZINC000875061303	FD	On-Demand	Anodyne	DPP7	44	36
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](CN2CCCC2)c2ccccc2)C1	ZINC000875061303	FD	On-Demand	Anodyne	BIRC2	25	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](CN2CCCC2)c2ccccc2)C1	ZINC000875061304	FD	On-Demand	Anodyne	SLC6A1	117	44
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](CN2CCCC2)c2ccccc2)C1	ZINC000875061304	FD	On-Demand	Anodyne	CCR5	41	45
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](CN2CCCC2)c2ccccc2)C1	ZINC000875061304	FD	On-Demand	Anodyne	DPP7	44	36
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](CN2CCCC2)c2ccccc2)C1	ZINC000875061304	FD	On-Demand	Anodyne	BIRC2	25	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](CN2CCCC2)c2ccccc2)C1	ZINC000875061305	FD	On-Demand	Anodyne	SLC6A1	117	44
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](CN2CCCC2)c2ccccc2)C1	ZINC000875061305	FD	On-Demand	Anodyne	CCR5	41	45
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](CN2CCCC2)c2ccccc2)C1	ZINC000875061305	FD	On-Demand	Anodyne	DPP7	44	36
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](CN2CCCC2)c2ccccc2)C1	ZINC000875061305	FD	On-Demand	Anodyne	BIRC2	25	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](CN2CCCC2)c2ccccc2)C1	ZINC000875061307	FD	On-Demand	Anodyne	SLC6A1	117	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](CN2CCCC2)c2ccccc2)C1	ZINC000875061307	FD	On-Demand	Anodyne	CCR5	41	45
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](CN2CCCC2)c2ccccc2)C1	ZINC000875061307	FD	On-Demand	Anodyne	DPP7	44	36
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](CN2CCCC2)c2ccccc2)C1	ZINC000875061307	FD	On-Demand	Anodyne	BIRC2	25	40
CCCNC(=O)c1cccc(CNC(=O)C(=O)N2CC[C@H]3[C@H](CCN3C)C2)c1	ZINC000875061341	GC	On-Demand	Anodyne	DRD4	42	32
CCCNC(=O)c1cccc(CNC(=O)C(=O)N2CC[C@@H]3[C@H](CCN3C)C2)c1	ZINC000875061342	GC	On-Demand	Anodyne	DRD4	42	32
CCCNC(=O)c1cccc(CNC(=O)C(=O)N2CC[C@H]3[C@@H](CCN3C)C2)c1	ZINC000875061343	GC	On-Demand	Anodyne	DRD4	42	32
CCCNC(=O)c1cccc(CNC(=O)C(=O)N2CC[C@@H]3[C@@H](CCN3C)C2)c1	ZINC000875061344	GC	On-Demand	Anodyne	DRD4	42	32
O=C(NCc1ccc(-n2cncn2)nc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875061346	GE	On-Demand	Anodyne	F2	17	40
O=C(NCc1ccc(-n2cncn2)nc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875061346	GE	On-Demand	Anodyne	PREP	17	41
O=C(NCc1ccc(-n2cncn2)nc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875061354	GE	On-Demand	Anodyne	F2	17	40
O=C(NCc1ccc(-n2cncn2)nc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875061354	GE	On-Demand	Anodyne	PREP	17	41
O=C(NCc1ccc(-n2cncn2)nc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875061355	GE	On-Demand	Anodyne	F2	17	40
O=C(NCc1ccc(-n2cncn2)nc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875061355	GE	On-Demand	Anodyne	PREP	17	41
O=C(NCc1ccc(-n2cncn2)nc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875061356	GE	On-Demand	Anodyne	F2	17	40
O=C(NCc1ccc(-n2cncn2)nc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875061356	GE	On-Demand	Anodyne	PREP	17	41
COc1ncccc1CNC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875061380	EE	On-Demand	Anodyne	CCR8	37	41
COc1ncccc1CNC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875061380	EE	On-Demand	Anodyne	KDM1A	16	43
N#Cc1ccc(Cc2cnc(NC(=O)c3ccc(F)c(S(=O)(=O)N4CCCCC4)c3)s2)cc1	ZINC000875061409	JI	On-Demand	Mild	SCD1	41	45
N#Cc1ccc(Cc2cnc(NC(=O)c3ccc(F)c(S(=O)(=O)N4CCCCC4)c3)s2)cc1	ZINC000875061409	JI	On-Demand	Mild	SCD	34	45
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccnc1OC	ZINC000875061413	CD	On-Demand	Anodyne	ANPEP	17	42
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccnc1OC	ZINC000875061413	CD	On-Demand	Anodyne	CAPN2	44	35
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccnc(OCc2ccccc2)c1	ZINC000875061427	FG	On-Demand	Anodyne	ANPEP	16	40
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccnc(OCc2ccccc2)c1	ZINC000875061427	FG	On-Demand	Anodyne	CAPN1	48	38
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccnc(OCc2ccccc2)c1	ZINC000875061427	FG	On-Demand	Anodyne	CAPN2	91	39
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccnc(OCc2ccccc2)c1	ZINC000875061427	FG	On-Demand	Anodyne	NPR	46	32
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccnc(OCc2ccccc2)c1	ZINC000875061427	FG	On-Demand	Anodyne	PDS	58	37
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1Cn1cncn1	ZINC000875061452	ED	On-Demand	Anodyne	HIS3	70	40
O=C(NCc1ccnc(OC2CCCC2)c1)N1CCC(CO)(CO)CC1	ZINC000875061458	FD	On-Demand	Anodyne	EPHX2	19	41
CC[C@@H](NC(=O)C(=O)N[C@H](C)CN1CCOCC1)c1cccc(OC)c1OC	ZINC000875061471	GD	On-Demand	Anodyne	PTGDS	36	40
CC[C@@H](NC(=O)C(=O)N[C@@H](C)CN1CCOCC1)c1cccc(OC)c1OC	ZINC000875061472	GD	On-Demand	Anodyne	PTGDS	36	40
O=C(NCc1ccc(N2CCCC2)nc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875061493	GG	On-Demand	Anodyne	F2	28	45
O=C(NCc1ccc(N2CCCC2)nc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875061493	GG	On-Demand	Anodyne	PREP	49	42
O=C(NCc1ccc(N2CCCC2)nc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875061493	GG	On-Demand	Anodyne	TMPRSS11D	55	33
O=C(NCc1ccc(N2CCCC2)nc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875061495	GG	On-Demand	Anodyne	F2	28	45
O=C(NCc1ccc(N2CCCC2)nc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875061495	GG	On-Demand	Anodyne	PREP	49	42
O=C(NCc1ccc(N2CCCC2)nc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875061495	GG	On-Demand	Anodyne	TMPRSS11D	55	33
O=C(NCc1ccc(N2CCCC2)nc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875061497	GG	On-Demand	Anodyne	F2	28	45
O=C(NCc1ccc(N2CCCC2)nc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875061497	GG	On-Demand	Anodyne	PREP	49	42
O=C(NCc1ccc(N2CCCC2)nc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875061497	GG	On-Demand	Anodyne	TMPRSS11D	55	33
C#CC[C@H](COC)NC(=O)C(=O)NCCCN1CCc2ccccc2C1	ZINC000875061514	FC	On-Demand	Mild	DRD2	26	42
C#CC[C@H](COC)NC(=O)C(=O)NCCCN1CCc2ccccc2C1	ZINC000875061514	FC	On-Demand	Mild	DRD4	17	40
C#CC[C@H](COC)NC(=O)C(=O)NCCCN1CCc2ccccc2C1	ZINC000875061514	FC	On-Demand	Mild	DRD3	47	44
C#CC[C@H](COC)NC(=O)C(=O)NCCCN1CCc2ccccc2C1	ZINC000875061514	FC	On-Demand	Mild	HTR7	27	43
C#CC[C@H](COC)NC(=O)C(=O)NCCCN1CCc2ccccc2C1	ZINC000875061514	FC	On-Demand	Mild	NOD2	40	36
C#CC[C@@H](COC)NC(=O)C(=O)NCCCN1CCc2ccccc2C1	ZINC000875061515	FC	On-Demand	Mild	DRD2	26	42
C#CC[C@@H](COC)NC(=O)C(=O)NCCCN1CCc2ccccc2C1	ZINC000875061515	FC	On-Demand	Mild	DRD4	17	40
C#CC[C@@H](COC)NC(=O)C(=O)NCCCN1CCc2ccccc2C1	ZINC000875061515	FC	On-Demand	Mild	DRD3	47	44
C#CC[C@@H](COC)NC(=O)C(=O)NCCCN1CCc2ccccc2C1	ZINC000875061515	FC	On-Demand	Mild	HTR7	27	43
C#CC[C@@H](COC)NC(=O)C(=O)NCCCN1CCc2ccccc2C1	ZINC000875061515	FC	On-Demand	Mild	NOD2	40	36
CC[C@@H](NC(=O)C(=O)NCCN1CCC[C@H](C)C1)c1cccc(OC)c1OC	ZINC000875061539	GE	On-Demand	Anodyne	HTR1A	27	40
CC[C@@H](NC(=O)C(=O)NCCN1CCC[C@H](C)C1)c1cccc(OC)c1OC	ZINC000875061539	GE	On-Demand	Anodyne	DRD2	38	42
CC[C@@H](NC(=O)C(=O)NCCN1CCC[C@H](C)C1)c1cccc(OC)c1OC	ZINC000875061539	GE	On-Demand	Anodyne	DRD4	40	30
CC[C@@H](NC(=O)C(=O)NCCN1CCC[C@H](C)C1)c1cccc(OC)c1OC	ZINC000875061539	GE	On-Demand	Anodyne	SLC6A1	61	37
CC[C@@H](NC(=O)C(=O)NCCN1CCC[C@@H](C)C1)c1cccc(OC)c1OC	ZINC000875061540	GE	On-Demand	Anodyne	HTR1A	27	40
CC[C@@H](NC(=O)C(=O)NCCN1CCC[C@@H](C)C1)c1cccc(OC)c1OC	ZINC000875061540	GE	On-Demand	Anodyne	DRD2	38	42
CC[C@@H](NC(=O)C(=O)NCCN1CCC[C@@H](C)C1)c1cccc(OC)c1OC	ZINC000875061540	GE	On-Demand	Anodyne	DRD4	40	30
CC[C@@H](NC(=O)C(=O)NCCN1CCC[C@@H](C)C1)c1cccc(OC)c1OC	ZINC000875061540	GE	On-Demand	Anodyne	SLC6A1	61	37
O=C(NCc1ccc(N2CCCC2)nc1)N1Cc2cccc(O)c2C1	ZINC000875061563	EF	On-Demand	Clean	NAMPT	41	44
CC(=O)C1CCN(C(=O)C(=O)NCCCN2CCc3ccccc3C2)CC1	ZINC000875061582	FD	On-Demand	Anodyne	HTR1A	18	45
CC(=O)C1CCN(C(=O)C(=O)NCCCN2CCc3ccccc3C2)CC1	ZINC000875061582	FD	On-Demand	Anodyne	DRD2	16	42
CC(=O)C1CCN(C(=O)C(=O)NCCCN2CCc3ccccc3C2)CC1	ZINC000875061582	FD	On-Demand	Anodyne	DRD3	26	51
CC(=O)C1CCN(C(=O)C(=O)NCCCN2CCc3ccccc3C2)CC1	ZINC000875061582	FD	On-Demand	Anodyne	HTR7	33	50
O=C(NCCCN1CCc2ccccc2C1)C(=O)NCC[C@H]1CCSC1	ZINC000875061588	GD	On-Demand	Anodyne	HTR1A	18	44
O=C(NCCCN1CCc2ccccc2C1)C(=O)NCC[C@H]1CCSC1	ZINC000875061588	GD	On-Demand	Anodyne	DRD3	18	48
O=C(NCCCN1CCc2ccccc2C1)C(=O)NCC[C@H]1CCSC1	ZINC000875061588	GD	On-Demand	Anodyne	HTR7	27	47
O=C(NCCCN1CCc2ccccc2C1)C(=O)NCC[C@@H]1CCSC1	ZINC000875061589	GD	On-Demand	Anodyne	HTR1A	18	44
O=C(NCCCN1CCc2ccccc2C1)C(=O)NCC[C@@H]1CCSC1	ZINC000875061589	GD	On-Demand	Anodyne	DRD3	18	48
O=C(NCCCN1CCc2ccccc2C1)C(=O)NCC[C@@H]1CCSC1	ZINC000875061589	GD	On-Demand	Anodyne	HTR7	27	47
CC[C@@H](NC(=O)NCc1ccc(N2CCCC2)nc1)[C@@H](O)c1ccccc1	ZINC000875061602	FF	On-Demand	Anodyne	KCNQ2	49	36
CC[C@@H](NC(=O)NCc1ccc(N2CCCC2)nc1)[C@H](O)c1ccccc1	ZINC000875061603	FF	On-Demand	Anodyne	KCNQ2	49	36
O=C(NCCO)C1CCN(C(=O)NCc2ccc(N3CCCC3)nc2)CC1	ZINC000875061604	GC	On-Demand	Anodyne	GPBAR1	24	40
O=C(NCc1cccnc1N1CCOCC1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875061609	GF	On-Demand	Anodyne	SCN10A	26	49
O=C(NCc1cccnc1N1CCOCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875061610	GE	On-Demand	Anodyne	SCN10A	20	43
O=C(NCc1cccnc1N1CCOCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875061611	GE	On-Demand	Anodyne	SCN10A	20	43
O=C(NCc1cccnc1N1CCOCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875061612	GE	On-Demand	Anodyne	SCN10A	20	43
O=C(NCc1cccnc1N1CCOCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875061613	GE	On-Demand	Anodyne	SCN10A	20	43
O=C(NCc1cccnc1N1CCOCC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875061615	ED	On-Demand	Anodyne	SCN10A	20	46
O=C(NCc1cccnc1N1CCOCC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875061616	ED	On-Demand	Anodyne	SCN10A	20	46
O=C(NCc1cccnc1N1CCOCC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875061617	ED	On-Demand	Anodyne	SCN10A	20	46
O=C(NCc1cccnc1N1CCOCC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875061618	ED	On-Demand	Anodyne	SCN10A	20	46
O=C(NCc1cccnc1N1CCOCC1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875061619	FE	On-Demand	Anodyne	MTOR	40	35
O=C(NCc1cccnc1N1CCOCC1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875061619	FE	On-Demand	Anodyne	SCN10A	20	46
O=C(NCc1cccnc1N1CCOCC1)NC1([C@H]2CCCCO2)CCC1	ZINC000875061620	FE	On-Demand	Anodyne	MTOR	40	35
O=C(NCc1cccnc1N1CCOCC1)NC1([C@H]2CCCCO2)CCC1	ZINC000875061620	FE	On-Demand	Anodyne	SCN10A	20	46
COc1ncccc1CNC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875061675	CD	On-Demand	Anodyne	EPHX2	17	50
COc1ncccc1CNC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875061676	CD	On-Demand	Anodyne	EPHX2	17	50
O=C1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)CCCCCCN1	ZINC000875061687	GF	On-Demand	Anodyne	HRH2	31	42
O=C1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)CCCCCCN1	ZINC000875061687	GF	On-Demand	Anodyne	CHRM3	18	43
O=C1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)CCCCCCN1	ZINC000875061687	GF	On-Demand	Anodyne	BDKRB1	42	38
COc1ncccc1CNC(=O)N1Cc2cccc(O)c2C1	ZINC000875061692	CE	On-Demand	Clean	KDM1A	15	42
COc1ncccc1CNC(=O)N1Cc2cccc(O)c2C1	ZINC000875061692	CE	On-Demand	Clean	NAMPT	16	42
O=C(NCc1cccnc1N1CCOCC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875061694	GD	On-Demand	Anodyne	EPHX2	17	45
O=C(NCc1cccnc1N1CCOCC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875061694	GD	On-Demand	Anodyne	SCN10A	21	48
O=C(NCc1cccnc1N1CCOCC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875061695	GD	On-Demand	Anodyne	EPHX2	17	45
O=C(NCc1cccnc1N1CCOCC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875061695	GD	On-Demand	Anodyne	SCN10A	21	48
CCC1(CC)CCCN1C(=O)NCc1cccnc1N1CCOCC1	ZINC000875061698	EF	On-Demand	Anodyne	SCN10A	21	46
O=C(NCc1cccnc1N1CCOCC1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875061699	GD	On-Demand	Anodyne	TRPV1	15	43
O=C(NCc1cccnc1N1CCOCC1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875061699	GD	On-Demand	Anodyne	SCN10A	23	45
O=C(NCc1cccnc1N1CCOCC1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875061700	GD	On-Demand	Anodyne	TRPV1	15	43
O=C(NCc1cccnc1N1CCOCC1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875061700	GD	On-Demand	Anodyne	SCN10A	23	45
N#Cc1ccc(Cc2cnc(NC(=O)c3cc(-c4ccncc4)nc4ccccc34)s2)cc1	ZINC000875061726	IK	On-Demand	Mild	TACR3	15	43
O=C(NCc1ccc(N2CCCC2)nc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875061733	FF	On-Demand	Anodyne	DGAT1	15	40
O=C(NCc1ccc(N2CCCC2)nc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875061734	FF	On-Demand	Anodyne	DGAT1	15	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(N2CCC(C)CC2)nc1	ZINC000875061739	GF	On-Demand	Anodyne	SLC6A3	41	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(N2CCC(C)CC2)nc1	ZINC000875061741	GF	On-Demand	Anodyne	SLC6A3	41	37
O=C(NCCCN1CCc2ccccc2C1)C(=O)NCc1ncc(Cl)s1	ZINC000875061788	GD	On-Demand	Anodyne	HTR1A	26	44
O=C(NCCCN1CCc2ccccc2C1)C(=O)NCc1ncc(Cl)s1	ZINC000875061788	GD	On-Demand	Anodyne	DRD2	25	43
O=C(NCCCN1CCc2ccccc2C1)C(=O)NCc1ncc(Cl)s1	ZINC000875061788	GD	On-Demand	Anodyne	DRD3	33	46
O=C(NCCCN1CCc2ccccc2C1)C(=O)NCc1ncc(Cl)s1	ZINC000875061788	GD	On-Demand	Anodyne	HTR7	38	45
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC(=O)N(C)Cc2ccccc2)C1	ZINC000875061827	FC	On-Demand	Anodyne	TACR1	19	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC(=O)N(C)Cc2ccccc2)C1	ZINC000875061828	FC	On-Demand	Anodyne	TACR1	19	42
O=C(NCc1ccccc1Cn1cncn1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875061830	GF	On-Demand	Anodyne	HIS3	46	35
O=C(NCc1ccccc1Cn1cncn1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875061831	GF	On-Demand	Anodyne	HIS3	46	35
O=C(NCc1ccccc1Cn1cncn1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875061833	GF	On-Demand	Anodyne	HIS3	46	35
O=C(NCc1ccccc1Cn1cncn1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875061834	GF	On-Demand	Anodyne	HIS3	46	35
COC(=O)N(C)NC(=O)NCc1ccnc(N2CCOCC2)c1	ZINC000875061836	DC	On-Demand	Reactive	EPHB4	75	38
N#Cc1ccc(Cc2cnc(NC(=O)c3cc(-c4cccnc4)nc4ccccc34)s2)cc1	ZINC000875061837	IK	On-Demand	Mild	TACR3	16	43
C[C@H](CN1CCOCC1)NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875061846	GC	On-Demand	Anodyne	CASR	47	36
C[C@H](CN1CCOCC1)NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875061846	GC	On-Demand	Anodyne	PGA5	41	32
C[C@H](CN1CCOCC1)NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875061847	GC	On-Demand	Anodyne	CASR	47	36
C[C@H](CN1CCOCC1)NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875061847	GC	On-Demand	Anodyne	PGA5	41	32
C[C@H](CN1CCOCC1)NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875061848	GC	On-Demand	Anodyne	CASR	47	36
C[C@H](CN1CCOCC1)NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875061848	GC	On-Demand	Anodyne	PGA5	41	32
C[C@H](CN1CCOCC1)NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875061849	GC	On-Demand	Anodyne	CASR	47	36
C[C@H](CN1CCOCC1)NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875061849	GC	On-Demand	Anodyne	PGA5	41	32
O=C(NCc1ccc(N2CCCC2)nc1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875061885	GF	On-Demand	Anodyne	SMO	15	44
O=C(NCc1ccc(N2CCCC2)nc1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875061886	GF	On-Demand	Anodyne	SMO	15	44
COc1ncccc1CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875061914	FF	On-Demand	Anodyne	FKBP1A	55	42
COc1ncccc1CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875061914	FF	On-Demand	Anodyne	CPT1A	67	34
COc1ncccc1CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875061915	FF	On-Demand	Anodyne	FKBP1A	55	42
COc1ncccc1CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875061915	FF	On-Demand	Anodyne	CPT1A	67	34
COc1ncccc1CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875061916	FF	On-Demand	Anodyne	FKBP1A	55	42
COc1ncccc1CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875061916	FF	On-Demand	Anodyne	CPT1A	67	34
COc1ncccc1CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875061917	FF	On-Demand	Anodyne	FKBP1A	55	42
COc1ncccc1CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875061917	FF	On-Demand	Anodyne	CPT1A	67	34
C#CC[C@@H](COC)NC(=O)C(=O)NCc1cccc(C(=O)NCCC)c1	ZINC000875061934	FC	On-Demand	Mild	DRD4	41	32
C#CC[C@H](COC)NC(=O)C(=O)NCc1cccc(C(=O)NCCC)c1	ZINC000875061935	FC	On-Demand	Mild	DRD4	41	32
CCCNC(=O)c1cccc(CNC(=O)C(=O)N2CCC(C(C)=O)CC2)c1	ZINC000875061937	FD	On-Demand	Anodyne	DRD4	43	33
CCCNC(=O)c1cccc(CNC(=O)C(=O)N2CCC(C(C)=O)CC2)c1	ZINC000875061937	FD	On-Demand	Anodyne	CHRM3	15	43
COC(=O)N(C)NC(=O)NCc1cccnc1N1CCOCC1	ZINC000875061953	DC	On-Demand	Reactive	MTOR	44	38
COC(=O)N(C)NC(=O)NCc1cccnc1N1CCOCC1	ZINC000875061953	DC	On-Demand	Reactive	SCN10A	21	48
COC(=O)N(C)NC(=O)NCc1cccnc1N1CCOCC1	ZINC000875061953	DC	On-Demand	Reactive	EPHB4	51	34
O=CN1CCCN(C(=O)NCc2cccnc2OC2CCCC2)CC1	ZINC000875061954	ED	On-Demand	Anodyne	EPHX2	21	49
CCCNC(=O)c1cccc(CNC(=O)C(=O)NCC2(OC(C)C)CCC2)c1	ZINC000875061955	GD	On-Demand	Anodyne	DRD4	40	31
COc1ncccc1CNC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875061956	EF	On-Demand	Anodyne	EPHX2	24	50
COc1ncccc1CNC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875061957	EF	On-Demand	Anodyne	EPHX2	24	50
C[C@H]1CCC[C@@H](C2CN(C(=O)NCc3cccnc3N3CCOCC3)C2)C1	ZINC000875061959	FF	On-Demand	Anodyne	SCN10A	19	43
COc1cc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)ccc1OC(C)C	ZINC000875061992	FG	On-Demand	Anodyne	MT-ND1	23	41
O=C(NCc1ccc(-n2cncn2)nc1)N1CCC[C@@H]1Cn1ccnc1	ZINC000875062031	FD	On-Demand	Anodyne	NOS2	54	34
COc1ncccc1CNC(=O)N1CC[C@H](C(F)(F)F)O[C@@H](C)C1	ZINC000875062045	EE	On-Demand	Anodyne	EPHX2	15	47
COc1ncccc1CNC(=O)N1CC[C@@H](C(F)(F)F)O[C@@H](C)C1	ZINC000875062046	EE	On-Demand	Anodyne	EPHX2	15	47
COc1ncccc1CNC(=O)N1CC[C@@H](C(F)(F)F)O[C@H](C)C1	ZINC000875062047	EE	On-Demand	Anodyne	EPHX2	15	47
COc1ncccc1CNC(=O)N1CC[C@H](C(F)(F)F)O[C@H](C)C1	ZINC000875062048	EE	On-Demand	Anodyne	EPHX2	15	47
O=C1CCN(C(=O)NCc2cccnc2N2CCOCC2)CCCCCCN1	ZINC000875062051	GD	On-Demand	Anodyne	SCN10A	21	45
CCCCCCCNC(=O)C(=O)NCc1cccc(C(=O)N(C)C)c1	ZINC000875062052	EE	On-Demand	Mild	ASAH1	76	34
N#Cc1ccc(Cc2cnc(NC(=O)c3cc[n+]([O-])cc3)s2)cc1	ZINC000875062072	EE	On-Demand	Mild	SCD1	39	40
N#Cc1ccc(Cc2cnc(NC(=O)c3cc[n+]([O-])cc3)s2)cc1	ZINC000875062072	EE	On-Demand	Mild	SCD	33	40
C[C@H](NC(=O)C(=O)NCCCN1CCc2ccccc2C1)c1ccnn1C	ZINC000875062155	FD	On-Demand	Anodyne	HTR1A	20	41
C[C@H](NC(=O)C(=O)NCCCN1CCc2ccccc2C1)c1ccnn1C	ZINC000875062155	FD	On-Demand	Anodyne	DRD3	30	48
C[C@H](NC(=O)C(=O)NCCCN1CCc2ccccc2C1)c1ccnn1C	ZINC000875062155	FD	On-Demand	Anodyne	HTR7	24	47
O=C(NCc1cccnc1N1CCOCC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875062174	GE	On-Demand	Anodyne	EPHX2	15	49
O=C(NCc1cccnc1N1CCOCC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875062174	GE	On-Demand	Anodyne	SCN10A	21	46
O=C(NCc1cccnc1N1CCOCC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875062175	GE	On-Demand	Anodyne	EPHX2	15	49
O=C(NCc1cccnc1N1CCOCC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875062175	GE	On-Demand	Anodyne	SCN10A	21	46
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(N3CCCC3)nc2)C1	ZINC000875062186	FE	On-Demand	Anodyne	DGAT1	16	40
CCCNC(=O)c1cccc(CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)c1	ZINC000875062207	FD	On-Demand	Anodyne	DRD4	40	31
CCCNC(=O)c1cccc(CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)c1	ZINC000875062207	FD	On-Demand	Anodyne	PREP	24	40
CCCNC(=O)c1cccc(CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)c1	ZINC000875062209	FD	On-Demand	Anodyne	DRD4	40	31
CCCNC(=O)c1cccc(CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)c1	ZINC000875062209	FD	On-Demand	Anodyne	PREP	24	40
C[C@H](CN1CCOCC1)NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875062234	FC	On-Demand	Anodyne	OXTR	52	36
C[C@H](CN1CCOCC1)NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875062237	FC	On-Demand	Anodyne	OXTR	52	36
O=C(NCc1cccnc1N1CCOCC1)NNc1cccc(F)c1Cl	ZINC000875062283	GF	On-Demand	Reactive	TRPV1	15	44
O=C(NCc1cccnc1N1CCOCC1)NNc1cccc(F)c1Cl	ZINC000875062283	GF	On-Demand	Reactive	P2RX7	19	45
O=C(NCc1cccnc1N1CCOCC1)NNc1cccc(F)c1Cl	ZINC000875062283	GF	On-Demand	Reactive	SCN10A	22	51
O=C(NCc1cccnc1N1CCOCC1)NNc1cccc(F)c1Cl	ZINC000875062283	GF	On-Demand	Reactive	STAT6	40	37
O=C(NCc1ccnc(-n2cccn2)c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875062299	GF	On-Demand	Anodyne	ADAM17	15	42
O=C(NCc1ccnc(-n2cccn2)c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875062299	GF	On-Demand	Anodyne	PREP	29	41
O=C(NCc1ccnc(-n2cccn2)c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875062300	GF	On-Demand	Anodyne	ADAM17	15	42
O=C(NCc1ccnc(-n2cccn2)c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875062300	GF	On-Demand	Anodyne	PREP	29	41
O=C(NCc1ccnc(-n2cccn2)c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875062301	GF	On-Demand	Anodyne	ADAM17	15	42
O=C(NCc1ccnc(-n2cccn2)c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875062301	GF	On-Demand	Anodyne	PREP	29	41
O=C(NCc1ccnc(-n2cccn2)c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875062302	GF	On-Demand	Anodyne	ADAM17	15	42
O=C(NCc1ccnc(-n2cccn2)c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875062302	GF	On-Demand	Anodyne	PREP	29	41
COc1ncccc1CNC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875062331	ED	On-Demand	Anodyne	EPHX2	21	48
COc1ncccc1CNC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875062332	ED	On-Demand	Anodyne	EPHX2	21	48
O=C(NCc1cccnc1N1CCOCC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875062348	GE	On-Demand	Anodyne	SCN10A	20	44
O=C(NCc1cccnc1N1CCOCC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875062348	GE	On-Demand	Anodyne	STAT6	51	36
N#Cc1ccc(Cc2cnc(NC(=O)/C=C/c3cccs3)s2)cc1	ZINC000875062354	FI	On-Demand	Mild	SCD	28	42
N#Cc1ccc(Cc2cnc(NC(=O)/C=C\c3cccs3)s2)cc1	ZINC000875062355	FI	On-Demand	Mild	SCD	28	42
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)ccc1F	ZINC000875062392	JI	On-Demand	Mild	SCD1	43	46
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)ccc1F	ZINC000875062392	JI	On-Demand	Mild	SCD	36	47
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccnc(N2CCN(C)CC2)c1	ZINC000875062433	GD	On-Demand	Anodyne	SLC6A3	45	36
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccnc(N2CCN(C)CC2)c1	ZINC000875062434	GD	On-Demand	Anodyne	SLC6A3	45	36
COCC(C)(C)CCNC(=O)C(=O)NCCCN1CCc2ccccc21	ZINC000875062460	FD	On-Demand	Anodyne	DRD2	27	42
COCC(C)(C)CCNC(=O)C(=O)NCCCN1CCc2ccccc21	ZINC000875062460	FD	On-Demand	Anodyne	DRD3	49	38
O=C(NCc1ccc(N2CCCC2)nc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875062481	GG	On-Demand	Anodyne	F2	22	43
O=C(NCc1ccc(N2CCCC2)nc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875062481	GG	On-Demand	Anodyne	PREP	34	40
O=C(NCc1ccc(N2CCCC2)nc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875062482	GG	On-Demand	Anodyne	F2	22	43
O=C(NCc1ccc(N2CCCC2)nc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875062482	GG	On-Demand	Anodyne	PREP	34	40
O=C(NCc1ccc(N2CCCC2)nc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875062483	GG	On-Demand	Anodyne	F2	22	43
O=C(NCc1ccc(N2CCCC2)nc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875062483	GG	On-Demand	Anodyne	PREP	34	40
O=C(NCc1ccc(N2CCCC2)nc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875062485	GG	On-Demand	Anodyne	F2	22	43
O=C(NCc1ccc(N2CCCC2)nc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875062485	GG	On-Demand	Anodyne	PREP	34	40
COc1ncccc1CNC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875062491	DD	On-Demand	Anodyne	EPHX2	15	48
COc1ncccc1CNC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875062493	DD	On-Demand	Anodyne	EPHX2	15	48
CC[C@H](C)NC(=O)c1cccc(CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)c1	ZINC000875062495	GD	On-Demand	Anodyne	PREP	21	42
O=C(NCc1ccnc(N2CCOCC2)c1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875062496	GE	On-Demand	Anodyne	STAT6	48	35
O=C(NCCCN1CCc2ccccc2C1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875062498	GD	On-Demand	Anodyne	HTR7	17	44
CC[C@H](C)NC(=O)c1cccc(CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)c1	ZINC000875062499	GD	On-Demand	Anodyne	PREP	21	42
O=C(NCCCN1CCc2ccccc2C1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875062507	GD	On-Demand	Anodyne	HTR7	17	44
O=C(NCCCN1CCc2ccccc2C1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875062508	GD	On-Demand	Anodyne	HTR7	17	44
O=C(NCCCN1CCc2ccccc2C1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875062509	GD	On-Demand	Anodyne	HTR7	17	44
O=C(NCc1cccnc1OCC(F)(F)F)N1CCC(CO)(CO)CC1	ZINC000875062515	GD	On-Demand	Anodyne	SCN10A	20	46
Cn1nc(C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)c2ccccc2c1=O	ZINC000875062517	HG	On-Demand	Mild	IMDH_CRYPV	25	48
O=C(NCc1ccc(N2CCCCCC2)nc1)N1Cc2cccc(O)c2C1	ZINC000875062518	FG	On-Demand	Clean	NAMPT	40	43
COc1ncccc1CNC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875062543	EE	On-Demand	Anodyne	EPHX2	16	49
COc1ncccc1CNC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875062544	EE	On-Demand	Anodyne	EPHX2	16	49
CCCNC(=O)c1cccc(CNC(=O)C(=O)N2C[C@@H](OC)CC[C@H]2C)c1	ZINC000875062545	GD	On-Demand	Anodyne	DRD4	44	33
CCCNC(=O)c1cccc(CNC(=O)C(=O)N2C[C@H](OC)CC[C@H]2C)c1	ZINC000875062546	GD	On-Demand	Anodyne	DRD4	44	33
CCCNC(=O)c1cccc(CNC(=O)C(=O)N2C[C@H](OC)CC[C@@H]2C)c1	ZINC000875062547	GD	On-Demand	Anodyne	DRD4	44	33
CCCNC(=O)c1cccc(CNC(=O)C(=O)N2C[C@@H](OC)CC[C@@H]2C)c1	ZINC000875062548	GD	On-Demand	Anodyne	DRD4	44	33
COc1ccc([C@@H]2CN(C(=O)C(=O)N[C@H](C)CN3CCOCC3)CCO2)cc1	ZINC000875062566	GC	On-Demand	Anodyne	PTGDS	19	41
COc1ccc([C@@H]2CN(C(=O)C(=O)N[C@@H](C)CN3CCOCC3)CCO2)cc1	ZINC000875062568	GC	On-Demand	Anodyne	PTGDS	19	41
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3cccnc3N3CCOCC3)C[C@@H]1C2	ZINC000875062582	FD	On-Demand	Anodyne	SCN10A	19	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccnc1N1CCOCC1	ZINC000875062598	ED	On-Demand	Anodyne	SCN10A	21	46
O=C(NCc1ccnc(-n2cccn2)c1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875062623	GE	On-Demand	Anodyne	FAAH	18	45
CCCNC(=O)c1cccc(CNC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)c1	ZINC000875062625	FD	On-Demand	Anodyne	DRD4	40	30
O=CN1CCCN(C(=O)NCc2cccnc2N2CCOCC2)CC1	ZINC000875062638	EC	On-Demand	Anodyne	SCN10A	22	48
N#Cc1ccc(Cc2cnc(NC(=O)/C=C/c3cccc(F)c3)s2)cc1	ZINC000875062672	FI	On-Demand	Mild	HPSE	23	40
N#Cc1ccc(Cc2cnc(NC(=O)/C=C/c3cccc(F)c3)s2)cc1	ZINC000875062672	FI	On-Demand	Mild	SCD	30	50
N#Cc1ccc(Cc2cnc(NC(=O)/C=C\c3cccc(F)c3)s2)cc1	ZINC000875062673	FI	On-Demand	Mild	HPSE	23	40
N#Cc1ccc(Cc2cnc(NC(=O)/C=C\c3cccc(F)c3)s2)cc1	ZINC000875062673	FI	On-Demand	Mild	SCD	30	50
O=C(NCc1ccc(-n2cncn2)nc1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875062683	GD	On-Demand	Anodyne	NAMPT	26	40
O=C(NCc1ccc(-n2cncn2)nc1)NC1CC(Nc2ccccc2)C1	ZINC000875062693	FE	On-Demand	Anodyne	NAMPT	21	41
O=C(NCc1ccc(OC2CCCC2)nc1)N1Cc2cccc(O)c2C1	ZINC000875062697	FG	On-Demand	Clean	NAMPT	25	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC(C)C)c(OC)c1	ZINC000875062698	GF	On-Demand	Anodyne	SLC6A4	31	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC(C)C)c(OC)c1	ZINC000875062698	GF	On-Demand	Anodyne	SLC6A3	59	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC(C)C)c(OC)c1	ZINC000875062699	GF	On-Demand	Anodyne	SLC6A4	31	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC(C)C)c(OC)c1	ZINC000875062699	GF	On-Demand	Anodyne	SLC6A3	59	42
O=C(NCc1ccccc1Cn1cncn1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875062702	GE	On-Demand	Anodyne	HIS3	40	37
O=C(NCc1ccccc1Cn1cncn1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875062703	GE	On-Demand	Anodyne	HIS3	40	37
O=C(NCc1ccc(N2CCCCCC2)nc1)N1CCC(CO)(CO)CC1	ZINC000875062708	GD	On-Demand	Anodyne	NAMPT	40	38
O=C(NCc1ccc(N2CCCC2)nc1)NC1CC(Nc2ccccc2)C1	ZINC000875062710	FG	On-Demand	Anodyne	NAMPT	39	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000875062732	FD	On-Demand	Anodyne	HTR1A	15	47
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000875062732	FD	On-Demand	Anodyne	SLC6A1	74	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000875062732	FD	On-Demand	Anodyne	DRD3	15	48
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000875062732	FD	On-Demand	Anodyne	HTR7	30	44
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000875062733	FD	On-Demand	Anodyne	HTR1A	15	47
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000875062733	FD	On-Demand	Anodyne	SLC6A1	74	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000875062733	FD	On-Demand	Anodyne	DRD3	15	48
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000875062733	FD	On-Demand	Anodyne	HTR7	30	44
COCC(C)(C)CCNC(=O)C(=O)NCCCN1CCc2ccccc2C1	ZINC000875062751	GD	On-Demand	Anodyne	HTR1A	34	43
COCC(C)(C)CCNC(=O)C(=O)NCCCN1CCc2ccccc2C1	ZINC000875062751	GD	On-Demand	Anodyne	DRD2	38	46
COCC(C)(C)CCNC(=O)C(=O)NCCCN1CCc2ccccc2C1	ZINC000875062751	GD	On-Demand	Anodyne	DRD4	40	32
COCC(C)(C)CCNC(=O)C(=O)NCCCN1CCc2ccccc2C1	ZINC000875062751	GD	On-Demand	Anodyne	DRD3	67	51
COCC(C)(C)CCNC(=O)C(=O)NCCCN1CCc2ccccc2C1	ZINC000875062751	GD	On-Demand	Anodyne	HTR7	39	47
COCC(C)(C)CCNC(=O)C(=O)NCCCN1CCc2ccccc2C1	ZINC000875062751	GD	On-Demand	Anodyne	NOD2	44	39
CN1CC[C@H]2CN(C(=O)C(=O)NCCCN3CCc4ccccc4C3)CC[C@@H]21	ZINC000875062777	GD	On-Demand	Anodyne	HTR1A	18	42
CN1CC[C@H]2CN(C(=O)C(=O)NCCCN3CCc4ccccc4C3)CC[C@@H]21	ZINC000875062777	GD	On-Demand	Anodyne	DRD2	18	43
CN1CC[C@H]2CN(C(=O)C(=O)NCCCN3CCc4ccccc4C3)CC[C@@H]21	ZINC000875062777	GD	On-Demand	Anodyne	DRD3	28	45
CN1CC[C@H]2CN(C(=O)C(=O)NCCCN3CCc4ccccc4C3)CC[C@@H]21	ZINC000875062777	GD	On-Demand	Anodyne	HTR7	29	44
CN1CC[C@H]2CN(C(=O)C(=O)NCCCN3CCc4ccccc4C3)CC[C@@H]21	ZINC000875062777	GD	On-Demand	Anodyne	NOD2	41	34
CC[C@@H]1COCCN1CCNC(=O)NCc1cccnc1N1CCOCC1	ZINC000875062781	GC	On-Demand	Anodyne	SCN10A	19	44
CN1CC[C@H]2CN(C(=O)C(=O)NCCCN3CCc4ccccc4C3)CC[C@H]21	ZINC000875062782	GD	On-Demand	Anodyne	HTR1A	18	42
CN1CC[C@H]2CN(C(=O)C(=O)NCCCN3CCc4ccccc4C3)CC[C@H]21	ZINC000875062782	GD	On-Demand	Anodyne	DRD2	18	43
CN1CC[C@H]2CN(C(=O)C(=O)NCCCN3CCc4ccccc4C3)CC[C@H]21	ZINC000875062782	GD	On-Demand	Anodyne	DRD3	28	45
CN1CC[C@H]2CN(C(=O)C(=O)NCCCN3CCc4ccccc4C3)CC[C@H]21	ZINC000875062782	GD	On-Demand	Anodyne	HTR7	29	44
CN1CC[C@H]2CN(C(=O)C(=O)NCCCN3CCc4ccccc4C3)CC[C@H]21	ZINC000875062782	GD	On-Demand	Anodyne	NOD2	41	34
CN1CC[C@H]2CN(C(=O)C(=O)NCc3cccc(C(N)=O)c3)CC[C@@H]21	ZINC000875062845	EB	On-Demand	Anodyne	ST14	61	33
CN1CC[C@H]2CN(C(=O)C(=O)NCc3cccc(C(N)=O)c3)CC[C@H]21	ZINC000875062849	EB	On-Demand	Anodyne	ST14	61	33
N#Cc1ccc(Cc2cnc(NC(=O)C(O)(c3ccccc3)c3ccccc3)s2)cc1	ZINC000875062863	II	On-Demand	Mild	CDK5	19	41
COc1ncccc1CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875062881	EE	On-Demand	Anodyne	PREP	41	38
COc1ncccc1CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875062882	EE	On-Demand	Anodyne	PREP	41	38
COc1ncccc1CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875062883	EE	On-Demand	Anodyne	PREP	41	38
COc1ncccc1CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875062884	EE	On-Demand	Anodyne	PREP	41	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2cccc(C(=O)N(C)C)c2)C1	ZINC000875062897	FC	On-Demand	Anodyne	PREP	27	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2cccc(C(=O)N(C)C)c2)C1	ZINC000875062899	FC	On-Demand	Anodyne	PREP	27	40
O=C(NCc1ccc(OC2CCCC2)nc1)N1CCC(CO)(CO)CC1	ZINC000875062932	FD	On-Demand	Anodyne	EPHX2	18	40
CC[C@@H](NC(=O)NCc1ccccc1Cn1cncn1)[C@@H](O)c1ccccc1	ZINC000875062950	GF	On-Demand	Anodyne	HIS3	53	37
CC[C@@H](NC(=O)NCc1ccccc1Cn1cncn1)[C@H](O)c1ccccc1	ZINC000875062952	GF	On-Demand	Anodyne	HIS3	53	37
O=C(NCc1ccnc(-n2cccn2)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875062964	FF	On-Demand	Anodyne	EPHX2	21	42
O=C(NCc1ccnc(-n2cccn2)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875062965	FF	On-Demand	Anodyne	EPHX2	21	42
CCO[C@@H](C(=O)Nc1cc(S(C)(=O)=O)ccc1C)C1CCOCC1	ZINC000875062987	FE	On-Demand	Anodyne	GCK	19	43
C[C@H](CN1CCOCC1)NC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875062999	GC	On-Demand	Anodyne	P2RX3	29	41
C[C@H](CN1CCOCC1)NC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875062999	GC	On-Demand	Anodyne	NPY2R	45	35
O=C(NCc1ccnc(N2CCOCC2)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875063012	GF	On-Demand	Anodyne	EPHX2	17	40
O=C(NCc1ccnc(N2CCOCC2)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875063013	GF	On-Demand	Anodyne	EPHX2	17	40
O=C(NCc1ccnc(N2CCOCC2)c1)N1Cc2cccc(O)c2C1	ZINC000875063028	FD	On-Demand	Clean	NAMPT	30	42
O=C(NCCCN1CCc2ccccc2C1)C(=O)N[C@H]1CC12CCC2	ZINC000875063042	ED	On-Demand	Anodyne	HTR1A	29	46
O=C(NCCCN1CCc2ccccc2C1)C(=O)N[C@H]1CC12CCC2	ZINC000875063042	ED	On-Demand	Anodyne	DRD2	23	40
O=C(NCCCN1CCc2ccccc2C1)C(=O)N[C@H]1CC12CCC2	ZINC000875063042	ED	On-Demand	Anodyne	HTR2A	17	46
O=C(NCCCN1CCc2ccccc2C1)C(=O)N[C@H]1CC12CCC2	ZINC000875063042	ED	On-Demand	Anodyne	DRD3	35	48
O=C(NCCCN1CCc2ccccc2C1)C(=O)N[C@H]1CC12CCC2	ZINC000875063042	ED	On-Demand	Anodyne	HTR7	38	47
O=C(NCCCN1CCc2ccccc2C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063043	ED	On-Demand	Anodyne	HTR1A	29	46
O=C(NCCCN1CCc2ccccc2C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063043	ED	On-Demand	Anodyne	DRD2	23	40
O=C(NCCCN1CCc2ccccc2C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063043	ED	On-Demand	Anodyne	HTR2A	17	46
O=C(NCCCN1CCc2ccccc2C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063043	ED	On-Demand	Anodyne	DRD3	35	48
O=C(NCCCN1CCc2ccccc2C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063043	ED	On-Demand	Anodyne	HTR7	38	47
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2cccc(C(=O)N(C)C)c2)C1	ZINC000875063079	FD	On-Demand	Anodyne	HCRTR2	18	40
COc1ncccc1CNC(=O)N(C)OCC(F)(F)F	ZINC000875063084	CD	On-Demand	Anodyne	SCN10A	15	43
COc1ncccc1CNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875063087	EE	On-Demand	Anodyne	SCN10A	23	41
COc1ncccc1CNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875063087	EE	On-Demand	Anodyne	PDS	53	37
COc1ncccc1CNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875063088	EE	On-Demand	Anodyne	SCN10A	23	41
COc1ncccc1CNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875063088	EE	On-Demand	Anodyne	PDS	53	37
CCCNC(=O)c1cccc(CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875063091	GD	On-Demand	Anodyne	DRD4	42	32
CCCNC(=O)c1cccc(CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875063091	GD	On-Demand	Anodyne	CACNA1I	40	33
CCCNC(=O)c1cccc(CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875063092	GD	On-Demand	Anodyne	DRD4	42	32
CCCNC(=O)c1cccc(CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875063092	GD	On-Demand	Anodyne	CACNA1I	40	33
O=C(NCc1cccnc1OC1CCCC1)N1CCC(CO)(CO)CC1	ZINC000875063099	FD	On-Demand	Anodyne	EPHX2	23	47
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccnc2N2CCOCC2)C1	ZINC000875063102	GD	On-Demand	Anodyne	P2RY12	15	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccnc2N2CCOCC2)C1	ZINC000875063102	GD	On-Demand	Anodyne	SCN10A	22	43
C[C@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccc(Cl)s1	ZINC000875063140	GD	On-Demand	Anodyne	L3MBTL3	47	41
O=C(NCc1cccnc1OC1CCCC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875063150	GG	On-Demand	Anodyne	EPHX2	22	51
O=C(NCc1cccnc1OC1CCCC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875063151	GG	On-Demand	Anodyne	EPHX2	22	51
O=C(NCc1ccnc(OCC(F)(F)F)c1)N1Cc2cccc(O)c2C1	ZINC000875063152	FF	On-Demand	Clean	NAMPT	22	41
COc1ncccc1CNC(=O)N[C@H](C)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875063158	FE	On-Demand	Anodyne	GPR119	19	41
COc1ncccc1CNC(=O)N[C@@H](C)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875063159	FE	On-Demand	Anodyne	GPR119	19	41
COC(=O)N(C)NC(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875063168	DD	On-Demand	Reactive	ACHE	16	48
COC(=O)N(C)NC(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875063168	DD	On-Demand	Reactive	HRH2	38	49
COC(=O)N(C)NC(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875063168	DD	On-Demand	Reactive	CHRM3	19	43
COC(=O)N(C)NC(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875063168	DD	On-Demand	Reactive	HRH3	15	44
COC(=O)N(C)NC(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875063168	DD	On-Demand	Reactive	MCHR1	17	45
COC(=O)N(C)NC(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875063168	DD	On-Demand	Reactive	NPFFR1	41	38
NC(=O)c1cccc(CNC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)c1	ZINC000875063170	EC	On-Demand	Anodyne	TRY2_BOVIN	58	34
O=C(NCc1cccnc1N1CCOCC1)N1Cc2cccc(O)c2C1	ZINC000875063171	FD	On-Demand	Clean	SCN10A	21	49
O=C(NCc1cccnc1N1CCOCC1)N1Cc2cccc(O)c2C1	ZINC000875063171	FD	On-Demand	Clean	NAMPT	27	42
CC[C@H](C)NC(=O)c1cccc(CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875063185	GD	On-Demand	Anodyne	ST14	44	33
CC[C@H](C)NC(=O)c1cccc(CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875063185	GD	On-Demand	Anodyne	CACNA1I	42	37
CC[C@H](C)NC(=O)c1cccc(CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875063186	GD	On-Demand	Anodyne	ST14	44	33
CC[C@H](C)NC(=O)c1cccc(CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875063186	GD	On-Demand	Anodyne	CACNA1I	42	37
CN1CCN(C(=O)NCc2cccnc2N2CCOCC2)CCC1(C)C	ZINC000875063202	FD	On-Demand	Anodyne	SCN10A	20	46
O=C(NCc1ccc(OCC(F)(F)F)nc1)N1Cc2cccc(O)c2C1	ZINC000875063216	FF	On-Demand	Clean	NAMPT	27	41
O=C(NCc1cccc(CN2CCCC2)c1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875063224	GF	On-Demand	Anodyne	HRH2	28	43
O=C(NCc1cccc(CN2CCCC2)c1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875063224	GF	On-Demand	Anodyne	CHRM3	15	40
O=C(NCc1cccc(CN2CCCC2)c1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875063225	GF	On-Demand	Anodyne	HRH2	28	43
O=C(NCc1cccc(CN2CCCC2)c1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875063225	GF	On-Demand	Anodyne	CHRM3	15	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccnc1OC	ZINC000875063228	DD	On-Demand	Anodyne	SLC6A3	47	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccnc1OC	ZINC000875063229	DD	On-Demand	Anodyne	SLC6A3	47	39
O=C(NCc1cccnc1N1CCOCC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875063231	FD	On-Demand	Anodyne	SCN10A	21	47
O=C(NCc1cccnc1N1CCOCC1)NC1CC(Nc2ccccc2)C1	ZINC000875063232	GE	On-Demand	Anodyne	MTOR	43	37
O=C(NCc1cccnc1N1CCOCC1)NC1CC(Nc2ccccc2)C1	ZINC000875063232	GE	On-Demand	Anodyne	EPHX2	17	40
O=C(NCc1cccnc1N1CCOCC1)NC1CC(Nc2ccccc2)C1	ZINC000875063232	GE	On-Demand	Anodyne	SCN10A	20	46
CN(C)C(=O)c1cccc(CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875063243	FC	On-Demand	Anodyne	ST14	43	33
CN(C)C(=O)c1cccc(CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875063244	FC	On-Demand	Anodyne	ST14	43	33
NC(=O)c1cccc(CNC(=O)C(=O)N2CC[C@H]3CSC[C@@H]3C2)c1	ZINC000875063258	EC	On-Demand	Anodyne	ST14	57	33
NC(=O)c1cccc(CNC(=O)C(=O)N2CC[C@@H]3CSC[C@@H]3C2)c1	ZINC000875063259	EC	On-Demand	Anodyne	ST14	57	33
NC(=O)c1cccc(CNC(=O)C(=O)N2CC[C@H]3CSC[C@H]3C2)c1	ZINC000875063260	EC	On-Demand	Anodyne	ST14	57	33
NC(=O)c1cccc(CNC(=O)C(=O)N2CC[C@@H]3CSC[C@H]3C2)c1	ZINC000875063261	EC	On-Demand	Anodyne	ST14	57	33
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccnc1OCC(F)(F)F	ZINC000875063275	EE	On-Demand	Anodyne	SCN10A	15	45
O=C(NCC[C@H](O)C1CCCC1)NCc1cccnc1N1CCOCC1	ZINC000875063294	FD	On-Demand	Anodyne	SCN10A	20	45
O=C(NCC[C@@H](O)C1CCCC1)NCc1cccnc1N1CCOCC1	ZINC000875063295	FD	On-Demand	Anodyne	SCN10A	20	45
CCCCCCCNC(=O)C(=O)NCc1cccc(C(=O)NC)c1	ZINC000875063298	ED	On-Demand	Mild	LPAR2	43	36
CCCCCCCNC(=O)C(=O)NCc1cccc(C(=O)NC)c1	ZINC000875063298	ED	On-Demand	Mild	S1PR2	61	36
CCCCCCCNC(=O)C(=O)NCc1cccc(C(=O)NC)c1	ZINC000875063298	ED	On-Demand	Mild	ASAH1	80	34
O=C(NCc1cccnc1N1CCOCC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875063299	GF	On-Demand	Anodyne	EPHX2	20	48
O=C(NCc1cccnc1N1CCOCC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875063299	GF	On-Demand	Anodyne	SCN10A	20	45
O=C(NCc1cccnc1N1CCOCC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875063300	GF	On-Demand	Anodyne	EPHX2	20	48
O=C(NCc1cccnc1N1CCOCC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875063300	GF	On-Demand	Anodyne	SCN10A	20	45
CC[C@@H](NC(=O)NCc1cccnc1N1CCOCC1)[C@@H](O)c1ccccc1	ZINC000875063321	GE	On-Demand	Anodyne	SCN10A	20	45
CC[C@@H](NC(=O)NCc1cccnc1N1CCOCC1)[C@H](O)c1ccccc1	ZINC000875063324	GE	On-Demand	Anodyne	SCN10A	20	45
CCCNC(=O)c1cccc(CNC(=O)C(=O)N[C@H]2CC23CCC3)c1	ZINC000875063330	ED	On-Demand	Anodyne	DRD4	41	32
CCCNC(=O)c1cccc(CNC(=O)C(=O)N[C@@H]2CC23CCC3)c1	ZINC000875063331	ED	On-Demand	Anodyne	DRD4	41	32
O=CN1CCCN(C(=O)NCc2cccnc2OCC(F)(F)F)CC1	ZINC000875063339	FD	On-Demand	Anodyne	SCN10A	19	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccnc1N1CCOCC1	ZINC000875063340	FD	On-Demand	Anodyne	SCN10A	19	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccnc1N1CCOCC1	ZINC000875063341	FD	On-Demand	Anodyne	SCN10A	19	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccnc(OCc2ccccc2)c1	ZINC000875063344	GF	On-Demand	Anodyne	SLC6A3	42	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccnc(OCc2ccccc2)c1	ZINC000875063345	GF	On-Demand	Anodyne	SLC6A3	42	41
CCCNC(=O)c1cccc(CNC(=O)C(=O)N2CCN(C)C(C)(C)CC2)c1	ZINC000875063355	GD	On-Demand	Anodyne	DRD4	42	32
O=C(NCc1cccnc1N1CCOCC1)NC[C@H]1C[C@H](O)C1	ZINC000875063371	DC	On-Demand	Anodyne	SCN10A	22	49
Cc1nnc(NNC(=O)NCc2cccc(CN3CCCC3)c2)n1C	ZINC000875063390	ED	On-Demand	Reactive	HRH2	37	43
CCN(CC)Cc1cccc(CNC(=O)N2Cc3cccc(O)c3C2)c1	ZINC000875063393	FG	On-Demand	Clean	NAMPT	19	41
O=CN1CCCN(C(=O)NCc2ccc(Oc3ccc(F)cc3)nc2)CC1	ZINC000875063415	FE	On-Demand	Anodyne	MLNR	26	41
COc1cccc(Oc2ccc(CNC(=O)N3CCC[C@H](C(C)(C)O)C3)cn2)c1	ZINC000875063444	GH	On-Demand	Anodyne	CCR3	15	41
COc1cccc(Oc2ccc(CNC(=O)N3CCC[C@@H](C(C)(C)O)C3)cn2)c1	ZINC000875063445	GH	On-Demand	Anodyne	CCR3	15	41
O=C(NC[C@H]1C[C@H](O)C1)NC1CCC(c2ccccc2)CC1	ZINC000875063452	DF	On-Demand	Anodyne	GRIN2B	16	44
O=C(NC[C@H]1C[C@H](O)C1)NC1CCC(c2ccccc2)CC1	ZINC000875063452	DF	On-Demand	Anodyne	SLC18A3	40	36
O=C(NC[C@H]1C[C@H](O)C1)NC1CCC(c2ccccc2)CC1	ZINC000875063452	DF	On-Demand	Anodyne	EPHX2	22	43
O=C(NCc1cccc(CN2CCCC2)c1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875063461	FG	On-Demand	Anodyne	HRH2	28	40
O=C(NCc1cccc(CN2CCCC2)c1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875063461	FG	On-Demand	Anodyne	SIGMAR1	24	44
O=C(NCc1ccsc1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875063469	DF	On-Demand	Anodyne	NPSR1	26	40
O=C(NCc1ccsc1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875063469	DF	On-Demand	Anodyne	SLC12A5	25	41
O=C(NCc1ccsc1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875063470	DF	On-Demand	Anodyne	NPSR1	26	40
O=C(NCc1ccsc1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875063470	DF	On-Demand	Anodyne	SLC12A5	25	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2ccc(-n3nc(C)cc3C)cc2)C1	ZINC000875063483	GD	On-Demand	Anodyne	GPBAR1	23	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2ccc(-n3nc(C)cc3C)cc2)C1	ZINC000875063484	GD	On-Demand	Anodyne	GPBAR1	23	40
COC(=O)c1sccc1NC(=O)Cn1nccc1C	ZINC000875063485	CD	On-Demand	Anodyne	FAS	87	53
O=C(NCc1cccc(CN2CCCC2)c1)N1CCC(CO)(CO)CC1	ZINC000875063490	FD	On-Demand	Anodyne	HRH2	32	48
O=C(NCc1cccc(CN2CCCC2)c1)N1CCC(CO)(CO)CC1	ZINC000875063490	FD	On-Demand	Anodyne	CHRM3	22	42
O=C(NCc1cccc(CN2CCCC2)c1)N1CCC(CO)(CO)CC1	ZINC000875063490	FD	On-Demand	Anodyne	SIGMAR1	31	43
O=C(NCc1cccc(CN2CCCC2)c1)N1CCC(CO)(CO)CC1	ZINC000875063490	FD	On-Demand	Anodyne	NPFFR2	37	40
O=C(NCc1cccc(CN2CCCC2)c1)N1CCC(CO)(CO)CC1	ZINC000875063490	FD	On-Demand	Anodyne	FAAH	24	43
O=C(NCc1cccc(CN2CCCC2)c1)N1CCC(CO)(CO)CC1	ZINC000875063490	FD	On-Demand	Anodyne	NPFFR1	47	40
CCN(CC)Cc1cccc(CNC(=O)N2CCC(C(=O)NCCO)CC2)c1	ZINC000875063514	GD	On-Demand	Anodyne	EPHX2	21	46
O=C(NCCO)C1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)CC1	ZINC000875063526	GD	On-Demand	Anodyne	HRH2	32	42
O=C(NCCO)C1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)CC1	ZINC000875063526	GD	On-Demand	Anodyne	CHRM3	19	41
O=C(NCCO)C1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)CC1	ZINC000875063526	GD	On-Demand	Anodyne	SIGMAR1	20	53
O=C(NCCO)C1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)CC1	ZINC000875063526	GD	On-Demand	Anodyne	EPHX2	20	51
O=C(NCCO)C1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)CC1	ZINC000875063526	GD	On-Demand	Anodyne	CACNA1G	35	42
COC(=O)c1sccc1NC(=O)C[C@@H](C)NC(=O)OC(C)(C)C	ZINC000875063535	EF	On-Demand	Anodyne	FAS	50	50
COC(=O)c1sccc1NC(=O)C[C@H](C)NC(=O)OC(C)(C)C	ZINC000875063536	EF	On-Demand	Anodyne	FAS	50	50
CCO[C@@H](C(=O)Nc1ccsc1C(=O)OC)C1CCCC1	ZINC000875063538	DG	On-Demand	Anodyne	FAS	42	45
COC(=O)c1sccc1NC(=O)c1cn2c(n1)C[C@H](OC)CC2	ZINC000875063546	ED	On-Demand	Anodyne	FAS	33	42
COC(=O)c1sccc1NC(=O)c1cn2c(n1)C[C@@H](OC)CC2	ZINC000875063547	ED	On-Demand	Anodyne	FAS	33	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccnc(Oc3ccccc3)c2)C1	ZINC000875063551	GG	On-Demand	Anodyne	PDS	47	36
COC(=O)c1sccc1NC(=O)[C@H]1CC[C@H]1C(=O)OC	ZINC000875063564	CD	On-Demand	Anodyne	FAS	44	49
COC(=O)c1sccc1NC(=O)CN1CCCCC(=O)C1=O	ZINC000875063570	DD	On-Demand	Anodyne	FAS	53	49
COC(=O)c1sccc1NC(=O)[C@@H]1CC[C@H]1C(=O)OC(C)(C)C	ZINC000875063571	EF	On-Demand	Anodyne	FAS	39	45
CCO[C@H]1COCC[C@H]1CC(=O)Nc1ccsc1C(=O)OC	ZINC000875063573	EE	On-Demand	Anodyne	FAS	46	45
CCO[C@H]1COCC[C@@H]1CC(=O)Nc1ccsc1C(=O)OC	ZINC000875063574	EE	On-Demand	Anodyne	FAS	46	45
CC(C)(C)OC(=O)NC1(CNC(=O)NCc2ccsc2)CCOCC1	ZINC000875063578	FF	On-Demand	Anodyne	PAPA1_CARPA	15	42
O=C(NCc1ccsc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875063586	DG	On-Demand	Anodyne	ACE	34	40
O=C(NCc1ccsc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875063586	DG	On-Demand	Anodyne	TRY1_BOVIN	41	38
O=C(NCc1ccsc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875063586	DG	On-Demand	Anodyne	PREP	38	44
O=C(NCc1ccsc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875063586	DG	On-Demand	Anodyne	TMPRSS11D	58	34
O=C(NCc1ccsc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875063587	DG	On-Demand	Anodyne	ACE	34	40
O=C(NCc1ccsc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875063587	DG	On-Demand	Anodyne	TRY1_BOVIN	41	38
O=C(NCc1ccsc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875063587	DG	On-Demand	Anodyne	PREP	38	44
O=C(NCc1ccsc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875063587	DG	On-Demand	Anodyne	TMPRSS11D	58	34
O=C(NCc1ccsc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875063588	DG	On-Demand	Anodyne	ACE	34	40
O=C(NCc1ccsc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875063588	DG	On-Demand	Anodyne	TRY1_BOVIN	41	38
O=C(NCc1ccsc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875063588	DG	On-Demand	Anodyne	PREP	38	44
O=C(NCc1ccsc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875063588	DG	On-Demand	Anodyne	TMPRSS11D	58	34
O=C(NCc1ccsc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875063589	DG	On-Demand	Anodyne	ACE	34	40
O=C(NCc1ccsc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875063589	DG	On-Demand	Anodyne	TRY1_BOVIN	41	38
O=C(NCc1ccsc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875063589	DG	On-Demand	Anodyne	PREP	38	44
O=C(NCc1ccsc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875063589	DG	On-Demand	Anodyne	TMPRSS11D	58	34
N#Cc1ccc(Cc2cnc(NC(=O)CCc3nc(O)c4c5c(sc4n3)CCCC5)s2)cc1	ZINC000875063610	JJ	On-Demand	Mild	VIPR1	26	41
Cn1nnnc1C1CCN(C(=O)NC2CCC(c3ccccc3)CC2)CC1	ZINC000875063645	FF	On-Demand	Anodyne	EPHX2	28	48
CCO[C@@H](C(=O)Nc1ccsc1C(=O)OC)C1CCOCC1	ZINC000875063646	EE	On-Demand	Anodyne	FAS	32	43
CCOC1CC2(C1)C[C@H]2C(=O)Nc1ccsc1C(=O)OC	ZINC000875063649	DF	On-Demand	Anodyne	FAS	32	43
C#CC[C@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875063677	GC	On-Demand	Mild	HTR1A	105	53
C#CC[C@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875063677	GC	On-Demand	Mild	DRD2	78	47
C#CC[C@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875063677	GC	On-Demand	Mild	DRD1	15	41
C#CC[C@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875063677	GC	On-Demand	Mild	DRD4	50	43
C#CC[C@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875063677	GC	On-Demand	Mild	ADRA1D	53	51
C#CC[C@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875063677	GC	On-Demand	Mild	HTR2A	67	45
C#CC[C@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875063677	GC	On-Demand	Mild	HTR2C	41	43
C#CC[C@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875063677	GC	On-Demand	Mild	SLC6A4	20	41
C#CC[C@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875063677	GC	On-Demand	Mild	ADRA1A	72	51
C#CC[C@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875063677	GC	On-Demand	Mild	ADRA1B	47	51
C#CC[C@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875063677	GC	On-Demand	Mild	DRD3	104	47
C#CC[C@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875063677	GC	On-Demand	Mild	HTR7	105	46
C#CC[C@@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875063678	GC	On-Demand	Mild	HTR1A	105	53
C#CC[C@@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875063678	GC	On-Demand	Mild	DRD2	78	47
C#CC[C@@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875063678	GC	On-Demand	Mild	DRD1	15	41
C#CC[C@@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875063678	GC	On-Demand	Mild	DRD4	50	43
C#CC[C@@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875063678	GC	On-Demand	Mild	ADRA1D	53	51
C#CC[C@@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875063678	GC	On-Demand	Mild	HTR2A	67	45
C#CC[C@@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875063678	GC	On-Demand	Mild	HTR2C	41	43
C#CC[C@@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875063678	GC	On-Demand	Mild	SLC6A4	20	41
C#CC[C@@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875063678	GC	On-Demand	Mild	ADRA1A	72	51
C#CC[C@@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875063678	GC	On-Demand	Mild	ADRA1B	47	51
C#CC[C@@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875063678	GC	On-Demand	Mild	DRD3	104	47
C#CC[C@@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875063678	GC	On-Demand	Mild	HTR7	105	46
COC(=O)c1sccc1NC(=O)c1cccn(C2CC2)c1=O	ZINC000875063695	DE	On-Demand	Anodyne	FAS	39	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccnc1Oc1cccc(F)c1	ZINC000875063698	GG	On-Demand	Anodyne	SLC6A3	23	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccnc1Oc1cccc(F)c1	ZINC000875063699	GG	On-Demand	Anodyne	SLC6A3	23	41
O=CN1CCCN(C(=O)NC2CCC(c3ccccc3)CC2)CC1	ZINC000875063703	EF	On-Demand	Anodyne	EPHX2	27	48
O=C(NCCO)C1CCN(C(=O)NC2CCC(c3ccccc3)CC2)CC1	ZINC000875063704	FE	On-Demand	Anodyne	SIGMAR1	15	44
O=C(NCCO)C1CCN(C(=O)NC2CCC(c3ccccc3)CC2)CC1	ZINC000875063704	FE	On-Demand	Anodyne	EPHX2	49	43
C[C@@H]1CN(C(=O)NCc2cccc(CN3CCCC3)c2)CC[C@H](C(F)(F)F)O1	ZINC000875063706	GH	On-Demand	Anodyne	CHRM3	20	40
C[C@@H]1CN(C(=O)NCc2cccc(CN3CCCC3)c2)CC[C@@H](C(F)(F)F)O1	ZINC000875063708	GH	On-Demand	Anodyne	CHRM3	20	40
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccnc1Oc1cccc(F)c1	ZINC000875063718	FG	On-Demand	Anodyne	P2RY1	19	41
N#Cc1ccc(Cc2cnc(NC(=O)COc3ccc4ccc(=O)oc4c3)s2)cc1	ZINC000875063738	HH	On-Demand	Mild	MAOA	41	39
N#Cc1ccc(Cc2cnc(NC(=O)COc3ccc4ccc(=O)oc4c3)s2)cc1	ZINC000875063738	HH	On-Demand	Mild	MAOB	19	40
CN1CCN(C2CCN(C(=O)NC3CCC(c4ccccc4)CC3)CC2)CC1	ZINC000875063739	GG	On-Demand	Anodyne	SIGMAR1	16	43
CN1CCN(C2CCN(C(=O)NC3CCC(c4ccccc4)CC3)CC2)CC1	ZINC000875063739	GG	On-Demand	Anodyne	SLC18A3	37	42
CN1CCN(C2CCN(C(=O)NC3CCC(c4ccccc4)CC3)CC2)CC1	ZINC000875063739	GG	On-Demand	Anodyne	EBP	16	40
CN1CCN(C2CCN(C(=O)NC3CCC(c4ccccc4)CC3)CC2)CC1	ZINC000875063739	GG	On-Demand	Anodyne	EPHX2	35	53
CN1CCN(C2CCN(C(=O)NC3CCC(c4ccccc4)CC3)CC2)CC1	ZINC000875063739	GG	On-Demand	Anodyne	CALCRL	27	40
CN1CCN(C2CCN(C(=O)NC3CCC(c4ccccc4)CC3)CC2)CC1	ZINC000875063739	GG	On-Demand	Anodyne	L3MBTL3	77	43
COC(=O)c1sccc1NC(=O)[C@@H](OC)C(=O)OC(C)(C)C	ZINC000875063752	ED	On-Demand	Anodyne	FAS	40	45
COC(=O)c1sccc1NC(=O)[C@H](OC)C(=O)OC(C)(C)C	ZINC000875063753	ED	On-Demand	Anodyne	FAS	40	45
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875063755	GD	On-Demand	Anodyne	HTR1A	53	52
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875063755	GD	On-Demand	Anodyne	DRD2	61	44
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875063755	GD	On-Demand	Anodyne	DRD4	54	38
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875063755	GD	On-Demand	Anodyne	ACHE	34	43
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875063755	GD	On-Demand	Anodyne	HTR2A	47	45
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875063755	GD	On-Demand	Anodyne	HTR2C	30	41
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875063755	GD	On-Demand	Anodyne	SLC6A4	15	41
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875063755	GD	On-Demand	Anodyne	ADRA1A	55	38
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875063755	GD	On-Demand	Anodyne	ADRA1B	42	38
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875063755	GD	On-Demand	Anodyne	DRD3	73	44
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875063755	GD	On-Demand	Anodyne	HTR7	38	46
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875063755	GD	On-Demand	Anodyne	SIGMAR1	79	46
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875063755	GD	On-Demand	Anodyne	BCHE	15	43
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875063755	GD	On-Demand	Anodyne	CCR3	21	42
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875063755	GD	On-Demand	Anodyne	CACNA1G	36	42
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875063755	GD	On-Demand	Anodyne	NPFFR1	51	39
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063756	GD	On-Demand	Anodyne	HTR1A	53	52
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063756	GD	On-Demand	Anodyne	DRD2	61	44
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063756	GD	On-Demand	Anodyne	DRD4	54	38
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063756	GD	On-Demand	Anodyne	ACHE	34	43
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063756	GD	On-Demand	Anodyne	HTR2A	47	45
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063756	GD	On-Demand	Anodyne	HTR2C	30	41
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063756	GD	On-Demand	Anodyne	SLC6A4	15	41
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063756	GD	On-Demand	Anodyne	ADRA1A	55	38
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063756	GD	On-Demand	Anodyne	ADRA1B	42	38
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063756	GD	On-Demand	Anodyne	DRD3	73	44
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063756	GD	On-Demand	Anodyne	HTR7	38	46
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063756	GD	On-Demand	Anodyne	SIGMAR1	79	46
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063756	GD	On-Demand	Anodyne	BCHE	15	43
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063756	GD	On-Demand	Anodyne	CCR3	21	42
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063756	GD	On-Demand	Anodyne	CACNA1G	36	42
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063756	GD	On-Demand	Anodyne	NPFFR1	51	39
CC(C)(C)[C@@H]1CCCC[C@@H]1NC(=O)NCCC[C@@H]1CCOC1=O	ZINC000875063763	DG	On-Demand	Anodyne	TRAR	61	32
CC(C)(C)[C@@H]1CCCC[C@@H]1NC(=O)NCCC[C@@H]1CCOC1=O	ZINC000875063763	DG	On-Demand	Anodyne	LASR	47	32
CC(C)(C)[C@@H]1CCCC[C@H]1NC(=O)NCCC[C@@H]1CCOC1=O	ZINC000875063764	DG	On-Demand	Anodyne	TRAR	61	32
CC(C)(C)[C@@H]1CCCC[C@H]1NC(=O)NCCC[C@@H]1CCOC1=O	ZINC000875063764	DG	On-Demand	Anodyne	LASR	47	32
CC(C)(C)[C@@H]1CCCC[C@H]1NC(=O)NCCC[C@H]1CCOC1=O	ZINC000875063765	DG	On-Demand	Anodyne	TRAR	61	32
CC(C)(C)[C@@H]1CCCC[C@H]1NC(=O)NCCC[C@H]1CCOC1=O	ZINC000875063765	DG	On-Demand	Anodyne	LASR	47	32
CC(C)(C)[C@@H]1CCCC[C@@H]1NC(=O)NCCC[C@H]1CCOC1=O	ZINC000875063766	DG	On-Demand	Anodyne	TRAR	61	32
CC(C)(C)[C@@H]1CCCC[C@@H]1NC(=O)NCCC[C@H]1CCOC1=O	ZINC000875063766	DG	On-Demand	Anodyne	LASR	47	32
O=C(NCc1cccnc1Oc1cccc(F)c1)N1CCC(CO)(CO)CC1	ZINC000875063769	GE	On-Demand	Anodyne	CACNA1H	42	33
COC(=O)c1sccc1NC(=O)c1cccn(C(C)(C)C)c1=O	ZINC000875063772	EF	On-Demand	Anodyne	FAS	45	46
O=C(NCc1cccc(CN2CCCC2)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875063773	GH	On-Demand	Anodyne	HRH2	32	42
O=C(NCc1cccc(CN2CCCC2)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875063773	GH	On-Demand	Anodyne	HRH3	15	48
O=C(NCc1cccc(CN2CCCC2)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875063773	GH	On-Demand	Anodyne	SIGMAR1	21	42
O=C(NCc1cccc(CN2CCCC2)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875063773	GH	On-Demand	Anodyne	CCR3	23	40
O=C(NCc1cccc(CN2CCCC2)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875063773	GH	On-Demand	Anodyne	FAAH	23	41
O=C(NCc1cccc(CN2CCCC2)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875063773	GH	On-Demand	Anodyne	EPHX2	23	41
O=C(NCc1cccc(CN2CCCC2)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875063773	GH	On-Demand	Anodyne	MCHR1	15	40
O=C(NCc1cccc(CN2CCCC2)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875063774	GH	On-Demand	Anodyne	HRH2	32	42
O=C(NCc1cccc(CN2CCCC2)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875063774	GH	On-Demand	Anodyne	HRH3	15	48
O=C(NCc1cccc(CN2CCCC2)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875063774	GH	On-Demand	Anodyne	SIGMAR1	21	42
O=C(NCc1cccc(CN2CCCC2)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875063774	GH	On-Demand	Anodyne	CCR3	23	40
O=C(NCc1cccc(CN2CCCC2)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875063774	GH	On-Demand	Anodyne	FAAH	23	41
O=C(NCc1cccc(CN2CCCC2)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875063774	GH	On-Demand	Anodyne	EPHX2	23	41
O=C(NCc1cccc(CN2CCCC2)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875063774	GH	On-Demand	Anodyne	MCHR1	15	40
COC(=O)c1sc(NC(=O)C(C)(C)c2cccc(OC)c2)nc1C	ZINC000875063787	EG	On-Demand	Anodyne	CSNK1D	28	42
O=C(NCCCN1CCN(c2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063792	FD	On-Demand	Anodyne	HTR1A	101	56
O=C(NCCCN1CCN(c2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063792	FD	On-Demand	Anodyne	DRD2	77	54
O=C(NCCCN1CCN(c2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063792	FD	On-Demand	Anodyne	DRD4	46	47
O=C(NCCCN1CCN(c2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063792	FD	On-Demand	Anodyne	ADRA1D	54	51
O=C(NCCCN1CCN(c2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063792	FD	On-Demand	Anodyne	HTR2A	72	49
O=C(NCCCN1CCN(c2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063792	FD	On-Demand	Anodyne	HTR2C	40	47
O=C(NCCCN1CCN(c2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063792	FD	On-Demand	Anodyne	SLC6A4	18	43
O=C(NCCCN1CCN(c2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063792	FD	On-Demand	Anodyne	ADRA1A	73	51
O=C(NCCCN1CCN(c2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063792	FD	On-Demand	Anodyne	ADRA1B	51	51
O=C(NCCCN1CCN(c2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063792	FD	On-Demand	Anodyne	DRD3	94	54
O=C(NCCCN1CCN(c2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063792	FD	On-Demand	Anodyne	DRD5	16	40
O=C(NCCCN1CCN(c2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063792	FD	On-Demand	Anodyne	HTR7	110	46
O=C(NCCCN1CCN(c2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875063792	FD	On-Demand	Anodyne	SIGMAR1	19	45
O=C(NCCCN1CCN(c2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875063793	FD	On-Demand	Anodyne	HTR1A	101	56
O=C(NCCCN1CCN(c2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875063793	FD	On-Demand	Anodyne	DRD2	77	54
O=C(NCCCN1CCN(c2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875063793	FD	On-Demand	Anodyne	DRD4	46	47
O=C(NCCCN1CCN(c2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875063793	FD	On-Demand	Anodyne	ADRA1D	54	51
O=C(NCCCN1CCN(c2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875063793	FD	On-Demand	Anodyne	HTR2A	72	49
O=C(NCCCN1CCN(c2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875063793	FD	On-Demand	Anodyne	HTR2C	40	47
O=C(NCCCN1CCN(c2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875063793	FD	On-Demand	Anodyne	SLC6A4	18	43
O=C(NCCCN1CCN(c2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875063793	FD	On-Demand	Anodyne	ADRA1A	73	51
O=C(NCCCN1CCN(c2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875063793	FD	On-Demand	Anodyne	ADRA1B	51	51
O=C(NCCCN1CCN(c2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875063793	FD	On-Demand	Anodyne	DRD3	94	54
O=C(NCCCN1CCN(c2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875063793	FD	On-Demand	Anodyne	DRD5	16	40
O=C(NCCCN1CCN(c2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875063793	FD	On-Demand	Anodyne	HTR7	110	46
O=C(NCCCN1CCN(c2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875063793	FD	On-Demand	Anodyne	SIGMAR1	19	45
COC(=O)c1sccc1NC(=O)CC[C@@H]1C[C@H](C(=O)OC)CO1	ZINC000875063796	ED	On-Demand	Anodyne	FAS	51	52
O=C(NCc1cccc(CN2CCCC2)c1)N1Cc2cccc(O)c2C1	ZINC000875063799	FG	On-Demand	Clean	HRH2	31	42
O=C(NCc1cccc(CN2CCCC2)c1)N1Cc2cccc(O)c2C1	ZINC000875063799	FG	On-Demand	Clean	CHRM3	17	45
O=C(NCc1cccc(CN2CCCC2)c1)N1Cc2cccc(O)c2C1	ZINC000875063799	FG	On-Demand	Clean	NAMPT	25	44
COC(=O)c1sccc1NC(=O)[C@@H]1COC(=O)N1	ZINC000875063809	CC	On-Demand	Anodyne	FAS	29	43
CCO[C@@H](C(=O)Nc1ccsc1C(=O)OC)[C@H]1CCOC1	ZINC000875063815	DD	On-Demand	Anodyne	FAS	28	41
CCO[C@@H](C(=O)Nc1ccsc1C(=O)OC)[C@@H]1CCOC1	ZINC000875063817	DD	On-Demand	Anodyne	FAS	28	41
O=C(NCc1cccnc1Oc1cccc(F)c1)N1CCC2(CCNC2=O)CC1	ZINC000875063822	GF	On-Demand	Anodyne	CACNA1H	51	38
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3cccc(CN4CCCC4)c3)C[C@@H]1C2	ZINC000875063825	FE	On-Demand	Anodyne	HRH2	36	48
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3cccc(CN4CCCC4)c3)C[C@@H]1C2	ZINC000875063825	FE	On-Demand	Anodyne	MCHR1	16	49
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(CN(CC)CC)c1	ZINC000875063831	EF	On-Demand	Anodyne	ANPEP	17	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(CN(CC)CC)c1	ZINC000875063831	EF	On-Demand	Anodyne	PDS	53	33
CCN(CC)Cc1cccc(CNC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)c1	ZINC000875063840	FF	On-Demand	Anodyne	SLC6A4	26	40
CCN(CC)Cc1cccc(CNC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)c1	ZINC000875063840	FF	On-Demand	Anodyne	SLC6A3	49	38
CCN(CC)Cc1cccc(CNC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)c1	ZINC000875063841	FF	On-Demand	Anodyne	SLC6A4	26	40
CCN(CC)Cc1cccc(CNC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)c1	ZINC000875063841	FF	On-Demand	Anodyne	SLC6A3	49	38
O=CN1CCCN(C(=O)NCc2cccc(CN3CCCC3)c2)CC1	ZINC000875063850	ED	On-Demand	Anodyne	HRH2	33	44
O=CN1CCCN(C(=O)NCc2cccc(CN3CCCC3)c2)CC1	ZINC000875063850	ED	On-Demand	Anodyne	CHRM3	17	43
O=CN1CCCN(C(=O)NCc2cccc(CN3CCCC3)c2)CC1	ZINC000875063850	ED	On-Demand	Anodyne	SIGMAR1	23	42
O=CN1CCCN(C(=O)NCc2cccc(CN3CCCC3)c2)CC1	ZINC000875063850	ED	On-Demand	Anodyne	FAAH	27	45
O=C(NC1CCC(c2ccccc2)CC1)N1CCC2(CCNC2=O)CC1	ZINC000875063855	FG	On-Demand	Anodyne	EPHX2	27	44
CC(=O)C1CCN(C(=O)NC2CCC(c3ccccc3)CC2)CC1	ZINC000875063874	EH	On-Demand	Anodyne	SIGMAR1	18	42
CC(=O)C1CCN(C(=O)NC2CCC(c3ccccc3)CC2)CC1	ZINC000875063874	EH	On-Demand	Anodyne	EPHX2	55	47
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccnc(Oc2ccccc2)c1	ZINC000875063887	EG	On-Demand	Anodyne	PDS	75	39
COC(=O)c1sccc1NC(=O)[C@H](CN(C)C)NC(=O)OC(C)(C)C	ZINC000875063890	FD	On-Demand	Anodyne	PAPA1_CARPA	38	43
COC(=O)c1sccc1NC(=O)[C@H](CN(C)C)NC(=O)OC(C)(C)C	ZINC000875063890	FD	On-Demand	Anodyne	FPR1	40	33
COC(=O)c1sccc1NC(=O)[C@H](CN(C)C)NC(=O)OC(C)(C)C	ZINC000875063890	FD	On-Demand	Anodyne	FAS	43	45
CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)c1	ZINC000875063891	JH	On-Demand	Mild	SCD1	37	43
CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)c1	ZINC000875063891	JH	On-Demand	Mild	SCD	30	43
O=C(NC1CCC(c2ccccc2)CC1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875063903	GG	On-Demand	Anodyne	CCR2	19	40
O=C(NCc1cccnc1Oc1cccc(F)c1)NC[C@H]1C[C@H](O)C1	ZINC000875063904	EF	On-Demand	Anodyne	P2RY1	25	42
COC(=O)N(C)NC(=O)NCc1ccc(OC)c(OC(F)F)c1	ZINC000875063908	ED	On-Demand	Reactive	MT-ND1	24	42
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875063926	EF	On-Demand	Anodyne	HRH2	31	52
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875063926	EF	On-Demand	Anodyne	CHRM3	18	42
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875063926	EF	On-Demand	Anodyne	ANPEP	16	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875063926	EF	On-Demand	Anodyne	PDS	44	31
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(Oc2cccc(OC)c2)nc1	ZINC000875063934	FG	On-Demand	Anodyne	MTNR1A	19	40
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(Oc2cccc(OC)c2)nc1	ZINC000875063934	FG	On-Demand	Anodyne	MTNR1B	21	40
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(Oc2cccc(OC)c2)nc1	ZINC000875063934	FG	On-Demand	Anodyne	PDS	53	43
O=C(NCc1cccc(CN2CCCC2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875063951	DD	On-Demand	Anodyne	HRH2	35	50
O=C(NCc1cccc(CN2CCCC2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875063951	DD	On-Demand	Anodyne	CHRM3	21	41
O=C(NCc1cccc(CN2CCCC2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875063951	DD	On-Demand	Anodyne	SIGMAR1	25	43
COC(=O)c1sccc1NC(=O)[C@@]12CC[C@@](C)(C(=O)O1)C2(C)C	ZINC000875063957	EF	On-Demand	Anodyne	FAS	32	43
COC(=O)c1sccc1NC(=O)C[C@H]1Cc2ccccc2O1	ZINC000875063966	DF	On-Demand	Anodyne	FAS	72	53
COC(=O)c1sccc1NC(=O)C[C@@H]1Cc2ccccc2O1	ZINC000875063967	DF	On-Demand	Anodyne	FAS	72	53
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)c1	ZINC000875063983	JK	On-Demand	Mild	SCD1	40	41
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)c1	ZINC000875063983	JK	On-Demand	Mild	SCD	35	41
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)c1	ZINC000875063983	JK	On-Demand	Mild	KCNK3	58	39
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)c1	ZINC000875063983	JK	On-Demand	Mild	KCNK9	45	39
COC(=O)c1sccc1NC(=O)c1cnn(C(C)C)c1Cl	ZINC000875063986	EG	On-Demand	Anodyne	FAS	39	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875063993	FF	On-Demand	Anodyne	HRH2	42	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875063993	FF	On-Demand	Anodyne	SLC6A3	51	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875063993	FF	On-Demand	Anodyne	SIGMAR1	25	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875063993	FF	On-Demand	Anodyne	ALK	15	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875063994	FF	On-Demand	Anodyne	HRH2	42	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875063994	FF	On-Demand	Anodyne	SLC6A3	51	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875063994	FF	On-Demand	Anodyne	SIGMAR1	25	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(CN2CCCC2)c1	ZINC000875063994	FF	On-Demand	Anodyne	ALK	15	42
COC(=O)c1sccc1NC(=O)C1=CC[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000875064011	FG	On-Demand	Anodyne	FAS	30	40
COC(=O)c1sccc1NC(=O)C1=CC[C@H](NC(=O)OC(C)(C)C)C1	ZINC000875064012	FG	On-Demand	Anodyne	FAS	30	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccnc(Oc2ccccc2)c1	ZINC000875064020	GG	On-Demand	Anodyne	SLC6A4	20	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccnc(Oc2ccccc2)c1	ZINC000875064020	GG	On-Demand	Anodyne	SLC6A3	41	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccnc(Oc2ccccc2)c1	ZINC000875064021	GG	On-Demand	Anodyne	SLC6A4	20	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccnc(Oc2ccccc2)c1	ZINC000875064021	GG	On-Demand	Anodyne	SLC6A3	41	41
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](C)c1ccc(OC(F)F)cc1	ZINC000875064022	FE	On-Demand	Mild	ACACA	21	40
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H](C)c1ccc(OC(F)F)cc1	ZINC000875064023	FE	On-Demand	Mild	ACACA	21	40
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H](C)c1ccc(OC(F)F)cc1	ZINC000875064024	FE	On-Demand	Mild	ACACA	21	40
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](C)c1ccc(OC(F)F)cc1	ZINC000875064025	FE	On-Demand	Mild	ACACA	21	40
COC(=O)c1sccc1NC(=O)[C@@H]1CCC(=O)N1C(C)C	ZINC000875064039	DD	On-Demand	Anodyne	FAS	40	45
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000875064049	FF	On-Demand	Anodyne	HRH2	33	43
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000875064049	FF	On-Demand	Anodyne	CHRM3	19	40
O=C(NC1CCC(c2ccccc2)CC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875064051	GH	On-Demand	Anodyne	EPHX2	16	48
O=C(NC1CCC(c2ccccc2)CC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875064051	GH	On-Demand	Anodyne	SMO	40	46
O=C(NC1CCC(c2ccccc2)CC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875064051	GH	On-Demand	Anodyne	ETHR	53	36
O=C(NC1CCC(c2ccccc2)CC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875064052	GH	On-Demand	Anodyne	EPHX2	16	48
O=C(NC1CCC(c2ccccc2)CC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875064052	GH	On-Demand	Anodyne	SMO	40	46
O=C(NC1CCC(c2ccccc2)CC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875064052	GH	On-Demand	Anodyne	ETHR	53	36
COC(=O)c1sccc1NC(=O)[C@H]1CCC(=O)O1	ZINC000875064053	CD	On-Demand	Anodyne	FAS	33	44
COC(=O)c1sccc1NC(=O)[C@@H]1OCCO[C@@H]1C(F)(F)F	ZINC000875064054	ED	On-Demand	Anodyne	FAS	31	42
COC(=O)c1sccc1NC(=O)c1cnn(C(C)C)c1Br	ZINC000875064067	FG	On-Demand	Anodyne	FAS	44	48
COC(=O)c1cc(C(=O)Nc2nc(C)c(C(=O)OC)s2)ccc1C	ZINC000875064068	EF	On-Demand	Anodyne	LCK	34	49
C[C@H](NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1)c1ccnn1C	ZINC000875064070	GC	On-Demand	Anodyne	HTR1A	102	56
C[C@H](NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1)c1ccnn1C	ZINC000875064070	GC	On-Demand	Anodyne	DRD2	79	50
C[C@H](NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1)c1ccnn1C	ZINC000875064070	GC	On-Demand	Anodyne	DRD1	16	41
C[C@H](NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1)c1ccnn1C	ZINC000875064070	GC	On-Demand	Anodyne	DRD4	50	47
C[C@H](NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1)c1ccnn1C	ZINC000875064070	GC	On-Demand	Anodyne	ADRA1D	48	53
C[C@H](NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1)c1ccnn1C	ZINC000875064070	GC	On-Demand	Anodyne	HTR2A	75	52
C[C@H](NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1)c1ccnn1C	ZINC000875064070	GC	On-Demand	Anodyne	HTR2C	42	47
C[C@H](NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1)c1ccnn1C	ZINC000875064070	GC	On-Demand	Anodyne	SLC6A4	19	43
C[C@H](NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1)c1ccnn1C	ZINC000875064070	GC	On-Demand	Anodyne	ADRA1A	67	53
C[C@H](NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1)c1ccnn1C	ZINC000875064070	GC	On-Demand	Anodyne	ADRA1B	40	53
C[C@H](NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1)c1ccnn1C	ZINC000875064070	GC	On-Demand	Anodyne	DRD3	102	52
C[C@H](NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1)c1ccnn1C	ZINC000875064070	GC	On-Demand	Anodyne	HTR7	114	46
C[C@H](NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1)c1ccnn1C	ZINC000875064070	GC	On-Demand	Anodyne	CAPN1	17	43
C[C@H](NC(=O)C(=O)NCCCN1CCN(c2ccccc2)CC1)c1ccnn1C	ZINC000875064070	GC	On-Demand	Anodyne	CAPN2	23	43
COC(=O)CC[C@@H]1CC[C@H](C(=O)Nc2ccsc2C(=O)OC)O1	ZINC000875064080	ED	On-Demand	Anodyne	FAS	32	45
COCC(C)(C)CCNC(=O)NCc1ccnc(Oc2ccc(OC)cc2)c1	ZINC000875064087	GH	On-Demand	Anodyne	PROKR1	50	30
C[C@@H](NC(=O)N1CCN(C)C(C)(C)CC1)c1cc(F)ccc1F	ZINC000875064099	EG	On-Demand	Anodyne	CACNA1H	55	42
C[C@@H](NC(=O)N1CCN(C)C(C)(C)CC1)c1cc(F)ccc1F	ZINC000875064099	EG	On-Demand	Anodyne	CCR1	46	38
CC(C)(C)OC(=O)N1CC[C@H]2[C@H]1CCCN2C(=O)NCc1ccc(C#N)cc1	ZINC000875064102	GG	On-Demand	Mild	DPP4	25	41
CC(C)(C)OC(=O)N1CC[C@H]2[C@H]1CCCN2C(=O)NCc1ccc(C#N)cc1	ZINC000875064102	GG	On-Demand	Mild	LGMN	70	35
CC(C)(C)OC(=O)N1CC[C@H]2[C@H]1CCCN2C(=O)NCc1ccc(C#N)cc1	ZINC000875064102	GG	On-Demand	Mild	GPR119	18	41
CC(C)(C)OC(=O)N1CC[C@@H]2[C@H]1CCCN2C(=O)NCc1ccc(C#N)cc1	ZINC000875064103	GG	On-Demand	Mild	DPP4	25	41
CC(C)(C)OC(=O)N1CC[C@@H]2[C@H]1CCCN2C(=O)NCc1ccc(C#N)cc1	ZINC000875064103	GG	On-Demand	Mild	LGMN	70	35
CC(C)(C)OC(=O)N1CC[C@@H]2[C@H]1CCCN2C(=O)NCc1ccc(C#N)cc1	ZINC000875064103	GG	On-Demand	Mild	GPR119	18	41
CC(C)(C)OC(=O)N1CC[C@H]2[C@@H]1CCCN2C(=O)NCc1ccc(C#N)cc1	ZINC000875064104	GG	On-Demand	Mild	DPP4	25	41
CC(C)(C)OC(=O)N1CC[C@H]2[C@@H]1CCCN2C(=O)NCc1ccc(C#N)cc1	ZINC000875064104	GG	On-Demand	Mild	LGMN	70	35
CC(C)(C)OC(=O)N1CC[C@H]2[C@@H]1CCCN2C(=O)NCc1ccc(C#N)cc1	ZINC000875064104	GG	On-Demand	Mild	GPR119	18	41
CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H]1CCCN2C(=O)NCc1ccc(C#N)cc1	ZINC000875064105	GG	On-Demand	Mild	DPP4	25	41
CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H]1CCCN2C(=O)NCc1ccc(C#N)cc1	ZINC000875064105	GG	On-Demand	Mild	LGMN	70	35
CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H]1CCCN2C(=O)NCc1ccc(C#N)cc1	ZINC000875064105	GG	On-Demand	Mild	GPR119	18	41
C[C@@H](NC(=O)NCc1ccc(C#N)cc1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875064110	FF	On-Demand	Mild	CTRB_BOVIN	45	34
C[C@@H](NC(=O)NCc1ccc(C#N)cc1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875064110	FF	On-Demand	Mild	GPR119	21	45
CC[C@@H](NC(=O)N1CC(O)(C(=O)OC)C1)c1cccc(Cl)c1	ZINC000875064126	ED	On-Demand	Anodyne	CACNA1H	34	42
CC[C@@H](NC(=O)N1CC(O)(C(=O)OC)C1)c1cccc(Cl)c1	ZINC000875064126	ED	On-Demand	Anodyne	MAPK1	51	40
CC[C@@H](NC(=O)N1CC(O)(C(=O)OC)C1)c1cccc(Cl)c1	ZINC000875064126	ED	On-Demand	Anodyne	PDS	32	40
CC[C@@H](NC(=O)N1CC(CNC(=O)C(F)(F)F)C1)c1cccc(Cl)c1	ZINC000875064131	GG	On-Demand	Anodyne	CACNA1H	25	41
CC[C@@H](NC(=O)N1CC(CNC(=O)C(F)(F)F)C1)c1cccc(Cl)c1	ZINC000875064131	GG	On-Demand	Anodyne	CACNA1I	42	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2ccc(OC(C)C)cc2)C1	ZINC000875064133	FG	On-Demand	Anodyne	ACACA	31	44
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2ccc(OC(C)C)cc2)C1	ZINC000875064133	FG	On-Demand	Anodyne	ACACB	46	44
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2ccc(OC(C)C)cc2)C1	ZINC000875064135	FG	On-Demand	Anodyne	ACACA	31	44
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2ccc(OC(C)C)cc2)C1	ZINC000875064135	FG	On-Demand	Anodyne	ACACB	46	44
N#Cc1ccc(CNC(=O)NC2CC(Nc3ccccc3)C2)cc1	ZINC000875064145	DG	On-Demand	Mild	BRD2	16	42
N#Cc1ccc(CNC(=O)NC2CC(Nc3ccccc3)C2)cc1	ZINC000875064145	DG	On-Demand	Mild	BRD3	17	42
N#Cc1cccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875064156	EG	On-Demand	Mild	EPHX2	22	55
N#Cc1cccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875064157	EG	On-Demand	Mild	EPHX2	22	55
COc1ccc(CC[C@H](C)NC(=O)C(=O)N[C@@H](C)c2ccnn2C)cc1	ZINC000875064164	FD	On-Demand	Anodyne	MMP3	16	40
COc1ccc(CC[C@H](C)NC(=O)C(=O)N[C@@H](C)c2ccnn2C)cc1	ZINC000875064164	FD	On-Demand	Anodyne	PSMB8	40	32
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N[C@@H](C)c2ccnn2C)cc1	ZINC000875064165	FD	On-Demand	Anodyne	MMP3	16	40
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N[C@@H](C)c2ccnn2C)cc1	ZINC000875064165	FD	On-Demand	Anodyne	PSMB8	40	32
COc1ccc(CC[C@H](C)NC(=O)C(=O)N[C@H](C)c2ccnn2C)cc1	ZINC000875064166	FD	On-Demand	Anodyne	MMP3	16	40
COc1ccc(CC[C@H](C)NC(=O)C(=O)N[C@H](C)c2ccnn2C)cc1	ZINC000875064166	FD	On-Demand	Anodyne	PSMB8	40	32
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N[C@H](C)c2ccnn2C)cc1	ZINC000875064167	FD	On-Demand	Anodyne	MMP3	16	40
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N[C@H](C)c2ccnn2C)cc1	ZINC000875064167	FD	On-Demand	Anodyne	PSMB8	40	32
O=C(NCc1ccsc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875064178	DG	On-Demand	Anodyne	EPHX2	21	40
O=C(NCc1ccsc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875064179	DG	On-Demand	Anodyne	EPHX2	21	40
COC(=O)c1sccc1NC(=O)[C@@H]1C[C@H](C)CC(=O)N1	ZINC000875064202	CD	On-Demand	Anodyne	FAS	36	45
COc1cccc(Oc2ccc(CNC(=O)N3CC[C@H](C(C)(C)O)C3)cn2)c1	ZINC000875064210	GG	On-Demand	Anodyne	DRD4	40	30
COc1cccc(Oc2ccc(CNC(=O)N3CC[C@@H](C(C)(C)O)C3)cn2)c1	ZINC000875064211	GG	On-Demand	Anodyne	DRD4	40	30
O=C(NCc1cccc(CN2CCCC2)c1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875064217	GG	On-Demand	Anodyne	HRH2	29	40
O=C(NCc1cccc(CN2CCCC2)c1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875064218	GG	On-Demand	Anodyne	HRH2	29	40
O=C(NCc1ccnc(Oc2ccccc2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875064225	EE	On-Demand	Anodyne	PDS	41	32
CONC(=O)C1CCN(C(=O)NC2CCC(c3ccccc3)CC2)CC1	ZINC000875064226	FF	On-Demand	Anodyne	EPHX2	51	44
CN1CC[C@H]2CN(C(=O)NCc3cccnc3Oc3cccc(F)c3)CC[C@@H]21	ZINC000875064233	GG	On-Demand	Anodyne	PDE4B	60	33
CN1CC[C@H]2CN(C(=O)NCc3cccnc3Oc3cccc(F)c3)CC[C@@H]21	ZINC000875064233	GG	On-Demand	Anodyne	CHRNA10	26	41
CN1CC[C@H]2CN(C(=O)NCc3cccnc3Oc3cccc(F)c3)CC[C@H]21	ZINC000875064234	GG	On-Demand	Anodyne	PDE4B	60	33
CN1CC[C@H]2CN(C(=O)NCc3cccnc3Oc3cccc(F)c3)CC[C@H]21	ZINC000875064234	GG	On-Demand	Anodyne	CHRNA10	26	41
O=C(NC1CCC(c2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875064241	EE	On-Demand	Anodyne	EPHX2	36	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)c(OC(F)F)c1	ZINC000875064244	GF	On-Demand	Anodyne	SLC6A4	28	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)c(OC(F)F)c1	ZINC000875064244	GF	On-Demand	Anodyne	SLC6A3	62	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)c(OC(F)F)c1	ZINC000875064245	GF	On-Demand	Anodyne	SLC6A4	28	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)c(OC(F)F)c1	ZINC000875064245	GF	On-Demand	Anodyne	SLC6A3	62	43
O=C(NCc1cccc(CN2CCCC2)c1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875064248	GE	On-Demand	Anodyne	HRH2	30	41
O=C(NCc1cccc(CN2CCCC2)c1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875064248	GE	On-Demand	Anodyne	CHRM3	21	41
O=C(NCc1cccc(CN2CCCC2)c1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875064248	GE	On-Demand	Anodyne	CACNA1I	15	43
COC(=O)c1sccc1NC(=O)[C@H](C)Cn1ccc(C)n1	ZINC000875064253	DE	On-Demand	Anodyne	FAS	45	47
COC(=O)c1sccc1NC(=O)[C@@H](C)Cn1ccc(C)n1	ZINC000875064254	DE	On-Demand	Anodyne	FAS	45	47
COC(=O)c1sccc1NC(=O)COCc1ccnc(OC)c1	ZINC000875064258	EE	On-Demand	Anodyne	FAS	57	52
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](C)c1ccc(OCc2cccnc2)cc1	ZINC000875064259	GD	On-Demand	Mild	ACACA	23	42
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](C)c1ccc(OCc2cccnc2)cc1	ZINC000875064259	GD	On-Demand	Mild	ACACB	23	42
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](C)c1ccc(OCc2cccnc2)cc1	ZINC000875064260	GD	On-Demand	Mild	ACACA	23	42
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](C)c1ccc(OCc2cccnc2)cc1	ZINC000875064260	GD	On-Demand	Mild	ACACB	23	42
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)c1ccc(OCc2cccnc2)cc1	ZINC000875064261	GD	On-Demand	Mild	ACACA	23	42
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)c1ccc(OCc2cccnc2)cc1	ZINC000875064261	GD	On-Demand	Mild	ACACB	23	42
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)c1ccc(OCc2cccnc2)cc1	ZINC000875064262	GD	On-Demand	Mild	ACACA	23	42
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)c1ccc(OCc2cccnc2)cc1	ZINC000875064262	GD	On-Demand	Mild	ACACB	23	42
CC(=O)C1CCN(C(=O)NCc2cccnc2Oc2cccc(F)c2)CC1	ZINC000875064267	FH	On-Demand	Anodyne	P2RY1	26	41
CC(=O)C1CCN(C(=O)NCc2cccnc2Oc2cccc(F)c2)CC1	ZINC000875064267	FH	On-Demand	Anodyne	PDE4B	40	31
CC(=O)C1CCN(C(=O)NCc2cccnc2Oc2cccc(F)c2)CC1	ZINC000875064267	FH	On-Demand	Anodyne	EPHX2	20	42
CN(C[C@H](O)CN(C)C(=O)OC(C)(C)C)C(=O)NCc1ccsc1	ZINC000875064287	FE	On-Demand	Anodyne	PAPA1_CARPA	16	44
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(C#N)cc1	ZINC000875064295	CD	On-Demand	Mild	ANPEP	16	42
CO[C@H]1C[C@H]2CN(C(=O)NCc3ccc(C#N)cc3)Cc3cccnc3N2C1	ZINC000875064305	GE	On-Demand	Mild	NAMPT	22	41
CO[C@@H]1C[C@@H]2CN(C(=O)NCc3ccc(C#N)cc3)Cc3cccnc3N2C1	ZINC000875064307	GE	On-Demand	Mild	NAMPT	22	41
COc1ccc(CC[C@H](C)NC(=O)C(=O)N[C@H]2CC23CCC3)cc1	ZINC000875064334	EE	On-Demand	Anodyne	BIRC2	15	40
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N[C@H]2CC23CCC3)cc1	ZINC000875064335	EE	On-Demand	Anodyne	BIRC2	15	40
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N[C@@H]2CC23CCC3)cc1	ZINC000875064336	EE	On-Demand	Anodyne	BIRC2	15	40
COc1ccc(CC[C@H](C)NC(=O)C(=O)N[C@@H]2CC23CCC3)cc1	ZINC000875064337	EE	On-Demand	Anodyne	BIRC2	15	40
O=C(NC1CCC2(CC1)OCCO2)N[C@@H](CCc1ccccc1)C(F)F	ZINC000875064342	FG	On-Demand	Anodyne	C5AR1	28	41
O=C(NC1CCC2(CC1)OCCO2)N[C@H](CCc1ccccc1)C(F)F	ZINC000875064343	FG	On-Demand	Anodyne	C5AR1	28	41
COC(=O)C1(O)CN(C(=O)N[C@H](C)c2cc(F)ccc2F)C1	ZINC000875064349	DC	On-Demand	Anodyne	CACNA1H	42	36
COC(=O)C1(O)CN(C(=O)N[C@@H](C)c2cc(F)ccc2F)C1	ZINC000875064350	DC	On-Demand	Anodyne	CACNA1H	42	36
COc1ccc(CC[C@H](C)NC(=O)C(=O)NCc2cccc3ncccc23)cc1	ZINC000875064363	GF	On-Demand	Anodyne	NQO2	17	43
COc1ccc(CC[C@H](C)NC(=O)C(=O)NCc2cccc3ncccc23)cc1	ZINC000875064363	GF	On-Demand	Anodyne	MTNR1A	55	43
COc1ccc(CC[C@H](C)NC(=O)C(=O)NCc2cccc3ncccc23)cc1	ZINC000875064363	GF	On-Demand	Anodyne	MTNR1B	45	39
COc1ccc(CC[C@@H](C)NC(=O)C(=O)NCc2cccc3ncccc23)cc1	ZINC000875064364	GF	On-Demand	Anodyne	NQO2	17	43
COc1ccc(CC[C@@H](C)NC(=O)C(=O)NCc2cccc3ncccc23)cc1	ZINC000875064364	GF	On-Demand	Anodyne	MTNR1A	55	43
COc1ccc(CC[C@@H](C)NC(=O)C(=O)NCc2cccc3ncccc23)cc1	ZINC000875064364	GF	On-Demand	Anodyne	MTNR1B	45	39
CC[C@@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1cccc(Cl)c1	ZINC000875064366	GG	On-Demand	Anodyne	CACNA1H	25	42
CC[C@@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1cccc(Cl)c1	ZINC000875064366	GG	On-Demand	Anodyne	MAPK1	48	38
CC[C@@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1cccc(Cl)c1	ZINC000875064366	GG	On-Demand	Anodyne	UTS2	54	34
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000875064369	GG	On-Demand	Anodyne	PTAFR	18	40
COc1ccc(CC[C@H](C)NC(=O)C(=O)N[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000875064371	GG	On-Demand	Anodyne	PTAFR	18	40
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N[C@H](C)c2cc3cnccc3o2)cc1	ZINC000875064373	GG	On-Demand	Anodyne	PTAFR	18	40
COc1ccc(CC[C@H](C)NC(=O)C(=O)N[C@H](C)c2cc3cnccc3o2)cc1	ZINC000875064375	GG	On-Demand	Anodyne	PTAFR	18	40
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1cc(F)ccc1F	ZINC000875064401	DF	On-Demand	Anodyne	CACNA1H	40	39
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1cc(F)ccc1F	ZINC000875064403	DF	On-Demand	Anodyne	CACNA1H	40	39
CC[C@@H](NC(=O)NN(C)C(=O)OC)c1cccc(Cl)c1	ZINC000875064409	CF	On-Demand	Reactive	UTS2	53	35
CC[C@@H](NC(=O)NN(C)C(=O)OC)c1cccc(Cl)c1	ZINC000875064409	CF	On-Demand	Reactive	PDS	52	45
COC(=O)C1(O)CN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000875064417	EC	On-Demand	Anodyne	HRH2	33	45
COC(=O)C1(O)CN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000875064417	EC	On-Demand	Anodyne	CHRM3	19	42
COc1cccc(Oc2ccc(CNC(=O)N(C)OCC(F)(F)F)cn2)c1	ZINC000875064424	GH	On-Demand	Anodyne	LIPE	20	42
COC(=O)c1sccc1NC(=O)c1coc(C(C)(C)C)n1	ZINC000875064432	DG	On-Demand	Anodyne	FAS	32	43
COC(=O)c1sccc1NC(=O)[C@H]1C[C@]1(C)Br	ZINC000875064444	DF	On-Demand	Anodyne	FAS	48	48
COC(=O)c1sccc1NC(=O)[C@@H]1C[C@]1(C)Br	ZINC000875064445	DF	On-Demand	Anodyne	FAS	48	48
COC(=O)c1sccc1NC(=O)[C@H]1C[C@@]1(C)Br	ZINC000875064446	DF	On-Demand	Anodyne	FAS	48	48
COC(=O)c1sccc1NC(=O)[C@@H]1C[C@@]1(C)Br	ZINC000875064447	DF	On-Demand	Anodyne	FAS	48	48
COC(=O)c1sccc1NC(=O)Cc1csc(C2CC2)n1	ZINC000875064450	DG	On-Demand	Anodyne	MAPK8	15	58
COC(=O)c1sccc1NC(=O)Cc1csc(C2CC2)n1	ZINC000875064450	DG	On-Demand	Anodyne	FAS	48	48
COC(=O)c1sccc1NC(=O)CCCOC1CCOCC1	ZINC000875064451	EE	On-Demand	Anodyne	FAS	52	54
COC(=O)c1sccc1NC(=O)[C@H]1COC(=O)N1C	ZINC000875064458	CC	On-Demand	Anodyne	FAS	36	44
COC(=O)c1sccc1NC(=O)[C@@H]1COC(=O)N1C	ZINC000875064459	CC	On-Demand	Anodyne	FAS	36	44
COC(=O)C1=NO[C@]2(CCN(C(=O)N[C@H](C)c3cc(F)ccc3F)C2)C1	ZINC000875064464	FE	On-Demand	Anodyne	CACNA1H	41	35
COC(=O)C1=NO[C@@]2(CCN(C(=O)N[C@@H](C)c3cc(F)ccc3F)C2)C1	ZINC000875064465	FE	On-Demand	Anodyne	CACNA1H	41	35
COC(=O)C1=NO[C@]2(CCN(C(=O)N[C@@H](C)c3cc(F)ccc3F)C2)C1	ZINC000875064466	FE	On-Demand	Anodyne	CACNA1H	41	35
COC(=O)C1=NO[C@@]2(CCN(C(=O)N[C@H](C)c3cc(F)ccc3F)C2)C1	ZINC000875064467	FE	On-Demand	Anodyne	CACNA1H	41	35
O=C(NC1CCC2(CC1)OCCO2)N[C@H](c1ccccn1)C1CCC1	ZINC000875064468	EF	On-Demand	Anodyne	TTK	20	40
O=C(NC1CCC2(CC1)OCCO2)N[C@@H](c1ccccn1)C1CCC1	ZINC000875064469	EF	On-Demand	Anodyne	TTK	20	40
COCCN(CC1CCN(C)CC1)C(=O)NCc1cccc(C#N)c1	ZINC000875064478	EE	On-Demand	Mild	CCR3	17	40
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)cc1	ZINC000875064481	GE	On-Demand	Anodyne	FKBP1A	41	42
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)cc1	ZINC000875064481	GE	On-Demand	Anodyne	MMP13	21	40
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)cc1	ZINC000875064481	GE	On-Demand	Anodyne	BIRC2	24	44
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)cc1	ZINC000875064481	GE	On-Demand	Anodyne	PSMB8	47	35
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)cc1	ZINC000875064482	GE	On-Demand	Anodyne	FKBP1A	41	42
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)cc1	ZINC000875064482	GE	On-Demand	Anodyne	MMP13	21	40
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)cc1	ZINC000875064482	GE	On-Demand	Anodyne	BIRC2	24	44
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)cc1	ZINC000875064482	GE	On-Demand	Anodyne	PSMB8	47	35
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1cc(F)ccc1F	ZINC000875064485	FH	On-Demand	Anodyne	CACNA1H	60	44
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1cc(F)ccc1F	ZINC000875064485	FH	On-Demand	Anodyne	CCR1	40	37
C[C@@H](NC(=O)N1CCC[C@H](OC2CCC2)CC1)c1cc(F)ccc1F	ZINC000875064500	FI	On-Demand	Anodyne	CACNA1H	47	38
C[C@@H](NC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1cc(F)ccc1F	ZINC000875064501	FI	On-Demand	Anodyne	CACNA1H	47	38
N#Cc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875064524	EF	On-Demand	Mild	F2	35	41
N#Cc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875064524	EF	On-Demand	Mild	TRY1_BOVIN	34	41
N#Cc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875064524	EF	On-Demand	Mild	DPP4	33	45
N#Cc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875064524	EF	On-Demand	Mild	PREP	47	46
N#Cc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875064524	EF	On-Demand	Mild	LGMN	65	37
N#Cc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875064524	EF	On-Demand	Mild	DPP8	19	45
N#Cc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875064524	EF	On-Demand	Mild	TMPRSS11D	67	45
N#Cc1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875064525	EF	On-Demand	Mild	F2	35	41
N#Cc1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875064525	EF	On-Demand	Mild	TRY1_BOVIN	34	41
N#Cc1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875064525	EF	On-Demand	Mild	DPP4	33	45
N#Cc1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875064525	EF	On-Demand	Mild	PREP	47	46
N#Cc1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875064525	EF	On-Demand	Mild	LGMN	65	37
N#Cc1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875064525	EF	On-Demand	Mild	DPP8	19	45
N#Cc1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875064525	EF	On-Demand	Mild	TMPRSS11D	67	45
N#Cc1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875064526	EF	On-Demand	Mild	F2	35	41
N#Cc1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875064526	EF	On-Demand	Mild	TRY1_BOVIN	34	41
N#Cc1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875064526	EF	On-Demand	Mild	DPP4	33	45
N#Cc1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875064526	EF	On-Demand	Mild	PREP	47	46
N#Cc1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875064526	EF	On-Demand	Mild	LGMN	65	37
N#Cc1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875064526	EF	On-Demand	Mild	DPP8	19	45
N#Cc1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875064526	EF	On-Demand	Mild	TMPRSS11D	67	45
N#Cc1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875064527	EF	On-Demand	Mild	F2	35	41
N#Cc1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875064527	EF	On-Demand	Mild	TRY1_BOVIN	34	41
N#Cc1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875064527	EF	On-Demand	Mild	DPP4	33	45
N#Cc1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875064527	EF	On-Demand	Mild	PREP	47	46
N#Cc1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875064527	EF	On-Demand	Mild	LGMN	65	37
N#Cc1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875064527	EF	On-Demand	Mild	DPP8	19	45
N#Cc1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875064527	EF	On-Demand	Mild	TMPRSS11D	67	45
CC[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1cccc(Cl)c1	ZINC000875064538	DH	On-Demand	Anodyne	CACNA1H	45	45
CC[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1cccc(Cl)c1	ZINC000875064538	DH	On-Demand	Anodyne	CACNA1I	41	37
CC[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1cccc(Cl)c1	ZINC000875064540	DH	On-Demand	Anodyne	CACNA1H	45	45
CC[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1cccc(Cl)c1	ZINC000875064540	DH	On-Demand	Anodyne	CACNA1I	41	37
N#Cc1cccc(CNC(=O)NC2CC(Nc3ccccc3)C2)c1	ZINC000875064556	DG	On-Demand	Mild	CCR3	21	44
N#Cc1cccc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)c1	ZINC000875064562	EF	On-Demand	Mild	FAAH	19	42
COC(=O)C1=NO[C@]2(CCN(C(=O)N[C@H](C)c3ccc(OC(C)C)cc3)C2)C1	ZINC000875064564	GF	On-Demand	Anodyne	ACACA	15	40
COC(=O)C1=NO[C@]2(CCN(C(=O)N[C@H](C)c3ccc(OC(C)C)cc3)C2)C1	ZINC000875064564	GF	On-Demand	Anodyne	ACACB	17	40
COC(=O)C1=NO[C@]2(CCN(C(=O)N[C@@H](C)c3ccc(OC(C)C)cc3)C2)C1	ZINC000875064565	GF	On-Demand	Anodyne	ACACA	15	40
COC(=O)C1=NO[C@]2(CCN(C(=O)N[C@@H](C)c3ccc(OC(C)C)cc3)C2)C1	ZINC000875064565	GF	On-Demand	Anodyne	ACACB	17	40
COC(=O)C1=NO[C@@]2(CCN(C(=O)N[C@H](C)c3ccc(OC(C)C)cc3)C2)C1	ZINC000875064566	GF	On-Demand	Anodyne	ACACA	15	40
COC(=O)C1=NO[C@@]2(CCN(C(=O)N[C@H](C)c3ccc(OC(C)C)cc3)C2)C1	ZINC000875064566	GF	On-Demand	Anodyne	ACACB	17	40
COC(=O)C1=NO[C@@]2(CCN(C(=O)N[C@@H](C)c3ccc(OC(C)C)cc3)C2)C1	ZINC000875064567	GF	On-Demand	Anodyne	ACACA	15	40
COC(=O)C1=NO[C@@]2(CCN(C(=O)N[C@@H](C)c3ccc(OC(C)C)cc3)C2)C1	ZINC000875064567	GF	On-Demand	Anodyne	ACACB	17	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccccc1OC(F)F	ZINC000875064574	FG	On-Demand	Anodyne	SLC6A4	22	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccccc1OC(F)F	ZINC000875064574	FG	On-Demand	Anodyne	SLC6A3	51	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccccc1OC(F)F	ZINC000875064575	FG	On-Demand	Anodyne	SLC6A4	22	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccccc1OC(F)F	ZINC000875064575	FG	On-Demand	Anodyne	SLC6A3	51	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccccc1OC(F)F	ZINC000875064576	FG	On-Demand	Anodyne	SLC6A4	22	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccccc1OC(F)F	ZINC000875064576	FG	On-Demand	Anodyne	SLC6A3	51	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccccc1OC(F)F	ZINC000875064577	FG	On-Demand	Anodyne	SLC6A4	22	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccccc1OC(F)F	ZINC000875064577	FG	On-Demand	Anodyne	SLC6A3	51	42
O=C(NCc1ccsc1)NC1CC(Nc2ccccc2)C1	ZINC000875064578	DG	On-Demand	Anodyne	EPHX2	15	42
CC(C)(C)NS(=O)(=O)c1cc(C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)ccc1Cl	ZINC000875064579	JJ	On-Demand	Mild	SCD1	44	49
CC(C)(C)NS(=O)(=O)c1cc(C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)ccc1Cl	ZINC000875064579	JJ	On-Demand	Mild	SCD	36	49
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875064582	FD	On-Demand	Anodyne	BIRC2	23	45
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875064583	FD	On-Demand	Anodyne	BIRC2	23	45
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875064584	FD	On-Demand	Anodyne	BIRC2	23	45
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875064585	FD	On-Demand	Anodyne	BIRC2	23	45
O=C(NC1CCC2(CC1)OCCO2)N1CCC(Oc2cccc(F)c2)CC1	ZINC000875064586	GG	On-Demand	Anodyne	MLNR	15	43
O=C(NC1CCC2(CC1)OCCO2)N1CCC(Oc2cccc(F)c2)CC1	ZINC000875064586	GG	On-Demand	Anodyne	EPHX2	34	46
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCN(C)C(C)(C)CC2)cc1	ZINC000875064587	GE	On-Demand	Anodyne	MMP13	23	40
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCN(C)C(C)(C)CC2)cc1	ZINC000875064587	GE	On-Demand	Anodyne	MMP9	22	40
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCN(C)C(C)(C)CC2)cc1	ZINC000875064587	GE	On-Demand	Anodyne	MMP1	28	40
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCN(C)C(C)(C)CC2)cc1	ZINC000875064587	GE	On-Demand	Anodyne	PSMB8	47	34
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCN(C)C(C)(C)CC2)cc1	ZINC000875064588	GE	On-Demand	Anodyne	MMP13	23	40
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCN(C)C(C)(C)CC2)cc1	ZINC000875064588	GE	On-Demand	Anodyne	MMP9	22	40
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCN(C)C(C)(C)CC2)cc1	ZINC000875064588	GE	On-Demand	Anodyne	MMP1	28	40
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCN(C)C(C)(C)CC2)cc1	ZINC000875064588	GE	On-Demand	Anodyne	PSMB8	47	34
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CC[C@H]3CSC[C@H]3C2)cc1	ZINC000875064589	GE	On-Demand	Anodyne	BIRC2	40	42
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CC[C@@H]3CSC[C@@H]3C2)cc1	ZINC000875064590	GE	On-Demand	Anodyne	BIRC2	40	42
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CC[C@@H]3CSC[C@H]3C2)cc1	ZINC000875064591	GE	On-Demand	Anodyne	BIRC2	40	42
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CC[C@H]3CSC[C@@H]3C2)cc1	ZINC000875064592	GE	On-Demand	Anodyne	BIRC2	40	42
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1cc(F)ccc1F	ZINC000875064611	ED	On-Demand	Anodyne	CACNA1H	62	44
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(C#N)c1	ZINC000875064617	CD	On-Demand	Mild	ANPEP	18	44
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(C#N)c1	ZINC000875064617	CD	On-Demand	Mild	CTSB	18	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(C#N)c1	ZINC000875064617	CD	On-Demand	Mild	PTGES	17	40
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(C#N)c1	ZINC000875064617	CD	On-Demand	Mild	PDS	50	48
N#Cc1cccc(CNC(=O)N2CCCCCCNC(=O)CC2)c1	ZINC000875064625	EE	On-Demand	Mild	DPP7	16	50
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(C#N)c1	ZINC000875064636	DD	On-Demand	Mild	SLC6A3	54	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(C#N)c1	ZINC000875064637	DD	On-Demand	Mild	SLC6A3	54	39
CC[C@@H](NC(=O)NCc1cccc(C#N)c1)[C@@H](O)c1ccccc1	ZINC000875064646	DF	On-Demand	Mild	CTSB	22	40
CC[C@@H](NC(=O)NCc1cccc(C#N)c1)[C@@H](O)c1ccccc1	ZINC000875064646	DF	On-Demand	Mild	CTSL	16	40
CC[C@@H](NC(=O)NCc1cccc(C#N)c1)[C@@H](O)c1ccccc1	ZINC000875064646	DF	On-Demand	Mild	CTRB_BOVIN	44	32
CC[C@@H](NC(=O)NCc1cccc(C#N)c1)[C@@H](O)c1ccccc1	ZINC000875064646	DF	On-Demand	Mild	PDS	54	48
CC[C@@H](NC(=O)NCc1cccc(C#N)c1)[C@H](O)c1ccccc1	ZINC000875064647	DF	On-Demand	Mild	CTSB	22	40
CC[C@@H](NC(=O)NCc1cccc(C#N)c1)[C@H](O)c1ccccc1	ZINC000875064647	DF	On-Demand	Mild	CTSL	16	40
CC[C@@H](NC(=O)NCc1cccc(C#N)c1)[C@H](O)c1ccccc1	ZINC000875064647	DF	On-Demand	Mild	CTRB_BOVIN	44	32
CC[C@@H](NC(=O)NCc1cccc(C#N)c1)[C@H](O)c1ccccc1	ZINC000875064647	DF	On-Demand	Mild	PDS	54	48
N#Cc1ccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000875064652	EG	On-Demand	Mild	EPHX2	21	53
N#Cc1ccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000875064653	EG	On-Demand	Mild	EPHX2	21	53
N#Cc1ccc(CNC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875064658	DC	On-Demand	Mild	NAMPT	19	41
COc1cccc([C@H](CNC(=O)NC2CCC3(CC2)OCCO3)OC)c1	ZINC000875064659	FE	On-Demand	Anodyne	C5AR1	23	43
CC[C@@H](CCc1ccccc1)NC(=O)NC1CCC2(CC1)OCCO2	ZINC000875064661	EG	On-Demand	Anodyne	TIMP3	55	36
CC[C@@H](CCc1ccccc1)NC(=O)NC1CCC2(CC1)OCCO2	ZINC000875064661	EG	On-Demand	Anodyne	MMP2	15	42
CC[C@@H](CCc1ccccc1)NC(=O)NC1CCC2(CC1)OCCO2	ZINC000875064661	EG	On-Demand	Anodyne	MMP3	21	41
CC[C@@H](CCc1ccccc1)NC(=O)NC1CCC2(CC1)OCCO2	ZINC000875064661	EG	On-Demand	Anodyne	C5AR1	30	45
CC[C@H](CCc1ccccc1)NC(=O)NC1CCC2(CC1)OCCO2	ZINC000875064662	EG	On-Demand	Anodyne	TIMP3	55	36
CC[C@H](CCc1ccccc1)NC(=O)NC1CCC2(CC1)OCCO2	ZINC000875064662	EG	On-Demand	Anodyne	MMP2	15	42
CC[C@H](CCc1ccccc1)NC(=O)NC1CCC2(CC1)OCCO2	ZINC000875064662	EG	On-Demand	Anodyne	MMP3	21	41
CC[C@H](CCc1ccccc1)NC(=O)NC1CCC2(CC1)OCCO2	ZINC000875064662	EG	On-Demand	Anodyne	C5AR1	30	45
CC[C@@H](NC(=O)N(C)OCC(F)(F)F)c1cccc(Cl)c1	ZINC000875064681	DH	On-Demand	Anodyne	PDS	62	41
CC[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1cccc(Cl)c1	ZINC000875064688	FE	On-Demand	Anodyne	CACNA1H	31	44
CC[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1cccc(Cl)c1	ZINC000875064688	FE	On-Demand	Anodyne	CCR5	19	43
CC[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1cccc(Cl)c1	ZINC000875064688	FE	On-Demand	Anodyne	EPHX2	21	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccsc1	ZINC000875064689	CD	On-Demand	Anodyne	SLC6A4	29	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccsc1	ZINC000875064689	CD	On-Demand	Anodyne	SLC6A3	53	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccsc1	ZINC000875064690	CD	On-Demand	Anodyne	SLC6A4	29	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccsc1	ZINC000875064690	CD	On-Demand	Anodyne	SLC6A3	53	44
CCC1(CC)CCCN1C(=O)NCc1cccc(C#N)c1	ZINC000875064691	CG	On-Demand	Mild	MCHR1	22	41
CCC1(CC)CCCN1C(=O)NCc1cccc(C#N)c1	ZINC000875064691	CG	On-Demand	Mild	SLC12A5	64	48
CC(C)(C)OC(=O)N1CCC2(CC1)CN(C(=O)NCc1cccc(C#N)c1)C2	ZINC000875064696	GG	On-Demand	Mild	GPR119	28	40
N#Cc1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875064698	EG	On-Demand	Mild	DPP4	22	42
N#Cc1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875064698	EG	On-Demand	Mild	PREP	41	43
N#Cc1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875064698	EG	On-Demand	Mild	LGMN	62	36
N#Cc1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875064698	EG	On-Demand	Mild	DPP7	18	41
N#Cc1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875064698	EG	On-Demand	Mild	TMPRSS11D	59	43
N#Cc1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875064699	EG	On-Demand	Mild	DPP4	22	42
N#Cc1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875064699	EG	On-Demand	Mild	PREP	41	43
N#Cc1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875064699	EG	On-Demand	Mild	LGMN	62	36
N#Cc1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875064699	EG	On-Demand	Mild	DPP7	18	41
N#Cc1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875064699	EG	On-Demand	Mild	TMPRSS11D	59	43
N#Cc1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875064700	EG	On-Demand	Mild	DPP4	22	42
N#Cc1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875064700	EG	On-Demand	Mild	PREP	41	43
N#Cc1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875064700	EG	On-Demand	Mild	LGMN	62	36
N#Cc1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875064700	EG	On-Demand	Mild	DPP7	18	41
N#Cc1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875064700	EG	On-Demand	Mild	TMPRSS11D	59	43
N#Cc1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875064701	EG	On-Demand	Mild	DPP4	22	42
N#Cc1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875064701	EG	On-Demand	Mild	PREP	41	43
N#Cc1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875064701	EG	On-Demand	Mild	LGMN	62	36
N#Cc1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875064701	EG	On-Demand	Mild	DPP7	18	41
N#Cc1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875064701	EG	On-Demand	Mild	TMPRSS11D	59	43
N#Cc1ccc(CNC(=O)N2CCC(c3nccc(-c4cccnc4)n3)CC2)cc1	ZINC000875064707	GG	On-Demand	Mild	NAMPT	51	37
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CC[C@H]3[C@@H](CCN3C)C2)cc1	ZINC000875064708	FD	On-Demand	Anodyne	BIRC2	39	43
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CC[C@@H]3[C@H](CCN3C)C2)cc1	ZINC000875064709	FD	On-Demand	Anodyne	BIRC2	39	43
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CC[C@@H]3[C@@H](CCN3C)C2)cc1	ZINC000875064710	FD	On-Demand	Anodyne	BIRC2	39	43
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CC[C@H]3[C@H](CCN3C)C2)cc1	ZINC000875064711	FD	On-Demand	Anodyne	BIRC2	39	43
COCCN(CC1CCN(C)CC1)C(=O)N[C@H](C)c1ccc(OC(C)C)cc1	ZINC000875064712	GH	On-Demand	Anodyne	ACACA	25	41
COCCN(CC1CCN(C)CC1)C(=O)N[C@H](C)c1ccc(OC(C)C)cc1	ZINC000875064712	GH	On-Demand	Anodyne	ACACB	26	41
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H](C)c1ccc(OC(C)C)cc1	ZINC000875064713	GH	On-Demand	Anodyne	ACACA	25	41
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H](C)c1ccc(OC(C)C)cc1	ZINC000875064713	GH	On-Demand	Anodyne	ACACB	26	41
N#Cc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875064722	EF	On-Demand	Mild	F2	37	45
N#Cc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875064722	EF	On-Demand	Mild	CCR3	19	41
N#Cc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875064722	EF	On-Demand	Mild	DPP4	29	48
N#Cc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875064722	EF	On-Demand	Mild	PREP	49	44
N#Cc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875064722	EF	On-Demand	Mild	DPP8	21	43
N#Cc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875064722	EF	On-Demand	Mild	TMPRSS11D	64	40
N#Cc1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875064723	EF	On-Demand	Mild	F2	37	45
N#Cc1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875064723	EF	On-Demand	Mild	CCR3	19	41
N#Cc1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875064723	EF	On-Demand	Mild	DPP4	29	48
N#Cc1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875064723	EF	On-Demand	Mild	PREP	49	44
N#Cc1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875064723	EF	On-Demand	Mild	DPP8	21	43
N#Cc1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875064723	EF	On-Demand	Mild	TMPRSS11D	64	40
N#Cc1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875064724	EF	On-Demand	Mild	F2	37	45
N#Cc1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875064724	EF	On-Demand	Mild	CCR3	19	41
N#Cc1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875064724	EF	On-Demand	Mild	DPP4	29	48
N#Cc1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875064724	EF	On-Demand	Mild	PREP	49	44
N#Cc1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875064724	EF	On-Demand	Mild	DPP8	21	43
N#Cc1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875064724	EF	On-Demand	Mild	TMPRSS11D	64	40
N#Cc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875064725	EF	On-Demand	Mild	F2	37	45
N#Cc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875064725	EF	On-Demand	Mild	CCR3	19	41
N#Cc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875064725	EF	On-Demand	Mild	DPP4	29	48
N#Cc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875064725	EF	On-Demand	Mild	PREP	49	44
N#Cc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875064725	EF	On-Demand	Mild	DPP8	21	43
N#Cc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875064725	EF	On-Demand	Mild	TMPRSS11D	64	40
COc1ccc(CC[C@H](C)NC(=O)C(=O)N[C@@H](C2CCC2)[C@@H]2CCOC2)cc1	ZINC000875064727	GE	On-Demand	Anodyne	PSMB8	46	36
COc1ccc(CC[C@H](C)NC(=O)C(=O)N[C@H](C2CCC2)[C@@H]2CCOC2)cc1	ZINC000875064728	GE	On-Demand	Anodyne	PSMB8	46	36
COc1ccc(CC[C@H](C)NC(=O)C(=O)N[C@@H](C2CCC2)[C@H]2CCOC2)cc1	ZINC000875064729	GE	On-Demand	Anodyne	PSMB8	46	36
COc1ccc(CC[C@H](C)NC(=O)C(=O)N[C@H](C2CCC2)[C@H]2CCOC2)cc1	ZINC000875064730	GE	On-Demand	Anodyne	PSMB8	46	36
N#Cc1ccc(Cc2cnc(NC(=O)c3ccc(CO)cc3)s2)cc1	ZINC000875064745	EG	On-Demand	Mild	ITK	23	42
N#Cc1ccc(Cc2cnc(NC(=O)c3ccc(CO)cc3)s2)cc1	ZINC000875064745	EG	On-Demand	Mild	SCD1	45	46
N#Cc1ccc(Cc2cnc(NC(=O)c3ccc(CO)cc3)s2)cc1	ZINC000875064745	EG	On-Demand	Mild	SCD	37	46
N#Cc1cccc(CNC(=O)N2CCC(c3nccc(-c4cccnc4)n3)CC2)c1	ZINC000875064753	GG	On-Demand	Mild	CHRNA7	21	40
N#Cc1ccc(CNC(=O)N2Cc3cccnc3N3C[C@H](O)C[C@H]3C2)cc1	ZINC000875064776	FD	On-Demand	Mild	NAMPT	22	43
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)CCc2ccc(OC(C)C)cc2)CC1	ZINC000875064790	GF	On-Demand	Anodyne	ACACA	15	47
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)CCc2ccc(OC(C)C)cc2)CC1	ZINC000875064790	GF	On-Demand	Anodyne	ACACB	24	47
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)CCc2ccc(OC(C)C)cc2)CC1	ZINC000875064791	GF	On-Demand	Anodyne	ACACA	15	47
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)CCc2ccc(OC(C)C)cc2)CC1	ZINC000875064791	GF	On-Demand	Anodyne	ACACB	24	47
CC[C@@H](NC(=O)NC[C@@H]1CCO[C@@H]1C(=O)OC)c1cccc(Cl)c1	ZINC000875064799	FF	On-Demand	Anodyne	PDS	63	38
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(C#N)cc2)C1	ZINC000875064805	DD	On-Demand	Mild	CTRB_BOVIN	51	36
COC(=O)C1(O)CN(C(=O)N[C@H](C)c2ccc(OC(C)C)cc2)C1	ZINC000875064840	ED	On-Demand	Anodyne	ACACA	27	48
COC(=O)C1(O)CN(C(=O)N[C@H](C)c2ccc(OC(C)C)cc2)C1	ZINC000875064840	ED	On-Demand	Anodyne	ACACB	40	48
COC(=O)C1(O)CN(C(=O)N[C@@H](C)c2ccc(OC(C)C)cc2)C1	ZINC000875064841	ED	On-Demand	Anodyne	ACACA	27	48
COC(=O)C1(O)CN(C(=O)N[C@@H](C)c2ccc(OC(C)C)cc2)C1	ZINC000875064841	ED	On-Demand	Anodyne	ACACB	40	48
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1ccccc1OC(F)F	ZINC000875064849	GH	On-Demand	Anodyne	HCN1	42	31
N#Cc1ccc(Cc2cnc(NC(=O)/C=C\c3nc4ccccc4s3)s2)cc1	ZINC000875064851	HJ	On-Demand	Mild	SCD	17	42
N#Cc1ccc(Cc2cnc(NC(=O)/C=C/c3nc4ccccc4s3)s2)cc1	ZINC000875064852	HJ	On-Demand	Mild	SCD	17	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C#N)cc1	ZINC000875064859	DD	On-Demand	Mild	SLC6A3	52	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C#N)cc1	ZINC000875064860	DD	On-Demand	Mild	SLC6A3	52	39
O=C(NCc1ccsc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875064869	EH	On-Demand	Anodyne	PREP	29	41
O=C(NCc1ccsc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875064869	EH	On-Demand	Anodyne	TMPRSS11D	51	32
O=C(NCc1ccsc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875064870	EH	On-Demand	Anodyne	PREP	29	41
O=C(NCc1ccsc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875064870	EH	On-Demand	Anodyne	TMPRSS11D	51	32
O=C(NCc1ccsc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875064871	EH	On-Demand	Anodyne	PREP	29	41
O=C(NCc1ccsc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875064871	EH	On-Demand	Anodyne	TMPRSS11D	51	32
O=C(NCc1ccsc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875064872	EH	On-Demand	Anodyne	PREP	29	41
O=C(NCc1ccsc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875064872	EH	On-Demand	Anodyne	TMPRSS11D	51	32
N#Cc1cccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875064886	EG	On-Demand	Mild	F2	27	42
N#Cc1cccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875064886	EG	On-Demand	Mild	CCR3	17	40
N#Cc1cccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875064886	EG	On-Demand	Mild	DPP4	15	45
N#Cc1cccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875064886	EG	On-Demand	Mild	PREP	44	41
N#Cc1cccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875064886	EG	On-Demand	Mild	TMPRSS11D	52	38
N#Cc1cccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875064887	EG	On-Demand	Mild	F2	27	42
N#Cc1cccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875064887	EG	On-Demand	Mild	CCR3	17	40
N#Cc1cccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875064887	EG	On-Demand	Mild	DPP4	15	45
N#Cc1cccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875064887	EG	On-Demand	Mild	PREP	44	41
N#Cc1cccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875064887	EG	On-Demand	Mild	TMPRSS11D	52	38
N#Cc1cccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875064888	EG	On-Demand	Mild	F2	27	42
N#Cc1cccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875064888	EG	On-Demand	Mild	CCR3	17	40
N#Cc1cccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875064888	EG	On-Demand	Mild	DPP4	15	45
N#Cc1cccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875064888	EG	On-Demand	Mild	PREP	44	41
N#Cc1cccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875064888	EG	On-Demand	Mild	TMPRSS11D	52	38
N#Cc1cccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875064889	EG	On-Demand	Mild	F2	27	42
N#Cc1cccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875064889	EG	On-Demand	Mild	CCR3	17	40
N#Cc1cccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875064889	EG	On-Demand	Mild	DPP4	15	45
N#Cc1cccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875064889	EG	On-Demand	Mild	PREP	44	41
N#Cc1cccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875064889	EG	On-Demand	Mild	TMPRSS11D	52	38
CC[C@@H]1COCCN1CCNC(=O)NCc1cccc(C#N)c1	ZINC000875064897	DD	On-Demand	Mild	CCR3	17	42
CC[C@@H](NC(=O)N1CC[C@]2(CC(C(=O)OC)=NO2)C1)c1cccc(Cl)c1	ZINC000875064901	GF	On-Demand	Anodyne	CACNA1H	33	41
CC[C@@H](NC(=O)N1CC[C@@]2(CC(C(=O)OC)=NO2)C1)c1cccc(Cl)c1	ZINC000875064903	GF	On-Demand	Anodyne	CACNA1H	33	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccsc1	ZINC000875064904	CE	On-Demand	Anodyne	ANPEP	15	40
COc1ccc(CC[C@@H](C)NC(=O)C(=O)NC2CCC(C)(N(C)C)CC2)cc1	ZINC000875064939	GF	On-Demand	Anodyne	BIRC2	24	41
COc1ccc(CC[C@@H](C)NC(=O)C(=O)NC2CCC(C)(N(C)C)CC2)cc1	ZINC000875064939	GF	On-Demand	Anodyne	PSMB8	46	33
COc1ccc(CC[C@H](C)NC(=O)C(=O)NC2CCC(C)(N(C)C)CC2)cc1	ZINC000875064940	GF	On-Demand	Anodyne	BIRC2	24	41
COc1ccc(CC[C@H](C)NC(=O)C(=O)NC2CCC(C)(N(C)C)CC2)cc1	ZINC000875064940	GF	On-Demand	Anodyne	PSMB8	46	33
CCCOc1ccc([C@H](C)NC(=O)C(=O)N[C@@H](C)c2ccnn2C)cc1OC	ZINC000875064942	GE	On-Demand	Anodyne	ENPP1	49	31
CCCOc1ccc([C@@H](C)NC(=O)C(=O)N[C@@H](C)c2ccnn2C)cc1OC	ZINC000875064943	GE	On-Demand	Anodyne	ENPP1	49	31
CCCOc1ccc([C@H](C)NC(=O)C(=O)N[C@H](C)c2ccnn2C)cc1OC	ZINC000875064944	GE	On-Demand	Anodyne	ENPP1	49	31
CCCOc1ccc([C@@H](C)NC(=O)C(=O)N[C@H](C)c2ccnn2C)cc1OC	ZINC000875064945	GE	On-Demand	Anodyne	ENPP1	49	31
CC[C@@H](NC(=O)N1Cc2cccc(O)c2C1)c1cccc(Cl)c1	ZINC000875064950	EI	On-Demand	Clean	CACNA1H	26	42
CC[C@@H](NC(=O)N1Cc2cccc(O)c2C1)c1cccc(Cl)c1	ZINC000875064950	EI	On-Demand	Clean	MAPK1	43	39
CCC1(CC)CCCN1C(=O)NCc1ccc(C#N)cc1	ZINC000875064954	CG	On-Demand	Mild	SLC12A5	44	44
N#Cc1cccc(CNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)c1	ZINC000875064963	EF	On-Demand	Mild	EPHX2	15	49
N#Cc1cccc(CNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)c1	ZINC000875064963	EF	On-Demand	Mild	SLC12A5	25	43
N#Cc1cccc(CNC(=O)N2CCC[C@](O)(c3ccccc3)C2)c1	ZINC000875064964	EF	On-Demand	Mild	EPHX2	15	49
N#Cc1cccc(CNC(=O)N2CCC[C@](O)(c3ccccc3)C2)c1	ZINC000875064964	EF	On-Demand	Mild	SLC12A5	25	43
CC[C@@H](NC(=O)NCc1ccsc1)[C@@H](O)c1ccccc1	ZINC000875064965	DG	On-Demand	Anodyne	ANPEP	16	42
CC[C@@H](NC(=O)NCc1ccsc1)[C@H](O)c1ccccc1	ZINC000875064967	DG	On-Demand	Anodyne	ANPEP	16	42
CC[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1cccc(Cl)c1	ZINC000875064980	CF	On-Demand	Anodyne	PDS	61	41
CC[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1cccc(Cl)c1	ZINC000875064991	EF	On-Demand	Anodyne	CACNA1H	63	54
CC[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1cccc(Cl)c1	ZINC000875064991	EF	On-Demand	Anodyne	KCNQ2	26	41
CC[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1cccc(Cl)c1	ZINC000875064991	EF	On-Demand	Anodyne	MAPK1	45	39
CC[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1cccc(Cl)c1	ZINC000875064991	EF	On-Demand	Anodyne	PDS	28	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(OC(C)C)cc1	ZINC000875065004	FG	On-Demand	Anodyne	SLC6A4	21	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(OC(C)C)cc1	ZINC000875065004	FG	On-Demand	Anodyne	SLC6A3	46	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(OC(C)C)cc1	ZINC000875065004	FG	On-Demand	Anodyne	ACACA	27	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(OC(C)C)cc1	ZINC000875065004	FG	On-Demand	Anodyne	ACACB	40	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(OC(C)C)cc1	ZINC000875065005	FG	On-Demand	Anodyne	SLC6A4	21	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(OC(C)C)cc1	ZINC000875065005	FG	On-Demand	Anodyne	SLC6A3	46	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(OC(C)C)cc1	ZINC000875065005	FG	On-Demand	Anodyne	ACACA	27	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(OC(C)C)cc1	ZINC000875065005	FG	On-Demand	Anodyne	ACACB	40	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(OC(C)C)cc1	ZINC000875065006	FG	On-Demand	Anodyne	SLC6A4	21	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(OC(C)C)cc1	ZINC000875065006	FG	On-Demand	Anodyne	SLC6A3	46	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(OC(C)C)cc1	ZINC000875065006	FG	On-Demand	Anodyne	ACACA	27	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(OC(C)C)cc1	ZINC000875065006	FG	On-Demand	Anodyne	ACACB	40	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(OC(C)C)cc1	ZINC000875065007	FG	On-Demand	Anodyne	SLC6A4	21	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(OC(C)C)cc1	ZINC000875065007	FG	On-Demand	Anodyne	SLC6A3	46	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(OC(C)C)cc1	ZINC000875065007	FG	On-Demand	Anodyne	ACACA	27	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(OC(C)C)cc1	ZINC000875065007	FG	On-Demand	Anodyne	ACACB	40	42
COC(=O)N(C)NC(=O)NCc1cccc(C#N)c1	ZINC000875065012	CC	On-Demand	Reactive	ROCK2	19	45
N#Cc1cccc(CNC(=O)NCC[C@H](O)C2CCCC2)c1	ZINC000875065013	DE	On-Demand	Mild	CCR3	18	41
N#Cc1cccc(CNC(=O)NCC[C@@H](O)C2CCCC2)c1	ZINC000875065014	DE	On-Demand	Mild	CCR3	18	41
Cc1nnc(NNC(=O)N[C@H](C)c2ccc(OC(C)C)cc2)n1C	ZINC000875065027	EE	On-Demand	Reactive	ACACA	22	45
Cc1nnc(NNC(=O)N[C@H](C)c2ccc(OC(C)C)cc2)n1C	ZINC000875065027	EE	On-Demand	Reactive	ACACB	31	45
Cc1nnc(NNC(=O)N[C@@H](C)c2ccc(OC(C)C)cc2)n1C	ZINC000875065028	EE	On-Demand	Reactive	ACACA	22	45
Cc1nnc(NNC(=O)N[C@@H](C)c2ccc(OC(C)C)cc2)n1C	ZINC000875065028	EE	On-Demand	Reactive	ACACB	31	45
N#Cc1cccc(CNC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875065031	CD	On-Demand	Mild	CCR3	15	40
CC(C)(C)OC(=O)N1CC[C@H]2[C@H]1CCCN2C(=O)NCc1cccc(C#N)c1	ZINC000875065047	GG	On-Demand	Mild	DPP4	22	43
CC(C)(C)OC(=O)N1CC[C@@H]2[C@H]1CCCN2C(=O)NCc1cccc(C#N)c1	ZINC000875065048	GG	On-Demand	Mild	DPP4	22	43
CC(C)(C)OC(=O)N1CC[C@H]2[C@@H]1CCCN2C(=O)NCc1cccc(C#N)c1	ZINC000875065049	GG	On-Demand	Mild	DPP4	22	43
CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H]1CCCN2C(=O)NCc1cccc(C#N)c1	ZINC000875065050	GG	On-Demand	Mild	DPP4	22	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cc(F)ccc1F	ZINC000875065054	EF	On-Demand	Anodyne	SLC6A4	24	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cc(F)ccc1F	ZINC000875065054	EF	On-Demand	Anodyne	SLC6A3	51	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cc(F)ccc1F	ZINC000875065055	EF	On-Demand	Anodyne	SLC6A4	24	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cc(F)ccc1F	ZINC000875065055	EF	On-Demand	Anodyne	SLC6A3	51	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cc(F)ccc1F	ZINC000875065056	EF	On-Demand	Anodyne	SLC6A4	24	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cc(F)ccc1F	ZINC000875065056	EF	On-Demand	Anodyne	SLC6A3	51	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cc(F)ccc1F	ZINC000875065057	EF	On-Demand	Anodyne	SLC6A4	24	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cc(F)ccc1F	ZINC000875065057	EF	On-Demand	Anodyne	SLC6A3	51	42
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)c1ccc(OC(C)C)cc1	ZINC000875065066	DG	On-Demand	Anodyne	ACACA	29	49
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)c1ccc(OC(C)C)cc1	ZINC000875065066	DG	On-Demand	Anodyne	ACACB	39	49
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)c1ccc(OC(C)C)cc1	ZINC000875065067	DG	On-Demand	Anodyne	ACACA	29	49
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)c1ccc(OC(C)C)cc1	ZINC000875065067	DG	On-Demand	Anodyne	ACACB	39	49
O=C(NC1CCC2(CC1)OCCO2)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875065074	FE	On-Demand	Anodyne	EPHX2	23	44
O=C(NC1CCC2(CC1)OCCO2)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875065075	FE	On-Demand	Anodyne	EPHX2	23	44
CC[C@@H](NC(=O)NCc1ccc(C#N)cc1)[C@@H](O)c1ccccc1	ZINC000875065085	DF	On-Demand	Mild	ANPEP	15	44
CC[C@@H](NC(=O)NCc1ccc(C#N)cc1)[C@@H](O)c1ccccc1	ZINC000875065085	DF	On-Demand	Mild	CTRB_BOVIN	48	35
CC[C@@H](NC(=O)NCc1ccc(C#N)cc1)[C@@H](O)c1ccccc1	ZINC000875065085	DF	On-Demand	Mild	PDS	44	41
CC[C@@H](NC(=O)NCc1ccc(C#N)cc1)[C@H](O)c1ccccc1	ZINC000875065086	DF	On-Demand	Mild	ANPEP	15	44
CC[C@@H](NC(=O)NCc1ccc(C#N)cc1)[C@H](O)c1ccccc1	ZINC000875065086	DF	On-Demand	Mild	CTRB_BOVIN	48	35
CC[C@@H](NC(=O)NCc1ccc(C#N)cc1)[C@H](O)c1ccccc1	ZINC000875065086	DF	On-Demand	Mild	PDS	44	41
CC[C@@H](NC(=O)N1CCCN(C=O)CC1)c1cccc(Cl)c1	ZINC000875065090	DF	On-Demand	Anodyne	CACNA1H	32	45
CC[C@@H](NC(=O)N1CCCN(C=O)CC1)c1cccc(Cl)c1	ZINC000875065090	DF	On-Demand	Anodyne	KCNQ2	36	43
N#Cc1cccc(CNC(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875065094	DC	On-Demand	Mild	MCHR1	16	40
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3cccc(C#N)c3)C[C@@H]1C2	ZINC000875065103	DD	On-Demand	Mild	MCHR1	17	47
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccc(C#N)c2)C1	ZINC000875065104	DD	On-Demand	Mild	CTRB_BOVIN	46	33
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875065123	GC	On-Demand	Anodyne	MMP13	33	41
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875065123	GC	On-Demand	Anodyne	MMP9	34	41
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875065123	GC	On-Demand	Anodyne	MMP1	41	41
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875065123	GC	On-Demand	Anodyne	PSMB8	44	35
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875065124	GC	On-Demand	Anodyne	MMP13	33	41
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875065124	GC	On-Demand	Anodyne	MMP9	34	41
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875065124	GC	On-Demand	Anodyne	MMP1	41	41
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875065124	GC	On-Demand	Anodyne	PSMB8	44	35
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H](C)c1cc(F)ccc1F	ZINC000875065128	FG	On-Demand	Anodyne	CACNA1I	45	31
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H](C)c1cc(F)ccc1F	ZINC000875065128	FG	On-Demand	Anodyne	ACKR3	45	32
COCCN(CC1CCN(C)CC1)C(=O)N[C@H](C)c1cc(F)ccc1F	ZINC000875065129	FG	On-Demand	Anodyne	CACNA1I	45	31
COCCN(CC1CCN(C)CC1)C(=O)N[C@H](C)c1cc(F)ccc1F	ZINC000875065129	FG	On-Demand	Anodyne	ACKR3	45	32
N#Cc1ccc(Cc2cnc(NC(=O)/C=C\c3ccc4ccccc4n3)s2)cc1	ZINC000875065132	GJ	On-Demand	Mild	SCD	17	42
N#Cc1ccc(Cc2cnc(NC(=O)/C=C/c3ccc4ccccc4n3)s2)cc1	ZINC000875065133	GJ	On-Demand	Mild	SCD	17	42
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875065139	FD	On-Demand	Anodyne	CHRM2	49	38
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875065139	FD	On-Demand	Anodyne	MMP13	38	40
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875065139	FD	On-Demand	Anodyne	MMP8	22	40
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875065139	FD	On-Demand	Anodyne	DPP7	24	42
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875065139	FD	On-Demand	Anodyne	MMP1	46	39
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875065139	FD	On-Demand	Anodyne	BIRC2	27	42
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875065139	FD	On-Demand	Anodyne	PSMB8	47	35
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875065140	FD	On-Demand	Anodyne	CHRM2	49	38
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875065140	FD	On-Demand	Anodyne	MMP13	38	40
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875065140	FD	On-Demand	Anodyne	MMP8	22	40
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875065140	FD	On-Demand	Anodyne	DPP7	24	42
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875065140	FD	On-Demand	Anodyne	MMP1	46	39
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875065140	FD	On-Demand	Anodyne	BIRC2	27	42
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875065140	FD	On-Demand	Anodyne	PSMB8	47	35
N#Cc1ccc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)cc1	ZINC000875065145	EF	On-Demand	Mild	SIGMAR1	18	42
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875065147	FD	On-Demand	Anodyne	FKBP1A	21	41
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875065147	FD	On-Demand	Anodyne	MMP13	27	42
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875065147	FD	On-Demand	Anodyne	MMP3	27	42
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875065147	FD	On-Demand	Anodyne	MMP8	17	42
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875065147	FD	On-Demand	Anodyne	DPP7	55	46
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875065147	FD	On-Demand	Anodyne	MMP1	34	42
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875065147	FD	On-Demand	Anodyne	BIRC2	35	44
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875065147	FD	On-Demand	Anodyne	PSMB8	47	36
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875065148	FD	On-Demand	Anodyne	FKBP1A	21	41
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875065148	FD	On-Demand	Anodyne	MMP13	27	42
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875065148	FD	On-Demand	Anodyne	MMP3	27	42
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875065148	FD	On-Demand	Anodyne	MMP8	17	42
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875065148	FD	On-Demand	Anodyne	DPP7	55	46
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875065148	FD	On-Demand	Anodyne	MMP1	34	42
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875065148	FD	On-Demand	Anodyne	BIRC2	35	44
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875065148	FD	On-Demand	Anodyne	PSMB8	47	36
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875065149	FD	On-Demand	Anodyne	FKBP1A	21	41
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875065149	FD	On-Demand	Anodyne	MMP13	27	42
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875065149	FD	On-Demand	Anodyne	MMP3	27	42
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875065149	FD	On-Demand	Anodyne	MMP8	17	42
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875065149	FD	On-Demand	Anodyne	DPP7	55	46
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875065149	FD	On-Demand	Anodyne	MMP1	34	42
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875065149	FD	On-Demand	Anodyne	BIRC2	35	44
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875065149	FD	On-Demand	Anodyne	PSMB8	47	36
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875065150	FD	On-Demand	Anodyne	FKBP1A	21	41
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875065150	FD	On-Demand	Anodyne	MMP13	27	42
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875065150	FD	On-Demand	Anodyne	MMP3	27	42
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875065150	FD	On-Demand	Anodyne	MMP8	17	42
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875065150	FD	On-Demand	Anodyne	DPP7	55	46
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875065150	FD	On-Demand	Anodyne	MMP1	34	42
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875065150	FD	On-Demand	Anodyne	BIRC2	35	44
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875065150	FD	On-Demand	Anodyne	PSMB8	47	36
COC(=O)N(C)NC(=O)N[C@H](C)c1ccc(OC(C)C)cc1	ZINC000875065152	DE	On-Demand	Reactive	ACACA	31	54
COC(=O)N(C)NC(=O)N[C@H](C)c1ccc(OC(C)C)cc1	ZINC000875065152	DE	On-Demand	Reactive	ACACB	44	54
COC(=O)N(C)NC(=O)N[C@@H](C)c1ccc(OC(C)C)cc1	ZINC000875065153	DE	On-Demand	Reactive	ACACA	31	54
COC(=O)N(C)NC(=O)N[C@@H](C)c1ccc(OC(C)C)cc1	ZINC000875065153	DE	On-Demand	Reactive	ACACB	44	54
N#Cc1ccc(CNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)cc1	ZINC000875065154	EF	On-Demand	Mild	EPHX2	15	51
N#Cc1ccc(CNC(=O)N2CCC[C@](O)(c3ccccc3)C2)cc1	ZINC000875065155	EF	On-Demand	Mild	EPHX2	15	51
N#Cc1ccc(CNC(=O)N2Cc3cccnc3N3CCC[C@H]3C2)cc1	ZINC000875065186	EF	On-Demand	Mild	NAMPT	26	43
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)cc1	ZINC000875065237	FF	On-Demand	Anodyne	MMP1	43	39
COc1ccc(CC[C@@H](C)NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)cc1	ZINC000875065237	FF	On-Demand	Anodyne	PSMB8	44	31
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)cc1	ZINC000875065238	FF	On-Demand	Anodyne	MMP1	43	39
COc1ccc(CC[C@H](C)NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)cc1	ZINC000875065238	FF	On-Demand	Anodyne	PSMB8	44	31
O=C(NCc1ccsc1C(F)(F)F)NC1CCC2(CC1)OCCO2	ZINC000875065262	FG	On-Demand	Anodyne	C5AR1	29	40
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NC1CCC3(CC1)OCCO3)CC2	ZINC000875065265	GG	On-Demand	Anodyne	SLC18A2	47	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NC1CCC3(CC1)OCCO3)CC2	ZINC000875065266	GG	On-Demand	Anodyne	SLC18A2	47	36
N#Cc1ccc(Cc2cnc(NC(=O)/C=C\c3ccccc3F)s2)cc1	ZINC000875065283	FI	On-Demand	Mild	SCD	29	43
N#Cc1ccc(Cc2cnc(NC(=O)/C=C/c3ccccc3F)s2)cc1	ZINC000875065284	FI	On-Demand	Mild	SCD	29	43
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCC2(CC1)OCCO2	ZINC000875065299	FE	On-Demand	Anodyne	C5AR1	35	43
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCC2(CC1)OCCO2	ZINC000875065300	FE	On-Demand	Anodyne	C5AR1	35	43
O=C(NC1CCC2(CC1)OCCO2)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875065308	FE	On-Demand	Anodyne	DRD4	21	43
O=C(NC1CCC2(CC1)OCCO2)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875065308	FE	On-Demand	Anodyne	SIGMAR1	38	45
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCCCN1CCOCC1	ZINC000875065388	FC	On-Demand	Anodyne	HTR1A	36	43
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCCCN1CCOCC1	ZINC000875065388	FC	On-Demand	Anodyne	DRD2	45	43
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCCCN1CCOCC1	ZINC000875065388	FC	On-Demand	Anodyne	HTR2A	27	40
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCCCN1CCOCC1	ZINC000875065388	FC	On-Demand	Anodyne	DRD3	79	43
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCCCN1CCOCC1	ZINC000875065388	FC	On-Demand	Anodyne	CASR	40	36
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCCCN1CCOCC1	ZINC000875065389	FC	On-Demand	Anodyne	HTR1A	36	43
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCCCN1CCOCC1	ZINC000875065389	FC	On-Demand	Anodyne	DRD2	45	43
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCCCN1CCOCC1	ZINC000875065389	FC	On-Demand	Anodyne	HTR2A	27	40
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCCCN1CCOCC1	ZINC000875065389	FC	On-Demand	Anodyne	DRD3	79	43
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCCCN1CCOCC1	ZINC000875065389	FC	On-Demand	Anodyne	CASR	40	36
C[C@H](NC(=O)C(=O)NCCCCN1CCC[C@@H](C)C1)c1ccnn1C	ZINC000875065392	ED	On-Demand	Anodyne	SLC6A1	80	36
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	ZINC000875065400	GC	On-Demand	Anodyne	LPL	39	41
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	ZINC000875065400	GC	On-Demand	Anodyne	CA1	15	41
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	ZINC000875065400	GC	On-Demand	Anodyne	GRM4	15	41
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	ZINC000875065400	GC	On-Demand	Anodyne	TGM2	78	47
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	ZINC000875065400	GC	On-Demand	Anodyne	F13A1	98	47
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	ZINC000875065400	GC	On-Demand	Anodyne	NAMPT	56	45
CN(C)S(=O)(=O)c1cc(C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)ccc1Cl	ZINC000875065420	JH	On-Demand	Mild	ITK	25	43
CN(C)S(=O)(=O)c1cc(C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)ccc1Cl	ZINC000875065420	JH	On-Demand	Mild	SCD1	44	50
CN(C)S(=O)(=O)c1cc(C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)ccc1Cl	ZINC000875065420	JH	On-Demand	Mild	SCD	36	50
N#Cc1ccc(Cc2cnc(NC(=O)c3cc(S(=O)(=O)N4CCCC4)ccc3Cl)s2)cc1	ZINC000875065468	JI	On-Demand	Mild	ITGA4	51	33
N#Cc1ccc(Cc2cnc(NC(=O)c3cc(S(=O)(=O)N4CCCC4)ccc3Cl)s2)cc1	ZINC000875065468	JI	On-Demand	Mild	SCD1	34	40
N#Cc1ccc(Cc2cnc(NC(=O)c3cc(S(=O)(=O)N4CCCC4)ccc3Cl)s2)cc1	ZINC000875065468	JI	On-Demand	Mild	SCD	27	40
COC(=O)N(C)NC(=O)NCc1ccccc1COCc1ccccc1	ZINC000875065469	FF	On-Demand	Reactive	NPR	41	30
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1CN1CCN(CC)CC1	ZINC000875065476	GE	On-Demand	Anodyne	ANPEP	16	41
C[C@H](NC(=O)C(=O)NCCCCN1CCCC[C@H]1C)c1cc2cnccc2o1	ZINC000875065501	GF	On-Demand	Anodyne	HRH3	57	39
C[C@H](NC(=O)C(=O)NCCCCN1CCCC[C@@H]1C)c1cc2cnccc2o1	ZINC000875065503	GF	On-Demand	Anodyne	HRH3	57	39
C[C@H]1CCCCN1CCCCNC(=O)C(=O)N[C@H](C)c1cc2cnccc2o1	ZINC000875065505	GF	On-Demand	Anodyne	HRH3	57	39
O=C(NCc1cccc(COCc2ccccc2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875065524	FF	On-Demand	Anodyne	PDS	44	31
CCOc1ccccc1[C@@H](CC)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875065577	FE	On-Demand	Anodyne	HCN1	50	36
CCOc1ccccc1[C@@H](CC)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875065577	FE	On-Demand	Anodyne	HCN4	40	35
COC(=O)N(C)NC(=O)NCc1cccc(COCc2ccccc2)c1	ZINC000875065578	FF	On-Demand	Reactive	PDS	47	33
CCOc1ccccc1[C@H](CC)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875065581	FE	On-Demand	Anodyne	HCN1	50	36
CCOc1ccccc1[C@H](CC)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875065581	FE	On-Demand	Anodyne	HCN4	40	35
CCOc1ccccc1[C@@H](CC)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875065584	FE	On-Demand	Anodyne	HCN1	50	36
CCOc1ccccc1[C@@H](CC)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875065584	FE	On-Demand	Anodyne	HCN4	40	35
CCOc1ccccc1[C@H](CC)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875065588	FE	On-Demand	Anodyne	HCN1	50	36
CCOc1ccccc1[C@H](CC)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875065588	FE	On-Demand	Anodyne	HCN4	40	35
O=C(NCc1nc(-c2ccncc2)cs1)NC1CCC2(CC1)OCCO2	ZINC000875065627	FF	On-Demand	Anodyne	ROCK1	21	44
O=C(NCc1nc(-c2ccncc2)cs1)NC1CCC2(CC1)OCCO2	ZINC000875065627	FF	On-Demand	Anodyne	ROCK2	15	44
COC(=O)C1(O)CN(C(=O)NCc2ccccc2COCc2ccccc2)C1	ZINC000875065665	GD	On-Demand	Anodyne	SLC12A5	52	37
O=C(NC1CCC2(CC1)OCCO2)N[C@@H](CO)c1cccc(C(F)(F)F)c1	ZINC000875065706	GF	On-Demand	Anodyne	CCR2	43	36
O=C(NC1CCC2(CC1)OCCO2)N[C@H](CO)c1cccc(C(F)(F)F)c1	ZINC000875065707	GF	On-Demand	Anodyne	CCR2	43	36
CN1CCC(CNC(=O)NC2CCC3(CC2)OCCO3)(c2ccccc2)CC1	ZINC000875065754	GF	On-Demand	Anodyne	KCNA3	52	47
CN1CCC(CNC(=O)NC2CCC3(CC2)OCCO3)(c2ccccc2)CC1	ZINC000875065754	GF	On-Demand	Anodyne	SOAT1	15	43
O=C1CCCN1Cc1ccccc1CNC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875065788	GG	On-Demand	Anodyne	EPHX2	24	46
O=C1CCCN1Cc1ccccc1CNC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875065789	GG	On-Demand	Anodyne	EPHX2	24	46
C[C@H]1CCCCN1CCCCNC(=O)C(=O)NCc1cccc2ncccc12	ZINC000875065790	GF	On-Demand	Anodyne	HRH3	38	41
C[C@H]1CCCCN1CCCCNC(=O)C(=O)NCc1cccc2ncccc12	ZINC000875065790	GF	On-Demand	Anodyne	HNMT	52	37
C[C@@H]1CCCCN1CCCCNC(=O)C(=O)NCc1cccc2ncccc12	ZINC000875065791	GF	On-Demand	Anodyne	HRH3	38	41
C[C@@H]1CCCCN1CCCCNC(=O)C(=O)NCc1cccc2ncccc12	ZINC000875065791	GF	On-Demand	Anodyne	HNMT	52	37
O=C(NC1CCC2(CC1)OCCO2)N1CCC(Oc2ccccc2F)CC1	ZINC000875065863	GG	On-Demand	Anodyne	EPHX2	33	43
CCOc1ccccc1[C@H](CC)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875065865	FE	On-Demand	Anodyne	HCN1	51	37
CCOc1ccccc1[C@H](CC)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875065865	FE	On-Demand	Anodyne	HCN4	43	35
CCOc1ccccc1[C@@H](CC)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875065866	FE	On-Demand	Anodyne	HCN1	51	37
CCOc1ccccc1[C@@H](CC)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875065866	FE	On-Demand	Anodyne	HCN4	43	35
O=C(NCc1ccccc1CN1CCCC1=O)NNc1cccc(F)c1Cl	ZINC000875065887	GG	On-Demand	Reactive	P2RX7	50	39
Cc1ccc(CN2CC[C@H](NC(=O)NC3CCC4(CC3)OCCO4)C2)cc1	ZINC000875065901	FF	On-Demand	Anodyne	CHRM2	15	45
Cc1ccc(CN2CC[C@H](NC(=O)NC3CCC4(CC3)OCCO4)C2)cc1	ZINC000875065901	FF	On-Demand	Anodyne	DRD4	37	48
Cc1ccc(CN2CC[C@H](NC(=O)NC3CCC4(CC3)OCCO4)C2)cc1	ZINC000875065901	FF	On-Demand	Anodyne	CHRM3	22	45
Cc1ccc(CN2CC[C@H](NC(=O)NC3CCC4(CC3)OCCO4)C2)cc1	ZINC000875065901	FF	On-Demand	Anodyne	SIGMAR1	32	44
Cc1ccc(CN2CC[C@H](NC(=O)NC3CCC4(CC3)OCCO4)C2)cc1	ZINC000875065901	FF	On-Demand	Anodyne	SSTR5	45	36
Cc1ccc(CN2CC[C@H](NC(=O)NC3CCC4(CC3)OCCO4)C2)cc1	ZINC000875065901	FF	On-Demand	Anodyne	CCR3	29	49
Cc1ccc(CN2CC[C@H](NC(=O)NC3CCC4(CC3)OCCO4)C2)cc1	ZINC000875065901	FF	On-Demand	Anodyne	CCR2	15	46
Cc1ccc(CN2CC[C@H](NC(=O)NC3CCC4(CC3)OCCO4)C2)cc1	ZINC000875065901	FF	On-Demand	Anodyne	EPHX2	20	44
Cc1ccc(CN2CC[C@H](NC(=O)NC3CCC4(CC3)OCCO4)C2)cc1	ZINC000875065901	FF	On-Demand	Anodyne	MCHR1	42	54
Cc1ccc(CN2CC[C@@H](NC(=O)NC3CCC4(CC3)OCCO4)C2)cc1	ZINC000875065902	FF	On-Demand	Anodyne	CHRM2	15	45
Cc1ccc(CN2CC[C@@H](NC(=O)NC3CCC4(CC3)OCCO4)C2)cc1	ZINC000875065902	FF	On-Demand	Anodyne	DRD4	37	48
Cc1ccc(CN2CC[C@@H](NC(=O)NC3CCC4(CC3)OCCO4)C2)cc1	ZINC000875065902	FF	On-Demand	Anodyne	CHRM3	22	45
Cc1ccc(CN2CC[C@@H](NC(=O)NC3CCC4(CC3)OCCO4)C2)cc1	ZINC000875065902	FF	On-Demand	Anodyne	SIGMAR1	32	44
Cc1ccc(CN2CC[C@@H](NC(=O)NC3CCC4(CC3)OCCO4)C2)cc1	ZINC000875065902	FF	On-Demand	Anodyne	SSTR5	45	36
Cc1ccc(CN2CC[C@@H](NC(=O)NC3CCC4(CC3)OCCO4)C2)cc1	ZINC000875065902	FF	On-Demand	Anodyne	CCR3	29	49
Cc1ccc(CN2CC[C@@H](NC(=O)NC3CCC4(CC3)OCCO4)C2)cc1	ZINC000875065902	FF	On-Demand	Anodyne	CCR2	15	46
Cc1ccc(CN2CC[C@@H](NC(=O)NC3CCC4(CC3)OCCO4)C2)cc1	ZINC000875065902	FF	On-Demand	Anodyne	EPHX2	20	44
Cc1ccc(CN2CC[C@@H](NC(=O)NC3CCC4(CC3)OCCO4)C2)cc1	ZINC000875065902	FF	On-Demand	Anodyne	MCHR1	42	54
O=C1CCCN1Cc1ccccc1CNC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875065918	GF	On-Demand	Anodyne	EPHX2	15	42
O=C1CCCN1Cc1ccccc1CNC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875065920	GF	On-Demand	Anodyne	EPHX2	15	42
CCOc1ccccc1[C@H](CC)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875065929	GD	On-Demand	Anodyne	HCN1	53	35
CCOc1ccccc1[C@H](CC)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875065929	GD	On-Demand	Anodyne	HCN4	45	35
CCOc1ccccc1[C@@H](CC)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875065931	GD	On-Demand	Anodyne	HCN1	53	35
CCOc1ccccc1[C@@H](CC)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875065931	GD	On-Demand	Anodyne	HCN4	45	35
O=C(NCc1ccc(COCc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875065976	GF	On-Demand	Anodyne	PREP	18	41
O=C(NCc1ccc(COCc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875065976	GF	On-Demand	Anodyne	EPHX2	18	43
O=C(NCc1ccc(COCc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875065976	GF	On-Demand	Anodyne	NPSR1	27	42
O=C(NCc1ccc(COCc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875065976	GF	On-Demand	Anodyne	SLC12A5	62	35
O=C(NCc1ccc(COCc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875065976	GF	On-Demand	Anodyne	NAMPT	27	45
CN1CCN(C2CCN(C(=O)C(=O)NCCc3c(F)cccc3F)CC2)CC1	ZINC000875065977	GC	On-Demand	Anodyne	L3MBTL3	63	40
COC(=O)C1(O)CN(C(=O)NCc2ccc(COCc3ccccc3)cc2)C1	ZINC000875065980	GD	On-Demand	Anodyne	SLC12A5	68	38
COC(=O)C1(O)CN(C(=O)NCc2ccc(COCc3ccccc3)cc2)C1	ZINC000875065980	GD	On-Demand	Anodyne	NAMPT	20	41
O=C(NCc1cccc(COCc2ccccc2)c1)N1CCC(CO)(CO)CC1	ZINC000875065983	GF	On-Demand	Anodyne	EPHX2	15	44
O=C(NCc1cccc(COCc2ccccc2)c1)N1CCC(CO)(CO)CC1	ZINC000875065983	GF	On-Demand	Anodyne	SLC12A5	42	33
C[C@H]1C[C@@H](C)CN(Cc2ccc(CNC(=O)N3CCCN(C=O)CC3)cc2)C1	ZINC000875066021	GF	On-Demand	Anodyne	MLNR	43	33
O=C(NC1CCC2(CC1)OCCO2)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875066092	FF	On-Demand	Anodyne	OXTR	44	37
O=C(NC1CCC2(CC1)OCCO2)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875066093	FF	On-Demand	Anodyne	OXTR	44	37
C[C@H](NC(=O)C(=O)NCCCCN1CCOCC1)c1cc2cnccc2o1	ZINC000875066139	FD	On-Demand	Anodyne	HTR1A	18	41
C[C@H](NC(=O)C(=O)NCCCCN1CCOCC1)c1cc2cnccc2o1	ZINC000875066139	FD	On-Demand	Anodyne	DRD3	45	41
C[C@H](NC(=O)C(=O)NCCCCN1CCOCC1)c1cc2cnccc2o1	ZINC000875066139	FD	On-Demand	Anodyne	CASR	47	39
O=C(NCc1ccccc1CC(F)(F)F)NC1CCC2(CC1)OCCO2	ZINC000875066140	FG	On-Demand	Anodyne	EPHX2	15	42
C[C@H]1CCCCN1CCCCNC(=O)C(=O)NC[C@@H]1c2ccccc2CN1C	ZINC000875066157	GE	On-Demand	Anodyne	DRD3	20	40
C[C@H]1CCCCN1CCCCNC(=O)C(=O)NC[C@H]1c2ccccc2CN1C	ZINC000875066158	GE	On-Demand	Anodyne	DRD3	20	40
C[C@@H]1CCCCN1CCCCNC(=O)C(=O)NC[C@H]1c2ccccc2CN1C	ZINC000875066159	GE	On-Demand	Anodyne	DRD3	20	40
C[C@@H]1CCCCN1CCCCNC(=O)C(=O)NC[C@@H]1c2ccccc2CN1C	ZINC000875066161	GE	On-Demand	Anodyne	DRD3	20	40
C[C@H]1CC(=O)N[C@@H](C(=O)Nc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)C1	ZINC000875066174	GC	On-Demand	Anodyne	TGM2	66	43
C[C@H]1CC(=O)N[C@@H](C(=O)Nc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)C1	ZINC000875066174	GC	On-Demand	Anodyne	F13A1	91	44
C[C@H]1CC(=O)N[C@@H](C(=O)Nc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)C1	ZINC000875066174	GC	On-Demand	Anodyne	NAMPT	38	40
O=C(NCCCCN1CCOCC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875066200	EC	On-Demand	Anodyne	EPHX2	15	42
CC[C@@H](NC(=O)NCc1ccc(COC)cc1)[C@@H](O)c1ccccc1	ZINC000875066205	EG	On-Demand	Anodyne	ANPEP	17	44
CC[C@@H](NC(=O)NCc1ccc(COC)cc1)[C@@H](O)c1ccccc1	ZINC000875066205	EG	On-Demand	Anodyne	CAPN2	64	37
CC[C@@H](NC(=O)NCc1ccc(COC)cc1)[C@@H](O)c1ccccc1	ZINC000875066205	EG	On-Demand	Anodyne	PDS	48	37
CC[C@@H](NC(=O)NCc1ccc(COC)cc1)[C@H](O)c1ccccc1	ZINC000875066208	EG	On-Demand	Anodyne	ANPEP	17	44
CC[C@@H](NC(=O)NCc1ccc(COC)cc1)[C@H](O)c1ccccc1	ZINC000875066208	EG	On-Demand	Anodyne	CAPN2	64	37
CC[C@@H](NC(=O)NCc1ccc(COC)cc1)[C@H](O)c1ccccc1	ZINC000875066208	EG	On-Demand	Anodyne	PDS	48	37
CCOc1ccccc1[C@H](CC)NC(=O)C(=O)N1CC[C@@H]2[C@H](CCN2C)C1	ZINC000875066240	FE	On-Demand	Anodyne	HCN1	48	32
CCOc1ccccc1[C@H](CC)NC(=O)C(=O)N1CC[C@@H]2[C@H](CCN2C)C1	ZINC000875066240	FE	On-Demand	Anodyne	HCN4	41	32
CCOc1ccccc1[C@H](CC)NC(=O)C(=O)N1CC[C@H]2[C@H](CCN2C)C1	ZINC000875066241	FE	On-Demand	Anodyne	HCN1	48	32
CCOc1ccccc1[C@H](CC)NC(=O)C(=O)N1CC[C@H]2[C@H](CCN2C)C1	ZINC000875066241	FE	On-Demand	Anodyne	HCN4	41	32
CCOc1ccccc1[C@H](CC)NC(=O)C(=O)N1CC[C@@H]2[C@@H](CCN2C)C1	ZINC000875066242	FE	On-Demand	Anodyne	HCN1	48	32
CCOc1ccccc1[C@H](CC)NC(=O)C(=O)N1CC[C@@H]2[C@@H](CCN2C)C1	ZINC000875066242	FE	On-Demand	Anodyne	HCN4	41	32
CCOc1ccccc1[C@H](CC)NC(=O)C(=O)N1CC[C@H]2[C@@H](CCN2C)C1	ZINC000875066243	FE	On-Demand	Anodyne	HCN1	48	32
CCOc1ccccc1[C@H](CC)NC(=O)C(=O)N1CC[C@H]2[C@@H](CCN2C)C1	ZINC000875066243	FE	On-Demand	Anodyne	HCN4	41	32
O=C(NCc1csc(C(F)(F)F)c1)NC1CCC2(CC1)OCCO2	ZINC000875066250	FG	On-Demand	Anodyne	C5AR1	26	41
CC(C)(C)OC(=O)C1CC(NC(=O)C(=O)NCCCCN2CCOCC2)C1	ZINC000875066272	GC	On-Demand	Anodyne	DRD2	16	42
CC(C)(C)OC(=O)C1CC(NC(=O)C(=O)NCCCCN2CCOCC2)C1	ZINC000875066272	GC	On-Demand	Anodyne	PAOX	18	44
CC[C@]1(C(=O)Nc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)CCNC1=O	ZINC000875066278	GC	On-Demand	Anodyne	TGM2	63	42
CC[C@]1(C(=O)Nc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)CCNC1=O	ZINC000875066278	GC	On-Demand	Anodyne	F13A1	90	42
CC[C@]1(C(=O)Nc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)CCNC1=O	ZINC000875066278	GC	On-Demand	Anodyne	NAMPT	46	41
O=C(NCc1ccc(O)c(Cl)c1)NC1CCC2(CC1)OCCO2	ZINC000875066283	EF	On-Demand	Anodyne	NCE103	15	46
CCOc1ccccc1[C@@H](CC)NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1	ZINC000875066337	GG	On-Demand	Anodyne	HCN1	47	32
CCOc1ccccc1[C@@H](CC)NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1	ZINC000875066337	GG	On-Demand	Anodyne	HCN4	41	32
CCOc1ccccc1[C@H](CC)NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1	ZINC000875066339	GG	On-Demand	Anodyne	HCN1	47	32
CCOc1ccccc1[C@H](CC)NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1	ZINC000875066339	GG	On-Demand	Anodyne	HCN4	41	32
CN(C(=O)NC1CCC2(CC1)OCCO2)[C@@H](CCc1ccccc1)C(F)F	ZINC000875066347	GH	On-Demand	Anodyne	C5AR1	35	42
CN(C(=O)NC1CCC2(CC1)OCCO2)[C@H](CCc1ccccc1)C(F)F	ZINC000875066352	GH	On-Demand	Anodyne	C5AR1	35	42
O=C(NC1CCC2(CC1)OCCO2)NC1CC(Nc2ccccc2)C1	ZINC000875066355	EF	On-Demand	Anodyne	EPHX2	18	44
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)c1	ZINC000875066420	IG	On-Demand	Mild	SCD1	37	40
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)c1	ZINC000875066420	IG	On-Demand	Mild	SCD	31	42
O=C(NCCCCN1CCOCC1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875066431	GC	On-Demand	Anodyne	DRD3	28	44
O=C(NCCCCN1CCOCC1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875066431	GC	On-Demand	Anodyne	CASR	52	38
O=C(NCCCCN1CCOCC1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875066431	GC	On-Demand	Anodyne	TACR2	18	41
O=C(NCCCCN1CCOCC1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875066432	GC	On-Demand	Anodyne	DRD3	28	44
O=C(NCCCCN1CCOCC1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875066432	GC	On-Demand	Anodyne	CASR	52	38
O=C(NCCCCN1CCOCC1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875066432	GC	On-Demand	Anodyne	TACR2	18	41
O=C(NCCCCN1CCOCC1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875066433	GC	On-Demand	Anodyne	DRD3	28	44
O=C(NCCCCN1CCOCC1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875066433	GC	On-Demand	Anodyne	CASR	52	38
O=C(NCCCCN1CCOCC1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875066433	GC	On-Demand	Anodyne	TACR2	18	41
O=C(NCCCCN1CCOCC1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875066434	GC	On-Demand	Anodyne	DRD3	28	44
O=C(NCCCCN1CCOCC1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875066434	GC	On-Demand	Anodyne	CASR	52	38
O=C(NCCCCN1CCOCC1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875066434	GC	On-Demand	Anodyne	TACR2	18	41
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NC1CCC2(CC1)OCCO2	ZINC000875066439	GF	On-Demand	Anodyne	C5AR1	33	42
O=C(NC1CCC2(CC1)OCCO2)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875066440	GE	On-Demand	Anodyne	FKBP1A	22	41
O=C(NC1CCC2(CC1)OCCO2)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875066440	GE	On-Demand	Anodyne	CTSL	18	40
O=C(NC1CCC2(CC1)OCCO2)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875066440	GE	On-Demand	Anodyne	EPHX2	23	43
O=C(NC1CCC2(CC1)OCCO2)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875066440	GE	On-Demand	Anodyne	C5AR1	29	40
O=C(NC1CCC2(CC1)OCCO2)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875066440	GE	On-Demand	Anodyne	NAAA	28	41
O=C(NC1CCC2(CC1)OCCO2)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875066440	GE	On-Demand	Anodyne	SLC12A5	68	38
COCc1ccccc1CNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875066453	ED	On-Demand	Anodyne	CCR3	15	48
COCc1ccccc1CNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875066453	ED	On-Demand	Anodyne	EPHX2	17	41
O=CN1CCCN(C(=O)NCc2cccc(COCc3ccccc3)c2)CC1	ZINC000875066485	GF	On-Demand	Anodyne	PREP	25	40
O=CN1CCCN(C(=O)NCc2ccc(COCc3ccccc3)cc2)CC1	ZINC000875066533	GF	On-Demand	Anodyne	PREP	35	45
O=CN1CCCN(C(=O)NCc2ccc(COCc3ccccc3)cc2)CC1	ZINC000875066533	GF	On-Demand	Anodyne	DPP7	40	41
O=CN1CCCN(C(=O)NCc2ccc(COCc3ccccc3)cc2)CC1	ZINC000875066533	GF	On-Demand	Anodyne	TPSAB1	17	44
O=CN1CCCN(C(=O)NCc2ccc(COCc3ccccc3)cc2)CC1	ZINC000875066533	GF	On-Demand	Anodyne	NPSR1	26	41
O=CN1CCCN(C(=O)NCc2ccc(COCc3ccccc3)cc2)CC1	ZINC000875066533	GF	On-Demand	Anodyne	NAMPT	15	42
O=CN1CCCN(C(=O)NCc2ccc(COCc3ccccc3)cc2)CC1	ZINC000875066533	GF	On-Demand	Anodyne	TMPRSS11D	47	34
COC(=O)C1(O)CN(C(=O)NCc2cccc(COCc3ccccc3)c2)C1	ZINC000875066542	GD	On-Demand	Anodyne	SLC12A5	65	37
O=C(NCc1ccc(CN2CCc3ccccc32)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875066546	FF	On-Demand	Anodyne	AVPR2	23	41
O=C(NC1CCC2(CC1)OCCO2)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875066565	GF	On-Demand	Anodyne	SMO	38	47
O=C(NC1CCC2(CC1)OCCO2)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875066565	GF	On-Demand	Anodyne	ETHR	52	47
N#Cc1ccc(N2CCN(C(=O)C(=O)NCCCCN3CCOCC3)CC2)cc1	ZINC000875066579	GC	On-Demand	Mild	HTR1A	28	44
N#Cc1ccc(N2CCN(C(=O)C(=O)NCCCCN3CCOCC3)CC2)cc1	ZINC000875066579	GC	On-Demand	Mild	DRD2	24	44
N#Cc1ccc(N2CCN(C(=O)C(=O)NCCCCN3CCOCC3)CC2)cc1	ZINC000875066579	GC	On-Demand	Mild	DRD3	44	54
N#Cc1ccc(Cc2cnc(NC(=O)[C@@H]3CCCN3C(=O)C34CC5CC(CC(C5)C3)C4)s2)cc1	ZINC000875066600	JJ	On-Demand	Mild	LGMN	45	34
N#Cc1ccc(Cc2cnc(NC(=O)[C@H]3CCCN3C(=O)C34CC5CC(CC(C5)C3)C4)s2)cc1	ZINC000875066601	JJ	On-Demand	Mild	LGMN	45	34
CC(=O)Nc1nc(COC(=O)c2ccc(C)c(S(N)(=O)=O)c2)cs1	ZINC000875066606	FD	On-Demand	Anodyne	AOC3	21	42
O=C(NCCCCN1CCOCC1)C(=O)NCc1cccc2ncccc12	ZINC000875066619	FD	On-Demand	Anodyne	EGFR	17	40
O=C(NCCCCN1CCOCC1)C(=O)NCc1cccc2ncccc12	ZINC000875066619	FD	On-Demand	Anodyne	HTR1A	43	46
O=C(NCCCCN1CCOCC1)C(=O)NCc1cccc2ncccc12	ZINC000875066619	FD	On-Demand	Anodyne	DRD2	41	46
O=C(NCCCCN1CCOCC1)C(=O)NCc1cccc2ncccc12	ZINC000875066619	FD	On-Demand	Anodyne	DRD4	20	46
O=C(NCCCCN1CCOCC1)C(=O)NCc1cccc2ncccc12	ZINC000875066619	FD	On-Demand	Anodyne	ACHE	15	44
O=C(NCCCCN1CCOCC1)C(=O)NCc1cccc2ncccc12	ZINC000875066619	FD	On-Demand	Anodyne	HTR2A	30	45
O=C(NCCCCN1CCOCC1)C(=O)NCc1cccc2ncccc12	ZINC000875066619	FD	On-Demand	Anodyne	DRD3	54	46
O=C(NCCCCN1CCOCC1)C(=O)NCc1cccc2ncccc12	ZINC000875066619	FD	On-Demand	Anodyne	CASR	41	37
O=C(NCCCCN1CCOCC1)C(=O)NCc1cccc2ncccc12	ZINC000875066619	FD	On-Demand	Anodyne	HTR7	46	36
O=C(NCCCCN1CCOCC1)C(=O)NCc1cccc2ncccc12	ZINC000875066619	FD	On-Demand	Anodyne	BCHE	23	44
O=C(NCCCCN1CCOCC1)C(=O)NCc1cccc2ncccc12	ZINC000875066619	FD	On-Demand	Anodyne	CCR4	18	42
O=C(NCCCCN1CCOCC1)C(=O)NCc1cccc2ncccc12	ZINC000875066619	FD	On-Demand	Anodyne	HNMT	92	43
O=C(NCCCCN1CCOCC1)C(=O)NCc1cccc2ncccc12	ZINC000875066619	FD	On-Demand	Anodyne	HPGDS	23	41
O=C(NCc1ccccc1COCc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875066633	GF	On-Demand	Anodyne	EPHX2	15	46
O=C(NC1CCC2(CC1)OCCO2)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875066642	FG	On-Demand	Anodyne	C3AR1	42	42
O=C(NC1CCC2(CC1)OCCO2)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875066643	FG	On-Demand	Anodyne	C3AR1	42	42
O=C(NC1CCC2(CC1)OCCO2)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875066666	GD	On-Demand	Anodyne	SMO	29	43
O=C(NC1CCC2(CC1)OCCO2)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875066667	GD	On-Demand	Anodyne	SMO	29	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(COC)cc1	ZINC000875066714	CE	On-Demand	Anodyne	ANPEP	19	45
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(COC)cc1	ZINC000875066714	CE	On-Demand	Anodyne	CAPN2	46	37
C[C@H](NC(=O)C(=O)NCCCCN1CCCC[C@H]1C)c1ccnn1C	ZINC000875066717	ED	On-Demand	Anodyne	HRH3	43	37
C[C@H](NC(=O)C(=O)NCCCCN1CCCC[C@@H]1C)c1ccnn1C	ZINC000875066718	ED	On-Demand	Anodyne	HRH3	43	37
C[C@H]1CCCCN1CCCCNC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875066720	ED	On-Demand	Anodyne	HRH3	43	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(COCc2ccco2)c1	ZINC000875066723	GG	On-Demand	Anodyne	SLC6A4	19	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(COCc2ccco2)c1	ZINC000875066723	GG	On-Demand	Anodyne	SLC6A3	36	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(COCc2ccco2)c1	ZINC000875066724	GG	On-Demand	Anodyne	SLC6A4	19	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(COCc2ccco2)c1	ZINC000875066724	GG	On-Demand	Anodyne	SLC6A3	36	40
C[C@H]1C[C@@H](C)CN(CCCCNC(=O)C(=O)NCc2cccc3ncccc23)C1	ZINC000875066739	GF	On-Demand	Anodyne	HTR1A	20	41
C[C@H]1C[C@@H](C)CN(CCCCNC(=O)C(=O)NCc2cccc3ncccc23)C1	ZINC000875066739	GF	On-Demand	Anodyne	DRD3	17	41
C[C@H]1C[C@@H](C)CN(CCCCNC(=O)C(=O)NCc2cccc3ncccc23)C1	ZINC000875066739	GF	On-Demand	Anodyne	HNMT	51	37
C[C@@H]1C[C@@H](C)CN(CCCCNC(=O)C(=O)NCc2cccc3ncccc23)C1	ZINC000875066740	GF	On-Demand	Anodyne	HTR1A	20	41
C[C@@H]1C[C@@H](C)CN(CCCCNC(=O)C(=O)NCc2cccc3ncccc23)C1	ZINC000875066740	GF	On-Demand	Anodyne	DRD3	17	41
C[C@@H]1C[C@@H](C)CN(CCCCNC(=O)C(=O)NCc2cccc3ncccc23)C1	ZINC000875066740	GF	On-Demand	Anodyne	HNMT	51	37
O=C(NCc1ccc(COCc2ccccc2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875066760	FF	On-Demand	Anodyne	EPHX2	19	47
O=C(NCc1ccc(COCc2ccccc2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875066760	FF	On-Demand	Anodyne	PDS	41	34
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(COCc2ccco2)c1	ZINC000875066778	FG	On-Demand	Anodyne	PDS	41	32
COC(=O)N(C)NC(=O)NCc1ccc(COCc2ccccc2)cc1	ZINC000875066844	FF	On-Demand	Reactive	CTSB	42	37
COC(=O)N(C)NC(=O)NCc1ccc(COCc2ccccc2)cc1	ZINC000875066844	FF	On-Demand	Reactive	PDS	47	35
O=C(NCc1cccnc1-n1ccnc1)N[C@@H]1C[C@H](CO)C1	ZINC000875066882	DC	On-Demand	Anodyne	NOS2	70	33
COCCCCNC(=O)C(=O)NC[C@H]1c2ccccc2CN1C	ZINC000875066885	DC	On-Demand	Anodyne	DRD3	46	35
COCCCCNC(=O)C(=O)NC[C@@H]1c2ccccc2CN1C	ZINC000875066886	DC	On-Demand	Anodyne	DRD3	46	35
CN(CCNC(=O)NCc1cccnc1-n1ccnc1)CC(F)F	ZINC000875066889	ED	On-Demand	Anodyne	NOS2	41	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccnc1-n1ccnc1	ZINC000875066890	FD	On-Demand	Anodyne	NOS2	56	33
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccnc1-n1ccnc1	ZINC000875066891	FD	On-Demand	Anodyne	NOS2	56	33
COC(=O)[C@@]1(C)CN(C(=O)NCc2cccnc2-n2ccnc2)C[C@@H]1C	ZINC000875066914	FD	On-Demand	Anodyne	NOS2	58	34
O=C(NCc1cccnc1-n1ccnc1)N1CCc2nc(C3CC3)ncc2C1	ZINC000875066915	GE	On-Demand	Anodyne	NOS2	85	35
COCCCCNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875066923	FD	On-Demand	Anodyne	ETHR	60	47
O=C(NCc1cccnc1-n1ccnc1)N1CCCC[C@@H]1[C@H]1CCCC[C@H]1O	ZINC000875066925	GF	On-Demand	Anodyne	NOS2	76	36
O=C(NCc1cccnc1-n1ccnc1)N1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O	ZINC000875066926	GF	On-Demand	Anodyne	NOS2	76	36
O=C(NCc1cccnc1-n1ccnc1)N1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O	ZINC000875066927	GF	On-Demand	Anodyne	NOS2	76	36
O=C(NCc1cccnc1-n1ccnc1)N1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O	ZINC000875066928	GF	On-Demand	Anodyne	NOS2	76	36
O=C(NCC[C@H](O)C1CCCC1)NCc1cccc(CN2CCCC2=O)c1	ZINC000875066934	FF	On-Demand	Anodyne	TYRO3	17	40
O=C(NCC[C@@H](O)C1CCCC1)NCc1cccc(CN2CCCC2=O)c1	ZINC000875066935	FF	On-Demand	Anodyne	TYRO3	17	40
C=CCOc1ccc(/C=C\C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)cc1OC	ZINC000875066936	IJ	On-Demand	Mild	SCD1	38	40
C=CCOc1ccc(/C=C\C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)cc1OC	ZINC000875066936	IJ	On-Demand	Mild	SCD	33	49
C=CCOc1ccc(/C=C/C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)cc1OC	ZINC000875066937	IJ	On-Demand	Mild	SCD1	38	40
C=CCOc1ccc(/C=C/C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)cc1OC	ZINC000875066937	IJ	On-Demand	Mild	SCD	33	49
CC(=O)C1CCN(C(=O)C(=O)NCCc2ccc(OC(F)(F)F)cc2)CC1	ZINC000875066953	GE	On-Demand	Anodyne	EPHX2	48	42
O=C(NCc1cccnc1-n1ccnc1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875066960	GE	On-Demand	Anodyne	NOS2	54	37
C[C@H](NC(=O)C(=O)NCc1c(Cl)cccc1Cl)c1ccnn1C	ZINC000875066964	FE	On-Demand	Anodyne	P2RX7	18	41
CN1CCO[C@H](CN(C)C(=O)NCc2cccnc2-n2ccnc2)C1	ZINC000875066965	EC	On-Demand	Anodyne	NOS2	96	38
CCOC(=O)[C@@]1(C)CN(C(=O)NCc2cccnc2-n2ccnc2)CCO1	ZINC000875066968	FD	On-Demand	Anodyne	NOS2	85	34
COC(=O)[C@@]1(OC)CCN(C(=O)NCc2cccnc2-n2ccnc2)C1	ZINC000875066971	FC	On-Demand	Anodyne	NOS2	67	34
O=C(NCc1cccnc1-n1ccnc1)N1CC2(CCCO2)C1	ZINC000875066974	DD	On-Demand	Anodyne	NOS2	65	34
CCOCCCCNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875066985	GD	On-Demand	Clean	HTR1A	39	45
CCOCCCCNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875066985	GD	On-Demand	Clean	DRD2	39	47
CCOCCCCNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875066985	GD	On-Demand	Clean	DRD4	43	34
CCOCCCCNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875066985	GD	On-Demand	Clean	ADRA1D	22	41
CCOCCCCNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875066985	GD	On-Demand	Clean	ADRA1A	22	41
CCOCCCCNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875066985	GD	On-Demand	Clean	DRD3	64	47
COCCCCNC(=O)C(=O)NC[C@@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000875066990	GC	On-Demand	Anodyne	DRD4	31	46
COCCCCNC(=O)C(=O)NC[C@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000875066991	GC	On-Demand	Anodyne	DRD4	31	46
COCCCCNC(=O)C(=O)N1CCO[C@H](c2ccccc2OC)C1	ZINC000875067002	FD	On-Demand	Anodyne	DRD2	26	41
COCCCCNC(=O)C(=O)N1CCO[C@H](c2ccccc2OC)C1	ZINC000875067002	FD	On-Demand	Anodyne	DRD4	23	41
COCCCCNC(=O)C(=O)N1CCO[C@H](c2ccccc2OC)C1	ZINC000875067002	FD	On-Demand	Anodyne	DRD3	44	39
COCCCCNC(=O)C(=O)N1CCO[C@@H](c2ccccc2OC)C1	ZINC000875067003	FD	On-Demand	Anodyne	DRD2	26	41
COCCCCNC(=O)C(=O)N1CCO[C@@H](c2ccccc2OC)C1	ZINC000875067003	FD	On-Demand	Anodyne	DRD4	23	41
COCCCCNC(=O)C(=O)N1CCO[C@@H](c2ccccc2OC)C1	ZINC000875067003	FD	On-Demand	Anodyne	DRD3	44	39
O=C(NCc1cccnc1-n1ccnc1)N[C@@H]1Cc2cncn2C1	ZINC000875067004	DC	On-Demand	Anodyne	NOS2	49	31
O=C(NCc1cccnc1-n1ccnc1)N[C@H]1Cc2cncn2C1	ZINC000875067005	DC	On-Demand	Anodyne	NOS2	49	31
COCC(C)(C)CCNC(=O)C(=O)N[C@@H](C)c1ccc(NC(=O)C2CC2)cc1	ZINC000875067006	GE	On-Demand	Anodyne	F7	15	48
COCC(C)(C)CCNC(=O)C(=O)N[C@H](C)c1ccc(NC(=O)C2CC2)cc1	ZINC000875067007	GE	On-Demand	Anodyne	F7	15	48
N#Cc1ccc(Cc2cnc(NC(=O)c3ccc(C4SCCS4)cc3)s2)cc1	ZINC000875067026	HK	On-Demand	Mild	ITK	19	40
N#Cc1ccc(Cc2cnc(NC(=O)c3ccc(C4SCCS4)cc3)s2)cc1	ZINC000875067026	HK	On-Demand	Mild	SCD1	39	40
N#Cc1ccc(Cc2cnc(NC(=O)c3ccc(C4SCCS4)cc3)s2)cc1	ZINC000875067026	HK	On-Demand	Mild	SCD	33	40
C[C@H]1CCC[C@@H](C2CN(C(=O)NCc3cccnc3-n3ccnc3)C2)C1	ZINC000875067030	FG	On-Demand	Anodyne	NOS2	73	34
C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1cccnc1-n1ccnc1	ZINC000875067032	ED	On-Demand	Anodyne	NOS2	56	31
C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1cccnc1-n1ccnc1	ZINC000875067034	ED	On-Demand	Anodyne	NOS2	56	31
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1cccnc1-n1ccnc1	ZINC000875067035	ED	On-Demand	Anodyne	NOS2	56	31
COCCCCNC(=O)C(=O)N1CC[C@@H](c2cccc(Cl)c2)C1(C)C	ZINC000875067050	FF	On-Demand	Anodyne	MDM2	48	31
COCCCCNC(=O)C(=O)N1CC[C@H](c2cccc(Cl)c2)C1(C)C	ZINC000875067051	FF	On-Demand	Anodyne	MDM2	48	31
CCOCCCCNC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875067055	FD	On-Demand	Anodyne	NPY2R	52	36
O=C1CCN(C(=O)NCc2cccnc2-n2ccnc2)CCCCCCN1	ZINC000875067059	FD	On-Demand	Anodyne	NOS2	53	33
CCOCCCCNC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1C	ZINC000875067091	GE	On-Demand	Anodyne	SLC18A2	48	36
CCOCCCCNC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1C	ZINC000875067091	GE	On-Demand	Anodyne	MTNR1B	15	41
CCOCCCCNC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1C	ZINC000875067092	GE	On-Demand	Anodyne	SLC18A2	48	36
CCOCCCCNC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1C	ZINC000875067092	GE	On-Demand	Anodyne	MTNR1B	15	41
CCOC(=O)[C@@H]1CN(C(=O)NCc2cccnc2-n2ccnc2)CCC1(F)F	ZINC000875067093	GD	On-Demand	Anodyne	NOS2	84	35
O=C(NCc1cccnc1-n1ccnc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875067095	FE	On-Demand	Anodyne	NOS2	96	37
O=C(NCc1cccnc1-n1ccnc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875067096	FE	On-Demand	Anodyne	NOS2	96	37
O=C(NCc1cccnc1-n1ccnc1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875067097	FF	On-Demand	Anodyne	NOS2	82	34
O=C(NCc1cccnc1-n1ccnc1)NC1([C@H]2CCCCO2)CCC1	ZINC000875067098	FF	On-Demand	Anodyne	NOS2	82	34
O=C(NCc1cccnc1-n1ccnc1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875067099	GE	On-Demand	Anodyne	NOS2	61	36
O=C(NCc1cccnc1-n1ccnc1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875067100	GE	On-Demand	Anodyne	NOS2	61	36
O=C(NCc1cccnc1-n1ccnc1)N1CCO[C@@H](C(F)F)CC1	ZINC000875067110	FD	On-Demand	Anodyne	NOS2	98	38
O=C(NCc1cccnc1-n1ccnc1)N1CCO[C@H](C(F)F)CC1	ZINC000875067111	FD	On-Demand	Anodyne	NOS2	98	38
COCCCCNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875067113	GC	On-Demand	Clean	HTR1A	49	48
COCCCCNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875067113	GC	On-Demand	Clean	DRD2	46	48
COCCCCNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875067113	GC	On-Demand	Clean	DRD4	47	37
COCCCCNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875067113	GC	On-Demand	Clean	ADRA1D	26	44
COCCCCNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875067113	GC	On-Demand	Clean	HTR2A	16	40
COCCCCNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875067113	GC	On-Demand	Clean	ADRA1A	27	45
COCCCCNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875067113	GC	On-Demand	Clean	DRD3	78	48
N#Cc1ccc(Cc2cnc(NC(=O)c3ccc(Br)c([N+](=O)[O-])c3)s2)cc1	ZINC000875067114	IJ	On-Demand	Mild	SCD1	40	42
N#Cc1ccc(Cc2cnc(NC(=O)c3ccc(Br)c([N+](=O)[O-])c3)s2)cc1	ZINC000875067114	IJ	On-Demand	Mild	SCD	34	42
O=C(CN1CCCCC(=O)C1=O)Nc1cc(Cl)c(Cl)cc1Cl	ZINC000875067121	FG	On-Demand	Anodyne	HEMY	45	35
N#Cc1ccc(Cc2cnc(NC(=O)c3ccc(S(=O)(=O)C(F)F)cc3)s2)cc1	ZINC000875067136	IH	On-Demand	Mild	SCD1	39	40
N#Cc1ccc(Cc2cnc(NC(=O)c3ccc(S(=O)(=O)C(F)F)cc3)s2)cc1	ZINC000875067136	IH	On-Demand	Mild	SCD	34	43
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)NCc1cccnc1-n1ccnc1	ZINC000875067141	ED	On-Demand	Anodyne	NOS2	68	32
O=C(NCc1cccnc1-n1ccnc1)N1CCCC2(CC1)CC2	ZINC000875067146	EF	On-Demand	Anodyne	NOS2	89	36
CCOCCCCNC(=O)C(=O)NC[C@H]1c2ccccc2CN1C	ZINC000875067151	ED	On-Demand	Anodyne	ADAM9	42	35
CCOCCCCNC(=O)C(=O)NC[C@@H]1c2ccccc2CN1C	ZINC000875067152	ED	On-Demand	Anodyne	ADAM9	42	35
CCOCCCCNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875067157	GD	On-Demand	Anodyne	ETHR	59	46
CO[C@H]1CN(C(=O)NCc2cccnc2-n2ccnc2)[C@](C)(CO)C1	ZINC000875067159	EC	On-Demand	Anodyne	NOS2	71	34
CO[C@H]1CN(C(=O)NCc2cccnc2-n2ccnc2)[C@@](C)(CO)C1	ZINC000875067160	EC	On-Demand	Anodyne	NOS2	71	34
O=C(NCc1cccnc1-n1ccnc1)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875067184	FD	On-Demand	Anodyne	NOS2	95	38
O=C(NCc1cccnc1-n1ccnc1)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875067185	FD	On-Demand	Anodyne	NOS2	95	38
CCOCCCCNC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875067192	EE	On-Demand	Anodyne	OXTR	45	35
CCOCCCCNC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875067193	EE	On-Demand	Anodyne	OXTR	45	35
CN(C)C[C@@H]1CN(C(=O)NCc2cccnc2-n2ccnc2)C[C@H]1CN(C)C	ZINC000875067195	GD	On-Demand	Anodyne	NOS2	95	38
CN1CCN(C(=O)NCc2cccnc2-n2ccnc2)CCC1(C)C	ZINC000875067223	ED	On-Demand	Anodyne	NOS2	70	35
CCO[C@@H](C(=O)Nc1ccc(S(=O)(=O)N(C)OC)cc1)C(C)C	ZINC000875067233	ED	On-Demand	Anodyne	CA14	15	44
CCO[C@@H](C(=O)Nc1ccc(S(=O)(=O)N(C)OC)cc1)C(C)C	ZINC000875067233	ED	On-Demand	Anodyne	MMP12	43	36
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2ccc(OC(F)(F)F)cc2)C1	ZINC000875067248	GE	On-Demand	Anodyne	GCGR	17	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2ccc(OC(F)(F)F)cc2)C1	ZINC000875067249	GE	On-Demand	Anodyne	GCGR	17	43
O=C(NCc1cccnc1-n1ccnc1)NC1(c2c(F)cccc2F)CCC1	ZINC000875067251	GG	On-Demand	Anodyne	NOS2	74	34
O=C(NCc1cccnc1-n1ccnc1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875067252	FE	On-Demand	Anodyne	NOS2	78	36
COCCCCNC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875067254	ED	On-Demand	Anodyne	AMY2	44	31
COCCCCNC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875067255	ED	On-Demand	Anodyne	AMY2	44	31
COCCCCNC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875067256	ED	On-Demand	Anodyne	AMY2	44	31
COCCCCNC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875067257	ED	On-Demand	Anodyne	AMY2	44	31
CO[C@H]1CCN([C@@H]2CCC[C@@H]2N(C)C(=O)NCc2cccnc2-n2ccnc2)C1	ZINC000875067260	GE	On-Demand	Anodyne	NOS2	89	35
O=C(NCc1cccnc1-n1ccnc1)NC1CC(Nc2ccccc2)C1	ZINC000875067262	FF	On-Demand	Anodyne	NOS2	74	35
CC(=O)NC[C@@H]1CCCCN1C(=O)NCc1cccnc1-n1ccnc1	ZINC000875067264	FD	On-Demand	Anodyne	NOS2	92	40
O=C(NCc1cccnc1-n1ccnc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875067270	GG	On-Demand	Anodyne	NOS2	85	36
O=C(NCc1cccnc1-n1ccnc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875067271	GG	On-Demand	Anodyne	NOS2	85	36
O=C(NCc1cccnc1-n1ccnc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875067272	GG	On-Demand	Anodyne	NOS2	85	36
O=C(NCc1cccnc1-n1ccnc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875067273	GG	On-Demand	Anodyne	NOS2	85	36
COC(=O)[C@@H]1CN(C(=O)NCc2cccnc2-n2ccnc2)C[C@@H](C)O1	ZINC000875067274	FC	On-Demand	Anodyne	NOS2	89	38
O=C(NCc1cccnc1-n1ccnc1)N(C1CC1)C1CC1	ZINC000875067275	CE	On-Demand	Anodyne	NOS2	98	36
O=C(NCc1cccnc1-n1ccnc1)N1CCCC(F)(F)CC1	ZINC000875067283	EF	On-Demand	Anodyne	NOS2	74	34
C[C@@H]1CN(C(=O)NCc2cccnc2-n2ccnc2)CC[C@@H](C(F)(F)F)O1	ZINC000875067300	GF	On-Demand	Anodyne	NOS2	93	36
C[C@@H]1CN(C(=O)NCc2cccnc2-n2ccnc2)CC[C@H](C(F)(F)F)O1	ZINC000875067301	GF	On-Demand	Anodyne	NOS2	93	36
O=C(NCc1cccnc1-n1ccnc1)N[C@]12CCCC[C@@H]1C2	ZINC000875067302	DE	On-Demand	Anodyne	NOS2	83	37
O=C(NCc1cccnc1-n1ccnc1)N[C@@]12CCCC[C@@H]1C2	ZINC000875067303	DE	On-Demand	Anodyne	NOS2	83	37
O=C(NCc1cccnc1-n1ccnc1)N[C@@]12CCCC[C@H]1C2	ZINC000875067304	DE	On-Demand	Anodyne	NOS2	83	37
O=C(NCc1cccnc1-n1ccnc1)N[C@]12CCCC[C@H]1C2	ZINC000875067305	DE	On-Demand	Anodyne	NOS2	83	37
CO[C@H]1CCN([C@@H]2CCC[C@@H]2NC(=O)NCc2cccnc2-n2ccnc2)C1	ZINC000875067313	GD	On-Demand	Anodyne	NOS2	56	34
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccnc2-n2ccnc2)C1	ZINC000875067332	FD	On-Demand	Anodyne	NOS2	72	36
C[C@H](NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(NC(=O)C2CC2)cc1	ZINC000875067336	GD	On-Demand	Anodyne	EPHX2	18	40
C[C@H](NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(NC(=O)C2CC2)cc1	ZINC000875067339	GD	On-Demand	Anodyne	EPHX2	18	40
O=C(NCc1cccnc1-n1ccnc1)N1CC(Cc2cccs2)C1	ZINC000875067340	FF	On-Demand	Anodyne	NOS2	91	37
COCCCCNC(=O)C(=O)N1CCN(c2ccc(C#N)cc2)CC1	ZINC000875067341	EC	On-Demand	Mild	DRD3	26	46
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)c2ccc(NC(=O)C3CC3)cc2)CC1	ZINC000875067351	GE	On-Demand	Anodyne	EPHX2	22	43
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)c2ccc(NC(=O)C3CC3)cc2)CC1	ZINC000875067352	GE	On-Demand	Anodyne	EPHX2	22	43
CN1CC[C@H]2CN(C(=O)C(=O)NCc3c(Cl)cccc3Cl)CC[C@@H]21	ZINC000875067360	FE	On-Demand	Anodyne	DRD3	28	40
CN1CC[C@H]2CN(C(=O)C(=O)NCc3c(Cl)cccc3Cl)CC[C@@H]21	ZINC000875067360	FE	On-Demand	Anodyne	P2RX7	20	43
CN1CC[C@H]2CN(C(=O)C(=O)NCc3c(Cl)cccc3Cl)CC[C@H]21	ZINC000875067361	FE	On-Demand	Anodyne	DRD3	28	40
CN1CC[C@H]2CN(C(=O)C(=O)NCc3c(Cl)cccc3Cl)CC[C@H]21	ZINC000875067361	FE	On-Demand	Anodyne	P2RX7	20	43
CCOc1ccccc1[C@@H](CC)NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875067368	EF	On-Demand	Anodyne	HCN1	50	34
CCOc1ccccc1[C@@H](CC)NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875067368	EF	On-Demand	Anodyne	HCN4	44	34
CCOc1ccccc1[C@H](CC)NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875067369	EF	On-Demand	Anodyne	HCN1	50	34
CCOc1ccccc1[C@H](CC)NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875067369	EF	On-Demand	Anodyne	HCN4	44	34
CCOc1ccccc1[C@H](CC)NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875067370	EF	On-Demand	Anodyne	HCN1	50	34
CCOc1ccccc1[C@H](CC)NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875067370	EF	On-Demand	Anodyne	HCN4	44	34
CCOc1ccccc1[C@@H](CC)NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875067371	EF	On-Demand	Anodyne	HCN1	50	34
CCOc1ccccc1[C@@H](CC)NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875067371	EF	On-Demand	Anodyne	HCN4	44	34
O=C(NCc1cccnc1-n1ccnc1)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875067375	ED	On-Demand	Anodyne	NOS2	64	32
O=C(NCc1cccnc1-n1ccnc1)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875067376	ED	On-Demand	Anodyne	NOS2	64	32
CCOCCCCNC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875067377	ED	On-Demand	Anodyne	FKBP1A	40	41
CCOCCCCNC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875067377	ED	On-Demand	Anodyne	TRY1_BOVIN	40	34
CCOCCCCNC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875067377	ED	On-Demand	Anodyne	NTSR1	40	30
CCOCCCCNC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875067377	ED	On-Demand	Anodyne	NTSR2	41	30
CCOCCCCNC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875067377	ED	On-Demand	Anodyne	AMY2	46	33
CCOCCCCNC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875067378	ED	On-Demand	Anodyne	FKBP1A	40	41
CCOCCCCNC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875067378	ED	On-Demand	Anodyne	TRY1_BOVIN	40	34
CCOCCCCNC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875067378	ED	On-Demand	Anodyne	NTSR1	40	30
CCOCCCCNC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875067378	ED	On-Demand	Anodyne	NTSR2	41	30
CCOCCCCNC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875067378	ED	On-Demand	Anodyne	AMY2	46	33
CCOCCCCNC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875067379	ED	On-Demand	Anodyne	FKBP1A	40	41
CCOCCCCNC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875067379	ED	On-Demand	Anodyne	TRY1_BOVIN	40	34
CCOCCCCNC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875067379	ED	On-Demand	Anodyne	NTSR1	40	30
CCOCCCCNC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875067379	ED	On-Demand	Anodyne	NTSR2	41	30
CCOCCCCNC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875067379	ED	On-Demand	Anodyne	AMY2	46	33
CCOCCCCNC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875067380	ED	On-Demand	Anodyne	FKBP1A	40	41
CCOCCCCNC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875067380	ED	On-Demand	Anodyne	TRY1_BOVIN	40	34
CCOCCCCNC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875067380	ED	On-Demand	Anodyne	NTSR1	40	30
CCOCCCCNC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875067380	ED	On-Demand	Anodyne	NTSR2	41	30
CCOCCCCNC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875067380	ED	On-Demand	Anodyne	AMY2	46	33
O=C(NCc1cccnc1-n1ccnc1)N1O[C@H]2C=C[C@H]1CC2	ZINC000875067381	DD	On-Demand	Anodyne	NOS2	84	33
CC(=O)C1CCN(C(=O)C(=O)NCc2c(Cl)cccc2Cl)CC1	ZINC000875067409	FE	On-Demand	Anodyne	P2RX7	29	46
CC(=O)C1CCN(C(=O)C(=O)NCc2c(Cl)cccc2Cl)CC1	ZINC000875067409	FE	On-Demand	Anodyne	EPHX2	22	41
COCCCCNC(=O)C(=O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000875067412	FF	On-Demand	Anodyne	DRD3	51	37
COCCCCNC(=O)C(=O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000875067412	FF	On-Demand	Anodyne	HTR4	50	38
COCCCCNC(=O)C(=O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000875067412	FF	On-Demand	Anodyne	CCR3	22	40
O=C(NCc1cccnc1-n1ccnc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875067416	GF	On-Demand	Anodyne	NOS2	91	35
O=C(NCc1cccnc1-n1ccnc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875067417	GF	On-Demand	Anodyne	NOS2	91	35
O=C(NCc1cccnc1-n1ccnc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875067418	GF	On-Demand	Anodyne	NOS2	91	35
O=C(NCc1cccnc1-n1ccnc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875067419	GF	On-Demand	Anodyne	NOS2	91	35
CCOCCCCNC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875067420	FD	On-Demand	Anodyne	ROCK2	15	40
O=C(NCc1cccnc1-n1ccnc1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875067428	GE	On-Demand	Anodyne	NOS2	96	37
COc1cccc(C(C)(C)C(=O)Nc2ccc(S(=O)(=O)N(C)OC)cc2)c1	ZINC000875067429	GF	On-Demand	Anodyne	MTNR1B	19	43
COc1cccc(C(C)(C)C(=O)Nc2ccc(S(=O)(=O)N(C)OC)cc2)c1	ZINC000875067429	GF	On-Demand	Anodyne	UREA_CANEN	16	41
C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCCN2C(=O)NCc2cccnc2-n2ccnc2)C1	ZINC000875067438	GG	On-Demand	Anodyne	NOS2	49	35
C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCCN2C(=O)NCc2cccnc2-n2ccnc2)C1	ZINC000875067439	GG	On-Demand	Anodyne	NOS2	49	35
C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCCN2C(=O)NCc2cccnc2-n2ccnc2)C1	ZINC000875067440	GG	On-Demand	Anodyne	NOS2	49	35
C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCCN2C(=O)NCc2cccnc2-n2ccnc2)C1	ZINC000875067441	GG	On-Demand	Anodyne	NOS2	49	35
CN(C[C@@H]1C[C@H](O)C1)C(=O)NCc1cccnc1-n1ccnc1	ZINC000875067451	DD	On-Demand	Anodyne	NOS2	87	33
O=C(NCc1cccnc1-n1ccnc1)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875067453	ED	On-Demand	Anodyne	NOS2	88	33
COCCCCNC(=O)C(=O)NCC1(c2ccc(Br)cc2)CC1	ZINC000875067459	GE	On-Demand	Anodyne	KCNA3	43	42
O=C(NCc1cccnc1-n1ccnc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875067464	FF	On-Demand	Anodyne	NOS2	78	35
O=C(NCc1cccnc1-n1ccnc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875067464	FF	On-Demand	Anodyne	EPHX2	18	46
O=C(NCc1cccnc1-n1ccnc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875067465	FF	On-Demand	Anodyne	NOS2	78	35
O=C(NCc1cccnc1-n1ccnc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875067465	FF	On-Demand	Anodyne	EPHX2	18	46
O=C(NCC[C@H](O)C1CCCC1)NCc1cccnc1-n1ccnc1	ZINC000875067473	EE	On-Demand	Anodyne	NOS2	81	33
O=C(NCC[C@@H](O)C1CCCC1)NCc1cccnc1-n1ccnc1	ZINC000875067474	EE	On-Demand	Anodyne	NOS2	81	33
COCCCCNC(=O)C(=O)N(C)C[C@H]1CCCCN1Cc1ccccc1	ZINC000875067477	GE	On-Demand	Anodyne	DRD2	22	42
COCCCCNC(=O)C(=O)N(C)C[C@H]1CCCCN1Cc1ccccc1	ZINC000875067477	GE	On-Demand	Anodyne	DRD3	16	43
COCCCCNC(=O)C(=O)N(C)C[C@H]1CCCCN1Cc1ccccc1	ZINC000875067477	GE	On-Demand	Anodyne	SIGMAR1	15	43
O=C(NCCN1CC[C@H](O)C1)NCc1cccnc1-n1ccnc1	ZINC000875067479	EC	On-Demand	Anodyne	NOS2	92	33
O=C(NCCN1CC[C@@H](O)C1)NCc1cccnc1-n1ccnc1	ZINC000875067480	EC	On-Demand	Anodyne	NOS2	92	33
COCCCCNC(=O)C(=O)N1CCN(c2ccc(F)cc2C#N)CC1	ZINC000875067483	FC	On-Demand	Mild	HTR1A	19	42
COCCCCNC(=O)C(=O)N1CCN(c2ccc(F)cc2C#N)CC1	ZINC000875067483	FC	On-Demand	Mild	DRD2	28	42
COCCCCNC(=O)C(=O)N1CCN(c2ccc(F)cc2C#N)CC1	ZINC000875067483	FC	On-Demand	Mild	DRD4	40	32
COCCCCNC(=O)C(=O)N1CCN(c2ccc(F)cc2C#N)CC1	ZINC000875067483	FC	On-Demand	Mild	ADRA1D	18	40
COCCCCNC(=O)C(=O)N1CCN(c2ccc(F)cc2C#N)CC1	ZINC000875067483	FC	On-Demand	Mild	DRD3	53	42
CC[C@@H]1COCCN1CCNC(=O)NCc1cccnc1-n1ccnc1	ZINC000875067490	FD	On-Demand	Anodyne	NOS2	93	39
CCOc1ccccc1[C@@H](CC)NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875067491	FE	On-Demand	Anodyne	HCN1	47	31
CCOc1ccccc1[C@@H](CC)NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875067491	FE	On-Demand	Anodyne	HCN4	40	31
CCOc1ccccc1[C@@H](CC)NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875067492	FE	On-Demand	Anodyne	HCN1	47	31
CCOc1ccccc1[C@@H](CC)NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875067492	FE	On-Demand	Anodyne	HCN4	40	31
CCOc1ccccc1[C@H](CC)NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875067493	FE	On-Demand	Anodyne	HCN1	47	31
CCOc1ccccc1[C@H](CC)NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875067493	FE	On-Demand	Anodyne	HCN4	40	31
CCOc1ccccc1[C@H](CC)NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875067494	FE	On-Demand	Anodyne	HCN1	47	31
CCOc1ccccc1[C@H](CC)NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875067494	FE	On-Demand	Anodyne	HCN4	40	31
COCCCCNC(=O)C(=O)NCC1(c2cccc(Cl)c2)CCC1	ZINC000875067499	FE	On-Demand	Anodyne	KCNA3	44	41
O=C(NCc1cccnc1-n1ccnc1)N1C[C@H](O)C[C@H]1C1CC1	ZINC000875067512	ED	On-Demand	Anodyne	NOS2	67	32
O=C(NCc1cccnc1-n1ccnc1)N1C[C@@H](O)C[C@H]1C1CC1	ZINC000875067513	ED	On-Demand	Anodyne	NOS2	67	32
O=C(NCc1cccnc1-n1ccnc1)N1C[C@H](O)C[C@@H]1C1CC1	ZINC000875067514	ED	On-Demand	Anodyne	NOS2	67	32
O=C(NCc1cccnc1-n1ccnc1)N1C[C@@H](O)C[C@@H]1C1CC1	ZINC000875067515	ED	On-Demand	Anodyne	NOS2	67	32
COCCN(CC1CCN(C)CC1)C(=O)NCc1cccnc1-n1ccnc1	ZINC000875067518	GD	On-Demand	Anodyne	NOS2	89	35
O=C(NCc1cccnc1-n1ccnc1)N1C[C@@H]2CCC[C@]2(CO)C1	ZINC000875067527	ED	On-Demand	Anodyne	NOS2	99	39
COCCCCNC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875067528	ED	On-Demand	Anodyne	ROCK1	24	44
COCCCCNC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875067528	ED	On-Demand	Anodyne	ROCK2	18	44
COCCCCNC(=O)C(=O)NC[C@@H]1CN(Cc2ccccc2C)CCO1	ZINC000875067542	GC	On-Demand	Anodyne	DRD4	27	41
COCCCCNC(=O)C(=O)NC[C@H]1CN(Cc2ccccc2C)CCO1	ZINC000875067543	GC	On-Demand	Anodyne	DRD4	27	41
O=C(NCc1cccnc1-n1ccnc1)N1CC(Cc2ccco2)C1	ZINC000875067544	EE	On-Demand	Anodyne	NOS2	89	39
O=C(NCc1cccnc1-n1ccnc1)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875067545	FF	On-Demand	Anodyne	NOS2	94	37
O=C(NCc1cccnc1-n1ccnc1)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875067546	FF	On-Demand	Anodyne	NOS2	94	37
COCCCCNC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875067547	FD	On-Demand	Anodyne	HTR1A	21	42
COCCCCNC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875067547	FD	On-Demand	Anodyne	DRD2	30	42
COCCCCNC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875067547	FD	On-Demand	Anodyne	ADRA1B	19	42
COCCCCNC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875067547	FD	On-Demand	Anodyne	DRD3	54	42
COCCCCNC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875067547	FD	On-Demand	Anodyne	NPY2R	41	35
CCC1(CC)CCCN1C(=O)NCc1cccnc1-n1ccnc1	ZINC000875067552	EG	On-Demand	Anodyne	NOS2	78	33
O=C(NCc1cccnc1-n1ccnc1)N1CC(OCC(F)F)C1	ZINC000875067567	ED	On-Demand	Anodyne	NOS2	82	36
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1CN1CCCC1=O	ZINC000875067568	GE	On-Demand	Anodyne	SLC6A3	40	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1CN1CCCC1=O	ZINC000875067569	GE	On-Demand	Anodyne	SLC6A3	40	36
CC1(C)CCC[C@@](O)(CNC(=O)NCc2cccnc2-n2ccnc2)CC1	ZINC000875067570	FF	On-Demand	Anodyne	NOS2	68	33
CC1(C)CCC[C@](O)(CNC(=O)NCc2cccnc2-n2ccnc2)CC1	ZINC000875067571	FF	On-Demand	Anodyne	NOS2	68	33
C[C@@H]1CN(C(=O)NCc2cccnc2-n2ccnc2)CC[C@H]1C(=O)OC(C)(C)C	ZINC000875067576	GF	On-Demand	Anodyne	NOS2	94	36
C[C@@H]1CN(C(=O)NCc2cccnc2-n2ccnc2)CC[C@@H]1C(=O)OC(C)(C)C	ZINC000875067578	GF	On-Demand	Anodyne	NOS2	94	36
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3cccnc3-n3ccnc3)C[C@@H]1C2	ZINC000875067584	FD	On-Demand	Anodyne	NOS2	95	36
O=C(NCc1cccnc1-n1ccnc1)NC[C@H]1C[C@H](O)C1	ZINC000875067591	DC	On-Demand	Anodyne	NOS2	76	32
O=C(NCc1cccnc1-n1ccnc1)NC[C@@H]1C[C@H](O)C1	ZINC000875067592	DC	On-Demand	Anodyne	NOS2	76	32
O=C(NCc1cccnc1-n1ccnc1)NCC1CC(O)C1	ZINC000875067593	DC	On-Demand	Anodyne	NOS2	76	32
CN1CCCC[C@H](N(C)C(=O)NCc2cccnc2-n2ccnc2)C1=O	ZINC000875067603	FD	On-Demand	Anodyne	NOS2	96	39
CN1CCCC[C@@H](N(C)C(=O)NCc2cccnc2-n2ccnc2)C1=O	ZINC000875067604	FD	On-Demand	Anodyne	NOS2	96	39
O=C(NCc1cccnc1-n1ccnc1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875067611	GD	On-Demand	Anodyne	NOS2	82	36
O=C(NCc1cccnc1-n1ccnc1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875067612	FE	On-Demand	Anodyne	NOS2	41	31
CN1CC[C@H]2CN(C(=O)C(=O)NCCc3ccc(OC(F)(F)F)cc3)CC[C@H]21	ZINC000875067619	GD	On-Demand	Anodyne	EPHX2	40	40
CN1CC[C@H]2CN(C(=O)C(=O)NCCc3ccc(OC(F)(F)F)cc3)CC[C@@H]21	ZINC000875067620	GD	On-Demand	Anodyne	EPHX2	40	40
O=C(NCc1cccnc1-n1ccnc1)N1OC2CCC1CC2	ZINC000875067626	DE	On-Demand	Anodyne	NOS2	99	37
COCCCCNC(=O)C(=O)NC[C@@H]1CN(Cc2cccc(C)c2)CCO1	ZINC000875067633	GC	On-Demand	Anodyne	DRD4	45	42
COCCCCNC(=O)C(=O)NC[C@H]1CN(Cc2cccc(C)c2)CCO1	ZINC000875067634	GC	On-Demand	Anodyne	DRD4	45	42
COCCCCNC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1C	ZINC000875067644	FD	On-Demand	Anodyne	SLC18A2	50	37
COCCCCNC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1C	ZINC000875067645	FD	On-Demand	Anodyne	SLC18A2	50	37
CCOCCCCNC(=O)C(=O)N1CCN(c2ccc(F)cc2C#N)CC1	ZINC000875067652	GD	On-Demand	Mild	DRD2	16	40
CCOCCCCNC(=O)C(=O)N1CCN(c2ccc(F)cc2C#N)CC1	ZINC000875067652	GD	On-Demand	Mild	DRD3	32	40
O=CN1CCCN(C(=O)NCc2cccnc2-n2ccnc2)CC1	ZINC000875067670	EC	On-Demand	Anodyne	NOS2	89	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(CN2CCCC2=O)c1	ZINC000875067673	GE	On-Demand	Anodyne	SLC6A3	41	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(CN2CCCC2=O)c1	ZINC000875067674	GE	On-Demand	Anodyne	SLC6A3	41	38
N#Cc1ccc(Cc2cnc(NC(=O)CNC(=O)c3ccc(-c4ccccc4)cc3)s2)cc1	ZINC000875067739	JJ	On-Demand	Mild	CTRB_BOVIN	45	32
C[C@@H](Cc1ccccc1F)NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875067748	ED	On-Demand	Anodyne	CCR1	22	43
C[C@@H](Cc1ccccc1F)NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875067749	ED	On-Demand	Anodyne	CCR1	22	43
C[C@H](Cc1ccccc1F)NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875067750	ED	On-Demand	Anodyne	CCR1	22	43
C[C@H](Cc1ccccc1F)NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875067751	ED	On-Demand	Anodyne	CCR1	22	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H](c2ccccc2)N2CCOCC2)C1	ZINC000875067799	GD	On-Demand	Anodyne	PGA5	41	31
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H](c2ccccc2)N2CCOCC2)C1	ZINC000875067800	GD	On-Demand	Anodyne	PGA5	41	31
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H](c2ccccc2)N2CCOCC2)C1	ZINC000875067801	GD	On-Demand	Anodyne	PGA5	41	31
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H](c2ccccc2)N2CCOCC2)C1	ZINC000875067802	GD	On-Demand	Anodyne	PGA5	41	31
C[C@@H](Cc1ccco1)NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875067833	FC	On-Demand	Anodyne	L3MBTL3	71	41
C[C@H](Cc1ccco1)NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875067834	FC	On-Demand	Anodyne	L3MBTL3	71	41
COc1ccccc1[C@H]1CN(C(=O)NCCC(=O)N2CCN(C)CC2)CCO1	ZINC000875067858	GC	On-Demand	Anodyne	HTR1A	21	40
COc1ccccc1[C@@H]1CN(C(=O)NCCC(=O)N2CCN(C)CC2)CCO1	ZINC000875067859	GC	On-Demand	Anodyne	HTR1A	21	40
O=C(NC[C@H](c1ccccc1)N1CCOCC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875067876	GD	On-Demand	Anodyne	CASR	40	35
O=C(NC[C@@H](c1ccccc1)N1CCOCC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875067877	GD	On-Demand	Anodyne	CASR	40	35
CCn1c(NC(=O)C2([C@@H]3CCCCO3)CCOCC2)nc2ccccc21	ZINC000875067938	FG	On-Demand	Anodyne	ADAM17	16	40
CCn1c(NC(=O)C2([C@H]3CCCCO3)CCOCC2)nc2ccccc21	ZINC000875067939	FG	On-Demand	Anodyne	ADAM17	16	40
CC(=O)C1CCN(C(=O)NCc2ccc(N3CCc4ccccc4C3)nc2)CC1	ZINC000875067948	GG	On-Demand	Anodyne	NAMPT	32	42
CNC(=O)[C@H]1CN(C(=O)[C@@H](Cc2cccnc2)C2CCCC2)c2ccccc2O1	ZINC000875068025	GF	On-Demand	Anodyne	C3AR1	43	40
CNC(=O)[C@@H]1CN(C(=O)[C@H](Cc2cccnc2)C2CCCC2)c2ccccc2O1	ZINC000875068026	GF	On-Demand	Anodyne	C3AR1	43	40
CNC(=O)[C@@H]1CN(C(=O)[C@@H](Cc2cccnc2)C2CCCC2)c2ccccc2O1	ZINC000875068027	GF	On-Demand	Anodyne	C3AR1	43	40
CNC(=O)[C@H]1CN(C(=O)[C@H](Cc2cccnc2)C2CCCC2)c2ccccc2O1	ZINC000875068028	GF	On-Demand	Anodyne	C3AR1	43	40
CC(=O)c1csc(NC(=O)[C@@H](Cc2cccnc2)C2CCCC2)n1	ZINC000875068033	EH	On-Demand	Anodyne	C3AR1	43	43
CC(=O)c1csc(NC(=O)[C@H](Cc2cccnc2)C2CCCC2)n1	ZINC000875068034	EH	On-Demand	Anodyne	C3AR1	43	43
CCOC(=O)Nc1ccc(C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)cc1	ZINC000875068065	HI	On-Demand	Mild	CTRB_BOVIN	47	34
CCOC(=O)Nc1ccc(C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)cc1	ZINC000875068065	HI	On-Demand	Mild	SCD1	42	43
CCOC(=O)Nc1ccc(C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)cc1	ZINC000875068065	HI	On-Demand	Mild	SCD	35	43
Cn1nc(Cl)c(C(=O)N(Cc2ccc(F)cc2)C2CC2)c1Cl	ZINC000875068127	EH	On-Demand	Anodyne	SLC6A9	20	41
COCc1ccccc1CNC(=O)NC1CC(Nc2ccccc2)C1	ZINC000875068139	EG	On-Demand	Anodyne	EPHX2	15	41
CCCCCCCNC(=O)C(=O)N[C@H](C)Cc1ccco1	ZINC000875068141	CE	On-Demand	Mild	ASAH1	82	36
CCCCCCCNC(=O)C(=O)N[C@@H](C)Cc1ccco1	ZINC000875068142	CE	On-Demand	Mild	ASAH1	82	36
COc1ccc([C@@H]2CN(C(=O)NCCC(=O)N3CCN(C)CC3)CCO2)cc1	ZINC000875068158	GC	On-Demand	Anodyne	BMP1	17	41
COCc1ccccc1CNC(=O)NC1CC(C(=O)OC)C1	ZINC000875068211	DD	On-Demand	Anodyne	EPHX2	17	41
C[C@H](Cc1ccco1)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875068231	GF	On-Demand	Anodyne	DRD2	17	40
C[C@H](Cc1ccco1)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875068231	GF	On-Demand	Anodyne	DRD4	33	40
C[C@H](Cc1ccco1)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875068231	GF	On-Demand	Anodyne	ACHE	54	53
C[C@H](Cc1ccco1)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875068231	GF	On-Demand	Anodyne	HTR4	29	42
C[C@H](Cc1ccco1)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875068231	GF	On-Demand	Anodyne	SIGMAR1	42	48
C[C@H](Cc1ccco1)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875068231	GF	On-Demand	Anodyne	MCHR1	15	41
C[C@@H](Cc1ccco1)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875068232	GF	On-Demand	Anodyne	DRD2	17	40
C[C@@H](Cc1ccco1)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875068232	GF	On-Demand	Anodyne	DRD4	33	40
C[C@@H](Cc1ccco1)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875068232	GF	On-Demand	Anodyne	ACHE	54	53
C[C@@H](Cc1ccco1)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875068232	GF	On-Demand	Anodyne	HTR4	29	42
C[C@@H](Cc1ccco1)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875068232	GF	On-Demand	Anodyne	SIGMAR1	42	48
C[C@@H](Cc1ccco1)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875068232	GF	On-Demand	Anodyne	MCHR1	15	41
CC(=O)C1CCN(C(=O)NC[C@@H](c2cccc(Cl)c2)N2CCCC2)CC1	ZINC000875068235	GG	On-Demand	Anodyne	EPHX2	19	43
CC(=O)C1CCN(C(=O)NC[C@H](c2cccc(Cl)c2)N2CCCC2)CC1	ZINC000875068236	GG	On-Demand	Anodyne	EPHX2	19	43
CC(=O)C1CCN(C(=O)NC[C@H](c2c(F)cccc2Cl)N2CCCC2)CC1	ZINC000875068294	GH	On-Demand	Anodyne	EPHX2	18	40
CC(=O)C1CCN(C(=O)NC[C@@H](c2c(F)cccc2Cl)N2CCCC2)CC1	ZINC000875068295	GH	On-Demand	Anodyne	EPHX2	18	40
O=C(NCCC(=O)N1CCCCC1)NC1CC(Nc2ccccc2)C1	ZINC000875068360	EE	On-Demand	Anodyne	PREP	48	37
O=C(NCCC(=O)N1CCCCC1)NC1CC(Nc2ccccc2)C1	ZINC000875068360	EE	On-Demand	Anodyne	EPHX2	29	43
Cn1nc(Cl)c(C(=O)Nc2ccccc2N2CCCC2=O)c1Cl	ZINC000875068382	FG	On-Demand	Anodyne	KCNQ2	57	34
CC(=O)c1csc(NC(=O)[C@H]2C[C@]2(C)Br)n1	ZINC000875068384	DE	On-Demand	Anodyne	TRPC6	44	34
CC(=O)c1csc(NC(=O)[C@H]2C[C@@]2(C)Br)n1	ZINC000875068387	DE	On-Demand	Anodyne	TRPC6	44	34
CC(=O)c1csc(NC(=O)[C@@H]2C[C@@]2(C)Br)n1	ZINC000875068391	DE	On-Demand	Anodyne	TRPC6	44	34
CC(=O)c1csc(NC(=O)[C@@H]2C[C@]2(C)Br)n1	ZINC000875068392	DE	On-Demand	Anodyne	TRPC6	44	34
C[C@@H](CN(C)C(=O)C(=O)N[C@@H](C)Cc1ccccc1F)NC(=O)OC(C)(C)C	ZINC000875068461	GE	On-Demand	Anodyne	PAPA1_CARPA	32	51
C[C@@H](CN(C)C(=O)C(=O)N[C@@H](C)Cc1ccccc1F)NC(=O)OC(C)(C)C	ZINC000875068461	GE	On-Demand	Anodyne	FPR1	48	39
C[C@@H](CN(C)C(=O)C(=O)N[C@H](C)Cc1ccccc1F)NC(=O)OC(C)(C)C	ZINC000875068464	GE	On-Demand	Anodyne	PAPA1_CARPA	32	51
C[C@@H](CN(C)C(=O)C(=O)N[C@H](C)Cc1ccccc1F)NC(=O)OC(C)(C)C	ZINC000875068464	GE	On-Demand	Anodyne	FPR1	48	39
C[C@@H](Cc1ccccc1F)NC(=O)C(=O)N(C)C[C@@H](C)NC(=O)OC(C)(C)C	ZINC000875068465	GE	On-Demand	Anodyne	PAPA1_CARPA	32	51
C[C@@H](Cc1ccccc1F)NC(=O)C(=O)N(C)C[C@@H](C)NC(=O)OC(C)(C)C	ZINC000875068465	GE	On-Demand	Anodyne	FPR1	48	39
C[C@H](Cc1ccccc1F)NC(=O)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875068471	GF	On-Demand	Anodyne	CCR1	15	41
C[C@@H](Cc1ccccc1F)NC(=O)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875068473	GF	On-Demand	Anodyne	CCR1	15	41
C[C@H](Cc1ccccc1F)NC(=O)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875068474	GF	On-Demand	Anodyne	CCR1	15	41
C[C@@H](Cc1ccccc1F)NC(=O)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875068476	GF	On-Demand	Anodyne	CCR1	15	41
COCc1ccccc1CNC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875068479	DE	On-Demand	Anodyne	EPHX2	26	51
COCc1ccccc1CNC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875068481	DE	On-Demand	Anodyne	EPHX2	26	51
N#Cc1ccc(Cc2cnc(NC(=O)/C=C/c3ccsc3)s2)cc1	ZINC000875068496	FI	On-Demand	Mild	SCD	16	44
N#Cc1ccc(Cc2cnc(NC(=O)/C=C\c3ccsc3)s2)cc1	ZINC000875068498	FI	On-Demand	Mild	SCD	16	44
C#C[C@@H]1CC[C@@H](NC(=O)NCCC(=O)N2CCN(C)CC2)CC1	ZINC000875068500	DC	On-Demand	Mild	EPHX2	16	43
O=C(CCNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)N1CCCCC1	ZINC000875068512	GF	On-Demand	Anodyne	PREP	38	40
CCCCCCCNC(=O)C(=O)NCCc1ccc(C)o1	ZINC000875068562	CE	On-Demand	Mild	ASAH1	92	37
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)Cc2ccccc2F)CC1	ZINC000875068610	ED	On-Demand	Anodyne	CCR1	22	43
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)Cc2ccccc2F)CC1	ZINC000875068612	ED	On-Demand	Anodyne	CCR1	22	43
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H](c1ccccc1)N1CCOCC1	ZINC000875068615	GC	On-Demand	Mild	CASR	41	36
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H](c1ccccc1)N1CCOCC1	ZINC000875068616	GC	On-Demand	Mild	CASR	41	36
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H](c1ccccc1)N1CCOCC1	ZINC000875068618	GC	On-Demand	Mild	CASR	41	36
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H](c1ccccc1)N1CCOCC1	ZINC000875068619	GC	On-Demand	Mild	CASR	41	36
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)cc1	ZINC000875068663	IJ	On-Demand	Mild	SCD1	41	42
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)cc1	ZINC000875068663	IJ	On-Demand	Mild	SCD	35	42
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H](C)Cc1ccco1)CC2	ZINC000875068689	GE	On-Demand	Anodyne	SLC18A2	48	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H](C)Cc1ccco1)CC2	ZINC000875068691	GE	On-Demand	Anodyne	SLC18A2	48	35
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@@H](C)Cc1ccco1)CC2	ZINC000875068692	GE	On-Demand	Anodyne	SLC18A2	48	35
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@H](C)Cc1ccco1)CC2	ZINC000875068694	GE	On-Demand	Anodyne	SLC18A2	48	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)Cc2ccccc2F)C1	ZINC000875068696	ED	On-Demand	Anodyne	SLC6A1	45	36
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)Cc2ccccc2F)C1	ZINC000875068696	ED	On-Demand	Anodyne	CCR1	17	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)Cc2ccccc2F)C1	ZINC000875068696	ED	On-Demand	Anodyne	DPP4	15	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)Cc2ccccc2F)C1	ZINC000875068696	ED	On-Demand	Anodyne	BIRC2	30	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)Cc2ccccc2F)C1	ZINC000875068698	ED	On-Demand	Anodyne	SLC6A1	45	36
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)Cc2ccccc2F)C1	ZINC000875068698	ED	On-Demand	Anodyne	CCR1	17	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)Cc2ccccc2F)C1	ZINC000875068698	ED	On-Demand	Anodyne	DPP4	15	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)Cc2ccccc2F)C1	ZINC000875068698	ED	On-Demand	Anodyne	BIRC2	30	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)Cc2ccccc2F)C1	ZINC000875068699	ED	On-Demand	Anodyne	SLC6A1	45	36
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)Cc2ccccc2F)C1	ZINC000875068699	ED	On-Demand	Anodyne	CCR1	17	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)Cc2ccccc2F)C1	ZINC000875068699	ED	On-Demand	Anodyne	DPP4	15	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)Cc2ccccc2F)C1	ZINC000875068699	ED	On-Demand	Anodyne	BIRC2	30	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)Cc2ccccc2F)C1	ZINC000875068700	ED	On-Demand	Anodyne	SLC6A1	45	36
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)Cc2ccccc2F)C1	ZINC000875068700	ED	On-Demand	Anodyne	CCR1	17	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)Cc2ccccc2F)C1	ZINC000875068700	ED	On-Demand	Anodyne	DPP4	15	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)Cc2ccccc2F)C1	ZINC000875068700	ED	On-Demand	Anodyne	BIRC2	30	41
C[C@@H](Cc1ccccc1F)NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875068724	FD	On-Demand	Anodyne	DPP4	19	42
CC(=O)c1csc(NC(=O)[C@H]2CCC(=O)O2)n1	ZINC000875068728	CC	On-Demand	Anodyne	TRPC6	43	33
CC(=O)c1csc(NC(=O)[C@H]2CCC(=O)O2)n1	ZINC000875068728	CC	On-Demand	Anodyne	TRPC3	42	33
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1ccc(OC(C)C)nc1	ZINC000875068776	ED	On-Demand	Mild	ACACB	18	41
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1ccc(OC(C)C)nc1	ZINC000875068778	ED	On-Demand	Mild	ACACB	18	41
N#Cc1ccc(Cc2cnc(NC(=O)c3cc(Cl)c4c(c3)OCCO4)s2)cc1	ZINC000875068873	HI	On-Demand	Mild	SCD1	40	47
N#Cc1ccc(Cc2cnc(NC(=O)c3cc(Cl)c4c(c3)OCCO4)s2)cc1	ZINC000875068873	HI	On-Demand	Mild	SCD	33	47
C[C@H](Cc1ccccc1F)NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875068883	FD	On-Demand	Anodyne	DPP4	19	42
O=C(CCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1)N1CCCCC1	ZINC000875068936	FF	On-Demand	Anodyne	CPT1A	54	33
O=C(CCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1)N1CCCCC1	ZINC000875068936	FF	On-Demand	Anodyne	PREP	62	37
O=C(CCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1)N1CCCCC1	ZINC000875068938	FF	On-Demand	Anodyne	CPT1A	54	33
O=C(CCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1)N1CCCCC1	ZINC000875068938	FF	On-Demand	Anodyne	PREP	62	37
CC(=O)c1csc(NC(=O)[C@H]2COC(=O)N2C)n1	ZINC000875068939	CC	On-Demand	Anodyne	TRPC6	42	32
CC(=O)c1csc(NC(=O)[C@H]2COC(=O)N2C)n1	ZINC000875068939	CC	On-Demand	Anodyne	TRPC3	41	32
O=C(CCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1)N1CCCCC1	ZINC000875068940	FF	On-Demand	Anodyne	CPT1A	54	33
O=C(CCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1)N1CCCCC1	ZINC000875068940	FF	On-Demand	Anodyne	PREP	62	37
O=C(CCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1)N1CCCCC1	ZINC000875068941	FF	On-Demand	Anodyne	CPT1A	54	33
O=C(CCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1)N1CCCCC1	ZINC000875068941	FF	On-Demand	Anodyne	PREP	62	37
CC(=O)c1csc(NC(=O)[C@@H]2COC(=O)N2C)n1	ZINC000875068945	CC	On-Demand	Anodyne	TRPC6	42	32
CC(=O)c1csc(NC(=O)[C@@H]2COC(=O)N2C)n1	ZINC000875068945	CC	On-Demand	Anodyne	TRPC3	41	32
O=C(CCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)N1CCCCC1	ZINC000875068999	FE	On-Demand	Anodyne	DPP4	15	43
O=C(CCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)N1CCCCC1	ZINC000875068999	FE	On-Demand	Anodyne	PREP	79	39
O=C(CCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)N1CCCCC1	ZINC000875069001	FE	On-Demand	Anodyne	DPP4	15	43
O=C(CCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)N1CCCCC1	ZINC000875069001	FE	On-Demand	Anodyne	PREP	79	39
O=C(CCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)N1CCCCC1	ZINC000875069002	FE	On-Demand	Anodyne	DPP4	15	43
O=C(CCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)N1CCCCC1	ZINC000875069002	FE	On-Demand	Anodyne	PREP	79	39
O=C(CCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)N1CCCCC1	ZINC000875069003	FE	On-Demand	Anodyne	DPP4	15	43
O=C(CCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)N1CCCCC1	ZINC000875069003	FE	On-Demand	Anodyne	PREP	79	39
O=C(Oc1ccc(C(F)(F)F)cc1)c1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875069004	GH	On-Demand	Anodyne	ACR	58	52
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069031	FF	On-Demand	Anodyne	ACE	43	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069031	FF	On-Demand	Anodyne	MME	105	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069031	FF	On-Demand	Anodyne	ANPEP	71	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069031	FF	On-Demand	Anodyne	PGC	49	31
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069031	FF	On-Demand	Anodyne	CTRA_BOVIN	19	48
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069031	FF	On-Demand	Anodyne	FCER2	97	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069031	FF	On-Demand	Anodyne	BMP1	18	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069031	FF	On-Demand	Anodyne	KLK3	73	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069031	FF	On-Demand	Anodyne	CTSB	79	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069031	FF	On-Demand	Anodyne	PAPA1_CARPA	88	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069031	FF	On-Demand	Anodyne	CYSP_TRYCR	71	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069031	FF	On-Demand	Anodyne	CCKAR	44	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069031	FF	On-Demand	Anodyne	CTSK	40	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069031	FF	On-Demand	Anodyne	CTSL	63	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069031	FF	On-Demand	Anodyne	TIMP3	88	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069031	FF	On-Demand	Anodyne	CAPNS1	70	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069031	FF	On-Demand	Anodyne	MMP3	34	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069031	FF	On-Demand	Anodyne	GRIA1	40	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069031	FF	On-Demand	Anodyne	HLA-DRB1	109	48
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069031	FF	On-Demand	Anodyne	REN	68	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069031	FF	On-Demand	Anodyne	HDAC6	15	59
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069031	FF	On-Demand	Anodyne	MMP11	56	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069031	FF	On-Demand	Anodyne	CTSS	28	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069031	FF	On-Demand	Anodyne	CAPN1	102	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069031	FF	On-Demand	Anodyne	CAPN2	131	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069031	FF	On-Demand	Anodyne	ACE2	57	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069031	FF	On-Demand	Anodyne	MC1R	69	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069031	FF	On-Demand	Anodyne	FPR1	70	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069031	FF	On-Demand	Anodyne	CTRB_BOVIN	48	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069031	FF	On-Demand	Anodyne	NPR	41	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069031	FF	On-Demand	Anodyne	PSMB8	46	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069031	FF	On-Demand	Anodyne	GPR142	96	43
N#Cc1ccc(Cc2cnc(NC(=O)Cn3c(SC(F)F)nc4ccccc43)s2)cc1	ZINC000875069052	JJ	On-Demand	Mild	IMDH_CRYPV	30	44
CC(=O)c1csc(NC(=O)[C@H](F)[C@H]2CCN(C(=O)OC(C)(C)C)C2)n1	ZINC000875069071	FF	On-Demand	Anodyne	GPR119	25	40
CC(=O)c1csc(NC(=O)[C@H](F)[C@H]2CCN(C(=O)OC(C)(C)C)C2)n1	ZINC000875069071	FF	On-Demand	Anodyne	TRPC6	45	36
CC(=O)c1csc(NC(=O)[C@@H](F)[C@H]2CCN(C(=O)OC(C)(C)C)C2)n1	ZINC000875069072	FF	On-Demand	Anodyne	GPR119	25	40
CC(=O)c1csc(NC(=O)[C@@H](F)[C@H]2CCN(C(=O)OC(C)(C)C)C2)n1	ZINC000875069072	FF	On-Demand	Anodyne	TRPC6	45	36
CC(=O)c1csc(NC(=O)[C@@H](F)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)n1	ZINC000875069073	FF	On-Demand	Anodyne	GPR119	25	40
CC(=O)c1csc(NC(=O)[C@@H](F)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)n1	ZINC000875069073	FF	On-Demand	Anodyne	TRPC6	45	36
CC(=O)c1csc(NC(=O)[C@H](F)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)n1	ZINC000875069074	FF	On-Demand	Anodyne	GPR119	25	40
CC(=O)c1csc(NC(=O)[C@H](F)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)n1	ZINC000875069074	FF	On-Demand	Anodyne	TRPC6	45	36
COCc1ccccc1CNC(=O)N1CC[C@@H](C(F)(F)F)O[C@H](C)C1	ZINC000875069170	FG	On-Demand	Anodyne	EPHX2	18	48
COCc1ccccc1CNC(=O)N1CC[C@H](C(F)(F)F)O[C@H](C)C1	ZINC000875069171	FG	On-Demand	Anodyne	EPHX2	18	48
COCc1ccccc1CNC(=O)N1CC[C@H](C(F)(F)F)O[C@@H](C)C1	ZINC000875069172	FG	On-Demand	Anodyne	EPHX2	18	48
COCc1ccccc1CNC(=O)N1CC[C@@H](C(F)(F)F)O[C@@H](C)C1	ZINC000875069173	FG	On-Demand	Anodyne	EPHX2	18	48
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N[C@H](C)Cc3ccco3)C2)cc1	ZINC000875069225	FE	On-Demand	Anodyne	DRD4	28	44
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N[C@H](C)Cc3ccco3)C2)cc1	ZINC000875069225	FE	On-Demand	Anodyne	MCHR1	27	41
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N[C@H](C)Cc3ccco3)C2)cc1	ZINC000875069225	FE	On-Demand	Anodyne	BIRC2	38	42
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N[C@@H](C)Cc3ccco3)C2)cc1	ZINC000875069226	FE	On-Demand	Anodyne	DRD4	28	44
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N[C@@H](C)Cc3ccco3)C2)cc1	ZINC000875069226	FE	On-Demand	Anodyne	MCHR1	27	41
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N[C@@H](C)Cc3ccco3)C2)cc1	ZINC000875069226	FE	On-Demand	Anodyne	BIRC2	38	42
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N[C@H](C)Cc3ccco3)C2)cc1	ZINC000875069227	FE	On-Demand	Anodyne	DRD4	28	44
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N[C@H](C)Cc3ccco3)C2)cc1	ZINC000875069227	FE	On-Demand	Anodyne	MCHR1	27	41
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N[C@H](C)Cc3ccco3)C2)cc1	ZINC000875069227	FE	On-Demand	Anodyne	BIRC2	38	42
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N[C@@H](C)Cc3ccco3)C2)cc1	ZINC000875069228	FE	On-Demand	Anodyne	DRD4	28	44
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N[C@@H](C)Cc3ccco3)C2)cc1	ZINC000875069228	FE	On-Demand	Anodyne	MCHR1	27	41
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N[C@@H](C)Cc3ccco3)C2)cc1	ZINC000875069228	FE	On-Demand	Anodyne	BIRC2	38	42
C[C@@H](Cc1ccccc1F)NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875069241	GD	On-Demand	Anodyne	L3MBTL3	74	41
C[C@H](Cc1ccccc1F)NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875069242	GD	On-Demand	Anodyne	L3MBTL3	74	41
COCCOc1ncccc1CNC(=O)C(=O)N1CCC[C@@H]1c1cncc(C)c1	ZINC000875069259	GD	On-Demand	Anodyne	SCN10A	25	40
COCCOc1ncccc1CNC(=O)C(=O)N1CCC[C@H]1c1cncc(C)c1	ZINC000875069260	GD	On-Demand	Anodyne	SCN10A	25	40
CC(=O)c1csc(NC(=O)c2ccc3c(c2)OC(C)(C)C3)n1	ZINC000875069335	DG	On-Demand	Anodyne	MAPKAPK2	21	41
COCc1ccccc1CNC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875069361	EE	On-Demand	Anodyne	SLC6A4	30	40
COCc1ccccc1CNC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875069361	EE	On-Demand	Anodyne	SLC6A3	57	40
COCc1ccccc1CNC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875069363	EE	On-Demand	Anodyne	SLC6A4	30	40
COCc1ccccc1CNC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875069363	EE	On-Demand	Anodyne	SLC6A3	57	40
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)Cc1ccco1	ZINC000875069448	EF	On-Demand	Anodyne	MME	58	40
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)Cc1ccco1	ZINC000875069448	EF	On-Demand	Anodyne	CAPN1	26	41
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)Cc1ccco1	ZINC000875069448	EF	On-Demand	Anodyne	CAPN2	53	41
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)Cc1ccco1	ZINC000875069448	EF	On-Demand	Anodyne	ACE2	52	36
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)Cc1ccco1	ZINC000875069450	EF	On-Demand	Anodyne	MME	58	40
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)Cc1ccco1	ZINC000875069450	EF	On-Demand	Anodyne	CAPN1	26	41
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)Cc1ccco1	ZINC000875069450	EF	On-Demand	Anodyne	CAPN2	53	41
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)Cc1ccco1	ZINC000875069450	EF	On-Demand	Anodyne	ACE2	52	36
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)Cc1ccco1	ZINC000875069452	EF	On-Demand	Anodyne	MME	58	40
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)Cc1ccco1	ZINC000875069452	EF	On-Demand	Anodyne	CAPN1	26	41
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)Cc1ccco1	ZINC000875069452	EF	On-Demand	Anodyne	CAPN2	53	41
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)Cc1ccco1	ZINC000875069452	EF	On-Demand	Anodyne	ACE2	52	36
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)Cc1ccco1	ZINC000875069455	EF	On-Demand	Anodyne	MME	58	40
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)Cc1ccco1	ZINC000875069455	EF	On-Demand	Anodyne	CAPN1	26	41
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)Cc1ccco1	ZINC000875069455	EF	On-Demand	Anodyne	CAPN2	53	41
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)Cc1ccco1	ZINC000875069455	EF	On-Demand	Anodyne	ACE2	52	36
C[C@@H](Cc1ccccc1F)NC(=O)C(=O)N[C@H](C)c1ccc(C(F)(F)F)nc1	ZINC000875069471	GG	On-Demand	Anodyne	TRPV1	89	36
C[C@@H](Cc1ccccc1F)NC(=O)C(=O)N[C@@H](C)c1ccc(C(F)(F)F)nc1	ZINC000875069472	GG	On-Demand	Anodyne	TRPV1	89	36
C[C@H](Cc1ccccc1F)NC(=O)C(=O)N[C@H](C)c1ccc(C(F)(F)F)nc1	ZINC000875069473	GG	On-Demand	Anodyne	TRPV1	89	36
O=C(CCNC(=O)N1CCC[C@@](O)(c2ccccc2)C1)N1CCCCC1	ZINC000875069535	FE	On-Demand	Anodyne	EPHX2	15	47
O=C(CCNC(=O)N1CCC[C@](O)(c2ccccc2)C1)N1CCCCC1	ZINC000875069536	FE	On-Demand	Anodyne	EPHX2	15	47
C[C@H](Cc1ccco1)NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875069572	FF	On-Demand	Anodyne	C3AR1	43	41
C[C@H](Cc1ccco1)NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875069573	FF	On-Demand	Anodyne	C3AR1	43	41
C[C@@H](Cc1ccco1)NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875069574	FF	On-Demand	Anodyne	C3AR1	43	41
C[C@@H](Cc1ccco1)NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875069575	FF	On-Demand	Anodyne	C3AR1	43	41
C[C@H](NC(=O)C(=O)NC[C@H](c1ccccc1)N1CCOCC1)c1ccnn1C	ZINC000875069579	GC	On-Demand	Anodyne	CASR	48	39
C[C@H](NC(=O)C(=O)NC[C@@H](c1ccccc1)N1CCOCC1)c1ccnn1C	ZINC000875069581	GC	On-Demand	Anodyne	CASR	48	39
O=C(CCNC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1)N1CCCCC1	ZINC000875069656	FE	On-Demand	Anodyne	PREP	49	36
COc1cccc(C(C)(C)C(=O)Nc2nc(C(C)=O)cs2)c1	ZINC000875069667	DG	On-Demand	Anodyne	CSNK1D	21	40
COCCOc1ccc(CNC(=O)C(=O)N2CCC[C@H]2c2cncc(C)c2)cc1	ZINC000875069668	GE	On-Demand	Anodyne	CPT1A	58	36
COCCOc1ccc(CNC(=O)C(=O)N2CCC[C@@H]2c2cncc(C)c2)cc1	ZINC000875069669	GE	On-Demand	Anodyne	CPT1A	58	36
N#Cc1ccc(Cc2cnc(NC(=O)Cn3c(S)nc4ccccc4c3=O)s2)cc1	ZINC000875069677	IG	On-Demand	Mild	IMDH_CRYPV	23	41
O=C(CSc1nnc(-c2ccc(Cl)cc2)o1)Oc1ccc(C(F)(F)F)cc1	ZINC000875069699	HK	On-Demand	Anodyne	ALOX15	41	47
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(COC)c1	ZINC000875069708	CE	On-Demand	Anodyne	ANPEP	18	47
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(COC)c1	ZINC000875069708	CE	On-Demand	Anodyne	CAPN2	52	34
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(COC)c1	ZINC000875069708	CE	On-Demand	Anodyne	PDS	55	37
CC(=O)c1csc(NC(=O)[C@H]2C[C@@H](C)CC(=O)N2)n1	ZINC000875069714	CD	On-Demand	Anodyne	TRPC6	40	36
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1COC	ZINC000875069768	CE	On-Demand	Anodyne	ANPEP	27	45
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1COC	ZINC000875069768	CE	On-Demand	Anodyne	CAPN2	63	33
CC(=O)c1csc(NC(=O)c2cccn(C3CC3)c2=O)n1	ZINC000875069827	DE	On-Demand	Anodyne	TRPC6	50	35
CC(=O)c1csc(NC(=O)c2cccn(C3CC3)c2=O)n1	ZINC000875069827	DE	On-Demand	Anodyne	TRPC3	44	35
CC(=O)c1csc(NC(=O)C2(NC(=O)OCc3ccccc3)CC2)n1	ZINC000875069842	FF	On-Demand	Anodyne	CTSK	24	48
CC(=O)c1csc(NC(=O)C2(NC(=O)OCc3ccccc3)CC2)n1	ZINC000875069842	FF	On-Demand	Anodyne	CAPNS1	56	34
CC(=O)c1csc(NC(=O)C2(NC(=O)OCc3ccccc3)CC2)n1	ZINC000875069842	FF	On-Demand	Anodyne	CAPN1	43	34
CC(=O)c1csc(NC(=O)C2(NC(=O)OCc3ccccc3)CC2)n1	ZINC000875069842	FF	On-Demand	Anodyne	CAPN2	64	32
CC(=O)c1csc(NC(=O)C2(NC(=O)OCc3ccccc3)CC2)n1	ZINC000875069842	FF	On-Demand	Anodyne	SLC12A5	65	33
COCCCn1c(S)nc2cc(C(=O)Nc3ncc(Cc4ccc(C#N)cc4)s3)ccc2c1=O	ZINC000875069853	JH	On-Demand	Mild	ITK	24	43
COCCCn1c(S)nc2cc(C(=O)Nc3ncc(Cc4ccc(C#N)cc4)s3)ccc2c1=O	ZINC000875069853	JH	On-Demand	Mild	SCD1	41	41
COCCCn1c(S)nc2cc(C(=O)Nc3ncc(Cc4ccc(C#N)cc4)s3)ccc2c1=O	ZINC000875069853	JH	On-Demand	Mild	SCD	34	41
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069871	DG	On-Demand	Anodyne	TRPC6	44	41
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1nc(C(C)=O)cs1	ZINC000875069871	DG	On-Demand	Anodyne	TRPC3	36	41
CNC(=O)[C@@H]1CN(C(=O)c2noc3c2CC(C)(C)CC3)c2ccccc2O1	ZINC000875069888	FE	On-Demand	Anodyne	PANC	40	31
CNC(=O)[C@H]1CN(C(=O)c2noc3c2CC(C)(C)CC3)c2ccccc2O1	ZINC000875069889	FE	On-Demand	Anodyne	PANC	40	31
CC(=O)c1csc(NC(=O)c2cccc(OC(C)(C)C)c2)n1	ZINC000875069892	DH	On-Demand	Anodyne	MPL	35	40
CC(=O)c1csc(NC(=O)c2cccc(OC(C)(C)C)c2)n1	ZINC000875069892	DH	On-Demand	Anodyne	GCK	19	55
CC(=O)c1csc(NC(=O)c2cccc(OC(C)(C)C)c2)n1	ZINC000875069892	DH	On-Demand	Anodyne	KCNK3	40	38
CC[C@@H](NC(=O)NCc1cccc(COC)c1)[C@@H](O)c1ccccc1	ZINC000875069958	EG	On-Demand	Anodyne	ANPEP	16	42
CC[C@@H](NC(=O)NCc1cccc(COC)c1)[C@@H](O)c1ccccc1	ZINC000875069958	EG	On-Demand	Anodyne	CAPN2	51	33
CC[C@@H](NC(=O)NCc1cccc(COC)c1)[C@@H](O)c1ccccc1	ZINC000875069958	EG	On-Demand	Anodyne	PDS	64	38
CC[C@@H](NC(=O)NCc1cccc(COC)c1)[C@H](O)c1ccccc1	ZINC000875069961	EG	On-Demand	Anodyne	ANPEP	16	42
CC[C@@H](NC(=O)NCc1cccc(COC)c1)[C@H](O)c1ccccc1	ZINC000875069961	EG	On-Demand	Anodyne	CAPN2	51	33
CC[C@@H](NC(=O)NCc1cccc(COC)c1)[C@H](O)c1ccccc1	ZINC000875069961	EG	On-Demand	Anodyne	PDS	64	38
Cn1cc(/C=C\C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)cn1	ZINC000875069971	EF	On-Demand	Mild	SCD	26	45
Cn1cc(/C=C/C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)cn1	ZINC000875069972	EF	On-Demand	Mild	SCD	26	45
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCOc2ccc(C)cc2)C1	ZINC000875070003	FE	On-Demand	Anodyne	HRH3	47	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCOc2ccc(C)cc2)C1	ZINC000875070004	FE	On-Demand	Anodyne	HRH3	47	37
CNC(=O)[C@@H]1CN(C(=O)c2ccc(C)c(C(=O)OC)c2)c2ccccc2O1	ZINC000875070029	FD	On-Demand	Anodyne	AVPR2	65	41
CNC(=O)[C@H]1CN(C(=O)c2ccc(C)c(C(=O)OC)c2)c2ccccc2O1	ZINC000875070030	FD	On-Demand	Anodyne	AVPR2	65	41
O=C(NCCC(=O)N1CCCCC1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875070031	FD	On-Demand	Anodyne	HRH2	25	43
O=C(NCCC(=O)N1CCCCC1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875070031	FD	On-Demand	Anodyne	DPP7	58	48
O=C(NCCC(=O)N1CCCCC1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875070032	FD	On-Demand	Anodyne	HRH2	25	43
O=C(NCCC(=O)N1CCCCC1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875070032	FD	On-Demand	Anodyne	DPP7	58	48
COCc1ccccc1CNC(=O)N[C@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875070165	GF	On-Demand	Anodyne	MTNR1A	43	39
COCc1ccccc1CNC(=O)N[C@@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875070166	GF	On-Demand	Anodyne	MTNR1A	43	39
COCc1ccccc1CNC(=O)N[C@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875070167	GF	On-Demand	Anodyne	MTNR1A	43	39
COCc1ccccc1CNC(=O)N[C@@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875070168	GF	On-Demand	Anodyne	MTNR1A	43	39
CC(=O)c1csc(NC(=O)c2noc3c2CC(C)(C)CC3)n1	ZINC000875070248	DG	On-Demand	Anodyne	PANC	40	30
CC[C@H](C[C@H](C)O)NC(=O)NCCC(=O)N1CCCCC1	ZINC000875070278	CD	On-Demand	Anodyne	RIR1_HHV11	78	46
COC1CC(C(=O)Nc2c(C(N)=O)oc3ccccc23)C1	ZINC000875070294	CD	On-Demand	Anodyne	FAS	17	40
CC[C@@H](NC(=O)NCCC(=O)N1CCCCC1)[C@@H](O)c1ccccc1	ZINC000875070313	EE	On-Demand	Anodyne	KCNQ2	43	35
CC[C@@H](NC(=O)NCCC(=O)N1CCCCC1)[C@@H](O)c1ccccc1	ZINC000875070313	EE	On-Demand	Anodyne	RIR1_HHV11	42	37
CC[C@@H](NC(=O)NCCC(=O)N1CCCCC1)[C@H](O)c1ccccc1	ZINC000875070315	EE	On-Demand	Anodyne	KCNQ2	43	35
CC[C@@H](NC(=O)NCCC(=O)N1CCCCC1)[C@H](O)c1ccccc1	ZINC000875070315	EE	On-Demand	Anodyne	RIR1_HHV11	42	37
CC(=O)c1csc(NC(=O)CCc2ccc(N3CCCS3(=O)=O)cc2)n1	ZINC000875070388	GE	On-Demand	Anodyne	CDK1	18	42
CON=Cc1ccc(C(=O)Oc2ccc(C(F)(F)F)cc2)cc1	ZINC000875070391	DH	On-Demand	Mild	PRSS1	15	50
CON=Cc1ccc(C(=O)Oc2ccc(C(F)(F)F)cc2)cc1	ZINC000875070391	DH	On-Demand	Mild	ACR	67	50
COCc1ccccc1CNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875070402	GH	On-Demand	Mild	CTSF	71	35
COCc1ccccc1CNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875070402	GH	On-Demand	Mild	CTSL	33	42
COCc1ccccc1CNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875070402	GH	On-Demand	Mild	CTSS	26	42
COCc1ccccc1CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875070403	GH	On-Demand	Mild	CTSF	71	35
COCc1ccccc1CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875070403	GH	On-Demand	Mild	CTSL	33	42
COCc1ccccc1CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875070403	GH	On-Demand	Mild	CTSS	26	42
COCc1ccccc1CNC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875070435	EF	On-Demand	Anodyne	EPHX2	26	47
COc1ccc2c(C)c(CCC(=O)Nc3ncc(Cc4ccc(C#N)cc4)s3)c(=O)oc2c1	ZINC000875070457	JJ	On-Demand	Mild	MAOB	32	46
O=C(NCCNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1cccnc1	ZINC000875070465	FD	On-Demand	Anodyne	EPHX2	22	43
O=C(NCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1cccnc1	ZINC000875070466	FD	On-Demand	Anodyne	EPHX2	22	43
O=C(NCCNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)c1cccnc1	ZINC000875070471	GD	On-Demand	Anodyne	TBXAS1	48	42
O=C(NCCNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)c1cccnc1	ZINC000875070471	GD	On-Demand	Anodyne	PTAFR	24	43
O=C(NCCNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)c1cccnc1	ZINC000875070471	GD	On-Demand	Anodyne	FAAH	19	49
O=C(NCCNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)c1cccnc1	ZINC000875070471	GD	On-Demand	Anodyne	NAMPT	46	39
Cc1cncc([C@@H]2CCCN2C(=O)NCCNC(=O)c2cccnc2)c1	ZINC000875070480	FE	On-Demand	Anodyne	DRD4	40	32
Cc1cncc([C@@H]2CCCN2C(=O)NCCNC(=O)c2cccnc2)c1	ZINC000875070480	FE	On-Demand	Anodyne	CHRNA7	23	42
Cc1cncc([C@@H]2CCCN2C(=O)NCCNC(=O)c2cccnc2)c1	ZINC000875070480	FE	On-Demand	Anodyne	PREP	31	54
Cc1cncc([C@H]2CCCN2C(=O)NCCNC(=O)c2cccnc2)c1	ZINC000875070481	FE	On-Demand	Anodyne	DRD4	40	32
Cc1cncc([C@H]2CCCN2C(=O)NCCNC(=O)c2cccnc2)c1	ZINC000875070481	FE	On-Demand	Anodyne	CHRNA7	23	42
Cc1cncc([C@H]2CCCN2C(=O)NCCNC(=O)c2cccnc2)c1	ZINC000875070481	FE	On-Demand	Anodyne	PREP	31	54
CCOc1ccc(CC(=O)Oc2ccc(C(F)(F)F)cc2)cc1	ZINC000875070499	DI	On-Demand	Anodyne	PPARA	23	44
CCOc1ccc(CC(=O)Oc2ccc(C(F)(F)F)cc2)cc1	ZINC000875070499	DI	On-Demand	Anodyne	PPARD	62	44
CN1CCN(C2CCN(C(=O)NCCNC(=O)c3cccnc3)CC2)CC1	ZINC000875070515	FC	On-Demand	Anodyne	DRD4	40	31
CN1CCN(C2CCN(C(=O)NCCNC(=O)c3cccnc3)CC2)CC1	ZINC000875070515	FC	On-Demand	Anodyne	CHRNA7	45	37
CN1CCN(C2CCN(C(=O)NCCNC(=O)c3cccnc3)CC2)CC1	ZINC000875070515	FC	On-Demand	Anodyne	L3MBTL3	74	43
CN1CC[C@H]2CN(C(=O)NCCNC(=O)c3cccnc3)CC[C@@H]21	ZINC000875070523	EC	On-Demand	Anodyne	DRD4	41	32
CN1CC[C@H]2CN(C(=O)NCCNC(=O)c3cccnc3)CC[C@@H]21	ZINC000875070523	EC	On-Demand	Anodyne	CHRNA7	50	38
CN1CC[C@H]2CN(C(=O)NCCNC(=O)c3cccnc3)CC[C@H]21	ZINC000875070525	EC	On-Demand	Anodyne	DRD4	41	32
CN1CC[C@H]2CN(C(=O)NCCNC(=O)c3cccnc3)CC[C@H]21	ZINC000875070525	EC	On-Demand	Anodyne	CHRNA7	50	38
Cc1nnc(NNC(=O)NCCN2CCc3ccccc3C2)n1C	ZINC000875070542	EC	On-Demand	Reactive	NOD2	40	34
COCCOc1ccc(CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875070547	FD	On-Demand	Anodyne	HRH3	33	41
COCCOc1ccc(CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875070548	FD	On-Demand	Anodyne	HRH3	33	41
O=C(NCCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1)c1cccnc1	ZINC000875070568	GE	On-Demand	Anodyne	FKBP1A	24	42
O=C(NCCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1)c1cccnc1	ZINC000875070568	GE	On-Demand	Anodyne	CPT1A	70	37
O=C(NCCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1)c1cccnc1	ZINC000875070568	GE	On-Demand	Anodyne	PREP	27	47
O=C(NCCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1)c1cccnc1	ZINC000875070569	GE	On-Demand	Anodyne	FKBP1A	24	42
O=C(NCCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1)c1cccnc1	ZINC000875070569	GE	On-Demand	Anodyne	CPT1A	70	37
O=C(NCCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1)c1cccnc1	ZINC000875070569	GE	On-Demand	Anodyne	PREP	27	47
O=C(NCCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1)c1cccnc1	ZINC000875070570	GE	On-Demand	Anodyne	FKBP1A	24	42
O=C(NCCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1)c1cccnc1	ZINC000875070570	GE	On-Demand	Anodyne	CPT1A	70	37
O=C(NCCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1)c1cccnc1	ZINC000875070570	GE	On-Demand	Anodyne	PREP	27	47
O=C(NCCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1)c1cccnc1	ZINC000875070571	GE	On-Demand	Anodyne	FKBP1A	24	42
O=C(NCCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1)c1cccnc1	ZINC000875070571	GE	On-Demand	Anodyne	CPT1A	70	37
O=C(NCCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1)c1cccnc1	ZINC000875070571	GE	On-Demand	Anodyne	PREP	27	47
O=C(NCCN1CCc2ccccc2C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875070582	GD	On-Demand	Anodyne	NOD2	41	37
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCCc2cc(OC)ccc21	ZINC000875070590	FD	On-Demand	Mild	BDKRB1	54	40
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H]1CCCc2cc(OC)ccc21	ZINC000875070591	FD	On-Demand	Mild	BDKRB1	54	40
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCCc2cc(OC)ccc21	ZINC000875070592	FD	On-Demand	Mild	BDKRB1	54	40
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H]1CCCc2cc(OC)ccc21	ZINC000875070593	FD	On-Demand	Mild	BDKRB1	54	40
O=C(NCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)c1cccnc1	ZINC000875070600	FD	On-Demand	Anodyne	PREP	38	50
O=C(NCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)c1cccnc1	ZINC000875070601	FD	On-Demand	Anodyne	PREP	38	50
O=C(NCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)c1cccnc1	ZINC000875070602	FD	On-Demand	Anodyne	PREP	38	50
O=C(NCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)c1cccnc1	ZINC000875070603	FD	On-Demand	Anodyne	PREP	38	50
COc1ccc([C@@H]2CN(C(=O)NCCNC(=O)c3cccnc3)CCO2)cc1	ZINC000875070605	GD	On-Demand	Anodyne	DRD4	46	35
COc1ccc([C@@H]2CN(C(=O)NCCNC(=O)c3cccnc3)CCO2)cc1	ZINC000875070605	GD	On-Demand	Anodyne	CHRNA7	15	40
CCn1c(S)nc2cc(C(=O)Nc3ncc(Cc4ccc(C#N)cc4)s3)ccc2c1=O	ZINC000875070606	IH	On-Demand	Mild	SCD1	39	40
CCn1c(S)nc2cc(C(=O)Nc3ncc(Cc4ccc(C#N)cc4)s3)ccc2c1=O	ZINC000875070606	IH	On-Demand	Mild	SCD	33	40
COC(=O)C1(O)CN(C(=O)NCCN2CCc3ccccc3C2)C1	ZINC000875070622	EB	On-Demand	Anodyne	DRD4	40	31
COC(=O)C1(O)CN(C(=O)NCCN2CCc3ccccc3C2)C1	ZINC000875070622	EB	On-Demand	Anodyne	DRD3	16	51
COC(=O)C1(O)CN(C(=O)NCCN2CCc3ccccc3C2)C1	ZINC000875070622	EB	On-Demand	Anodyne	HTR7	15	45
COC(=O)C1(O)CN(C(=O)NCCN2CCc3ccccc3C2)C1	ZINC000875070622	EB	On-Demand	Anodyne	NOD2	44	38
C[C@]1(C(F)(F)F)CCN(C(=O)NCCNC(=O)c2cccnc2)C1	ZINC000875070654	ED	On-Demand	Anodyne	EPHX2	18	46
O=C(NCCNC(=O)c1cccnc1)NC1CC(Nc2ccccc2)C1	ZINC000875070708	FD	On-Demand	Anodyne	TBXAS1	36	41
O=C(NCCNC(=O)c1cccnc1)NC1CC(Nc2ccccc2)C1	ZINC000875070708	FD	On-Demand	Anodyne	NAMPT	28	41
COC(=O)c1ccc(C(=O)Oc2ccc(C(F)(F)F)cc2)cc1	ZINC000875070714	DH	On-Demand	Anodyne	PRSS1	21	63
COC(=O)c1ccc(C(=O)Oc2ccc(C(F)(F)F)cc2)cc1	ZINC000875070714	DH	On-Demand	Anodyne	ACR	99	63
COCCOc1ccc(CNC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875070715	FD	On-Demand	Anodyne	LTA4H	20	40
COCCN(CC1CCN(C)CC1)C(=O)NCCNC(=O)c1cccnc1	ZINC000875070720	GC	On-Demand	Anodyne	DRD4	42	32
CC[C@@H]1COCCN1CCNC(=O)NCCNC(=O)c1cccnc1	ZINC000875070741	EC	On-Demand	Anodyne	DRD4	40	32
O=C(NCCNC(=O)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1)c1cccnc1	ZINC000875070778	FE	On-Demand	Anodyne	TBXAS1	27	41
O=C(NCCNC(=O)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1)c1cccnc1	ZINC000875070778	FE	On-Demand	Anodyne	EPHX2	16	50
O=C(NCCNC(=O)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1)c1cccnc1	ZINC000875070778	FE	On-Demand	Anodyne	NAMPT	36	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCN1CCc2ccccc2C1	ZINC000875070786	FD	On-Demand	Anodyne	SLC6A4	27	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCN1CCc2ccccc2C1	ZINC000875070786	FD	On-Demand	Anodyne	SLC6A3	51	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCN1CCc2ccccc2C1	ZINC000875070786	FD	On-Demand	Anodyne	HTR7	15	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCN1CCc2ccccc2C1	ZINC000875070786	FD	On-Demand	Anodyne	NOD2	40	35
C[C@@H](CNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)N1CCOCC1	ZINC000875070789	FD	On-Demand	Mild	ITK	15	47
C[C@@H](CNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)N1CCOCC1	ZINC000875070789	FD	On-Demand	Mild	PANC	41	36
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CCCc2cc(OC)ccc21	ZINC000875070801	ED	On-Demand	Mild	BDKRB1	55	40
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CCCc2cc(OC)ccc21	ZINC000875070802	ED	On-Demand	Mild	BDKRB1	55	40
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H]1CCCc2cc(OC)ccc21	ZINC000875070803	ED	On-Demand	Mild	BDKRB1	55	40
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H]1CCCc2cc(OC)ccc21	ZINC000875070804	ED	On-Demand	Mild	BDKRB1	55	40
CN1CCN(C(=O)NCCNC(=O)c2cccnc2)CCC1(C)C	ZINC000875070839	EC	On-Demand	Anodyne	DRD4	40	31
CCOC(=O)[C@H](C)C1CN(C(=O)NCCN2CCc3ccccc3C2)C1	ZINC000875070841	FD	On-Demand	Anodyne	ACE	20	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCCN2CCc3ccccc3C2)C1	ZINC000875070841	FD	On-Demand	Anodyne	HTR7	18	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCCN2CCc3ccccc3C2)C1	ZINC000875070841	FD	On-Demand	Anodyne	ABCB1B	41	33
CCOC(=O)[C@H](C)C1CN(C(=O)NCCN2CCc3ccccc3C2)C1	ZINC000875070841	FD	On-Demand	Anodyne	NOD1	16	43
CCOC(=O)[C@H](C)C1CN(C(=O)NCCN2CCc3ccccc3C2)C1	ZINC000875070841	FD	On-Demand	Anodyne	NOD2	45	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875070901	GC	On-Demand	Anodyne	HTR1A	71	50
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875070901	GC	On-Demand	Anodyne	DRD2	48	47
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875070901	GC	On-Demand	Anodyne	DRD4	47	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875070901	GC	On-Demand	Anodyne	ADRA1D	17	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875070901	GC	On-Demand	Anodyne	HTR2A	41	47
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875070901	GC	On-Demand	Anodyne	HTR2C	20	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875070901	GC	On-Demand	Anodyne	SLC6A1	134	38
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875070901	GC	On-Demand	Anodyne	ADRA1A	21	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875070901	GC	On-Demand	Anodyne	DRD3	63	47
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875070901	GC	On-Demand	Anodyne	HTR7	62	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875070901	GC	On-Demand	Anodyne	ADAM10	37	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875070902	GC	On-Demand	Anodyne	HTR1A	71	50
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875070902	GC	On-Demand	Anodyne	DRD2	48	47
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875070902	GC	On-Demand	Anodyne	DRD4	47	37
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875070902	GC	On-Demand	Anodyne	ADRA1D	17	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875070902	GC	On-Demand	Anodyne	HTR2A	41	47
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875070902	GC	On-Demand	Anodyne	HTR2C	20	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875070902	GC	On-Demand	Anodyne	SLC6A1	134	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875070902	GC	On-Demand	Anodyne	ADRA1A	21	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875070902	GC	On-Demand	Anodyne	DRD3	63	47
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875070902	GC	On-Demand	Anodyne	HTR7	62	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875070902	GC	On-Demand	Anodyne	ADAM10	37	41
N#Cc1ccc(Cc2cnc(NC(=O)/C=C/c3ccc(Cl)s3)s2)cc1	ZINC000875070922	GJ	On-Demand	Mild	SCD	17	40
N#Cc1ccc(Cc2cnc(NC(=O)/C=C\c3ccc(Cl)s3)s2)cc1	ZINC000875070923	GJ	On-Demand	Mild	SCD	17	40
Cn1nc(Cl)c(C(=O)Nc2ccccc2C(=O)NC[C@@H]2CCCO2)c1Cl	ZINC000875070929	GF	On-Demand	Anodyne	G2YM83_BOTF4	57	34
Cn1nc(Cl)c(C(=O)Nc2ccccc2C(=O)NC[C@H]2CCCO2)c1Cl	ZINC000875070930	GF	On-Demand	Anodyne	G2YM83_BOTF4	57	34
O=C(NCCNC(=O)N1CCC[C@@](F)(c2ccccc2)C1)c1cccnc1	ZINC000875070956	FE	On-Demand	Anodyne	EPHX2	21	54
O=C(NCCNC(=O)N1CCC[C@](F)(c2ccccc2)C1)c1cccnc1	ZINC000875070957	FE	On-Demand	Anodyne	EPHX2	21	54
O=C(NCC[C@H]1CCSC1)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875070981	GD	On-Demand	Anodyne	HTR1A	66	50
O=C(NCC[C@H]1CCSC1)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875070981	GD	On-Demand	Anodyne	DRD2	51	50
O=C(NCC[C@H]1CCSC1)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875070981	GD	On-Demand	Anodyne	DRD4	46	37
O=C(NCC[C@H]1CCSC1)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875070981	GD	On-Demand	Anodyne	HTR2A	43	45
O=C(NCC[C@H]1CCSC1)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875070981	GD	On-Demand	Anodyne	HTR2C	18	41
O=C(NCC[C@H]1CCSC1)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875070981	GD	On-Demand	Anodyne	DRD3	62	48
O=C(NCC[C@H]1CCSC1)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875070981	GD	On-Demand	Anodyne	HTR7	56	42
O=C(NCC[C@@H]1CCSC1)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875070982	GD	On-Demand	Anodyne	HTR1A	66	50
O=C(NCC[C@@H]1CCSC1)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875070982	GD	On-Demand	Anodyne	DRD2	51	50
O=C(NCC[C@@H]1CCSC1)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875070982	GD	On-Demand	Anodyne	DRD4	46	37
O=C(NCC[C@@H]1CCSC1)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875070982	GD	On-Demand	Anodyne	HTR2A	43	45
O=C(NCC[C@@H]1CCSC1)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875070982	GD	On-Demand	Anodyne	HTR2C	18	41
O=C(NCC[C@@H]1CCSC1)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875070982	GD	On-Demand	Anodyne	DRD3	62	48
O=C(NCC[C@@H]1CCSC1)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875070982	GD	On-Demand	Anodyne	HTR7	56	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(N(C)C)nc1	ZINC000875071072	ED	On-Demand	Anodyne	SLC6A3	48	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(N(C)C)nc1	ZINC000875071074	ED	On-Demand	Anodyne	SLC6A3	48	39
COc1ccccc1[C@H]1CCCN(C(=O)NCCNC(=O)c2cccnc2)CC1	ZINC000875071081	GF	On-Demand	Anodyne	HTR1A	20	52
COc1ccccc1[C@H]1CCCN(C(=O)NCCNC(=O)c2cccnc2)CC1	ZINC000875071081	GF	On-Demand	Anodyne	DRD2	25	52
COc1ccccc1[C@H]1CCCN(C(=O)NCCNC(=O)c2cccnc2)CC1	ZINC000875071081	GF	On-Demand	Anodyne	DRD4	41	32
COc1ccccc1[C@H]1CCCN(C(=O)NCCNC(=O)c2cccnc2)CC1	ZINC000875071081	GF	On-Demand	Anodyne	DRD3	30	41
COc1ccccc1[C@H]1CCCN(C(=O)NCCNC(=O)c2cccnc2)CC1	ZINC000875071081	GF	On-Demand	Anodyne	ACKR3	62	32
COc1ccccc1[C@@H]1CCCN(C(=O)NCCNC(=O)c2cccnc2)CC1	ZINC000875071083	GF	On-Demand	Anodyne	HTR1A	20	52
COc1ccccc1[C@@H]1CCCN(C(=O)NCCNC(=O)c2cccnc2)CC1	ZINC000875071083	GF	On-Demand	Anodyne	DRD2	25	52
COc1ccccc1[C@@H]1CCCN(C(=O)NCCNC(=O)c2cccnc2)CC1	ZINC000875071083	GF	On-Demand	Anodyne	DRD4	41	32
COc1ccccc1[C@@H]1CCCN(C(=O)NCCNC(=O)c2cccnc2)CC1	ZINC000875071083	GF	On-Demand	Anodyne	DRD3	30	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCCNC(=O)c2cccnc2)CC1	ZINC000875071083	GF	On-Demand	Anodyne	ACKR3	62	32
CC(=O)[C@H]1CCCN(C(=O)NCCNC(=O)c2cccnc2)C1	ZINC000875071096	DC	On-Demand	Anodyne	PREP	28	51
CC(=O)[C@H]1CCCN(C(=O)NCCNC(=O)c2cccnc2)C1	ZINC000875071096	DC	On-Demand	Anodyne	DPP7	17	42
CC(=O)[C@H]1CCCN(C(=O)NCCNC(=O)c2cccnc2)C1	ZINC000875071096	DC	On-Demand	Anodyne	NAMPT	43	39
CC(=O)[C@@H]1CCCN(C(=O)NCCNC(=O)c2cccnc2)C1	ZINC000875071098	DC	On-Demand	Anodyne	PREP	28	51
CC(=O)[C@@H]1CCCN(C(=O)NCCNC(=O)c2cccnc2)C1	ZINC000875071098	DC	On-Demand	Anodyne	DPP7	17	42
CC(=O)[C@@H]1CCCN(C(=O)NCCNC(=O)c2cccnc2)C1	ZINC000875071098	DC	On-Demand	Anodyne	NAMPT	43	39
Cn1cc(/C=C/C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)c(=O)n(C)c1=O	ZINC000875071148	HD	On-Demand	Mild	SCD	28	40
Cn1cc(/C=C\C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)c(=O)n(C)c1=O	ZINC000875071149	HD	On-Demand	Mild	SCD	28	40
CNC(=O)CN1CCC(NC(=O)C(=O)N2CCC[C@H]2c2cncc(C)c2)CC1	ZINC000875071174	GC	On-Demand	Anodyne	SSTR5	32	41
CNC(=O)CN1CCC(NC(=O)C(=O)N2CCC[C@@H]2c2cncc(C)c2)CC1	ZINC000875071175	GC	On-Demand	Anodyne	SSTR5	32	41
C[C@@H](CNC(=O)NC1CC(Nc2ccccc2)C1)N1CCOCC1	ZINC000875071255	ED	On-Demand	Anodyne	ITGAL	41	32
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCNC(=O)c2cccnc2)C1	ZINC000875071281	DD	On-Demand	Anodyne	DRD4	43	34
C[C@]1(C(F)(F)F)CN(C(=O)NCCNC(=O)c2cccnc2)CCO1	ZINC000875071318	FD	On-Demand	Anodyne	EPHX2	18	42
O=C(Cc1ccc2c(c1)OCCO2)Oc1ccc(C(F)(F)F)cc1	ZINC000875071372	EH	On-Demand	Anodyne	LUXR	19	40
O=C(Cc1ccc2c(c1)OCCO2)Oc1ccc(C(F)(F)F)cc1	ZINC000875071372	EH	On-Demand	Anodyne	TRAR	17	40
CCCCCCCNC(=O)C(=O)NC1CCN(CC(=O)NC)CC1	ZINC000875071409	EC	On-Demand	Mild	ASAH1	42	32
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)N(C)c1ccccc1	ZINC000875071417	EE	On-Demand	Anodyne	SLC6A4	24	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)N(C)c1ccccc1	ZINC000875071417	EE	On-Demand	Anodyne	SLC6A3	52	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)N(C)c1ccccc1	ZINC000875071419	EE	On-Demand	Anodyne	SLC6A4	24	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)N(C)c1ccccc1	ZINC000875071419	EE	On-Demand	Anodyne	SLC6A3	52	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)N(C)c1ccccc1	ZINC000875071421	EE	On-Demand	Anodyne	SLC6A4	24	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)N(C)c1ccccc1	ZINC000875071421	EE	On-Demand	Anodyne	SLC6A3	52	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)N(C)c1ccccc1	ZINC000875071423	EE	On-Demand	Anodyne	SLC6A4	24	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)N(C)c1ccccc1	ZINC000875071423	EE	On-Demand	Anodyne	SLC6A3	52	42
O=CN1CCCN(C(=O)NCCN2CCc3ccccc3C2)CC1	ZINC000875071430	EC	On-Demand	Anodyne	NOD2	40	33
CCC(CC)C(=O)N1CCC(NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)CC1	ZINC000875071439	GD	On-Demand	Anodyne	EPHX2	20	43
O=C(NCCNC(=O)N1CCC[C@@](O)(c2ccccc2)C1)c1cccnc1	ZINC000875071458	FD	On-Demand	Anodyne	EPHX2	18	55
O=C(NCCNC(=O)N1CCC[C@](O)(c2ccccc2)C1)c1cccnc1	ZINC000875071460	FD	On-Demand	Anodyne	EPHX2	18	55
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875071469	FD	On-Demand	Anodyne	HTR1A	32	52
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875071469	FD	On-Demand	Anodyne	DRD2	23	52
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875071469	FD	On-Demand	Anodyne	HTR2A	23	41
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875071469	FD	On-Demand	Anodyne	DRD3	25	44
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875071469	FD	On-Demand	Anodyne	HTR7	28	41
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875071469	FD	On-Demand	Anodyne	PLD2	64	37
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875071469	FD	On-Demand	Anodyne	SLC27A1	30	40
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875071471	FD	On-Demand	Anodyne	HTR1A	32	52
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875071471	FD	On-Demand	Anodyne	DRD2	23	52
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875071471	FD	On-Demand	Anodyne	HTR2A	23	41
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875071471	FD	On-Demand	Anodyne	DRD3	25	44
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875071471	FD	On-Demand	Anodyne	HTR7	28	41
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875071471	FD	On-Demand	Anodyne	PLD2	64	37
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875071471	FD	On-Demand	Anodyne	SLC27A1	30	40
O=C(NCCNC(=O)N1CCN(c2ccc(F)cc2F)CC1)c1cccnc1	ZINC000875071495	GD	On-Demand	Anodyne	DRD2	18	50
O=C(NCCNC(=O)N1CCN(c2ccc(F)cc2F)CC1)c1cccnc1	ZINC000875071495	GD	On-Demand	Anodyne	DRD4	44	34
O=C(NCCNC(=O)N1CCN(c2ccc(F)cc2F)CC1)c1cccnc1	ZINC000875071495	GD	On-Demand	Anodyne	DRD3	34	42
O=C(NCCNC(=O)N1CCN(c2ccc(F)cc2F)CC1)c1cccnc1	ZINC000875071495	GD	On-Demand	Anodyne	NPY2R	51	38
O=C(NCCNC(=O)N1CCN(c2ccc(F)cc2F)CC1)c1cccnc1	ZINC000875071495	GD	On-Demand	Anodyne	CXCR3	18	44
O=C(NCCNC(=O)N1CCN(c2ccc(F)cc2F)CC1)c1cccnc1	ZINC000875071495	GD	On-Demand	Anodyne	CHEK1	44	36
CN1CCC(CNC(=O)NCCNC(=O)c2cccnc2)(c2ccccc2)CC1	ZINC000875071496	GD	On-Demand	Anodyne	DRD4	40	31
CN1CCC(CNC(=O)NCCNC(=O)c2cccnc2)(c2ccccc2)CC1	ZINC000875071496	GD	On-Demand	Anodyne	KCNA3	45	39
CN1CCC(CNC(=O)NCCNC(=O)c2cccnc2)(c2ccccc2)CC1	ZINC000875071496	GD	On-Demand	Anodyne	SLC6A9	20	40
CC(=O)C1CCN(C(=O)NCCNC(=O)c2cccnc2)CC1	ZINC000875071497	DC	On-Demand	Anodyne	DRD4	41	31
CC(=O)C1CCN(C(=O)NCCNC(=O)c2cccnc2)CC1	ZINC000875071497	DC	On-Demand	Anodyne	CHRNA7	42	37
CC(=O)C1CCN(C(=O)NCCNC(=O)c2cccnc2)CC1	ZINC000875071497	DC	On-Demand	Anodyne	EPHX2	15	46
CC(=O)C1CCN(C(=O)NCCNC(=O)c2cccnc2)CC1	ZINC000875071497	DC	On-Demand	Anodyne	NAMPT	52	40
O=C(NCCNC(=O)N1CC[C@H]2CSC[C@@H]2C1)c1cccnc1	ZINC000875071511	ED	On-Demand	Anodyne	CHRNA7	49	39
O=C(NCCNC(=O)N1CC[C@@H]2CSC[C@@H]2C1)c1cccnc1	ZINC000875071512	ED	On-Demand	Anodyne	CHRNA7	49	39
O=C(NCCNC(=O)N1CC[C@H]2CSC[C@H]2C1)c1cccnc1	ZINC000875071513	ED	On-Demand	Anodyne	CHRNA7	49	39
O=C(NCCNC(=O)N1CC[C@@H]2CSC[C@H]2C1)c1cccnc1	ZINC000875071514	ED	On-Demand	Anodyne	CHRNA7	49	39
O=C(NCCNC(=O)N1CC2(CC(=O)N2Cc2ccccc2)C1)c1cccnc1	ZINC000875071524	GD	On-Demand	Anodyne	TBXAS1	39	40
O=C(NCCNC(=O)N1CC2(CC(=O)N2Cc2ccccc2)C1)c1cccnc1	ZINC000875071524	GD	On-Demand	Anodyne	PTAFR	23	43
O=C(NCCNC(=O)N1CC2(CC(=O)N2Cc2ccccc2)C1)c1cccnc1	ZINC000875071524	GD	On-Demand	Anodyne	NAMPT	63	39
C[C@@H](CNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)N1CCOCC1	ZINC000875071529	FD	On-Demand	Anodyne	OPRL1	17	42
O=C(CCC(=O)c1ccccc1)Oc1ccc(C(F)(F)F)cc1	ZINC000875071555	DI	On-Demand	Anodyne	PPARD	27	41
O=C(CCC(=O)c1ccccc1)Oc1ccc(C(F)(F)F)cc1	ZINC000875071555	DI	On-Demand	Anodyne	ACR	17	45
C[C@@H](CNC(=O)N1CC[C@H](C(C)(C)O)C1)N(C)c1ccccc1	ZINC000875071637	DE	On-Demand	Anodyne	AMY2	46	32
C[C@@H](CNC(=O)N1CC[C@H](C(C)(C)O)C1)N(C)c1ccccc1	ZINC000875071637	DE	On-Demand	Anodyne	CCR8	41	33
C[C@@H](CNC(=O)N1CC[C@@H](C(C)(C)O)C1)N(C)c1ccccc1	ZINC000875071639	DE	On-Demand	Anodyne	AMY2	46	32
C[C@@H](CNC(=O)N1CC[C@@H](C(C)(C)O)C1)N(C)c1ccccc1	ZINC000875071639	DE	On-Demand	Anodyne	CCR8	41	33
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H](C)N(C)c2ccccc2)C1	ZINC000875071652	EE	On-Demand	Anodyne	ACE	19	42
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H](C)N(C)c2ccccc2)C1	ZINC000875071652	EE	On-Demand	Anodyne	AMY2	43	29
CCOc1ccc(OCC(=O)Oc2ccc(C(F)(F)F)cc2)cc1	ZINC000875071656	EI	On-Demand	Anodyne	PPARD	57	46
CCOc1ccc(OCC(=O)Oc2ccc(C(F)(F)F)cc2)cc1	ZINC000875071656	EI	On-Demand	Anodyne	PLA2G4B	62	35
CCOc1ccc(OCC(=O)Oc2ccc(C(F)(F)F)cc2)cc1	ZINC000875071656	EI	On-Demand	Anodyne	ACR	15	40
COC(=O)[C@@]12C[C@@H](NC(=O)NCCN3CCc4ccccc4C3)C[C@@H]1C2	ZINC000875071659	FD	On-Demand	Anodyne	NOD2	40	35
CCC(CC)C(=O)N1CCC(NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875071691	GD	On-Demand	Anodyne	EPHX2	17	42
CCC(CC)C(=O)N1CCC(NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875071692	GD	On-Demand	Anodyne	EPHX2	17	42
Cn1cnnc1SCC(=O)Nc1cccc(C(=O)Oc2ccc(C(F)(F)F)cc2)c1	ZINC000875071712	IH	On-Demand	Anodyne	ACR	47	43
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)C1	ZINC000875071715	II	On-Demand	Mild	GPBAR1	23	40
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)C1	ZINC000875071715	II	On-Demand	Mild	GPR119	31	49
O=C(NCCN1CCc2ccccc2C1)N1Cc2cccc(O)c2C1	ZINC000875071720	EE	On-Demand	Clean	DRD4	42	33
O=C(NCCN1CCc2ccccc2C1)N1Cc2cccc(O)c2C1	ZINC000875071720	EE	On-Demand	Clean	DRD5	25	44
O=C(NCCN1CCc2ccccc2C1)N1Cc2cccc(O)c2C1	ZINC000875071720	EE	On-Demand	Clean	HTR7	15	45
O=C(NCCN1CCc2ccccc2C1)N1Cc2cccc(O)c2C1	ZINC000875071720	EE	On-Demand	Clean	NOD2	43	36
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H](C)N(C)c2ccccc2)C1	ZINC000875071753	EE	On-Demand	Anodyne	ACE	19	42
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H](C)N(C)c2ccccc2)C1	ZINC000875071753	EE	On-Demand	Anodyne	AMY2	43	29
C[C@H](NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1)c1ccnn1C	ZINC000875071783	GC	On-Demand	Anodyne	HTR1A	72	49
C[C@H](NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1)c1ccnn1C	ZINC000875071783	GC	On-Demand	Anodyne	DRD2	53	48
C[C@H](NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1)c1ccnn1C	ZINC000875071783	GC	On-Demand	Anodyne	DRD4	47	38
C[C@H](NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1)c1ccnn1C	ZINC000875071783	GC	On-Demand	Anodyne	ADRA1D	26	45
C[C@H](NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1)c1ccnn1C	ZINC000875071783	GC	On-Demand	Anodyne	HTR2A	48	46
C[C@H](NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1)c1ccnn1C	ZINC000875071783	GC	On-Demand	Anodyne	HTR2C	28	42
C[C@H](NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1)c1ccnn1C	ZINC000875071783	GC	On-Demand	Anodyne	ADRA1A	26	45
C[C@H](NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1)c1ccnn1C	ZINC000875071783	GC	On-Demand	Anodyne	DRD3	71	46
C[C@H](NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1)c1ccnn1C	ZINC000875071783	GC	On-Demand	Anodyne	HTR7	66	41
C[C@H](NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1)c1ccnn1C	ZINC000875071783	GC	On-Demand	Anodyne	PRNP	45	33
CCC(CC)C(=O)N1CCC(NC(=O)C(=O)N2CC[C@H]3[C@H](CCN3C)C2)CC1	ZINC000875071857	GD	On-Demand	Anodyne	EPHX2	17	40
CCC(CC)C(=O)N1CCC(NC(=O)C(=O)N2CC[C@@H]3[C@@H](CCN3C)C2)CC1	ZINC000875071858	GD	On-Demand	Anodyne	EPHX2	17	40
CCC(CC)C(=O)N1CCC(NC(=O)C(=O)N2CC[C@@H]3[C@H](CCN3C)C2)CC1	ZINC000875071859	GD	On-Demand	Anodyne	EPHX2	17	40
CCC(CC)C(=O)N1CCC(NC(=O)C(=O)N2CC[C@H]3[C@@H](CCN3C)C2)CC1	ZINC000875071860	GD	On-Demand	Anodyne	EPHX2	17	40
CN(C)C[C@@H]1CN(C(=O)NCCN2CCc3ccccc3C2)C[C@H]1CN(C)C	ZINC000875071861	GD	On-Demand	Anodyne	NOD2	41	34
O=C(NCCN1CCc2ccccc2C1)NC[C@H]1C[C@H](O)C1	ZINC000875071864	DD	On-Demand	Anodyne	HTR7	15	45
O=C(NCCN1CCc2ccccc2C1)NC[C@H]1C[C@H](O)C1	ZINC000875071864	DD	On-Demand	Anodyne	NOD2	41	34
CCC(CC)C(=O)N1CCC(NC(=O)C(=O)N[C@H]2CC23CCC3)CC1	ZINC000875071900	ED	On-Demand	Anodyne	EPHX2	17	44
CCC(CC)C(=O)N1CCC(NC(=O)C(=O)N[C@@H]2CC23CCC3)CC1	ZINC000875071901	ED	On-Demand	Anodyne	EPHX2	17	44
COCCN(CC1CCN(C)CC1)C(=O)NCCN1CCc2ccccc2C1	ZINC000875071934	GE	On-Demand	Anodyne	NOD2	44	39
C[C@H](NC(=O)C(=O)NC[C@H](C)N1CCN(c2ccccc2)CC1)c1ccnn1C	ZINC000875071937	GC	On-Demand	Anodyne	HTR1A	16	40
C[C@H](NC(=O)C(=O)NC[C@H](C)N1CCN(c2ccccc2)CC1)c1ccnn1C	ZINC000875071937	GC	On-Demand	Anodyne	HCN1	18	40
C[C@H](NC(=O)C(=O)NC[C@@H](C)N1CCN(c2ccccc2)CC1)c1ccnn1C	ZINC000875071938	GC	On-Demand	Anodyne	HTR1A	16	40
C[C@H](NC(=O)C(=O)NC[C@@H](C)N1CCN(c2ccccc2)CC1)c1ccnn1C	ZINC000875071938	GC	On-Demand	Anodyne	HCN1	18	40
COC(=O)N(C)NC(=O)NCCN1CCc2ccccc2C1	ZINC000875071939	DC	On-Demand	Reactive	HTR1A	16	42
COC(=O)N(C)NC(=O)NCCN1CCc2ccccc2C1	ZINC000875071939	DC	On-Demand	Reactive	DRD4	41	32
COC(=O)N(C)NC(=O)NCCN1CCc2ccccc2C1	ZINC000875071939	DC	On-Demand	Reactive	DRD3	22	51
COC(=O)N(C)NC(=O)NCCN1CCc2ccccc2C1	ZINC000875071939	DC	On-Demand	Reactive	HTR7	15	44
COC(=O)N(C)NC(=O)NCCN1CCc2ccccc2C1	ZINC000875071939	DC	On-Demand	Reactive	ABCB1B	47	33
COC(=O)N(C)NC(=O)NCCN1CCc2ccccc2C1	ZINC000875071939	DC	On-Demand	Reactive	MTNR1A	15	40
COC(=O)N(C)NC(=O)NCCN1CCc2ccccc2C1	ZINC000875071939	DC	On-Demand	Reactive	MTNR1B	15	40
COC(=O)N(C)NC(=O)NCCN1CCc2ccccc2C1	ZINC000875071939	DC	On-Demand	Reactive	NOD1	17	40
COC(=O)N(C)NC(=O)NCCN1CCc2ccccc2C1	ZINC000875071939	DC	On-Demand	Reactive	NOD2	44	40
O=C(NCCN1CCc2ccccc2C1)N1CCC(CO)(CO)CC1	ZINC000875071944	EC	On-Demand	Anodyne	HTR7	15	48
O=C(NCCN1CCc2ccccc2C1)N1CCC(CO)(CO)CC1	ZINC000875071944	EC	On-Demand	Anodyne	NOD2	41	34
O=C(NCCNC(=O)N1CC[C@@]2(CCc3ccccc32)C1)c1cccnc1	ZINC000875071952	FE	On-Demand	Anodyne	OXTR	15	46
CNC(=O)CN1CCC(NC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000875071954	GC	On-Demand	Anodyne	OXTR	56	37
CNC(=O)CN1CCC(NC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000875071954	GC	On-Demand	Anodyne	SIGMAR1	20	43
CNC(=O)CN1CCC(NC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000875071955	GC	On-Demand	Anodyne	OXTR	56	37
CNC(=O)CN1CCC(NC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000875071955	GC	On-Demand	Anodyne	SIGMAR1	20	43
O=C(Cc1csc(-c2ccccc2)n1)Oc1ccc(C(F)(F)F)cc1	ZINC000875072029	FJ	On-Demand	Anodyne	PPARA	20	45
O=C(Cc1csc(-c2ccccc2)n1)Oc1ccc(C(F)(F)F)cc1	ZINC000875072029	FJ	On-Demand	Anodyne	PPARD	46	45
O=C(NCCNC(=O)N1CC[C@]2(CCc3ccccc32)C1)c1cccnc1	ZINC000875072053	FE	On-Demand	Anodyne	OXTR	15	46
CCC(CC)C(=O)N1CCC(NC(=O)C(=O)N2CC[C@@H]3CSC[C@@H]3C2)CC1	ZINC000875072061	GD	On-Demand	Anodyne	EPHX2	18	41
CCC(CC)C(=O)N1CCC(NC(=O)C(=O)N2CC[C@H]3CSC[C@@H]3C2)CC1	ZINC000875072062	GD	On-Demand	Anodyne	EPHX2	18	41
CCC(CC)C(=O)N1CCC(NC(=O)C(=O)N2CC[C@@H]3CSC[C@H]3C2)CC1	ZINC000875072063	GD	On-Demand	Anodyne	EPHX2	18	41
CCC(CC)C(=O)N1CCC(NC(=O)C(=O)N2CC[C@H]3CSC[C@H]3C2)CC1	ZINC000875072064	GD	On-Demand	Anodyne	EPHX2	18	41
CN1CCN(C(=O)NCCN2CCc3ccccc3C2)CCC1(C)C	ZINC000875072065	EE	On-Demand	Anodyne	NOD2	41	34
O=C(NCCNC(=O)c1cccnc1)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875072069	GE	On-Demand	Anodyne	PTAFR	16	40
O=C(NCCNC(=O)c1cccnc1)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875072069	GE	On-Demand	Anodyne	NAMPT	47	37
O=C(NCCNC(=O)c1cccnc1)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875072070	GE	On-Demand	Anodyne	PTAFR	16	40
O=C(NCCNC(=O)c1cccnc1)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875072070	GE	On-Demand	Anodyne	NAMPT	47	37
CCC(CC)C(=O)N1CCC(NC(=O)C(=O)NCCCCC2CC2)CC1	ZINC000875072072	FE	On-Demand	Anodyne	EPHX2	19	44
COc1ccccc1[C@H]1CN(C(=O)NCCNC(=O)c2cccnc2)CCO1	ZINC000875072107	GD	On-Demand	Anodyne	HTR1A	15	51
COc1ccccc1[C@H]1CN(C(=O)NCCNC(=O)c2cccnc2)CCO1	ZINC000875072107	GD	On-Demand	Anodyne	DRD2	20	53
COc1ccccc1[C@H]1CN(C(=O)NCCNC(=O)c2cccnc2)CCO1	ZINC000875072107	GD	On-Demand	Anodyne	DRD4	42	32
COc1ccccc1[C@H]1CN(C(=O)NCCNC(=O)c2cccnc2)CCO1	ZINC000875072107	GD	On-Demand	Anodyne	DRD3	32	41
COc1ccccc1[C@@H]1CN(C(=O)NCCNC(=O)c2cccnc2)CCO1	ZINC000875072108	GD	On-Demand	Anodyne	HTR1A	15	51
COc1ccccc1[C@@H]1CN(C(=O)NCCNC(=O)c2cccnc2)CCO1	ZINC000875072108	GD	On-Demand	Anodyne	DRD2	20	53
COc1ccccc1[C@@H]1CN(C(=O)NCCNC(=O)c2cccnc2)CCO1	ZINC000875072108	GD	On-Demand	Anodyne	DRD4	42	32
COc1ccccc1[C@@H]1CN(C(=O)NCCNC(=O)c2cccnc2)CCO1	ZINC000875072108	GD	On-Demand	Anodyne	DRD3	32	41
N#Cc1ccc(Cc2cnc(NC(=O)c3ccc(N4CCOCC4)nc3)s2)cc1	ZINC000875072140	HG	On-Demand	Mild	ITK	17	40
N#Cc1ccc(Cc2cnc(NC(=O)c3ccc(N4CCOCC4)nc3)s2)cc1	ZINC000875072140	HG	On-Demand	Mild	HDAC1	17	40
N#Cc1ccc(Cc2cnc(NC(=O)c3ccc(N4CCOCC4)nc3)s2)cc1	ZINC000875072140	HG	On-Demand	Mild	SCD1	37	40
N#Cc1ccc(Cc2cnc(NC(=O)c3ccc(N4CCOCC4)nc3)s2)cc1	ZINC000875072140	HG	On-Demand	Mild	SCD	30	40
N#Cc1ccc(Cc2cnc(NC(=O)c3ccc(N4CCOCC4)nc3)s2)cc1	ZINC000875072140	HG	On-Demand	Mild	HPGDS	15	42
O=C(Oc1ccc(C(F)(F)F)cc1)c1ccc(N2CCCC2=O)cc1	ZINC000875072152	EI	On-Demand	Anodyne	SRD5A1	21	53
O=C(Oc1ccc(C(F)(F)F)cc1)c1ccc(N2CCCC2=O)cc1	ZINC000875072152	EI	On-Demand	Anodyne	ACR	57	51
CN1CC[C@H]2CN(C(=O)C(=O)NCCN3CCN(c4ccccc4)CC3)CC[C@H]21	ZINC000875072158	GC	On-Demand	Anodyne	HTR1A	65	48
CN1CC[C@H]2CN(C(=O)C(=O)NCCN3CCN(c4ccccc4)CC3)CC[C@H]21	ZINC000875072158	GC	On-Demand	Anodyne	DRD2	58	49
CN1CC[C@H]2CN(C(=O)C(=O)NCCN3CCN(c4ccccc4)CC3)CC[C@H]21	ZINC000875072158	GC	On-Demand	Anodyne	DRD4	49	39
CN1CC[C@H]2CN(C(=O)C(=O)NCCN3CCN(c4ccccc4)CC3)CC[C@H]21	ZINC000875072158	GC	On-Demand	Anodyne	HTR2A	47	44
CN1CC[C@H]2CN(C(=O)C(=O)NCCN3CCN(c4ccccc4)CC3)CC[C@H]21	ZINC000875072158	GC	On-Demand	Anodyne	HTR2C	27	40
CN1CC[C@H]2CN(C(=O)C(=O)NCCN3CCN(c4ccccc4)CC3)CC[C@H]21	ZINC000875072158	GC	On-Demand	Anodyne	ADRA1A	18	41
CN1CC[C@H]2CN(C(=O)C(=O)NCCN3CCN(c4ccccc4)CC3)CC[C@H]21	ZINC000875072158	GC	On-Demand	Anodyne	DRD3	85	49
CN1CC[C@H]2CN(C(=O)C(=O)NCCN3CCN(c4ccccc4)CC3)CC[C@H]21	ZINC000875072158	GC	On-Demand	Anodyne	HTR7	59	43
CN1CC[C@H]2CN(C(=O)C(=O)NCCN3CCN(c4ccccc4)CC3)CC[C@H]21	ZINC000875072158	GC	On-Demand	Anodyne	PLD1	68	35
CN1CC[C@H]2CN(C(=O)C(=O)NCCN3CCN(c4ccccc4)CC3)CC[C@H]21	ZINC000875072158	GC	On-Demand	Anodyne	PLD2	73	35
CN1CC[C@H]2CN(C(=O)C(=O)NCCN3CCN(c4ccccc4)CC3)CC[C@@H]21	ZINC000875072160	GC	On-Demand	Anodyne	HTR1A	65	48
CN1CC[C@H]2CN(C(=O)C(=O)NCCN3CCN(c4ccccc4)CC3)CC[C@@H]21	ZINC000875072160	GC	On-Demand	Anodyne	DRD2	58	49
CN1CC[C@H]2CN(C(=O)C(=O)NCCN3CCN(c4ccccc4)CC3)CC[C@@H]21	ZINC000875072160	GC	On-Demand	Anodyne	DRD4	49	39
CN1CC[C@H]2CN(C(=O)C(=O)NCCN3CCN(c4ccccc4)CC3)CC[C@@H]21	ZINC000875072160	GC	On-Demand	Anodyne	HTR2A	47	44
CN1CC[C@H]2CN(C(=O)C(=O)NCCN3CCN(c4ccccc4)CC3)CC[C@@H]21	ZINC000875072160	GC	On-Demand	Anodyne	HTR2C	27	40
CN1CC[C@H]2CN(C(=O)C(=O)NCCN3CCN(c4ccccc4)CC3)CC[C@@H]21	ZINC000875072160	GC	On-Demand	Anodyne	ADRA1A	18	41
CN1CC[C@H]2CN(C(=O)C(=O)NCCN3CCN(c4ccccc4)CC3)CC[C@@H]21	ZINC000875072160	GC	On-Demand	Anodyne	DRD3	85	49
CN1CC[C@H]2CN(C(=O)C(=O)NCCN3CCN(c4ccccc4)CC3)CC[C@@H]21	ZINC000875072160	GC	On-Demand	Anodyne	HTR7	59	43
CN1CC[C@H]2CN(C(=O)C(=O)NCCN3CCN(c4ccccc4)CC3)CC[C@@H]21	ZINC000875072160	GC	On-Demand	Anodyne	PLD1	68	35
CN1CC[C@H]2CN(C(=O)C(=O)NCCN3CCN(c4ccccc4)CC3)CC[C@@H]21	ZINC000875072160	GC	On-Demand	Anodyne	PLD2	73	35
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCCc2cc(OC)ccc21	ZINC000875072194	FE	On-Demand	Anodyne	DRD4	42	32
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCCc2cc(OC)ccc21	ZINC000875072194	FE	On-Demand	Anodyne	NQO2	30	44
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCCc2cc(OC)ccc21	ZINC000875072194	FE	On-Demand	Anodyne	BDKRB1	47	43
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCCc2cc(OC)ccc21	ZINC000875072194	FE	On-Demand	Anodyne	MTNR1A	27	45
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCCc2cc(OC)ccc21	ZINC000875072196	FE	On-Demand	Anodyne	DRD4	42	32
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCCc2cc(OC)ccc21	ZINC000875072196	FE	On-Demand	Anodyne	NQO2	30	44
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCCc2cc(OC)ccc21	ZINC000875072196	FE	On-Demand	Anodyne	BDKRB1	47	43
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCCc2cc(OC)ccc21	ZINC000875072196	FE	On-Demand	Anodyne	MTNR1A	27	45
CC[C@H](C[C@H](C)O)NC(=O)NCCN1CCc2ccccc2C1	ZINC000875072208	DD	On-Demand	Anodyne	NOD2	41	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCCNC(=O)c1cccnc1)CC2	ZINC000875072212	GE	On-Demand	Anodyne	DRD4	45	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCCNC(=O)c1cccnc1)CC2	ZINC000875072212	GE	On-Demand	Anodyne	SLC18A2	45	32
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCCNC(=O)c1cccnc1)CC2	ZINC000875072212	GE	On-Demand	Anodyne	PTAFR	16	42
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCCNC(=O)c1cccnc1)CC2	ZINC000875072212	GE	On-Demand	Anodyne	HCRTR1	17	49
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCCNC(=O)c1cccnc1)CC2	ZINC000875072215	GE	On-Demand	Anodyne	DRD4	45	34
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCCNC(=O)c1cccnc1)CC2	ZINC000875072215	GE	On-Demand	Anodyne	SLC18A2	45	32
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCCNC(=O)c1cccnc1)CC2	ZINC000875072215	GE	On-Demand	Anodyne	PTAFR	16	42
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCCNC(=O)c1cccnc1)CC2	ZINC000875072215	GE	On-Demand	Anodyne	HCRTR1	17	49
CCC(CC)C(=O)N1CCC(NC(=O)C(=O)NCCC(C)(C)COC)CC1	ZINC000875072261	GD	On-Demand	Anodyne	EPHX2	16	40
O=C(NCCNC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1)c1cccnc1	ZINC000875072262	FD	On-Demand	Anodyne	TBXAS1	36	41
CN1CCN(C(=O)NCCNC(=O)c2cccnc2)Cc2cccnc21	ZINC000875072269	FC	On-Demand	Anodyne	DRD4	42	32
N#Cc1ccc(Cc2cnc(NC(=O)c3ccc(SC(F)F)cc3)s2)cc1	ZINC000875072305	HK	On-Demand	Mild	SCD1	40	41
N#Cc1ccc(Cc2cnc(NC(=O)c3ccc(SC(F)F)cc3)s2)cc1	ZINC000875072305	HK	On-Demand	Mild	SCD	34	41
Cn1nc(Cl)c(C(=O)Nc2ccccc2C(=O)N2CCCC2)c1Cl	ZINC000875072316	FG	On-Demand	Anodyne	EPHB3	47	34
Cn1nc(Cl)c(C(=O)Nc2ccccc2C(=O)N2CCCC2)c1Cl	ZINC000875072316	FG	On-Demand	Anodyne	NPSR1	17	53
Cn1nc(Cl)c(C(=O)Nc2ccccc2C(=O)N2CCCC2)c1Cl	ZINC000875072316	FG	On-Demand	Anodyne	G2YM83_BOTF4	60	35
N#CCc1ccsc1C(=O)Nc1ccccc1C(=O)N1CCCC1	ZINC000875072368	EG	On-Demand	Mild	NPSR1	16	48
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1cc(C)on1)CC2	ZINC000875072432	FD	On-Demand	Anodyne	SLC18A2	46	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1cc(C)on1)CC2	ZINC000875072433	FD	On-Demand	Anodyne	SLC18A2	46	34
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](c2ccccc2)C(C)(C)C)CC1	ZINC000875072435	EF	On-Demand	Anodyne	SFRP1	44	32
CC(=O)C1CCN(C(=O)C(=O)N[C@H](c2ccccc2)C(C)(C)C)CC1	ZINC000875072436	EF	On-Demand	Anodyne	SFRP1	44	32
O=C(NCCN1CCN(c2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875072470	FC	On-Demand	Anodyne	HTR1A	71	51
O=C(NCCN1CCN(c2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875072470	FC	On-Demand	Anodyne	DRD2	48	51
O=C(NCCN1CCN(c2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875072470	FC	On-Demand	Anodyne	DRD4	47	38
O=C(NCCN1CCN(c2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875072470	FC	On-Demand	Anodyne	ADRA1D	16	43
O=C(NCCN1CCN(c2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875072470	FC	On-Demand	Anodyne	HTR2A	43	45
O=C(NCCN1CCN(c2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875072470	FC	On-Demand	Anodyne	HTR2C	19	41
O=C(NCCN1CCN(c2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875072470	FC	On-Demand	Anodyne	ADRA1A	22	43
O=C(NCCN1CCN(c2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875072470	FC	On-Demand	Anodyne	ADRA1B	15	43
O=C(NCCN1CCN(c2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875072470	FC	On-Demand	Anodyne	DRD3	60	48
O=C(NCCN1CCN(c2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875072470	FC	On-Demand	Anodyne	HTR7	67	43
O=C(NCCN1CCN(c2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875072470	FC	On-Demand	Anodyne	PLD2	47	37
O=C(NCCN1CCN(c2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875072471	FC	On-Demand	Anodyne	HTR1A	71	51
O=C(NCCN1CCN(c2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875072471	FC	On-Demand	Anodyne	DRD2	48	51
O=C(NCCN1CCN(c2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875072471	FC	On-Demand	Anodyne	DRD4	47	38
O=C(NCCN1CCN(c2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875072471	FC	On-Demand	Anodyne	ADRA1D	16	43
O=C(NCCN1CCN(c2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875072471	FC	On-Demand	Anodyne	HTR2A	43	45
O=C(NCCN1CCN(c2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875072471	FC	On-Demand	Anodyne	HTR2C	19	41
O=C(NCCN1CCN(c2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875072471	FC	On-Demand	Anodyne	ADRA1A	22	43
O=C(NCCN1CCN(c2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875072471	FC	On-Demand	Anodyne	ADRA1B	15	43
O=C(NCCN1CCN(c2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875072471	FC	On-Demand	Anodyne	DRD3	60	48
O=C(NCCN1CCN(c2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875072471	FC	On-Demand	Anodyne	HTR7	67	43
O=C(NCCN1CCN(c2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875072471	FC	On-Demand	Anodyne	PLD2	47	37
C[C@@H](CNC(=O)N1CCC[C@H](C(C)(C)O)C1)N(C)c1ccccc1	ZINC000875072482	EF	On-Demand	Anodyne	AMY2	49	33
C[C@@H](CNC(=O)N1CCC[C@@H](C(C)(C)O)C1)N(C)c1ccccc1	ZINC000875072484	EF	On-Demand	Anodyne	AMY2	49	33
Cc1ccc(C(=O)Oc2ccc(C(F)(F)F)cc2)o1	ZINC000875072502	CH	On-Demand	Anodyne	PPARA	15	40
Cc1ccc(C(=O)Oc2ccc(C(F)(F)F)cc2)o1	ZINC000875072502	CH	On-Demand	Anodyne	PPARD	47	39
Cc1ccc(C(=O)Oc2ccc(C(F)(F)F)cc2)o1	ZINC000875072502	CH	On-Demand	Anodyne	ACR	20	44
COCC(C)(C)CCNC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072503	GD	On-Demand	Anodyne	HTR1A	100	53
COCC(C)(C)CCNC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072503	GD	On-Demand	Anodyne	DRD2	77	51
COCC(C)(C)CCNC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072503	GD	On-Demand	Anodyne	DRD4	61	53
COCC(C)(C)CCNC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072503	GD	On-Demand	Anodyne	ADRA1D	41	43
COCC(C)(C)CCNC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072503	GD	On-Demand	Anodyne	HTR2A	60	46
COCC(C)(C)CCNC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072503	GD	On-Demand	Anodyne	HTR2C	34	41
COCC(C)(C)CCNC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072503	GD	On-Demand	Anodyne	SLC6A4	16	40
COCC(C)(C)CCNC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072503	GD	On-Demand	Anodyne	ADRA1A	47	45
COCC(C)(C)CCNC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072503	GD	On-Demand	Anodyne	ADRA1B	28	45
COCC(C)(C)CCNC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072503	GD	On-Demand	Anodyne	DRD3	103	53
COCC(C)(C)CCNC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072503	GD	On-Demand	Anodyne	HTR4	24	42
COCC(C)(C)CCNC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072503	GD	On-Demand	Anodyne	HTR7	94	48
COCC(C)(C)CCNC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072503	GD	On-Demand	Anodyne	SIGMAR1	15	44
O=C(Oc1ccc(C(F)(F)F)cc1)c1cc([N+](=O)[O-])ccc1N1CCOCC1	ZINC000875072522	GH	On-Demand	Bother	SLC6A9	22	68
O=C(Oc1ccc(C(F)(F)F)cc1)c1cc([N+](=O)[O-])ccc1N1CCOCC1	ZINC000875072522	GH	On-Demand	Bother	LIPG	47	38
CC(C)(C)C[C@H](NC(=O)C(=O)N1CCC(CO)(CO)CC1)c1ccccc1	ZINC000875072570	GD	On-Demand	Anodyne	GHRHR	53	33
CC(C)(C)C[C@@H](NC(=O)C(=O)N1CCC(CO)(CO)CC1)c1ccccc1	ZINC000875072571	GD	On-Demand	Anodyne	GHRHR	53	33
C#CC[C@@H](COC)NC(=O)C(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000875072713	GC	On-Demand	Mild	HTR1A	34	49
C#CC[C@@H](COC)NC(=O)C(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000875072713	GC	On-Demand	Mild	DRD2	31	47
C#CC[C@@H](COC)NC(=O)C(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000875072713	GC	On-Demand	Mild	DRD4	48	39
C#CC[C@@H](COC)NC(=O)C(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000875072713	GC	On-Demand	Mild	HTR2A	18	41
C#CC[C@@H](COC)NC(=O)C(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000875072713	GC	On-Demand	Mild	DRD3	49	39
C#CC[C@@H](COC)NC(=O)C(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000875072713	GC	On-Demand	Mild	HTR7	26	41
C#CC[C@@H](COC)NC(=O)C(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000875072713	GC	On-Demand	Mild	PLD2	46	32
C#CC[C@H](COC)NC(=O)C(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000875072714	GC	On-Demand	Mild	HTR1A	34	49
C#CC[C@H](COC)NC(=O)C(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000875072714	GC	On-Demand	Mild	DRD2	31	47
C#CC[C@H](COC)NC(=O)C(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000875072714	GC	On-Demand	Mild	DRD4	48	39
C#CC[C@H](COC)NC(=O)C(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000875072714	GC	On-Demand	Mild	HTR2A	18	41
C#CC[C@H](COC)NC(=O)C(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000875072714	GC	On-Demand	Mild	DRD3	49	39
C#CC[C@H](COC)NC(=O)C(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000875072714	GC	On-Demand	Mild	HTR7	26	41
C#CC[C@H](COC)NC(=O)C(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000875072714	GC	On-Demand	Mild	PLD2	46	32
CCCCCCCNC(=O)C(=O)NCc1ccc(C)nc1	ZINC000875072739	CE	On-Demand	Mild	LPAR2	46	36
CCCCCCCNC(=O)C(=O)NCc1ccc(C)nc1	ZINC000875072739	CE	On-Demand	Mild	S1PR2	63	37
CCCCCCCNC(=O)C(=O)NCc1ccc(C)nc1	ZINC000875072739	CE	On-Demand	Mild	ASAH1	86	36
C#CC[C@H](CCOC)NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072751	GC	On-Demand	Mild	HTR1A	74	50
C#CC[C@H](CCOC)NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072751	GC	On-Demand	Mild	DRD2	62	48
C#CC[C@H](CCOC)NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072751	GC	On-Demand	Mild	DRD4	53	42
C#CC[C@H](CCOC)NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072751	GC	On-Demand	Mild	HTR2A	44	41
C#CC[C@H](CCOC)NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072751	GC	On-Demand	Mild	ADRA1A	28	42
C#CC[C@H](CCOC)NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072751	GC	On-Demand	Mild	ADRA1B	17	42
C#CC[C@H](CCOC)NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072751	GC	On-Demand	Mild	DRD3	90	50
C#CC[C@H](CCOC)NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072751	GC	On-Demand	Mild	HTR7	61	41
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072753	GC	On-Demand	Mild	HTR1A	74	50
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072753	GC	On-Demand	Mild	DRD2	62	48
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072753	GC	On-Demand	Mild	DRD4	53	42
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072753	GC	On-Demand	Mild	HTR2A	44	41
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072753	GC	On-Demand	Mild	ADRA1A	28	42
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072753	GC	On-Demand	Mild	ADRA1B	17	42
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072753	GC	On-Demand	Mild	DRD3	90	50
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072753	GC	On-Demand	Mild	HTR7	61	41
C#CC[C@@H](COC)NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072756	FC	On-Demand	Mild	HTR1A	73	48
C#CC[C@@H](COC)NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072756	FC	On-Demand	Mild	DRD2	57	46
C#CC[C@@H](COC)NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072756	FC	On-Demand	Mild	DRD4	51	41
C#CC[C@@H](COC)NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072756	FC	On-Demand	Mild	HTR2A	40	40
C#CC[C@@H](COC)NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072756	FC	On-Demand	Mild	ADRA1A	28	43
C#CC[C@@H](COC)NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072756	FC	On-Demand	Mild	ADRA1B	19	43
C#CC[C@@H](COC)NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072756	FC	On-Demand	Mild	DRD3	79	48
C#CC[C@@H](COC)NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072756	FC	On-Demand	Mild	HTR7	65	41
C#CC[C@H](COC)NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072759	FC	On-Demand	Mild	HTR1A	73	48
C#CC[C@H](COC)NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072759	FC	On-Demand	Mild	DRD2	57	46
C#CC[C@H](COC)NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072759	FC	On-Demand	Mild	DRD4	51	41
C#CC[C@H](COC)NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072759	FC	On-Demand	Mild	HTR2A	40	40
C#CC[C@H](COC)NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072759	FC	On-Demand	Mild	ADRA1A	28	43
C#CC[C@H](COC)NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072759	FC	On-Demand	Mild	ADRA1B	19	43
C#CC[C@H](COC)NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072759	FC	On-Demand	Mild	DRD3	79	48
C#CC[C@H](COC)NC(=O)C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875072759	FC	On-Demand	Mild	HTR7	65	41
CC(=O)C1CCN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875072761	GC	On-Demand	Anodyne	HTR1A	80	54
CC(=O)C1CCN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875072761	GC	On-Demand	Anodyne	DRD2	62	50
CC(=O)C1CCN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875072761	GC	On-Demand	Anodyne	DRD4	50	39
CC(=O)C1CCN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875072761	GC	On-Demand	Anodyne	ADRA1D	23	42
CC(=O)C1CCN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875072761	GC	On-Demand	Anodyne	HTR2A	55	48
CC(=O)C1CCN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875072761	GC	On-Demand	Anodyne	HTR2C	29	41
CC(=O)C1CCN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875072761	GC	On-Demand	Anodyne	ADRA1A	25	44
CC(=O)C1CCN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875072761	GC	On-Demand	Anodyne	DRD3	85	49
CC(=O)C1CCN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875072761	GC	On-Demand	Anodyne	HTR4	26	41
CC(=O)C1CCN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875072761	GC	On-Demand	Anodyne	HTR7	79	45
CC(=O)C1CCN(C(=O)C(=O)NCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875072761	GC	On-Demand	Anodyne	PLD2	47	38
Cc1cccc(CNC(=O)C(=O)NCCCCC2CC2)n1	ZINC000875072784	CD	On-Demand	Anodyne	PDE8B	42	37
O=C(Cn1c(C(F)(F)F)nc2ccccc21)Oc1ccc(C(F)(F)F)cc1	ZINC000875072785	GJ	On-Demand	Anodyne	IMDH_CRYPV	26	47
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCC2CCCC2)C1	ZINC000875072794	DD	On-Demand	Anodyne	BMP1	45	38
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCC2CCCC2)C1	ZINC000875072795	DD	On-Demand	Anodyne	BMP1	45	38
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccc(C)nc3)CC2)c(OC)c1	ZINC000875072804	GD	On-Demand	Clean	HTR1A	32	40
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccc(C)nc3)CC2)c(OC)c1	ZINC000875072804	GD	On-Demand	Clean	ADRA1D	20	40
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccc(C)nc3)CC2)c(OC)c1	ZINC000875072804	GD	On-Demand	Clean	ADRA1A	21	40
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccc(C)nc3)CC2)c(OC)c1	ZINC000875072804	GD	On-Demand	Clean	DRD3	40	39
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccc(C)nc3)CC2)c(OC)c1	ZINC000875072804	GD	On-Demand	Clean	PDGFRB	52	42
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccc(C)nc3)CC2)c(OC)c1	ZINC000875072804	GD	On-Demand	Clean	HTR7	29	40
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CN(C(=O)C(=O)NCc1ccoc1)C2	ZINC000875072825	FD	On-Demand	Anodyne	GPR119	20	40
NC(=O)CCOC(=O)CCSc1nc2ccccc2s1	ZINC000875072834	DE	On-Demand	Anodyne	HMOX2	32	44
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NCc3ccc(C)nc3)C2)c1	ZINC000875072850	GD	On-Demand	Anodyne	DRD4	21	41
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NCc3ccc(C)nc3)C2)c1	ZINC000875072851	GD	On-Demand	Anodyne	DRD4	21	41
COc1ccc(N2CCN(C(=O)C(=O)NCc3cccc(C)n3)CC2)c(OC)c1	ZINC000875072854	GD	On-Demand	Clean	HTR1A	47	41
COc1ccc(N2CCN(C(=O)C(=O)NCc3cccc(C)n3)CC2)c(OC)c1	ZINC000875072854	GD	On-Demand	Clean	DRD2	39	40
COc1ccc(N2CCN(C(=O)C(=O)NCc3cccc(C)n3)CC2)c(OC)c1	ZINC000875072854	GD	On-Demand	Clean	DRD4	44	35
COc1ccc(N2CCN(C(=O)C(=O)NCc3cccc(C)n3)CC2)c(OC)c1	ZINC000875072854	GD	On-Demand	Clean	HTR2A	15	41
COc1ccc(N2CCN(C(=O)C(=O)NCc3cccc(C)n3)CC2)c(OC)c1	ZINC000875072854	GD	On-Demand	Clean	DRD3	59	41
COc1ccc(N2CCN(C(=O)C(=O)NCc3cccc(C)n3)CC2)c(OC)c1	ZINC000875072854	GD	On-Demand	Clean	HTR7	40	39
CN1CCN(C(=O)N[C@H](CN2CCCC2=O)c2ccccc2)CCC1(C)C	ZINC000875072881	FE	On-Demand	Anodyne	CACNA1H	23	40
CN1CCN(C(=O)N[C@@H](CN2CCCC2=O)c2ccccc2)CCC1(C)C	ZINC000875072882	FE	On-Demand	Anodyne	CACNA1H	23	40
N#Cc1ccc(Cn2cc(NC(=O)NCCCOCC(F)(F)F)cn2)cc1	ZINC000875072885	GF	On-Demand	Mild	ITK	16	51
N#Cc1ccc(Cn2cc(NC(=O)NCCCOCC(F)(F)F)cn2)cc1	ZINC000875072885	GF	On-Demand	Mild	PANC	55	38
O=C(NCCO)C1CCN(C(=O)NCCCN2CCc3ccccc3C2)CC1	ZINC000875072942	GC	On-Demand	Anodyne	HTR7	25	47
O=C(NCCCN1CCc2ccccc2C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875072950	GF	On-Demand	Anodyne	HTR7	18	44
O=C(NCCCN1CCc2ccccc2C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875072951	GF	On-Demand	Anodyne	HTR7	18	44
Cc1cccc(CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)n1	ZINC000875072957	DC	On-Demand	Anodyne	PDE8B	48	38
Cc1cccc(CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)n1	ZINC000875072958	DC	On-Demand	Anodyne	PDE8B	48	38
C[C@H](NC(=O)C(=O)NCCCC1CCCCC1)c1ccnn1C	ZINC000875072978	DE	On-Demand	Anodyne	BMP1	81	37
Cc1ccc(CNC(=O)C(=O)N2CCN(C)c3ncccc3C2)cn1	ZINC000875073023	EC	On-Demand	Anodyne	NAMPT	24	41
Cc1cccc(CNC(=O)C(=O)NCC[C@@H]2CCSC2)n1	ZINC000875073024	DD	On-Demand	Anodyne	PDE8B	40	36
Cc1cccc(CNC(=O)C(=O)NCC[C@H]2CCSC2)n1	ZINC000875073025	DD	On-Demand	Anodyne	PDE8B	40	36
Cc1cccc(CNC(=O)C(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)n1	ZINC000875073038	FC	On-Demand	Anodyne	PDE8B	47	38
O=C(NCCCCCCc1ccccc1)C(=O)NCc1ccoc1	ZINC000875073039	EF	On-Demand	Anodyne	SIGMAR1	18	44
O=C(NCCCCCCc1ccccc1)C(=O)NCc1ccoc1	ZINC000875073039	EF	On-Demand	Anodyne	SCN2A	16	41
O=C(NCCCCCCc1ccccc1)C(=O)NCc1ccoc1	ZINC000875073039	EF	On-Demand	Anodyne	FAAH	68	45
O=C(NCCCCCCc1ccccc1)C(=O)NCc1ccoc1	ZINC000875073039	EF	On-Demand	Anodyne	S1PR2	16	41
O=C(NCCCCCCc1ccccc1)C(=O)NCc1ccoc1	ZINC000875073039	EF	On-Demand	Anodyne	SLC6A5	22	40
O=C(NCCCCCCc1ccccc1)C(=O)NCc1ccoc1	ZINC000875073039	EF	On-Demand	Anodyne	CES1	71	38
O=C(NCCCCCCc1ccccc1)C(=O)NCc1ccoc1	ZINC000875073039	EF	On-Demand	Anodyne	AMP1_PLAFQ	42	47
O=C(NCCCC1CCCCC1)C(=O)NCc1ncc(Cl)s1	ZINC000875073050	EF	On-Demand	Anodyne	BMP1	63	35
COc1ccc(N2CCN(C(=O)C(=O)NCC3CCOCC3)CC2)c(OC)c1	ZINC000875073071	GC	On-Demand	Clean	DRD2	31	40
COc1ccc(N2CCN(C(=O)C(=O)NCC3CCOCC3)CC2)c(OC)c1	ZINC000875073071	GC	On-Demand	Clean	DRD4	42	32
COc1ccc(N2CCN(C(=O)C(=O)NCC3CCOCC3)CC2)c(OC)c1	ZINC000875073071	GC	On-Demand	Clean	DRD3	42	37
COc1ccc(N2CCN(C(=O)C(=O)NCC3CCOCC3)CC2)c(OC)c1	ZINC000875073071	GC	On-Demand	Clean	MTNR1B	27	41
C[C@H](CN1CCOCC1)NC(=O)N1Cc2cccc(O)c2C1	ZINC000875073100	DD	On-Demand	Clean	PLD1	43	34
CCCCCCCNC(=O)C(=O)NCc1cc(C)on1	ZINC000875073115	CD	On-Demand	Mild	ASAH1	86	35
O=C(NCCCN1CCc2ccccc2C1)N1CCC(CO)(CO)CC1	ZINC000875073134	FD	On-Demand	Anodyne	DRD3	21	54
O=C(NCCCN1CCc2ccccc2C1)N1CCC(CO)(CO)CC1	ZINC000875073134	FD	On-Demand	Anodyne	HTR7	24	53
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCN3CCc4ccccc4C3)C[C@@H]1C2	ZINC000875073172	FE	On-Demand	Anodyne	HTR1A	15	40
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCN3CCc4ccccc4C3)C[C@@H]1C2	ZINC000875073172	FE	On-Demand	Anodyne	DRD3	23	44
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCN3CCc4ccccc4C3)C[C@@H]1C2	ZINC000875073172	FE	On-Demand	Anodyne	HTR7	18	43
CN(C)S(=O)(=O)c1ccc2c(c1)CCCN2C(=O)Cc1ccc(Cl)cn1	ZINC000875073209	GF	On-Demand	Anodyne	EIF2AK3	57	33
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)C1	ZINC000875073213	GD	On-Demand	Clean	STAT6	47	34
Cc1ccc(CNC(=O)C(=O)NC[C@H]2CN(Cc3ccccc3C)CCO2)cn1	ZINC000875073219	GD	On-Demand	Anodyne	DRD4	15	42
Cc1ccc(CNC(=O)C(=O)NC[C@@H]2CN(Cc3ccccc3C)CCO2)cn1	ZINC000875073220	GD	On-Demand	Anodyne	DRD4	15	42
Cn1nccc1C(NC(=O)C(=O)NCCCC1CCCC1)c1ccnn1C	ZINC000875073229	FD	On-Demand	Anodyne	BMP1	78	37
COc1ccccc1[C@H]1CCCN(C(=O)NCC(=O)N2CCCCC2)CC1	ZINC000875073241	FF	On-Demand	Anodyne	HTR1A	22	43
COc1ccccc1[C@H]1CCCN(C(=O)NCC(=O)N2CCCCC2)CC1	ZINC000875073241	FF	On-Demand	Anodyne	DRD2	23	46
COc1ccccc1[C@H]1CCCN(C(=O)NCC(=O)N2CCCCC2)CC1	ZINC000875073241	FF	On-Demand	Anodyne	RBP4	38	41
COc1ccccc1[C@H]1CCCN(C(=O)NCC(=O)N2CCCCC2)CC1	ZINC000875073241	FF	On-Demand	Anodyne	ACKR3	42	32
COc1ccccc1[C@@H]1CCCN(C(=O)NCC(=O)N2CCCCC2)CC1	ZINC000875073244	FF	On-Demand	Anodyne	HTR1A	22	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCC(=O)N2CCCCC2)CC1	ZINC000875073244	FF	On-Demand	Anodyne	DRD2	23	46
COc1ccccc1[C@@H]1CCCN(C(=O)NCC(=O)N2CCCCC2)CC1	ZINC000875073244	FF	On-Demand	Anodyne	RBP4	38	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCC(=O)N2CCCCC2)CC1	ZINC000875073244	FF	On-Demand	Anodyne	ACKR3	42	32
Cc1ccc(CNC(=O)C(=O)N2CCN(c3ccc(F)cc3C#N)CC2)cn1	ZINC000875073257	GD	On-Demand	Mild	P2RY12	15	43
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(C)n2)CC1	ZINC000875073279	DC	On-Demand	Anodyne	PDE8B	47	38
O=C(NCCCC1CCCC1)C(=O)NCc1ccc(Br)cn1	ZINC000875073298	FF	On-Demand	Anodyne	BMP1	70	40
Cc1cccc(CNC(=O)C(=O)NC[C@H]2CCN2C2CCCCCC2)n1	ZINC000875073302	FD	On-Demand	Anodyne	PDE8B	47	38
Cc1cccc(CNC(=O)C(=O)NC[C@@H]2CCN2C2CCCCCC2)n1	ZINC000875073303	FD	On-Demand	Anodyne	PDE8B	47	38
COC(=O)N(C)NC(=O)NCCCN1CCc2ccccc21	ZINC000875073308	DD	On-Demand	Reactive	DRD3	44	37
O=C(NCCCC1CCCC1)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875073321	FF	On-Demand	Anodyne	BMP1	64	42
Cc1cccc(CNC(=O)C(=O)N2CC[C@@H](C(F)(F)F)O[C@@H](C)C2)n1	ZINC000875073325	FD	On-Demand	Anodyne	PDE8B	40	35
Cc1cccc(CNC(=O)C(=O)N2CC[C@H](C(F)(F)F)O[C@H](C)C2)n1	ZINC000875073326	FD	On-Demand	Anodyne	PDE8B	40	35
Cc1cccc(CNC(=O)C(=O)N2CC[C@H](C(F)(F)F)O[C@@H](C)C2)n1	ZINC000875073327	FD	On-Demand	Anodyne	PDE8B	40	35
Cc1cccc(CNC(=O)C(=O)N2CC[C@@H](C(F)(F)F)O[C@H](C)C2)n1	ZINC000875073328	FD	On-Demand	Anodyne	PDE8B	40	35
COC[C@H](NC(=O)C(=O)NCc1ccoc1)c1cccc(Br)c1	ZINC000875073330	GE	On-Demand	Anodyne	PDS	45	39
COC[C@@H](NC(=O)C(=O)NCc1ccoc1)c1cccc(Br)c1	ZINC000875073331	GE	On-Demand	Anodyne	PDS	45	39
C[C@H](NC(=O)C(=O)NCCCC1CCCC1)c1ccc(C(F)(F)F)nc1	ZINC000875073347	FG	On-Demand	Anodyne	BMP1	52	33
C[C@H](NC(=O)C(=O)NCCCC1CCCC1)c1ccc(C(F)(F)F)nc1	ZINC000875073347	FG	On-Demand	Anodyne	TRPV1	72	39
O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCc1cccc2[nH]ccc12	ZINC000875073356	GD	On-Demand	Clean	ATR	42	41
O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCc1cccc2[nH]ccc12	ZINC000875073356	GD	On-Demand	Clean	STAT6	41	34
CCCCCCCNC(=O)C(=O)NCC1CCOCC1	ZINC000875073360	CD	On-Demand	Mild	EPHX2	15	43
CCCCCCCNC(=O)C(=O)NCC1CCOCC1	ZINC000875073360	CD	On-Demand	Mild	ASAH1	65	39
CCCCCCCNC(=O)C(=O)NCC1CCOCC1	ZINC000875073360	CD	On-Demand	Mild	LASR	40	34
CC(C)(C)OC(=O)N1CCC(CNC(=O)C(=O)N2CCC(CCF)CC2)CC1	ZINC000875073366	GE	On-Demand	Anodyne	CACNA1I	49	36
CC(C)(C)OC(=O)N1CCC(CNC(=O)C(=O)N2CCC(CCF)CC2)CC1	ZINC000875073366	GE	On-Demand	Anodyne	GPR119	35	44
O=C(CNC(=O)N1CCC[C@@](O)(c2ccccc2)C1)N1CCCCC1	ZINC000875073371	ED	On-Demand	Anodyne	PREP	16	45
O=C(CNC(=O)N1CCC[C@@](O)(c2ccccc2)C1)N1CCCCC1	ZINC000875073371	ED	On-Demand	Anodyne	EPHX2	15	47
O=C(CNC(=O)N1CCC[C@](O)(c2ccccc2)C1)N1CCCCC1	ZINC000875073372	ED	On-Demand	Anodyne	PREP	16	45
O=C(CNC(=O)N1CCC[C@](O)(c2ccccc2)C1)N1CCCCC1	ZINC000875073372	ED	On-Demand	Anodyne	EPHX2	15	47
O=C(N[C@@H](CN1CCCC1)c1ccccc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875073373	GG	On-Demand	Anodyne	CCR5	17	42
O=C(N[C@H](CN1CCCC1)c1ccccc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875073374	GG	On-Demand	Anodyne	CCR5	17	42
O=C(N[C@@H](CN1CCCC1)c1ccccc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875073375	GG	On-Demand	Anodyne	CCR5	17	42
O=C(N[C@H](CN1CCCC1)c1ccccc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875073376	GG	On-Demand	Anodyne	CCR5	17	42
C[C@H](CN1CCOCC1)NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875073380	FD	On-Demand	Mild	ITK	15	47
CC(=O)C1CCN(C(=O)C(=O)NCc2ccccc2N2CCCCC2)CC1	ZINC000875073383	FE	On-Demand	Anodyne	MC4R	18	41
CC(=O)C1CCN(C(=O)C(=O)NCc2ccccc2N2CCCCC2)CC1	ZINC000875073383	FE	On-Demand	Anodyne	KCNQ2	74	40
CC(=O)C1CCN(C(=O)C(=O)NCc2ccccc2N2CCCCC2)CC1	ZINC000875073383	FE	On-Demand	Anodyne	SCN2A	19	45
CC(=O)C1CCN(C(=O)C(=O)NCc2ccccc2N2CCCCC2)CC1	ZINC000875073383	FE	On-Demand	Anodyne	SCN10A	15	45
C#CC[C@@H](COC)NC(=O)C(=O)NCc1ccccc1N1CCCCC1	ZINC000875073384	FD	On-Demand	Mild	KCNQ2	69	37
C#CC[C@@H](COC)NC(=O)C(=O)NCc1ccccc1N1CCCCC1	ZINC000875073384	FD	On-Demand	Mild	SCN2A	17	40
C#CC[C@H](COC)NC(=O)C(=O)NCc1ccccc1N1CCCCC1	ZINC000875073385	FD	On-Demand	Mild	KCNQ2	69	37
C#CC[C@H](COC)NC(=O)C(=O)NCc1ccccc1N1CCCCC1	ZINC000875073385	FD	On-Demand	Mild	SCN2A	17	40
C=CCc1cc([N+](=O)[O-])ccc1OC(=O)[C@H]1CCCN1C(C)=O	ZINC000875073394	DE	On-Demand	Reactive	LGMN	44	31
Cc1ccc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)o1	ZINC000875073401	FD	On-Demand	Clean	STAT6	51	35
Cc1nnc(NNC(=O)N[C@@H](CN2CCCC2)c2ccccc2)n1C	ZINC000875073406	ED	On-Demand	Reactive	CCR5	25	44
Cc1nnc(NNC(=O)N[C@H](CN2CCCC2)c2ccccc2)n1C	ZINC000875073407	ED	On-Demand	Reactive	CCR5	25	44
O=C(CNC(=O)N1Cc2cccc(O)c2C1)N1CCCCC1	ZINC000875073408	DD	On-Demand	Clean	PREP	29	57
COCC(C)(C)CCNC(=O)C(=O)NCc1ccccc1N1CCCCC1	ZINC000875073410	GE	On-Demand	Anodyne	KCNQ2	73	41
COCC(C)(C)CCNC(=O)C(=O)NCc1ccccc1N1CCCCC1	ZINC000875073410	GE	On-Demand	Anodyne	SCN2A	18	44
COCC(C)(C)CCNC(=O)C(=O)NCc1ccccc1N1CCCCC1	ZINC000875073410	GE	On-Demand	Anodyne	SCN10A	15	44
C[C@H](CN1CCOCC1)NC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875073417	FE	On-Demand	Anodyne	CASR	48	36
C[C@H](CN1CCOCC1)NC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875073418	FE	On-Demand	Anodyne	CASR	48	36
C[C@H](CN1CCOCC1)NC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875073419	FE	On-Demand	Anodyne	CASR	48	36
C[C@H](CN1CCOCC1)NC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875073420	FE	On-Demand	Anodyne	CASR	48	36
O=C(NCC[C@H]1CCSC1)C(=O)NCc1ccccc1N1CCCCC1	ZINC000875073423	GF	On-Demand	Anodyne	KCNQ2	63	38
O=C(NCC[C@H]1CCSC1)C(=O)NCc1ccccc1N1CCCCC1	ZINC000875073423	GF	On-Demand	Anodyne	SCN2A	17	41
O=C(NCC[C@@H]1CCSC1)C(=O)NCc1ccccc1N1CCCCC1	ZINC000875073424	GF	On-Demand	Anodyne	KCNQ2	63	38
O=C(NCC[C@@H]1CCSC1)C(=O)NCc1ccccc1N1CCCCC1	ZINC000875073424	GF	On-Demand	Anodyne	SCN2A	17	41
CCC(F)(F)C(C)(C)CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1	ZINC000875073455	GE	On-Demand	Clean	STAT6	55	36
O=C(NCc1ccccc1N1CCCCC1)C(=O)N[C@H]1CC12CCC2	ZINC000875073465	EE	On-Demand	Anodyne	KCNQ2	68	40
O=C(NCc1ccccc1N1CCCCC1)C(=O)N[C@H]1CC12CCC2	ZINC000875073465	EE	On-Demand	Anodyne	SCN2A	18	43
O=C(NCc1ccccc1N1CCCCC1)C(=O)N[C@H]1CC12CCC2	ZINC000875073465	EE	On-Demand	Anodyne	SCN10A	15	43
O=C(NCc1ccccc1N1CCCCC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875073466	EE	On-Demand	Anodyne	KCNQ2	68	40
O=C(NCc1ccccc1N1CCCCC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875073466	EE	On-Demand	Anodyne	SCN2A	18	43
O=C(NCc1ccccc1N1CCCCC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875073466	EE	On-Demand	Anodyne	SCN10A	15	43
O=C(NCCCOCC(F)(F)F)NC1CC(Nc2ccccc2)C1	ZINC000875073478	EF	On-Demand	Anodyne	EPHX2	28	43
O=C(NCCCOCC(F)(F)F)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875073486	FF	On-Demand	Anodyne	EPHX2	22	44
O=C(NCCCOCC(F)(F)F)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875073487	FF	On-Demand	Anodyne	EPHX2	22	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCN1CCc2ccccc2C1	ZINC000875073503	FE	On-Demand	Anodyne	HTR1A	18	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCN1CCc2ccccc2C1	ZINC000875073503	FE	On-Demand	Anodyne	DRD2	17	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCN1CCc2ccccc2C1	ZINC000875073503	FE	On-Demand	Anodyne	DRD3	28	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCN1CCc2ccccc2C1	ZINC000875073503	FE	On-Demand	Anodyne	SLC6A3	44	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCN1CCc2ccccc2C1	ZINC000875073503	FE	On-Demand	Anodyne	HTR7	23	43
Cc1nnc(NNC(=O)NCCCN2CCc3ccccc3C2)n1C	ZINC000875073510	ED	On-Demand	Reactive	HTR1A	15	41
Cc1nnc(NNC(=O)NCCCN2CCc3ccccc3C2)n1C	ZINC000875073510	ED	On-Demand	Reactive	DRD2	17	41
Cc1nnc(NNC(=O)NCCCN2CCc3ccccc3C2)n1C	ZINC000875073510	ED	On-Demand	Reactive	DRD3	29	49
Cc1nnc(NNC(=O)NCCCN2CCc3ccccc3C2)n1C	ZINC000875073510	ED	On-Demand	Reactive	HTR7	18	46
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)cn1	ZINC000875073517	GE	On-Demand	Anodyne	DRD2	24	42
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)cn1	ZINC000875073517	GE	On-Demand	Anodyne	DRD4	54	44
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)cn1	ZINC000875073517	GE	On-Demand	Anodyne	ACHE	66	58
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)cn1	ZINC000875073517	GE	On-Demand	Anodyne	DRD3	21	44
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)cn1	ZINC000875073517	GE	On-Demand	Anodyne	HTR4	30	43
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)cn1	ZINC000875073517	GE	On-Demand	Anodyne	HRH3	16	41
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)cn1	ZINC000875073517	GE	On-Demand	Anodyne	SIGMAR1	55	53
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)cn1	ZINC000875073517	GE	On-Demand	Anodyne	SSTR5	46	36
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)cn1	ZINC000875073517	GE	On-Demand	Anodyne	BCHE	21	47
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)cn1	ZINC000875073517	GE	On-Demand	Anodyne	CCR3	41	39
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)cn1	ZINC000875073517	GE	On-Demand	Anodyne	FAAH	15	45
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)cn1	ZINC000875073517	GE	On-Demand	Anodyne	CXCR3	29	42
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)cn1	ZINC000875073517	GE	On-Demand	Anodyne	MCHR1	35	44
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)cn1	ZINC000875073517	GE	On-Demand	Anodyne	CACNA1G	37	42
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)cn1	ZINC000875073517	GE	On-Demand	Anodyne	SIRT3	52	33
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)cn1	ZINC000875073517	GE	On-Demand	Anodyne	SIRT2	54	33
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)cn1	ZINC000875073517	GE	On-Demand	Anodyne	SIRT1	52	37
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)cn1	ZINC000875073517	GE	On-Demand	Anodyne	NAMPT	29	41
Cc1cccc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)n1	ZINC000875073519	ED	On-Demand	Anodyne	PDE8B	41	36
Cc1cccc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)n1	ZINC000875073519	ED	On-Demand	Anodyne	SIRT3	53	34
Cc1cccc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)n1	ZINC000875073519	ED	On-Demand	Anodyne	SIRT2	53	34
Cc1cccc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)n1	ZINC000875073519	ED	On-Demand	Anodyne	SIRT1	53	34
CC(=O)C1CCN(C(=O)C(=O)N[C@H](CC(C)(C)C)c2ccccc2)CC1	ZINC000875073522	FG	On-Demand	Anodyne	CCR5	26	44
CC(=O)C1CCN(C(=O)C(=O)N[C@H](CC(C)(C)C)c2ccccc2)CC1	ZINC000875073522	FG	On-Demand	Anodyne	SFRP1	67	34
CC(=O)C1CCN(C(=O)C(=O)N[C@H](CC(C)(C)C)c2ccccc2)CC1	ZINC000875073522	FG	On-Demand	Anodyne	WNT3	51	34
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](CC(C)(C)C)c2ccccc2)CC1	ZINC000875073524	FG	On-Demand	Anodyne	CCR5	26	44
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](CC(C)(C)C)c2ccccc2)CC1	ZINC000875073524	FG	On-Demand	Anodyne	SFRP1	67	34
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](CC(C)(C)C)c2ccccc2)CC1	ZINC000875073524	FG	On-Demand	Anodyne	WNT3	51	34
CN1CCN(C2CCN(C(=O)C(=O)NCCCC3CCCCC3)CC2)CC1	ZINC000875073525	GD	On-Demand	Anodyne	L3MBTL3	42	39
Cc1ccc(CNC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)cn1	ZINC000875073528	FE	On-Demand	Anodyne	NAMPT	53	38
Cc1ccc(CNC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)cn1	ZINC000875073530	FE	On-Demand	Anodyne	NAMPT	53	38
Cc1cccc(CNC(=O)C(=O)N[C@H](C)c2ccc(C(F)(F)F)nc2)n1	ZINC000875073548	FE	On-Demand	Anodyne	TRPV1	46	31
Cc1cccc(CNC(=O)C(=O)N[C@@H](C)c2ccc(C(F)(F)F)nc2)n1	ZINC000875073549	FE	On-Demand	Anodyne	TRPV1	46	31
CN1CCN(C2CCN(C(=O)C(=O)NCCCC3CCCC3)CC2)CC1	ZINC000875073591	FD	On-Demand	Anodyne	L3MBTL3	45	40
Cc1cccc(CNC(=O)C(=O)NC[C@H]2c3ccccc3CN2C)n1	ZINC000875073623	ED	On-Demand	Anodyne	PDE8B	48	49
Cc1cccc(CNC(=O)C(=O)NC[C@@H]2c3ccccc3CN2C)n1	ZINC000875073624	ED	On-Demand	Anodyne	PDE8B	48	49
Cc1ccc(C(=O)Oc2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-]	ZINC000875073645	EI	On-Demand	Bother	LIPE	16	40
Cc1ccc(C(=O)Oc2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-]	ZINC000875073645	EI	On-Demand	Bother	ACR	36	45
O=C(NCCCC1CCCCC1)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875073653	GG	On-Demand	Anodyne	BMP1	77	43
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1ccc(C)nc1)CC2	ZINC000875073655	GE	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1ccc(C)nc1)CC2	ZINC000875073655	GE	On-Demand	Anodyne	HCRTR1	18	49
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1ccc(C)nc1)CC2	ZINC000875073655	GE	On-Demand	Anodyne	HCRTR2	16	44
O=C(NCc1ncc(Cl)s1)C(=O)NCc1ccccc1N1CCCCC1	ZINC000875073665	GF	On-Demand	Anodyne	KCNQ2	70	45
O=C(NCc1ncc(Cl)s1)C(=O)NCc1ccccc1N1CCCCC1	ZINC000875073665	GF	On-Demand	Anodyne	SCN2A	22	52
O=C(NCc1ncc(Cl)s1)C(=O)NCc1ccccc1N1CCCCC1	ZINC000875073665	GF	On-Demand	Anodyne	SCN10A	27	52
O=C(CSc1ccc(F)cc1)Oc1ccc(C(F)(F)F)cc1	ZINC000875073679	EJ	On-Demand	Anodyne	PPARD	30	43
CC(C)(C)OC(=O)N1CCC(CNC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)CC1	ZINC000875073690	GE	On-Demand	Anodyne	CACNA1I	48	35
CC(C)(C)OC(=O)N1CCC(CNC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)CC1	ZINC000875073690	GE	On-Demand	Anodyne	GPR119	34	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC1CCOCC1	ZINC000875073699	GD	On-Demand	Anodyne	CHRM2	18	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC1CCOCC1	ZINC000875073699	GD	On-Demand	Anodyne	DRD2	28	48
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC1CCOCC1	ZINC000875073699	GD	On-Demand	Anodyne	DRD4	53	48
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC1CCOCC1	ZINC000875073699	GD	On-Demand	Anodyne	ACHE	69	63
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC1CCOCC1	ZINC000875073699	GD	On-Demand	Anodyne	HRH1	19	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC1CCOCC1	ZINC000875073699	GD	On-Demand	Anodyne	DRD3	23	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC1CCOCC1	ZINC000875073699	GD	On-Demand	Anodyne	SLC6A3	20	50
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC1CCOCC1	ZINC000875073699	GD	On-Demand	Anodyne	HTR4	53	46
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC1CCOCC1	ZINC000875073699	GD	On-Demand	Anodyne	CHRM3	21	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC1CCOCC1	ZINC000875073699	GD	On-Demand	Anodyne	LTA4H	23	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC1CCOCC1	ZINC000875073699	GD	On-Demand	Anodyne	TACR2	29	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC1CCOCC1	ZINC000875073699	GD	On-Demand	Anodyne	SIGMAR1	76	46
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC1CCOCC1	ZINC000875073699	GD	On-Demand	Anodyne	BCHE	20	56
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC1CCOCC1	ZINC000875073699	GD	On-Demand	Anodyne	CCR3	37	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC1CCOCC1	ZINC000875073699	GD	On-Demand	Anodyne	MCHR1	29	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC1CCOCC1	ZINC000875073699	GD	On-Demand	Anodyne	CACNA1G	27	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC1CCOCC1	ZINC000875073699	GD	On-Demand	Anodyne	CACNA1I	68	44
O=C(CNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)N1CCCCC1	ZINC000875073706	FE	On-Demand	Anodyne	OPRL1	20	46
O=C(CNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)N1CCCCC1	ZINC000875073706	FE	On-Demand	Anodyne	PREP	34	42
O=C(CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)N1CCCCC1	ZINC000875073713	ED	On-Demand	Anodyne	ACE	38	41
O=C(CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)N1CCCCC1	ZINC000875073713	ED	On-Demand	Anodyne	DPP4	23	43
O=C(CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)N1CCCCC1	ZINC000875073713	ED	On-Demand	Anodyne	PREP	96	42
O=C(CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)N1CCCCC1	ZINC000875073713	ED	On-Demand	Anodyne	TMPRSS11D	45	31
O=C(CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)N1CCCCC1	ZINC000875073714	ED	On-Demand	Anodyne	ACE	38	41
O=C(CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)N1CCCCC1	ZINC000875073714	ED	On-Demand	Anodyne	DPP4	23	43
O=C(CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)N1CCCCC1	ZINC000875073714	ED	On-Demand	Anodyne	PREP	96	42
O=C(CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)N1CCCCC1	ZINC000875073714	ED	On-Demand	Anodyne	TMPRSS11D	45	31
O=C(CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)N1CCCCC1	ZINC000875073715	ED	On-Demand	Anodyne	ACE	38	41
O=C(CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)N1CCCCC1	ZINC000875073715	ED	On-Demand	Anodyne	DPP4	23	43
O=C(CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)N1CCCCC1	ZINC000875073715	ED	On-Demand	Anodyne	PREP	96	42
O=C(CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)N1CCCCC1	ZINC000875073715	ED	On-Demand	Anodyne	TMPRSS11D	45	31
O=C(CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)N1CCCCC1	ZINC000875073716	ED	On-Demand	Anodyne	ACE	38	41
O=C(CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)N1CCCCC1	ZINC000875073716	ED	On-Demand	Anodyne	DPP4	23	43
O=C(CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)N1CCCCC1	ZINC000875073716	ED	On-Demand	Anodyne	PREP	96	42
O=C(CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)N1CCCCC1	ZINC000875073716	ED	On-Demand	Anodyne	TMPRSS11D	45	31
COC(=O)N(C)NC(=O)N[C@@H](CN1CCCC1)c1ccccc1	ZINC000875073721	DD	On-Demand	Reactive	OPRK1	31	45
COC(=O)N(C)NC(=O)N[C@H](CN1CCCC1)c1ccccc1	ZINC000875073722	DD	On-Demand	Reactive	OPRK1	31	45
C[C@H](CN1CCOCC1)NC(=O)NNc1cccc(F)c1Cl	ZINC000875073746	ED	On-Demand	Reactive	PLD1	42	38
C[C@H](CN1CCOCC1)NC(=O)NNc1cccc(F)c1Cl	ZINC000875073746	ED	On-Demand	Reactive	PTGDS	24	41
CC(C)(C)OC(=O)N1CCC(CNC(=O)C(=O)NCC2CC=CC2)CC1	ZINC000875073748	FD	On-Demand	Anodyne	CACNA1I	58	38
CC(C)(C)OC(=O)N1CCC(CNC(=O)C(=O)NCC2CC=CC2)CC1	ZINC000875073748	FD	On-Demand	Anodyne	GPR119	49	46
COC(=O)C1(O)CN(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)C1	ZINC000875073749	EC	On-Demand	Anodyne	OPRK1	18	41
COC(=O)C1(O)CN(C(=O)N[C@H](CN2CCCC2)c2ccccc2)C1	ZINC000875073750	EC	On-Demand	Anodyne	OPRK1	18	41
O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCc1cccc(F)c1F	ZINC000875073751	GD	On-Demand	Clean	P2RX7	16	41
O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCc1cccc(F)c1F	ZINC000875073751	GD	On-Demand	Clean	STAT6	64	51
O=C(NCCCN1CCc2ccccc2C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875073773	FF	On-Demand	Anodyne	HTR7	22	48
NC(=O)CCOC(=O)c1cc(-c2ccccc2)[nH]n1	ZINC000875073784	CD	On-Demand	Anodyne	LTB4R	16	42
NC(=O)CCOC(=O)c1cc(-c2ccccc2)[nH]n1	ZINC000875073784	CD	On-Demand	Anodyne	PLA2G10	15	42
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1ccc(C)nc1)CC2	ZINC000875073791	GE	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1ccc(C)nc1)CC2	ZINC000875073791	GE	On-Demand	Anodyne	HCRTR1	18	49
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1ccc(C)nc1)CC2	ZINC000875073791	GE	On-Demand	Anodyne	HCRTR2	16	44
C[C@@H](Cn1cccn1)NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875073814	ED	On-Demand	Anodyne	FAAH	18	41
O=C(NCc1ccoc1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875073815	ED	On-Demand	Anodyne	TMPRSS11D	57	34
O=C(NCc1ccoc1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875073817	ED	On-Demand	Anodyne	TMPRSS11D	57	34
CCCCCCCNC(=O)C(=O)NC[C@@]1(N(C)C)CCSC1	ZINC000875073818	ED	On-Demand	Mild	ASAH1	48	30
O=C(NCc1ccoc1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875073819	ED	On-Demand	Anodyne	TMPRSS11D	57	34
CCCCCCCNC(=O)C(=O)NC[C@]1(N(C)C)CCSC1	ZINC000875073820	ED	On-Demand	Mild	ASAH1	48	30
O=C(NCc1ccoc1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875073821	ED	On-Demand	Anodyne	TMPRSS11D	57	34
Cc1ccc(CNC(=O)C(=O)N2C[C@@H]3CC[C@H](C2)N3C(=O)OC(C)(C)C)cn1	ZINC000875073823	GD	On-Demand	Anodyne	GPR119	34	44
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)cn1	ZINC000875073828	ED	On-Demand	Anodyne	SIRT3	54	33
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)cn1	ZINC000875073828	ED	On-Demand	Anodyne	SIRT2	55	34
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)cn1	ZINC000875073828	ED	On-Demand	Anodyne	SIRT1	54	33
COC(=O)C1(O)CN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000875073840	EC	On-Demand	Anodyne	HTR1A	24	44
COC(=O)C1(O)CN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000875073840	EC	On-Demand	Anodyne	DRD2	27	48
COC(=O)C1(O)CN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000875073840	EC	On-Demand	Anodyne	DRD4	17	43
COC(=O)C1(O)CN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000875073840	EC	On-Demand	Anodyne	ADRA1D	30	41
COC(=O)C1(O)CN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000875073840	EC	On-Demand	Anodyne	ADRA1A	48	41
COC(=O)C1(O)CN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000875073840	EC	On-Demand	Anodyne	ADRA1B	33	41
COC(=O)C1(O)CN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000875073840	EC	On-Demand	Anodyne	DRD3	49	48
COC(=O)C1(O)CN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000875073840	EC	On-Demand	Anodyne	HTR7	31	50
COC(=O)C1(O)CN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000875073840	EC	On-Demand	Anodyne	NOD2	42	37
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NCc3cccc(C)n3)C2)c1	ZINC000875073898	GD	On-Demand	Anodyne	PDE8B	70	41
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NCc3cccc(C)n3)C2)c1	ZINC000875073899	GD	On-Demand	Anodyne	PDE8B	70	41
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1cccc(C)n1	ZINC000875073913	DC	On-Demand	Mild	PDE8B	42	38
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1cccc(C)n1	ZINC000875073914	DC	On-Demand	Mild	PDE8B	42	38
O=C(NCCCC1CCCC1)C(=O)NCc1ncc(Br)s1	ZINC000875073915	FF	On-Demand	Anodyne	BMP1	68	35
Cc1cccc(CNC(=O)C(=O)N2C[C@@H]3CN(Cc4ccccc4)C[C@]3(C)C2)n1	ZINC000875073918	GD	On-Demand	Anodyne	PDE8B	49	39
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccoc3)CC2)c(OC)c1	ZINC000875073940	FD	On-Demand	Clean	DRD2	29	40
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccoc3)CC2)c(OC)c1	ZINC000875073940	FD	On-Demand	Clean	DRD4	41	32
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccoc3)CC2)c(OC)c1	ZINC000875073940	FD	On-Demand	Clean	DRD3	47	38
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCN2CCc3ccccc32)C1	ZINC000875073942	FE	On-Demand	Anodyne	ACE	20	45
Cc1cccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)n1	ZINC000875073946	FD	On-Demand	Anodyne	PDE8B	45	36
Cc1cccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)n1	ZINC000875073947	FD	On-Demand	Anodyne	PDE8B	45	36
Cc1cccc(CNC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)n1	ZINC000875073948	FD	On-Demand	Anodyne	PDE8B	45	36
Cc1cccc(CNC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)n1	ZINC000875073949	FD	On-Demand	Anodyne	PDE8B	45	36
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NCC(=O)N1CCCCC1	ZINC000875073961	FD	On-Demand	Anodyne	DPP7	42	40
Cc1scc(CNC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)c1C	ZINC000875073971	GE	On-Demand	Clean	STAT6	51	33
O=C(CNC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1)N1CCCCC1	ZINC000875073974	ED	On-Demand	Anodyne	PREP	58	42
C[C@H](CN1CCOCC1)NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875073976	ED	On-Demand	Anodyne	PLD1	43	36
O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCC(C1CCC1)C1CCC1	ZINC000875073997	GE	On-Demand	Clean	STAT6	42	34
O=C(NCC(=O)N1CCCCC1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875074002	FD	On-Demand	Anodyne	HRH2	22	41
O=C(NCC(=O)N1CCCCC1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875074002	FD	On-Demand	Anodyne	DPP7	52	48
O=C(NCC(=O)N1CCCCC1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875074003	FD	On-Demand	Anodyne	HRH2	22	41
O=C(NCC(=O)N1CCCCC1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875074003	FD	On-Demand	Anodyne	DPP7	52	48
O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCC1CC=CC1	ZINC000875074017	ED	On-Demand	Clean	STAT6	52	35
O=C(NCc1ccccc1N1CCCCC1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875074044	GF	On-Demand	Anodyne	KCNQ2	59	37
O=C(NCc1ccccc1N1CCCCC1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875074044	GF	On-Demand	Anodyne	SCN2A	17	40
O=C(NCc1ccccc1N1CCCCC1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875074045	GF	On-Demand	Anodyne	KCNQ2	59	37
O=C(NCc1ccccc1N1CCCCC1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875074045	GF	On-Demand	Anodyne	SCN2A	17	40
O=C(NCc1ccccc1N1CCCCC1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875074046	GF	On-Demand	Anodyne	KCNQ2	59	37
O=C(NCc1ccccc1N1CCCCC1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875074046	GF	On-Demand	Anodyne	SCN2A	17	40
O=C(NCc1ccccc1N1CCCCC1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875074047	GF	On-Demand	Anodyne	KCNQ2	59	37
O=C(NCc1ccccc1N1CCCCC1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875074047	GF	On-Demand	Anodyne	SCN2A	17	40
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)C(=O)NCC1CCOCC1	ZINC000875074049	GF	On-Demand	Anodyne	MDM2	49	34
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)C(=O)NCC1CCOCC1	ZINC000875074049	GF	On-Demand	Anodyne	CACNA1I	54	39
O=C(CNC(=O)N1Cc2cccnc2N2CCC[C@H]2C1)N1CCCCC1	ZINC000875074053	FD	On-Demand	Anodyne	PREP	24	40
Cc1cccc(CNC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)n1	ZINC000875074057	CD	On-Demand	Anodyne	PDE8B	48	38
O=C(NCCCC1CCCCC1)C(=O)NCc1ncc(Br)s1	ZINC000875074093	GF	On-Demand	Anodyne	BMP1	77	37
CCCCCCCNC(=O)C(=O)NCc1cccc(C)n1	ZINC000875074094	CE	On-Demand	Mild	ASAH1	90	36
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2cccc(C)n2)C1	ZINC000875074104	DD	On-Demand	Anodyne	HCRTR1	15	41
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2cccc(C)n2)C1	ZINC000875074104	DD	On-Demand	Anodyne	HCRTR2	27	41
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2cccc(C)n2)C1	ZINC000875074104	DD	On-Demand	Anodyne	PDE8B	42	37
C[C@H](NC(=O)C(=O)NCCCC1CCCC1)c1ccnn1C	ZINC000875074112	DD	On-Demand	Anodyne	BMP1	77	35
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NCc3cc(C)on3)C2)c1	ZINC000875074115	GC	On-Demand	Anodyne	PDE8B	57	31
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NCc3cc(C)on3)C2)c1	ZINC000875074118	GC	On-Demand	Anodyne	PDE8B	57	31
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1cccc(C)n1)CC2	ZINC000875074124	GE	On-Demand	Anodyne	HCRTR1	15	45
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1cccc(C)n1)CC2	ZINC000875074124	GE	On-Demand	Anodyne	MTNR1B	17	44
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1cccc(C)n1)CC2	ZINC000875074124	GE	On-Demand	Anodyne	HCRTR2	15	40
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1cccc(C)n1)CC2	ZINC000875074125	GE	On-Demand	Anodyne	HCRTR1	15	45
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1cccc(C)n1)CC2	ZINC000875074125	GE	On-Demand	Anodyne	MTNR1B	17	44
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1cccc(C)n1)CC2	ZINC000875074125	GE	On-Demand	Anodyne	HCRTR2	15	40
Cc1cccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)n1	ZINC000875074126	GE	On-Demand	Anodyne	DRD2	27	44
Cc1cccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)n1	ZINC000875074126	GE	On-Demand	Anodyne	DRD4	52	43
Cc1cccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)n1	ZINC000875074126	GE	On-Demand	Anodyne	ACHE	66	58
Cc1cccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)n1	ZINC000875074126	GE	On-Demand	Anodyne	HTR2A	15	41
Cc1cccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)n1	ZINC000875074126	GE	On-Demand	Anodyne	DRD3	24	42
Cc1cccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)n1	ZINC000875074126	GE	On-Demand	Anodyne	HTR4	21	41
Cc1cccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)n1	ZINC000875074126	GE	On-Demand	Anodyne	CHRM3	20	46
Cc1cccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)n1	ZINC000875074126	GE	On-Demand	Anodyne	SIGMAR1	54	45
Cc1cccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)n1	ZINC000875074126	GE	On-Demand	Anodyne	BCHE	19	49
Cc1cccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)n1	ZINC000875074126	GE	On-Demand	Anodyne	SCN5A	25	42
Cc1cccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)n1	ZINC000875074126	GE	On-Demand	Anodyne	MCHR1	31	40
Cc1cccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)n1	ZINC000875074126	GE	On-Demand	Anodyne	PDE8B	51	41
Cc1cccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)n1	ZINC000875074126	GE	On-Demand	Anodyne	CACNA1G	27	40
Cc1cccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)n1	ZINC000875074126	GE	On-Demand	Anodyne	SIRT3	41	33
Cc1cccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)n1	ZINC000875074126	GE	On-Demand	Anodyne	SIRT2	45	33
Cc1cccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)n1	ZINC000875074126	GE	On-Demand	Anodyne	SIRT1	42	36
CCCCCCCNC(=O)C(=O)NCc1ccoc1	ZINC000875074142	CD	On-Demand	Mild	S1PR2	42	35
CCCCCCCNC(=O)C(=O)NCc1ccoc1	ZINC000875074142	CD	On-Demand	Mild	ASAH1	99	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000875074166	FE	On-Demand	Anodyne	ACE	16	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000875074166	FE	On-Demand	Anodyne	ADRA1A	45	37
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000875074166	FE	On-Demand	Anodyne	DRD3	16	45
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000875074166	FE	On-Demand	Anodyne	HTR7	24	44
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000875074166	FE	On-Demand	Anodyne	NOD1	15	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000875074166	FE	On-Demand	Anodyne	NOD2	43	41
Cc1cccc(CNC(=O)C(=O)N2CCN(c3ccc(C#N)cc3)CC2)n1	ZINC000875074169	FD	On-Demand	Mild	MAPKAPK2	15	47
O=C(Oc1ccc(C(F)(F)F)cc1)C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000875074175	JJ	On-Demand	Anodyne	CNR1	16	44
O=C(Oc1ccc(C(F)(F)F)cc1)C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000875074175	JJ	On-Demand	Anodyne	CACNA1B	64	46
O=C(Oc1ccc(C(F)(F)F)cc1)C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000875074175	JJ	On-Demand	Anodyne	EPHX2	33	47
O=C(Oc1ccc(C(F)(F)F)cc1)C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000875074175	JJ	On-Demand	Anodyne	PKM	29	49
O=C(Oc1ccc(C(F)(F)F)cc1)C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000875074175	JJ	On-Demand	Anodyne	AKR1C3	59	39
O=C(Oc1ccc(C(F)(F)F)cc1)C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000875074175	JJ	On-Demand	Anodyne	LIPG	43	36
O=C(Oc1ccc(C(F)(F)F)cc1)C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000875074175	JJ	On-Demand	Anodyne	SFRP1	57	42
Cc1ccc(CNC(=O)C(=O)N2C[C@@H]3C[C@H]2CN3C(=O)OC(C)(C)C)cn1	ZINC000875074190	FD	On-Demand	Anodyne	GPR119	19	41
Cc1ccc(CNC(=O)C(=O)N2C[C@@H]3C[C@H]2CN3C(=O)OC(C)(C)C)cn1	ZINC000875074190	FD	On-Demand	Anodyne	VHL	47	31
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(C)nc2)CC1	ZINC000875074191	DC	On-Demand	Anodyne	NAMPT	42	43
C[C@H](NC(=O)C(=O)NCCCC1CCCC1)c1cc2cnccc2o1	ZINC000875074193	EG	On-Demand	Anodyne	BMP1	73	36
Cc1cccc(CNC(=O)C(=O)N2C[C@@H]3C[C@H]2CN3C(=O)OC(C)(C)C)n1	ZINC000875074207	FD	On-Demand	Anodyne	PDE8B	49	38
COc1ccc(N2CCN(C(=O)C(=O)NCc3cc(C)on3)CC2)c(OC)c1	ZINC000875074251	GC	On-Demand	Clean	DRD2	33	41
COc1ccc(N2CCN(C(=O)C(=O)NCc3cc(C)on3)CC2)c(OC)c1	ZINC000875074251	GC	On-Demand	Clean	DRD4	41	32
COc1ccc(N2CCN(C(=O)C(=O)NCc3cc(C)on3)CC2)c(OC)c1	ZINC000875074251	GC	On-Demand	Clean	DRD3	51	41
C=CC(C)(C)CCNC(=O)C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875074266	GE	On-Demand	Mild	CACNA1I	42	33
C=CC(C)(C)CCNC(=O)C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875074266	GE	On-Demand	Mild	GPR119	30	41
O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCCC2(CC1)CC2	ZINC000875074267	FD	On-Demand	Clean	STAT6	51	34
O=C(NCC(=O)N1CCCCC1)NC1CC(Nc2ccccc2)C1	ZINC000875074280	ED	On-Demand	Anodyne	PREP	51	44
O=C(NCC(=O)N1CCCCC1)NC1CC(Nc2ccccc2)C1	ZINC000875074280	ED	On-Demand	Anodyne	EPHX2	30	44
O=C(NCC(=O)N1CCCCC1)NC1CC(Nc2ccccc2)C1	ZINC000875074280	ED	On-Demand	Anodyne	DPP7	31	40
O=C(NCc1ccccc1N1CCCCC1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875074289	GC	On-Demand	Anodyne	KCNQ2	73	41
O=C(NCc1ccccc1N1CCCCC1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875074289	GC	On-Demand	Anodyne	SCN2A	18	44
O=C(NCc1ccccc1N1CCCCC1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875074289	GC	On-Demand	Anodyne	SCN10A	15	44
CC(=O)C1CCN(C(=O)C(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000875074298	GD	On-Demand	Anodyne	CACNA1I	44	35
O=C(CNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)N1CCCCC1	ZINC000875074306	FD	On-Demand	Anodyne	SIGMAR1	35	41
O=C(CNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)N1CCCCC1	ZINC000875074306	FD	On-Demand	Anodyne	PREP	33	43
O=C(CNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)N1CCCCC1	ZINC000875074306	FD	On-Demand	Anodyne	DPP7	45	38
O=C(CNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)N1CCCCC1	ZINC000875074306	FD	On-Demand	Anodyne	NPFFR1	41	38
C=CC(C)(C)CCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1	ZINC000875074312	FD	On-Demand	Mild	STAT6	63	37
O=C(NCC1CCOCC1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875074332	ED	On-Demand	Anodyne	OXTR	55	38
O=C(NCC1CCOCC1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875074333	ED	On-Demand	Anodyne	OXTR	55	38
O=C(NCC1CCOCC1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875074343	GD	On-Demand	Anodyne	SMO	32	44
O=C(NCC1CCOCC1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875074343	GD	On-Demand	Anodyne	ETHR	61	49
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875074346	FE	On-Demand	Anodyne	SLC6A1	43	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875074346	FE	On-Demand	Anodyne	KCNQ2	72	39
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875074346	FE	On-Demand	Anodyne	SCN2A	17	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875074347	FE	On-Demand	Anodyne	SLC6A1	43	32
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875074347	FE	On-Demand	Anodyne	KCNQ2	72	39
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875074347	FE	On-Demand	Anodyne	SCN2A	17	42
O=C(NCCCN1CCc2ccccc2C1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875074393	GE	On-Demand	Anodyne	HTR7	17	42
O=C(NCCCN1CCc2ccccc2C1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875074394	GE	On-Demand	Anodyne	HTR7	17	42
Cc1cccc(CNC(=O)C(=O)N[C@@H]2C[C@@H](C(=O)OC(C)(C)C)C2)n1	ZINC000875074415	ED	On-Demand	Anodyne	PDE8B	48	39
Cc1cccc(CNC(=O)C(=O)NC2CC(C(=O)OC(C)(C)C)C2)n1	ZINC000875074417	ED	On-Demand	Anodyne	PDE8B	48	39
Cc1cccc(CNC(=O)C(=O)N[C@@H]2C[C@H](C(=O)OC(C)(C)C)C2)n1	ZINC000875074419	ED	On-Demand	Anodyne	PDE8B	48	39
Cn1nccc1C(NC(=O)C(=O)NCCCC1CCCCC1)c1ccnn1C	ZINC000875074427	GD	On-Demand	Anodyne	BMP1	82	38
O=C(NCCCC1CCCC1)C(=O)NCc1ncc(Cl)s1	ZINC000875074433	EE	On-Demand	Anodyne	BMP1	48	33
O=C(NCCCN1CCc2ccccc2C1)N1Cc2cccc(O)c2C1	ZINC000875074469	FF	On-Demand	Clean	HTR1A	20	45
O=C(NCCCN1CCc2ccccc2C1)N1Cc2cccc(O)c2C1	ZINC000875074469	FF	On-Demand	Clean	DRD2	19	42
O=C(NCCCN1CCc2ccccc2C1)N1Cc2cccc(O)c2C1	ZINC000875074469	FF	On-Demand	Clean	DRD3	35	51
O=C(NCCCN1CCc2ccccc2C1)N1Cc2cccc(O)c2C1	ZINC000875074469	FF	On-Demand	Clean	DRD5	23	41
O=C(NCCCN1CCc2ccccc2C1)N1Cc2cccc(O)c2C1	ZINC000875074469	FF	On-Demand	Clean	HTR7	25	50
O=C(NCCCN1CCc2ccccc2C1)N1Cc2cccc(O)c2C1	ZINC000875074469	FF	On-Demand	Clean	NOD2	41	34
CN1CCN(C2CCN(C(=O)C(=O)NCc3ccoc3)CC2)CC1	ZINC000875074484	EC	On-Demand	Anodyne	L3MBTL3	70	42
CC[C@H](C[C@H](C)O)NC(=O)NCCCN1CCc2ccccc2C1	ZINC000875074500	EE	On-Demand	Anodyne	HTR7	17	47
O=C1CCCN1C[C@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccccc1	ZINC000875074515	GD	On-Demand	Anodyne	CACNA1H	27	40
O=C1CCCN1C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccccc1	ZINC000875074517	GD	On-Demand	Anodyne	CACNA1H	27	40
Cc1cccc(CNC(=O)C(=O)N2CC[C@@H]3CSC[C@H]3C2)n1	ZINC000875074524	DD	On-Demand	Anodyne	PDE8B	41	36
Cc1cccc(CNC(=O)C(=O)N2CC[C@@H]3CSC[C@@H]3C2)n1	ZINC000875074527	DD	On-Demand	Anodyne	PDE8B	41	36
Cc1cccc(CNC(=O)C(=O)N2CC[C@H]3CSC[C@H]3C2)n1	ZINC000875074529	DD	On-Demand	Anodyne	PDE8B	41	36
Cc1cccc(CNC(=O)C(=O)N2CC[C@H]3CSC[C@@H]3C2)n1	ZINC000875074532	DD	On-Demand	Anodyne	PDE8B	41	36
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)C(=O)NCC1CCOCC1	ZINC000875074535	GE	On-Demand	Anodyne	SIGMAR1	17	42
COC(=O)N(C)NC(=O)NCCCN1CCc2ccccc2C1	ZINC000875074574	DD	On-Demand	Reactive	HTR1A	28	44
COC(=O)N(C)NC(=O)NCCCN1CCc2ccccc2C1	ZINC000875074574	DD	On-Demand	Reactive	DRD2	30	48
COC(=O)N(C)NC(=O)NCCCN1CCc2ccccc2C1	ZINC000875074574	DD	On-Demand	Reactive	DRD4	19	45
COC(=O)N(C)NC(=O)NCCCN1CCc2ccccc2C1	ZINC000875074574	DD	On-Demand	Reactive	DRD3	57	50
COC(=O)N(C)NC(=O)NCCCN1CCc2ccccc2C1	ZINC000875074574	DD	On-Demand	Reactive	HTR7	30	49
COC(=O)N(C)NC(=O)NCCCN1CCc2ccccc2C1	ZINC000875074574	DD	On-Demand	Reactive	ABCB1B	45	32
COC(=O)N(C)NC(=O)NCCCN1CCc2ccccc2C1	ZINC000875074574	DD	On-Demand	Reactive	NOD2	42	38
CC(C)(C)OC(=O)N1CC[C@H]2[C@H]1CCCN2C(=O)NCC(=O)N1CCCCC1	ZINC000875074582	GE	On-Demand	Anodyne	PREP	40	50
CC(C)(C)OC(=O)N1CC[C@H]2[C@@H]1CCCN2C(=O)NCC(=O)N1CCCCC1	ZINC000875074583	GE	On-Demand	Anodyne	PREP	40	50
CC(C)(C)OC(=O)N1CC[C@@H]2[C@H]1CCCN2C(=O)NCC(=O)N1CCCCC1	ZINC000875074584	GE	On-Demand	Anodyne	PREP	40	50
CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H]1CCCN2C(=O)NCC(=O)N1CCCCC1	ZINC000875074585	GE	On-Demand	Anodyne	PREP	40	50
CC(C)(C)OC(=O)N1CCC(CNC(=O)C(=O)NC[C@@H]2CC[C@@H]3C[C@H]3C2)CC1	ZINC000875074586	GE	On-Demand	Anodyne	CACNA1I	45	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)C(=O)NC[C@@H]2CC[C@@H]3C[C@H]3C2)CC1	ZINC000875074586	GE	On-Demand	Anodyne	GPR119	35	43
CC(C)(C)OC(=O)N1CCC(CNC(=O)C(=O)NC[C@@H]2CC[C@H]3C[C@@H]3C2)CC1	ZINC000875074587	GE	On-Demand	Anodyne	CACNA1I	45	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)C(=O)NC[C@@H]2CC[C@H]3C[C@@H]3C2)CC1	ZINC000875074587	GE	On-Demand	Anodyne	GPR119	35	43
CC(C)(C)OC(=O)N1CCC(CNC(=O)C(=O)NC[C@@H]2CC[C@H]3C[C@H]3C2)CC1	ZINC000875074588	GE	On-Demand	Anodyne	CACNA1I	45	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)C(=O)NC[C@@H]2CC[C@H]3C[C@H]3C2)CC1	ZINC000875074588	GE	On-Demand	Anodyne	GPR119	35	43
CC(C)(C)OC(=O)N1CCC(CNC(=O)C(=O)NC[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1	ZINC000875074589	GE	On-Demand	Anodyne	CACNA1I	45	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)C(=O)NC[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1	ZINC000875074589	GE	On-Demand	Anodyne	GPR119	35	43
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCC1CCOCC1)CC2	ZINC000875074590	GD	On-Demand	Anodyne	SLC18A2	48	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCC1CCOCC1)CC2	ZINC000875074591	GD	On-Demand	Anodyne	SLC18A2	48	35
CC(C)(C)OC(=O)N1CC[C@H]2[C@H]1CCCN2C(=O)C(=O)NCC1CCOCC1	ZINC000875074601	GD	On-Demand	Anodyne	CACNA1I	40	30
CC(C)(C)OC(=O)N1CC[C@H]2[C@@H]1CCCN2C(=O)C(=O)NCC1CCOCC1	ZINC000875074602	GD	On-Demand	Anodyne	CACNA1I	40	30
CC(C)(C)OC(=O)N1CC[C@@H]2[C@H]1CCCN2C(=O)C(=O)NCC1CCOCC1	ZINC000875074603	GD	On-Demand	Anodyne	CACNA1I	40	30
CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H]1CCCN2C(=O)C(=O)NCC1CCOCC1	ZINC000875074604	GD	On-Demand	Anodyne	CACNA1I	40	30
N#Cc1cccc([C@H](NC(=O)NCC(=O)N2CCCCC2)C(F)(F)F)c1	ZINC000875074628	FE	On-Demand	Mild	MCHR1	20	40
N#Cc1cccc([C@@H](NC(=O)NCC(=O)N2CCCCC2)C(F)(F)F)c1	ZINC000875074629	FE	On-Demand	Mild	MCHR1	20	40
O=C(NCC1CCOCC1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875074635	FD	On-Demand	Anodyne	C3AR1	40	40
O=C(NCC1CCOCC1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875074636	FD	On-Demand	Anodyne	C3AR1	40	40
O=C(NCCO)C1CCN(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)CC1	ZINC000875074653	GD	On-Demand	Anodyne	CCR5	23	41
O=C(NCCO)C1CCN(C(=O)N[C@H](CN2CCCC2)c2ccccc2)CC1	ZINC000875074654	GD	On-Demand	Anodyne	CCR5	23	41
Cc1ccc(CNC(=O)C(=O)N2CCN(c3ccc(F)cc3F)CC2)cn1	ZINC000875074658	FD	On-Demand	Anodyne	NPY2R	53	34
Cc1cccc(CNC(=O)C(=O)N2CCC(C)(N3CCCCC3)CC2)n1	ZINC000875074675	FD	On-Demand	Anodyne	CCR5	30	40
Cc1cccc(CNC(=O)C(=O)N2CCC(C)(N3CCCCC3)CC2)n1	ZINC000875074675	FD	On-Demand	Anodyne	PDE8B	41	36
Cc1cccc(CNC(=O)C(=O)N2CC[C@@H](c3nc(C)cs3)C2)n1	ZINC000875074680	ED	On-Demand	Anodyne	PDE8B	40	36
Cc1cccc(CNC(=O)C(=O)N2CC[C@H](c3nc(C)cs3)C2)n1	ZINC000875074681	ED	On-Demand	Anodyne	PDE8B	40	36
O=C(CSc1ccc2c(c1)OCCO2)Oc1ccc(C(F)(F)F)cc1	ZINC000875074690	FI	On-Demand	Anodyne	PPARD	33	40
Cc1cccc(CNC(=O)C(=O)N2CCN(c3ccc(F)cc3F)CC2)n1	ZINC000875074702	FD	On-Demand	Anodyne	NPY2R	63	36
O=C(NCC[C@H](O)C1CCCC1)NCC(=O)N1CCCCC1	ZINC000875074719	DD	On-Demand	Anodyne	DPP7	19	41
O=C(NCC[C@@H](O)C1CCCC1)NCC(=O)N1CCCCC1	ZINC000875074721	DD	On-Demand	Anodyne	DPP7	19	41
C[C@H](CN1CCOCC1)NC(=O)NNc1cccc(F)c1Br	ZINC000875074737	GD	On-Demand	Reactive	PTGDS	24	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CN1CCCC1)c1ccccc1	ZINC000875074748	FF	On-Demand	Anodyne	SLC6A4	23	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CN1CCCC1)c1ccccc1	ZINC000875074748	FF	On-Demand	Anodyne	SLC6A3	60	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CN1CCCC1)c1ccccc1	ZINC000875074748	FF	On-Demand	Anodyne	CCR5	30	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CN1CCCC1)c1ccccc1	ZINC000875074750	FF	On-Demand	Anodyne	SLC6A4	23	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CN1CCCC1)c1ccccc1	ZINC000875074750	FF	On-Demand	Anodyne	SLC6A3	60	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CN1CCCC1)c1ccccc1	ZINC000875074750	FF	On-Demand	Anodyne	CCR5	30	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CN1CCCC1)c1ccccc1	ZINC000875074751	FF	On-Demand	Anodyne	SLC6A4	23	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CN1CCCC1)c1ccccc1	ZINC000875074751	FF	On-Demand	Anodyne	SLC6A3	60	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CN1CCCC1)c1ccccc1	ZINC000875074751	FF	On-Demand	Anodyne	CCR5	30	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CN1CCCC1)c1ccccc1	ZINC000875074752	FF	On-Demand	Anodyne	SLC6A4	23	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CN1CCCC1)c1ccccc1	ZINC000875074752	FF	On-Demand	Anodyne	SLC6A3	60	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CN1CCCC1)c1ccccc1	ZINC000875074752	FF	On-Demand	Anodyne	CCR5	30	40
CN(C)S(=O)(=O)c1ccc2c(c1)CCCN2C(=O)c1coc(C#N)c1	ZINC000875074772	FD	On-Demand	Mild	AVPR2	22	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccoc1	ZINC000875074802	FE	On-Demand	Anodyne	DRD2	22	47
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccoc1	ZINC000875074802	FE	On-Demand	Anodyne	DRD4	47	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccoc1	ZINC000875074802	FE	On-Demand	Anodyne	ACHE	65	62
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccoc1	ZINC000875074802	FE	On-Demand	Anodyne	DRD3	16	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccoc1	ZINC000875074802	FE	On-Demand	Anodyne	HTR4	31	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccoc1	ZINC000875074802	FE	On-Demand	Anodyne	CHRM3	21	46
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccoc1	ZINC000875074802	FE	On-Demand	Anodyne	SIGMAR1	67	51
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccoc1	ZINC000875074802	FE	On-Demand	Anodyne	BCHE	23	52
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccoc1	ZINC000875074802	FE	On-Demand	Anodyne	CACNA1G	28	40
CC[C@@H](NC(=O)NCC(=O)N1CCCCC1)[C@H](O)c1ccccc1	ZINC000875074804	ED	On-Demand	Anodyne	KCNQ2	47	37
CC[C@@H](NC(=O)NCC(=O)N1CCCCC1)[C@@H](O)c1ccccc1	ZINC000875074810	ED	On-Demand	Anodyne	KCNQ2	47	37
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCC2CCCCC2)C1	ZINC000875074830	DE	On-Demand	Anodyne	BMP1	45	38
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCC2CCCCC2)C1	ZINC000875074838	DE	On-Demand	Anodyne	BMP1	45	38
O=C(NCC1CCOCC1)C(=O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000875074839	GF	On-Demand	Anodyne	HTR4	43	41
O=C(NCC1CCOCC1)C(=O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000875074839	GF	On-Demand	Anodyne	CCR3	16	40
O=C(NCC1CCOCC1)C(=O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000875074839	GF	On-Demand	Anodyne	EPHX2	16	41
O=C(NCC1CCOCC1)C(=O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000875074839	GF	On-Demand	Anodyne	CACNA1I	61	36
O=C(CCNC(=O)c1ccc(Br)cc1)Oc1ccc(C(F)(F)F)cc1	ZINC000875074855	HI	On-Demand	Anodyne	GCGR	49	39
O=C(CCNC(=O)c1ccc(Br)cc1)Oc1ccc(C(F)(F)F)cc1	ZINC000875074855	HI	On-Demand	Anodyne	PPARD	15	42
O=C(CCNC(=O)c1ccc(Br)cc1)Oc1ccc(C(F)(F)F)cc1	ZINC000875074855	HI	On-Demand	Anodyne	ACR	17	43
O=C(CCNC(=O)c1ccc(Br)cc1)Oc1ccc(C(F)(F)F)cc1	ZINC000875074855	HI	On-Demand	Anodyne	GIPR	60	38
O=C(NCC1CCOCC1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875074861	ED	On-Demand	Anodyne	F2	27	44
O=C(NCC1CCOCC1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875074863	ED	On-Demand	Anodyne	F2	27	44
O=C(NCC1CCOCC1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875074865	ED	On-Demand	Anodyne	F2	27	44
O=C(NCC1CCOCC1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875074867	ED	On-Demand	Anodyne	F2	27	44
C[C@H]1C[C@H](CO)CCN1C(=O)C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875074942	GD	On-Demand	Anodyne	CACNA1I	40	31
COc1ccc([C@@H]2CN(C(=O)C(=O)NCc3cccc(C)n3)CCO2)cc1	ZINC000875074962	FD	On-Demand	Anodyne	PDE8B	42	36
CCOC(=O)[C@@H]1CN(C(=O)C(=O)NCc2cccc(C)n2)CC12COC2	ZINC000875074963	FC	On-Demand	Anodyne	PDE8B	45	36
Cc1ccc(CNC(=O)C(=O)NCc2cc(C(F)(F)F)cc(Cl)n2)cn1	ZINC000875074965	GE	On-Demand	Anodyne	ATF1	45	33
Cc1ccc(CNC(=O)C(=O)NCc2cc(C(F)(F)F)cc(Cl)n2)cn1	ZINC000875074965	GE	On-Demand	Anodyne	NFKB1	42	33
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1ccoc1)CC2	ZINC000875074966	FE	On-Demand	Anodyne	SLC18A2	46	34
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1ccoc1)CC2	ZINC000875074966	FE	On-Demand	Anodyne	HCRTR1	15	45
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1ccoc1)CC2	ZINC000875074967	FE	On-Demand	Anodyne	SLC18A2	46	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1ccoc1)CC2	ZINC000875074967	FE	On-Demand	Anodyne	HCRTR1	15	45
O=C(NCCCC1CCCC1)C(=O)NCc1cccc2ncccc12	ZINC000875074974	EF	On-Demand	Anodyne	BMP1	57	36
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2cccc(C)n2)C1	ZINC000875074976	DC	On-Demand	Anodyne	PDE8B	47	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2cccc(C)n2)C1	ZINC000875074977	DC	On-Demand	Anodyne	PDE8B	47	38
COc1ccccc1[C@H]1CN(C(=O)C(=O)NCc2cccc(C)n2)CCO1	ZINC000875074978	FD	On-Demand	Anodyne	PDE8B	46	39
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NCc2cccc(C)n2)CCO1	ZINC000875074979	FD	On-Demand	Anodyne	PDE8B	46	39
NC(=O)CCOC(=O)CCc1nc(-c2cccs2)no1	ZINC000875074984	CD	On-Demand	Anodyne	ETHR	31	41
Cc1cccc(CNC(=O)C(=O)NC[C@H]2CN(Cc3ccccc3C)CCO2)n1	ZINC000875074985	GD	On-Demand	Anodyne	PDE8B	72	42
Cc1cccc(CNC(=O)C(=O)NC[C@@H]2CN(Cc3ccccc3C)CCO2)n1	ZINC000875074986	GD	On-Demand	Anodyne	PDE8B	72	42
Cc1cccc(CNC(=O)C(=O)N2C[C@@H]3CC[C@H](C2)N3C(=O)OC(C)(C)C)n1	ZINC000875074993	GD	On-Demand	Anodyne	PDE8B	45	36
Cc1ncc([C@@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)s1	ZINC000875075001	GD	On-Demand	Clean	STAT6	58	36
Cc1ncc([C@H](C)NC(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)s1	ZINC000875075003	GD	On-Demand	Clean	STAT6	58	36
O=C(NCCCC1CCCC1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875075021	GG	On-Demand	Anodyne	BMP1	56	35
O=C(NCCCC1CCCC1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875075021	GG	On-Demand	Anodyne	ETHR	66	56
CC(C)(C)OC(=O)N1CCC(CNC(=O)C(=O)NCCCCC2CC2)CC1	ZINC000875075028	GE	On-Demand	Anodyne	CACNA1I	46	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)C(=O)NCCCCC2CC2)CC1	ZINC000875075028	GE	On-Demand	Anodyne	GPR119	37	49
CC(C)(C)OC(=O)N1CCC(CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875075033	GD	On-Demand	Anodyne	CACNA1I	44	35
CC(C)(C)OC(=O)N1CCC(CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875075033	GD	On-Demand	Anodyne	GPR119	39	40
CC(C)(C)OC(=O)N1CCC(CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875075034	GD	On-Demand	Anodyne	CACNA1I	44	35
CC(C)(C)OC(=O)N1CCC(CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875075034	GD	On-Demand	Anodyne	GPR119	39	40
C[C@H](CN1CCOCC1)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875075043	FD	On-Demand	Anodyne	PLD1	46	34
Cc1ccccc1CN1CCO[C@@H](CNC(=O)C(=O)NCC2CCOCC2)C1	ZINC000875075073	GC	On-Demand	Anodyne	DRD4	15	40
Cc1ccccc1CN1CCO[C@@H](CNC(=O)C(=O)NCC2CCOCC2)C1	ZINC000875075073	GC	On-Demand	Anodyne	SLC6A1	44	33
Cc1ccccc1CN1CCO[C@@H](CNC(=O)C(=O)NCC2CCOCC2)C1	ZINC000875075073	GC	On-Demand	Anodyne	PDE8B	30	43
CCCCCCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1	ZINC000875075084	FE	On-Demand	Mild	SPHK1	19	40
CCCCCCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1	ZINC000875075084	FE	On-Demand	Mild	ASAH1	90	48
CCCCCCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1	ZINC000875075084	FE	On-Demand	Mild	STAT6	51	35
C=CCCC(C)(C)CNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1	ZINC000875075086	FE	On-Demand	Mild	STAT6	62	36
O=C(NCCCCCCc1ccccc1)C(=O)NCC1CCOCC1	ZINC000875075087	EE	On-Demand	Anodyne	FKBP1A	22	42
O=C(NCCCCCCc1ccccc1)C(=O)NCC1CCOCC1	ZINC000875075087	EE	On-Demand	Anodyne	TACR2	15	41
O=C(NCCCCCCc1ccccc1)C(=O)NCC1CCOCC1	ZINC000875075087	EE	On-Demand	Anodyne	SIGMAR1	19	42
O=C(NCCCCCCc1ccccc1)C(=O)NCC1CCOCC1	ZINC000875075087	EE	On-Demand	Anodyne	SCN2A	17	41
O=C(NCCCCCCc1ccccc1)C(=O)NCC1CCOCC1	ZINC000875075087	EE	On-Demand	Anodyne	MTNR1A	32	41
O=C(NCCCCCCc1ccccc1)C(=O)NCC1CCOCC1	ZINC000875075087	EE	On-Demand	Anodyne	MTNR1B	33	41
O=C(NCCCCCCc1ccccc1)C(=O)NCC1CCOCC1	ZINC000875075087	EE	On-Demand	Anodyne	FAAH	68	44
O=C(NCCCCCCc1ccccc1)C(=O)NCC1CCOCC1	ZINC000875075087	EE	On-Demand	Anodyne	CES1	70	39
O=C(NCCCCCCc1ccccc1)C(=O)NCC1CCOCC1	ZINC000875075087	EE	On-Demand	Anodyne	AMP1_PLAFQ	23	45
N#CCCN1CCN(C(=O)C(=O)NCc2ccc(N3CCOCC3)cc2)CC1	ZINC000875075139	GC	On-Demand	Mild	STAT6	47	34
O=C(NCCCOCC(F)(F)F)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875075182	FF	On-Demand	Anodyne	HRH2	23	40
O=C(NCCCOCC(F)(F)F)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875075182	FF	On-Demand	Anodyne	PDS	41	38
O=C(NCCCOCC(F)(F)F)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875075183	FF	On-Demand	Anodyne	HRH2	23	40
O=C(NCCCOCC(F)(F)F)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875075183	FF	On-Demand	Anodyne	PDS	41	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CN1CCCC1=O)c1ccccc1	ZINC000875075192	GE	On-Demand	Anodyne	SLC6A3	39	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CN1CCCC1=O)c1ccccc1	ZINC000875075193	GE	On-Demand	Anodyne	SLC6A3	39	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CN1CCCC1=O)c1ccccc1	ZINC000875075194	GE	On-Demand	Anodyne	SLC6A3	39	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CN1CCCC1=O)c1ccccc1	ZINC000875075195	GE	On-Demand	Anodyne	SLC6A3	39	40
O=C1CCN(C(=O)NCCCN2CCc3ccccc3C2)CCCCCCN1	ZINC000875075202	GF	On-Demand	Anodyne	HTR7	18	45
CC(C)(C)OC(=O)N1CCC(CNC(=O)C(=O)NCC[C@@H]2CCCOC2)CC1	ZINC000875075213	GD	On-Demand	Anodyne	GPR119	29	42
CC(C)(C)OC(=O)N1CCC(CNC(=O)C(=O)NCC[C@H]2CCCOC2)CC1	ZINC000875075214	GD	On-Demand	Anodyne	GPR119	29	42
CC(C)(C)OC(=O)N1CCC(CNC(=O)C(=O)NCC[C@H]2CCSC2)CC1	ZINC000875075215	GE	On-Demand	Anodyne	GPR119	29	41
CC(C)(C)OC(=O)N1CCC(CNC(=O)C(=O)NCC[C@@H]2CCSC2)CC1	ZINC000875075216	GE	On-Demand	Anodyne	GPR119	29	41
CN(Cc1ncc[nH]1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1	ZINC000875075221	FC	On-Demand	Clean	EPHB4	51	33
CN(Cc1ncc[nH]1)C(=O)C(=O)NCc1ccc(N2CCOCC2)cc1	ZINC000875075221	FC	On-Demand	Clean	STAT6	46	34
C[C@H](CN1CCOCC1)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875075222	ED	On-Demand	Anodyne	ACE	33	41
C[C@H](CN1CCOCC1)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875075222	ED	On-Demand	Anodyne	CASR	45	35
C[C@H](CN1CCOCC1)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875075223	ED	On-Demand	Anodyne	ACE	33	41
C[C@H](CN1CCOCC1)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875075223	ED	On-Demand	Anodyne	CASR	45	35
C[C@H](CN1CCOCC1)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875075224	ED	On-Demand	Anodyne	ACE	33	41
C[C@H](CN1CCOCC1)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875075224	ED	On-Demand	Anodyne	CASR	45	35
C[C@H](CN1CCOCC1)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875075225	ED	On-Demand	Anodyne	ACE	33	41
C[C@H](CN1CCOCC1)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875075225	ED	On-Demand	Anodyne	CASR	45	35
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NCC3CCOCC3)C2)c1	ZINC000875075230	GC	On-Demand	Anodyne	DRD4	34	41
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NCC3CCOCC3)C2)c1	ZINC000875075230	GC	On-Demand	Anodyne	AVPR1B	28	44
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NCC3CCOCC3)C2)c1	ZINC000875075230	GC	On-Demand	Anodyne	CCR3	16	44
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NCC3CCOCC3)C2)c1	ZINC000875075230	GC	On-Demand	Anodyne	PDE8B	28	42
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NCC3CCOCC3)C2)c1	ZINC000875075231	GC	On-Demand	Anodyne	DRD4	34	41
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NCC3CCOCC3)C2)c1	ZINC000875075231	GC	On-Demand	Anodyne	AVPR1B	28	44
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NCC3CCOCC3)C2)c1	ZINC000875075231	GC	On-Demand	Anodyne	CCR3	16	44
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NCC3CCOCC3)C2)c1	ZINC000875075231	GC	On-Demand	Anodyne	PDE8B	28	42
C[C@H](CN1CCOCC1)NC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875075236	FE	On-Demand	Mild	CASR	35	44
C[C@H](CN1CCOCC1)NC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875075237	FE	On-Demand	Mild	CASR	35	44
COCC(C)(C)CCNC(=O)C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875075245	GD	On-Demand	Anodyne	CACNA1I	47	35
O=C(CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1)N1CCCCC1	ZINC000875075299	FE	On-Demand	Anodyne	FKBP1A	27	41
O=C(CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1)N1CCCCC1	ZINC000875075299	FE	On-Demand	Anodyne	CPT1A	69	35
O=C(CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1)N1CCCCC1	ZINC000875075299	FE	On-Demand	Anodyne	CPT2	43	33
O=C(CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1)N1CCCCC1	ZINC000875075299	FE	On-Demand	Anodyne	PREP	81	42
O=C(CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1)N1CCCCC1	ZINC000875075300	FE	On-Demand	Anodyne	FKBP1A	27	41
O=C(CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1)N1CCCCC1	ZINC000875075300	FE	On-Demand	Anodyne	CPT1A	69	35
O=C(CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1)N1CCCCC1	ZINC000875075300	FE	On-Demand	Anodyne	CPT2	43	33
O=C(CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1)N1CCCCC1	ZINC000875075300	FE	On-Demand	Anodyne	PREP	81	42
O=C(CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1)N1CCCCC1	ZINC000875075301	FE	On-Demand	Anodyne	FKBP1A	27	41
O=C(CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1)N1CCCCC1	ZINC000875075301	FE	On-Demand	Anodyne	CPT1A	69	35
O=C(CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1)N1CCCCC1	ZINC000875075301	FE	On-Demand	Anodyne	CPT2	43	33
O=C(CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1)N1CCCCC1	ZINC000875075301	FE	On-Demand	Anodyne	PREP	81	42
O=C(CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1)N1CCCCC1	ZINC000875075302	FE	On-Demand	Anodyne	FKBP1A	27	41
O=C(CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1)N1CCCCC1	ZINC000875075302	FE	On-Demand	Anodyne	CPT1A	69	35
O=C(CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1)N1CCCCC1	ZINC000875075302	FE	On-Demand	Anodyne	CPT2	43	33
O=C(CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1)N1CCCCC1	ZINC000875075302	FE	On-Demand	Anodyne	PREP	81	42
CC(C)(C)OC(=O)N1CCC[C@@H](NC(=O)C(=O)NCc2cccc(F)c2F)C1	ZINC000875075303	GE	On-Demand	Anodyne	GPR119	37	57
CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)C(=O)NCc2cccc(F)c2F)C1	ZINC000875075304	GE	On-Demand	Anodyne	GPR119	37	57
O=C(NCCCN1CCc2ccccc2C1)NC[C@H]1C[C@H](O)C1	ZINC000875075308	DD	On-Demand	Anodyne	DRD3	18	51
O=C(NCCCN1CCc2ccccc2C1)NC[C@H]1C[C@H](O)C1	ZINC000875075308	DD	On-Demand	Anodyne	HTR7	22	50
O=C(NCCCN1CCc2ccccc2C1)NC[C@H]1C[C@H](O)C1	ZINC000875075308	DD	On-Demand	Anodyne	CCR3	22	42
CC(C)(C)OC(=O)N1CCC(CNC(=O)C(=O)NC[C@]2(C)C[C@@H]3C[C@@H]3C2)CC1	ZINC000875075309	GE	On-Demand	Anodyne	CACNA1I	40	31
CC(C)(C)OC(=O)N1CCC(CNC(=O)C(=O)NC[C@]2(C)C[C@@H]3C[C@@H]3C2)CC1	ZINC000875075309	GE	On-Demand	Anodyne	GPR119	28	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](CN1CCCC1)c1ccccc1	ZINC000875075321	EF	On-Demand	Anodyne	OPRK1	19	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](CN1CCCC1)c1ccccc1	ZINC000875075321	EF	On-Demand	Anodyne	KCNQ2	52	38
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](CN1CCCC1)c1ccccc1	ZINC000875075321	EF	On-Demand	Anodyne	TACR3	31	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](CN1CCCC1)c1ccccc1	ZINC000875075323	EF	On-Demand	Anodyne	OPRK1	19	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](CN1CCCC1)c1ccccc1	ZINC000875075323	EF	On-Demand	Anodyne	KCNQ2	52	38
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](CN1CCCC1)c1ccccc1	ZINC000875075323	EF	On-Demand	Anodyne	TACR3	31	41
O=CN1CCCN(C(=O)NCCCN2CCc3ccccc3C2)CC1	ZINC000875075387	ED	On-Demand	Anodyne	DRD3	17	53
O=CN1CCCN(C(=O)NCCCN2CCc3ccccc3C2)CC1	ZINC000875075387	ED	On-Demand	Anodyne	HTR7	22	49
O=C(NCc1ccccc1N1CCCCC1)C(=O)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875075434	GF	On-Demand	Anodyne	KCNQ2	69	36
O=C(NCc1ccccc1N1CCCCC1)C(=O)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875075435	GF	On-Demand	Anodyne	KCNQ2	69	36
O=C(NCc1ccccc1N1CCCCC1)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875075436	GF	On-Demand	Anodyne	KCNQ2	69	36
O=C(NCc1ccccc1N1CCCCC1)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875075437	GF	On-Demand	Anodyne	KCNQ2	69	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)C1	ZINC000875075454	FF	On-Demand	Anodyne	OPRK1	26	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)C1	ZINC000875075454	FF	On-Demand	Anodyne	CCR5	45	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)C1	ZINC000875075454	FF	On-Demand	Anodyne	Q6PRC7_IXORI	41	33
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CN2CCCC2)c2ccccc2)C1	ZINC000875075457	FF	On-Demand	Anodyne	OPRK1	26	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CN2CCCC2)c2ccccc2)C1	ZINC000875075457	FF	On-Demand	Anodyne	CCR5	45	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CN2CCCC2)c2ccccc2)C1	ZINC000875075457	FF	On-Demand	Anodyne	Q6PRC7_IXORI	41	33
C[C@H](CN1CCOCC1)NC(=O)NC1CC(Nc2ccccc2)C1	ZINC000875075459	ED	On-Demand	Anodyne	BRD2	16	41
C[C@H](CN1CCOCC1)NC(=O)NC1CC(Nc2ccccc2)C1	ZINC000875075459	ED	On-Demand	Anodyne	BRD3	15	41
CC[C@H](C[C@H](C)O)NC(=O)NCC(=O)N1CCCCC1	ZINC000875075465	CC	On-Demand	Anodyne	RIR1_HHV11	73	50
O=C(NC[C@H]1C[C@H](O)C1)N[C@H](CN1CCCC1)c1ccccc1	ZINC000875075472	DD	On-Demand	Anodyne	OPRK1	31	41
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H](CN1CCCC1)c1ccccc1	ZINC000875075473	DD	On-Demand	Anodyne	OPRK1	31	41
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1ccccc1N1CCCCC1	ZINC000875075487	FD	On-Demand	Mild	KCNQ2	68	37
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1ccccc1N1CCCCC1	ZINC000875075487	FD	On-Demand	Mild	SCN2A	17	41
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1ccccc1N1CCCCC1	ZINC000875075488	FD	On-Demand	Mild	KCNQ2	68	37
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1ccccc1N1CCCCC1	ZINC000875075488	FD	On-Demand	Mild	SCN2A	17	41
O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N1CCC(CCF)CC1	ZINC000875075489	GD	On-Demand	Clean	STAT6	43	32
C[C@H](CN1CCOCC1)NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875075493	FD	On-Demand	Anodyne	PLD1	45	35
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccccc3N3CCCCC3)CC[C@@H]21	ZINC000875075495	GD	On-Demand	Anodyne	KCNQ2	68	37
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccccc3N3CCCCC3)CC[C@@H]21	ZINC000875075495	GD	On-Demand	Anodyne	SCN2A	17	41
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccccc3N3CCCCC3)CC[C@H]21	ZINC000875075496	GD	On-Demand	Anodyne	KCNQ2	68	37
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccccc3N3CCCCC3)CC[C@H]21	ZINC000875075496	GD	On-Demand	Anodyne	SCN2A	17	41
O=C(Oc1ccc(C(F)(F)F)cc1)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCO3)CC1	ZINC000875075502	JG	On-Demand	Anodyne	EPHX2	17	55
O=C(Oc1ccc(C(F)(F)F)cc1)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCO3)CC1	ZINC000875075502	JG	On-Demand	Anodyne	PKM	54	58
NC(=O)c1cccc(CNC(=O)N2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000875075522	ED	On-Demand	Anodyne	ST14	68	35
NC(=O)c1cccc(CNC(=O)N2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000875075523	ED	On-Demand	Anodyne	ST14	68	35
CN(C)C(=O)c1cccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875075540	FG	On-Demand	Anodyne	EPHX2	22	40
CN(C)C(=O)c1cccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875075541	FG	On-Demand	Anodyne	EPHX2	22	40
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCc2ccc(-n3cccn3)cc2)c1	ZINC000875075544	GF	On-Demand	Anodyne	ADAM17	18	53
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCc2ccc(-n3cccn3)cc2)c1	ZINC000875075545	GF	On-Demand	Anodyne	ADAM17	18	53
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cccc(OC(F)F)c1	ZINC000875075559	FG	On-Demand	Anodyne	SLC6A4	23	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cccc(OC(F)F)c1	ZINC000875075559	FG	On-Demand	Anodyne	SLC6A3	50	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cccc(OC(F)F)c1	ZINC000875075560	FG	On-Demand	Anodyne	SLC6A4	23	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cccc(OC(F)F)c1	ZINC000875075560	FG	On-Demand	Anodyne	SLC6A3	50	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cccc(OC(F)F)c1	ZINC000875075561	FG	On-Demand	Anodyne	SLC6A4	23	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cccc(OC(F)F)c1	ZINC000875075561	FG	On-Demand	Anodyne	SLC6A3	50	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cccc(OC(F)F)c1	ZINC000875075562	FG	On-Demand	Anodyne	SLC6A4	23	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cccc(OC(F)F)c1	ZINC000875075562	FG	On-Demand	Anodyne	SLC6A3	50	43
CN(C)C(=O)c1cccc(CNC(=O)NC2CC(Nc3ccccc3)C2)c1	ZINC000875075578	FF	On-Demand	Anodyne	ROCK2	15	41
CN(C)C(=O)c1cccc(CNC(=O)NC2CC(Nc3ccccc3)C2)c1	ZINC000875075578	FF	On-Demand	Anodyne	EPHX2	17	41
COC(=O)N(C)NC(=O)NCc1cccc(C(=O)N(C)C)c1	ZINC000875075620	DC	On-Demand	Reactive	ROCK2	26	41
CN1CCN(C(=O)NCc2cccc(C(N)=O)c2)CCC1(C)C	ZINC000875075630	DD	On-Demand	Anodyne	TRY2_BOVIN	78	34
CN1CCN(C(=O)NCc2cccc(C(N)=O)c2)CCC1(C)C	ZINC000875075630	DD	On-Demand	Anodyne	TPSAB1	17	41
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cccc(C(N)=O)c2)CC1	ZINC000875075650	GG	On-Demand	Anodyne	HTR1A	19	46
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cccc(C(N)=O)c2)CC1	ZINC000875075650	GG	On-Demand	Anodyne	DRD2	22	49
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cccc(C(N)=O)c2)CC1	ZINC000875075650	GG	On-Demand	Anodyne	DRD4	18	49
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cccc(C(N)=O)c2)CC1	ZINC000875075650	GG	On-Demand	Anodyne	F10	16	40
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cccc(C(N)=O)c2)CC1	ZINC000875075650	GG	On-Demand	Anodyne	CCR3	18	40
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cccc(C(N)=O)c2)CC1	ZINC000875075650	GG	On-Demand	Anodyne	ST14	55	36
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cccc(C(N)=O)c2)CC1	ZINC000875075650	GG	On-Demand	Anodyne	TMPRSS11D	52	31
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cccc(C(N)=O)c2)CC1	ZINC000875075650	GG	On-Demand	Anodyne	ACKR3	55	31
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cccc(C(N)=O)c2)CC1	ZINC000875075651	GG	On-Demand	Anodyne	HTR1A	19	46
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cccc(C(N)=O)c2)CC1	ZINC000875075651	GG	On-Demand	Anodyne	DRD2	22	49
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cccc(C(N)=O)c2)CC1	ZINC000875075651	GG	On-Demand	Anodyne	DRD4	18	49
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cccc(C(N)=O)c2)CC1	ZINC000875075651	GG	On-Demand	Anodyne	F10	16	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cccc(C(N)=O)c2)CC1	ZINC000875075651	GG	On-Demand	Anodyne	CCR3	18	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cccc(C(N)=O)c2)CC1	ZINC000875075651	GG	On-Demand	Anodyne	ST14	55	36
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cccc(C(N)=O)c2)CC1	ZINC000875075651	GG	On-Demand	Anodyne	TMPRSS11D	52	31
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cccc(C(N)=O)c2)CC1	ZINC000875075651	GG	On-Demand	Anodyne	ACKR3	55	31
CC[C@@H](NC(=O)NCc1cccc(C(=O)N(C)C)c1)[C@@H](O)c1ccccc1	ZINC000875075679	FF	On-Demand	Anodyne	PDS	47	36
CC[C@@H](NC(=O)NCc1cccc(C(=O)N(C)C)c1)[C@H](O)c1ccccc1	ZINC000875075682	FF	On-Demand	Anodyne	PDS	47	36
NC(=O)c1cccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875075683	FF	On-Demand	Anodyne	F2	51	43
NC(=O)c1cccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875075683	FF	On-Demand	Anodyne	PLG	40	38
NC(=O)c1cccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875075683	FF	On-Demand	Anodyne	FKBP1A	44	39
NC(=O)c1cccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875075683	FF	On-Demand	Anodyne	OPRK1	15	42
NC(=O)c1cccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875075683	FF	On-Demand	Anodyne	F10	19	40
NC(=O)c1cccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875075683	FF	On-Demand	Anodyne	TRY2_BOVIN	40	39
NC(=O)c1cccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875075683	FF	On-Demand	Anodyne	TRY1_BOVIN	48	39
NC(=O)c1cccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875075683	FF	On-Demand	Anodyne	PREP	46	41
NC(=O)c1cccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875075683	FF	On-Demand	Anodyne	TPSAB1	15	40
NC(=O)c1cccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875075683	FF	On-Demand	Anodyne	ST14	49	37
NC(=O)c1cccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875075683	FF	On-Demand	Anodyne	TMPRSS11D	71	38
NC(=O)c1cccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875075684	FF	On-Demand	Anodyne	F2	51	43
NC(=O)c1cccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875075684	FF	On-Demand	Anodyne	PLG	40	38
NC(=O)c1cccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875075684	FF	On-Demand	Anodyne	FKBP1A	44	39
NC(=O)c1cccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875075684	FF	On-Demand	Anodyne	OPRK1	15	42
NC(=O)c1cccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875075684	FF	On-Demand	Anodyne	F10	19	40
NC(=O)c1cccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875075684	FF	On-Demand	Anodyne	TRY2_BOVIN	40	39
NC(=O)c1cccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875075684	FF	On-Demand	Anodyne	TRY1_BOVIN	48	39
NC(=O)c1cccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875075684	FF	On-Demand	Anodyne	PREP	46	41
NC(=O)c1cccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875075684	FF	On-Demand	Anodyne	TPSAB1	15	40
NC(=O)c1cccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875075684	FF	On-Demand	Anodyne	ST14	49	37
NC(=O)c1cccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875075684	FF	On-Demand	Anodyne	TMPRSS11D	71	38
NC(=O)c1cccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875075685	FF	On-Demand	Anodyne	F2	51	43
NC(=O)c1cccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875075685	FF	On-Demand	Anodyne	PLG	40	38
NC(=O)c1cccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875075685	FF	On-Demand	Anodyne	FKBP1A	44	39
NC(=O)c1cccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875075685	FF	On-Demand	Anodyne	OPRK1	15	42
NC(=O)c1cccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875075685	FF	On-Demand	Anodyne	F10	19	40
NC(=O)c1cccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875075685	FF	On-Demand	Anodyne	TRY2_BOVIN	40	39
NC(=O)c1cccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875075685	FF	On-Demand	Anodyne	TRY1_BOVIN	48	39
NC(=O)c1cccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875075685	FF	On-Demand	Anodyne	PREP	46	41
NC(=O)c1cccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875075685	FF	On-Demand	Anodyne	TPSAB1	15	40
NC(=O)c1cccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875075685	FF	On-Demand	Anodyne	ST14	49	37
NC(=O)c1cccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875075685	FF	On-Demand	Anodyne	TMPRSS11D	71	38
NC(=O)c1cccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875075686	FF	On-Demand	Anodyne	F2	51	43
NC(=O)c1cccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875075686	FF	On-Demand	Anodyne	PLG	40	38
NC(=O)c1cccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875075686	FF	On-Demand	Anodyne	FKBP1A	44	39
NC(=O)c1cccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875075686	FF	On-Demand	Anodyne	OPRK1	15	42
NC(=O)c1cccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875075686	FF	On-Demand	Anodyne	F10	19	40
NC(=O)c1cccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875075686	FF	On-Demand	Anodyne	TRY2_BOVIN	40	39
NC(=O)c1cccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875075686	FF	On-Demand	Anodyne	TRY1_BOVIN	48	39
NC(=O)c1cccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875075686	FF	On-Demand	Anodyne	PREP	46	41
NC(=O)c1cccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875075686	FF	On-Demand	Anodyne	TPSAB1	15	40
NC(=O)c1cccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875075686	FF	On-Demand	Anodyne	ST14	49	37
NC(=O)c1cccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875075686	FF	On-Demand	Anodyne	TMPRSS11D	71	38
O=C(NCC[C@H]1CCSC1)C(=O)NCc1ccc(-n2cccn2)cc1	ZINC000875075689	FD	On-Demand	Anodyne	AMP1_PLAFQ	41	34
O=C(NCC[C@@H]1CCSC1)C(=O)NCc1ccc(-n2cccn2)cc1	ZINC000875075690	FD	On-Demand	Anodyne	AMP1_PLAFQ	41	34
COCCN(CC1CCN(C)CC1)C(=O)NCc1cccc(C(N)=O)c1	ZINC000875075700	FD	On-Demand	Anodyne	ACKR3	50	31
C[C@@H]1CN(C(=O)NCc2cccc(C(N)=O)c2)CC[C@@H](C(F)(F)F)O1	ZINC000875075710	FE	On-Demand	Anodyne	ST14	63	34
C[C@@H]1CN(C(=O)NCc2cccc(C(N)=O)c2)CC[C@H](C(F)(F)F)O1	ZINC000875075711	FE	On-Demand	Anodyne	ST14	63	34
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCS(C)(=O)=O	ZINC000875075719	EC	On-Demand	Anodyne	MME	57	45
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCS(C)(=O)=O	ZINC000875075719	EC	On-Demand	Anodyne	MMP3	43	35
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCS(C)(=O)=O	ZINC000875075719	EC	On-Demand	Anodyne	CAPN1	51	39
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCS(C)(=O)=O	ZINC000875075719	EC	On-Demand	Anodyne	CAPN2	82	38
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCS(C)(=O)=O	ZINC000875075719	EC	On-Demand	Anodyne	CTSC	15	44
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCS(C)(=O)=O	ZINC000875075719	EC	On-Demand	Anodyne	AMP1_PLAFQ	38	40
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCS(C)(=O)=O	ZINC000875075720	EC	On-Demand	Anodyne	MME	57	45
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCS(C)(=O)=O	ZINC000875075720	EC	On-Demand	Anodyne	MMP3	43	35
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCS(C)(=O)=O	ZINC000875075720	EC	On-Demand	Anodyne	CAPN1	51	39
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCS(C)(=O)=O	ZINC000875075720	EC	On-Demand	Anodyne	CAPN2	82	38
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCS(C)(=O)=O	ZINC000875075720	EC	On-Demand	Anodyne	CTSC	15	44
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCS(C)(=O)=O	ZINC000875075720	EC	On-Demand	Anodyne	AMP1_PLAFQ	38	40
C#CC[C@@H](COC)NC(=O)C(=O)NCc1ccc(-n2cccn2)cc1	ZINC000875075726	EC	On-Demand	Mild	AMP1_PLAFQ	55	38
C#CC[C@H](COC)NC(=O)C(=O)NCc1ccc(-n2cccn2)cc1	ZINC000875075727	EC	On-Demand	Mild	AMP1_PLAFQ	55	38
O=C(NCc1ccc(-n2cccn2)cc1)C(=O)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875075731	GD	On-Demand	Anodyne	AMP1_PLAFQ	51	36
O=C(NCc1ccc(-n2cccn2)cc1)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875075732	GD	On-Demand	Anodyne	AMP1_PLAFQ	51	36
O=C(NCc1ccc(-n2cccn2)cc1)C(=O)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875075733	GD	On-Demand	Anodyne	AMP1_PLAFQ	51	36
O=C(NCc1ccc(-n2cccn2)cc1)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875075734	GD	On-Demand	Anodyne	AMP1_PLAFQ	51	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(C(=O)N(C)C)c1	ZINC000875075741	FD	On-Demand	Anodyne	SLC6A3	50	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(C(=O)N(C)C)c1	ZINC000875075742	FD	On-Demand	Anodyne	SLC6A3	50	39
O=C(Oc1ccc(C(F)(F)F)cc1)c1ccc2nccnc2c1	ZINC000875075767	DH	On-Demand	Anodyne	ACR	58	31
CC[C@H](C)NC(=O)c1cccc(CNC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)c1	ZINC000875075784	GE	On-Demand	Anodyne	SLC6A3	46	38
CC[C@H](C)NC(=O)c1cccc(CNC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)c1	ZINC000875075787	GE	On-Demand	Anodyne	SLC6A3	46	38
CCCNC(=O)c1cccc(CNC(=O)N(CC)[C@H](C)[C@@H](O)c2ccccc2)c1	ZINC000875075793	GG	On-Demand	Anodyne	BACE1	19	40
CCCNC(=O)c1cccc(CNC(=O)N(CC)[C@H](C)[C@@H](O)c2ccccc2)c1	ZINC000875075793	GG	On-Demand	Anodyne	NPR	56	37
CCCNC(=O)c1cccc(CNC(=O)N(CC)[C@@H](C)[C@@H](O)c2ccccc2)c1	ZINC000875075794	GG	On-Demand	Anodyne	BACE1	19	40
CCCNC(=O)c1cccc(CNC(=O)N(CC)[C@@H](C)[C@@H](O)c2ccccc2)c1	ZINC000875075794	GG	On-Demand	Anodyne	NPR	56	37
CCCNC(=O)c1cccc(CNC(=O)N(CC)[C@H](C)[C@H](O)c2ccccc2)c1	ZINC000875075795	GG	On-Demand	Anodyne	BACE1	19	40
CCCNC(=O)c1cccc(CNC(=O)N(CC)[C@H](C)[C@H](O)c2ccccc2)c1	ZINC000875075795	GG	On-Demand	Anodyne	NPR	56	37
CCCNC(=O)c1cccc(CNC(=O)N(CC)[C@@H](C)[C@H](O)c2ccccc2)c1	ZINC000875075796	GG	On-Demand	Anodyne	BACE1	19	40
CCCNC(=O)c1cccc(CNC(=O)N(CC)[C@@H](C)[C@H](O)c2ccccc2)c1	ZINC000875075796	GG	On-Demand	Anodyne	NPR	56	37
O=C(NCc1ccccc1N1CCOCC1)C(=O)NCc1cccc2[nH]ccc12	ZINC000875075806	GD	On-Demand	Anodyne	PIK3CD	18	44
O=C(NCc1ccccc1N1CCOCC1)C(=O)NCc1cccc2[nH]ccc12	ZINC000875075806	GD	On-Demand	Anodyne	SCN10A	16	48
O=C(NCc1ccccc1N1CCOCC1)C(=O)NCc1cccc2[nH]ccc12	ZINC000875075806	GD	On-Demand	Anodyne	PIK3CB	23	40
O=C(NCc1ccccc1N1CCOCC1)C(=O)NCc1cccc2[nH]ccc12	ZINC000875075806	GD	On-Demand	Anodyne	ATR	46	41
O=C(NCc1ccc(-n2cccn2)cc1)C(=O)N[C@H]1CC12CCC2	ZINC000875075815	DD	On-Demand	Anodyne	AMP1_PLAFQ	50	36
O=C(NCc1ccc(-n2cccn2)cc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875075816	DD	On-Demand	Anodyne	AMP1_PLAFQ	50	36
COCC(C)(C)CCNC(=O)C(=O)NCc1ccc(-n2cccn2)cc1	ZINC000875075848	FD	On-Demand	Anodyne	AMP1_PLAFQ	56	41
NC(=O)c1cccc(CNC(=O)NC2CC(Nc3ccccc3)C2)c1	ZINC000875075850	EE	On-Demand	Anodyne	EPHX2	19	43
NC(=O)c1cccc(CNC(=O)NC2CC(Nc3ccccc3)C2)c1	ZINC000875075850	EE	On-Demand	Anodyne	ST14	15	40
Cn1cccc1CNC(=O)C(=O)N1CCN(c2cccc(F)c2)CC1	ZINC000875075864	ED	On-Demand	Anodyne	SSTR1	17	41
CN1CCN(C2CCN(C(=O)C(=O)NCc3cccn3C)CC2)CC1	ZINC000875075868	EB	On-Demand	Anodyne	L3MBTL3	70	42
COCC(C)(C)CCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1	ZINC000875075878	GD	On-Demand	Clean	STAT6	52	34
CN1CCN(C2CCN(C(=O)C(=O)NCc3ccc4c(c3)CCO4)CC2)CC1	ZINC000875075886	GC	On-Demand	Anodyne	L3MBTL3	46	37
CCCNC(=O)c1cccc(CNC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)c1	ZINC000875075887	FE	On-Demand	Anodyne	DRD4	42	32
CCCNC(=O)c1cccc(CNC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)c1	ZINC000875075887	FE	On-Demand	Anodyne	SLC6A3	40	38
CCCNC(=O)c1cccc(CNC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)c1	ZINC000875075888	FE	On-Demand	Anodyne	DRD4	42	32
CCCNC(=O)c1cccc(CNC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)c1	ZINC000875075888	FE	On-Demand	Anodyne	SLC6A3	40	38
CCCNC(=O)c1cccc(CNC(=O)N[C@@H]2C[C@H]3C[C@@]3(C(=O)OC)C2)c1	ZINC000875075894	FD	On-Demand	Anodyne	DRD4	42	32
Cn1cccc1CNC(=O)C(=O)N[C@H](c1ccccn1)C1CCC1	ZINC000875075901	ED	On-Demand	Anodyne	TTK	29	41
Cn1cccc1CNC(=O)C(=O)N[C@@H](c1ccccn1)C1CCC1	ZINC000875075902	ED	On-Demand	Anodyne	TTK	29	41
CCCCCCCNC(=O)C(=O)NCCS(C)(=O)=O	ZINC000875075913	CC	On-Demand	Mild	ASAH1	86	35
CCCCCCCNC(=O)C(=O)NCCS(C)(=O)=O	ZINC000875075913	CC	On-Demand	Mild	CQSS	48	30
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(C(=O)N(C)C)c1	ZINC000875075926	DD	On-Demand	Anodyne	ANPEP	17	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(C(=O)N(C)C)c1	ZINC000875075926	DD	On-Demand	Anodyne	PDS	48	33
O=C(NCCCCC1CC1)C(=O)NCc1ccc(-n2cccn2)cc1	ZINC000875075935	EE	On-Demand	Anodyne	AMP1_PLAFQ	58	34
CN(C)C(=O)c1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875075941	FD	On-Demand	Anodyne	DRD4	22	42
CN(C)C(=O)c1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875075941	FD	On-Demand	Anodyne	CCR2	27	40
CN(C)C(=O)c1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875075941	FD	On-Demand	Anodyne	MCHR1	15	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(Cl)s1	ZINC000875075954	EG	On-Demand	Anodyne	SLC6A4	25	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(Cl)s1	ZINC000875075954	EG	On-Demand	Anodyne	SLC6A3	48	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(Cl)s1	ZINC000875075956	EG	On-Demand	Anodyne	SLC6A4	25	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(Cl)s1	ZINC000875075956	EG	On-Demand	Anodyne	SLC6A3	48	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(Cl)s1	ZINC000875075957	EG	On-Demand	Anodyne	SLC6A4	25	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(Cl)s1	ZINC000875075957	EG	On-Demand	Anodyne	SLC6A3	48	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(Cl)s1	ZINC000875075958	EG	On-Demand	Anodyne	SLC6A4	25	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(Cl)s1	ZINC000875075958	EG	On-Demand	Anodyne	SLC6A3	48	43
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(Cl)s1	ZINC000875075961	EE	On-Demand	Anodyne	CACNA1H	41	36
O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@H]1CC12CCC2	ZINC000875075966	ED	On-Demand	Clean	STAT6	51	35
O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875075968	ED	On-Demand	Clean	STAT6	51	35
CCCNC(=O)c1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875075970	GG	On-Demand	Anodyne	F2	31	40
CCCNC(=O)c1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875075970	GG	On-Demand	Anodyne	PREP	44	41
CCCNC(=O)c1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875075970	GG	On-Demand	Anodyne	TMPRSS11D	66	35
CCCNC(=O)c1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875075971	GG	On-Demand	Anodyne	F2	31	40
CCCNC(=O)c1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875075971	GG	On-Demand	Anodyne	PREP	44	41
CCCNC(=O)c1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875075971	GG	On-Demand	Anodyne	TMPRSS11D	66	35
CCCNC(=O)c1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875075973	GG	On-Demand	Anodyne	F2	31	40
CCCNC(=O)c1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875075973	GG	On-Demand	Anodyne	PREP	44	41
CCCNC(=O)c1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875075973	GG	On-Demand	Anodyne	TMPRSS11D	66	35
CCCNC(=O)c1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875075974	GG	On-Demand	Anodyne	F2	31	40
CCCNC(=O)c1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875075974	GG	On-Demand	Anodyne	PREP	44	41
CCCNC(=O)c1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875075974	GG	On-Demand	Anodyne	TMPRSS11D	66	35
CCCCCCCNC(=O)C(=O)NCc1ccc2c(c1)CCO2	ZINC000875075995	DE	On-Demand	Mild	ASAH1	57	33
CC[C@H](C)NC(=O)c1cccc(CNC(=O)N[C@H](CC)C[C@H](C)O)c1	ZINC000875076008	EF	On-Demand	Anodyne	ANPEP	17	42
CC[C@H](C)NC(=O)c1cccc(CNC(=O)N[C@H](CC)C[C@H](C)O)c1	ZINC000875076008	EF	On-Demand	Anodyne	PDS	48	33
CC[C@H](C)NC(=O)c1cccc(CNC(=O)N[C@H](CC)C[C@@H](C)O)c1	ZINC000875076010	EF	On-Demand	Anodyne	ANPEP	17	42
CC[C@H](C)NC(=O)c1cccc(CNC(=O)N[C@H](CC)C[C@@H](C)O)c1	ZINC000875076010	EF	On-Demand	Anodyne	PDS	48	33
CC[C@H](C)NC(=O)c1cccc(CNC(=O)N[C@@H](CC)C[C@@H](C)O)c1	ZINC000875076011	EF	On-Demand	Anodyne	ANPEP	17	42
CC[C@H](C)NC(=O)c1cccc(CNC(=O)N[C@@H](CC)C[C@@H](C)O)c1	ZINC000875076011	EF	On-Demand	Anodyne	PDS	48	33
CC[C@H](C)NC(=O)c1cccc(CNC(=O)N[C@@H](CC)C[C@H](C)O)c1	ZINC000875076012	EF	On-Demand	Anodyne	ANPEP	17	42
CC[C@H](C)NC(=O)c1cccc(CNC(=O)N[C@@H](CC)C[C@H](C)O)c1	ZINC000875076012	EF	On-Demand	Anodyne	PDS	48	33
CCCNC(=O)c1cccc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875076055	FF	On-Demand	Anodyne	DRD4	41	32
CCCNC(=O)c1cccc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875076055	FF	On-Demand	Anodyne	CHRM3	18	40
CCCNC(=O)c1cccc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875076055	FF	On-Demand	Anodyne	CACNA1I	48	37
CCCNC(=O)c1cccc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875076056	FF	On-Demand	Anodyne	DRD4	41	32
CCCNC(=O)c1cccc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875076056	FF	On-Demand	Anodyne	CHRM3	18	40
CCCNC(=O)c1cccc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875076056	FF	On-Demand	Anodyne	CACNA1I	48	37
O=C(NCc1ccc(N2CCOCC2)cc1)C(=O)NCc1ncc(Cl)s1	ZINC000875076057	GD	On-Demand	Clean	STAT6	72	39
CCC[C@@H](CNC(=O)C(=O)NCc1ccccc1N1CCOCC1)OCC	ZINC000875076058	GD	On-Demand	Anodyne	KCNQ2	44	36
CCC[C@H](CNC(=O)C(=O)NCc1ccccc1N1CCOCC1)OCC	ZINC000875076059	GD	On-Demand	Anodyne	KCNQ2	44	36
CCC(F)(F)C(C)(C)CNC(=O)C(=O)NCc1ccccc1N1CCOCC1	ZINC000875076086	GE	On-Demand	Anodyne	KCNQ2	61	34
CCC(F)(F)C(C)(C)CNC(=O)C(=O)NCc1ccccc1N1CCOCC1	ZINC000875076086	GE	On-Demand	Anodyne	SCN10A	15	45
COc1ccc([C@@H]2CCN(C(=O)C(=O)NCc3cccn3C)C2)cc1F	ZINC000875076092	FD	On-Demand	Anodyne	ACKR3	44	32
Cn1cccc1CNC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875076094	FD	On-Demand	Anodyne	NPY2R	73	37
Cn1cccc1CNC(=O)C(=O)NCc1ccc(Cl)c(C(F)(F)F)c1	ZINC000875076098	FF	On-Demand	Anodyne	P2RX7	31	45
COc1ccc([C@@H]2CN(C(=O)C(=O)NCc3ccc4c(c3)CCO4)CCO2)cc1	ZINC000875076112	GD	On-Demand	Anodyne	EDNRA	29	42
COc1ccc([C@@H]2CN(C(=O)C(=O)NCc3ccc4c(c3)CCO4)CCO2)cc1	ZINC000875076112	GD	On-Demand	Anodyne	NOS2	53	33
CCCNC(=O)c1cccc(CNC(=O)N2CCC[C@@H](CCC(=O)OC)C2)c1	ZINC000875076122	GF	On-Demand	Anodyne	DRD4	44	34
CCCNC(=O)c1cccc(CNC(=O)N2CCC[C@H](CCC(=O)OC)C2)c1	ZINC000875076123	GF	On-Demand	Anodyne	DRD4	44	34
CCCCCCCNC(=O)C(=O)NCc1ccccc1N1CCOCC1	ZINC000875076126	FE	On-Demand	Mild	HTR1A	21	44
CCCCCCCNC(=O)C(=O)NCc1ccccc1N1CCOCC1	ZINC000875076126	FE	On-Demand	Mild	DRD2	27	44
CCCCCCCNC(=O)C(=O)NCc1ccccc1N1CCOCC1	ZINC000875076126	FE	On-Demand	Mild	DRD3	52	35
CCCCCCCNC(=O)C(=O)NCc1ccccc1N1CCOCC1	ZINC000875076126	FE	On-Demand	Mild	KCNQ2	55	34
CCCCCCCNC(=O)C(=O)NCc1ccccc1N1CCOCC1	ZINC000875076126	FE	On-Demand	Mild	SCN10A	15	47
CCCCCCCNC(=O)C(=O)NCc1ccccc1N1CCOCC1	ZINC000875076126	FE	On-Demand	Mild	ASAH1	87	51
CN(C)C(=O)c1cccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875076164	ED	On-Demand	Anodyne	ST14	62	35
CN(C)C(=O)c1cccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875076165	ED	On-Demand	Anodyne	ST14	62	35
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(Oc3ccccc3)cc2)CC1	ZINC000875076180	GF	On-Demand	Anodyne	LTA4H	63	44
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(Oc3ccccc3)cc2)CC1	ZINC000875076180	GF	On-Demand	Anodyne	MMP13	27	41
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(Oc3ccccc3)cc2)CC1	ZINC000875076180	GF	On-Demand	Anodyne	EPHX2	20	42
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1ccc(OC(F)F)cc1	ZINC000875076193	EG	On-Demand	Anodyne	ACACA	23	41
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1ccc(OC(F)F)cc1	ZINC000875076193	EG	On-Demand	Anodyne	ACACB	23	41
O=C(NCc1ccc(Oc2ccccc2)cc1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875076196	GD	On-Demand	Anodyne	MMP13	23	41
CN(C)C(=O)c1cccc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)c1	ZINC000875076197	GE	On-Demand	Anodyne	CHRM3	15	40
CN(C)C(=O)c1cccc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)c1	ZINC000875076197	GE	On-Demand	Anodyne	FAAH	18	44
CN(C)C(=O)c1cccc(CNC(=O)NC2(C)CCC(C)(C)CC2)c1	ZINC000875076200	EH	On-Demand	Anodyne	ROCK2	15	40
CN(C)C(=O)c1cccc(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000875076204	GE	On-Demand	Anodyne	CTSV	28	41
CN(C)C(=O)c1cccc(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000875076204	GE	On-Demand	Anodyne	PDS	48	37
CN(C)C(=O)c1cccc(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000875076205	GE	On-Demand	Anodyne	CTSV	28	41
CN(C)C(=O)c1cccc(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000875076205	GE	On-Demand	Anodyne	PDS	48	37
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(-n4cccn4)cc3)CC[C@H]21	ZINC000875076209	FD	On-Demand	Anodyne	AMP1_PLAFQ	49	33
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(-n4cccn4)cc3)CC[C@@H]21	ZINC000875076211	FD	On-Demand	Anodyne	AMP1_PLAFQ	49	33
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1cccc(OC(F)F)c1	ZINC000875076214	GH	On-Demand	Anodyne	CACNA1H	33	41
NC(=O)c1cccc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)c1	ZINC000875076224	FD	On-Demand	Anodyne	FAAH	23	43
NC(=O)c1cccc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)c1	ZINC000875076224	FD	On-Demand	Anodyne	NPFFR1	47	38
CN(C)C(=O)c1cccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875076230	GG	On-Demand	Anodyne	F2	27	41
CN(C)C(=O)c1cccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875076230	GG	On-Demand	Anodyne	FKBP1A	40	40
CN(C)C(=O)c1cccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875076230	GG	On-Demand	Anodyne	OPRK1	20	41
CN(C)C(=O)c1cccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875076230	GG	On-Demand	Anodyne	PREP	36	40
CN(C)C(=O)c1cccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875076230	GG	On-Demand	Anodyne	TMPRSS11D	63	34
CN(C)C(=O)c1cccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875076232	GG	On-Demand	Anodyne	F2	27	41
CN(C)C(=O)c1cccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875076232	GG	On-Demand	Anodyne	FKBP1A	40	40
CN(C)C(=O)c1cccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875076232	GG	On-Demand	Anodyne	OPRK1	20	41
CN(C)C(=O)c1cccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875076232	GG	On-Demand	Anodyne	PREP	36	40
CN(C)C(=O)c1cccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875076232	GG	On-Demand	Anodyne	TMPRSS11D	63	34
CN(C)C(=O)c1cccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875076233	GG	On-Demand	Anodyne	F2	27	41
CN(C)C(=O)c1cccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875076233	GG	On-Demand	Anodyne	FKBP1A	40	40
CN(C)C(=O)c1cccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875076233	GG	On-Demand	Anodyne	OPRK1	20	41
CN(C)C(=O)c1cccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875076233	GG	On-Demand	Anodyne	PREP	36	40
CN(C)C(=O)c1cccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875076233	GG	On-Demand	Anodyne	TMPRSS11D	63	34
CN(C)C(=O)c1cccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875076234	GG	On-Demand	Anodyne	F2	27	41
CN(C)C(=O)c1cccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875076234	GG	On-Demand	Anodyne	FKBP1A	40	40
CN(C)C(=O)c1cccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875076234	GG	On-Demand	Anodyne	OPRK1	20	41
CN(C)C(=O)c1cccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875076234	GG	On-Demand	Anodyne	PREP	36	40
CN(C)C(=O)c1cccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875076234	GG	On-Demand	Anodyne	TMPRSS11D	63	34
CCCNC(=O)c1cccc(CNC(=O)N2CCN(C)C(C)(C)CC2)c1	ZINC000875076235	FE	On-Demand	Anodyne	DRD4	43	33
Cn1cccc1CNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875076237	FD	On-Demand	Anodyne	ETHR	65	45
N#Cc1cc(C(=O)N2CCCc3cc(S(=O)(=O)N4CCCC4)ccc32)co1	ZINC000875076239	GF	On-Demand	Mild	AVPR2	24	43
N#Cc1cc(C(=O)N2CCCc3cc(S(=O)(=O)N4CCCC4)ccc32)co1	ZINC000875076239	GF	On-Demand	Mild	AKR1C3	45	36
NC(=O)c1cccc(CNC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)c1	ZINC000875076250	ED	On-Demand	Anodyne	KCNH2	43	41
NC(=O)c1cccc(CNC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)c1	ZINC000875076250	ED	On-Demand	Anodyne	ST14	66	33
CCCNC(=O)c1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875076256	GD	On-Demand	Anodyne	CACNA1H	16	40
CCCNC(=O)c1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875076256	GD	On-Demand	Anodyne	DRD4	40	31
CCCNC(=O)c1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875076256	GD	On-Demand	Anodyne	CHRM3	26	40
CCCNC(=O)c1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875076256	GD	On-Demand	Anodyne	CCR2	47	44
CCCNC(=O)c1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875076256	GD	On-Demand	Anodyne	MCHR1	17	41
CCCNC(=O)c1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875076256	GD	On-Demand	Anodyne	CACNA1I	45	36
CC[C@H](C)NC(=O)c1cccc(CNC(=O)NN(C)C(=O)OC)c1	ZINC000875076301	ED	On-Demand	Reactive	ROCK2	21	40
CC[C@H](C)NC(=O)c1cccc(CNC(=O)NN(C)C(=O)OC)c1	ZINC000875076301	ED	On-Demand	Reactive	PDS	41	32
CC[C@H](C)NC(=O)c1cccc(CNC(=O)N(C)OCC(F)(F)F)c1	ZINC000875076304	FF	On-Demand	Anodyne	PDS	48	35
CCCCCCCNC(=O)C(=O)NCc1c(C)nn(C)c1C	ZINC000875076331	DD	On-Demand	Mild	ASAH1	83	36
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1cccc(OC(F)F)c1	ZINC000875076349	FE	On-Demand	Anodyne	CACNA1H	37	43
O=C(NCCC(=O)Oc1ccc(C(F)(F)F)cc1)NC12CC3CC(CC(C3)C1)C2	ZINC000875076370	HI	On-Demand	Anodyne	EPHX2	121	57
NC(=O)c1cccc(CNC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)c1	ZINC000875076389	GF	On-Demand	Anodyne	KCNH2	41	42
NC(=O)c1cccc(CNC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)c1	ZINC000875076389	GF	On-Demand	Anodyne	F11	40	33
NC(=O)c1cccc(CNC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)c1	ZINC000875076389	GF	On-Demand	Anodyne	TMPRSS11D	45	32
CCCNC(=O)c1cccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875076393	GG	On-Demand	Anodyne	DRD4	42	32
CCCNC(=O)c1cccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875076394	GG	On-Demand	Anodyne	DRD4	42	32
O=C(NCc1ccc2c(c1)CCO2)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875076410	GD	On-Demand	Anodyne	TMPRSS11D	51	33
O=C(NCc1ccc2c(c1)CCO2)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875076412	GD	On-Demand	Anodyne	TMPRSS11D	51	33
O=C(NCc1ccc2c(c1)CCO2)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875076414	GD	On-Demand	Anodyne	TMPRSS11D	51	33
O=C(NCc1ccc2c(c1)CCO2)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875076415	GD	On-Demand	Anodyne	TMPRSS11D	51	33
CCCNC(=O)c1cccc(CNC(=O)N(CC)OCC)c1	ZINC000875076420	DE	On-Demand	Anodyne	DRD4	41	31
CCCNC(=O)c1cccc(CNC(=O)N(CCOC)C2CCOCC2)c1	ZINC000875076423	GE	On-Demand	Anodyne	DRD4	40	32
O=C(NCc1ncc(Cl)s1)C(=O)NCc1ccccc1N1CCOCC1	ZINC000875076424	GD	On-Demand	Anodyne	SCN2A	18	41
O=C(NCc1ncc(Cl)s1)C(=O)NCc1ccccc1N1CCOCC1	ZINC000875076424	GD	On-Demand	Anodyne	SCN10A	28	53
NC(=O)c1cccc(CNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)c1	ZINC000875076428	FD	On-Demand	Anodyne	FABP4	16	41
NC(=O)c1cccc(CNC(=O)N2CCC[C@](O)(c3ccccc3)C2)c1	ZINC000875076430	FD	On-Demand	Anodyne	FABP4	16	41
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(-n3cccn3)cc2)CC1	ZINC000875076441	FD	On-Demand	Anodyne	AMP1_PLAFQ	57	33
Cn1cccc1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875076446	GE	On-Demand	Anodyne	DRD2	27	44
Cn1cccc1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875076446	GE	On-Demand	Anodyne	DRD4	50	43
Cn1cccc1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875076446	GE	On-Demand	Anodyne	ACHE	67	59
Cn1cccc1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875076446	GE	On-Demand	Anodyne	DRD3	22	43
Cn1cccc1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875076446	GE	On-Demand	Anodyne	SLC6A3	21	47
Cn1cccc1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875076446	GE	On-Demand	Anodyne	HTR4	25	40
Cn1cccc1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875076446	GE	On-Demand	Anodyne	SIGMAR1	62	44
Cn1cccc1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875076446	GE	On-Demand	Anodyne	BCHE	21	48
Cn1cccc1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875076446	GE	On-Demand	Anodyne	CCR3	45	43
Cn1cccc1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875076446	GE	On-Demand	Anodyne	MCHR1	26	51
Cn1cccc1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875076446	GE	On-Demand	Anodyne	CACNA1G	28	41
CCC1(CC)CCCN1C(=O)NCc1cccc(C(N)=O)c1	ZINC000875076458	DF	On-Demand	Anodyne	FABP4	16	42
CCC1(CC)CCCN1C(=O)NCc1cccc(C(N)=O)c1	ZINC000875076458	DF	On-Demand	Anodyne	SLC12A5	62	35
CCCNC(=O)c1cccc(CNC(=O)N2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000875076476	GF	On-Demand	Anodyne	CCR2	41	36
CCCNC(=O)c1cccc(CNC(=O)N2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000875076477	GF	On-Demand	Anodyne	CCR2	41	36
CCCNC(=O)c1cccc(CNC(=O)N(Cc2ccccc2)[C@H](CC)CO)c1	ZINC000875076486	GG	On-Demand	Anodyne	PDS	51	33
O=C(NCc1ccccc1N1CCOCC1)C(=O)N[C@H]1CC12CCC2	ZINC000875076492	ED	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1ccccc1N1CCOCC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875076493	ED	On-Demand	Anodyne	SCN10A	15	44
NC(=O)c1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875076515	FE	On-Demand	Anodyne	F2	60	46
NC(=O)c1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875076515	FE	On-Demand	Anodyne	PLG	46	40
NC(=O)c1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875076515	FE	On-Demand	Anodyne	PRSS1	41	40
NC(=O)c1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875076515	FE	On-Demand	Anodyne	OPRK1	15	42
NC(=O)c1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875076515	FE	On-Demand	Anodyne	F10	21	41
NC(=O)c1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875076515	FE	On-Demand	Anodyne	TRY2_BOVIN	47	36
NC(=O)c1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875076515	FE	On-Demand	Anodyne	TRY1_BOVIN	55	42
NC(=O)c1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875076515	FE	On-Demand	Anodyne	PREP	55	44
NC(=O)c1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875076515	FE	On-Demand	Anodyne	ST14	51	39
NC(=O)c1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875076515	FE	On-Demand	Anodyne	TMPRSS11D	77	40
NC(=O)c1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875076516	FE	On-Demand	Anodyne	F2	60	46
NC(=O)c1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875076516	FE	On-Demand	Anodyne	PLG	46	40
NC(=O)c1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875076516	FE	On-Demand	Anodyne	PRSS1	41	40
NC(=O)c1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875076516	FE	On-Demand	Anodyne	OPRK1	15	42
NC(=O)c1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875076516	FE	On-Demand	Anodyne	F10	21	41
NC(=O)c1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875076516	FE	On-Demand	Anodyne	TRY2_BOVIN	47	36
NC(=O)c1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875076516	FE	On-Demand	Anodyne	TRY1_BOVIN	55	42
NC(=O)c1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875076516	FE	On-Demand	Anodyne	PREP	55	44
NC(=O)c1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875076516	FE	On-Demand	Anodyne	ST14	51	39
NC(=O)c1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875076516	FE	On-Demand	Anodyne	TMPRSS11D	77	40
NC(=O)c1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875076517	FE	On-Demand	Anodyne	F2	60	46
NC(=O)c1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875076517	FE	On-Demand	Anodyne	PLG	46	40
NC(=O)c1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875076517	FE	On-Demand	Anodyne	PRSS1	41	40
NC(=O)c1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875076517	FE	On-Demand	Anodyne	OPRK1	15	42
NC(=O)c1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875076517	FE	On-Demand	Anodyne	F10	21	41
NC(=O)c1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875076517	FE	On-Demand	Anodyne	TRY2_BOVIN	47	36
NC(=O)c1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875076517	FE	On-Demand	Anodyne	TRY1_BOVIN	55	42
NC(=O)c1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875076517	FE	On-Demand	Anodyne	PREP	55	44
NC(=O)c1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875076517	FE	On-Demand	Anodyne	ST14	51	39
NC(=O)c1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875076517	FE	On-Demand	Anodyne	TMPRSS11D	77	40
NC(=O)c1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875076518	FE	On-Demand	Anodyne	F2	60	46
NC(=O)c1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875076518	FE	On-Demand	Anodyne	PLG	46	40
NC(=O)c1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875076518	FE	On-Demand	Anodyne	PRSS1	41	40
NC(=O)c1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875076518	FE	On-Demand	Anodyne	OPRK1	15	42
NC(=O)c1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875076518	FE	On-Demand	Anodyne	F10	21	41
NC(=O)c1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875076518	FE	On-Demand	Anodyne	TRY2_BOVIN	47	36
NC(=O)c1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875076518	FE	On-Demand	Anodyne	TRY1_BOVIN	55	42
NC(=O)c1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875076518	FE	On-Demand	Anodyne	PREP	55	44
NC(=O)c1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875076518	FE	On-Demand	Anodyne	ST14	51	39
NC(=O)c1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875076518	FE	On-Demand	Anodyne	TMPRSS11D	77	40
NC(=O)c1cccc(CNC(=O)N2CCCN(C=O)CC2)c1	ZINC000875076536	DC	On-Demand	Anodyne	TRY2_BOVIN	78	42
CC(=O)C1CCN(C(=O)C(=O)NCc2ccccc2N2CCOCC2)CC1	ZINC000875076548	FC	On-Demand	Anodyne	SCN10A	15	46
CCCNC(=O)c1cccc(CNC(=O)N2CC([C@H](C)C(=O)OCC)C2)c1	ZINC000875076554	GE	On-Demand	Anodyne	DRD4	41	33
CCCNC(=O)c1cccc(CNC(=O)N2CC([C@@H](C)C(=O)OCC)C2)c1	ZINC000875076555	GE	On-Demand	Anodyne	DRD4	41	33
CCCNC(=O)c1cccc(CNC(=O)N2CCCN(C=O)CC2)c1	ZINC000875076560	ED	On-Demand	Anodyne	DRD4	42	33
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3cccn3C)C2)cc1	ZINC000875076561	FD	On-Demand	Anodyne	DRD4	38	49
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3cccn3C)C2)cc1	ZINC000875076561	FD	On-Demand	Anodyne	SIGMAR1	22	45
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3cccn3C)C2)cc1	ZINC000875076561	FD	On-Demand	Anodyne	CCR3	34	40
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3cccn3C)C2)cc1	ZINC000875076561	FD	On-Demand	Anodyne	MLNR	43	35
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3cccn3C)C2)cc1	ZINC000875076561	FD	On-Demand	Anodyne	CCR2	18	47
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3cccn3C)C2)cc1	ZINC000875076561	FD	On-Demand	Anodyne	MCHR1	34	49
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3cccn3C)C2)cc1	ZINC000875076562	FD	On-Demand	Anodyne	DRD4	38	49
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3cccn3C)C2)cc1	ZINC000875076562	FD	On-Demand	Anodyne	SIGMAR1	22	45
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3cccn3C)C2)cc1	ZINC000875076562	FD	On-Demand	Anodyne	CCR3	34	40
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3cccn3C)C2)cc1	ZINC000875076562	FD	On-Demand	Anodyne	MLNR	43	35
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3cccn3C)C2)cc1	ZINC000875076562	FD	On-Demand	Anodyne	CCR2	18	47
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3cccn3C)C2)cc1	ZINC000875076562	FD	On-Demand	Anodyne	MCHR1	34	49
Cc1ccc(CNC(=O)C(=O)NCc2ccccc2N2CCOCC2)o1	ZINC000875076563	FD	On-Demand	Anodyne	SCN10A	15	47
O=C(NCc1ccccc1N1CCOCC1)C(=O)NCC(C1CCC1)C1CCC1	ZINC000875076587	GE	On-Demand	Anodyne	KCNQ2	57	35
O=C(NCc1ccccc1N1CCOCC1)C(=O)NCC(C1CCC1)C1CCC1	ZINC000875076587	GE	On-Demand	Anodyne	SCN10A	15	45
CCCNC(=O)c1cccc(CNC(=O)N2CC[C@]3(C(=O)OC)CCC[C@H]23)c1	ZINC000875076599	GE	On-Demand	Anodyne	DRD4	42	32
CCCNC(=O)c1cccc(CNC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875076600	DD	On-Demand	Anodyne	DRD4	40	31
Cc1ncc([C@@H](C)NC(=O)C(=O)NCc2ccccc2N2CCOCC2)s1	ZINC000875076603	GD	On-Demand	Anodyne	SCN10A	15	44
Cc1ncc([C@H](C)NC(=O)C(=O)NCc2ccccc2N2CCOCC2)s1	ZINC000875076604	GD	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1ccccc1N1CCOCC1)C(=O)NCC1CC=CC1	ZINC000875076622	ED	On-Demand	Anodyne	SCN10A	15	48
Cc1scc(CNC(=O)C(=O)NCc2ccccc2N2CCOCC2)c1C	ZINC000875076628	GE	On-Demand	Anodyne	SCN10A	15	46
CCCNC(=O)c1cccc(CNC(=O)N[C@@H](CC)C[C@H](C)O)c1	ZINC000875076630	EE	On-Demand	Anodyne	ANPEP	20	42
CCCNC(=O)c1cccc(CNC(=O)N[C@@H](CC)C[C@H](C)O)c1	ZINC000875076630	EE	On-Demand	Anodyne	PDS	42	32
CCCNC(=O)c1cccc(CNC(=O)N[C@@H](CC)C[C@@H](C)O)c1	ZINC000875076631	EE	On-Demand	Anodyne	ANPEP	20	42
CCCNC(=O)c1cccc(CNC(=O)N[C@@H](CC)C[C@@H](C)O)c1	ZINC000875076631	EE	On-Demand	Anodyne	PDS	42	32
CCCNC(=O)c1cccc(CNC(=O)N[C@H](CC)C[C@@H](C)O)c1	ZINC000875076632	EE	On-Demand	Anodyne	ANPEP	20	42
CCCNC(=O)c1cccc(CNC(=O)N[C@H](CC)C[C@@H](C)O)c1	ZINC000875076632	EE	On-Demand	Anodyne	PDS	42	32
CCCNC(=O)c1cccc(CNC(=O)N[C@H](CC)C[C@H](C)O)c1	ZINC000875076633	EE	On-Demand	Anodyne	ANPEP	20	42
CCCNC(=O)c1cccc(CNC(=O)N[C@H](CC)C[C@H](C)O)c1	ZINC000875076633	EE	On-Demand	Anodyne	PDS	42	32
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1cccc(OC(F)F)c1	ZINC000875076649	FH	On-Demand	Anodyne	REN	16	40
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1cccc(OC(F)F)c1	ZINC000875076650	FH	On-Demand	Anodyne	REN	16	40
CN(C)C(=O)c1cccc(CNC(=O)N2Cc3cccc(O)c3C2)c1	ZINC000875076651	EE	On-Demand	Clean	NAMPT	22	42
CCCCCCCNC(=O)C(=O)NCc1ccc(-n2cccn2)cc1	ZINC000875076656	EF	On-Demand	Mild	AMP1_PLAFQ	63	42
CCCCCCCNC(=O)C(=O)NCc1ccc(-n2cccn2)cc1	ZINC000875076656	EF	On-Demand	Mild	ASAH1	94	39
COC(=O)N(C)NC(=O)N[C@H](C)c1ccc(OC(F)F)cc1	ZINC000875076665	DE	On-Demand	Reactive	ACACA	26	43
COC(=O)N(C)NC(=O)N[C@H](C)c1ccc(OC(F)F)cc1	ZINC000875076665	DE	On-Demand	Reactive	ACACB	26	43
COC(=O)N(C)NC(=O)N[C@@H](C)c1ccc(OC(F)F)cc1	ZINC000875076666	DE	On-Demand	Reactive	ACACA	26	43
COC(=O)N(C)NC(=O)N[C@@H](C)c1ccc(OC(F)F)cc1	ZINC000875076666	DE	On-Demand	Reactive	ACACB	26	43
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1cccn1C	ZINC000875076675	EE	On-Demand	Anodyne	CAPN1	18	44
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1cccn1C	ZINC000875076675	EE	On-Demand	Anodyne	CAPN2	52	44
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1cccn1C	ZINC000875076676	EE	On-Demand	Anodyne	CAPN1	18	44
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1cccn1C	ZINC000875076676	EE	On-Demand	Anodyne	CAPN2	52	44
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1ccc(-n2cccn2)cc1	ZINC000875076685	FD	On-Demand	Mild	AMP1_PLAFQ	55	37
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1ccc(-n2cccn2)cc1	ZINC000875076687	FD	On-Demand	Mild	AMP1_PLAFQ	55	37
O=C(NCc1cccc2ncccc12)C(=O)NC1CCC1	ZINC000875076720	CD	On-Demand	Anodyne	CDK5	24	43
O=C(NCCCCN1CCOCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875076723	FE	On-Demand	Anodyne	HTR1A	23	40
O=C(NCCCCN1CCOCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875076723	FE	On-Demand	Anodyne	DRD2	19	45
O=C(NCCCCN1CCOCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875076723	FE	On-Demand	Anodyne	ADRA1D	17	40
O=C(NCCCCN1CCOCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875076723	FE	On-Demand	Anodyne	HTR2A	15	42
O=C(NCCCCN1CCOCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875076723	FE	On-Demand	Anodyne	ADRA1A	27	42
O=C(NCCCCN1CCOCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875076723	FE	On-Demand	Anodyne	ADRA1B	22	42
O=C(NCCCCN1CCOCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875076723	FE	On-Demand	Anodyne	DRD3	38	45
O=C(NCCCCN1CCOCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875076723	FE	On-Demand	Anodyne	CASR	50	38
O=C(NCCCCN1CCOCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875076723	FE	On-Demand	Anodyne	TACR2	19	42
O=C(NCCCCN1CCOCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875076723	FE	On-Demand	Anodyne	EPHX2	20	41
O=C(NCCCCN1CCOCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875076723	FE	On-Demand	Anodyne	CYP2J2	44	31
O=C(NCCCCN1CCOCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875076724	FE	On-Demand	Anodyne	HTR1A	23	40
O=C(NCCCCN1CCOCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875076724	FE	On-Demand	Anodyne	DRD2	19	45
O=C(NCCCCN1CCOCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875076724	FE	On-Demand	Anodyne	ADRA1D	17	40
O=C(NCCCCN1CCOCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875076724	FE	On-Demand	Anodyne	HTR2A	15	42
O=C(NCCCCN1CCOCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875076724	FE	On-Demand	Anodyne	ADRA1A	27	42
O=C(NCCCCN1CCOCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875076724	FE	On-Demand	Anodyne	ADRA1B	22	42
O=C(NCCCCN1CCOCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875076724	FE	On-Demand	Anodyne	DRD3	38	45
O=C(NCCCCN1CCOCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875076724	FE	On-Demand	Anodyne	CASR	50	38
O=C(NCCCCN1CCOCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875076724	FE	On-Demand	Anodyne	TACR2	19	42
O=C(NCCCCN1CCOCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875076724	FE	On-Demand	Anodyne	EPHX2	20	41
O=C(NCCCCN1CCOCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875076724	FE	On-Demand	Anodyne	CYP2J2	44	31
O=C(NCCCCN1CCOCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875076725	FE	On-Demand	Anodyne	HTR1A	23	40
O=C(NCCCCN1CCOCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875076725	FE	On-Demand	Anodyne	DRD2	19	45
O=C(NCCCCN1CCOCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875076725	FE	On-Demand	Anodyne	ADRA1D	17	40
O=C(NCCCCN1CCOCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875076725	FE	On-Demand	Anodyne	HTR2A	15	42
O=C(NCCCCN1CCOCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875076725	FE	On-Demand	Anodyne	ADRA1A	27	42
O=C(NCCCCN1CCOCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875076725	FE	On-Demand	Anodyne	ADRA1B	22	42
O=C(NCCCCN1CCOCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875076725	FE	On-Demand	Anodyne	DRD3	38	45
O=C(NCCCCN1CCOCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875076725	FE	On-Demand	Anodyne	CASR	50	38
O=C(NCCCCN1CCOCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875076725	FE	On-Demand	Anodyne	TACR2	19	42
O=C(NCCCCN1CCOCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875076725	FE	On-Demand	Anodyne	EPHX2	20	41
O=C(NCCCCN1CCOCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875076725	FE	On-Demand	Anodyne	CYP2J2	44	31
O=C(NCCCCN1CCOCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875076726	FE	On-Demand	Anodyne	HTR1A	23	40
O=C(NCCCCN1CCOCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875076726	FE	On-Demand	Anodyne	DRD2	19	45
O=C(NCCCCN1CCOCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875076726	FE	On-Demand	Anodyne	ADRA1D	17	40
O=C(NCCCCN1CCOCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875076726	FE	On-Demand	Anodyne	HTR2A	15	42
O=C(NCCCCN1CCOCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875076726	FE	On-Demand	Anodyne	ADRA1A	27	42
O=C(NCCCCN1CCOCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875076726	FE	On-Demand	Anodyne	ADRA1B	22	42
O=C(NCCCCN1CCOCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875076726	FE	On-Demand	Anodyne	DRD3	38	45
O=C(NCCCCN1CCOCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875076726	FE	On-Demand	Anodyne	CASR	50	38
O=C(NCCCCN1CCOCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875076726	FE	On-Demand	Anodyne	TACR2	19	42
O=C(NCCCCN1CCOCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875076726	FE	On-Demand	Anodyne	EPHX2	20	41
O=C(NCCCCN1CCOCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875076726	FE	On-Demand	Anodyne	CYP2J2	44	31
O=C(NC1CCC1)C(=O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000875076737	EF	On-Demand	Anodyne	SIGMAR1	19	49
O=C(NC1CCC1)C(=O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000875076737	EF	On-Demand	Anodyne	CCR3	17	43
O=C(NC1CCC1)C(=O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000875076737	EF	On-Demand	Anodyne	EPHX2	44	46
O=C(NCCCCN1CCOCC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875076740	GE	On-Demand	Anodyne	HTR1A	24	42
O=C(NCCCCN1CCOCC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875076740	GE	On-Demand	Anodyne	DRD2	26	42
O=C(NCCCCN1CCOCC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875076740	GE	On-Demand	Anodyne	DRD4	15	42
O=C(NCCCCN1CCOCC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875076740	GE	On-Demand	Anodyne	HTR2A	17	42
O=C(NCCCCN1CCOCC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875076740	GE	On-Demand	Anodyne	ADRA1A	40	37
O=C(NCCCCN1CCOCC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875076740	GE	On-Demand	Anodyne	DRD3	47	40
O=C(NCCCCN1CCOCC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875076740	GE	On-Demand	Anodyne	OPRL1	16	41
O=C(NCCCCN1CCOCC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875076740	GE	On-Demand	Anodyne	EPHX2	23	42
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)NC1CCC1	ZINC000875076762	DD	On-Demand	Anodyne	ROCK1	25	41
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)NC1CCC1	ZINC000875076762	DD	On-Demand	Anodyne	ROCK2	17	41
O=C(NCCCCN1CCOCC1)NC1CC(Nc2ccccc2)C1	ZINC000875076766	EE	On-Demand	Anodyne	HTR1A	35	45
O=C(NCCCCN1CCOCC1)NC1CC(Nc2ccccc2)C1	ZINC000875076766	EE	On-Demand	Anodyne	DRD2	40	41
O=C(NCCCCN1CCOCC1)NC1CC(Nc2ccccc2)C1	ZINC000875076766	EE	On-Demand	Anodyne	HTR2A	25	40
O=C(NCCCCN1CCOCC1)NC1CC(Nc2ccccc2)C1	ZINC000875076766	EE	On-Demand	Anodyne	DRD3	70	41
O=C(NCCCCN1CCOCC1)NC1CC(Nc2ccccc2)C1	ZINC000875076766	EE	On-Demand	Anodyne	HTR4	23	40
O=C(NCCCCN1CCOCC1)NC1CC(Nc2ccccc2)C1	ZINC000875076766	EE	On-Demand	Anodyne	TACR2	15	45
O=C(NCCCCN1CCOCC1)NC1CC(Nc2ccccc2)C1	ZINC000875076766	EE	On-Demand	Anodyne	CCR3	34	46
O=C(NCCCCN1CCOCC1)NC1CC(Nc2ccccc2)C1	ZINC000875076766	EE	On-Demand	Anodyne	EPHX2	45	48
O=C(NCCCCN1CCOCC1)NC1CC(Nc2ccccc2)C1	ZINC000875076766	EE	On-Demand	Anodyne	BRD2	15	40
COc1ccc(N2CCN(C(=O)C(=O)NC3CCC3)CC2)c(OC)c1	ZINC000875076779	ED	On-Demand	Clean	HTR1A	34	42
COc1ccc(N2CCN(C(=O)C(=O)NC3CCC3)CC2)c(OC)c1	ZINC000875076779	ED	On-Demand	Clean	DRD2	30	45
COc1ccc(N2CCN(C(=O)C(=O)NC3CCC3)CC2)c(OC)c1	ZINC000875076779	ED	On-Demand	Clean	ADRA1D	27	45
COc1ccc(N2CCN(C(=O)C(=O)NC3CCC3)CC2)c(OC)c1	ZINC000875076779	ED	On-Demand	Clean	ADRA1A	25	45
COc1ccc(N2CCN(C(=O)C(=O)NC3CCC3)CC2)c(OC)c1	ZINC000875076779	ED	On-Demand	Clean	ADRA1B	18	45
COc1ccc(N2CCN(C(=O)C(=O)NC3CCC3)CC2)c(OC)c1	ZINC000875076779	ED	On-Demand	Clean	HTR7	26	42
COc1ccc(N2CCN(C(=O)C(=O)NC3CCC3)CC2)c(OC)c1	ZINC000875076779	ED	On-Demand	Clean	MTNR1B	21	44
COCCCCNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875076782	EF	On-Demand	Anodyne	KCNA3	38	41
O=C(NCCCCN1CCOCC1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875076800	GE	On-Demand	Anodyne	DRD2	18	49
O=C(NCCCCN1CCOCC1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875076800	GE	On-Demand	Anodyne	ADRA1D	15	40
O=C(NCCCCN1CCOCC1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875076800	GE	On-Demand	Anodyne	HTR2A	15	41
O=C(NCCCCN1CCOCC1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875076800	GE	On-Demand	Anodyne	ADRA1A	26	44
O=C(NCCCCN1CCOCC1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875076800	GE	On-Demand	Anodyne	ADRA1B	21	41
O=C(NCCCCN1CCOCC1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875076800	GE	On-Demand	Anodyne	DRD3	38	49
O=C(NCCCCN1CCOCC1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875076800	GE	On-Demand	Anodyne	CASR	54	39
O=C(NCCCCN1CCOCC1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875076800	GE	On-Demand	Anodyne	TACR2	20	41
O=C(NCCCCN1CCOCC1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875076800	GE	On-Demand	Anodyne	EPHX2	21	40
O=C(NCCCCN1CCOCC1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875076800	GE	On-Demand	Anodyne	CYP2J2	43	31
O=C(NCCCCN1CCOCC1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875076801	GE	On-Demand	Anodyne	DRD2	18	49
O=C(NCCCCN1CCOCC1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875076801	GE	On-Demand	Anodyne	ADRA1D	15	40
O=C(NCCCCN1CCOCC1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875076801	GE	On-Demand	Anodyne	HTR2A	15	41
O=C(NCCCCN1CCOCC1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875076801	GE	On-Demand	Anodyne	ADRA1A	26	44
O=C(NCCCCN1CCOCC1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875076801	GE	On-Demand	Anodyne	ADRA1B	21	41
O=C(NCCCCN1CCOCC1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875076801	GE	On-Demand	Anodyne	DRD3	38	49
O=C(NCCCCN1CCOCC1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875076801	GE	On-Demand	Anodyne	CASR	54	39
O=C(NCCCCN1CCOCC1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875076801	GE	On-Demand	Anodyne	TACR2	20	41
O=C(NCCCCN1CCOCC1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875076801	GE	On-Demand	Anodyne	EPHX2	21	40
O=C(NCCCCN1CCOCC1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875076801	GE	On-Demand	Anodyne	CYP2J2	43	31
O=C(NCCCCN1CCOCC1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875076802	GE	On-Demand	Anodyne	DRD2	18	49
O=C(NCCCCN1CCOCC1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875076802	GE	On-Demand	Anodyne	ADRA1D	15	40
O=C(NCCCCN1CCOCC1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875076802	GE	On-Demand	Anodyne	HTR2A	15	41
O=C(NCCCCN1CCOCC1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875076802	GE	On-Demand	Anodyne	ADRA1A	26	44
O=C(NCCCCN1CCOCC1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875076802	GE	On-Demand	Anodyne	ADRA1B	21	41
O=C(NCCCCN1CCOCC1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875076802	GE	On-Demand	Anodyne	DRD3	38	49
O=C(NCCCCN1CCOCC1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875076802	GE	On-Demand	Anodyne	CASR	54	39
O=C(NCCCCN1CCOCC1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875076802	GE	On-Demand	Anodyne	TACR2	20	41
O=C(NCCCCN1CCOCC1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875076802	GE	On-Demand	Anodyne	EPHX2	21	40
O=C(NCCCCN1CCOCC1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875076802	GE	On-Demand	Anodyne	CYP2J2	43	31
O=C(NCCCCN1CCOCC1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875076803	GE	On-Demand	Anodyne	DRD2	18	49
O=C(NCCCCN1CCOCC1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875076803	GE	On-Demand	Anodyne	ADRA1D	15	40
O=C(NCCCCN1CCOCC1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875076803	GE	On-Demand	Anodyne	HTR2A	15	41
O=C(NCCCCN1CCOCC1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875076803	GE	On-Demand	Anodyne	ADRA1A	26	44
O=C(NCCCCN1CCOCC1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875076803	GE	On-Demand	Anodyne	ADRA1B	21	41
O=C(NCCCCN1CCOCC1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875076803	GE	On-Demand	Anodyne	DRD3	38	49
O=C(NCCCCN1CCOCC1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875076803	GE	On-Demand	Anodyne	CASR	54	39
O=C(NCCCCN1CCOCC1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875076803	GE	On-Demand	Anodyne	TACR2	20	41
O=C(NCCCCN1CCOCC1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875076803	GE	On-Demand	Anodyne	EPHX2	21	40
O=C(NCCCCN1CCOCC1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875076803	GE	On-Demand	Anodyne	CYP2J2	43	31
COCCCCNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875076810	DD	On-Demand	Anodyne	DRD3	40	38
COCCCCNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875076810	DD	On-Demand	Anodyne	SCN2A	15	41
COCCCCNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875076810	DD	On-Demand	Anodyne	FAAH	19	40
C=CC(C)(C)CCNC(=O)C(=O)NCc1ccccc1N1CCOCC1	ZINC000875076819	FD	On-Demand	Mild	SCN10A	15	44
CC[C@H](C)NC(=O)c1cccc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875076824	GF	On-Demand	Anodyne	PREP	23	41
CC[C@H](C)NC(=O)c1cccc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875076826	GF	On-Demand	Anodyne	PREP	23	41
COc1ccc(N2CCN(C(=O)C(=O)NCc3cccn3C)CC2)c(OC)c1	ZINC000875076845	GD	On-Demand	Clean	HTR1A	53	43
COc1ccc(N2CCN(C(=O)C(=O)NCc3cccn3C)CC2)c(OC)c1	ZINC000875076845	GD	On-Demand	Clean	DRD2	43	43
COc1ccc(N2CCN(C(=O)C(=O)NCc3cccn3C)CC2)c(OC)c1	ZINC000875076845	GD	On-Demand	Clean	DRD4	45	36
COc1ccc(N2CCN(C(=O)C(=O)NCc3cccn3C)CC2)c(OC)c1	ZINC000875076845	GD	On-Demand	Clean	DRD3	62	40
COc1ccc(N2CCN(C(=O)C(=O)NCc3cccn3C)CC2)c(OC)c1	ZINC000875076845	GD	On-Demand	Clean	HTR7	44	42
CCCNC(=O)c1cccc(CNC(=O)N[C@@H](CC)[C@@H](O)c2ccccc2)c1	ZINC000875076856	GG	On-Demand	Anodyne	ANPEP	16	40
CCCNC(=O)c1cccc(CNC(=O)N[C@@H](CC)[C@@H](O)c2ccccc2)c1	ZINC000875076856	GG	On-Demand	Anodyne	BACE1	16	42
CCCNC(=O)c1cccc(CNC(=O)N[C@@H](CC)[C@@H](O)c2ccccc2)c1	ZINC000875076856	GG	On-Demand	Anodyne	PDS	43	35
CCCNC(=O)c1cccc(CNC(=O)N[C@H](CC)[C@@H](O)c2ccccc2)c1	ZINC000875076857	GG	On-Demand	Anodyne	ANPEP	16	40
CCCNC(=O)c1cccc(CNC(=O)N[C@H](CC)[C@@H](O)c2ccccc2)c1	ZINC000875076857	GG	On-Demand	Anodyne	BACE1	16	42
CCCNC(=O)c1cccc(CNC(=O)N[C@H](CC)[C@@H](O)c2ccccc2)c1	ZINC000875076857	GG	On-Demand	Anodyne	PDS	43	35
CCCNC(=O)c1cccc(CNC(=O)N[C@@H](CC)[C@H](O)c2ccccc2)c1	ZINC000875076858	GG	On-Demand	Anodyne	ANPEP	16	40
CCCNC(=O)c1cccc(CNC(=O)N[C@@H](CC)[C@H](O)c2ccccc2)c1	ZINC000875076858	GG	On-Demand	Anodyne	BACE1	16	42
CCCNC(=O)c1cccc(CNC(=O)N[C@@H](CC)[C@H](O)c2ccccc2)c1	ZINC000875076858	GG	On-Demand	Anodyne	PDS	43	35
CCCNC(=O)c1cccc(CNC(=O)N[C@H](CC)[C@H](O)c2ccccc2)c1	ZINC000875076860	GG	On-Demand	Anodyne	ANPEP	16	40
CCCNC(=O)c1cccc(CNC(=O)N[C@H](CC)[C@H](O)c2ccccc2)c1	ZINC000875076860	GG	On-Demand	Anodyne	BACE1	16	42
CCCNC(=O)c1cccc(CNC(=O)N[C@H](CC)[C@H](O)c2ccccc2)c1	ZINC000875076860	GG	On-Demand	Anodyne	PDS	43	35
CCCNC(=O)c1cccc(CNC(=O)N2CCCCCCNC(=O)CC2)c1	ZINC000875076863	GE	On-Demand	Anodyne	DRD4	42	32
CCCNC(=O)c1cccc(CNC(=O)N2CCCCCCNC(=O)CC2)c1	ZINC000875076863	GE	On-Demand	Anodyne	CHRM3	15	44
CC[C@H](C)NC(=O)c1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875076872	GD	On-Demand	Anodyne	DRD4	23	43
CC[C@H](C)NC(=O)c1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875076872	GD	On-Demand	Anodyne	CCR2	37	41
CC[C@H](C)NC(=O)c1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875076872	GD	On-Demand	Anodyne	CACNA1I	41	36
CCCNC(=O)c1cccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875076874	EE	On-Demand	Anodyne	DRD4	44	33
CCCNC(=O)c1cccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875076874	EE	On-Demand	Anodyne	CHRM3	17	41
CCCNC(=O)c1cccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875076874	EE	On-Demand	Anodyne	ST14	52	35
CCCNC(=O)c1cccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875076874	EE	On-Demand	Anodyne	CACNA1I	52	38
CCCNC(=O)c1cccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875076875	EE	On-Demand	Anodyne	DRD4	44	33
CCCNC(=O)c1cccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875076875	EE	On-Demand	Anodyne	CHRM3	17	41
CCCNC(=O)c1cccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875076875	EE	On-Demand	Anodyne	ST14	52	35
CCCNC(=O)c1cccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875076875	EE	On-Demand	Anodyne	CACNA1I	52	38
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875076876	ED	On-Demand	Reactive	HTR1A	141	60
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875076876	ED	On-Demand	Reactive	ADRA2A	16	45
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875076876	ED	On-Demand	Reactive	DRD2	100	53
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875076876	ED	On-Demand	Reactive	DRD1	19	43
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875076876	ED	On-Demand	Reactive	DRD4	68	50
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875076876	ED	On-Demand	Reactive	ADRA1D	72	54
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875076876	ED	On-Demand	Reactive	HTR2A	91	50
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875076876	ED	On-Demand	Reactive	HTR2C	49	50
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875076876	ED	On-Demand	Reactive	SLC6A4	23	45
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875076876	ED	On-Demand	Reactive	ADRA1A	97	54
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875076876	ED	On-Demand	Reactive	ADRA1B	64	54
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875076876	ED	On-Demand	Reactive	DRD3	129	53
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875076876	ED	On-Demand	Reactive	HTR4	16	42
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875076876	ED	On-Demand	Reactive	DRD5	19	42
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875076876	ED	On-Demand	Reactive	HTR7	151	52
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875076876	ED	On-Demand	Reactive	SIGMAR1	22	45
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875076876	ED	On-Demand	Reactive	NPY1R	15	45
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2)CC1	ZINC000875076876	ED	On-Demand	Reactive	CCR3	29	44
CCCCCCCNC(=O)C(=O)NCc1cccn1C	ZINC000875076888	CD	On-Demand	Mild	ASAH1	103	45
C=CCCC(C)(C)CNC(=O)C(=O)NCc1ccccc1N1CCOCC1	ZINC000875076902	FE	On-Demand	Mild	SCN10A	15	48
CC(C)(C)OC(=O)N1CCC(NC(=O)C(=O)NCCCCC2CC2)CC1	ZINC000875076913	FE	On-Demand	Anodyne	GPR119	31	45
CN1CCN(C2CCN(C(=O)C(=O)NCCC3CCCCC3)CC2)CC1	ZINC000875076921	FD	On-Demand	Anodyne	L3MBTL3	44	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)c1ccc(OCc2cccnc2)cc1	ZINC000875076927	FH	On-Demand	Anodyne	ACACA	23	43
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)c1ccc(OCc2cccnc2)cc1	ZINC000875076927	FH	On-Demand	Anodyne	ACACB	23	43
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)c1ccc(OCc2cccnc2)cc1	ZINC000875076927	FH	On-Demand	Anodyne	CAPN2	31	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)c1ccc(OCc2cccnc2)cc1	ZINC000875076931	FH	On-Demand	Anodyne	ACACA	23	43
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)c1ccc(OCc2cccnc2)cc1	ZINC000875076931	FH	On-Demand	Anodyne	ACACB	23	43
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)c1ccc(OCc2cccnc2)cc1	ZINC000875076931	FH	On-Demand	Anodyne	CAPN2	31	40
CC[C@H](C)NC(=O)c1cccc(CNC(=O)N2CCCN(C=O)CC2)c1	ZINC000875076932	FD	On-Demand	Anodyne	TRY2_BOVIN	46	37
O=C(NCCC1CCCCC1)C(=O)NCc1cccc2ncccc12	ZINC000875076941	EF	On-Demand	Anodyne	BMP1	40	35
O=C(CCc1c(-c2ccc(F)cc2)[nH]c2ccc(F)cc12)OCCO	ZINC000875076961	EH	On-Demand	Anodyne	TSPO	20	45
O=C(CCc1c(-c2ccc(F)cc2)[nH]c2ccc(F)cc12)OCCO	ZINC000875076961	EH	On-Demand	Anodyne	MPO	48	40
O=C(NCc1ccc(-n2cccn2)cc1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875077026	FD	On-Demand	Anodyne	AMP1_PLAFQ	58	32
COCCN(CC1CCN(C)CC1)C(=O)NCc1cccc(C(=O)N(C)C)c1	ZINC000875077032	GD	On-Demand	Anodyne	ACKR3	50	31
CC[C@@H](NC(=O)N[C@H]1CCN(CC(C)(C)O)C1)c1ccccc1OC	ZINC000875077035	EE	On-Demand	Anodyne	DRD2	16	41
CC[C@@H](NC(=O)N[C@H]1CCN(CC(C)(C)O)C1)c1ccccc1OC	ZINC000875077035	EE	On-Demand	Anodyne	DRD4	22	40
CC[C@@H](NC(=O)N[C@H]1CCN(CC(C)(C)O)C1)c1ccccc1OC	ZINC000875077035	EE	On-Demand	Anodyne	BIRC2	31	42
C[C@@H](NC(=O)N(C)CCN1CC2(CCOCC2)C1)c1cccc(OC(F)F)c1	ZINC000875077052	GG	On-Demand	Anodyne	CASR	41	38
CC[C@@H](NC(=O)N1CCCC(F)(F)CC1)c1ccccc1OC	ZINC000875077061	EH	On-Demand	Anodyne	HCN1	62	36
CC[C@@H](NC(=O)N1CCCC(F)(F)CC1)c1ccccc1OC	ZINC000875077061	EH	On-Demand	Anodyne	HCN4	49	36
NC(=O)c1cccc(CNC(=O)N2Cc3cccnc3N3CCC[C@H]3C2)c1	ZINC000875077066	FD	On-Demand	Anodyne	NAMPT	20	40
O=C(Oc1ccc(C(F)(F)F)cc1)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1	ZINC000875077069	II	On-Demand	Anodyne	SFRP1	42	34
O=C(Oc1ccc(C(F)(F)F)cc1)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1	ZINC000875077079	II	On-Demand	Anodyne	SFRP1	42	34
CONC(=O)C1CCN(C(=O)N[C@H](C)c2ccc(NC(=O)C3CC3)cc2)CC1	ZINC000875077082	GE	On-Demand	Anodyne	EPHX2	22	42
CONC(=O)C1CCN(C(=O)N[C@H](C)c2ccc(NC(=O)C3CC3)cc2)CC1	ZINC000875077082	GE	On-Demand	Anodyne	F7	21	51
CONC(=O)C1CCN(C(=O)N[C@@H](C)c2ccc(NC(=O)C3CC3)cc2)CC1	ZINC000875077084	GE	On-Demand	Anodyne	EPHX2	22	42
CONC(=O)C1CCN(C(=O)N[C@@H](C)c2ccc(NC(=O)C3CC3)cc2)CC1	ZINC000875077084	GE	On-Demand	Anodyne	F7	21	51
CCOC1CC2(C1)C[C@H]2C(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000875077087	DF	On-Demand	Bother	SLC27A4	52	37
O=C1CCN(C(=O)C(=O)NCc2ccc(-n3cccn3)cc2)CCCCCCN1	ZINC000875077097	GD	On-Demand	Anodyne	AMP1_PLAFQ	40	34
CCO[C@H](C(=O)N(C)c1ccc([N+](=O)[O-])cc1)C1CCOCC1	ZINC000875077110	DE	On-Demand	Bother	SLC27A4	52	36
CCO[C@@H](C(=O)N(C)c1ccc([N+](=O)[O-])cc1)C1CCOCC1	ZINC000875077112	DE	On-Demand	Bother	SLC27A4	52	36
COC(=O)c1cnc(NC(=O)c2cccc(OC(C)(C)C)c2)s1	ZINC000875077114	EG	On-Demand	Anodyne	GCK	32	41
COC(=O)c1cnc(NC(=O)c2cccc(OC(C)(C)C)c2)s1	ZINC000875077114	EG	On-Demand	Anodyne	SCD	34	46
O=C(NCc1ccc(-n2cccn2)cc1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875077119	FD	On-Demand	Anodyne	AMP1_PLAFQ	40	33
O=C(NCc1ccc(-n2cccn2)cc1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875077120	FD	On-Demand	Anodyne	AMP1_PLAFQ	40	33
O=C(NCc1ccc(-n2cccn2)cc1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875077121	FD	On-Demand	Anodyne	AMP1_PLAFQ	40	33
O=C(NCc1ccc(-n2cccn2)cc1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875077122	FD	On-Demand	Anodyne	AMP1_PLAFQ	40	33
CC[C@@H](NC(=O)N(C)[C@@H]1CCCC[C@H]1O)c1ccccc1OC	ZINC000875077163	DG	On-Demand	Anodyne	AMY2	45	32
CC[C@@H](NC(=O)N(C)[C@@H]1CCCC[C@H]1O)c1ccccc1OC	ZINC000875077163	DG	On-Demand	Anodyne	HCN1	40	31
CC[C@@H](NC(=O)N(C)[C@@H]1CCCC[C@H]1O)c1ccccc1OC	ZINC000875077163	DG	On-Demand	Anodyne	HCN4	41	33
CN(C(=O)Cc1csc(C2CC2)n1)c1ccc([N+](=O)[O-])cc1	ZINC000875077165	DG	On-Demand	Bother	SLC27A4	42	31
CC[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1OC	ZINC000875077166	EG	On-Demand	Anodyne	AMY2	45	30
CC[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1OC	ZINC000875077166	EG	On-Demand	Anodyne	REN	15	44
CC[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1OC	ZINC000875077166	EG	On-Demand	Anodyne	BIRC2	18	42
CC[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1OC	ZINC000875077167	EG	On-Demand	Anodyne	AMY2	45	30
CC[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1OC	ZINC000875077167	EG	On-Demand	Anodyne	REN	15	44
CC[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1OC	ZINC000875077167	EG	On-Demand	Anodyne	BIRC2	18	42
O=C(NCCC[C@H]1C=CCC1)C(=O)NCc1ccc(-n2cccn2)cc1	ZINC000875077168	FE	On-Demand	Anodyne	AMP1_PLAFQ	40	34
O=C(NCCC[C@@H]1C=CCC1)C(=O)NCc1ccc(-n2cccn2)cc1	ZINC000875077172	FE	On-Demand	Anodyne	AMP1_PLAFQ	40	34
CN(C)C(=O)c1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875077175	GF	On-Demand	Anodyne	F2	40	42
CN(C)C(=O)c1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875077175	GF	On-Demand	Anodyne	PREP	46	42
CN(C)C(=O)c1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875077175	GF	On-Demand	Anodyne	TMPRSS11D	66	36
Cn1nc(Cl)c(C(=O)NC2(c3ccccc3)CCC2)c1Cl	ZINC000875077180	DH	On-Demand	Anodyne	TACR3	21	47
O=C(NCCc1ccc(OC(F)(F)F)cc1)N1CCC(CO)(CO)CC1	ZINC000875077197	GD	On-Demand	Anodyne	MMP2	23	40
O=C(NCCc1ccc(OC(F)(F)F)cc1)N1CCC(CO)(CO)CC1	ZINC000875077197	GD	On-Demand	Anodyne	MMP14	16	40
O=C(NCCc1ccc(OC(F)(F)F)cc1)N1CCC(CO)(CO)CC1	ZINC000875077197	GD	On-Demand	Anodyne	MMP9	18	40
O=C(NCCc1ccc(OC(F)(F)F)cc1)N1CCC(CO)(CO)CC1	ZINC000875077197	GD	On-Demand	Anodyne	EPHX2	50	42
CC[C@@H](NC(=O)N(C1CC1)C1CC1)c1ccccc1OC	ZINC000875077202	CG	On-Demand	Anodyne	AMY2	44	31
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(NC(=O)C2CC2)cc1	ZINC000875077208	EE	On-Demand	Anodyne	F7	22	54
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(NC(=O)C2CC2)cc1	ZINC000875077209	EE	On-Demand	Anodyne	F7	22	54
O=C(NCCCCN1CCOCC1)NNc1cccc(F)c1Br	ZINC000875077215	GE	On-Demand	Reactive	DRD3	58	39
O=C(NCCCCN1CCOCC1)NNc1cccc(F)c1Br	ZINC000875077215	GE	On-Demand	Reactive	CHRNA7	15	44
O=C(NCCCCN1CCOCC1)NNc1cccc(F)c1Br	ZINC000875077215	GE	On-Demand	Reactive	EPHX2	23	42
COc1ccccc1[C@H]1CCCN(C(=O)NCCCCN2CCOCC2)CC1	ZINC000875077229	GG	On-Demand	Anodyne	HTR1A	67	46
COc1ccccc1[C@H]1CCCN(C(=O)NCCCCN2CCOCC2)CC1	ZINC000875077229	GG	On-Demand	Anodyne	DRD2	61	47
COc1ccccc1[C@H]1CCCN(C(=O)NCCCCN2CCOCC2)CC1	ZINC000875077229	GG	On-Demand	Anodyne	DRD4	32	44
COc1ccccc1[C@H]1CCCN(C(=O)NCCCCN2CCOCC2)CC1	ZINC000875077229	GG	On-Demand	Anodyne	ADRA1D	63	41
COc1ccccc1[C@H]1CCCN(C(=O)NCCCCN2CCOCC2)CC1	ZINC000875077229	GG	On-Demand	Anodyne	HTR1D	17	41
COc1ccccc1[C@H]1CCCN(C(=O)NCCCCN2CCOCC2)CC1	ZINC000875077229	GG	On-Demand	Anodyne	HTR1B	18	41
COc1ccccc1[C@H]1CCCN(C(=O)NCCCCN2CCOCC2)CC1	ZINC000875077229	GG	On-Demand	Anodyne	HTR2A	27	44
COc1ccccc1[C@H]1CCCN(C(=O)NCCCCN2CCOCC2)CC1	ZINC000875077229	GG	On-Demand	Anodyne	ADRA1A	73	41
COc1ccccc1[C@H]1CCCN(C(=O)NCCCCN2CCOCC2)CC1	ZINC000875077229	GG	On-Demand	Anodyne	ADRA1B	60	41
COc1ccccc1[C@H]1CCCN(C(=O)NCCCCN2CCOCC2)CC1	ZINC000875077229	GG	On-Demand	Anodyne	DRD3	70	47
COc1ccccc1[C@H]1CCCN(C(=O)NCCCCN2CCOCC2)CC1	ZINC000875077229	GG	On-Demand	Anodyne	HTR7	46	40
COc1ccccc1[C@H]1CCCN(C(=O)NCCCCN2CCOCC2)CC1	ZINC000875077229	GG	On-Demand	Anodyne	SIGMAR1	22	46
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCCN2CCOCC2)CC1	ZINC000875077230	GG	On-Demand	Anodyne	HTR1A	67	46
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCCN2CCOCC2)CC1	ZINC000875077230	GG	On-Demand	Anodyne	DRD2	61	47
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCCN2CCOCC2)CC1	ZINC000875077230	GG	On-Demand	Anodyne	DRD4	32	44
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCCN2CCOCC2)CC1	ZINC000875077230	GG	On-Demand	Anodyne	ADRA1D	63	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCCN2CCOCC2)CC1	ZINC000875077230	GG	On-Demand	Anodyne	HTR1D	17	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCCN2CCOCC2)CC1	ZINC000875077230	GG	On-Demand	Anodyne	HTR1B	18	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCCN2CCOCC2)CC1	ZINC000875077230	GG	On-Demand	Anodyne	HTR2A	27	44
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCCN2CCOCC2)CC1	ZINC000875077230	GG	On-Demand	Anodyne	ADRA1A	73	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCCN2CCOCC2)CC1	ZINC000875077230	GG	On-Demand	Anodyne	ADRA1B	60	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCCN2CCOCC2)CC1	ZINC000875077230	GG	On-Demand	Anodyne	DRD3	70	47
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCCN2CCOCC2)CC1	ZINC000875077230	GG	On-Demand	Anodyne	HTR7	46	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCCN2CCOCC2)CC1	ZINC000875077230	GG	On-Demand	Anodyne	SIGMAR1	22	46
N#Cc1ccc(Cn2cc(NC(=O)NCCCCN3CCOCC3)cn2)cc1	ZINC000875077283	GE	On-Demand	Mild	CCR3	37	51
N#Cc1ccc(Cn2cc(NC(=O)NCCCCN3CCOCC3)cn2)cc1	ZINC000875077283	GE	On-Demand	Mild	ITK	15	49
N#Cc1ccc(Cn2cc(NC(=O)NCCCCN3CCOCC3)cn2)cc1	ZINC000875077283	GE	On-Demand	Mild	MAP2K1	19	42
N#Cc1ccc(Cn2cc(NC(=O)NCCCCN3CCOCC3)cn2)cc1	ZINC000875077283	GE	On-Demand	Mild	EPHX2	21	42
CN(C)C(=O)c1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875077299	GF	On-Demand	Anodyne	F2	40	42
CN(C)C(=O)c1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875077299	GF	On-Demand	Anodyne	PREP	46	42
CN(C)C(=O)c1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875077299	GF	On-Demand	Anodyne	TMPRSS11D	66	36
CN(C)C(=O)c1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875077300	GF	On-Demand	Anodyne	F2	40	42
CN(C)C(=O)c1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875077300	GF	On-Demand	Anodyne	PREP	46	42
CN(C)C(=O)c1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875077300	GF	On-Demand	Anodyne	TMPRSS11D	66	36
CN(C)C(=O)c1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875077301	GF	On-Demand	Anodyne	F2	40	42
CN(C)C(=O)c1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875077301	GF	On-Demand	Anodyne	PREP	46	42
CN(C)C(=O)c1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875077301	GF	On-Demand	Anodyne	TMPRSS11D	66	36
NC(=O)c1cccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875077307	EE	On-Demand	Anodyne	KCNH2	40	38
NC(=O)c1cccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875077307	EE	On-Demand	Anodyne	PREP	26	40
NC(=O)c1cccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875077307	EE	On-Demand	Anodyne	EPHX2	22	41
NC(=O)c1cccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875077307	EE	On-Demand	Anodyne	TPSAB1	30	45
NC(=O)c1cccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875077307	EE	On-Demand	Anodyne	ST14	75	33
NC(=O)c1cccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875077307	EE	On-Demand	Anodyne	TMPRSS11D	50	31
NC(=O)c1cccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875077308	EE	On-Demand	Anodyne	KCNH2	40	38
NC(=O)c1cccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875077308	EE	On-Demand	Anodyne	PREP	26	40
NC(=O)c1cccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875077308	EE	On-Demand	Anodyne	EPHX2	22	41
NC(=O)c1cccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875077308	EE	On-Demand	Anodyne	TPSAB1	30	45
NC(=O)c1cccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875077308	EE	On-Demand	Anodyne	ST14	75	33
NC(=O)c1cccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875077308	EE	On-Demand	Anodyne	TMPRSS11D	50	31
CC(=O)C1CCN(C(=O)C(=O)NC2CCC2)CC1	ZINC000875077309	CC	On-Demand	Anodyne	EPHX2	19	47
CCCNC(=O)c1cccc(CNC(=O)N2Cc3cccc(O)c3C2)c1	ZINC000875077343	FF	On-Demand	Clean	DRD4	41	31
CCCNC(=O)c1cccc(CNC(=O)N2Cc3cccc(O)c3C2)c1	ZINC000875077343	FF	On-Demand	Clean	NAMPT	21	41
COCC(C)(C)CCNC(=O)C(=O)NCc1ccccc1N1CCOCC1	ZINC000875077350	GD	On-Demand	Anodyne	SCN10A	15	46
CCCNC(=O)c1cccc(CNC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875077356	GF	On-Demand	Anodyne	DRD4	45	34
CCCNC(=O)c1cccc(CNC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875077356	GF	On-Demand	Anodyne	CHRM3	16	46
CCCNC(=O)c1cccc(CNC(=O)NC2CC(C(=O)OC)C2)c1	ZINC000875077370	ED	On-Demand	Anodyne	DRD4	44	34
CCCNC(=O)c1cccc(CNC(=O)NC2CC(C(=O)OC)C2)c1	ZINC000875077370	ED	On-Demand	Anodyne	ROCK2	17	45
CCCNC(=O)c1cccc(CNC(=O)NNc2cccc(C)n2)c1	ZINC000875077385	EE	On-Demand	Reactive	GRM5	17	45
Cn1cccc1CNC(=O)C(=O)N1CCc2ccc(C(F)(F)F)cc2C1	ZINC000875077386	FE	On-Demand	Anodyne	CCR2	24	42
CCCNC(=O)c1cccc(CNC(=O)NN(C)C(=O)OC)c1	ZINC000875077398	DD	On-Demand	Reactive	DRD4	42	32
CCCNC(=O)c1cccc(CNC(=O)NN(C)C(=O)OC)c1	ZINC000875077398	DD	On-Demand	Reactive	ROCK2	22	43
CC(C)(C)OC(=O)N1CCC(NC(=O)C(=O)NCc2cccc(F)c2F)CC1	ZINC000875077401	GE	On-Demand	Anodyne	EPHX2	38	40
CC(C)(C)OC(=O)N1CCC(NC(=O)C(=O)NCc2cccc(F)c2F)CC1	ZINC000875077401	GE	On-Demand	Anodyne	GPR119	51	63
O=CN1CCCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)CC1	ZINC000875077427	GD	On-Demand	Anodyne	HTR1A	37	46
O=CN1CCCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)CC1	ZINC000875077427	GD	On-Demand	Anodyne	DRD2	47	40
O=CN1CCCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)CC1	ZINC000875077427	GD	On-Demand	Anodyne	ACHE	28	45
O=CN1CCCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)CC1	ZINC000875077427	GD	On-Demand	Anodyne	HTR2A	34	47
O=CN1CCCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)CC1	ZINC000875077427	GD	On-Demand	Anodyne	ADRA1A	34	42
O=CN1CCCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)CC1	ZINC000875077427	GD	On-Demand	Anodyne	DRD3	63	40
O=CN1CCCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)CC1	ZINC000875077427	GD	On-Demand	Anodyne	HTR7	28	48
O=CN1CCCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)CC1	ZINC000875077427	GD	On-Demand	Anodyne	HRH3	15	41
O=CN1CCCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)CC1	ZINC000875077427	GD	On-Demand	Anodyne	SIGMAR1	57	45
O=CN1CCCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)CC1	ZINC000875077427	GD	On-Demand	Anodyne	CCR3	17	43
O=CN1CCCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)CC1	ZINC000875077427	GD	On-Demand	Anodyne	FAAH	23	45
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(C(=O)OC(C)(C)C)CC3)CC[C@H]21	ZINC000875077455	GD	On-Demand	Anodyne	GPR119	23	40
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(C(=O)OC(C)(C)C)CC3)CC[C@@H]21	ZINC000875077456	GD	On-Demand	Anodyne	GPR119	23	40
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000875077469	GD	On-Demand	Anodyne	GPR119	26	40
O=C1CC[C@H](C(=O)N2CCCc3cc(S(=O)(=O)N4CCCC4)ccc32)O1	ZINC000875077473	GD	On-Demand	Anodyne	AKR1C3	43	35
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1cccn1C)CC2	ZINC000875077475	FD	On-Demand	Anodyne	SLC18A2	45	33
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1cccn1C)CC2	ZINC000875077475	FD	On-Demand	Anodyne	MTNR1B	15	45
O=C(CSCC(=O)N1CCCCC1)Oc1ccc(C(F)(F)F)cc1	ZINC000875077489	FG	On-Demand	Anodyne	LIPE	21	48
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1cccn1C)CC2	ZINC000875077492	FD	On-Demand	Anodyne	SLC18A2	45	33
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1cccn1C)CC2	ZINC000875077492	FD	On-Demand	Anodyne	MTNR1B	15	45
O=C(NCCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875077498	GF	On-Demand	Clean	HTR1A	104	57
O=C(NCCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875077498	GF	On-Demand	Clean	DRD2	83	56
O=C(NCCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875077498	GF	On-Demand	Clean	DRD4	51	56
O=C(NCCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875077498	GF	On-Demand	Clean	ADRA1D	45	50
O=C(NCCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875077498	GF	On-Demand	Clean	HTR2A	76	53
O=C(NCCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875077498	GF	On-Demand	Clean	HTR2C	42	46
O=C(NCCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875077498	GF	On-Demand	Clean	SLC6A4	21	43
O=C(NCCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875077498	GF	On-Demand	Clean	ADRA1A	65	50
O=C(NCCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875077498	GF	On-Demand	Clean	ADRA1B	43	50
O=C(NCCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875077498	GF	On-Demand	Clean	DRD3	108	56
O=C(NCCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875077498	GF	On-Demand	Clean	DRD5	22	49
O=C(NCCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875077498	GF	On-Demand	Clean	HTR7	120	50
O=C(NCCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875077498	GF	On-Demand	Clean	SIGMAR1	15	43
Cc1scc(CNC(=O)C(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1C	ZINC000875077499	GE	On-Demand	Anodyne	GPR119	39	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)c1cccc(OC(C)C)c1	ZINC000875077510	DG	On-Demand	Anodyne	PDS	23	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)c1cccc(OC(C)C)c1	ZINC000875077511	DG	On-Demand	Anodyne	PDS	23	40
CNc1ccc(C(=O)Oc2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-]	ZINC000875077518	EH	On-Demand	Bother	ACR	50	45
O=C(NCCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875077536	FD	On-Demand	Anodyne	HTR1A	38	49
O=C(NCCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875077536	FD	On-Demand	Anodyne	DRD2	55	43
O=C(NCCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875077536	FD	On-Demand	Anodyne	DRD4	61	41
O=C(NCCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875077536	FD	On-Demand	Anodyne	ACHE	47	48
O=C(NCCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875077536	FD	On-Demand	Anodyne	HRH2	29	42
O=C(NCCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875077536	FD	On-Demand	Anodyne	HTR2A	43	48
O=C(NCCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875077536	FD	On-Demand	Anodyne	HTR2C	31	40
O=C(NCCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875077536	FD	On-Demand	Anodyne	SLC6A4	20	40
O=C(NCCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875077536	FD	On-Demand	Anodyne	DRD3	72	52
O=C(NCCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875077536	FD	On-Demand	Anodyne	HTR7	23	49
O=C(NCCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875077536	FD	On-Demand	Anodyne	SIGMAR1	73	49
O=C(NCCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875077536	FD	On-Demand	Anodyne	BCHE	19	43
O=C(NCCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875077536	FD	On-Demand	Anodyne	CCR3	52	52
O=C(NCCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875077536	FD	On-Demand	Anodyne	NPFFR1	41	38
CC[C@@H](NC(=O)NNc1cccc(C)n1)c1ccccc1OC	ZINC000875077544	DG	On-Demand	Reactive	GRM5	15	43
O=C(Oc1ccc(C(F)(F)F)cc1)C1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1	ZINC000875077577	JJ	On-Demand	Anodyne	CNR1	15	40
O=C(Oc1ccc(C(F)(F)F)cc1)C1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1	ZINC000875077577	JJ	On-Demand	Anodyne	CHRM5	15	42
O=C(Oc1ccc(C(F)(F)F)cc1)C1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1	ZINC000875077577	JJ	On-Demand	Anodyne	TRY2_BOVIN	46	37
O=C(Oc1ccc(C(F)(F)F)cc1)C1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1	ZINC000875077577	JJ	On-Demand	Anodyne	EPHX2	30	42
O=C(Oc1ccc(C(F)(F)F)cc1)C1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1	ZINC000875077577	JJ	On-Demand	Anodyne	PKM	26	46
O=C(Oc1ccc(C(F)(F)F)cc1)C1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1	ZINC000875077577	JJ	On-Demand	Anodyne	GCK	42	32
O=C(Oc1ccc(C(F)(F)F)cc1)C1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1	ZINC000875077577	JJ	On-Demand	Anodyne	AKR1C3	20	57
O=C(Oc1ccc(C(F)(F)F)cc1)C1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1	ZINC000875077577	JJ	On-Demand	Anodyne	SFRP1	85	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)c1ccc(NC(=O)C2CC2)cc1	ZINC000875077579	EF	On-Demand	Anodyne	F7	16	52
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)c1ccc(NC(=O)C2CC2)cc1	ZINC000875077580	EF	On-Demand	Anodyne	F7	16	52
COC(=O)c1cnc(NC(=O)[C@@H](Cc2cccnc2)C2CCCC2)s1	ZINC000875077592	FG	On-Demand	Anodyne	C3AR1	41	43
COC(=O)c1cnc(NC(=O)[C@@H](Cc2cccnc2)C2CCCC2)s1	ZINC000875077592	FG	On-Demand	Anodyne	CDK5	47	38
COC(=O)c1cnc(NC(=O)[C@H](Cc2cccnc2)C2CCCC2)s1	ZINC000875077593	FG	On-Demand	Anodyne	C3AR1	41	43
COC(=O)c1cnc(NC(=O)[C@H](Cc2cccnc2)C2CCCC2)s1	ZINC000875077593	FG	On-Demand	Anodyne	CDK5	47	38
C[C@@H](NC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccc(NC(=O)C2CC2)cc1	ZINC000875077595	GI	On-Demand	Anodyne	EPHX2	22	40
C[C@@H](NC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccc(NC(=O)C2CC2)cc1	ZINC000875077596	GI	On-Demand	Anodyne	EPHX2	22	40
CCO[C@@H](C(=O)Nc1ncc(C(=O)OC)s1)C1CCOCC1	ZINC000875077602	ED	On-Demand	Anodyne	GCK	17	44
O=C(CC(F)(F)C(F)(F)F)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000875077610	DG	On-Demand	Bother	EIF2AK3	53	34
CN(C(=O)[C@@H]1C[C@]1(C)Br)c1ccc([N+](=O)[O-])cc1	ZINC000875077613	DF	On-Demand	Bother	SLC27A4	51	34
O=C(Oc1ccc(C(F)(F)F)cc1)c1ccc(NC(=O)C2CC2)cc1	ZINC000875077617	EI	On-Demand	Anodyne	PRSS1	17	65
O=C(Oc1ccc(C(F)(F)F)cc1)c1ccc(NC(=O)C2CC2)cc1	ZINC000875077617	EI	On-Demand	Anodyne	DHODH	22	46
O=C(Oc1ccc(C(F)(F)F)cc1)c1ccc(NC(=O)C2CC2)cc1	ZINC000875077617	EI	On-Demand	Anodyne	RAF1	19	40
O=C(Oc1ccc(C(F)(F)F)cc1)c1ccc(NC(=O)C2CC2)cc1	ZINC000875077617	EI	On-Demand	Anodyne	LIPE	19	43
O=C(Oc1ccc(C(F)(F)F)cc1)c1ccc(NC(=O)C2CC2)cc1	ZINC000875077617	EI	On-Demand	Anodyne	EPHX2	58	44
O=C(Oc1ccc(C(F)(F)F)cc1)c1ccc(NC(=O)C2CC2)cc1	ZINC000875077617	EI	On-Demand	Anodyne	ACR	89	65
O=C(Oc1ccc(C(F)(F)F)cc1)c1ccc(NC(=O)C2CC2)cc1	ZINC000875077617	EI	On-Demand	Anodyne	TRPM8	51	39
CCO[C@H](C(=O)N(C)c1ccc([N+](=O)[O-])cc1)C1CCCC1	ZINC000875077624	DG	On-Demand	Bother	SLC27A4	53	36
CCO[C@@H](C(=O)N(C)c1ccc([N+](=O)[O-])cc1)C1CCCC1	ZINC000875077625	DG	On-Demand	Bother	SLC27A4	53	36
O=C(Oc1ccc(C(F)(F)F)cc1)C1CCN(S(=O)(=O)c2cc(Cl)ccc2Cl)CC1	ZINC000875077645	JK	On-Demand	Anodyne	EPHX2	37	45
COCCCCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875077646	DF	On-Demand	Anodyne	FKBP1A	59	42
COCCCCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875077646	DF	On-Demand	Anodyne	DRD3	27	42
COCCCCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875077646	DF	On-Demand	Anodyne	CPT1A	75	33
COCCCCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875077646	DF	On-Demand	Anodyne	AMY2	45	31
COCCCCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875077647	DF	On-Demand	Anodyne	FKBP1A	59	42
COCCCCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875077647	DF	On-Demand	Anodyne	DRD3	27	42
COCCCCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875077647	DF	On-Demand	Anodyne	CPT1A	75	33
COCCCCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875077647	DF	On-Demand	Anodyne	AMY2	45	31
COCCCCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875077648	DF	On-Demand	Anodyne	FKBP1A	59	42
COCCCCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875077648	DF	On-Demand	Anodyne	DRD3	27	42
COCCCCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875077648	DF	On-Demand	Anodyne	CPT1A	75	33
COCCCCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875077648	DF	On-Demand	Anodyne	AMY2	45	31
COCCCCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875077649	DF	On-Demand	Anodyne	FKBP1A	59	42
COCCCCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875077649	DF	On-Demand	Anodyne	DRD3	27	42
COCCCCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875077649	DF	On-Demand	Anodyne	CPT1A	75	33
COCCCCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875077649	DF	On-Demand	Anodyne	AMY2	45	31
O=C(NCCCCN1CCOCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875077675	FD	On-Demand	Anodyne	HTR1A	25	42
O=C(NCCCCN1CCOCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875077675	FD	On-Demand	Anodyne	ACHE	20	41
O=C(NCCCCN1CCOCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875077675	FD	On-Demand	Anodyne	HTR2A	21	40
O=C(NCCCCN1CCOCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875077675	FD	On-Demand	Anodyne	DRD3	55	39
O=C(NCCCCN1CCOCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875077675	FD	On-Demand	Anodyne	TACR2	24	44
O=C(NCCCCN1CCOCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875077675	FD	On-Demand	Anodyne	SIGMAR1	48	39
O=C(NCCCCN1CCOCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875077675	FD	On-Demand	Anodyne	FAAH	17	46
O=C(NCCCCN1CCOCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875077675	FD	On-Demand	Anodyne	EPHX2	27	43
CC[C@@H](NC(=O)NCCCCN1CCOCC1)[C@@H](O)c1ccccc1	ZINC000875077694	ED	On-Demand	Anodyne	HTR1A	21	41
CC[C@@H](NC(=O)NCCCCN1CCOCC1)[C@@H](O)c1ccccc1	ZINC000875077694	ED	On-Demand	Anodyne	DRD2	26	40
CC[C@@H](NC(=O)NCCCCN1CCOCC1)[C@@H](O)c1ccccc1	ZINC000875077694	ED	On-Demand	Anodyne	DRD3	54	40
CC[C@@H](NC(=O)NCCCCN1CCOCC1)[C@@H](O)c1ccccc1	ZINC000875077694	ED	On-Demand	Anodyne	CASR	51	38
CC[C@@H](NC(=O)NCCCCN1CCOCC1)[C@@H](O)c1ccccc1	ZINC000875077694	ED	On-Demand	Anodyne	TACR2	22	47
CC[C@@H](NC(=O)NCCCCN1CCOCC1)[C@@H](O)c1ccccc1	ZINC000875077694	ED	On-Demand	Anodyne	CAPN2	17	52
CC[C@@H](NC(=O)NCCCCN1CCOCC1)[C@@H](O)c1ccccc1	ZINC000875077694	ED	On-Demand	Anodyne	EPHX2	23	42
CC[C@@H](NC(=O)NCCCCN1CCOCC1)[C@H](O)c1ccccc1	ZINC000875077695	ED	On-Demand	Anodyne	HTR1A	21	41
CC[C@@H](NC(=O)NCCCCN1CCOCC1)[C@H](O)c1ccccc1	ZINC000875077695	ED	On-Demand	Anodyne	DRD2	26	40
CC[C@@H](NC(=O)NCCCCN1CCOCC1)[C@H](O)c1ccccc1	ZINC000875077695	ED	On-Demand	Anodyne	DRD3	54	40
CC[C@@H](NC(=O)NCCCCN1CCOCC1)[C@H](O)c1ccccc1	ZINC000875077695	ED	On-Demand	Anodyne	CASR	51	38
CC[C@@H](NC(=O)NCCCCN1CCOCC1)[C@H](O)c1ccccc1	ZINC000875077695	ED	On-Demand	Anodyne	TACR2	22	47
CC[C@@H](NC(=O)NCCCCN1CCOCC1)[C@H](O)c1ccccc1	ZINC000875077695	ED	On-Demand	Anodyne	CAPN2	17	52
CC[C@@H](NC(=O)NCCCCN1CCOCC1)[C@H](O)c1ccccc1	ZINC000875077695	ED	On-Demand	Anodyne	EPHX2	23	42
COCCCCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875077698	DD	On-Demand	Anodyne	HRH2	24	41
COCCCCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875077698	DD	On-Demand	Anodyne	MAOB	18	42
COCCCCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875077698	DD	On-Demand	Anodyne	ADRB3	28	41
COCCCCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875077698	DD	On-Demand	Anodyne	CTSL	15	43
COCCCCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875077698	DD	On-Demand	Anodyne	CTSV	30	43
COCCCCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875077699	DD	On-Demand	Anodyne	HRH2	24	41
COCCCCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875077699	DD	On-Demand	Anodyne	MAOB	18	42
COCCCCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875077699	DD	On-Demand	Anodyne	ADRB3	28	41
COCCCCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875077699	DD	On-Demand	Anodyne	CTSL	15	43
COCCCCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875077699	DD	On-Demand	Anodyne	CTSV	30	43
COCCCCNC(=O)NC1CC(Nc2ccccc2)C1	ZINC000875077713	CE	On-Demand	Anodyne	EPHX2	32	50
COCCCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875077714	EG	On-Demand	Anodyne	HTR1A	34	41
COCCCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875077714	EG	On-Demand	Anodyne	DRD2	44	47
COCCCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875077714	EG	On-Demand	Anodyne	DRD4	26	47
COCCCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875077714	EG	On-Demand	Anodyne	DRD3	53	39
COCCCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875077714	EG	On-Demand	Anodyne	KCNA3	39	40
COCCCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875077714	EG	On-Demand	Anodyne	RBP4	29	40
COCCCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875077715	EG	On-Demand	Anodyne	HTR1A	34	41
COCCCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875077715	EG	On-Demand	Anodyne	DRD2	44	47
COCCCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875077715	EG	On-Demand	Anodyne	DRD4	26	47
COCCCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875077715	EG	On-Demand	Anodyne	DRD3	53	39
COCCCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875077715	EG	On-Demand	Anodyne	KCNA3	39	40
COCCCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875077715	EG	On-Demand	Anodyne	RBP4	29	40
O=C(NC1CCC1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875077717	CD	On-Demand	Anodyne	OXTR	53	38
O=C(NC1CCC1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875077717	CD	On-Demand	Anodyne	SLC18A3	15	41
O=C(NC1CCC1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875077718	CD	On-Demand	Anodyne	OXTR	53	38
O=C(NC1CCC1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875077718	CD	On-Demand	Anodyne	SLC18A3	15	41
N#CCc1ccsc1C(=O)N[C@@H](CN1CCOCC1)c1ccccc1	ZINC000875077740	FF	On-Demand	Mild	CASR	48	41
O=C(NCc1ccccc1N1CCOCC1)C(=O)NCc1cccc(F)c1F	ZINC000875077744	GD	On-Demand	Anodyne	HTR1A	15	40
O=C(NCc1ccccc1N1CCOCC1)C(=O)NCc1cccc(F)c1F	ZINC000875077744	GD	On-Demand	Anodyne	KCNQ2	54	35
O=C(NCc1ccccc1N1CCOCC1)C(=O)NCc1cccc(F)c1F	ZINC000875077744	GD	On-Demand	Anodyne	P2RX7	21	44
O=C(NCc1ccccc1N1CCOCC1)C(=O)NCc1cccc(F)c1F	ZINC000875077744	GD	On-Demand	Anodyne	SCN10A	17	51
O=C(NCc1ccccc1N1CCOCC1)C(=O)NCc1cccc(F)c1F	ZINC000875077744	GD	On-Demand	Anodyne	PIK3CB	40	39
O=C(NCc1ccccc1N1CCOCC1)C(=O)NCc1cccc(F)c1F	ZINC000875077744	GD	On-Demand	Anodyne	STAT6	52	45
CN(Cc1ncc[nH]1)C(=O)C(=O)NCc1ccccc1N1CCOCC1	ZINC000875077757	FC	On-Demand	Anodyne	SCN10A	15	44
O=C(NCCCCC1CC1)C(=O)NCc1ccccc1N1CCOCC1	ZINC000875077763	FD	On-Demand	Anodyne	DRD3	45	34
O=C(NCCCCC1CC1)C(=O)NCc1ccccc1N1CCOCC1	ZINC000875077763	FD	On-Demand	Anodyne	SCN10A	15	45
O=C(NCc1ccccc1N1CCOCC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875077776	FD	On-Demand	Anodyne	SCN10A	15	45
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccc(OCc2cccnc2)cc1	ZINC000875077791	GF	On-Demand	Anodyne	PTAFR	50	39
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccc(OCc2cccnc2)cc1	ZINC000875077791	GF	On-Demand	Anodyne	ACACA	22	43
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccc(OCc2cccnc2)cc1	ZINC000875077791	GF	On-Demand	Anodyne	ACACB	23	43
CC[C@H](C)NC(=O)c1cccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875077807	FF	On-Demand	Anodyne	ST14	65	34
CC[C@H](C)NC(=O)c1cccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875077807	FF	On-Demand	Anodyne	CACNA1I	52	37
CC[C@H](C)NC(=O)c1cccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875077808	FF	On-Demand	Anodyne	ST14	65	34
CC[C@H](C)NC(=O)c1cccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875077808	FF	On-Demand	Anodyne	CACNA1I	52	37
C=CC(C)(C)CCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)cc1	ZINC000875077820	FE	On-Demand	Mild	STAT6	62	36
NC(=O)c1ccc(N2CCCC2)c(NC(=O)C(F)(F)c2cc(F)cc(F)c2)c1	ZINC000875077824	GG	On-Demand	Anodyne	KCNQ2	59	38
NC(=O)c1ccc(N2CCCC2)c(NC(=O)C(F)(F)c2cc(F)cc(F)c2)c1	ZINC000875077824	GG	On-Demand	Anodyne	TAAR1	27	44
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(OCc2cccnc2)cc1	ZINC000875077830	GE	On-Demand	Anodyne	PTAFR	41	39
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(OCc2cccnc2)cc1	ZINC000875077830	GE	On-Demand	Anodyne	ACACA	23	44
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(OCc2cccnc2)cc1	ZINC000875077830	GE	On-Demand	Anodyne	ACACB	25	44
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(OCc2cccnc2)cc1	ZINC000875077830	GE	On-Demand	Anodyne	CYP26A1	54	38
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(OCc2cccnc2)cc1	ZINC000875077830	GE	On-Demand	Anodyne	VCP	43	34
O=C(NCc1ccccc1N1CCOCC1)C(=O)N[C@H]1CCCn2nccc21	ZINC000875077875	GC	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1ccccc1N1CCOCC1)C(=O)N[C@@H]1CCCn2nccc21	ZINC000875077877	GC	On-Demand	Anodyne	SCN10A	15	44
COC(=O)N(C)NC(=O)N[C@H](C)c1ccc(OCc2cccnc2)cc1	ZINC000875077889	FF	On-Demand	Reactive	ACACA	24	46
COC(=O)N(C)NC(=O)N[C@H](C)c1ccc(OCc2cccnc2)cc1	ZINC000875077889	FF	On-Demand	Reactive	ACACB	25	46
COC(=O)N(C)NC(=O)N[C@H](C)c1ccc(OCc2cccnc2)cc1	ZINC000875077889	FF	On-Demand	Reactive	CYP26A1	48	40
COC(=O)N(C)NC(=O)N[C@@H](C)c1ccc(OCc2cccnc2)cc1	ZINC000875077890	FF	On-Demand	Reactive	ACACA	24	46
COC(=O)N(C)NC(=O)N[C@@H](C)c1ccc(OCc2cccnc2)cc1	ZINC000875077890	FF	On-Demand	Reactive	ACACB	25	46
COC(=O)N(C)NC(=O)N[C@@H](C)c1ccc(OCc2cccnc2)cc1	ZINC000875077890	FF	On-Demand	Reactive	CYP26A1	48	40
C[C@@H]1CN(Cc2ccccc2)C[C@H]1CNC(=O)C(=O)NCCS(C)(=O)=O	ZINC000875077907	GC	On-Demand	Anodyne	DRD4	18	49
C[C@H]1CN(Cc2ccccc2)C[C@H]1CNC(=O)C(=O)NCCS(C)(=O)=O	ZINC000875077908	GC	On-Demand	Anodyne	DRD4	18	49
C[C@H]1CN(Cc2ccccc2)C[C@@H]1CNC(=O)C(=O)NCCS(C)(=O)=O	ZINC000875077909	GC	On-Demand	Anodyne	DRD4	18	49
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1CNC(=O)C(=O)NCCS(C)(=O)=O	ZINC000875077910	GC	On-Demand	Anodyne	DRD4	18	49
O=C(CCc1c(-c2ccc(F)cc2)[nH]c2ccc(F)cc12)OCCCO	ZINC000875077914	FH	On-Demand	Anodyne	TSPO	20	44
O=C(CCc1c(-c2ccc(F)cc2)[nH]c2ccc(F)cc12)OCCCO	ZINC000875077914	FH	On-Demand	Anodyne	MPO	52	40
O=C(NCCC1CCCCC1)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875077921	FF	On-Demand	Anodyne	BMP1	48	41
CC(C)(C)OC(=O)N1CCC(NC(=O)C(=O)N2CC[C@H]3CSC[C@@H]3C2)CC1	ZINC000875077922	GD	On-Demand	Anodyne	GPR119	26	40
CC(C)(C)OC(=O)N1CCC(NC(=O)C(=O)N2CC[C@@H]3CSC[C@@H]3C2)CC1	ZINC000875077923	GD	On-Demand	Anodyne	GPR119	26	40
CC(C)(C)OC(=O)N1CCC(NC(=O)C(=O)N2CC[C@H]3CSC[C@H]3C2)CC1	ZINC000875077924	GD	On-Demand	Anodyne	GPR119	26	40
CC(C)(C)OC(=O)N1CCC(NC(=O)C(=O)N2CC[C@@H]3CSC[C@H]3C2)CC1	ZINC000875077925	GD	On-Demand	Anodyne	GPR119	26	40
COc1ccc(O[C@H](C)CNC(=O)C(=O)N[C@H]2CC23CCC3)cc1	ZINC000875077926	ED	On-Demand	Anodyne	MTNR1A	16	44
COc1ccc(O[C@H](C)CNC(=O)C(=O)N[C@@H]2CC23CCC3)cc1	ZINC000875077927	ED	On-Demand	Anodyne	MTNR1A	16	44
COc1ccc(O[C@@H](C)CNC(=O)C(=O)N[C@@H]2CC23CCC3)cc1	ZINC000875077928	ED	On-Demand	Anodyne	MTNR1A	16	44
COc1ccc(O[C@@H](C)CNC(=O)C(=O)N[C@H]2CC23CCC3)cc1	ZINC000875077929	ED	On-Demand	Anodyne	MTNR1A	16	44
Cn1cccc1CNC(=O)C(=O)N1CCC(C)(N2CCCCC2)CC1	ZINC000875077950	ED	On-Demand	Anodyne	CCR5	18	41
Cn1cccc1CNC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875077956	EF	On-Demand	Anodyne	SIGMAR1	20	42
Cn1cccc1CNC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875077956	EF	On-Demand	Anodyne	FAAH	60	44
Cn1cccc1CNC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875077956	EF	On-Demand	Anodyne	CES1	64	36
Cn1cccc1CNC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875077956	EF	On-Demand	Anodyne	CAPN2	22	41
Cn1cccc1CNC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875077956	EF	On-Demand	Anodyne	AMP1_PLAFQ	31	47
N#CCc1ccsc1C(=O)N[C@H](CN1CCOCC1)c1ccccc1	ZINC000875077958	FF	On-Demand	Mild	CASR	48	41
CCCNC(=O)c1cccc(CNC(=O)NCCN2CCOC[C@H]2CC)c1	ZINC000875077975	GD	On-Demand	Anodyne	DRD4	43	34
CCCNC(=O)c1cccc(CNC(=O)NCCN2CCOC[C@@H]2CC)c1	ZINC000875077977	GD	On-Demand	Anodyne	DRD4	43	34
Cn1nc(Cl)c(C(=O)N[C@H](CN2CCOCC2)c2ccccc2)c1Cl	ZINC000875077978	GF	On-Demand	Anodyne	CASR	49	36
Cn1nc(Cl)c(C(=O)N[C@H](CN2CCOCC2)c2ccccc2)c1Cl	ZINC000875077978	GF	On-Demand	Anodyne	TACR3	48	39
Cn1nc(Cl)c(C(=O)N[C@@H](CN2CCOCC2)c2ccccc2)c1Cl	ZINC000875077980	GF	On-Demand	Anodyne	CASR	49	36
Cn1nc(Cl)c(C(=O)N[C@@H](CN2CCOCC2)c2ccccc2)c1Cl	ZINC000875077980	GF	On-Demand	Anodyne	TACR3	48	39
CC(C)(C)OC(=O)N1CCc2c(CNC(=O)C(=O)NC3CCC3)cccc2C1	ZINC000875077988	GE	On-Demand	Anodyne	GPR119	33	40
CC[C@@H]1COCCN1CCNC(=O)NCCCCN1CCOCC1	ZINC000875078011	EC	On-Demand	Anodyne	EPHX2	18	49
O=C(NCCCCN1CCOCC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875078015	FD	On-Demand	Anodyne	HTR1A	27	46
O=C(NCCCCN1CCOCC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875078015	FD	On-Demand	Anodyne	DRD2	22	41
O=C(NCCCCN1CCOCC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875078015	FD	On-Demand	Anodyne	ADRA1D	18	40
O=C(NCCCCN1CCOCC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875078015	FD	On-Demand	Anodyne	HTR2A	19	41
O=C(NCCCCN1CCOCC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875078015	FD	On-Demand	Anodyne	ADRA1B	23	40
O=C(NCCCCN1CCOCC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875078015	FD	On-Demand	Anodyne	DRD3	44	41
O=C(NCCCCN1CCOCC1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875078016	FD	On-Demand	Anodyne	EPHX2	15	42
O=C(NCCCCN1CCOCC1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875078017	FD	On-Demand	Anodyne	EPHX2	15	42
COCCCCNC(=O)NC1(C)CC(F)(F)C1	ZINC000875078019	CD	On-Demand	Anodyne	EPHX2	22	49
COCCCCNC(=O)N[C@@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875078020	ED	On-Demand	Anodyne	MTNR1A	53	44
COCCCCNC(=O)N[C@@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875078020	ED	On-Demand	Anodyne	MTNR1B	48	45
COCCCCNC(=O)N[C@@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875078021	ED	On-Demand	Anodyne	MTNR1A	53	44
COCCCCNC(=O)N[C@@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875078021	ED	On-Demand	Anodyne	MTNR1B	48	45
COCCCCNC(=O)N[C@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875078022	ED	On-Demand	Anodyne	MTNR1A	53	44
COCCCCNC(=O)N[C@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875078022	ED	On-Demand	Anodyne	MTNR1B	48	45
COCCCCNC(=O)N[C@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875078023	ED	On-Demand	Anodyne	MTNR1A	53	44
COCCCCNC(=O)N[C@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875078023	ED	On-Demand	Anodyne	MTNR1B	48	45
COC(=O)C1(O)CN(C(=O)NCCCCN2CCCC[C@H]2C)C1	ZINC000875078024	EC	On-Demand	Anodyne	HRH3	22	40
COC(=O)C1(O)CN(C(=O)NCCCCN2CCCC[C@@H]2C)C1	ZINC000875078025	EC	On-Demand	Anodyne	HRH3	22	40
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NCCCCN1CCOCC1	ZINC000875078031	GE	On-Demand	Anodyne	EPHX2	21	44
N#Cc1cccc([C@H](NC(=O)NCCCCN2CCOCC2)C(F)(F)F)c1	ZINC000875078040	GF	On-Demand	Mild	DRD3	32	43
N#Cc1cccc([C@H](NC(=O)NCCCCN2CCOCC2)C(F)(F)F)c1	ZINC000875078040	GF	On-Demand	Mild	CASR	47	48
N#Cc1cccc([C@H](NC(=O)NCCCCN2CCOCC2)C(F)(F)F)c1	ZINC000875078040	GF	On-Demand	Mild	CCR3	28	47
N#Cc1cccc([C@H](NC(=O)NCCCCN2CCOCC2)C(F)(F)F)c1	ZINC000875078040	GF	On-Demand	Mild	EPHX2	23	40
N#Cc1cccc([C@H](NC(=O)NCCCCN2CCOCC2)C(F)(F)F)c1	ZINC000875078040	GF	On-Demand	Mild	MCHR1	21	40
N#Cc1cccc([C@@H](NC(=O)NCCCCN2CCOCC2)C(F)(F)F)c1	ZINC000875078041	GF	On-Demand	Mild	DRD3	32	43
N#Cc1cccc([C@@H](NC(=O)NCCCCN2CCOCC2)C(F)(F)F)c1	ZINC000875078041	GF	On-Demand	Mild	CASR	47	48
N#Cc1cccc([C@@H](NC(=O)NCCCCN2CCOCC2)C(F)(F)F)c1	ZINC000875078041	GF	On-Demand	Mild	CCR3	28	47
N#Cc1cccc([C@@H](NC(=O)NCCCCN2CCOCC2)C(F)(F)F)c1	ZINC000875078041	GF	On-Demand	Mild	EPHX2	23	40
N#Cc1cccc([C@@H](NC(=O)NCCCCN2CCOCC2)C(F)(F)F)c1	ZINC000875078041	GF	On-Demand	Mild	MCHR1	21	40
COCCCCNC(=O)N1CCC[C@]1(C)Cc1ccc(F)c(F)c1	ZINC000875078051	EG	On-Demand	Anodyne	ADRA1A	41	37
COCCCCNC(=O)N1CCC[C@]1(C)Cc1ccc(F)c(F)c1	ZINC000875078051	EG	On-Demand	Anodyne	SLC12A5	56	38
COCCCCNC(=O)N1CCC[C@@]1(C)Cc1ccc(F)c(F)c1	ZINC000875078052	EG	On-Demand	Anodyne	ADRA1A	41	37
COCCCCNC(=O)N1CCC[C@@]1(C)Cc1ccc(F)c(F)c1	ZINC000875078052	EG	On-Demand	Anodyne	SLC12A5	56	38
CCN(CC)S(=O)(=O)c1cc(C(=O)Oc2ccc(C(F)(F)F)cc2)ccc1OC	ZINC000875078085	IH	On-Demand	Anodyne	ACR	46	42
CCN(CC)S(=O)(=O)c1cc(C(=O)Oc2ccc(C(F)(F)F)cc2)ccc1OC	ZINC000875078085	IH	On-Demand	Anodyne	PTGDR2	15	42
COC(=O)c1cnc(NC(=O)Cc2csc(C3CC3)n2)s1	ZINC000875078101	DE	On-Demand	Anodyne	CDK5	47	39
CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccccc1OC	ZINC000875078111	EF	On-Demand	Anodyne	SLC6A4	26	41
CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccccc1OC	ZINC000875078111	EF	On-Demand	Anodyne	SLC6A3	54	41
CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccccc1OC	ZINC000875078114	EF	On-Demand	Anodyne	SLC6A4	26	41
CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccccc1OC	ZINC000875078114	EF	On-Demand	Anodyne	SLC6A3	54	41
C=CCc1ccc(OCC(=O)Oc2ccc(C(F)(F)F)cc2)c(OC)c1	ZINC000875078133	FI	On-Demand	Mild	PPARA	19	45
C=CCc1ccc(OCC(=O)Oc2ccc(C(F)(F)F)cc2)c(OC)c1	ZINC000875078133	FI	On-Demand	Mild	PPARD	68	45
CN(C(=O)[C@H]1CCC(=O)O1)c1ccc([N+](=O)[O-])cc1	ZINC000875078134	CD	On-Demand	Bother	SLC27A4	51	34
CC[C@@H](NC(=O)NCCN1CC[C@H](O)C1)c1ccccc1OC	ZINC000875078135	DD	On-Demand	Anodyne	HTR1A	35	42
CC[C@@H](NC(=O)NCCN1CC[C@H](O)C1)c1ccccc1OC	ZINC000875078135	DD	On-Demand	Anodyne	DRD2	39	42
CC[C@@H](NC(=O)NCCN1CC[C@H](O)C1)c1ccccc1OC	ZINC000875078135	DD	On-Demand	Anodyne	DRD4	41	32
CC[C@@H](NC(=O)NCCN1CC[C@H](O)C1)c1ccccc1OC	ZINC000875078135	DD	On-Demand	Anodyne	DRD3	47	39
CC[C@@H](NC(=O)NCCN1CC[C@H](O)C1)c1ccccc1OC	ZINC000875078135	DD	On-Demand	Anodyne	OPRK1	20	44
CC[C@@H](NC(=O)NCCN1CC[C@H](O)C1)c1ccccc1OC	ZINC000875078135	DD	On-Demand	Anodyne	HTR4	41	36
CC[C@@H](NC(=O)NCCN1CC[C@H](O)C1)c1ccccc1OC	ZINC000875078135	DD	On-Demand	Anodyne	HTR7	25	41
CC[C@@H](NC(=O)NCCN1CC[C@H](O)C1)c1ccccc1OC	ZINC000875078135	DD	On-Demand	Anodyne	HCN1	51	31
CC[C@@H](NC(=O)NCCN1CC[C@H](O)C1)c1ccccc1OC	ZINC000875078135	DD	On-Demand	Anodyne	HCN4	47	30
CC[C@@H](NC(=O)NCCN1CC[C@@H](O)C1)c1ccccc1OC	ZINC000875078137	DD	On-Demand	Anodyne	HTR1A	35	42
CC[C@@H](NC(=O)NCCN1CC[C@@H](O)C1)c1ccccc1OC	ZINC000875078137	DD	On-Demand	Anodyne	DRD2	39	42
CC[C@@H](NC(=O)NCCN1CC[C@@H](O)C1)c1ccccc1OC	ZINC000875078137	DD	On-Demand	Anodyne	DRD4	41	32
CC[C@@H](NC(=O)NCCN1CC[C@@H](O)C1)c1ccccc1OC	ZINC000875078137	DD	On-Demand	Anodyne	DRD3	47	39
CC[C@@H](NC(=O)NCCN1CC[C@@H](O)C1)c1ccccc1OC	ZINC000875078137	DD	On-Demand	Anodyne	OPRK1	20	44
CC[C@@H](NC(=O)NCCN1CC[C@@H](O)C1)c1ccccc1OC	ZINC000875078137	DD	On-Demand	Anodyne	HTR4	41	36
CC[C@@H](NC(=O)NCCN1CC[C@@H](O)C1)c1ccccc1OC	ZINC000875078137	DD	On-Demand	Anodyne	HTR7	25	41
CC[C@@H](NC(=O)NCCN1CC[C@@H](O)C1)c1ccccc1OC	ZINC000875078137	DD	On-Demand	Anodyne	HCN1	51	31
CC[C@@H](NC(=O)NCCN1CC[C@@H](O)C1)c1ccccc1OC	ZINC000875078137	DD	On-Demand	Anodyne	HCN4	47	30
CC[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccccc1OC	ZINC000875078141	ED	On-Demand	Anodyne	HCN1	52	33
COC(=O)N(C)NC(=O)N[C@H](C)c1ccc(OC2CCCC2)c(OC)c1	ZINC000875078163	FF	On-Demand	Reactive	PDE4A	37	44
COC(=O)N(C)NC(=O)N[C@H](C)c1ccc(OC2CCCC2)c(OC)c1	ZINC000875078163	FF	On-Demand	Reactive	PDE4B	18	44
COC(=O)N(C)NC(=O)N[C@H](C)c1ccc(OC2CCCC2)c(OC)c1	ZINC000875078163	FF	On-Demand	Reactive	PDE4D	18	44
COC(=O)N(C)NC(=O)N[C@H](C)c1ccc(OC2CCCC2)c(OC)c1	ZINC000875078163	FF	On-Demand	Reactive	PDE4C	16	44
COC(=O)N(C)NC(=O)N[C@@H](C)c1ccc(OC2CCCC2)c(OC)c1	ZINC000875078164	FF	On-Demand	Reactive	PDE4A	37	44
COC(=O)N(C)NC(=O)N[C@@H](C)c1ccc(OC2CCCC2)c(OC)c1	ZINC000875078164	FF	On-Demand	Reactive	PDE4B	18	44
COC(=O)N(C)NC(=O)N[C@@H](C)c1ccc(OC2CCCC2)c(OC)c1	ZINC000875078164	FF	On-Demand	Reactive	PDE4D	18	44
COC(=O)N(C)NC(=O)N[C@@H](C)c1ccc(OC2CCCC2)c(OC)c1	ZINC000875078164	FF	On-Demand	Reactive	PDE4C	16	44
C[C@@H](NC(=O)NC1(C)CC(F)(F)C1)c1ccc(OC(F)F)cc1	ZINC000875078190	EH	On-Demand	Anodyne	ACACA	18	40
C[C@@H](NC(=O)NC1(C)CC(F)(F)C1)c1ccc(OC(F)F)cc1	ZINC000875078190	EH	On-Demand	Anodyne	ACACB	18	40
C[C@H](NC(=O)NC1(C)CC(F)(F)C1)c1ccc(OC(F)F)cc1	ZINC000875078191	EH	On-Demand	Anodyne	ACACA	18	40
C[C@H](NC(=O)NC1(C)CC(F)(F)C1)c1ccc(OC(F)F)cc1	ZINC000875078191	EH	On-Demand	Anodyne	ACACB	18	40
COC(=O)N(C)NC(=O)N[C@H](C)c1cccc(OC(C)C)c1	ZINC000875078198	DE	On-Demand	Reactive	ACACA	19	40
COC(=O)N(C)NC(=O)N[C@H](C)c1cccc(OC(C)C)c1	ZINC000875078198	DE	On-Demand	Reactive	ACACB	20	40
COC(=O)N(C)NC(=O)N[C@@H](C)c1cccc(OC(C)C)c1	ZINC000875078199	DE	On-Demand	Reactive	ACACA	19	40
COC(=O)N(C)NC(=O)N[C@@H](C)c1cccc(OC(C)C)c1	ZINC000875078199	DE	On-Demand	Reactive	ACACB	20	40
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1ccc(OCc2cccnc2)cc1	ZINC000875078213	GH	On-Demand	Anodyne	ACACA	23	44
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1ccc(OCc2cccnc2)cc1	ZINC000875078213	GH	On-Demand	Anodyne	ACACB	23	44
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1ccc(OCc2cccnc2)cc1	ZINC000875078213	GH	On-Demand	Anodyne	CYP26A1	52	38
O=C(NCCC1CCCCC1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875078219	GG	On-Demand	Anodyne	SMO	30	40
O=C(NCCC1CCCCC1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875078219	GG	On-Demand	Anodyne	ETHR	67	57
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000875078224	GC	On-Demand	Anodyne	HTR1A	58	44
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000875078224	GC	On-Demand	Anodyne	DRD2	69	42
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000875078224	GC	On-Demand	Anodyne	DRD4	61	40
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000875078224	GC	On-Demand	Anodyne	ACHE	34	45
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000875078224	GC	On-Demand	Anodyne	ADRA1D	60	45
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000875078224	GC	On-Demand	Anodyne	HTR2A	49	45
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000875078224	GC	On-Demand	Anodyne	HTR2C	32	41
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000875078224	GC	On-Demand	Anodyne	SLC6A4	19	41
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000875078224	GC	On-Demand	Anodyne	ADRA1A	85	45
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000875078224	GC	On-Demand	Anodyne	ADRA1B	58	45
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000875078224	GC	On-Demand	Anodyne	DRD3	88	47
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000875078224	GC	On-Demand	Anodyne	HTR4	19	41
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000875078224	GC	On-Demand	Anodyne	HTR7	49	49
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000875078224	GC	On-Demand	Anodyne	SIGMAR1	80	44
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000875078224	GC	On-Demand	Anodyne	BCHE	19	45
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000875078224	GC	On-Demand	Anodyne	CCR3	19	40
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000875078224	GC	On-Demand	Anodyne	FAAH	28	43
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000875078224	GC	On-Demand	Anodyne	NPFFR1	40	36
COCCCCNC(=O)N1CCC[C@@]1(C)Cc1ccc(C)cc1	ZINC000875078271	DH	On-Demand	Anodyne	SLC12A5	59	42
COCCCCNC(=O)N1CCC[C@]1(C)Cc1ccc(C)cc1	ZINC000875078272	DH	On-Demand	Anodyne	SLC12A5	59	42
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCCN3CCOCC3)C[C@@H]1C2	ZINC000875078283	EC	On-Demand	Anodyne	EPHX2	26	50
COCCCCNC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875078284	BC	On-Demand	Anodyne	EPHX2	25	47
COCCCCNC(=O)N1CCCSC[C@H]1c1ccccc1OC	ZINC000875078285	FG	On-Demand	Anodyne	DRD3	42	38
COCCCCNC(=O)N1CCCSC[C@@H]1c1ccccc1OC	ZINC000875078286	FG	On-Demand	Anodyne	DRD3	42	38
O=C(NCCCCN1CCOCC1)N1Cc2cccc(O)c2C1	ZINC000875078288	DD	On-Demand	Clean	HTR1A	21	40
O=C(NCCCCN1CCOCC1)N1Cc2cccc(O)c2C1	ZINC000875078288	DD	On-Demand	Clean	DRD3	49	39
O=C(NCCCCN1CCOCC1)N1Cc2cccc(O)c2C1	ZINC000875078288	DD	On-Demand	Clean	PAOX	16	40
O=C(NCCCCN1CCOCC1)N1Cc2cccc(O)c2C1	ZINC000875078288	DD	On-Demand	Clean	EPHX2	22	43
COCCCCNC(=O)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875078345	CD	On-Demand	Anodyne	EPHX2	16	42
COCCCCNC(=O)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875078346	CD	On-Demand	Anodyne	EPHX2	16	42
COCCCCNC(=O)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875078347	CD	On-Demand	Anodyne	EPHX2	16	42
COCCCCNC(=O)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875078348	CD	On-Demand	Anodyne	EPHX2	16	42
O=C(NC1CCC1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875078356	DD	On-Demand	Anodyne	CHRNA7	42	35
O=C(NC1CCC1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875078356	DD	On-Demand	Anodyne	C3AR1	48	47
O=C(NC1CCC1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875078357	DD	On-Demand	Anodyne	CHRNA7	42	35
O=C(NC1CCC1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875078357	DD	On-Demand	Anodyne	C3AR1	48	47
COCCCCNC(=O)NC[C@@H]1CN(Cc2ccccc2C)CCO1	ZINC000875078361	ED	On-Demand	Anodyne	DRD4	23	41
COCCCCNC(=O)NC[C@H]1CN(Cc2ccccc2C)CCO1	ZINC000875078362	ED	On-Demand	Anodyne	DRD4	23	41
COC(=O)N(C)NC(=O)NCCCCN1CCOCC1	ZINC000875078365	CC	On-Demand	Reactive	EPHX2	17	46
CC[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1OC	ZINC000875078389	FD	On-Demand	Anodyne	DRD3	15	40
CC[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1OC	ZINC000875078389	FD	On-Demand	Anodyne	CACNA1G	36	42
COC(=O)N(C)NC(=O)N[C@@H](C)c1ccc(NC(=O)C2CC2)cc1	ZINC000875078390	EE	On-Demand	Reactive	F7	18	50
COC(=O)N(C)NC(=O)N[C@H](C)c1ccc(NC(=O)C2CC2)cc1	ZINC000875078391	EE	On-Demand	Reactive	F7	18	50
C[C@@H](NC(=O)N(C)CCc1cccc(C#N)c1)c1ccc(NC(=O)C2CC2)cc1	ZINC000875078419	GH	On-Demand	Mild	MCHR1	32	40
CC[C@@H](NC(=O)N1C[C@@H]2CCC[C@]2(CO)C1)c1ccccc1OC	ZINC000875078426	EF	On-Demand	Anodyne	HCN1	42	31
CC[C@@H](NC(=O)N1C[C@@H]2CCC[C@]2(CO)C1)c1ccccc1OC	ZINC000875078426	EF	On-Demand	Anodyne	HCN4	40	31
C[C@H]1CC(=O)N[C@@H](C(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000875078460	CD	On-Demand	Bother	SLC27A4	51	34
CN(C(=O)c1cccn(C2CC2)c1=O)c1ccc([N+](=O)[O-])cc1	ZINC000875078463	DE	On-Demand	Bother	SLC27A4	48	31
CC[C@@H](NC(=O)N1CCc2nc(C3CC3)ncc2C1)c1ccccc1OC	ZINC000875078469	FH	On-Demand	Anodyne	MAPK1	51	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(OC(C)C)c(OC)c1	ZINC000875078470	GG	On-Demand	Anodyne	SLC6A4	22	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(OC(C)C)c(OC)c1	ZINC000875078470	GG	On-Demand	Anodyne	SLC6A3	44	41
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NC2CCC2)c1	ZINC000875078500	CD	On-Demand	Anodyne	SSTR5	31	42
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NC2CCC2)c1	ZINC000875078502	CD	On-Demand	Anodyne	SSTR5	31	42
COCCCCNC(=O)NCC[C@@H](O)C1CCCC1	ZINC000875078520	CD	On-Demand	Anodyne	EPHX2	16	56
COCCCCNC(=O)NCC[C@H](O)C1CCCC1	ZINC000875078522	CD	On-Demand	Anodyne	EPHX2	16	56
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NC3CCC3)C2)c1	ZINC000875078557	EC	On-Demand	Anodyne	DRD4	43	46
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NC3CCC3)C2)c1	ZINC000875078557	EC	On-Demand	Anodyne	CCR3	26	43
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NC3CCC3)C2)c1	ZINC000875078559	EC	On-Demand	Anodyne	DRD4	43	46
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NC3CCC3)C2)c1	ZINC000875078559	EC	On-Demand	Anodyne	CCR3	26	43
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)C(=O)NC1CCC1	ZINC000875078569	EE	On-Demand	Anodyne	LTA4H	18	43
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)C(=O)NC1CCC1	ZINC000875078569	EE	On-Demand	Anodyne	SIGMAR1	31	47
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)C(=O)NC1CCC1	ZINC000875078569	EE	On-Demand	Anodyne	BIRC2	20	40
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCS(C)(=O)=O)C2)cc1	ZINC000875078570	FB	On-Demand	Anodyne	DRD4	35	52
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCS(C)(=O)=O)C2)cc1	ZINC000875078570	FB	On-Demand	Anodyne	SIGMAR1	22	43
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCS(C)(=O)=O)C2)cc1	ZINC000875078570	FB	On-Demand	Anodyne	SSTR5	42	39
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCS(C)(=O)=O)C2)cc1	ZINC000875078570	FB	On-Demand	Anodyne	CCR3	28	45
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCS(C)(=O)=O)C2)cc1	ZINC000875078570	FB	On-Demand	Anodyne	UTS2R	23	41
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCS(C)(=O)=O)C2)cc1	ZINC000875078570	FB	On-Demand	Anodyne	CCR2	17	48
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCS(C)(=O)=O)C2)cc1	ZINC000875078570	FB	On-Demand	Anodyne	MCHR1	36	47
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCS(C)(=O)=O)C2)cc1	ZINC000875078576	FB	On-Demand	Anodyne	DRD4	35	52
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCS(C)(=O)=O)C2)cc1	ZINC000875078576	FB	On-Demand	Anodyne	SIGMAR1	22	43
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCS(C)(=O)=O)C2)cc1	ZINC000875078576	FB	On-Demand	Anodyne	SSTR5	42	39
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCS(C)(=O)=O)C2)cc1	ZINC000875078576	FB	On-Demand	Anodyne	CCR3	28	45
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCS(C)(=O)=O)C2)cc1	ZINC000875078576	FB	On-Demand	Anodyne	UTS2R	23	41
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCS(C)(=O)=O)C2)cc1	ZINC000875078576	FB	On-Demand	Anodyne	CCR2	17	48
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCS(C)(=O)=O)C2)cc1	ZINC000875078576	FB	On-Demand	Anodyne	MCHR1	36	47
COCCCCNC(=O)NNc1ccc(OC)cc1Br	ZINC000875078588	EF	On-Demand	Reactive	MTNR1A	56	40
COCCCCNC(=O)NNc1ccc(OC)cc1Br	ZINC000875078588	EF	On-Demand	Reactive	MTNR1B	45	41
COCCCCNC(=O)N[C@@H]1C[C@H]2C[C@@]2(C(=O)OC)C1	ZINC000875078638	CD	On-Demand	Anodyne	EPHX2	25	51
COc1ccc(O[C@@H](C)CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875078640	FD	On-Demand	Anodyne	MMP13	15	40
COc1ccc(O[C@@H](C)CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875078640	FD	On-Demand	Anodyne	MTNR1A	23	46
COc1ccc(O[C@@H](C)CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875078640	FD	On-Demand	Anodyne	MTNR1B	20	46
COc1ccc(O[C@@H](C)CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875078640	FD	On-Demand	Anodyne	MMP3	15	40
COc1ccc(O[C@@H](C)CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875078640	FD	On-Demand	Anodyne	MMP1	17	40
COc1ccc(O[C@H](C)CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875078642	FD	On-Demand	Anodyne	MMP13	15	40
COc1ccc(O[C@H](C)CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875078642	FD	On-Demand	Anodyne	MTNR1A	23	46
COc1ccc(O[C@H](C)CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875078642	FD	On-Demand	Anodyne	MTNR1B	20	46
COc1ccc(O[C@H](C)CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875078642	FD	On-Demand	Anodyne	MMP3	15	40
COc1ccc(O[C@H](C)CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875078642	FD	On-Demand	Anodyne	MMP1	17	40
COc1ccc(O[C@H](C)CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875078644	FD	On-Demand	Anodyne	MMP13	15	40
COc1ccc(O[C@H](C)CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875078644	FD	On-Demand	Anodyne	MTNR1A	23	46
COc1ccc(O[C@H](C)CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875078644	FD	On-Demand	Anodyne	MTNR1B	20	46
COc1ccc(O[C@H](C)CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875078644	FD	On-Demand	Anodyne	MMP3	15	40
COc1ccc(O[C@H](C)CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875078644	FD	On-Demand	Anodyne	MMP1	17	40
COc1ccc(O[C@@H](C)CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875078646	FD	On-Demand	Anodyne	MMP13	15	40
COc1ccc(O[C@@H](C)CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875078646	FD	On-Demand	Anodyne	MTNR1A	23	46
COc1ccc(O[C@@H](C)CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875078646	FD	On-Demand	Anodyne	MTNR1B	20	46
COc1ccc(O[C@@H](C)CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875078646	FD	On-Demand	Anodyne	MMP3	15	40
COc1ccc(O[C@@H](C)CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875078646	FD	On-Demand	Anodyne	MMP1	17	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(OC(C)C)c(OC)c1	ZINC000875078671	GG	On-Demand	Anodyne	SLC6A4	22	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(OC(C)C)c(OC)c1	ZINC000875078671	GG	On-Demand	Anodyne	SLC6A3	44	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(OC(C)C)c(OC)c1	ZINC000875078672	GG	On-Demand	Anodyne	SLC6A4	22	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(OC(C)C)c(OC)c1	ZINC000875078672	GG	On-Demand	Anodyne	SLC6A3	44	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(OC(C)C)c(OC)c1	ZINC000875078673	GG	On-Demand	Anodyne	SLC6A4	22	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(OC(C)C)c(OC)c1	ZINC000875078673	GG	On-Demand	Anodyne	SLC6A3	44	41
CN(C(=O)[C@@H]1[C@H]2CC[C@]3(COC(=O)[C@H]13)O2)c1ccc([N+](=O)[O-])cc1	ZINC000875078710	ED	On-Demand	Bother	SLC27A4	49	32
C[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1ccc(NC(=O)C2CC2)cc1	ZINC000875078714	GE	On-Demand	Anodyne	CACNA1H	49	43
COC(=O)c1cnc(NC(=O)[C@@H]2CC[C@H](Cc3ccccc3)O2)s1	ZINC000875078715	EF	On-Demand	Anodyne	CDK5	36	40
COC(=O)c1cnc(NC(=O)[C@@H]2CC[C@H](Cc3ccccc3)O2)s1	ZINC000875078715	EF	On-Demand	Anodyne	MGEA5	33	41
CCCOc1ccc([C@@H](C)NC(=O)N(CC)OCC)cc1OC	ZINC000875078718	DH	On-Demand	Anodyne	ACACB	16	40
CCCOc1ccc([C@H](C)NC(=O)N(CC)OCC)cc1OC	ZINC000875078719	DH	On-Demand	Anodyne	ACACB	16	40
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccc(NC(=O)C2CC2)cc1	ZINC000875078735	FG	On-Demand	Anodyne	EPHX2	20	42
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccc(NC(=O)C2CC2)cc1	ZINC000875078736	FG	On-Demand	Anodyne	EPHX2	20	42
COCCCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875078739	EG	On-Demand	Reactive	TSHR	43	33
COCCCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875078739	EG	On-Demand	Reactive	MAOB	32	40
COCCCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875078739	EG	On-Demand	Reactive	DRD3	19	44
COCCCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875078739	EG	On-Demand	Reactive	LTA4H	46	47
COCCCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875078739	EG	On-Demand	Reactive	CA1	16	47
COCCCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875078739	EG	On-Demand	Reactive	SCN2A	23	45
COCCCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875078739	EG	On-Demand	Reactive	MTNR1A	20	45
COCCCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875078739	EG	On-Demand	Reactive	MTNR1B	23	45
COCCCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875078739	EG	On-Demand	Reactive	PLA2G4B	58	34
COCCCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875078739	EG	On-Demand	Reactive	SLC6A5	42	36
COCCCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875078739	EG	On-Demand	Reactive	TAAR1	15	42
COCCCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875078739	EG	On-Demand	Reactive	FFAR1	34	41
CN(C)S(=O)(=O)c1cc(C(=O)Oc2ccc(C(F)(F)F)cc2)ccc1Br	ZINC000875078765	JH	On-Demand	Anodyne	ACR	35	44
O=C(NCCCCN1CCOCC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875078773	FD	On-Demand	Anodyne	HTR1A	21	41
O=C(NCCCCN1CCOCC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875078773	FD	On-Demand	Anodyne	DRD2	23	40
O=C(NCCCCN1CCOCC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875078773	FD	On-Demand	Anodyne	ADRA1A	40	38
O=C(NCCCCN1CCOCC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875078773	FD	On-Demand	Anodyne	DRD3	40	38
O=C(NCCCCN1CCOCC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875078773	FD	On-Demand	Anodyne	CCR1	40	40
O=C(NCCCCN1CCOCC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875078773	FD	On-Demand	Anodyne	EPHX2	32	45
O=C(NCCCCN1CCOCC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875078774	FD	On-Demand	Anodyne	HTR1A	21	41
O=C(NCCCCN1CCOCC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875078774	FD	On-Demand	Anodyne	DRD2	23	40
O=C(NCCCCN1CCOCC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875078774	FD	On-Demand	Anodyne	ADRA1A	40	38
O=C(NCCCCN1CCOCC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875078774	FD	On-Demand	Anodyne	DRD3	40	38
O=C(NCCCCN1CCOCC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875078774	FD	On-Demand	Anodyne	CCR1	40	40
O=C(NCCCCN1CCOCC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875078774	FD	On-Demand	Anodyne	EPHX2	32	45
O=C(COc1ccc(F)cc1)Oc1ccc(C(F)(F)F)cc1	ZINC000875078848	DH	On-Demand	Anodyne	PPARD	43	46
COCCCCNC(=O)N(C)C[C@H]1CCCCN1Cc1ccccc1	ZINC000875078849	EG	On-Demand	Anodyne	DRD2	27	43
COCCCCNC(=O)N(C)C[C@H]1CCCCN1Cc1ccccc1	ZINC000875078849	EG	On-Demand	Anodyne	FKBP1A	46	39
COCCCCNC(=O)N(C)C[C@H]1CCCCN1Cc1ccccc1	ZINC000875078849	EG	On-Demand	Anodyne	DRD3	23	44
COCCCCNC(=O)N(C)C[C@H]1CCCCN1Cc1ccccc1	ZINC000875078849	EG	On-Demand	Anodyne	LTA4H	16	44
COCCCCNC(=O)N(C)C[C@H]1CCCCN1Cc1ccccc1	ZINC000875078849	EG	On-Demand	Anodyne	SIGMAR1	24	45
O=C(NCCC1CCCCC1)C(=O)NCc1ccc(Br)cn1	ZINC000875078854	FF	On-Demand	Anodyne	BMP1	54	38
COCCCCNC(=O)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875078859	FF	On-Demand	Anodyne	ABL1	15	43
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCC1	ZINC000875078865	DF	On-Demand	Anodyne	FKBP1A	28	46
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCC1	ZINC000875078865	DF	On-Demand	Anodyne	GRIN2B	15	45
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCC1	ZINC000875078865	DF	On-Demand	Anodyne	MME	19	40
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCC1	ZINC000875078865	DF	On-Demand	Anodyne	SIGMAR1	32	46
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCC1	ZINC000875078865	DF	On-Demand	Anodyne	S1PR3	18	42
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCC1	ZINC000875078865	DF	On-Demand	Anodyne	PREP	44	36
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCC1	ZINC000875078865	DF	On-Demand	Anodyne	FAAH	70	47
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCC1	ZINC000875078865	DF	On-Demand	Anodyne	CES1	68	41
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCC1	ZINC000875078865	DF	On-Demand	Anodyne	EPHX2	23	56
O=C(NCCCCCCc1ccccc1)C(=O)NC1CCC1	ZINC000875078865	DF	On-Demand	Anodyne	AMP1_PLAFQ	26	48
O=C(NCCCCN1CCOCC1)NC[C@H]1C[C@H](O)C1	ZINC000875078875	CC	On-Demand	Anodyne	EPHX2	24	53
CC[C@@H](NC(=O)NCCCCOC)[C@@H](O)c1ccccc1	ZINC000875078889	CE	On-Demand	Anodyne	C3AR1	44	31
CC[C@@H](NC(=O)NCCCCOC)[C@@H](O)c1ccccc1	ZINC000875078889	CE	On-Demand	Anodyne	TACR3	42	38
CC[C@@H](NC(=O)NCCCCOC)[C@H](O)c1ccccc1	ZINC000875078893	CE	On-Demand	Anodyne	C3AR1	44	31
CC[C@@H](NC(=O)NCCCCOC)[C@H](O)c1ccccc1	ZINC000875078893	CE	On-Demand	Anodyne	TACR3	42	38
CCCCCCCNC(=O)C(=O)NC1CCC1	ZINC000875078915	BD	On-Demand	Mild	EPHX2	28	67
CCCCCCCNC(=O)C(=O)NC1CCC1	ZINC000875078915	BD	On-Demand	Mild	ASAH1	79	35
CCCCCCCNC(=O)C(=O)NC1CCC1	ZINC000875078915	BD	On-Demand	Mild	LASR	47	33
COCCCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875078916	DE	On-Demand	Anodyne	TRY1_BOVIN	48	34
COCCCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875078916	DE	On-Demand	Anodyne	PREP	41	37
COCCCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875078917	DE	On-Demand	Anodyne	TRY1_BOVIN	48	34
COCCCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875078917	DE	On-Demand	Anodyne	PREP	41	37
COCCCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875078918	DE	On-Demand	Anodyne	TRY1_BOVIN	48	34
COCCCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875078918	DE	On-Demand	Anodyne	PREP	41	37
COCCCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875078919	DE	On-Demand	Anodyne	TRY1_BOVIN	48	34
COCCCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875078919	DE	On-Demand	Anodyne	PREP	41	37
CC(C)(C)OC(=O)N1CCC(NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)CC1	ZINC000875078953	GD	On-Demand	Anodyne	GPR119	31	42
N#CCc1ccsc1C(=O)Nc1cc(C(N)=O)ccc1N1CCCC1	ZINC000875078965	FF	On-Demand	Mild	KCNQ2	64	35
N#CCc1ccsc1C(=O)Nc1cc(C(N)=O)ccc1N1CCCC1	ZINC000875078965	FF	On-Demand	Mild	CSF1R	17	42
COc1ccc(O[C@H](C)CNC(=O)C(=O)NCc2nn(C)cc2C(F)F)cc1	ZINC000875078968	GD	On-Demand	Anodyne	MTNR1A	15	42
COc1ccc(O[C@@H](C)CNC(=O)C(=O)NCc2nn(C)cc2C(F)F)cc1	ZINC000875078969	GD	On-Demand	Anodyne	MTNR1A	15	42
COc1ccc(O[C@H](C)CNC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875078970	FD	On-Demand	Anodyne	CHRM2	44	38
COc1ccc(O[C@H](C)CNC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875078970	FD	On-Demand	Anodyne	MTNR1A	24	49
COc1ccc(O[C@H](C)CNC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875078970	FD	On-Demand	Anodyne	MTNR1B	21	49
CC[C@@H](NC(=O)N(C)[C@H]1CCCCN(C)C1=O)c1ccccc1OC	ZINC000875078990	EF	On-Demand	Anodyne	HCN1	41	32
CC[C@@H](NC(=O)N(C)[C@H]1CCCCN(C)C1=O)c1ccccc1OC	ZINC000875078990	EF	On-Demand	Anodyne	HCN4	41	32
CC[C@@H](NC(=O)N(C)[C@@H]1CCCCN(C)C1=O)c1ccccc1OC	ZINC000875078992	EF	On-Demand	Anodyne	HCN1	41	32
CC[C@@H](NC(=O)N(C)[C@@H]1CCCCN(C)C1=O)c1ccccc1OC	ZINC000875078992	EF	On-Demand	Anodyne	HCN4	41	32
O=C(Cc1csc(C2CC2)n1)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000875078994	EG	On-Demand	Bother	EIF2AK3	48	39
C[C@@H](NC(=O)N1CC[C@@](C)(C(F)(F)F)C1)c1ccc(NC(=O)C2CC2)cc1	ZINC000875079003	GI	On-Demand	Anodyne	EPHX2	44	40
C[C@@H](NC(=O)N1CC[C@](C)(C(F)(F)F)C1)c1ccc(NC(=O)C2CC2)cc1	ZINC000875079005	GI	On-Demand	Anodyne	EPHX2	44	40
CN(C(=O)[C@@]12CC[C@@](C)(C(=O)O1)C2(C)C)c1ccc([N+](=O)[O-])cc1	ZINC000875079014	EF	On-Demand	Bother	SLC27A4	48	31
CC[C@@H](NC(=O)N1CC2(CCCO2)C1)c1ccccc1OC	ZINC000875079016	DF	On-Demand	Anodyne	HCN1	51	33
CC[C@@H](NC(=O)N1CC2(CCCO2)C1)c1ccccc1OC	ZINC000875079016	DF	On-Demand	Anodyne	HCN4	48	33
COC(=O)C1(O)CN(C(=O)NCCc2ccc(OC(F)(F)F)cc2)C1	ZINC000875079017	FD	On-Demand	Anodyne	EPHX2	42	39
COC(=O)c1cnc(NC(=O)C(C)(C)c2cccc(OC)c2)s1	ZINC000875079020	EF	On-Demand	Anodyne	SCD1	20	40
COC(=O)c1cnc(NC(=O)C(C)(C)c2cccc(OC)c2)s1	ZINC000875079020	EF	On-Demand	Anodyne	SCD	23	40
CC[C@@H](NC(=O)N1CCCC[C@H]1CNC(C)=O)c1ccccc1OC	ZINC000875079028	EF	On-Demand	Anodyne	HCN1	40	32
CC[C@@H](NC(=O)N1CCCC[C@H]1CNC(C)=O)c1ccccc1OC	ZINC000875079028	EF	On-Demand	Anodyne	HCN4	40	32
CC[C@@H](NC(=O)N1CCCC[C@H]1CNC(C)=O)c1ccccc1OC	ZINC000875079028	EF	On-Demand	Anodyne	ACKR3	60	31
CC[C@@H](NC(=O)N1CCCC[C@@H]1CNC(C)=O)c1ccccc1OC	ZINC000875079029	EF	On-Demand	Anodyne	HCN1	40	32
CC[C@@H](NC(=O)N1CCCC[C@@H]1CNC(C)=O)c1ccccc1OC	ZINC000875079029	EF	On-Demand	Anodyne	HCN4	40	32
CC[C@@H](NC(=O)N1CCCC[C@@H]1CNC(C)=O)c1ccccc1OC	ZINC000875079029	EF	On-Demand	Anodyne	ACKR3	60	31
COC(=O)C1(O)CN(C(=O)N[C@H](C)c2ccc(OC3CCCC3)c(OC)c2)C1	ZINC000875079039	GE	On-Demand	Anodyne	PDE4A	38	42
COC(=O)C1(O)CN(C(=O)N[C@H](C)c2ccc(OC3CCCC3)c(OC)c2)C1	ZINC000875079039	GE	On-Demand	Anodyne	PDE4B	20	42
COC(=O)C1(O)CN(C(=O)N[C@H](C)c2ccc(OC3CCCC3)c(OC)c2)C1	ZINC000875079039	GE	On-Demand	Anodyne	PDE4D	19	42
COC(=O)C1(O)CN(C(=O)N[C@H](C)c2ccc(OC3CCCC3)c(OC)c2)C1	ZINC000875079039	GE	On-Demand	Anodyne	PDE4C	16	42
COC(=O)C1(O)CN(C(=O)N[C@@H](C)c2ccc(OC3CCCC3)c(OC)c2)C1	ZINC000875079041	GE	On-Demand	Anodyne	PDE4A	38	42
COC(=O)C1(O)CN(C(=O)N[C@@H](C)c2ccc(OC3CCCC3)c(OC)c2)C1	ZINC000875079041	GE	On-Demand	Anodyne	PDE4B	20	42
COC(=O)C1(O)CN(C(=O)N[C@@H](C)c2ccc(OC3CCCC3)c(OC)c2)C1	ZINC000875079041	GE	On-Demand	Anodyne	PDE4D	19	42
COC(=O)C1(O)CN(C(=O)N[C@@H](C)c2ccc(OC3CCCC3)c(OC)c2)C1	ZINC000875079041	GE	On-Demand	Anodyne	PDE4C	16	42
COCCCCNC(=O)NC1CC(C(=O)OC)C1	ZINC000875079054	CC	On-Demand	Anodyne	EPHX2	27	60
CC[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1ccccc1OC	ZINC000875079055	FH	On-Demand	Anodyne	CCR8	24	40
CC[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1ccccc1OC	ZINC000875079055	FH	On-Demand	Anodyne	HCN1	55	38
O=C(NCCCCN1CCOCC1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875079056	FD	On-Demand	Anodyne	HTR1A	20	41
O=C(NCCCCN1CCOCC1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875079056	FD	On-Demand	Anodyne	HRH2	24	42
O=C(NCCCCN1CCOCC1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875079056	FD	On-Demand	Anodyne	DRD3	40	38
O=C(NCCCCN1CCOCC1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875079056	FD	On-Demand	Anodyne	TACR2	20	54
O=C(NCCCCN1CCOCC1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875079056	FD	On-Demand	Anodyne	CCR4	18	44
O=C(NCCCCN1CCOCC1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875079056	FD	On-Demand	Anodyne	EPHX2	29	47
O=C(NCCCCN1CCOCC1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875079058	FD	On-Demand	Anodyne	HTR1A	20	41
O=C(NCCCCN1CCOCC1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875079058	FD	On-Demand	Anodyne	HRH2	24	42
O=C(NCCCCN1CCOCC1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875079058	FD	On-Demand	Anodyne	DRD3	40	38
O=C(NCCCCN1CCOCC1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875079058	FD	On-Demand	Anodyne	TACR2	20	54
O=C(NCCCCN1CCOCC1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875079058	FD	On-Demand	Anodyne	CCR4	18	44
O=C(NCCCCN1CCOCC1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875079058	FD	On-Demand	Anodyne	EPHX2	29	47
O=C(NCCCCN1CCOCC1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875079068	EE	On-Demand	Anodyne	EPHX2	19	45
COCCCCNC(=O)N[C@@H]1CC(C)(C)CC[C@H]1O	ZINC000875079083	CD	On-Demand	Anodyne	EPHX2	21	47
Cc1ccccc1CN1CCO[C@@H](CNC(=O)C(=O)NC2CCC2)C1	ZINC000875079111	EC	On-Demand	Anodyne	DRD4	21	45
Cc1ccccc1CN1CCO[C@@H](CNC(=O)C(=O)NC2CCC2)C1	ZINC000875079111	EC	On-Demand	Anodyne	SLC6A1	43	34
Cc1ccc(NC(=O)CS[C@H](C)C(=O)Oc2ccc(C(F)(F)F)cc2)cc1	ZINC000875079114	GJ	On-Demand	Anodyne	LTA4H	21	43
Cc1ccc(NC(=O)CS[C@H](C)C(=O)Oc2ccc(C(F)(F)F)cc2)cc1	ZINC000875079114	GJ	On-Demand	Anodyne	EPHX2	26	40
Cc1ccc(NC(=O)CS[C@H](C)C(=O)Oc2ccc(C(F)(F)F)cc2)cc1	ZINC000875079114	GJ	On-Demand	Anodyne	ACR	45	46
Cc1ccc(NC(=O)CS[C@H](C)C(=O)Oc2ccc(C(F)(F)F)cc2)cc1	ZINC000875079114	GJ	On-Demand	Anodyne	SLC1A2	44	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NC1CCC1)CC2	ZINC000875079126	ED	On-Demand	Anodyne	SLC18A2	48	35
Cc1ccc(NC(=O)CS[C@@H](C)C(=O)Oc2ccc(C(F)(F)F)cc2)cc1	ZINC000875079127	GJ	On-Demand	Anodyne	LTA4H	21	43
Cc1ccc(NC(=O)CS[C@@H](C)C(=O)Oc2ccc(C(F)(F)F)cc2)cc1	ZINC000875079127	GJ	On-Demand	Anodyne	EPHX2	26	40
Cc1ccc(NC(=O)CS[C@@H](C)C(=O)Oc2ccc(C(F)(F)F)cc2)cc1	ZINC000875079127	GJ	On-Demand	Anodyne	ACR	45	46
Cc1ccc(NC(=O)CS[C@@H](C)C(=O)Oc2ccc(C(F)(F)F)cc2)cc1	ZINC000875079127	GJ	On-Demand	Anodyne	SLC1A2	44	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NC1CCC1)CC2	ZINC000875079128	ED	On-Demand	Anodyne	SLC18A2	48	35
Cc1csc2nc(CC(=O)N3CCc4cc([N+](=O)[O-])ccc43)cn12	ZINC000875079133	EF	On-Demand	Bother	EIF2AK3	75	36
O=C(NCCCCN1CCOCC1)NNc1cccc(F)c1Cl	ZINC000875079150	EE	On-Demand	Reactive	HTR1A	23	42
O=C(NCCCCN1CCOCC1)NNc1cccc(F)c1Cl	ZINC000875079150	EE	On-Demand	Reactive	DRD2	33	42
O=C(NCCCCN1CCOCC1)NNc1cccc(F)c1Cl	ZINC000875079150	EE	On-Demand	Reactive	DRD3	64	42
O=C(NCCCCN1CCOCC1)NNc1cccc(F)c1Cl	ZINC000875079150	EE	On-Demand	Reactive	CHRNA7	15	44
O=C(NCCCCN1CCOCC1)NNc1cccc(F)c1Cl	ZINC000875079150	EE	On-Demand	Reactive	EPHX2	25	45
COCCCCNC(=O)NC1([C@H]2CCCCO2)CCC1	ZINC000875079168	CE	On-Demand	Anodyne	EPHX2	19	46
COCCCCNC(=O)NC1([C@@H]2CCCCO2)CCC1	ZINC000875079169	CE	On-Demand	Anodyne	EPHX2	19	46
COc1ccc(O[C@@H](C)CNC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875079171	FD	On-Demand	Anodyne	CHRM2	44	38
COc1ccc(O[C@@H](C)CNC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875079171	FD	On-Demand	Anodyne	MTNR1A	24	49
COc1ccc(O[C@@H](C)CNC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875079171	FD	On-Demand	Anodyne	MTNR1B	21	49
Cn1nc(Cl)c(C(=O)Nc2cc(C(N)=O)ccc2N2CCCC2)c1Cl	ZINC000875079206	GF	On-Demand	Anodyne	CNR1	55	33
Cn1nc(Cl)c(C(=O)Nc2cc(C(N)=O)ccc2N2CCCC2)c1Cl	ZINC000875079206	GF	On-Demand	Anodyne	KCNQ2	59	35
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000875079217	GC	On-Demand	Anodyne	HTR1A	129	58
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000875079217	GC	On-Demand	Anodyne	ADRA2A	16	41
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000875079217	GC	On-Demand	Anodyne	DRD2	96	51
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000875079217	GC	On-Demand	Anodyne	DRD1	19	42
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000875079217	GC	On-Demand	Anodyne	DRD4	61	46
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000875079217	GC	On-Demand	Anodyne	ADRA1D	76	53
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000875079217	GC	On-Demand	Anodyne	HTR2A	86	49
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000875079217	GC	On-Demand	Anodyne	HTR2C	44	46
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000875079217	GC	On-Demand	Anodyne	SLC6A4	20	46
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000875079217	GC	On-Demand	Anodyne	ADRA1A	104	49
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000875079217	GC	On-Demand	Anodyne	ADRA1B	73	53
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000875079217	GC	On-Demand	Anodyne	DRD3	116	51
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000875079217	GC	On-Demand	Anodyne	HTR4	21	41
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000875079217	GC	On-Demand	Anodyne	DRD5	17	42
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000875079217	GC	On-Demand	Anodyne	HTR7	145	50
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000875079217	GC	On-Demand	Anodyne	SIGMAR1	26	45
C[C@H](NC(=O)C(=O)NCCC1CCCCC1)c1ccnn1C	ZINC000875079225	DD	On-Demand	Anodyne	BMP1	70	34
Cn1nc(Cl)c(C(=O)N2CCC[C@H]2c2cccnc2)c1Cl	ZINC000875079228	EG	On-Demand	Anodyne	GPBAR1	19	62
Cn1nc(Cl)c(C(=O)N2CCC[C@@H]2c2cccnc2)c1Cl	ZINC000875079229	EG	On-Demand	Anodyne	GPBAR1	19	62
O=CN1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875079256	FD	On-Demand	Anodyne	HTR1A	100	57
O=CN1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875079256	FD	On-Demand	Anodyne	DRD2	78	53
O=CN1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875079256	FD	On-Demand	Anodyne	DRD4	47	48
O=CN1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875079256	FD	On-Demand	Anodyne	ADRA1D	45	52
O=CN1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875079256	FD	On-Demand	Anodyne	HTR2A	74	50
O=CN1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875079256	FD	On-Demand	Anodyne	HTR2C	40	48
O=CN1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875079256	FD	On-Demand	Anodyne	SLC6A4	18	43
O=CN1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875079256	FD	On-Demand	Anodyne	ADRA1A	62	52
O=CN1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875079256	FD	On-Demand	Anodyne	ADRA1B	41	52
O=CN1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875079256	FD	On-Demand	Anodyne	DRD3	96	53
O=CN1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875079256	FD	On-Demand	Anodyne	DRD5	15	43
O=CN1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875079256	FD	On-Demand	Anodyne	HTR7	117	47
O=CN1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875079256	FD	On-Demand	Anodyne	SIGMAR1	16	45
C[C@H](NC(=O)NC1(C)CC(F)(F)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079266	GI	On-Demand	Anodyne	ACACA	22	42
C[C@H](NC(=O)NC1(C)CC(F)(F)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079266	GI	On-Demand	Anodyne	ACACB	23	42
C[C@@H](NC(=O)NC1(C)CC(F)(F)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079267	GI	On-Demand	Anodyne	ACACA	22	42
C[C@@H](NC(=O)NC1(C)CC(F)(F)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079267	GI	On-Demand	Anodyne	ACACB	23	42
O=C(Oc1ccc(C(F)(F)F)cc1)C1CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1	ZINC000875079302	IH	On-Demand	Anodyne	EPHX2	32	42
O=C(Oc1ccc(C(F)(F)F)cc1)C1CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1	ZINC000875079302	IH	On-Demand	Anodyne	GCK	51	32
O=C(Oc1ccc(C(F)(F)F)cc1)C1CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1	ZINC000875079302	IH	On-Demand	Anodyne	GCKR	50	30
COCCCCNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875079314	EE	On-Demand	Mild	ITK	22	54
COCCCCNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875079314	EE	On-Demand	Mild	PANC	55	38
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC1CCC1	ZINC000875079316	EE	On-Demand	Anodyne	CHRM2	22	51
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC1CCC1	ZINC000875079316	EE	On-Demand	Anodyne	HTR1A	15	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC1CCC1	ZINC000875079316	EE	On-Demand	Anodyne	CHRM1	20	51
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC1CCC1	ZINC000875079316	EE	On-Demand	Anodyne	DRD2	44	52
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC1CCC1	ZINC000875079316	EE	On-Demand	Anodyne	DRD4	69	52
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC1CCC1	ZINC000875079316	EE	On-Demand	Anodyne	ACHE	71	65
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC1CCC1	ZINC000875079316	EE	On-Demand	Anodyne	HRH2	25	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC1CCC1	ZINC000875079316	EE	On-Demand	Anodyne	HRH1	16	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC1CCC1	ZINC000875079316	EE	On-Demand	Anodyne	DRD3	36	52
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC1CCC1	ZINC000875079316	EE	On-Demand	Anodyne	SLC6A3	22	52
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC1CCC1	ZINC000875079316	EE	On-Demand	Anodyne	HTR4	30	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC1CCC1	ZINC000875079316	EE	On-Demand	Anodyne	CHRM3	29	51
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC1CCC1	ZINC000875079316	EE	On-Demand	Anodyne	LTA4H	31	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC1CCC1	ZINC000875079316	EE	On-Demand	Anodyne	HRH3	16	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC1CCC1	ZINC000875079316	EE	On-Demand	Anodyne	SIGMAR1	81	57
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC1CCC1	ZINC000875079316	EE	On-Demand	Anodyne	SSTR5	49	37
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC1CCC1	ZINC000875079316	EE	On-Demand	Anodyne	BCHE	21	52
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC1CCC1	ZINC000875079316	EE	On-Demand	Anodyne	CCR3	52	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC1CCC1	ZINC000875079316	EE	On-Demand	Anodyne	FAAH	22	46
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC1CCC1	ZINC000875079316	EE	On-Demand	Anodyne	SLC6A5	25	47
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC1CCC1	ZINC000875079316	EE	On-Demand	Anodyne	EPHX2	16	47
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC1CCC1	ZINC000875079316	EE	On-Demand	Anodyne	MCHR1	52	48
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC1CCC1	ZINC000875079316	EE	On-Demand	Anodyne	CACNA1G	35	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC1CCC1	ZINC000875079316	EE	On-Demand	Anodyne	SIRT3	52	33
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC1CCC1	ZINC000875079316	EE	On-Demand	Anodyne	SIRT2	54	34
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC1CCC1	ZINC000875079316	EE	On-Demand	Anodyne	SIRT1	52	33
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC1CCC1	ZINC000875079316	EE	On-Demand	Anodyne	BIRC2	20	40
O=C(NCCCCN1CCOCC1)NCC[C@H](O)C1CCCC1	ZINC000875079331	ED	On-Demand	Anodyne	EPHX2	17	47
O=C(NCCCCN1CCOCC1)NCC[C@@H](O)C1CCCC1	ZINC000875079332	ED	On-Demand	Anodyne	EPHX2	17	47
C[C@@H](NC(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21)c1ccc(NC(=O)C2CC2)cc1	ZINC000875079337	GG	On-Demand	Anodyne	UL80	41	40
C[C@@H](NC(=O)N1Cc2cccc(O)c2C1)c1ccc(NC(=O)C2CC2)cc1	ZINC000875079339	FH	On-Demand	Clean	F7	15	47
C[C@H](NC(=O)N1Cc2cccc(O)c2C1)c1ccc(NC(=O)C2CC2)cc1	ZINC000875079340	FH	On-Demand	Clean	F7	15	47
COCCCCNC(=O)NC1(C)CCC(C)(C)CC1	ZINC000875079341	CG	On-Demand	Anodyne	EPHX2	24	51
COc1ccc(-c2nc(CC(=O)Oc3ccc(C(F)(F)F)cc3)cs2)cc1OC	ZINC000875079347	HJ	On-Demand	Anodyne	PPARA	28	45
COc1ccc(-c2nc(CC(=O)Oc3ccc(C(F)(F)F)cc3)cs2)cc1OC	ZINC000875079347	HJ	On-Demand	Anodyne	DCK	22	41
COc1ccc(-c2nc(CC(=O)Oc3ccc(C(F)(F)F)cc3)cs2)cc1OC	ZINC000875079347	HJ	On-Demand	Anodyne	PPARD	74	45
C[C@@H](NC(=O)NCC[C@@H](O)C1CCCC1)c1ccc(NC(=O)C2CC2)cc1	ZINC000875079354	FG	On-Demand	Anodyne	F7	20	52
C[C@@H](NC(=O)NCC[C@H](O)C1CCCC1)c1ccc(NC(=O)C2CC2)cc1	ZINC000875079356	FG	On-Demand	Anodyne	F7	20	52
CN(C)S(=O)(=O)c1cc(C(=O)Oc2ccc(C(F)(F)F)cc2)ccc1Cl	ZINC000875079360	HH	On-Demand	Anodyne	ACR	35	43
Cc1cncc([C@H]2CCCN2C(=O)N[C@@H](C)c2ccc(NC(=O)C3CC3)cc2)c1	ZINC000875079363	GI	On-Demand	Anodyne	UL80	43	40
Cc1cncc([C@@H]2CCCN2C(=O)N[C@H](C)c2ccc(NC(=O)C3CC3)cc2)c1	ZINC000875079364	GI	On-Demand	Anodyne	UL80	43	40
Cc1cncc([C@H]2CCCN2C(=O)N[C@H](C)c2ccc(NC(=O)C3CC3)cc2)c1	ZINC000875079365	GI	On-Demand	Anodyne	UL80	43	40
Cc1cncc([C@@H]2CCCN2C(=O)N[C@@H](C)c2ccc(NC(=O)C3CC3)cc2)c1	ZINC000875079366	GI	On-Demand	Anodyne	UL80	43	40
COC(=O)c1cnc(NC(=O)[C@@H](C)CCc2ccc(F)cc2)s1	ZINC000875079367	EG	On-Demand	Anodyne	LEF	40	37
COC(=O)c1cnc(NC(=O)[C@H](C)CCc2ccc(F)cc2)s1	ZINC000875079368	EG	On-Demand	Anodyne	LEF	40	37
Cc1ccnn1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000875079401	CD	On-Demand	Bother	EIF2AK3	58	53
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cccc(OC(C)C)c1	ZINC000875079405	FG	On-Demand	Anodyne	SLC6A4	20	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cccc(OC(C)C)c1	ZINC000875079405	FG	On-Demand	Anodyne	SLC6A3	41	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cccc(OC(C)C)c1	ZINC000875079406	FG	On-Demand	Anodyne	SLC6A4	20	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cccc(OC(C)C)c1	ZINC000875079406	FG	On-Demand	Anodyne	SLC6A3	41	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cccc(OC(C)C)c1	ZINC000875079407	FG	On-Demand	Anodyne	SLC6A4	20	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cccc(OC(C)C)c1	ZINC000875079407	FG	On-Demand	Anodyne	SLC6A3	41	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cccc(OC(C)C)c1	ZINC000875079408	FG	On-Demand	Anodyne	SLC6A4	20	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cccc(OC(C)C)c1	ZINC000875079408	FG	On-Demand	Anodyne	SLC6A3	41	42
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079441	FF	On-Demand	Anodyne	KCNA5	16	41
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079441	FF	On-Demand	Anodyne	ACACA	21	42
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079441	FF	On-Demand	Anodyne	ACACB	24	42
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079441	FF	On-Demand	Anodyne	VCP	44	34
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079442	FF	On-Demand	Anodyne	KCNA5	16	41
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079442	FF	On-Demand	Anodyne	ACACA	21	42
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079442	FF	On-Demand	Anodyne	ACACB	24	42
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079442	FF	On-Demand	Anodyne	VCP	44	34
O=C(NCCC1CCCCC1)C(=O)NCc1ncc(Br)s1	ZINC000875079467	FF	On-Demand	Anodyne	BMP1	58	34
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079486	GH	On-Demand	Anodyne	GRIN2B	23	41
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079486	GH	On-Demand	Anodyne	ACACA	22	41
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079486	GH	On-Demand	Anodyne	ACACB	24	41
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079486	GH	On-Demand	Anodyne	CHRNA7	48	38
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079486	GH	On-Demand	Anodyne	C3AR1	40	42
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079486	GH	On-Demand	Anodyne	SLC6A5	28	42
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079486	GH	On-Demand	Anodyne	CYP26A1	42	37
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079486	GH	On-Demand	Anodyne	VCP	62	37
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079489	GH	On-Demand	Anodyne	GRIN2B	23	41
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079489	GH	On-Demand	Anodyne	ACACA	22	41
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079489	GH	On-Demand	Anodyne	ACACB	24	41
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079489	GH	On-Demand	Anodyne	CHRNA7	48	38
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079489	GH	On-Demand	Anodyne	C3AR1	40	42
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079489	GH	On-Demand	Anodyne	SLC6A5	28	42
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079489	GH	On-Demand	Anodyne	CYP26A1	42	37
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079489	GH	On-Demand	Anodyne	VCP	62	37
C=CCc1cc(C(=O)OC)cc(OC)c1OC(=O)[C@H]1CCCN1C(C)=O	ZINC000875079499	FE	On-Demand	Mild	FKBP1A	32	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(OC(F)F)cc1	ZINC000875079508	FG	On-Demand	Anodyne	SLC6A4	23	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(OC(F)F)cc1	ZINC000875079508	FG	On-Demand	Anodyne	SLC6A3	50	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(OC(F)F)cc1	ZINC000875079509	FG	On-Demand	Anodyne	SLC6A4	23	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(OC(F)F)cc1	ZINC000875079509	FG	On-Demand	Anodyne	SLC6A3	50	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(OC(F)F)cc1	ZINC000875079510	FG	On-Demand	Anodyne	SLC6A4	23	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(OC(F)F)cc1	ZINC000875079510	FG	On-Demand	Anodyne	SLC6A3	50	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(OC(F)F)cc1	ZINC000875079511	FG	On-Demand	Anodyne	SLC6A4	23	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(OC(F)F)cc1	ZINC000875079511	FG	On-Demand	Anodyne	SLC6A3	50	41
C[C@H](NC(=O)C(=O)NCCC1CCCCC1)c1cc2cnccc2o1	ZINC000875079517	EG	On-Demand	Anodyne	BMP1	61	34
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079522	GH	On-Demand	Anodyne	ACACA	21	40
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079522	GH	On-Demand	Anodyne	ACACB	23	40
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079522	GH	On-Demand	Anodyne	CHRNA7	43	37
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079522	GH	On-Demand	Anodyne	C3AR1	39	41
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079522	GH	On-Demand	Anodyne	SLC6A5	22	41
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079522	GH	On-Demand	Anodyne	CYP26A1	55	38
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079522	GH	On-Demand	Anodyne	VCP	64	39
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079523	GH	On-Demand	Anodyne	ACACA	21	40
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079523	GH	On-Demand	Anodyne	ACACB	23	40
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079523	GH	On-Demand	Anodyne	CHRNA7	43	37
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079523	GH	On-Demand	Anodyne	C3AR1	39	41
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079523	GH	On-Demand	Anodyne	SLC6A5	22	41
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079523	GH	On-Demand	Anodyne	CYP26A1	55	38
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccc(OCc2cccnc2)cc1	ZINC000875079523	GH	On-Demand	Anodyne	VCP	64	39
Cc1nnc(NNC(=O)NCCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875079526	FC	On-Demand	Reactive	HTR1A	111	56
Cc1nnc(NNC(=O)NCCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875079526	FC	On-Demand	Reactive	DRD2	87	49
Cc1nnc(NNC(=O)NCCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875079526	FC	On-Demand	Reactive	DRD1	15	40
Cc1nnc(NNC(=O)NCCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875079526	FC	On-Demand	Reactive	DRD4	52	45
Cc1nnc(NNC(=O)NCCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875079526	FC	On-Demand	Reactive	ADRA1D	59	53
Cc1nnc(NNC(=O)NCCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875079526	FC	On-Demand	Reactive	HTR2A	80	49
Cc1nnc(NNC(=O)NCCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875079526	FC	On-Demand	Reactive	HTR2C	45	49
Cc1nnc(NNC(=O)NCCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875079526	FC	On-Demand	Reactive	SLC6A4	21	46
Cc1nnc(NNC(=O)NCCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875079526	FC	On-Demand	Reactive	ADRA1A	81	48
Cc1nnc(NNC(=O)NCCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875079526	FC	On-Demand	Reactive	ADRA1B	52	53
Cc1nnc(NNC(=O)NCCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875079526	FC	On-Demand	Reactive	DRD3	107	49
Cc1nnc(NNC(=O)NCCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875079526	FC	On-Demand	Reactive	HTR7	124	46
Cc1nnc(NNC(=O)NCCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875079526	FC	On-Demand	Reactive	NPY1R	18	48
COC(=O)N(C)NC(=O)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000875079530	FD	On-Demand	Reactive	HTR1A	63	43
COC(=O)N(C)NC(=O)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000875079530	FD	On-Demand	Reactive	DRD2	72	43
COC(=O)N(C)NC(=O)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000875079530	FD	On-Demand	Reactive	DRD4	71	42
COC(=O)N(C)NC(=O)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000875079530	FD	On-Demand	Reactive	ACHE	43	47
COC(=O)N(C)NC(=O)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000875079530	FD	On-Demand	Reactive	HRH2	31	42
COC(=O)N(C)NC(=O)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000875079530	FD	On-Demand	Reactive	ADRA1D	57	45
COC(=O)N(C)NC(=O)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000875079530	FD	On-Demand	Reactive	HTR2A	49	47
COC(=O)N(C)NC(=O)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000875079530	FD	On-Demand	Reactive	HTR2C	35	40
COC(=O)N(C)NC(=O)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000875079530	FD	On-Demand	Reactive	SLC6A4	23	40
COC(=O)N(C)NC(=O)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000875079530	FD	On-Demand	Reactive	ADRA1A	78	45
COC(=O)N(C)NC(=O)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000875079530	FD	On-Demand	Reactive	ADRA1B	49	45
COC(=O)N(C)NC(=O)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000875079530	FD	On-Demand	Reactive	DRD3	96	51
COC(=O)N(C)NC(=O)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000875079530	FD	On-Demand	Reactive	SLC6A3	16	40
COC(=O)N(C)NC(=O)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000875079530	FD	On-Demand	Reactive	HTR7	62	48
COC(=O)N(C)NC(=O)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000875079530	FD	On-Demand	Reactive	TACR2	17	41
COC(=O)N(C)NC(=O)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000875079530	FD	On-Demand	Reactive	SIGMAR1	71	45
COC(=O)N(C)NC(=O)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000875079530	FD	On-Demand	Reactive	NPY1R	15	40
COC(=O)N(C)NC(=O)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000875079530	FD	On-Demand	Reactive	BCHE	26	47
COC(=O)N(C)NC(=O)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000875079530	FD	On-Demand	Reactive	CCR3	38	48
COC(=O)N(C)NC(=O)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000875079530	FD	On-Demand	Reactive	MCHR1	20	45
COC(=O)N(C)NC(=O)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000875079530	FD	On-Demand	Reactive	CACNA1G	45	41
COC(=O)N(C)NC(=O)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000875079530	FD	On-Demand	Reactive	NPFFR1	42	37
O=C(NCCCN1CCN(c2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875079532	GC	On-Demand	Anodyne	HTR1A	104	59
O=C(NCCCN1CCN(c2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875079532	GC	On-Demand	Anodyne	DRD2	83	55
O=C(NCCCN1CCN(c2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875079532	GC	On-Demand	Anodyne	DRD1	18	40
O=C(NCCCN1CCN(c2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875079532	GC	On-Demand	Anodyne	DRD4	53	49
O=C(NCCCN1CCN(c2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875079532	GC	On-Demand	Anodyne	ADRA1D	62	54
O=C(NCCCN1CCN(c2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875079532	GC	On-Demand	Anodyne	HTR2A	77	52
O=C(NCCCN1CCN(c2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875079532	GC	On-Demand	Anodyne	HTR2C	42	49
O=C(NCCCN1CCN(c2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875079532	GC	On-Demand	Anodyne	SLC6A4	20	44
O=C(NCCCN1CCN(c2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875079532	GC	On-Demand	Anodyne	ADRA1A	84	46
O=C(NCCCN1CCN(c2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875079532	GC	On-Demand	Anodyne	ADRA1B	59	54
O=C(NCCCN1CCN(c2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875079532	GC	On-Demand	Anodyne	DRD3	100	55
O=C(NCCCN1CCN(c2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875079532	GC	On-Demand	Anodyne	DRD5	19	45
O=C(NCCCN1CCN(c2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875079532	GC	On-Demand	Anodyne	HTR7	113	48
O=C(NCCCN1CCN(c2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875079532	GC	On-Demand	Anodyne	SIGMAR1	19	48
CN(C(=O)[C@@H]1OCCO[C@@H]1C(F)(F)F)c1ccc([N+](=O)[O-])cc1	ZINC000875079541	ED	On-Demand	Bother	SLC27A4	42	31
CC[C@@H](NC(=O)N1CCN(C)C(C)(C)CC1)c1ccccc1OC	ZINC000875079547	EG	On-Demand	Anodyne	HCN1	43	33
O=C(Oc1ccc(C(F)(F)F)cc1)[C@@H]1CC(=O)N(Cc2ccccc2Cl)C1	ZINC000875079548	GI	On-Demand	Anodyne	P2RX7	18	46
O=C(Oc1ccc(C(F)(F)F)cc1)[C@H]1CC(=O)N(Cc2ccccc2Cl)C1	ZINC000875079549	GI	On-Demand	Anodyne	P2RX7	18	46
C[C@@H](NC(=O)N1CCO[C@@](C)(C(F)(F)F)C1)c1ccc(NC(=O)C2CC2)cc1	ZINC000875079570	GG	On-Demand	Anodyne	EPHX2	36	41
C[C@@H](NC(=O)N1CCO[C@](C)(C(F)(F)F)C1)c1ccc(NC(=O)C2CC2)cc1	ZINC000875079572	GG	On-Demand	Anodyne	EPHX2	36	41
COC(=O)CC[C@@H]1CC[C@H](C(=O)N(C)c2ccc([N+](=O)[O-])cc2)O1	ZINC000875079575	EE	On-Demand	Bother	SLC27A4	42	32
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(NC(=O)C2CC2)cc1	ZINC000875079581	GF	On-Demand	Anodyne	SLC6A3	34	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(NC(=O)C2CC2)cc1	ZINC000875079582	GF	On-Demand	Anodyne	SLC6A3	34	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(NC(=O)C2CC2)cc1	ZINC000875079583	GF	On-Demand	Anodyne	SLC6A3	34	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(NC(=O)C2CC2)cc1	ZINC000875079584	GF	On-Demand	Anodyne	SLC6A3	34	41
CCO[C@@H](C(=O)Nc1ncc(C(=O)OC)s1)[C@@H]1CCOC1	ZINC000875079585	DD	On-Demand	Anodyne	GCK	15	41
CCO[C@@H](C(=O)Nc1ncc(C(=O)OC)s1)[C@H]1CCOC1	ZINC000875079587	DD	On-Demand	Anodyne	GCK	15	41
CCO[C@H]1COCC[C@@H]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000875079599	DE	On-Demand	Bother	SLC27A4	53	35
CCO[C@H]1COCC[C@H]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000875079602	DE	On-Demand	Bother	SLC27A4	53	35
O=CN1CCCN(C(=O)NCCc2ccc(OC(F)(F)F)cc2)CC1	ZINC000875079609	FE	On-Demand	Anodyne	EPHX2	41	40
CC[C@@H](NC(=O)NCCCN1CCC[C@H]1C(N)=O)c1ccccc1OC	ZINC000875079610	FD	On-Demand	Anodyne	HTR1A	23	41
CC[C@@H](NC(=O)NCCCN1CCC[C@H]1C(N)=O)c1ccccc1OC	ZINC000875079610	FD	On-Demand	Anodyne	DRD2	32	40
CC[C@@H](NC(=O)NCCCN1CCC[C@H]1C(N)=O)c1ccccc1OC	ZINC000875079610	FD	On-Demand	Anodyne	TRHR	44	35
CC[C@@H](NC(=O)NCCCN1CCC[C@H]1C(N)=O)c1ccccc1OC	ZINC000875079610	FD	On-Demand	Anodyne	CTRA_BOVIN	50	31
CC[C@@H](NC(=O)NCCCN1CCC[C@H]1C(N)=O)c1ccccc1OC	ZINC000875079610	FD	On-Demand	Anodyne	TRY1_BOVIN	55	34
CC[C@@H](NC(=O)NCCCN1CCC[C@H]1C(N)=O)c1ccccc1OC	ZINC000875079610	FD	On-Demand	Anodyne	NTSR1	67	31
CC[C@@H](NC(=O)NCCCN1CCC[C@H]1C(N)=O)c1ccccc1OC	ZINC000875079610	FD	On-Demand	Anodyne	NTSR2	69	31
CC[C@@H](NC(=O)NCCCN1CCC[C@H]1C(N)=O)c1ccccc1OC	ZINC000875079610	FD	On-Demand	Anodyne	CTSG	40	31
CC[C@@H](NC(=O)NCCCN1CCC[C@H]1C(N)=O)c1ccccc1OC	ZINC000875079610	FD	On-Demand	Anodyne	CELA2A	40	31
CC[C@@H](NC(=O)NCCCN1CCC[C@H]1C(N)=O)c1ccccc1OC	ZINC000875079610	FD	On-Demand	Anodyne	SORT1	46	31
CC[C@@H](NC(=O)NCCCN1CCC[C@H]1C(N)=O)c1ccccc1OC	ZINC000875079610	FD	On-Demand	Anodyne	ACKR3	43	32
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)Oc3ccc(C(F)(F)F)cc3)CC2)cc1	ZINC000875079626	JI	On-Demand	Anodyne	HSD11B1	17	41
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)Oc3ccc(C(F)(F)F)cc3)CC2)cc1	ZINC000875079626	JI	On-Demand	Anodyne	MMP13	42	41
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)Oc3ccc(C(F)(F)F)cc3)CC2)cc1	ZINC000875079626	JI	On-Demand	Anodyne	ADAM17	33	43
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)Oc3ccc(C(F)(F)F)cc3)CC2)cc1	ZINC000875079626	JI	On-Demand	Anodyne	EPHX2	29	45
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)Oc3ccc(C(F)(F)F)cc3)CC2)cc1	ZINC000875079626	JI	On-Demand	Anodyne	TGM2	35	41
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)Oc3ccc(C(F)(F)F)cc3)CC2)cc1	ZINC000875079626	JI	On-Demand	Anodyne	GCK	47	31
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)Oc3ccc(C(F)(F)F)cc3)CC2)cc1	ZINC000875079626	JI	On-Demand	Anodyne	GCKR	60	32
COc1ccc(O[C@H](C)CNC(=O)C(=O)N[C@H](C)c2ccnn2C)cc1	ZINC000875079651	FD	On-Demand	Anodyne	MTNR1A	17	43
COc1ccc(O[C@H](C)CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)cc1	ZINC000875079652	FD	On-Demand	Anodyne	MTNR1A	17	43
COc1ccc(O[C@@H](C)CNC(=O)C(=O)N[C@H](C)c2ccnn2C)cc1	ZINC000875079653	FD	On-Demand	Anodyne	MTNR1A	17	43
COc1ccc(O[C@@H](C)CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)cc1	ZINC000875079654	FD	On-Demand	Anodyne	MTNR1A	17	43
Cn1nccc1C(NC(=O)C(=O)NCCC1CCCCC1)c1ccnn1C	ZINC000875079657	FD	On-Demand	Anodyne	BMP1	71	35
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(C)C[C@H]2c2ccccc2)C1	ZINC000875079661	GC	On-Demand	Anodyne	ADRA1A	43	37
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(C)C[C@@H]2c2ccccc2)C1	ZINC000875079662	GC	On-Demand	Anodyne	ADRA1A	43	37
CC(C)(C)OC(=O)N1CCC(NC(=O)C(=O)NCC2CC=CC2)CC1	ZINC000875079667	FD	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CCC(NC(=O)C(=O)NCC2CC=CC2)CC1	ZINC000875079667	FD	On-Demand	Anodyne	GPR119	39	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccccc1OC(C)C	ZINC000875079668	FG	On-Demand	Anodyne	SLC6A4	28	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccccc1OC(C)C	ZINC000875079668	FG	On-Demand	Anodyne	SLC6A3	57	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccccc1OC(C)C	ZINC000875079669	FG	On-Demand	Anodyne	SLC6A4	28	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccccc1OC(C)C	ZINC000875079669	FG	On-Demand	Anodyne	SLC6A3	57	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccccc1OC(C)C	ZINC000875079670	FG	On-Demand	Anodyne	SLC6A4	28	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccccc1OC(C)C	ZINC000875079670	FG	On-Demand	Anodyne	SLC6A3	57	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccccc1OC(C)C	ZINC000875079671	FG	On-Demand	Anodyne	SLC6A4	28	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccccc1OC(C)C	ZINC000875079671	FG	On-Demand	Anodyne	SLC6A3	57	41
Cc1nnc(NNC(=O)NCCCN2CCN(Cc3ccccc3)CC2)n1C	ZINC000875079701	GC	On-Demand	Reactive	HTR1A	41	41
Cc1nnc(NNC(=O)NCCCN2CCN(Cc3ccccc3)CC2)n1C	ZINC000875079701	GC	On-Demand	Reactive	DRD2	53	40
Cc1nnc(NNC(=O)NCCCN2CCN(Cc3ccccc3)CC2)n1C	ZINC000875079701	GC	On-Demand	Reactive	DRD4	43	37
Cc1nnc(NNC(=O)NCCCN2CCN(Cc3ccccc3)CC2)n1C	ZINC000875079701	GC	On-Demand	Reactive	ACHE	28	44
Cc1nnc(NNC(=O)NCCCN2CCN(Cc3ccccc3)CC2)n1C	ZINC000875079701	GC	On-Demand	Reactive	ADRA1D	43	39
Cc1nnc(NNC(=O)NCCCN2CCN(Cc3ccccc3)CC2)n1C	ZINC000875079701	GC	On-Demand	Reactive	HTR2A	42	43
Cc1nnc(NNC(=O)NCCCN2CCN(Cc3ccccc3)CC2)n1C	ZINC000875079701	GC	On-Demand	Reactive	SLC6A4	16	40
Cc1nnc(NNC(=O)NCCCN2CCN(Cc3ccccc3)CC2)n1C	ZINC000875079701	GC	On-Demand	Reactive	ADRA1A	61	39
Cc1nnc(NNC(=O)NCCCN2CCN(Cc3ccccc3)CC2)n1C	ZINC000875079701	GC	On-Demand	Reactive	DRD3	70	40
Cc1nnc(NNC(=O)NCCCN2CCN(Cc3ccccc3)CC2)n1C	ZINC000875079701	GC	On-Demand	Reactive	HTR7	28	45
Cc1nnc(NNC(=O)NCCCN2CCN(Cc3ccccc3)CC2)n1C	ZINC000875079701	GC	On-Demand	Reactive	SIGMAR1	41	42
Cc1nnc(NNC(=O)NCCCN2CCN(Cc3ccccc3)CC2)n1C	ZINC000875079701	GC	On-Demand	Reactive	CCR3	30	43
Cc1nnc(NNC(=O)NCCCN2CCN(Cc3ccccc3)CC2)n1C	ZINC000875079701	GC	On-Demand	Reactive	POLC	16	40
Cc1nnc(NNC(=O)NCCCN2CCN(Cc3ccccc3)CC2)n1C	ZINC000875079701	GC	On-Demand	Reactive	NPFFR1	42	37
COC(=O)c1cnc(NC(=O)[C@@H]2CCc3cc(OC)ccc32)s1	ZINC000875079723	EF	On-Demand	Anodyne	PPARD	52	41
COC(=O)c1cnc(NC(=O)[C@H]2CCc3cc(OC)ccc32)s1	ZINC000875079724	EF	On-Demand	Anodyne	PPARD	52	41
O=C(NCCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875079725	ED	On-Demand	Anodyne	HTR1A	108	58
O=C(NCCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875079725	ED	On-Demand	Anodyne	DRD2	84	56
O=C(NCCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875079725	ED	On-Demand	Anodyne	DRD1	17	41
O=C(NCCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875079725	ED	On-Demand	Anodyne	DRD4	57	51
O=C(NCCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875079725	ED	On-Demand	Anodyne	ADRA1D	44	53
O=C(NCCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875079725	ED	On-Demand	Anodyne	HTR2A	80	51
O=C(NCCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875079725	ED	On-Demand	Anodyne	HTR2C	45	48
O=C(NCCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875079725	ED	On-Demand	Anodyne	SLC6A4	21	45
O=C(NCCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875079725	ED	On-Demand	Anodyne	ADRA1A	62	53
O=C(NCCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875079725	ED	On-Demand	Anodyne	ADRA1B	41	53
O=C(NCCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875079725	ED	On-Demand	Anodyne	DRD3	106	56
O=C(NCCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875079725	ED	On-Demand	Anodyne	DRD5	17	41
O=C(NCCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875079725	ED	On-Demand	Anodyne	HTR7	119	47
O=C(NCCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875079725	ED	On-Demand	Anodyne	SIGMAR1	17	46
O=C(NCCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875079725	ED	On-Demand	Anodyne	NPY1R	15	44
O=C(NCCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875079725	ED	On-Demand	Anodyne	CCR3	31	47
CCOC(=O)[C@@H]1CC[C@H](C(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000875079733	DF	On-Demand	Bother	FASN	34	42
CCOC(=O)[C@@H]1CC[C@H](C(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000875079733	DF	On-Demand	Bother	SLC27A4	56	37
CC(=O)C1CCN(C(=O)N[C@H](C)c2ccc(NC(=O)C3CC3)cc2)CC1	ZINC000875079743	FG	On-Demand	Anodyne	EPHX2	27	44
CC(=O)C1CCN(C(=O)N[C@@H](C)c2ccc(NC(=O)C3CC3)cc2)CC1	ZINC000875079744	FG	On-Demand	Anodyne	EPHX2	27	44
CC(C)(C)OC(=O)N1CCC(NC(=O)C(=O)N2CCC(CCF)CC2)CC1	ZINC000875079751	GE	On-Demand	Anodyne	GPR119	33	42
CC[C@@H](NC(=O)N(CCOC)CC1CCN(C)CC1)c1ccccc1OC	ZINC000875079778	GG	On-Demand	Anodyne	ACKR3	62	32
CCO[C@@H](C(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCOC1	ZINC000875079787	DD	On-Demand	Bother	SLC27A4	51	35
CCO[C@H](C(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@H]1CCOC1	ZINC000875079788	DD	On-Demand	Bother	SLC27A4	51	35
CCO[C@H](C(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCOC1	ZINC000875079789	DD	On-Demand	Bother	SLC27A4	51	35
CCO[C@@H](C(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@H]1CCOC1	ZINC000875079790	DD	On-Demand	Bother	SLC27A4	51	35
COCCCCNC(=O)NNc1cccc(C)n1	ZINC000875079795	CD	On-Demand	Reactive	GRM5	19	42
COC(=O)c1cnc(NC(=O)c2noc3c2CC(C)(C)CC3)s1	ZINC000875079803	EF	On-Demand	Anodyne	PANC	49	34
CCCOc1ccc([C@@H](C)NC(=O)NN(C)C(=O)OC)cc1OC	ZINC000875079809	EE	On-Demand	Reactive	ACACB	16	40
CCCOc1ccc([C@H](C)NC(=O)NN(C)C(=O)OC)cc1OC	ZINC000875079810	EE	On-Demand	Reactive	ACACB	16	40
CC[C@@H](NC(=O)N1CCC[C@](O)(CC)C1)c1ccccc1OC	ZINC000875079822	DG	On-Demand	Anodyne	HCN1	51	33
CC[C@@H](NC(=O)N1CCC[C@](O)(CC)C1)c1ccccc1OC	ZINC000875079822	DG	On-Demand	Anodyne	HCN4	48	33
CC[C@@H](NC(=O)N1CCC[C@@](O)(CC)C1)c1ccccc1OC	ZINC000875079824	DG	On-Demand	Anodyne	HCN1	51	33
CC[C@@H](NC(=O)N1CCC[C@@](O)(CC)C1)c1ccccc1OC	ZINC000875079824	DG	On-Demand	Anodyne	HCN4	48	33
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)C(=O)NCCS(C)(=O)=O	ZINC000875079841	GD	On-Demand	Anodyne	MDM2	122	36
CC(=O)[C@@H](C)OC(=O)CCc1c(-c2ccc(F)cc2)[nH]c2ccc(F)cc12	ZINC000875079842	FJ	On-Demand	Anodyne	TSPO	23	45
CC(=O)[C@H](C)OC(=O)CCc1c(-c2ccc(F)cc2)[nH]c2ccc(F)cc12	ZINC000875079843	FJ	On-Demand	Anodyne	TSPO	23	45
CCCCCCCNC(=O)C(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875079858	FF	On-Demand	Mild	EPHX2	23	53
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2ccc(NC(=O)C3CC3)cc2)C1	ZINC000875079869	GF	On-Demand	Anodyne	F7	17	48
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2ccc(NC(=O)C3CC3)cc2)C1	ZINC000875079871	GF	On-Demand	Anodyne	F7	17	48
O=C(COc1cccc(Cl)c1)Oc1ccc(C(F)(F)F)cc1	ZINC000875079872	EI	On-Demand	Anodyne	MAOB	24	45
O=C(COc1cccc(Cl)c1)Oc1ccc(C(F)(F)F)cc1	ZINC000875079872	EI	On-Demand	Anodyne	PPARD	43	41
O=C(COc1cccc(Cl)c1)Oc1ccc(C(F)(F)F)cc1	ZINC000875079872	EI	On-Demand	Anodyne	LIPE	20	44
O=C(COc1cccc(Cl)c1)Oc1ccc(C(F)(F)F)cc1	ZINC000875079872	EI	On-Demand	Anodyne	PDS	65	42
COC(=O)c1cnc(NC(=O)Cc2csc(C3CCCC3)n2)s1	ZINC000875079873	FG	On-Demand	Anodyne	CDK5	53	45
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(NC(=O)C2CC2)cc1	ZINC000875079890	FF	On-Demand	Anodyne	EPHX2	23	42
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(NC(=O)C2CC2)cc1	ZINC000875079891	FF	On-Demand	Anodyne	EPHX2	23	42
COCC(C)(C)CCNC(=O)C(=O)NCCCc1nc2ccccc2[nH]1	ZINC000875079896	FD	On-Demand	Anodyne	CACNA1G	24	46
COc1ccc(CN(CC(F)(F)F)C(=O)c2cccn(C(C)(C)C)c2=O)cc1	ZINC000875079923	GH	On-Demand	Anodyne	PROKR1	47	31
O=C(Oc1ccc(C(F)(F)F)cc1)c1cccc(NC(=O)C2CC2)c1	ZINC000875079932	EI	On-Demand	Anodyne	MTTP	40	35
O=C(Oc1ccc(C(F)(F)F)cc1)c1cccc(NC(=O)C2CC2)c1	ZINC000875079932	EI	On-Demand	Anodyne	EPHX2	41	45
O=C(Oc1ccc(C(F)(F)F)cc1)c1cccc(NC(=O)C2CC2)c1	ZINC000875079932	EI	On-Demand	Anodyne	ACR	56	48
O=C(Oc1ccc(C(F)(F)F)cc1)c1cccc(NC(=O)C2CC2)c1	ZINC000875079932	EI	On-Demand	Anodyne	AKR1C3	22	45
O=C(Oc1ccc(C(F)(F)F)cc1)c1cccc(NC(=O)C2CC2)c1	ZINC000875079932	EI	On-Demand	Anodyne	KCNK3	73	47
COC(=O)N(C)NC(=O)NCCc1cccc2ccccc12	ZINC000875079946	DE	On-Demand	Reactive	NQO2	60	50
COC(=O)N(C)NC(=O)NCCc1cccc2ccccc12	ZINC000875079946	DE	On-Demand	Reactive	MTNR1A	108	64
COC(=O)N(C)NC(=O)NCCc1cccc2ccccc12	ZINC000875079946	DE	On-Demand	Reactive	MTNR1B	71	50
O=C(NCCc1cccc2ccccc12)NC[C@H]1C[C@H](O)C1	ZINC000875079973	CE	On-Demand	Anodyne	NQO2	34	42
O=C(NCCc1cccc2ccccc12)NC[C@H]1C[C@H](O)C1	ZINC000875079973	CE	On-Demand	Anodyne	MTNR1A	55	59
O=C(NCCc1cccc2ccccc12)NC[C@H]1C[C@H](O)C1	ZINC000875079973	CE	On-Demand	Anodyne	MTNR1B	37	41
CC(C)(C)OC(=O)N1CC[C@H]([C@@H](F)C(=O)Nc2cnccn2)C1	ZINC000875079985	DE	On-Demand	Anodyne	GPR119	50	52
CC(C)(C)OC(=O)N1CC[C@H]([C@H](F)C(=O)Nc2cnccn2)C1	ZINC000875079986	DE	On-Demand	Anodyne	GPR119	50	52
CC(C)(C)OC(=O)N1CC[C@@H]([C@H](F)C(=O)Nc2cnccn2)C1	ZINC000875079987	DE	On-Demand	Anodyne	GPR119	50	52
CC(C)(C)OC(=O)N1CC[C@@H]([C@@H](F)C(=O)Nc2cnccn2)C1	ZINC000875079988	DE	On-Demand	Anodyne	GPR119	50	52
O=C(NCCc1ccsc1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875080006	EF	On-Demand	Anodyne	SLC12A5	19	40
O=C(NCCc1ccsc1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875080007	EF	On-Demand	Anodyne	SLC12A5	19	40
O=C(NCCc1cccc2ccccc12)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875080008	GF	On-Demand	Anodyne	KCNJ11	49	30
O=C(NCCc1cccc2ccccc12)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875080008	GF	On-Demand	Anodyne	MTNR1A	31	47
O=C(CCc1c[nH]c2ccccc12)Oc1ccc(C(F)(F)F)cc1	ZINC000875080020	EJ	On-Demand	Anodyne	HTR1D	20	43
O=C(CCc1c[nH]c2ccccc12)Oc1ccc(C(F)(F)F)cc1	ZINC000875080020	EJ	On-Demand	Anodyne	TACR1	22	47
O=C(CCc1c[nH]c2ccccc12)Oc1ccc(C(F)(F)F)cc1	ZINC000875080020	EJ	On-Demand	Anodyne	CCKBR	44	40
Cc1noc(C)c1COc1ccc(CC(=O)Oc2ccc(C(F)(F)F)cc2)cc1	ZINC000875080035	HK	On-Demand	Anodyne	PPARA	22	43
Cc1noc(C)c1COc1ccc(CC(=O)Oc2ccc(C(F)(F)F)cc2)cc1	ZINC000875080035	HK	On-Demand	Anodyne	PPARD	51	48
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCc2nc3ccccc3[nH]2)C1	ZINC000875080065	FD	On-Demand	Anodyne	HCRTR1	15	41
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCc2nc3ccccc3[nH]2)C1	ZINC000875080065	FD	On-Demand	Anodyne	HCRTR2	23	41
O=C(NCCO)C1CCN(C(=O)NCCc2cccc3ccccc23)CC1	ZINC000875080075	FD	On-Demand	Anodyne	NQO2	34	50
O=C(NCCO)C1CCN(C(=O)NCCc2cccc3ccccc23)CC1	ZINC000875080075	FD	On-Demand	Anodyne	MTNR1A	47	50
O=C(NCCO)C1CCN(C(=O)NCCc2cccc3ccccc23)CC1	ZINC000875080075	FD	On-Demand	Anodyne	MTNR1B	31	49
O=C(NCCO)C1CCN(C(=O)NCCc2cccc3ccccc23)CC1	ZINC000875080075	FD	On-Demand	Anodyne	EPHX2	16	44
O=C(NCCO)C1CCN(C(=O)NCCc2cccc3ccccc23)CC1	ZINC000875080075	FD	On-Demand	Anodyne	Q6PRC7_IXORI	42	35
O=C(CCc1ccc(N2CCCS2(=O)=O)cc1)Nc1cnccn1	ZINC000875080123	ED	On-Demand	Anodyne	CDK1	18	44
CN(C)C[C@@H]1CN(C(=O)NCCc2cccc3ccccc23)C[C@H]1CN(C)C	ZINC000875080135	GF	On-Demand	Anodyne	NQO2	34	41
CN(C)C[C@@H]1CN(C(=O)NCCc2cccc3ccccc23)C[C@H]1CN(C)C	ZINC000875080135	GF	On-Demand	Anodyne	MTNR1A	45	51
CN(C)C[C@@H]1CN(C(=O)NCCc2cccc3ccccc23)C[C@H]1CN(C)C	ZINC000875080135	GF	On-Demand	Anodyne	MTNR1B	27	41
CN(C)C[C@@H]1CN(C(=O)NCCc2cccc3ccccc23)C[C@H]1CN(C)C	ZINC000875080135	GF	On-Demand	Anodyne	Q6PRC7_IXORI	49	35
COC(=O)C1(O)CN(C(=O)NCCc2cccc3ccccc23)C1	ZINC000875080144	ED	On-Demand	Anodyne	NQO2	46	44
COC(=O)C1(O)CN(C(=O)NCCc2cccc3ccccc23)C1	ZINC000875080144	ED	On-Demand	Anodyne	MTNR1A	61	51
COC(=O)C1(O)CN(C(=O)NCCc2cccc3ccccc23)C1	ZINC000875080144	ED	On-Demand	Anodyne	MTNR1B	40	43
COC(=O)C1(O)CN(C(=O)NCCc2cccc3ccccc23)C1	ZINC000875080144	ED	On-Demand	Anodyne	Q6PRC7_IXORI	44	30
CC[C@@H](NC(=O)NCCCCN1CCN(CC)CC1)[C@@H](O)c1ccccc1	ZINC000875080157	GE	On-Demand	Anodyne	HTR1A	33	42
CC[C@@H](NC(=O)NCCCCN1CCN(CC)CC1)[C@@H](O)c1ccccc1	ZINC000875080157	GE	On-Demand	Anodyne	DRD2	40	44
CC[C@@H](NC(=O)NCCCCN1CCN(CC)CC1)[C@@H](O)c1ccccc1	ZINC000875080157	GE	On-Demand	Anodyne	ADRA1A	22	42
CC[C@@H](NC(=O)NCCCCN1CCN(CC)CC1)[C@@H](O)c1ccccc1	ZINC000875080157	GE	On-Demand	Anodyne	DRD3	72	44
CC[C@@H](NC(=O)NCCCCN1CCN(CC)CC1)[C@@H](O)c1ccccc1	ZINC000875080157	GE	On-Demand	Anodyne	CAPN2	18	41
CC[C@@H](NC(=O)NCCCCN1CCN(CC)CC1)[C@H](O)c1ccccc1	ZINC000875080159	GE	On-Demand	Anodyne	HTR1A	33	42
CC[C@@H](NC(=O)NCCCCN1CCN(CC)CC1)[C@H](O)c1ccccc1	ZINC000875080159	GE	On-Demand	Anodyne	DRD2	40	44
CC[C@@H](NC(=O)NCCCCN1CCN(CC)CC1)[C@H](O)c1ccccc1	ZINC000875080159	GE	On-Demand	Anodyne	ADRA1A	22	42
CC[C@@H](NC(=O)NCCCCN1CCN(CC)CC1)[C@H](O)c1ccccc1	ZINC000875080159	GE	On-Demand	Anodyne	DRD3	72	44
CC[C@@H](NC(=O)NCCCCN1CCN(CC)CC1)[C@H](O)c1ccccc1	ZINC000875080159	GE	On-Demand	Anodyne	CAPN2	18	41
O=C(NCCc1cccc2ccccc12)N1CCC(CO)(CO)CC1	ZINC000875080160	EE	On-Demand	Anodyne	NQO2	32	40
O=C(NCCc1cccc2ccccc12)N1CCC(CO)(CO)CC1	ZINC000875080160	EE	On-Demand	Anodyne	MTNR1A	40	52
O=C(NCCc1cccc2ccccc12)N1CCC(CO)(CO)CC1	ZINC000875080160	EE	On-Demand	Anodyne	MTNR1B	25	40
O=C(NCCc1cccc2ccccc12)N1CCC(CO)(CO)CC1	ZINC000875080160	EE	On-Demand	Anodyne	Q6PRC7_IXORI	47	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccsc1	ZINC000875080261	DE	On-Demand	Anodyne	SLC6A4	22	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccsc1	ZINC000875080261	DE	On-Demand	Anodyne	SLC6A3	40	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccsc1	ZINC000875080262	DE	On-Demand	Anodyne	SLC6A4	22	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccsc1	ZINC000875080262	DE	On-Demand	Anodyne	SLC6A3	40	42
O=C(NC1(C(=O)Nc2cnccn2)CC1)OCc1ccccc1	ZINC000875080278	DD	On-Demand	Anodyne	CYSP_TRYCR	42	34
O=C(NC1(C(=O)Nc2cnccn2)CC1)OCc1ccccc1	ZINC000875080278	DD	On-Demand	Anodyne	CTSK	16	49
O=C(NC1(C(=O)Nc2cnccn2)CC1)OCc1ccccc1	ZINC000875080278	DD	On-Demand	Anodyne	CAPNS1	51	34
O=C(NC1(C(=O)Nc2cnccn2)CC1)OCc1ccccc1	ZINC000875080278	DD	On-Demand	Anodyne	CAPN2	42	36
O=C(NC1(C(=O)Nc2cnccn2)CC1)OCc1ccccc1	ZINC000875080278	DD	On-Demand	Anodyne	SLC12A5	45	32
COc1ccc(CN(CC(F)(F)F)C(=O)Cc2cn3cc(F)ccc3n2)cc1	ZINC000875080352	GH	On-Demand	Anodyne	PLA2G7	71	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2csc(-c3ccccc3)n2)C1	ZINC000875080410	FE	On-Demand	Anodyne	DPP7	43	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2csc(-c3ccccc3)n2)C1	ZINC000875080411	FE	On-Demand	Anodyne	DPP7	43	35
O=CN1CCCN(C(=O)NCCc2cccc3ccccc23)CC1	ZINC000875080422	EE	On-Demand	Anodyne	MTNR1A	36	51
O=CN1CCCN(C(=O)NCCc2cccc3ccccc23)CC1	ZINC000875080422	EE	On-Demand	Anodyne	DPP7	18	44
O=CN1CCCN(C(=O)NCCc2cccc3ccccc23)CC1	ZINC000875080422	EE	On-Demand	Anodyne	Q6PRC7_IXORI	50	38
CO[C@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)Nc2cnccn2)C1	ZINC000875080435	FE	On-Demand	Anodyne	GRIN2B	15	49
CO[C@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)Nc2cnccn2)C1	ZINC000875080435	FE	On-Demand	Anodyne	SLC12A5	41	35
CO[C@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)Nc2cnccn2)C1	ZINC000875080436	FE	On-Demand	Anodyne	GRIN2B	15	49
CO[C@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)Nc2cnccn2)C1	ZINC000875080436	FE	On-Demand	Anodyne	SLC12A5	41	35
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)Nc2cnccn2)C1	ZINC000875080437	FE	On-Demand	Anodyne	GRIN2B	15	49
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)Nc2cnccn2)C1	ZINC000875080437	FE	On-Demand	Anodyne	SLC12A5	41	35
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)Nc2cnccn2)C1	ZINC000875080438	FE	On-Demand	Anodyne	GRIN2B	15	49
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)Nc2cnccn2)C1	ZINC000875080438	FE	On-Demand	Anodyne	SLC12A5	41	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	ACE	46	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	OPRM1	28	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	OPRD1	27	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	MME	111	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	ANPEP	82	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	PGC	42	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	CMA1	50	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	CTRA_BOVIN	49	51
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	FCER2	99	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	BMP1	18	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	KLK3	79	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	CTSB	87	48
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	PAPA1_CARPA	90	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	CYSP_TRYCR	78	51
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	CTSG	16	50
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	CTSK	48	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	CTSL	70	48
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	CPA1	23	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	TIMP3	95	48
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	CTRB1	21	50
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	CAPNS1	77	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	GRIA1	42	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	HLA-DRB1	106	50
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	REN	70	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	CTSS	32	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	CAPN1	113	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	MMP9	28	48
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	CTRC	44	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	CAPN2	146	48
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	ACE2	81	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	MC1R	49	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	PLAU	24	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	LAP3	46	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	MMP1	36	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	FPR1	76	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	CTRB_BOVIN	50	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	CYP3A4	28	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	NPR	52	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	PSMB5	59	50
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	BLA1_STEMA	45	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	PSMB8	32	50
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	GPR142	104	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cnccn1	ZINC000875080456	DD	On-Demand	Anodyne	PDS	44	33
COCCOc1ncccc1CNC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875080576	GF	On-Demand	Anodyne	EPHX2	19	48
COCCOc1ncccc1CNC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875080577	GF	On-Demand	Anodyne	EPHX2	19	48
COCCOc1ncccc1CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875080578	GF	On-Demand	Anodyne	CPT1A	83	35
COCCOc1ncccc1CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875080579	GF	On-Demand	Anodyne	CPT1A	83	35
COCCOc1ncccc1CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875080580	GF	On-Demand	Anodyne	CPT1A	83	35
COCCOc1ncccc1CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875080581	GF	On-Demand	Anodyne	CPT1A	83	35
C[C@@H](Cc1cccs1)NC(=O)N1CCCCCCNC(=O)CC1	ZINC000875080585	EF	On-Demand	Anodyne	DPP7	18	40
CN1CC[C@H]2CN(C(=O)C(=O)NCCCc3nc4ccccc4[nH]3)CC[C@H]21	ZINC000875080604	FD	On-Demand	Anodyne	PLD1	46	34
CN1CC[C@H]2CN(C(=O)C(=O)NCCCc3nc4ccccc4[nH]3)CC[C@@H]21	ZINC000875080605	FD	On-Demand	Anodyne	PLD1	46	34
O=C(NCCCc1nc2ccccc2[nH]1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875080630	GF	On-Demand	Anodyne	GRIN2B	16	43
O=C(NCCCc1nc2ccccc2[nH]1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875080631	GF	On-Demand	Anodyne	GRIN2B	16	43
COC(=O)C1CCN(C(=O)[C@@H](C)OC(=O)CCc2c(-c3ccc(OC)cc3)[nH]c3ccccc23)CC1	ZINC000875080636	JI	On-Demand	Anodyne	ALOX15	27	42
COC(=O)C1CCN(C(=O)[C@H](C)OC(=O)CCc2c(-c3ccc(OC)cc3)[nH]c3ccccc23)CC1	ZINC000875080637	JI	On-Demand	Anodyne	ALOX15	27	42
O=C(NCCc1ccsc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875080643	EF	On-Demand	Anodyne	ADRB1	23	41
O=C(NCCc1ccsc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875080643	EF	On-Demand	Anodyne	ADRB3	20	41
O=C(NCCc1ccsc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875080644	EF	On-Demand	Anodyne	ADRB1	23	41
O=C(NCCc1ccsc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875080644	EF	On-Demand	Anodyne	ADRB3	20	41
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1cnccn1	ZINC000875080645	CE	On-Demand	Anodyne	PPARG	26	41
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1cnccn1	ZINC000875080645	CE	On-Demand	Anodyne	PPARD	42	41
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1cnccn1	ZINC000875080645	CE	On-Demand	Anodyne	MTNR1A	26	41
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1cnccn1	ZINC000875080645	CE	On-Demand	Anodyne	MTNR1B	30	41
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1cnccn1	ZINC000875080645	CE	On-Demand	Anodyne	TYK2	20	41
O=C(NCCc1ccsc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875080689	EG	On-Demand	Anodyne	TRY1_BOVIN	41	33
O=C(NCCc1ccsc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875080689	EG	On-Demand	Anodyne	PREP	44	36
O=C(NCCc1ccsc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875080690	EG	On-Demand	Anodyne	TRY1_BOVIN	41	33
O=C(NCCc1ccsc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875080690	EG	On-Demand	Anodyne	PREP	44	36
O=C(NCCc1ccsc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875080691	EG	On-Demand	Anodyne	TRY1_BOVIN	41	33
O=C(NCCc1ccsc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875080691	EG	On-Demand	Anodyne	PREP	44	36
O=C(NCCc1ccsc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875080692	EG	On-Demand	Anodyne	TRY1_BOVIN	41	33
O=C(NCCc1ccsc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875080692	EG	On-Demand	Anodyne	PREP	44	36
COC(=O)c1c(NC(=O)CCCOC2CCOCC2)sc2c1CCCC2	ZINC000875080779	GG	On-Demand	Anodyne	VIPR1	25	40
CN(C[C@H](O)CN(C)C(=O)OC(C)(C)C)C(=O)NCCc1ccsc1	ZINC000875080808	FE	On-Demand	Anodyne	PAPA1_CARPA	16	42
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCCc1nc2ccccc2[nH]1	ZINC000875080819	GD	On-Demand	Anodyne	OPRD1	19	41
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCCc1nc2ccccc2[nH]1	ZINC000875080820	GD	On-Demand	Anodyne	OPRD1	19	41
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCCCc2nc3ccccc3[nH]2)c1	ZINC000875080839	GF	On-Demand	Anodyne	OPRD1	18	40
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCCCc2nc3ccccc3[nH]2)c1	ZINC000875080840	GF	On-Demand	Anodyne	OPRD1	18	40
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2csc(-c3ccccc3)n2)C1	ZINC000875080851	FE	On-Demand	Anodyne	HCRTR1	17	41
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2csc(-c3ccccc3)n2)C1	ZINC000875080851	FE	On-Demand	Anodyne	HCRTR2	24	41
O=C(NCC[C@@H]1CCSC1)C(=O)NCc1csc(-c2ccccc2)n1	ZINC000875080856	GF	On-Demand	Anodyne	VCP	57	37
O=C(NCC[C@H]1CCSC1)C(=O)NCc1csc(-c2ccccc2)n1	ZINC000875080857	GF	On-Demand	Anodyne	VCP	57	37
Cc1oc(-c2ccccc2)nc1C(=O)Oc1ccc(C(F)(F)F)cc1	ZINC000875080859	EJ	On-Demand	Anodyne	PPARG	75	45
Cc1oc(-c2ccccc2)nc1C(=O)Oc1ccc(C(F)(F)F)cc1	ZINC000875080859	EJ	On-Demand	Anodyne	PPARA	86	45
Cc1oc(-c2ccccc2)nc1C(=O)Oc1ccc(C(F)(F)F)cc1	ZINC000875080859	EJ	On-Demand	Anodyne	PPARD	36	47
Cc1oc(-c2ccccc2)nc1C(=O)Oc1ccc(C(F)(F)F)cc1	ZINC000875080859	EJ	On-Demand	Anodyne	PDE8B	42	29
C=CC(C)(C)CCCNC(=O)C(=O)NCCCc1nc2ccccc2[nH]1	ZINC000875080871	FF	On-Demand	Mild	CACNA1G	22	41
CC(C)(C)OC(=O)N1C[C@@H]2CCC[C@]2(C(=O)Nc2cnccn2)C1	ZINC000875080885	EE	On-Demand	Anodyne	GPR119	16	43
COCCOc1ccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000875080947	GG	On-Demand	Anodyne	LTA4H	27	42
COCCOc1ccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000875080947	GG	On-Demand	Anodyne	HRH3	24	45
COCCOc1ccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000875080947	GG	On-Demand	Anodyne	EPHX2	23	42
COCCOc1ccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000875080948	GG	On-Demand	Anodyne	LTA4H	27	42
COCCOc1ccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000875080948	GG	On-Demand	Anodyne	HRH3	24	45
COCCOc1ccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000875080948	GG	On-Demand	Anodyne	EPHX2	23	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1cccs1	ZINC000875081085	DE	On-Demand	Anodyne	SLC6A4	22	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1cccs1	ZINC000875081085	DE	On-Demand	Anodyne	SLC6A3	47	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1cccs1	ZINC000875081087	DE	On-Demand	Anodyne	SLC6A4	22	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1cccs1	ZINC000875081087	DE	On-Demand	Anodyne	SLC6A3	47	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1cccs1	ZINC000875081089	DE	On-Demand	Anodyne	SLC6A4	22	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1cccs1	ZINC000875081089	DE	On-Demand	Anodyne	SLC6A3	47	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1cccs1	ZINC000875081091	DE	On-Demand	Anodyne	SLC6A4	22	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1cccs1	ZINC000875081091	DE	On-Demand	Anodyne	SLC6A3	47	44
C[C@@H](Cc1cccs1)NC(=O)NCC1(NC(=O)OC(C)(C)C)CCOCC1	ZINC000875081101	GG	On-Demand	Anodyne	PAPA1_CARPA	22	46
C[C@H](Cc1ccco1)NC(=O)N1CCc2nc(C3CC3)ncc2C1	ZINC000875081122	EF	On-Demand	Anodyne	MAPK1	51	37
C[C@@H](Cc1ccco1)NC(=O)N1CCc2nc(C3CC3)ncc2C1	ZINC000875081123	EF	On-Demand	Anodyne	MAPK1	51	37
C[C@@H](Cc1ccco1)NC(=O)NCC[C@@H](O)COCc1ccccc1	ZINC000875081131	EE	On-Demand	Anodyne	CAPN2	47	34
C[C@H](Cc1ccco1)NC(=O)NCC[C@@H](O)COCc1ccccc1	ZINC000875081132	EE	On-Demand	Anodyne	CAPN2	47	34
COCCOc1ncccc1CNC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875081153	GD	On-Demand	Anodyne	EPHX2	15	46
COCCOc1ncccc1CNC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875081154	GD	On-Demand	Anodyne	EPHX2	15	46
C[C@@H](Cc1cccs1)NC(=O)NCC[C@@H](O)C1CCCC1	ZINC000875081161	DF	On-Demand	Anodyne	CTSC	35	42
C[C@@H](Cc1cccs1)NC(=O)NCC[C@H](O)C1CCCC1	ZINC000875081162	DF	On-Demand	Anodyne	CTSC	35	42
COCCOc1ncccc1CNC(=O)NNc1cccc(C)n1	ZINC000875081194	ED	On-Demand	Reactive	GRM5	17	40
COC(=O)N(C)NC(=O)N[C@H](C)Cc1cccs1	ZINC000875081226	CD	On-Demand	Reactive	CTSC	36	41
COC(=O)N(C)NC(=O)N[C@@H](C)Cc1cccs1	ZINC000875081227	CD	On-Demand	Reactive	CTSC	36	41
C[C@@H](Cc1cccs1)NC(=O)N1CCCN(C=O)CC1	ZINC000875081234	CD	On-Demand	Anodyne	DPP7	15	41
C[C@H](Cc1ccco1)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875081258	EG	On-Demand	Anodyne	ACE	29	42
C[C@H](Cc1ccco1)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875081258	EG	On-Demand	Anodyne	XIAP	31	41
C[C@H](Cc1ccco1)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875081259	EG	On-Demand	Anodyne	ACE	29	42
C[C@H](Cc1ccco1)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875081259	EG	On-Demand	Anodyne	XIAP	31	41
C[C@H](Cc1ccco1)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875081260	EG	On-Demand	Anodyne	ACE	29	42
C[C@H](Cc1ccco1)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875081260	EG	On-Demand	Anodyne	XIAP	31	41
C[C@H](Cc1ccco1)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875081261	EG	On-Demand	Anodyne	ACE	29	42
C[C@H](Cc1ccco1)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875081261	EG	On-Demand	Anodyne	XIAP	31	41
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NC[C@H]2CCCc3ccccc32)CC1	ZINC000875081267	GC	On-Demand	Anodyne	HTR6	43	39
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NC[C@@H]2CCCc3ccccc32)CC1	ZINC000875081268	GC	On-Demand	Anodyne	HTR6	43	39
C[C@H](NC(=O)C(=O)NC1CCN(CC2CC2)CC1)c1cc2cnccc2o1	ZINC000875081276	FD	On-Demand	Anodyne	SSTR5	53	36
C[C@H](NC(=O)C(=O)NC1CCN(CC2CC2)CC1)c1cc2cnccc2o1	ZINC000875081276	FD	On-Demand	Anodyne	PDK1	40	39
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@H]2CCCc3ccccc32)C1	ZINC000875081295	EE	On-Demand	Anodyne	MTNR1B	16	40
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@@H]2CCCc3ccccc32)C1	ZINC000875081296	EE	On-Demand	Anodyne	MTNR1B	16	40
COCCOc1ccc(CNC(=O)N2CCC[C@](O)(c3ccccc3)C2)cc1	ZINC000875081328	GF	On-Demand	Anodyne	EPHX2	15	52
C[C@@H](Cc1cccs1)NC(=O)NC1(C)CC(F)(F)C1	ZINC000875081354	CG	On-Demand	Anodyne	CTSC	37	45
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCOc2ccc(C)cc2)C1	ZINC000875081395	FF	On-Demand	Anodyne	PLA2G4B	50	31
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1ccccc1)N1CCOCC1	ZINC000875081421	GD	On-Demand	Anodyne	SLC6A4	20	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1ccccc1)N1CCOCC1	ZINC000875081421	GD	On-Demand	Anodyne	SLC6A3	49	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1ccccc1)N1CCOCC1	ZINC000875081422	GD	On-Demand	Anodyne	SLC6A4	20	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1ccccc1)N1CCOCC1	ZINC000875081422	GD	On-Demand	Anodyne	SLC6A3	49	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1ccccc1)N1CCOCC1	ZINC000875081423	GD	On-Demand	Anodyne	SLC6A4	20	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1ccccc1)N1CCOCC1	ZINC000875081423	GD	On-Demand	Anodyne	SLC6A3	49	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1ccccc1)N1CCOCC1	ZINC000875081424	GD	On-Demand	Anodyne	SLC6A4	20	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1ccccc1)N1CCOCC1	ZINC000875081424	GD	On-Demand	Anodyne	SLC6A3	49	40
COCCOc1ccc(CNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)cc1	ZINC000875081429	GF	On-Demand	Anodyne	EPHX2	15	52
O=C(CSc1ccc([N+](=O)[O-])cc1)Oc1ccc(C(F)(F)F)cc1	ZINC000875081435	FI	On-Demand	Bother	PPARD	19	40
COCCOc1ccc(CNC(=O)N2CCC[C@@H](CCC(=O)OC)C2)cc1	ZINC000875081452	GF	On-Demand	Anodyne	LTA4H	21	41
COCCOc1ccc(CNC(=O)N2CCC[C@H](CCC(=O)OC)C2)cc1	ZINC000875081453	GF	On-Demand	Anodyne	LTA4H	21	41
COc1ccc(OCCCC(=O)Oc2ccc(C(F)(F)F)cc2)cc1	ZINC000875081464	FI	On-Demand	Anodyne	PPARD	52	44
COc1ccc(OCCCC(=O)Oc2ccc(C(F)(F)F)cc2)cc1	ZINC000875081464	FI	On-Demand	Anodyne	PLA2G4B	64	33
COc1ccc(OCCCC(=O)Oc2ccc(C(F)(F)F)cc2)cc1	ZINC000875081464	FI	On-Demand	Anodyne	LIPE	19	42
O=C(NC1CCN(CC2CC2)CC1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875081465	GD	On-Demand	Anodyne	SIGMAR1	22	40
O=C(NC1CCN(CC2CC2)CC1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875081466	GD	On-Demand	Anodyne	SIGMAR1	22	40
O=C(NC1CCN(CC2CC2)CC1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875081467	GD	On-Demand	Anodyne	SIGMAR1	22	40
O=C(NC1CCN(CC2CC2)CC1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875081468	GD	On-Demand	Anodyne	SIGMAR1	22	40
N#Cc1ccc(N2CCN(C(=O)C(=O)NC3CCN(CC4CC4)CC3)CC2)cc1	ZINC000875081478	GD	On-Demand	Mild	SIGMAR1	18	50
CN1CCN(C2CCN(C(=O)C(=O)NC[C@@H]3CCCc4ccccc43)CC2)CC1	ZINC000875081496	GD	On-Demand	Anodyne	HTR6	26	40
CN1CCN(C2CCN(C(=O)C(=O)NC[C@@H]3CCCc4ccccc43)CC2)CC1	ZINC000875081496	GD	On-Demand	Anodyne	L3MBTL3	72	41
CN1CCN(C2CCN(C(=O)C(=O)NC[C@H]3CCCc4ccccc43)CC2)CC1	ZINC000875081497	GD	On-Demand	Anodyne	HTR6	26	40
CN1CCN(C2CCN(C(=O)C(=O)NC[C@H]3CCCc4ccccc43)CC2)CC1	ZINC000875081497	GD	On-Demand	Anodyne	L3MBTL3	72	41
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccccc1C(=O)Nc1ccc(Cl)cc1	ZINC000875081520	GH	On-Demand	Anodyne	AVPR2	50	45
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccccc1C(=O)Nc1ccc(Cl)cc1	ZINC000875081520	GH	On-Demand	Anodyne	F10	38	47
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccccc1C(=O)Nc1ccc(Cl)cc1	ZINC000875081520	GH	On-Demand	Anodyne	ELANE	40	38
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccccc1C(=O)Nc1ccc(Cl)cc1	ZINC000875081520	GH	On-Demand	Anodyne	CCR1	24	44
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccccc1C(=O)Nc1ccc(Cl)cc1	ZINC000875081520	GH	On-Demand	Anodyne	LGMN	70	38
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccccc1C(=O)Nc1ccc(Cl)cc1	ZINC000875081520	GH	On-Demand	Anodyne	CFTR	22	40
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccccc1C(=O)Nc1ccc(Cl)cc1	ZINC000875081520	GH	On-Demand	Anodyne	XIAP	43	40
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccccc1C(=O)Nc1ccc(Cl)cc1	ZINC000875081520	GH	On-Demand	Anodyne	NR2E3	54	36
COCC1CC(NC(=O)NCc2cccc(C(=O)NCc3ccc(C)cc3)c2)C1	ZINC000875081540	GG	On-Demand	Anodyne	MMP13	18	46
COCC1CC(NC(=O)NCc2cccc(C(=O)NCc3ccc(C)cc3)c2)C1	ZINC000875081540	GG	On-Demand	Anodyne	ROCK2	21	43
COC(=O)c1c(NC(=O)Cn2nccc2C)sc2c1CCCC2	ZINC000875081543	EF	On-Demand	Anodyne	VIPR1	26	41
Cn1nc(Cl)c(C(=O)N(Cc2ccncc2)C2CC2)c1Cl	ZINC000875081618	EF	On-Demand	Anodyne	SLC6A9	17	42
O=C(Oc1ccccc1C(=O)N1CCOCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875081619	GF	On-Demand	Anodyne	ACHE	24	42
O=C(Oc1ccccc1C(=O)N1CCOCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875081619	GF	On-Demand	Anodyne	SLC6A1	71	36
O=C(Oc1ccccc1C(=O)N1CCOCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875081619	GF	On-Demand	Anodyne	SIGMAR1	37	41
O=C(Oc1ccccc1C(=O)N1CCOCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875081619	GF	On-Demand	Anodyne	CCR3	18	40
O=C(Oc1ccccc1C(=O)N1CCOCC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875081619	GF	On-Demand	Anodyne	SLC18A3	18	40
O=C(Oc1ccccc1C(=O)N1CCOCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875081620	GF	On-Demand	Anodyne	ACHE	24	42
O=C(Oc1ccccc1C(=O)N1CCOCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875081620	GF	On-Demand	Anodyne	SLC6A1	71	36
O=C(Oc1ccccc1C(=O)N1CCOCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875081620	GF	On-Demand	Anodyne	SIGMAR1	37	41
O=C(Oc1ccccc1C(=O)N1CCOCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875081620	GF	On-Demand	Anodyne	CCR3	18	40
O=C(Oc1ccccc1C(=O)N1CCOCC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875081620	GF	On-Demand	Anodyne	SLC18A3	18	40
COCCOc1ccc(CNC(=O)N2Cc3cccc(O)c3C2)cn1	ZINC000875081627	EE	On-Demand	Clean	NAMPT	25	40
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OC(C)C)nc1	ZINC000875081636	DE	On-Demand	Anodyne	ACACB	19	42
COCCOc1ccc(CNC(=O)NCC[C@@H](O)C2CCCC2)cc1	ZINC000875081661	FE	On-Demand	Anodyne	ADRB1	24	41
COCCOc1ccc(CNC(=O)NCC[C@H](O)C2CCCC2)cc1	ZINC000875081663	FE	On-Demand	Anodyne	ADRB1	24	41
COCCOc1ncccc1CNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875081672	GE	On-Demand	Anodyne	SCN10A	24	42
COCCOc1ccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875081673	EE	On-Demand	Anodyne	HRH3	17	42
COCCOc1ncccc1CNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875081674	GE	On-Demand	Anodyne	SCN10A	24	42
COCCOc1ccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875081675	EE	On-Demand	Anodyne	HRH3	17	42
O=C(CC(F)(F)C(F)(F)F)Oc1ccccc1C(=O)N1CCOCC1	ZINC000875081704	FF	On-Demand	Anodyne	MLYCD	22	42
COC(=O)c1c(NC(=O)c2coc(C#N)c2)sc2c1CCCC2	ZINC000875081726	EG	On-Demand	Mild	VIPR1	27	42
COCCOc1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cn1	ZINC000875081734	GF	On-Demand	Anodyne	F2	18	41
COCCOc1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cn1	ZINC000875081734	GF	On-Demand	Anodyne	FKBP1A	43	37
COCCOc1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cn1	ZINC000875081734	GF	On-Demand	Anodyne	CPT1A	85	39
COCCOc1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cn1	ZINC000875081734	GF	On-Demand	Anodyne	PREP	26	41
COCCOc1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cn1	ZINC000875081736	GF	On-Demand	Anodyne	F2	18	41
COCCOc1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cn1	ZINC000875081736	GF	On-Demand	Anodyne	FKBP1A	43	37
COCCOc1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cn1	ZINC000875081736	GF	On-Demand	Anodyne	CPT1A	85	39
COCCOc1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cn1	ZINC000875081736	GF	On-Demand	Anodyne	PREP	26	41
COCCOc1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cn1	ZINC000875081738	GF	On-Demand	Anodyne	F2	18	41
COCCOc1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cn1	ZINC000875081738	GF	On-Demand	Anodyne	FKBP1A	43	37
COCCOc1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cn1	ZINC000875081738	GF	On-Demand	Anodyne	CPT1A	85	39
COCCOc1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cn1	ZINC000875081738	GF	On-Demand	Anodyne	PREP	26	41
COCCOc1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cn1	ZINC000875081740	GF	On-Demand	Anodyne	F2	18	41
COCCOc1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cn1	ZINC000875081740	GF	On-Demand	Anodyne	FKBP1A	43	37
COCCOc1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cn1	ZINC000875081740	GF	On-Demand	Anodyne	CPT1A	85	39
COCCOc1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cn1	ZINC000875081740	GF	On-Demand	Anodyne	PREP	26	41
COCCOc1ccc(CNC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)cn1	ZINC000875081742	FD	On-Demand	Anodyne	SLC6A3	41	37
COCCOc1ccc(CNC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)cn1	ZINC000875081744	FD	On-Demand	Anodyne	SLC6A3	41	37
O=C(Nc1cnccn1)[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875081771	CF	On-Demand	Anodyne	C3AR1	47	48
O=C(Nc1cnccn1)[C@H](Cc1cccnc1)C1CCCC1	ZINC000875081773	CF	On-Demand	Anodyne	C3AR1	47	48
O=C(NCc1ccc(OC(F)F)cc1F)C(=O)NC1CCN(CC2CC2)CC1	ZINC000875081783	GE	On-Demand	Anodyne	SIGMAR1	17	41
CCCCCCCNC(=O)C(=O)NC1CCN(CC2CC2)CC1	ZINC000875081816	DE	On-Demand	Mild	ASAH1	57	42
CC[C@@H](NC(=O)NCc1ccc(OCCOC)cc1)[C@@H](O)c1ccccc1	ZINC000875081821	FG	On-Demand	Anodyne	ANPEP	17	44
CC[C@@H](NC(=O)NCc1ccc(OCCOC)cc1)[C@@H](O)c1ccccc1	ZINC000875081821	FG	On-Demand	Anodyne	PDS	60	41
CC[C@@H](NC(=O)NCc1ccc(OCCOC)cc1)[C@H](O)c1ccccc1	ZINC000875081825	FG	On-Demand	Anodyne	ANPEP	17	44
CC[C@@H](NC(=O)NCc1ccc(OCCOC)cc1)[C@H](O)c1ccccc1	ZINC000875081825	FG	On-Demand	Anodyne	PDS	60	41
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H]1CCN2CCC[C@H]2C1	ZINC000875081834	GE	On-Demand	Anodyne	CHRNA7	47	37
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H]1CCN2CCC[C@H]2C1	ZINC000875081834	GE	On-Demand	Anodyne	C3AR1	45	44
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H]1CCN2CCC[C@@H]2C1	ZINC000875081835	GE	On-Demand	Anodyne	CHRNA7	47	37
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H]1CCN2CCC[C@@H]2C1	ZINC000875081835	GE	On-Demand	Anodyne	C3AR1	45	44
O=C(N[C@@H]1CCN2CCC[C@H]2C1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875081836	GE	On-Demand	Anodyne	CHRNA7	47	37
O=C(N[C@@H]1CCN2CCC[C@H]2C1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875081836	GE	On-Demand	Anodyne	C3AR1	45	44
O=C(N[C@@H]1CCN2CCC[C@@H]2C1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875081837	GE	On-Demand	Anodyne	CHRNA7	47	37
O=C(N[C@@H]1CCN2CCC[C@@H]2C1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875081837	GE	On-Demand	Anodyne	C3AR1	45	44
O=C(N[C@@H]1CCN2CCC[C@H]2C1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875081853	FD	On-Demand	Anodyne	OXTR	40	35
O=C(N[C@@H]1CCN2CCC[C@@H]2C1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875081854	FD	On-Demand	Anodyne	OXTR	40	35
O=C(N[C@@H]1CCN2CCC[C@@H]2C1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875081855	FD	On-Demand	Anodyne	OXTR	40	35
O=C(N[C@@H]1CCN2CCC[C@H]2C1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875081856	FD	On-Demand	Anodyne	OXTR	40	35
O=C(NC[C@H]1CCCCN1Cc1ccccc1)C(=O)N[C@@H]1CCN2CCC[C@@H]2C1	ZINC000875081890	GD	On-Demand	Anodyne	DRD2	32	44
O=C(NC[C@H]1CCCCN1Cc1ccccc1)C(=O)N[C@@H]1CCN2CCC[C@@H]2C1	ZINC000875081890	GD	On-Demand	Anodyne	SIGMAR1	26	46
O=C(NC[C@H]1CCCCN1Cc1ccccc1)C(=O)N[C@H]1CCN2CCC[C@H]2C1	ZINC000875081891	GD	On-Demand	Anodyne	DRD2	32	44
O=C(NC[C@H]1CCCCN1Cc1ccccc1)C(=O)N[C@H]1CCN2CCC[C@H]2C1	ZINC000875081891	GD	On-Demand	Anodyne	SIGMAR1	26	46
O=C(NC[C@H]1CCCCN1Cc1ccccc1)C(=O)N[C@H]1CCN2CCC[C@@H]2C1	ZINC000875081892	GD	On-Demand	Anodyne	DRD2	32	44
O=C(NC[C@H]1CCCCN1Cc1ccccc1)C(=O)N[C@H]1CCN2CCC[C@@H]2C1	ZINC000875081892	GD	On-Demand	Anodyne	SIGMAR1	26	46
O=C(NC[C@H]1CCCCN1Cc1ccccc1)C(=O)N[C@@H]1CCN2CCC[C@H]2C1	ZINC000875081893	GD	On-Demand	Anodyne	DRD2	32	44
O=C(NC[C@H]1CCCCN1Cc1ccccc1)C(=O)N[C@@H]1CCN2CCC[C@H]2C1	ZINC000875081893	GD	On-Demand	Anodyne	SIGMAR1	26	46
C[C@@]1(Br)C[C@@H]1C(=O)Nc1nccc(-c2ccccc2)n1	ZINC000875081927	EG	On-Demand	Anodyne	CAMK2D	33	43
C[C@@]1(Br)C[C@@H]1C(=O)Nc1nccc(-c2ccccc2)n1	ZINC000875081927	EG	On-Demand	Anodyne	SMG1	57	33
O=C(NCCN1CCN(c2ccccc2)CC1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875081934	GD	On-Demand	Anodyne	HTR1A	56	47
O=C(NCCN1CCN(c2ccccc2)CC1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875081934	GD	On-Demand	Anodyne	DRD2	46	47
O=C(NCCN1CCN(c2ccccc2)CC1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875081934	GD	On-Demand	Anodyne	DRD4	43	34
O=C(NCCN1CCN(c2ccccc2)CC1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875081934	GD	On-Demand	Anodyne	HTR2A	36	40
O=C(NCCN1CCN(c2ccccc2)CC1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875081934	GD	On-Demand	Anodyne	DRD3	68	42
O=C(NCCN1CCN(c2ccccc2)CC1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875081934	GD	On-Demand	Anodyne	HTR7	52	40
O=C(NCCN1CCN(c2ccccc2)CC1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875081935	GD	On-Demand	Anodyne	HTR1A	56	47
O=C(NCCN1CCN(c2ccccc2)CC1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875081935	GD	On-Demand	Anodyne	DRD2	46	47
O=C(NCCN1CCN(c2ccccc2)CC1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875081935	GD	On-Demand	Anodyne	DRD4	43	34
O=C(NCCN1CCN(c2ccccc2)CC1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875081935	GD	On-Demand	Anodyne	HTR2A	36	40
O=C(NCCN1CCN(c2ccccc2)CC1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875081935	GD	On-Demand	Anodyne	DRD3	68	42
O=C(NCCN1CCN(c2ccccc2)CC1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875081935	GD	On-Demand	Anodyne	HTR7	52	40
O=C(NCCN1CCN(c2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875081936	GC	On-Demand	Anodyne	HTR1A	76	54
O=C(NCCN1CCN(c2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875081936	GC	On-Demand	Anodyne	DRD2	55	54
O=C(NCCN1CCN(c2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875081936	GC	On-Demand	Anodyne	DRD4	49	40
O=C(NCCN1CCN(c2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875081936	GC	On-Demand	Anodyne	ADRA1D	28	45
O=C(NCCN1CCN(c2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875081936	GC	On-Demand	Anodyne	HTR2A	47	48
O=C(NCCN1CCN(c2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875081936	GC	On-Demand	Anodyne	HTR2C	24	43
O=C(NCCN1CCN(c2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875081936	GC	On-Demand	Anodyne	ADRA1A	38	45
O=C(NCCN1CCN(c2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875081936	GC	On-Demand	Anodyne	ADRA1B	28	45
O=C(NCCN1CCN(c2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875081936	GC	On-Demand	Anodyne	DRD3	72	48
O=C(NCCN1CCN(c2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875081936	GC	On-Demand	Anodyne	HTR4	15	44
O=C(NCCN1CCN(c2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875081936	GC	On-Demand	Anodyne	HTR7	70	45
O=C(NCCN1CCN(c2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875081936	GC	On-Demand	Anodyne	PLD2	50	37
CC[C@H](C[C@H](C)O)NC(=O)NCCCCOc1ccc(C)cc1	ZINC000875081964	DG	On-Demand	Anodyne	ADRB1	17	41
COC(=O)C1(O)CN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000875081976	GB	On-Demand	Anodyne	HTR1A	51	53
COC(=O)C1(O)CN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000875081976	GB	On-Demand	Anodyne	DRD2	46	51
COC(=O)C1(O)CN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000875081976	GB	On-Demand	Anodyne	DRD1	22	43
COC(=O)C1(O)CN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000875081976	GB	On-Demand	Anodyne	DRD4	51	42
COC(=O)C1(O)CN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000875081976	GB	On-Demand	Anodyne	ADRA1D	38	41
COC(=O)C1(O)CN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000875081976	GB	On-Demand	Anodyne	HTR2A	35	46
COC(=O)C1(O)CN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000875081976	GB	On-Demand	Anodyne	HTR2C	17	43
COC(=O)C1(O)CN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000875081976	GB	On-Demand	Anodyne	ADRA1A	45	41
COC(=O)C1(O)CN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000875081976	GB	On-Demand	Anodyne	ADRA1B	32	41
COC(=O)C1(O)CN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000875081976	GB	On-Demand	Anodyne	DRD3	61	43
COC(=O)C1(O)CN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000875081976	GB	On-Demand	Anodyne	HTR7	41	46
COC(=O)C1(O)CN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000875081976	GB	On-Demand	Anodyne	PLD2	63	36
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCCOc1ccc(C)cc1	ZINC000875082011	FF	On-Demand	Anodyne	SLC6A4	26	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCCOc1ccc(C)cc1	ZINC000875082011	FF	On-Demand	Anodyne	SLC6A3	51	42
COC(=O)c1ccc(CC(=O)Nc2sc3c(c2C(=O)OC)CCCC3)cn1	ZINC000875082027	GF	On-Demand	Anodyne	VIPR1	28	45
CC(=O)N1CCC[C@@H]1C(=O)Oc1ccccc1C(=O)N1CCOCC1	ZINC000875082041	ED	On-Demand	Anodyne	PREP	43	38
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1ncc(C(N)=O)s1	ZINC000875082076	DD	On-Demand	Anodyne	PPARD	52	41
COCCOc1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cn1	ZINC000875082118	GF	On-Demand	Anodyne	F2	25	43
COCCOc1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cn1	ZINC000875082118	GF	On-Demand	Anodyne	PREP	45	44
COCCOc1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cn1	ZINC000875082118	GF	On-Demand	Anodyne	TMPRSS11D	43	32
COCCOc1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cn1	ZINC000875082119	GF	On-Demand	Anodyne	F2	25	43
COCCOc1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cn1	ZINC000875082119	GF	On-Demand	Anodyne	PREP	45	44
COCCOc1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cn1	ZINC000875082119	GF	On-Demand	Anodyne	TMPRSS11D	43	32
COCCOc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cn1	ZINC000875082120	GF	On-Demand	Anodyne	F2	25	43
COCCOc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cn1	ZINC000875082120	GF	On-Demand	Anodyne	PREP	45	44
COCCOc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cn1	ZINC000875082120	GF	On-Demand	Anodyne	TMPRSS11D	43	32
COCCOc1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cn1	ZINC000875082122	GF	On-Demand	Anodyne	F2	25	43
COCCOc1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cn1	ZINC000875082122	GF	On-Demand	Anodyne	PREP	45	44
COCCOc1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cn1	ZINC000875082122	GF	On-Demand	Anodyne	TMPRSS11D	43	32
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OCCOC)cc1	ZINC000875082133	DE	On-Demand	Anodyne	ANPEP	20	47
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OCCOC)cc1	ZINC000875082133	DE	On-Demand	Anodyne	PDS	53	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)c2cc(C(C)=O)c[nH]2)CC1	ZINC000875082139	FD	On-Demand	Anodyne	P2RY12	41	39
CCOC(=O)N1CCN(C(=O)[C@H](C)OC(=O)c2cc(C(C)=O)c[nH]2)CC1	ZINC000875082140	FD	On-Demand	Anodyne	P2RY12	41	39
COCCOc1ccc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875082170	FE	On-Demand	Anodyne	LTA4H	18	40
COCCOc1ccc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875082170	FE	On-Demand	Anodyne	HRH3	25	44
COCCOc1ccc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875082171	FE	On-Demand	Anodyne	LTA4H	18	40
COCCOc1ccc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875082171	FE	On-Demand	Anodyne	HRH3	25	44
COCCOc1ccc(CNC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)cc1	ZINC000875082179	FD	On-Demand	Anodyne	SLC6A4	28	44
COCCOc1ccc(CNC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)cc1	ZINC000875082179	FD	On-Demand	Anodyne	SLC6A3	53	44
COCCOc1ccc(CNC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)cc1	ZINC000875082180	FD	On-Demand	Anodyne	SLC6A4	28	44
COCCOc1ccc(CNC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)cc1	ZINC000875082180	FD	On-Demand	Anodyne	SLC6A3	53	44
C[C@@]1(Br)C[C@H]1C(=O)Nc1nccc(-c2ccccc2)n1	ZINC000875082204	EG	On-Demand	Anodyne	CAMK2D	33	43
C[C@@]1(Br)C[C@H]1C(=O)Nc1nccc(-c2ccccc2)n1	ZINC000875082204	EG	On-Demand	Anodyne	SMG1	57	33
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(CC2CC2)CC1	ZINC000875082213	ED	On-Demand	Anodyne	HTR4	20	41
Cc1nc(NC(=O)Cc2cccc3ncccc23)nc2c1CCCC2	ZINC000875082261	EG	On-Demand	Anodyne	ACHE	67	38
Cc1nc(NC(=O)Cc2cccc3ncccc23)nc2c1CCCC2	ZINC000875082261	EG	On-Demand	Anodyne	BCHE	89	38
Cc1nc(NC(=O)c2ccc(-c3cnn(C)c3)cc2)nc2c1CCCC2	ZINC000875082274	EG	On-Demand	Anodyne	SHH	23	45
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1[C@H]2CC[C@H]1CC1(CC1)C2	ZINC000875082294	GE	On-Demand	Anodyne	PLG	56	32
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1[C@H]2CC[C@H]1CC1(CC1)C2	ZINC000875082294	GE	On-Demand	Anodyne	TRYP_PIG	47	32
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1[C@H]2CC[C@H]1CC1(CC1)C2	ZINC000875082294	GE	On-Demand	Anodyne	TMPRSS11D	86	34
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875082301	FD	On-Demand	Anodyne	HTR1A	38	55
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875082301	FD	On-Demand	Anodyne	DRD2	30	55
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875082301	FD	On-Demand	Anodyne	DRD4	45	38
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875082301	FD	On-Demand	Anodyne	HTR2A	28	45
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875082301	FD	On-Demand	Anodyne	DRD3	37	45
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875082301	FD	On-Demand	Anodyne	HTR7	32	40
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875082301	FD	On-Demand	Anodyne	CCR3	51	39
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875082301	FD	On-Demand	Anodyne	PLD2	59	35
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875082301	FD	On-Demand	Anodyne	SLC27A1	30	40
O=C(NCCCNc1ccccn1)C(=O)NCC[C@@H]1CCSC1	ZINC000875082323	ED	On-Demand	Anodyne	SIRT3	42	31
O=C(NCCCNc1ccccn1)C(=O)NCC[C@@H]1CCSC1	ZINC000875082323	ED	On-Demand	Anodyne	SIRT2	44	31
O=C(NCCCNc1ccccn1)C(=O)NCC[C@@H]1CCSC1	ZINC000875082323	ED	On-Demand	Anodyne	SIRT1	44	32
O=C(NCCCNc1ccccn1)C(=O)NCC[C@H]1CCSC1	ZINC000875082325	ED	On-Demand	Anodyne	SIRT3	42	31
O=C(NCCCNc1ccccn1)C(=O)NCC[C@H]1CCSC1	ZINC000875082325	ED	On-Demand	Anodyne	SIRT2	44	31
O=C(NCCCNc1ccccn1)C(=O)NCC[C@H]1CCSC1	ZINC000875082325	ED	On-Demand	Anodyne	SIRT1	44	32
COC(=O)N(C)NC(=O)NCc1cccc(C(=O)NCc2ccc(C)cc2)c1	ZINC000875082358	GE	On-Demand	Reactive	ROCK2	31	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1ccco1	ZINC000875082371	DD	On-Demand	Anodyne	SLC6A4	23	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1ccco1	ZINC000875082371	DD	On-Demand	Anodyne	SLC6A3	49	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1ccco1	ZINC000875082373	DD	On-Demand	Anodyne	SLC6A4	23	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1ccco1	ZINC000875082373	DD	On-Demand	Anodyne	SLC6A3	49	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1ccco1	ZINC000875082374	DD	On-Demand	Anodyne	SLC6A4	23	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1ccco1	ZINC000875082374	DD	On-Demand	Anodyne	SLC6A3	49	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1ccco1	ZINC000875082376	DD	On-Demand	Anodyne	SLC6A4	23	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1ccco1	ZINC000875082376	DD	On-Demand	Anodyne	SLC6A3	49	41
O=C(CCCOc1ccccc1)Oc1ccc(C(F)(F)F)cc1	ZINC000875082377	DI	On-Demand	Anodyne	PPARG	19	44
O=C(CCCOc1ccccc1)Oc1ccc(C(F)(F)F)cc1	ZINC000875082377	DI	On-Demand	Anodyne	PPARA	30	44
O=C(CCCOc1ccccc1)Oc1ccc(C(F)(F)F)cc1	ZINC000875082377	DI	On-Demand	Anodyne	LTA4H	27	41
O=C(CCCOc1ccccc1)Oc1ccc(C(F)(F)F)cc1	ZINC000875082377	DI	On-Demand	Anodyne	PPARD	54	44
O=C(CCCOc1ccccc1)Oc1ccc(C(F)(F)F)cc1	ZINC000875082377	DI	On-Demand	Anodyne	PLA2G4B	78	37
O=C(CCCOc1ccccc1)Oc1ccc(C(F)(F)F)cc1	ZINC000875082377	DI	On-Demand	Anodyne	FAAH	15	44
O=C(CCCOc1ccccc1)Oc1ccc(C(F)(F)F)cc1	ZINC000875082377	DI	On-Demand	Anodyne	FFAR1	19	40
O=C(CCCOc1ccccc1)Oc1ccc(C(F)(F)F)cc1	ZINC000875082377	DI	On-Demand	Anodyne	PDS	31	40
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875082404	GC	On-Demand	Anodyne	HTR1A	38	57
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875082404	GC	On-Demand	Anodyne	DRD2	29	57
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875082404	GC	On-Demand	Anodyne	DRD4	45	38
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875082404	GC	On-Demand	Anodyne	ADRA1D	22	43
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875082404	GC	On-Demand	Anodyne	HTR2A	29	43
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875082404	GC	On-Demand	Anodyne	ADRA1B	21	43
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875082404	GC	On-Demand	Anodyne	DRD3	32	43
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875082404	GC	On-Demand	Anodyne	HTR7	39	40
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875082404	GC	On-Demand	Anodyne	PLD2	70	43
Cc1nnc(NNC(=O)NC[C@@H](c2ccccc2)N2CCOCC2)n1C	ZINC000875082434	FC	On-Demand	Reactive	CASR	42	37
Cc1nnc(NNC(=O)NC[C@H](c2ccccc2)N2CCOCC2)n1C	ZINC000875082435	FC	On-Demand	Reactive	CASR	42	37
COCCOc1ncccc1CNC(=O)N1Cc2cccc(O)c2C1	ZINC000875082441	EE	On-Demand	Clean	NAMPT	20	40
O=C(Oc1ccc(C(F)(F)F)cc1)c1ccc(F)cc1	ZINC000875082442	CI	On-Demand	Anodyne	PRSS1	15	61
O=C(Oc1ccc(C(F)(F)F)cc1)c1ccc(F)cc1	ZINC000875082442	CI	On-Demand	Anodyne	ACR	77	61
COC(=O)N(C)NC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875082471	EC	On-Demand	Reactive	HTR1A	106	54
COC(=O)N(C)NC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875082471	EC	On-Demand	Reactive	DRD2	77	52
COC(=O)N(C)NC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875082471	EC	On-Demand	Reactive	DRD4	63	54
COC(=O)N(C)NC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875082471	EC	On-Demand	Reactive	ADRA1D	43	46
COC(=O)N(C)NC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875082471	EC	On-Demand	Reactive	HTR2A	60	46
COC(=O)N(C)NC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875082471	EC	On-Demand	Reactive	HTR2C	35	44
COC(=O)N(C)NC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875082471	EC	On-Demand	Reactive	SLC6A4	15	41
COC(=O)N(C)NC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875082471	EC	On-Demand	Reactive	ADRA1A	52	46
COC(=O)N(C)NC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875082471	EC	On-Demand	Reactive	ADRA1B	30	46
COC(=O)N(C)NC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875082471	EC	On-Demand	Reactive	DRD3	107	56
COC(=O)N(C)NC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875082471	EC	On-Demand	Reactive	HTR4	21	40
COC(=O)N(C)NC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875082471	EC	On-Demand	Reactive	HTR7	107	46
COC(=O)N(C)NC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875082471	EC	On-Demand	Reactive	SIGMAR1	17	45
Cc1ccc(C(=O)Oc2ccc(C(F)(F)F)cc2)s1	ZINC000875082509	CI	On-Demand	Anodyne	ACR	24	46
CC[C@H](C[C@H](C)O)NC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875082510	ED	On-Demand	Anodyne	HTR1A	64	50
CC[C@H](C[C@H](C)O)NC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875082510	ED	On-Demand	Anodyne	DRD2	48	49
CC[C@H](C[C@H](C)O)NC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875082510	ED	On-Demand	Anodyne	DRD4	48	39
CC[C@H](C[C@H](C)O)NC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875082510	ED	On-Demand	Anodyne	ADRA1D	16	40
CC[C@H](C[C@H](C)O)NC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875082510	ED	On-Demand	Anodyne	HTR2A	42	43
CC[C@H](C[C@H](C)O)NC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875082510	ED	On-Demand	Anodyne	HTR2C	24	40
CC[C@H](C[C@H](C)O)NC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875082510	ED	On-Demand	Anodyne	ADRA1A	18	46
CC[C@H](C[C@H](C)O)NC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875082510	ED	On-Demand	Anodyne	DRD3	64	47
CC[C@H](C[C@H](C)O)NC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875082510	ED	On-Demand	Anodyne	HTR7	64	41
COC(=O)C1(O)CN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875082517	FB	On-Demand	Anodyne	HTR1A	97	53
COC(=O)C1(O)CN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875082517	FB	On-Demand	Anodyne	DRD2	72	50
COC(=O)C1(O)CN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875082517	FB	On-Demand	Anodyne	DRD4	56	53
COC(=O)C1(O)CN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875082517	FB	On-Demand	Anodyne	ADRA1D	55	44
COC(=O)C1(O)CN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875082517	FB	On-Demand	Anodyne	HTR2A	53	44
COC(=O)C1(O)CN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875082517	FB	On-Demand	Anodyne	HTR2C	28	41
COC(=O)C1(O)CN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875082517	FB	On-Demand	Anodyne	ADRA1A	66	42
COC(=O)C1(O)CN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875082517	FB	On-Demand	Anodyne	ADRA1B	48	44
COC(=O)C1(O)CN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875082517	FB	On-Demand	Anodyne	DRD3	90	54
COC(=O)C1(O)CN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875082517	FB	On-Demand	Anodyne	HTR4	23	43
COC(=O)C1(O)CN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875082517	FB	On-Demand	Anodyne	HTR7	98	44
COC(=O)C1(O)CN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875082517	FB	On-Demand	Anodyne	SIGMAR1	20	47
COC(=O)C1(O)CN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875082517	FB	On-Demand	Anodyne	PLD2	45	37
COc1ccc([C@@H]2CCCN2C(=O)COC(=O)c2cc(C(C)=O)c[nH]2)cc1OC	ZINC000875082539	HF	On-Demand	Anodyne	CPT1A	47	35
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NC2CCN(CC3CC3)CC2)c1	ZINC000875082542	FE	On-Demand	Anodyne	SSTR5	35	44
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NC2CCN(CC3CC3)CC2)c1	ZINC000875082543	FE	On-Demand	Anodyne	SSTR5	35	44
COCCOc1ccc(CNC(=O)N2CCCCCCNC(=O)CC2)cc1	ZINC000875082551	GE	On-Demand	Anodyne	HRH3	20	40
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCCc2ccccc21	ZINC000875082554	EE	On-Demand	Anodyne	HTR6	24	41
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCCc2ccccc21	ZINC000875082555	EE	On-Demand	Anodyne	HTR6	24	41
CC(=O)c1c[nH]c(C(=O)O[C@H](C)C(=O)N2c3ccccc3CC[C@@H]2C)c1	ZINC000875082566	FG	On-Demand	Anodyne	TPP2	42	35
CC(=O)c1c[nH]c(C(=O)O[C@@H](C)C(=O)N2c3ccccc3CC[C@@H]2C)c1	ZINC000875082567	FG	On-Demand	Anodyne	TPP2	42	35
CC(=O)c1c[nH]c(C(=O)O[C@@H](C)C(=O)N2c3ccccc3CC[C@H]2C)c1	ZINC000875082568	FG	On-Demand	Anodyne	TPP2	42	35
CC(=O)c1c[nH]c(C(=O)O[C@H](C)C(=O)N2c3ccccc3CC[C@H]2C)c1	ZINC000875082569	FG	On-Demand	Anodyne	TPP2	42	35
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC(C)C)nc1	ZINC000875082600	EE	On-Demand	Anodyne	SLC6A3	50	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC(C)C)nc1	ZINC000875082601	EE	On-Demand	Anodyne	SLC6A3	50	38
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3cccc(C)c3)CC2)C1	ZINC000875082669	GC	On-Demand	Anodyne	HTR1A	93	55
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3cccc(C)c3)CC2)C1	ZINC000875082669	GC	On-Demand	Anodyne	DRD2	70	55
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3cccc(C)c3)CC2)C1	ZINC000875082669	GC	On-Demand	Anodyne	DRD1	15	51
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3cccc(C)c3)CC2)C1	ZINC000875082669	GC	On-Demand	Anodyne	DRD4	48	41
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3cccc(C)c3)CC2)C1	ZINC000875082669	GC	On-Demand	Anodyne	ADRA1D	58	46
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3cccc(C)c3)CC2)C1	ZINC000875082669	GC	On-Demand	Anodyne	HTR2A	73	55
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3cccc(C)c3)CC2)C1	ZINC000875082669	GC	On-Demand	Anodyne	HTR2C	43	53
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3cccc(C)c3)CC2)C1	ZINC000875082669	GC	On-Demand	Anodyne	SLC6A4	18	47
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3cccc(C)c3)CC2)C1	ZINC000875082669	GC	On-Demand	Anodyne	ADRA1A	82	46
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3cccc(C)c3)CC2)C1	ZINC000875082669	GC	On-Demand	Anodyne	ADRA1B	52	46
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3cccc(C)c3)CC2)C1	ZINC000875082669	GC	On-Demand	Anodyne	DRD3	91	53
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3cccc(C)c3)CC2)C1	ZINC000875082669	GC	On-Demand	Anodyne	HTR7	93	45
O=C(Oc1ccc(C(F)(F)F)cc1)[C@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1	ZINC000875082701	HJ	On-Demand	Anodyne	LIPE	20	41
O=C(Oc1ccc(C(F)(F)F)cc1)[C@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1	ZINC000875082701	HJ	On-Demand	Anodyne	MLYCD	19	44
O=C(Oc1ccc(C(F)(F)F)cc1)[C@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1	ZINC000875082701	HJ	On-Demand	Anodyne	SFRP1	22	40
O=C(Oc1ccc(C(F)(F)F)cc1)[C@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1	ZINC000875082701	HJ	On-Demand	Anodyne	L3MBTL3	48	38
O=C(Oc1ccc(C(F)(F)F)cc1)[C@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1	ZINC000875082701	HJ	On-Demand	Anodyne	HPGD	19	40
O=C(Oc1ccc(C(F)(F)F)cc1)C1CCCCC1	ZINC000875082702	CI	On-Demand	Anodyne	LIPE	21	43
O=C(Oc1ccc(C(F)(F)F)cc1)[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1	ZINC000875082717	HJ	On-Demand	Anodyne	LIPE	20	41
O=C(Oc1ccc(C(F)(F)F)cc1)[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1	ZINC000875082717	HJ	On-Demand	Anodyne	MLYCD	19	44
O=C(Oc1ccc(C(F)(F)F)cc1)[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1	ZINC000875082717	HJ	On-Demand	Anodyne	SFRP1	22	40
O=C(Oc1ccc(C(F)(F)F)cc1)[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1	ZINC000875082717	HJ	On-Demand	Anodyne	L3MBTL3	48	38
O=C(Oc1ccc(C(F)(F)F)cc1)[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1	ZINC000875082717	HJ	On-Demand	Anodyne	HPGD	19	40
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1[C@H]2CC[C@H]1CC(F)(F)C2	ZINC000875082723	GE	On-Demand	Anodyne	PLG	53	32
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1[C@H]2CC[C@H]1CC(F)(F)C2	ZINC000875082723	GE	On-Demand	Anodyne	TRYP_PIG	46	32
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1[C@H]2CC[C@H]1CC(F)(F)C2	ZINC000875082723	GE	On-Demand	Anodyne	TMPRSS11D	89	35
NC(=O)c1cnc(NC(=O)[C@@H]2CC[C@H](Cc3ccccc3)O2)s1	ZINC000875082724	ED	On-Demand	Anodyne	CDK5	33	42
O=C(Oc1ccc(C(F)(F)F)cc1)c1ccc2c(c1)OCO2	ZINC000875082727	DH	On-Demand	Anodyne	EDNRA	28	42
O=C(Oc1ccc(C(F)(F)F)cc1)c1ccc2c(c1)OCO2	ZINC000875082727	DH	On-Demand	Anodyne	ACR	61	33
COC(=O)N(C)NC(=O)NC[C@@H](c1ccccc1)N1CCOCC1	ZINC000875082744	EC	On-Demand	Reactive	CASR	45	38
COC(=O)N(C)NC(=O)NC[C@H](c1ccccc1)N1CCOCC1	ZINC000875082746	EC	On-Demand	Reactive	CASR	45	38
CCCCCCCNC(=O)C(=O)N[C@@H]1CCN2CCC[C@H]2C1	ZINC000875082790	DD	On-Demand	Mild	TPP2	20	41
CCCCCCCNC(=O)C(=O)N[C@H]1CCN2CCC[C@H]2C1	ZINC000875082793	DD	On-Demand	Mild	TPP2	20	41
CCCCCCCNC(=O)C(=O)N[C@@H]1CCN2CCC[C@@H]2C1	ZINC000875082794	DD	On-Demand	Mild	TPP2	20	41
CCCCCCCNC(=O)C(=O)N[C@H]1CCN2CCC[C@@H]2C1	ZINC000875082797	DD	On-Demand	Mild	TPP2	20	41
COCCOc1ccc(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)cn1	ZINC000875082807	GE	On-Demand	Anodyne	PDS	56	37
COCCOc1ccc(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)cn1	ZINC000875082809	GE	On-Demand	Anodyne	PDS	56	37
NC(=O)c1cnc(NC(=O)Cc2csc(C3CC3)n2)s1	ZINC000875082815	DD	On-Demand	Anodyne	CDK5	41	41
Cn1nccc1CNC(=O)C(=O)N1CC[C@@H](c2cccc(Cl)c2)C1(C)C	ZINC000875082819	FE	On-Demand	Anodyne	MDM2	42	31
Cn1nccc1CNC(=O)C(=O)N1CC[C@H](c2cccc(Cl)c2)C1(C)C	ZINC000875082820	FE	On-Demand	Anodyne	MDM2	42	31
Cc1nnc(NNC(=O)NCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875082825	FC	On-Demand	Reactive	HTR1A	78	49
Cc1nnc(NNC(=O)NCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875082825	FC	On-Demand	Reactive	DRD2	60	48
Cc1nnc(NNC(=O)NCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875082825	FC	On-Demand	Reactive	DRD4	48	40
Cc1nnc(NNC(=O)NCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875082825	FC	On-Demand	Reactive	ADRA1D	34	43
Cc1nnc(NNC(=O)NCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875082825	FC	On-Demand	Reactive	HTR2A	55	44
Cc1nnc(NNC(=O)NCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875082825	FC	On-Demand	Reactive	HTR2C	33	44
Cc1nnc(NNC(=O)NCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875082825	FC	On-Demand	Reactive	SLC6A4	16	42
Cc1nnc(NNC(=O)NCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875082825	FC	On-Demand	Reactive	ADRA1A	34	43
Cc1nnc(NNC(=O)NCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875082825	FC	On-Demand	Reactive	ADRA1B	21	45
Cc1nnc(NNC(=O)NCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875082825	FC	On-Demand	Reactive	DRD3	79	48
Cc1nnc(NNC(=O)NCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875082825	FC	On-Demand	Reactive	HTR7	71	43
CC(=O)NC[C@@H]1CCCCN1C(=O)N[C@@H](C)Cc1ccco1	ZINC000875082828	DD	On-Demand	Anodyne	HCRTR1	15	40
CC(=O)NC[C@@H]1CCCCN1C(=O)N[C@H](C)Cc1ccco1	ZINC000875082829	DD	On-Demand	Anodyne	HCRTR1	15	40
CC(=O)c1c[nH]c(C(=O)OCC[C@H]2CCCCN2C)c1	ZINC000875082831	CE	On-Demand	Anodyne	CHRNA10	52	33
CC(=O)c1c[nH]c(C(=O)OCC[C@H]2CCCCN2C)c1	ZINC000875082831	CE	On-Demand	Anodyne	ACKR3	69	35
CC(=O)c1c[nH]c(C(=O)OCC[C@@H]2CCCCN2C)c1	ZINC000875082832	CE	On-Demand	Anodyne	CHRNA10	52	33
CC(=O)c1c[nH]c(C(=O)OCC[C@@H]2CCCCN2C)c1	ZINC000875082832	CE	On-Demand	Anodyne	ACKR3	69	35
Cc1ccc(C(=O)CCC(=O)Oc2ccc(C(F)(F)F)cc2)cc1	ZINC000875082867	EJ	On-Demand	Anodyne	LIPE	16	40
Cc1ccc(C(=O)CCC(=O)Oc2ccc(C(F)(F)F)cc2)cc1	ZINC000875082867	EJ	On-Demand	Anodyne	ACR	29	46
O=C(Oc1ccc(C(F)(F)F)cc1)c1ccc([N+](=O)[O-])cc1	ZINC000875082870	DH	On-Demand	Bother	ACR	60	54
CCCCCCCNC(=O)C(=O)NCc1ccnn1C	ZINC000875082893	CD	On-Demand	Mild	ASAH1	98	41
COc1cccc(C(C)(C)C(=O)Nc2ncc(C(N)=O)s2)c1	ZINC000875082905	DE	On-Demand	Anodyne	SCD	30	40
NC(=O)c1cnc(NC(=O)[C@H](Cc2cccnc2)C2CCCC2)s1	ZINC000875082910	EF	On-Demand	Anodyne	C3AR1	41	43
NC(=O)c1cnc(NC(=O)[C@H](Cc2cccnc2)C2CCCC2)s1	ZINC000875082910	EF	On-Demand	Anodyne	CDK5	48	39
NC(=O)c1cnc(NC(=O)[C@@H](Cc2cccnc2)C2CCCC2)s1	ZINC000875082911	EF	On-Demand	Anodyne	C3AR1	41	43
NC(=O)c1cnc(NC(=O)[C@@H](Cc2cccnc2)C2CCCC2)s1	ZINC000875082911	EF	On-Demand	Anodyne	CDK5	48	39
COCCOc1ccc(CNC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875082998	EF	On-Demand	Clean	NAMPT	23	46
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CCCC(F)(F)CC1	ZINC000875083011	GD	On-Demand	Anodyne	TMPRSS11D	61	31
COC(=O)N(C)NC(=O)NCc1ccc(OC(C)C)nc1	ZINC000875083012	CD	On-Demand	Reactive	ACACB	20	45
CCCCCCCNC(=O)C(=O)NCCc1nc(C)cs1	ZINC000875083013	DE	On-Demand	Mild	ASAH1	82	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccnc1OC(C)C	ZINC000875083029	EE	On-Demand	Anodyne	SLC6A3	44	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccnc1OC(C)C	ZINC000875083030	EE	On-Demand	Anodyne	SLC6A3	44	38
Cc1nc(NC(=O)C2(NC(=O)OCc3ccccc3)CC2)nc2c1CCCC2	ZINC000875083056	GG	On-Demand	Anodyne	BCHE	49	32
Cc1nc(NC(=O)C2(NC(=O)OCc3ccccc3)CC2)nc2c1CCCC2	ZINC000875083056	GG	On-Demand	Anodyne	SLC12A5	67	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCCc3ccccc32)C1	ZINC000875083075	EE	On-Demand	Anodyne	HTR6	22	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCCc3ccccc32)C1	ZINC000875083077	EE	On-Demand	Anodyne	HTR6	22	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCCc3ccccc32)C1	ZINC000875083078	EE	On-Demand	Anodyne	HTR6	22	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCCc3ccccc32)C1	ZINC000875083080	EE	On-Demand	Anodyne	HTR6	22	42
O=C(NCc1cccc2ncccc12)C(=O)NC1CCN(CC2CC2)CC1	ZINC000875083103	FD	On-Demand	Anodyne	SIGMAR1	18	45
COC(=O)N(C)NC(=O)NCCCCN1CCN(c2cccc(C)c2)CC1	ZINC000875083113	GD	On-Demand	Reactive	HTR1A	102	57
COC(=O)N(C)NC(=O)NCCCCN1CCN(c2cccc(C)c2)CC1	ZINC000875083113	GD	On-Demand	Reactive	DRD2	77	57
COC(=O)N(C)NC(=O)NCCCCN1CCN(c2cccc(C)c2)CC1	ZINC000875083113	GD	On-Demand	Reactive	DRD1	15	57
COC(=O)N(C)NC(=O)NCCCCN1CCN(c2cccc(C)c2)CC1	ZINC000875083113	GD	On-Demand	Reactive	DRD4	50	43
COC(=O)N(C)NC(=O)NCCCCN1CCN(c2cccc(C)c2)CC1	ZINC000875083113	GD	On-Demand	Reactive	ADRA1D	47	45
COC(=O)N(C)NC(=O)NCCCCN1CCN(c2cccc(C)c2)CC1	ZINC000875083113	GD	On-Demand	Reactive	HTR2A	74	57
COC(=O)N(C)NC(=O)NCCCCN1CCN(c2cccc(C)c2)CC1	ZINC000875083113	GD	On-Demand	Reactive	HTR2C	45	57
COC(=O)N(C)NC(=O)NCCCCN1CCN(c2cccc(C)c2)CC1	ZINC000875083113	GD	On-Demand	Reactive	SLC6A4	20	45
COC(=O)N(C)NC(=O)NCCCCN1CCN(c2cccc(C)c2)CC1	ZINC000875083113	GD	On-Demand	Reactive	ADRA1A	65	45
COC(=O)N(C)NC(=O)NCCCCN1CCN(c2cccc(C)c2)CC1	ZINC000875083113	GD	On-Demand	Reactive	ADRA1B	36	45
COC(=O)N(C)NC(=O)NCCCCN1CCN(c2cccc(C)c2)CC1	ZINC000875083113	GD	On-Demand	Reactive	DRD3	107	57
COC(=O)N(C)NC(=O)NCCCCN1CCN(c2cccc(C)c2)CC1	ZINC000875083113	GD	On-Demand	Reactive	HTR7	98	45
COC(=O)N(C)NC(=O)NCCCCN1CCN(c2cccc(C)c2)CC1	ZINC000875083113	GD	On-Demand	Reactive	NPY1R	15	40
COC(=O)N(C)NC(=O)NCCCCN1CCN(c2cccc(C)c2)CC1	ZINC000875083113	GD	On-Demand	Reactive	CACNA1G	15	40
O=C(Oc1ccc(C(F)(F)F)cc1)[C@H]1CC(=O)N(Cc2ccccc2)C1	ZINC000875083126	FH	On-Demand	Anodyne	LIPE	17	40
O=C(Oc1ccc(C(F)(F)F)cc1)[C@H]1CC(=O)N(Cc2ccccc2)C1	ZINC000875083126	FH	On-Demand	Anodyne	SLC6A5	27	41
O=C(Oc1ccc(C(F)(F)F)cc1)[C@@H]1CC(=O)N(Cc2ccccc2)C1	ZINC000875083127	FH	On-Demand	Anodyne	LIPE	17	40
O=C(Oc1ccc(C(F)(F)F)cc1)[C@@H]1CC(=O)N(Cc2ccccc2)C1	ZINC000875083127	FH	On-Demand	Anodyne	SLC6A5	27	41
Cn1nccc1CNC(=O)C(=O)N1CCC(C)(N2CCCCC2)CC1	ZINC000875083154	EC	On-Demand	Anodyne	CCR5	20	40
COC(=O)c1c(NC(=O)COCc2ccnc(O)c2)sc2c1CCCC2	ZINC000875083162	GF	On-Demand	Anodyne	VIPR1	26	40
Cn1nccc1CNC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875083181	ED	On-Demand	Anodyne	SIGMAR1	18	40
Cn1nccc1CNC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875083181	ED	On-Demand	Anodyne	MTNR1A	21	40
Cn1nccc1CNC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875083181	ED	On-Demand	Anodyne	MTNR1B	23	40
Cn1nccc1CNC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875083181	ED	On-Demand	Anodyne	FAAH	87	40
Cn1nccc1CNC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875083181	ED	On-Demand	Anodyne	CES1	74	38
Cn1nccc1CNC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875083181	ED	On-Demand	Anodyne	AMP1_PLAFQ	27	45
Cn1nccc1CNC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875083181	ED	On-Demand	Anodyne	CES1D	55	35
CC[C@@H](NC(=O)NCc1ccc(OCCOC)nc1)[C@H](O)c1ccccc1	ZINC000875083187	FE	On-Demand	Anodyne	TACR3	40	36
CC[C@@H](NC(=O)NCc1ccc(OCCOC)nc1)[C@@H](O)c1ccccc1	ZINC000875083189	FE	On-Demand	Anodyne	TACR3	40	36
CCC1(CC)CCCN1C(=O)NCc1ccc(OCCOC)nc1	ZINC000875083200	EF	On-Demand	Anodyne	SLC12A5	48	34
COC(=O)[C@@]12C[C@@H](NC(=O)NCCN3CCN(c4ccccc4)CC3)C[C@@H]1C2	ZINC000875083210	GD	On-Demand	Anodyne	HTR1A	62	48
COC(=O)[C@@]12C[C@@H](NC(=O)NCCN3CCN(c4ccccc4)CC3)C[C@@H]1C2	ZINC000875083210	GD	On-Demand	Anodyne	DRD2	48	45
COC(=O)[C@@]12C[C@@H](NC(=O)NCCN3CCN(c4ccccc4)CC3)C[C@@H]1C2	ZINC000875083210	GD	On-Demand	Anodyne	DRD4	50	40
COC(=O)[C@@]12C[C@@H](NC(=O)NCCN3CCN(c4ccccc4)CC3)C[C@@H]1C2	ZINC000875083210	GD	On-Demand	Anodyne	ADRA1D	28	40
COC(=O)[C@@]12C[C@@H](NC(=O)NCCN3CCN(c4ccccc4)CC3)C[C@@H]1C2	ZINC000875083210	GD	On-Demand	Anodyne	ADRA1A	35	40
COC(=O)[C@@]12C[C@@H](NC(=O)NCCN3CCN(c4ccccc4)CC3)C[C@@H]1C2	ZINC000875083210	GD	On-Demand	Anodyne	ADRA1B	24	40
COC(=O)[C@@]12C[C@@H](NC(=O)NCCN3CCN(c4ccccc4)CC3)C[C@@H]1C2	ZINC000875083210	GD	On-Demand	Anodyne	DRD3	67	52
COC(=O)[C@@]12C[C@@H](NC(=O)NCCN3CCN(c4ccccc4)CC3)C[C@@H]1C2	ZINC000875083210	GD	On-Demand	Anodyne	HTR7	58	41
O=C(Cc1cccs1)Oc1ccc(C(F)(F)F)cc1	ZINC000875083211	CH	On-Demand	Anodyne	PPARD	18	41
COCCOc1ncccc1CNC(=O)N(C)OCC(F)(F)F	ZINC000875083221	ED	On-Demand	Anodyne	SCN10A	15	45
O=C(NCCSC(F)(F)F)C(=O)NCc1ccc2cccnc2c1	ZINC000875083237	FE	On-Demand	Anodyne	SUCNR1	55	36
C[C@H](CNC(=O)N1CCC(CO)(CO)CC1)N1CCN(c2ccccc2)CC1	ZINC000875083241	GC	On-Demand	Anodyne	HCN1	23	42
C[C@@H](CNC(=O)N1CCC(CO)(CO)CC1)N1CCN(c2ccccc2)CC1	ZINC000875083247	GC	On-Demand	Anodyne	HCN1	23	42
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)Cc1cccs1	ZINC000875083249	CF	On-Demand	Anodyne	CTSC	39	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)Cc1cccs1	ZINC000875083254	CF	On-Demand	Anodyne	CTSC	39	41
O=C(Oc1ccc(C(F)(F)F)cc1)c1cccc([N+](=O)[O-])c1	ZINC000875083258	DH	On-Demand	Bother	CACNA1C	41	38
O=C(Oc1ccc(C(F)(F)F)cc1)c1cccc([N+](=O)[O-])c1	ZINC000875083258	DH	On-Demand	Bother	CACNA1D	68	38
O=C(Oc1ccc(C(F)(F)F)cc1)c1cccc([N+](=O)[O-])c1	ZINC000875083258	DH	On-Demand	Bother	ACR	26	44
O=C(Oc1ccc(C(F)(F)F)cc1)c1cccc([N+](=O)[O-])c1	ZINC000875083258	DH	On-Demand	Bother	AKR1C3	19	41
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccnn3C)CC2)c(OC)c1	ZINC000875083319	GC	On-Demand	Clean	HTR1A	41	39
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccnn3C)CC2)c(OC)c1	ZINC000875083319	GC	On-Demand	Clean	DRD2	35	41
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccnn3C)CC2)c(OC)c1	ZINC000875083319	GC	On-Demand	Clean	DRD4	42	33
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccnn3C)CC2)c(OC)c1	ZINC000875083319	GC	On-Demand	Clean	DRD3	53	38
NC(=O)c1cnc(NC(=O)Cc2csc(C3CCCC3)n2)s1	ZINC000875083338	EF	On-Demand	Anodyne	CDK5	55	47
O=C(NCCNS(=O)(=O)Cc1ccccc1)N(C1CC1)C1CC1	ZINC000875083347	ED	On-Demand	Anodyne	TMPRSS11D	91	35
O=C(Nc1nccc(-c2ccccc2)n1)C1(F)CCOCC1	ZINC000875083413	DF	On-Demand	Anodyne	JAK2	17	46
O=C(Nc1nccc(-c2ccccc2)n1)C1(F)CCOCC1	ZINC000875083413	DF	On-Demand	Anodyne	MAPK1	56	38
O=C(Nc1nccc(-c2ccccc2)n1)C1(F)CCOCC1	ZINC000875083413	DF	On-Demand	Anodyne	CAMK2D	27	43
O=C(Nc1nccc(-c2ccccc2)n1)C1(F)CCOCC1	ZINC000875083413	DF	On-Demand	Anodyne	SMG1	43	34
O=C(Oc1ccc(C(F)(F)F)cc1)c1ccc(Br)o1	ZINC000875083414	EI	On-Demand	Anodyne	ACR	16	43
O=C(NC1CCN(CC2CC2)CC1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875083449	GE	On-Demand	Anodyne	OXTR	45	36
O=C(NC1CCN(CC2CC2)CC1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875083449	GE	On-Demand	Anodyne	SIGMAR1	28	52
O=C(NC1CCN(CC2CC2)CC1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875083450	GE	On-Demand	Anodyne	OXTR	45	36
O=C(NC1CCN(CC2CC2)CC1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875083450	GE	On-Demand	Anodyne	SIGMAR1	28	52
O=C(NC[C@@H]1CCCc2ccccc21)C(=O)N1CCC(CO)(CO)CC1	ZINC000875083456	FC	On-Demand	Anodyne	HTR6	25	44
O=C(NC[C@H]1CCCc2ccccc21)C(=O)N1CCC(CO)(CO)CC1	ZINC000875083457	FC	On-Demand	Anodyne	HTR6	25	44
CCOc1ccc(C(=O)CCC(=O)Oc2ccc(C(F)(F)F)cc2)cc1	ZINC000875083459	FJ	On-Demand	Anodyne	PPARD	40	42
CCOc1ccc(C(=O)CCC(=O)Oc2ccc(C(F)(F)F)cc2)cc1	ZINC000875083459	FJ	On-Demand	Anodyne	ACR	28	44
COCCOc1ccc(CNC(=O)NNc2cccc(C)n2)cc1	ZINC000875083488	EE	On-Demand	Reactive	GRM5	18	40
CCCCCOc1ccc([C@H](C)NC(=O)N2CCCN(C=O)CC2)cc1OC	ZINC000875083505	GG	On-Demand	Anodyne	P2RY12	69	33
CCCCCOc1ccc([C@@H](C)NC(=O)N2CCCN(C=O)CC2)cc1OC	ZINC000875083506	GG	On-Demand	Anodyne	P2RY12	69	33
COCCOc1ccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875083510	FD	On-Demand	Anodyne	DRD4	20	41
COCCOc1ccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875083510	FD	On-Demand	Anodyne	LTA4H	24	47
COCCOc1ccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875083510	FD	On-Demand	Anodyne	CCR3	19	45
COCCOc1ccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875083510	FD	On-Demand	Anodyne	UTS2R	20	44
COCCOc1ccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875083510	FD	On-Demand	Anodyne	SLC6A5	38	42
COCCOc1ccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875083510	FD	On-Demand	Anodyne	MCHR1	19	47
O=C(NC[C@H]1CCCc2ccccc21)C(=O)N[C@@H]1CC12CCC2	ZINC000875083516	DE	On-Demand	Anodyne	HTR6	24	41
O=C(NC[C@@H]1CCCc2ccccc21)C(=O)N[C@@H]1CC12CCC2	ZINC000875083517	DE	On-Demand	Anodyne	HTR6	24	41
O=C(NC[C@@H]1CCCc2ccccc21)C(=O)N[C@H]1CC12CCC2	ZINC000875083518	DE	On-Demand	Anodyne	HTR6	24	41
O=C(NC[C@H]1CCCc2ccccc21)C(=O)N[C@H]1CC12CCC2	ZINC000875083519	DE	On-Demand	Anodyne	HTR6	24	41
COCCOc1ccc(CNC(=O)N2CCC3(CCN(C)CC3)CC2)cc1	ZINC000875083520	GF	On-Demand	Anodyne	HRH3	17	45
COCCOc1ccc(CNC(=O)N2CCC3(CCN(C)CC3)CC2)cc1	ZINC000875083520	GF	On-Demand	Anodyne	MMP13	21	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(OCCOC)c1	ZINC000875083521	DE	On-Demand	Anodyne	HRH2	24	45
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(OCCOC)c1	ZINC000875083521	DE	On-Demand	Anodyne	ANPEP	18	51
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(OCCOC)c1	ZINC000875083521	DE	On-Demand	Anodyne	ROCK2	29	49
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(OCCOC)c1	ZINC000875083521	DE	On-Demand	Anodyne	PDS	96	43
COCCOc1ccc(CNC(=O)NC2CC(C(=O)OC)C2)cc1	ZINC000875083532	ED	On-Demand	Anodyne	EPHX2	20	40
COCCOc1ccc(CNC(=O)N2C[C@@H]3C[C@H]2CN3c2ccccc2)cc1	ZINC000875083533	GF	On-Demand	Anodyne	LTA4H	29	41
COCCOc1ccc(CNC(=O)N2C[C@@H]3C[C@H]2CN3c2ccccc2)cc1	ZINC000875083533	GF	On-Demand	Anodyne	CYSLTR2	43	34
CCOC(=O)[C@H](C)C1CN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875083545	GD	On-Demand	Anodyne	HTR1A	73	47
CCOC(=O)[C@H](C)C1CN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875083545	GD	On-Demand	Anodyne	DRD2	52	46
CCOC(=O)[C@H](C)C1CN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875083545	GD	On-Demand	Anodyne	DRD4	48	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875083545	GD	On-Demand	Anodyne	ADRA1D	34	48
CCOC(=O)[C@H](C)C1CN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875083545	GD	On-Demand	Anodyne	HTR2A	50	44
CCOC(=O)[C@H](C)C1CN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875083545	GD	On-Demand	Anodyne	HTR2C	32	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875083545	GD	On-Demand	Anodyne	SLC6A4	16	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875083545	GD	On-Demand	Anodyne	ADRA1A	49	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875083545	GD	On-Demand	Anodyne	ADRA1B	30	48
CCOC(=O)[C@H](C)C1CN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875083545	GD	On-Demand	Anodyne	DRD3	66	48
CCOC(=O)[C@H](C)C1CN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875083545	GD	On-Demand	Anodyne	HTR4	28	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875083545	GD	On-Demand	Anodyne	P2RY12	43	36
CCOC(=O)[C@H](C)C1CN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000875083545	GD	On-Demand	Anodyne	HTR7	69	41
Cc1ccsc1C(=O)Oc1ccc(C(F)(F)F)cc1	ZINC000875083550	CI	On-Demand	Anodyne	ACR	23	42
O=CN1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875083570	FC	On-Demand	Anodyne	HTR1A	72	52
O=CN1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875083570	FC	On-Demand	Anodyne	DRD2	53	52
O=CN1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875083570	FC	On-Demand	Anodyne	DRD4	47	38
O=CN1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875083570	FC	On-Demand	Anodyne	HTR2A	44	46
O=CN1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875083570	FC	On-Demand	Anodyne	HTR2C	20	42
O=CN1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875083570	FC	On-Demand	Anodyne	ADRA1A	15	43
O=CN1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875083570	FC	On-Demand	Anodyne	DRD3	66	47
O=CN1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875083570	FC	On-Demand	Anodyne	HTR7	76	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875083591	GD	On-Demand	Anodyne	HTR1A	82	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875083591	GD	On-Demand	Anodyne	DRD2	61	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875083591	GD	On-Demand	Anodyne	DRD4	50	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875083591	GD	On-Demand	Anodyne	ADRA1D	33	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875083591	GD	On-Demand	Anodyne	HTR2A	48	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875083591	GD	On-Demand	Anodyne	SLC6A4	36	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875083591	GD	On-Demand	Anodyne	ADRA1A	43	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875083591	GD	On-Demand	Anodyne	ADRA1B	27	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875083591	GD	On-Demand	Anodyne	DRD3	79	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875083591	GD	On-Demand	Anodyne	SLC6A3	53	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875083591	GD	On-Demand	Anodyne	HTR4	30	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875083591	GD	On-Demand	Anodyne	HTR7	70	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875083591	GD	On-Demand	Anodyne	SIGMAR1	16	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875083591	GD	On-Demand	Anodyne	PLD1	46	35
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000875083591	GD	On-Demand	Anodyne	PLD2	45	35
Cc1nnc(NNC(=O)NCCN2CCN(c3ccc(F)cc3)CC2)n1C	ZINC000875083595	GC	On-Demand	Reactive	HTR1A	38	49
Cc1nnc(NNC(=O)NCCN2CCN(c3ccc(F)cc3)CC2)n1C	ZINC000875083595	GC	On-Demand	Reactive	DRD2	31	49
Cc1nnc(NNC(=O)NCCN2CCN(c3ccc(F)cc3)CC2)n1C	ZINC000875083595	GC	On-Demand	Reactive	DRD4	45	39
Cc1nnc(NNC(=O)NCCN2CCN(c3ccc(F)cc3)CC2)n1C	ZINC000875083595	GC	On-Demand	Reactive	HTR2A	30	44
Cc1nnc(NNC(=O)NCCN2CCN(c3ccc(F)cc3)CC2)n1C	ZINC000875083595	GC	On-Demand	Reactive	HTR2C	18	44
Cc1nnc(NNC(=O)NCCN2CCN(c3ccc(F)cc3)CC2)n1C	ZINC000875083595	GC	On-Demand	Reactive	DRD3	41	41
Cc1nnc(NNC(=O)NCCN2CCN(c3ccc(F)cc3)CC2)n1C	ZINC000875083595	GC	On-Demand	Reactive	CCR3	53	36
Cc1nnc(NNC(=O)NCCN2CCN(c3ccc(F)cc3)CC2)n1C	ZINC000875083595	GC	On-Demand	Reactive	PLD2	43	32
Cc1nnc(NNC(=O)NCCN2CCN(c3ccc(F)cc3)CC2)n1C	ZINC000875083595	GC	On-Demand	Reactive	SLC27A1	29	40
O=C(NCCSC(F)(F)F)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875083596	GE	On-Demand	Anodyne	ROCK1	21	41
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCN2CCC[C@H]2C1	ZINC000875083622	FF	On-Demand	Anodyne	ACE	40	42
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCN2CCC[C@H]2C1	ZINC000875083622	FF	On-Demand	Anodyne	FKBP1A	35	44
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCN2CCC[C@H]2C1	ZINC000875083622	FF	On-Demand	Anodyne	SIGMAR1	32	40
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCN2CCC[C@H]2C1	ZINC000875083622	FF	On-Demand	Anodyne	PREP	62	38
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCN2CCC[C@H]2C1	ZINC000875083622	FF	On-Demand	Anodyne	MC5R	28	41
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCN2CCC[C@H]2C1	ZINC000875083622	FF	On-Demand	Anodyne	FAAH	16	41
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCN2CCC[C@H]2C1	ZINC000875083622	FF	On-Demand	Anodyne	AMP1_PLAFQ	18	40
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCN2CCC[C@H]2C1	ZINC000875083622	FF	On-Demand	Anodyne	L3MBTL3	44	32
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCN2CCC[C@H]2C1	ZINC000875083623	FF	On-Demand	Anodyne	ACE	40	42
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCN2CCC[C@H]2C1	ZINC000875083623	FF	On-Demand	Anodyne	FKBP1A	35	44
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCN2CCC[C@H]2C1	ZINC000875083623	FF	On-Demand	Anodyne	SIGMAR1	32	40
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCN2CCC[C@H]2C1	ZINC000875083623	FF	On-Demand	Anodyne	PREP	62	38
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCN2CCC[C@H]2C1	ZINC000875083623	FF	On-Demand	Anodyne	MC5R	28	41
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCN2CCC[C@H]2C1	ZINC000875083623	FF	On-Demand	Anodyne	FAAH	16	41
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCN2CCC[C@H]2C1	ZINC000875083623	FF	On-Demand	Anodyne	AMP1_PLAFQ	18	40
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCN2CCC[C@H]2C1	ZINC000875083623	FF	On-Demand	Anodyne	L3MBTL3	44	32
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCN2CCC[C@@H]2C1	ZINC000875083624	FF	On-Demand	Anodyne	ACE	40	42
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCN2CCC[C@@H]2C1	ZINC000875083624	FF	On-Demand	Anodyne	FKBP1A	35	44
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCN2CCC[C@@H]2C1	ZINC000875083624	FF	On-Demand	Anodyne	SIGMAR1	32	40
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCN2CCC[C@@H]2C1	ZINC000875083624	FF	On-Demand	Anodyne	PREP	62	38
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCN2CCC[C@@H]2C1	ZINC000875083624	FF	On-Demand	Anodyne	MC5R	28	41
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCN2CCC[C@@H]2C1	ZINC000875083624	FF	On-Demand	Anodyne	FAAH	16	41
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCN2CCC[C@@H]2C1	ZINC000875083624	FF	On-Demand	Anodyne	AMP1_PLAFQ	18	40
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCN2CCC[C@@H]2C1	ZINC000875083624	FF	On-Demand	Anodyne	L3MBTL3	44	32
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCN2CCC[C@@H]2C1	ZINC000875083625	FF	On-Demand	Anodyne	ACE	40	42
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCN2CCC[C@@H]2C1	ZINC000875083625	FF	On-Demand	Anodyne	FKBP1A	35	44
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCN2CCC[C@@H]2C1	ZINC000875083625	FF	On-Demand	Anodyne	SIGMAR1	32	40
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCN2CCC[C@@H]2C1	ZINC000875083625	FF	On-Demand	Anodyne	PREP	62	38
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCN2CCC[C@@H]2C1	ZINC000875083625	FF	On-Demand	Anodyne	MC5R	28	41
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCN2CCC[C@@H]2C1	ZINC000875083625	FF	On-Demand	Anodyne	FAAH	16	41
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCN2CCC[C@@H]2C1	ZINC000875083625	FF	On-Demand	Anodyne	AMP1_PLAFQ	18	40
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCN2CCC[C@@H]2C1	ZINC000875083625	FF	On-Demand	Anodyne	L3MBTL3	44	32
C=CC[C@H]1CCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000875083638	FD	On-Demand	Mild	F2	20	40
C=CC[C@H]1CCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000875083638	FD	On-Demand	Mild	PRSS1	19	40
C=CC[C@H]1CCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000875083638	FD	On-Demand	Mild	TGM2	43	41
C=CC[C@H]1CCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000875083638	FD	On-Demand	Mild	F13A1	32	41
C=CC[C@H]1CCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000875083638	FD	On-Demand	Mild	TMPRSS11D	91	34
C=CC[C@@H]1CCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000875083639	FD	On-Demand	Mild	F2	20	40
C=CC[C@@H]1CCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000875083639	FD	On-Demand	Mild	PRSS1	19	40
C=CC[C@@H]1CCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000875083639	FD	On-Demand	Mild	TGM2	43	41
C=CC[C@@H]1CCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000875083639	FD	On-Demand	Mild	F13A1	32	41
C=CC[C@@H]1CCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000875083639	FD	On-Demand	Mild	TMPRSS11D	91	34
O=C(NC1CCN(CC2CC2)CC1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875083684	GE	On-Demand	Anodyne	CHRNA7	42	35
O=C(NC1CCN(CC2CC2)CC1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875083684	GE	On-Demand	Anodyne	C3AR1	49	48
O=C(NC1CCN(CC2CC2)CC1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875083685	GE	On-Demand	Anodyne	CHRNA7	42	35
O=C(NC1CCN(CC2CC2)CC1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875083685	GE	On-Demand	Anodyne	C3AR1	49	48
COCCOc1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875083693	GG	On-Demand	Anodyne	F2	34	41
COCCOc1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875083693	GG	On-Demand	Anodyne	FKBP1A	42	36
COCCOc1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875083693	GG	On-Demand	Anodyne	LTA4H	53	44
COCCOc1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875083693	GG	On-Demand	Anodyne	HRH3	24	51
COCCOc1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875083693	GG	On-Demand	Anodyne	TRY1_BOVIN	40	41
COCCOc1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875083693	GG	On-Demand	Anodyne	ADAM17	19	41
COCCOc1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875083693	GG	On-Demand	Anodyne	CPT1A	54	35
COCCOc1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875083693	GG	On-Demand	Anodyne	PREP	43	45
COCCOc1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875083693	GG	On-Demand	Anodyne	TMPRSS11D	64	35
COCCOc1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875083696	GG	On-Demand	Anodyne	F2	34	41
COCCOc1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875083696	GG	On-Demand	Anodyne	FKBP1A	42	36
COCCOc1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875083696	GG	On-Demand	Anodyne	LTA4H	53	44
COCCOc1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875083696	GG	On-Demand	Anodyne	HRH3	24	51
COCCOc1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875083696	GG	On-Demand	Anodyne	TRY1_BOVIN	40	41
COCCOc1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875083696	GG	On-Demand	Anodyne	ADAM17	19	41
COCCOc1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875083696	GG	On-Demand	Anodyne	CPT1A	54	35
COCCOc1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875083696	GG	On-Demand	Anodyne	PREP	43	45
COCCOc1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875083696	GG	On-Demand	Anodyne	TMPRSS11D	64	35
COCCOc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875083698	GG	On-Demand	Anodyne	F2	34	41
COCCOc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875083698	GG	On-Demand	Anodyne	FKBP1A	42	36
COCCOc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875083698	GG	On-Demand	Anodyne	LTA4H	53	44
COCCOc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875083698	GG	On-Demand	Anodyne	HRH3	24	51
COCCOc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875083698	GG	On-Demand	Anodyne	TRY1_BOVIN	40	41
COCCOc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875083698	GG	On-Demand	Anodyne	ADAM17	19	41
COCCOc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875083698	GG	On-Demand	Anodyne	CPT1A	54	35
COCCOc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875083698	GG	On-Demand	Anodyne	PREP	43	45
COCCOc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875083698	GG	On-Demand	Anodyne	TMPRSS11D	64	35
COCCOc1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875083699	GG	On-Demand	Anodyne	F2	34	41
COCCOc1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875083699	GG	On-Demand	Anodyne	FKBP1A	42	36
COCCOc1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875083699	GG	On-Demand	Anodyne	LTA4H	53	44
COCCOc1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875083699	GG	On-Demand	Anodyne	HRH3	24	51
COCCOc1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875083699	GG	On-Demand	Anodyne	TRY1_BOVIN	40	41
COCCOc1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875083699	GG	On-Demand	Anodyne	ADAM17	19	41
COCCOc1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875083699	GG	On-Demand	Anodyne	CPT1A	54	35
COCCOc1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875083699	GG	On-Demand	Anodyne	PREP	43	45
COCCOc1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875083699	GG	On-Demand	Anodyne	TMPRSS11D	64	35
O=C(NCC1(c2cccc(Cl)c2)CCC1)C(=O)N[C@@H]1CCN2CCC[C@H]2C1	ZINC000875083710	GF	On-Demand	Anodyne	MCHR1	17	44
O=C(NCC1(c2cccc(Cl)c2)CCC1)C(=O)N[C@@H]1CCN2CCC[C@@H]2C1	ZINC000875083711	GF	On-Demand	Anodyne	MCHR1	17	44
O=C(NCC1(c2cccc(Cl)c2)CCC1)C(=O)N[C@H]1CCN2CCC[C@H]2C1	ZINC000875083712	GF	On-Demand	Anodyne	MCHR1	17	44
O=C(NCC1(c2cccc(Cl)c2)CCC1)C(=O)N[C@H]1CCN2CCC[C@@H]2C1	ZINC000875083713	GF	On-Demand	Anodyne	MCHR1	17	44
COCCOc1ccc(CNC(=O)N2Cc3cccnc3N3CCC[C@H]3C2)cc1	ZINC000875083715	GF	On-Demand	Anodyne	NAMPT	24	41
O=C(NCCCNc1ccccn1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875083736	ED	On-Demand	Anodyne	GRIN2B	15	40
O=C(NCCCNc1ccccn1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875083738	ED	On-Demand	Anodyne	GRIN2B	15	40
O=C(NCCCNc1ccccn1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875083740	ED	On-Demand	Anodyne	GRIN2B	15	40
O=C(NCCCNc1ccccn1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875083742	ED	On-Demand	Anodyne	GRIN2B	15	40
CCCCCCCNC(=O)C(=O)NC1CCN(c2ccccn2)CC1	ZINC000875083744	EE	On-Demand	Mild	HTR1A	24	47
CCCCCCCNC(=O)C(=O)NC1CCN(c2ccccn2)CC1	ZINC000875083744	EE	On-Demand	Mild	DRD2	26	49
CCCCCCCNC(=O)C(=O)NC1CCN(c2ccccn2)CC1	ZINC000875083744	EE	On-Demand	Mild	DRD4	37	41
CCCCCCCNC(=O)C(=O)NC1CCN(c2ccccn2)CC1	ZINC000875083744	EE	On-Demand	Mild	DRD3	31	46
CCCCCCCNC(=O)C(=O)NC1CCN(c2ccccn2)CC1	ZINC000875083744	EE	On-Demand	Mild	EPHX2	22	44
CCCCCCCNC(=O)C(=O)NC1CCN(c2ccccn2)CC1	ZINC000875083744	EE	On-Demand	Mild	SIRT3	42	32
CCCCCCCNC(=O)C(=O)NC1CCN(c2ccccn2)CC1	ZINC000875083744	EE	On-Demand	Mild	SIRT2	43	31
CCCCCCCNC(=O)C(=O)NC1CCN(c2ccccn2)CC1	ZINC000875083744	EE	On-Demand	Mild	SIRT1	44	32
CCCCCCCNC(=O)C(=O)NC1CCN(c2ccccn2)CC1	ZINC000875083744	EE	On-Demand	Mild	TYRO3	18	41
CCCCCCCNC(=O)C(=O)NC1CCN(c2ccccn2)CC1	ZINC000875083744	EE	On-Demand	Mild	MERTK	24	41
CCCCCCCNC(=O)C(=O)NC1CCN(c2ccccn2)CC1	ZINC000875083744	EE	On-Demand	Mild	ASAH1	66	33
O=C(CC1CCCC1)Oc1ccc(C(F)(F)F)cc1	ZINC000875083754	CI	On-Demand	Anodyne	PPARD	17	40
O=C(CC1CCCC1)Oc1ccc(C(F)(F)F)cc1	ZINC000875083754	CI	On-Demand	Anodyne	LIPE	16	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCNc2ccccn2)C1	ZINC000875083786	EC	On-Demand	Anodyne	TBK1	43	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCNc2ccccn2)C1	ZINC000875083787	EC	On-Demand	Anodyne	TBK1	43	32
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1ccc(-c2ccccc2)o1	ZINC000875083836	FE	On-Demand	Mild	NPPA	40	39
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1ccc(-c2ccccc2)o1	ZINC000875083837	FE	On-Demand	Mild	NPPA	40	39
COC(=O)N(C)NC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000875083841	FC	On-Demand	Reactive	HTR1A	59	55
COC(=O)N(C)NC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000875083841	FC	On-Demand	Reactive	DRD2	51	53
COC(=O)N(C)NC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000875083841	FC	On-Demand	Reactive	DRD1	18	42
COC(=O)N(C)NC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000875083841	FC	On-Demand	Reactive	DRD4	52	44
COC(=O)N(C)NC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000875083841	FC	On-Demand	Reactive	HTR2A	38	45
COC(=O)N(C)NC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000875083841	FC	On-Demand	Reactive	HTR2C	20	44
COC(=O)N(C)NC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000875083841	FC	On-Demand	Reactive	DRD3	70	44
COC(=O)N(C)NC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000875083841	FC	On-Demand	Reactive	HTR7	55	45
COC(=O)N(C)NC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000875083841	FC	On-Demand	Reactive	PLD2	59	36
O=C(NCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875083842	FE	On-Demand	Clean	HTR1A	78	55
O=C(NCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875083842	FE	On-Demand	Clean	DRD2	59	53
O=C(NCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875083842	FE	On-Demand	Clean	DRD4	54	44
O=C(NCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875083842	FE	On-Demand	Clean	HTR2A	47	50
O=C(NCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875083842	FE	On-Demand	Clean	HTR2C	25	43
O=C(NCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875083842	FE	On-Demand	Clean	ADRA1A	15	42
O=C(NCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875083842	FE	On-Demand	Clean	DRD3	84	53
O=C(NCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875083842	FE	On-Demand	Clean	DRD5	19	46
O=C(NCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875083842	FE	On-Demand	Clean	HTR7	77	47
O=C(NCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875083842	FE	On-Demand	Clean	PLD2	43	36
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(-c3ccccc3)o2)C1	ZINC000875083872	FE	On-Demand	Anodyne	SLC6A1	48	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(-c3ccccc3)o2)C1	ZINC000875083873	FE	On-Demand	Anodyne	SLC6A1	48	32
Cn1nccc1CNC(=O)C(=O)NCc1ccc(OC(F)F)cc1F	ZINC000875083874	FD	On-Demand	Anodyne	P2RX7	18	47
Cn1nccc1CNC(=O)C(=O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000875083877	FE	On-Demand	Anodyne	P2RX7	20	43
CC[C@@H]1COCCN1CCNC(=O)NCc1cccc(OCCOC)c1	ZINC000875083879	FD	On-Demand	Anodyne	DRD4	40	32
CC[C@@H]1COCCN1CCNC(=O)NCc1cccc(OCCOC)c1	ZINC000875083879	FD	On-Demand	Anodyne	HRH2	38	44
COc1cccc(C(=O)Oc2ccc(C(F)(F)F)cc2)c1	ZINC000875083895	CH	On-Demand	Anodyne	SRD5A1	15	49
COc1cccc(C(=O)Oc2ccc(C(F)(F)F)cc2)c1	ZINC000875083895	CH	On-Demand	Anodyne	DRD4	42	32
COc1cccc(C(=O)Oc2ccc(C(F)(F)F)cc2)c1	ZINC000875083895	CH	On-Demand	Anodyne	TUBB2B	33	42
COc1cccc(C(=O)Oc2ccc(C(F)(F)F)cc2)c1	ZINC000875083895	CH	On-Demand	Anodyne	ACR	64	47
COc1cccc(C(=O)Oc2ccc(C(F)(F)F)cc2)c1	ZINC000875083895	CH	On-Demand	Anodyne	TAAR1	21	41
COc1cccc(C(=O)Oc2ccc(C(F)(F)F)cc2)c1	ZINC000875083895	CH	On-Demand	Anodyne	AKR1C3	29	43
COc1cccc(C(=O)Oc2ccc(C(F)(F)F)cc2)c1	ZINC000875083895	CH	On-Demand	Anodyne	AKR1C2	23	43
COc1cccc(C(=O)Oc2ccc(C(F)(F)F)cc2)c1	ZINC000875083895	CH	On-Demand	Anodyne	KCNK3	20	45
COc1cccc(C(=O)Oc2ccc(C(F)(F)F)cc2)c1	ZINC000875083895	CH	On-Demand	Anodyne	CYSP_PLAFA	15	50
CCCCCCCNC(=O)C(=O)N[C@H]1CCCc2occc21	ZINC000875083978	DF	On-Demand	Mild	LASR	44	32
CCCCCCCNC(=O)C(=O)N[C@@H]1CCCc2occc21	ZINC000875083979	DF	On-Demand	Mild	LASR	44	32
CN1CCN(C2CCN(C(=O)C(=O)N[C@H]3CCCc4occc43)CC2)CC1	ZINC000875083989	FD	On-Demand	Anodyne	L3MBTL3	66	41
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3CCCc4occc43)CC2)CC1	ZINC000875083990	FD	On-Demand	Anodyne	L3MBTL3	66	41
CCCCCCCNC(=O)C(=O)N[C@@H]1CCc2n[nH]cc2C1	ZINC000875083995	DD	On-Demand	Mild	ASAH1	47	31
CCCCCCCNC(=O)C(=O)N[C@H]1CCc2n[nH]cc2C1	ZINC000875083996	DD	On-Demand	Mild	ASAH1	47	31
Cn1nccc1CNC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875083997	FC	On-Demand	Anodyne	NPY2R	52	35
O=C(Oc1ccc(C(F)(F)F)cc1)c1ccccc1F	ZINC000875084021	CI	On-Demand	Anodyne	ACR	16	45
Nc1ccc(C(=O)Oc2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-]	ZINC000875084028	EG	On-Demand	Bother	ACR	53	31
Cn1nccc1CNC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875084031	FD	On-Demand	Anodyne	C3AR1	40	40
Cn1nccc1CNC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875084032	FD	On-Demand	Anodyne	C3AR1	40	40
O=C(NCCN1CCN(c2ccccc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875084033	GE	On-Demand	Anodyne	HTR1A	60	48
O=C(NCCN1CCN(c2ccccc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875084033	GE	On-Demand	Anodyne	DRD2	43	48
O=C(NCCN1CCN(c2ccccc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875084033	GE	On-Demand	Anodyne	DRD4	45	36
O=C(NCCN1CCN(c2ccccc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875084033	GE	On-Demand	Anodyne	HTR2A	41	44
O=C(NCCN1CCN(c2ccccc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875084033	GE	On-Demand	Anodyne	HTR2C	17	42
O=C(NCCN1CCN(c2ccccc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875084033	GE	On-Demand	Anodyne	ADRA1A	15	41
O=C(NCCN1CCN(c2ccccc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875084033	GE	On-Demand	Anodyne	DRD3	53	47
O=C(NCCN1CCN(c2ccccc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875084033	GE	On-Demand	Anodyne	HTR4	19	42
O=C(NCCN1CCN(c2ccccc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875084033	GE	On-Demand	Anodyne	HTR7	56	41
O=C(NCCN1CCN(c2ccccc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875084033	GE	On-Demand	Anodyne	PLD1	42	35
O=C(NCCN1CCN(c2ccccc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875084033	GE	On-Demand	Anodyne	PLD2	43	35
O=C(NCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875084041	EC	On-Demand	Anodyne	HTR1A	74	53
O=C(NCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875084041	EC	On-Demand	Anodyne	DRD2	58	53
O=C(NCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875084041	EC	On-Demand	Anodyne	DRD4	49	41
O=C(NCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875084041	EC	On-Demand	Anodyne	HTR2A	54	47
O=C(NCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875084041	EC	On-Demand	Anodyne	HTR2C	26	43
O=C(NCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875084041	EC	On-Demand	Anodyne	ADRA1A	15	44
O=C(NCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875084041	EC	On-Demand	Anodyne	DRD3	79	49
O=C(NCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875084041	EC	On-Demand	Anodyne	HTR7	71	44
O=C(NCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875084041	EC	On-Demand	Anodyne	PLD2	40	34
O=CN1CCCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)CC1	ZINC000875084068	GC	On-Demand	Anodyne	HTR1A	42	55
O=CN1CCCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)CC1	ZINC000875084068	GC	On-Demand	Anodyne	DRD2	32	55
O=CN1CCCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)CC1	ZINC000875084068	GC	On-Demand	Anodyne	HTR2A	29	43
O=CN1CCCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)CC1	ZINC000875084068	GC	On-Demand	Anodyne	HTR2C	15	43
O=CN1CCCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)CC1	ZINC000875084068	GC	On-Demand	Anodyne	DRD3	39	43
O=CN1CCCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)CC1	ZINC000875084068	GC	On-Demand	Anodyne	HTR7	45	41
O=CN1CCCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)CC1	ZINC000875084068	GC	On-Demand	Anodyne	PLD2	57	35
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccc(OCCOC)c2)C1	ZINC000875084075	FE	On-Demand	Anodyne	ROCK2	20	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccc(OCCOC)c2)C1	ZINC000875084075	FE	On-Demand	Anodyne	PDS	55	38
COC(=O)N(C)NC(=O)NCCCN1CCN(c2cccc(C)c2)CC1	ZINC000875084099	FD	On-Demand	Reactive	HTR1A	101	57
COC(=O)N(C)NC(=O)NCCCN1CCN(c2cccc(C)c2)CC1	ZINC000875084099	FD	On-Demand	Reactive	DRD2	73	57
COC(=O)N(C)NC(=O)NCCCN1CCN(c2cccc(C)c2)CC1	ZINC000875084099	FD	On-Demand	Reactive	DRD4	50	43
COC(=O)N(C)NC(=O)NCCCN1CCN(c2cccc(C)c2)CC1	ZINC000875084099	FD	On-Demand	Reactive	ADRA1D	53	48
COC(=O)N(C)NC(=O)NCCCN1CCN(c2cccc(C)c2)CC1	ZINC000875084099	FD	On-Demand	Reactive	HTR2A	77	57
COC(=O)N(C)NC(=O)NCCCN1CCN(c2cccc(C)c2)CC1	ZINC000875084099	FD	On-Demand	Reactive	HTR2C	49	55
COC(=O)N(C)NC(=O)NCCCN1CCN(c2cccc(C)c2)CC1	ZINC000875084099	FD	On-Demand	Reactive	SLC6A4	20	46
COC(=O)N(C)NC(=O)NCCCN1CCN(c2cccc(C)c2)CC1	ZINC000875084099	FD	On-Demand	Reactive	ADRA1A	74	44
COC(=O)N(C)NC(=O)NCCCN1CCN(c2cccc(C)c2)CC1	ZINC000875084099	FD	On-Demand	Reactive	ADRA1B	43	48
COC(=O)N(C)NC(=O)NCCCN1CCN(c2cccc(C)c2)CC1	ZINC000875084099	FD	On-Demand	Reactive	DRD3	101	55
COC(=O)N(C)NC(=O)NCCCN1CCN(c2cccc(C)c2)CC1	ZINC000875084099	FD	On-Demand	Reactive	HTR7	104	45
COC(=O)N(C)NC(=O)NCCCN1CCN(c2cccc(C)c2)CC1	ZINC000875084099	FD	On-Demand	Reactive	NPY1R	17	42
COC(=O)N(C)NC(=O)NCCCN1CCN(c2cccc(C)c2)CC1	ZINC000875084099	FD	On-Demand	Reactive	CCR3	28	41
CN1CCN(C2CCN(C(=O)C(=O)NCCCNc3ccccn3)CC2)CC1	ZINC000875084121	GC	On-Demand	Anodyne	GRIN2B	16	40
CN1CCN(C2CCN(C(=O)C(=O)NCCCNc3ccccn3)CC2)CC1	ZINC000875084121	GC	On-Demand	Anodyne	L3MBTL3	50	39
O=C(Oc1ccc(C(F)(F)F)cc1)C1CCCC1	ZINC000875084129	CH	On-Demand	Anodyne	LIPE	22	42
Cn1nccc1CNC(=O)C(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C	ZINC000875084210	GC	On-Demand	Anodyne	GPR119	22	41
CC[C@@H](NC(=O)NCc1cccc(OCCOC)c1)[C@@H](O)c1ccccc1	ZINC000875084262	FG	On-Demand	Anodyne	HRH2	25	41
CC[C@@H](NC(=O)NCc1cccc(OCCOC)c1)[C@@H](O)c1ccccc1	ZINC000875084262	FG	On-Demand	Anodyne	ROCK2	21	48
CC[C@@H](NC(=O)NCc1cccc(OCCOC)c1)[C@@H](O)c1ccccc1	ZINC000875084262	FG	On-Demand	Anodyne	BACE1	21	40
CC[C@@H](NC(=O)NCc1cccc(OCCOC)c1)[C@@H](O)c1ccccc1	ZINC000875084262	FG	On-Demand	Anodyne	PDS	98	45
CC[C@@H](NC(=O)NCc1cccc(OCCOC)c1)[C@H](O)c1ccccc1	ZINC000875084266	FG	On-Demand	Anodyne	HRH2	25	41
CC[C@@H](NC(=O)NCc1cccc(OCCOC)c1)[C@H](O)c1ccccc1	ZINC000875084266	FG	On-Demand	Anodyne	ROCK2	21	48
CC[C@@H](NC(=O)NCc1cccc(OCCOC)c1)[C@H](O)c1ccccc1	ZINC000875084266	FG	On-Demand	Anodyne	BACE1	21	40
CC[C@@H](NC(=O)NCc1cccc(OCCOC)c1)[C@H](O)c1ccccc1	ZINC000875084266	FG	On-Demand	Anodyne	PDS	98	45
Cn1nccc1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875084318	GD	On-Demand	Anodyne	DRD2	26	44
Cn1nccc1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875084318	GD	On-Demand	Anodyne	DRD4	46	42
Cn1nccc1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875084318	GD	On-Demand	Anodyne	ACHE	66	58
Cn1nccc1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875084318	GD	On-Demand	Anodyne	DRD3	22	42
Cn1nccc1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875084318	GD	On-Demand	Anodyne	SLC6A3	16	46
Cn1nccc1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875084318	GD	On-Demand	Anodyne	SIGMAR1	61	42
Cn1nccc1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875084318	GD	On-Demand	Anodyne	BCHE	20	49
Cn1nccc1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875084318	GD	On-Demand	Anodyne	CACNA1G	26	40
Cn1nccc1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875084318	GD	On-Demand	Anodyne	CYP2J2	42	30
Cc1ccc2nc(C(=O)Nc3nc(C)c4c(n3)CCCC4)cn2c1	ZINC000875084331	DF	On-Demand	Anodyne	MAP3K5	33	41
Cc1nc(NC(=O)Cc2ccc3cccnc3c2)nc2c1CCCC2	ZINC000875084359	EG	On-Demand	Anodyne	ACHE	43	34
Cc1nc(NC(=O)Cc2ccc3cccnc3c2)nc2c1CCCC2	ZINC000875084359	EG	On-Demand	Anodyne	BCHE	67	34
Cc1nc(NC(=O)Cc2ccc3cccnc3c2)nc2c1CCCC2	ZINC000875084359	EG	On-Demand	Anodyne	CDK5	16	41
CC(=O)C1CCN(C(=O)C(=O)NCCCNc2ccccn2)CC1	ZINC000875084371	EC	On-Demand	Anodyne	GRIN2B	16	42
CCn1ncnc1-c1ccc(C(=O)N2CCCc3cccc(C)c32)cc1	ZINC000875084380	EH	On-Demand	Anodyne	AVPR2	51	41
O=C(Oc1ccc(C(F)(F)F)cc1)c1cncc(Br)c1	ZINC000875084387	EI	On-Demand	Anodyne	ACR	25	46
O=C(Oc1ccc(C(F)(F)F)cc1)c1cncc(Br)c1	ZINC000875084387	EI	On-Demand	Anodyne	R1A_CVHSA	19	43
O=C(Oc1ccc(C(F)(F)F)cc1)c1cncc(Br)c1	ZINC000875084387	EI	On-Demand	Anodyne	POLG_HRV16	26	43
Cc1cccc2c1N(C(=O)c1cccn(C(C)(C)C)c1=O)CCC2	ZINC000875084397	DH	On-Demand	Anodyne	AVPR2	52	42
COc1cccc(C(C)(C)C(=O)Nc2nc(C)c3c(n2)CCCC3)c1	ZINC000875084415	EH	On-Demand	Anodyne	ACHE	50	41
COc1cccc(C(C)(C)C(=O)Nc2nc(C)c3c(n2)CCCC3)c1	ZINC000875084415	EH	On-Demand	Anodyne	BCHE	54	36
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875084457	GD	On-Demand	Anodyne	TMPRSS11D	68	33
CN(C(=O)NCCNS(=O)(=O)Cc1ccccc1)[C@@H]1CCCC[C@H]1O	ZINC000875084467	FD	On-Demand	Anodyne	F2	20	42
CN(C(=O)NCCNS(=O)(=O)Cc1ccccc1)[C@@H]1CCCC[C@H]1O	ZINC000875084467	FD	On-Demand	Anodyne	TMPRSS11D	72	33
CNC(=O)CN1CCC(NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875084482	FD	On-Demand	Anodyne	DRD4	23	41
CNC(=O)CN1CCC(NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875084482	FD	On-Demand	Anodyne	SIGMAR1	15	40
CNC(=O)CN1CCC(NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875084482	FD	On-Demand	Anodyne	BIRC2	59	41
CNC(=O)CN1CCC(NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875084483	FD	On-Demand	Anodyne	DRD4	23	41
CNC(=O)CN1CCC(NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875084483	FD	On-Demand	Anodyne	SIGMAR1	15	40
CNC(=O)CN1CCC(NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875084483	FD	On-Demand	Anodyne	BIRC2	59	41
CNC(=O)CN1CCC(NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875084484	FD	On-Demand	Anodyne	DRD4	23	41
CNC(=O)CN1CCC(NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875084484	FD	On-Demand	Anodyne	SIGMAR1	15	40
CNC(=O)CN1CCC(NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875084484	FD	On-Demand	Anodyne	BIRC2	59	41
CNC(=O)CN1CCC(NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875084485	FD	On-Demand	Anodyne	DRD4	23	41
CNC(=O)CN1CCC(NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875084485	FD	On-Demand	Anodyne	SIGMAR1	15	40
CNC(=O)CN1CCC(NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875084485	FD	On-Demand	Anodyne	BIRC2	59	41
O=C(CCC(=O)c1ccc(Cl)cc1)Oc1ccc(C(F)(F)F)cc1	ZINC000875084488	FJ	On-Demand	Anodyne	ACR	22	46
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCC2CCCCC2)C1	ZINC000875084510	DG	On-Demand	Anodyne	BMP1	51	38
CNC(=O)CN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875084516	GC	On-Demand	Anodyne	DRD4	30	43
CNC(=O)CN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875084516	GC	On-Demand	Anodyne	SIGMAR1	17	51
CNC(=O)CN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875084516	GC	On-Demand	Anodyne	CCR3	20	40
CNC(=O)CN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875084516	GC	On-Demand	Anodyne	EPHX2	20	43
CNC(=O)CN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875084516	GC	On-Demand	Anodyne	CXCR3	15	42
CNC(=O)CN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875084516	GC	On-Demand	Anodyne	MCHR1	26	41
CNC(=O)CN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875084517	GC	On-Demand	Anodyne	DRD4	30	43
CNC(=O)CN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875084517	GC	On-Demand	Anodyne	SIGMAR1	17	51
CNC(=O)CN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875084517	GC	On-Demand	Anodyne	CCR3	20	40
CNC(=O)CN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875084517	GC	On-Demand	Anodyne	EPHX2	20	43
CNC(=O)CN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875084517	GC	On-Demand	Anodyne	CXCR3	15	42
CNC(=O)CN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875084517	GC	On-Demand	Anodyne	MCHR1	26	41
C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCCNS(=O)(=O)Cc1ccccc1	ZINC000875084518	GD	On-Demand	Anodyne	PLG	57	34
C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCCNS(=O)(=O)Cc1ccccc1	ZINC000875084518	GD	On-Demand	Anodyne	TRYP_PIG	46	34
C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCCNS(=O)(=O)Cc1ccccc1	ZINC000875084518	GD	On-Demand	Anodyne	TMPRSS11D	75	34
C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)NCCNS(=O)(=O)Cc1ccccc1	ZINC000875084519	GD	On-Demand	Anodyne	PLG	57	34
C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)NCCNS(=O)(=O)Cc1ccccc1	ZINC000875084519	GD	On-Demand	Anodyne	TRYP_PIG	46	34
C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)NCCNS(=O)(=O)Cc1ccccc1	ZINC000875084519	GD	On-Demand	Anodyne	TMPRSS11D	75	34
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCCNS(=O)(=O)Cc1ccccc1	ZINC000875084521	GD	On-Demand	Anodyne	PLG	57	34
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCCNS(=O)(=O)Cc1ccccc1	ZINC000875084521	GD	On-Demand	Anodyne	TRYP_PIG	46	34
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCCNS(=O)(=O)Cc1ccccc1	ZINC000875084521	GD	On-Demand	Anodyne	TMPRSS11D	75	34
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)NCCNS(=O)(=O)Cc1ccccc1	ZINC000875084522	GD	On-Demand	Anodyne	PLG	61	36
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)NCCNS(=O)(=O)Cc1ccccc1	ZINC000875084522	GD	On-Demand	Anodyne	TRYP_PIG	49	36
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)NCCNS(=O)(=O)Cc1ccccc1	ZINC000875084522	GD	On-Demand	Anodyne	TMPRSS11D	70	33
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NC[C@@H]1CCN(CC(F)(F)F)C1	ZINC000875084529	GD	On-Demand	Anodyne	CACNA1I	65	36
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NC[C@H]1CCN(CC(F)(F)F)C1	ZINC000875084530	GD	On-Demand	Anodyne	CACNA1I	65	36
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NC[C@H]1CCN(CC(F)(F)F)C1	ZINC000875084531	GD	On-Demand	Anodyne	CACNA1I	65	36
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NC[C@@H]1CCN(CC(F)(F)F)C1	ZINC000875084532	GD	On-Demand	Anodyne	CACNA1I	65	36
COC(=O)C1(O)CN(C(=O)NCc2ccc(C)nc2)C1	ZINC000875084549	CB	On-Demand	Anodyne	NAMPT	24	44
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)C1	ZINC000875084554	FD	On-Demand	Anodyne	CACNA1I	41	33
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@H]2CCN(CC(F)(F)F)C2)C1	ZINC000875084555	FD	On-Demand	Anodyne	CACNA1I	41	33
C[C@H](NC(=O)C(=O)NC[C@@H]1CCN(CC(F)(F)F)C1)c1ccnn1C	ZINC000875084562	FC	On-Demand	Anodyne	CACNA1I	51	33
C[C@H](NC(=O)C(=O)NC[C@H]1CCN(CC(F)(F)F)C1)c1ccnn1C	ZINC000875084563	FC	On-Demand	Anodyne	CACNA1I	51	33
C[C@@H]1CC(F)(F)CCN1C(=O)NCCNS(=O)(=O)Cc1ccccc1	ZINC000875084572	GD	On-Demand	Anodyne	TMPRSS11D	52	33
C[C@H]1CC(F)(F)CCN1C(=O)NCCNS(=O)(=O)Cc1ccccc1	ZINC000875084573	GD	On-Demand	Anodyne	TMPRSS11D	52	33
C[C@H]1C[C@H](CO)CCN1C(=O)NCCNS(=O)(=O)Cc1ccccc1	ZINC000875084583	FC	On-Demand	Anodyne	TMPRSS11D	73	33
O=C(Cc1ccsc1)Oc1ccc(C(F)(F)F)cc1	ZINC000875084589	CH	On-Demand	Anodyne	PPARD	26	44
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CC[C@H](O)[C@H]2CCCC[C@@H]21	ZINC000875084603	GD	On-Demand	Anodyne	F2	33	41
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CC[C@H](O)[C@H]2CCCC[C@@H]21	ZINC000875084603	GD	On-Demand	Anodyne	PRSS1	26	40
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CC[C@H](O)[C@H]2CCCC[C@@H]21	ZINC000875084603	GD	On-Demand	Anodyne	FKBP1A	24	42
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CC[C@H](O)[C@H]2CCCC[C@@H]21	ZINC000875084603	GD	On-Demand	Anodyne	TMPRSS11D	71	36
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CC[C@H](O)[C@H]2CCCC[C@H]21	ZINC000875084604	GD	On-Demand	Anodyne	F2	33	41
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CC[C@H](O)[C@H]2CCCC[C@H]21	ZINC000875084604	GD	On-Demand	Anodyne	PRSS1	26	40
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CC[C@H](O)[C@H]2CCCC[C@H]21	ZINC000875084604	GD	On-Demand	Anodyne	FKBP1A	24	42
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CC[C@H](O)[C@H]2CCCC[C@H]21	ZINC000875084604	GD	On-Demand	Anodyne	TMPRSS11D	71	36
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CC[C@H](O)[C@@H]2CCCC[C@H]21	ZINC000875084605	GD	On-Demand	Anodyne	F2	33	41
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CC[C@H](O)[C@@H]2CCCC[C@H]21	ZINC000875084605	GD	On-Demand	Anodyne	PRSS1	26	40
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CC[C@H](O)[C@@H]2CCCC[C@H]21	ZINC000875084605	GD	On-Demand	Anodyne	FKBP1A	24	42
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CC[C@H](O)[C@@H]2CCCC[C@H]21	ZINC000875084605	GD	On-Demand	Anodyne	TMPRSS11D	71	36
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CC[C@H](O)[C@@H]2CCCC[C@@H]21	ZINC000875084606	GD	On-Demand	Anodyne	F2	33	41
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CC[C@H](O)[C@@H]2CCCC[C@@H]21	ZINC000875084606	GD	On-Demand	Anodyne	PRSS1	26	40
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CC[C@H](O)[C@@H]2CCCC[C@@H]21	ZINC000875084606	GD	On-Demand	Anodyne	FKBP1A	24	42
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CC[C@H](O)[C@@H]2CCCC[C@@H]21	ZINC000875084606	GD	On-Demand	Anodyne	TMPRSS11D	71	36
C[C@H](NC(=O)C(=O)NC[C@H]1CCN(CC(F)(F)F)C1)c1cc2cnccc2o1	ZINC000875084615	GE	On-Demand	Anodyne	CACNA1I	56	32
C[C@H](NC(=O)C(=O)NC[C@@H]1CCN(CC(F)(F)F)C1)c1cc2cnccc2o1	ZINC000875084616	GE	On-Demand	Anodyne	CACNA1I	56	32
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CCCC2(CC1)CC2	ZINC000875084629	FE	On-Demand	Anodyne	TMPRSS11D	90	33
CNC(=O)CN1CCC(NC(=O)NC2(C)CCC(C)(C)CC2)CC1	ZINC000875084631	ED	On-Demand	Anodyne	EPHX2	15	44
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1C[C@H](O)C[C@H]1C1CC1	ZINC000875084635	FC	On-Demand	Anodyne	TMPRSS11D	55	32
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1C[C@@H](O)C[C@H]1C1CC1	ZINC000875084636	FC	On-Demand	Anodyne	TMPRSS11D	55	32
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1C[C@H](O)C[C@@H]1C1CC1	ZINC000875084637	FC	On-Demand	Anodyne	TMPRSS11D	55	32
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1C[C@@H](O)C[C@@H]1C1CC1	ZINC000875084638	FC	On-Demand	Anodyne	TMPRSS11D	55	32
CC[C@@H](NC(=O)NC1CCN(CC(=O)NC)CC1)[C@@H](O)c1ccccc1	ZINC000875084639	FD	On-Demand	Anodyne	DRD4	21	40
CC[C@@H](NC(=O)NC1CCN(CC(=O)NC)CC1)[C@@H](O)c1ccccc1	ZINC000875084639	FD	On-Demand	Anodyne	SIGMAR1	15	40
CC[C@@H](NC(=O)NC1CCN(CC(=O)NC)CC1)[C@@H](O)c1ccccc1	ZINC000875084639	FD	On-Demand	Anodyne	CCR5	21	44
CC[C@@H](NC(=O)NC1CCN(CC(=O)NC)CC1)[C@@H](O)c1ccccc1	ZINC000875084639	FD	On-Demand	Anodyne	XIAP	55	36
CC[C@@H](NC(=O)NC1CCN(CC(=O)NC)CC1)[C@@H](O)c1ccccc1	ZINC000875084639	FD	On-Demand	Anodyne	BIRC2	56	38
CC[C@@H](NC(=O)NC1CCN(CC(=O)NC)CC1)[C@@H](O)c1ccccc1	ZINC000875084639	FD	On-Demand	Anodyne	BIRC8	56	33
CC[C@@H](NC(=O)NC1CCN(CC(=O)NC)CC1)[C@H](O)c1ccccc1	ZINC000875084641	FD	On-Demand	Anodyne	DRD4	21	40
CC[C@@H](NC(=O)NC1CCN(CC(=O)NC)CC1)[C@H](O)c1ccccc1	ZINC000875084641	FD	On-Demand	Anodyne	SIGMAR1	15	40
CC[C@@H](NC(=O)NC1CCN(CC(=O)NC)CC1)[C@H](O)c1ccccc1	ZINC000875084641	FD	On-Demand	Anodyne	CCR5	21	44
CC[C@@H](NC(=O)NC1CCN(CC(=O)NC)CC1)[C@H](O)c1ccccc1	ZINC000875084641	FD	On-Demand	Anodyne	XIAP	55	36
CC[C@@H](NC(=O)NC1CCN(CC(=O)NC)CC1)[C@H](O)c1ccccc1	ZINC000875084641	FD	On-Demand	Anodyne	BIRC2	56	38
CC[C@@H](NC(=O)NC1CCN(CC(=O)NC)CC1)[C@H](O)c1ccccc1	ZINC000875084641	FD	On-Demand	Anodyne	BIRC8	56	33
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CCO[C@H](C(F)F)CC1	ZINC000875084649	GD	On-Demand	Anodyne	TMPRSS11D	75	34
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CCO[C@@H](C(F)F)CC1	ZINC000875084650	GD	On-Demand	Anodyne	TMPRSS11D	75	34
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000875084652	FD	On-Demand	Anodyne	TMPRSS11D	67	33
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CCC[C@@H]1Cn1ccnc1	ZINC000875084659	GD	On-Demand	Anodyne	TMPRSS11D	67	36
CC(=O)C1CCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)CC1	ZINC000875084674	FD	On-Demand	Anodyne	FKBP1A	17	40
CC(=O)C1CCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)CC1	ZINC000875084674	FD	On-Demand	Anodyne	EPHX2	26	41
CC(=O)C1CCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)CC1	ZINC000875084674	FD	On-Demand	Anodyne	TMPRSS11D	78	35
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccc(C)nc2)CC1	ZINC000875084678	FH	On-Demand	Anodyne	EPHX2	17	41
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccc(C)nc2)CC1	ZINC000875084679	FH	On-Demand	Anodyne	EPHX2	17	41
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875084694	FC	On-Demand	Anodyne	TMPRSS11D	40	31
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875084695	FC	On-Demand	Anodyne	TMPRSS11D	40	31
O=C(Oc1ccc(C(F)(F)F)cc1)c1cccc(F)c1	ZINC000875084696	CI	On-Demand	Anodyne	ACR	51	49
O=C(Oc1ccc(C(F)(F)F)cc1)c1cccc(F)c1	ZINC000875084696	CI	On-Demand	Anodyne	KCNK3	15	40
CNC(=O)CN1CCC(NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)CC1	ZINC000875084699	FC	On-Demand	Anodyne	DRD4	22	40
CNC(=O)CN1CCC(NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)CC1	ZINC000875084699	FC	On-Demand	Anodyne	EPHX2	20	45
CNC(=O)CN1CCC(NC(=O)N2CCC[C@](O)(c3ccccc3)C2)CC1	ZINC000875084700	FC	On-Demand	Anodyne	DRD4	22	40
CNC(=O)CN1CCC(NC(=O)N2CCC[C@](O)(c3ccccc3)C2)CC1	ZINC000875084700	FC	On-Demand	Anodyne	EPHX2	20	45
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875084710	GD	On-Demand	Anodyne	TMPRSS11D	67	32
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875084711	GD	On-Demand	Anodyne	TMPRSS11D	67	32
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875084712	GD	On-Demand	Anodyne	TMPRSS11D	67	32
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875084713	GD	On-Demand	Anodyne	TMPRSS11D	67	32
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C)nc1	ZINC000875084716	DD	On-Demand	Anodyne	SLC6A4	33	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C)nc1	ZINC000875084716	DD	On-Demand	Anodyne	SLC6A3	66	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C)nc1	ZINC000875084717	DD	On-Demand	Anodyne	SLC6A4	33	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C)nc1	ZINC000875084717	DD	On-Demand	Anodyne	SLC6A3	66	41
CC(C)[C@H]1CN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)CCN1C	ZINC000875084722	GD	On-Demand	Anodyne	TRY2_BOVIN	46	33
CC(C)[C@H]1CN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)CCN1C	ZINC000875084722	GD	On-Demand	Anodyne	TMPRSS11D	96	35
CN1CC[C@H]2CN(C(=O)NCCNS(=O)(=O)Cc3ccccc3)CC[C@H]21	ZINC000875084724	GC	On-Demand	Anodyne	TMPRSS11D	77	32
CN1CC[C@H]2CN(C(=O)NCCNS(=O)(=O)Cc3ccccc3)CC[C@@H]21	ZINC000875084726	GC	On-Demand	Anodyne	TMPRSS11D	77	32
CNC(=O)CN1CCC(NC(=O)NNc2cccc(F)c2Cl)CC1	ZINC000875084738	FD	On-Demand	Reactive	DRD4	24	40
CNC(=O)CN1CCC(NC(=O)NNc2cccc(F)c2Cl)CC1	ZINC000875084738	FD	On-Demand	Reactive	SIGMAR1	15	44
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1OC2CCC1CC2	ZINC000875084741	FD	On-Demand	Anodyne	F2	27	40
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1OC2CCC1CC2	ZINC000875084741	FD	On-Demand	Anodyne	PLG	57	33
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1OC2CCC1CC2	ZINC000875084741	FD	On-Demand	Anodyne	TRYP_PIG	46	32
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1OC2CCC1CC2	ZINC000875084741	FD	On-Demand	Anodyne	TMPRSS11D	95	36
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CC=CC1	ZINC000875084744	DC	On-Demand	Anodyne	TMPRSS11D	62	32
CNC(=O)CN1CCC(NC(=O)N2CCOC[C@@H]2c2ccc(OC)cc2)CC1	ZINC000875084747	GC	On-Demand	Anodyne	PDK1	41	35
CNC(=O)CN1CCC(NC(=O)N2CCOC[C@@H]2c2ccc(OC)cc2)CC1	ZINC000875084747	GC	On-Demand	Anodyne	MCHR1	16	42
CNC(=O)CN1CCC(NC(=O)N2CCOC[C@H]2c2ccc(OC)cc2)CC1	ZINC000875084748	GC	On-Demand	Anodyne	PDK1	41	35
CNC(=O)CN1CCC(NC(=O)N2CCOC[C@H]2c2ccc(OC)cc2)CC1	ZINC000875084748	GC	On-Demand	Anodyne	MCHR1	16	42
CNC(=O)CN1CCC(NC(=O)NC2CC(C(=O)OC)C2)CC1	ZINC000875084765	EB	On-Demand	Anodyne	EPHX2	16	41
CN1CCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)CCC1(C)C	ZINC000875084782	GD	On-Demand	Anodyne	TMPRSS11D	51	31
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1C[C@H]2COC[C@H]2C1	ZINC000875084792	FC	On-Demand	Anodyne	TMPRSS11D	67	31
CNC(=O)CN1CCC(NC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875084793	GD	On-Demand	Mild	CTSF	46	32
CNC(=O)CN1CCC(NC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875084793	GD	On-Demand	Mild	LGMN	54	33
CNC(=O)CN1CCC(NC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875084793	GD	On-Demand	Mild	MCHR1	49	48
CNC(=O)CN1CCC(NC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875084794	GD	On-Demand	Mild	CTSF	46	32
CNC(=O)CN1CCC(NC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875084794	GD	On-Demand	Mild	LGMN	54	33
CNC(=O)CN1CCC(NC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875084794	GD	On-Demand	Mild	MCHR1	49	48
CNC(=O)CN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(Cl)cc2)CC1	ZINC000875084801	GD	On-Demand	Anodyne	SIGMAR1	16	45
CNC(=O)CN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(Cl)cc2)CC1	ZINC000875084801	GD	On-Demand	Anodyne	MCHR1	21	40
CNC(=O)CN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(Cl)cc2)CC1	ZINC000875084802	GD	On-Demand	Anodyne	SIGMAR1	16	45
CNC(=O)CN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(Cl)cc2)CC1	ZINC000875084802	GD	On-Demand	Anodyne	MCHR1	21	40
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CC(OCC(F)F)C1	ZINC000875084812	GC	On-Demand	Anodyne	TMPRSS11D	78	31
O=C(Oc1ccc(C(F)(F)F)cc1)c1ccc2nc[nH]c2c1	ZINC000875084857	DH	On-Demand	Anodyne	ACR	35	45
CNC(=O)CN1CCC(NC(=O)N2C[C@@H]3C[C@H]2CN3c2ccccc2)CC1	ZINC000875084865	FC	On-Demand	Anodyne	BIRC2	60	37
O=C(NCc1ncc(Cl)s1)C(=O)NC[C@H]1CCN(CC(F)(F)F)C1	ZINC000875084872	GD	On-Demand	Anodyne	CACNA1I	55	34
O=C(NCc1ncc(Cl)s1)C(=O)NC[C@@H]1CCN(CC(F)(F)F)C1	ZINC000875084873	GD	On-Demand	Anodyne	CACNA1I	55	34
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1Cc2cccc(O)c2C1	ZINC000875084880	GD	On-Demand	Clean	TMPRSS11D	76	32
CCC(CC)C(=O)Oc1ccc(C(F)(F)F)cc1	ZINC000875084895	CI	On-Demand	Anodyne	PPARA	18	42
CCC(CC)C(=O)Oc1ccc(C(F)(F)F)cc1	ZINC000875084895	CI	On-Demand	Anodyne	PPARD	47	40
CCC(CC)C(=O)Oc1ccc(C(F)(F)F)cc1	ZINC000875084895	CI	On-Demand	Anodyne	ACR	24	46
O=C(NC[C@H]1CCN(CC(F)(F)F)C1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875084917	FD	On-Demand	Anodyne	CACNA1I	41	34
O=C(NC[C@@H]1CCN(CC(F)(F)F)C1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875084918	FD	On-Demand	Anodyne	CACNA1I	41	34
CCCCCCCNC(=O)C(=O)NC[C@@H]1CCN(C2CC2)C1	ZINC000875084924	DD	On-Demand	Mild	ASAH1	54	35
CCCCCCCNC(=O)C(=O)NC[C@H]1CCN(C2CC2)C1	ZINC000875084925	DD	On-Demand	Mild	ASAH1	54	35
CNC(=O)CN1CCC(NC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875084929	GD	On-Demand	Anodyne	DRD4	21	42
CNC(=O)CN1CCC(NC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875084929	GD	On-Demand	Anodyne	SIGMAR1	16	40
CNC(=O)CN1CCC(NC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875084929	GD	On-Demand	Anodyne	BIRC2	59	40
CNC(=O)CN1CCC(NC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875084930	GD	On-Demand	Anodyne	DRD4	21	42
CNC(=O)CN1CCC(NC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875084930	GD	On-Demand	Anodyne	SIGMAR1	16	40
CNC(=O)CN1CCC(NC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875084930	GD	On-Demand	Anodyne	BIRC2	59	40
CNC(=O)CN1CCC(NC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875084931	GD	On-Demand	Anodyne	DRD4	21	42
CNC(=O)CN1CCC(NC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875084931	GD	On-Demand	Anodyne	SIGMAR1	16	40
CNC(=O)CN1CCC(NC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875084931	GD	On-Demand	Anodyne	BIRC2	59	40
CNC(=O)CN1CCC(NC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875084932	GD	On-Demand	Anodyne	DRD4	21	42
CNC(=O)CN1CCC(NC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875084932	GD	On-Demand	Anodyne	SIGMAR1	16	40
CNC(=O)CN1CCC(NC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875084932	GD	On-Demand	Anodyne	BIRC2	59	40
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CC[C@H]2CC[C@@H](C1)S2	ZINC000875084933	GD	On-Demand	Anodyne	TMPRSS11D	77	33
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CCc2c(O)cccc2C1	ZINC000875084938	GD	On-Demand	Anodyne	AKR1C3	19	41
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1O[C@H]2C=C[C@H]1CC2	ZINC000875084939	FD	On-Demand	Anodyne	TMPRSS11D	75	35
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CCC(CCF)CC1	ZINC000875084960	FD	On-Demand	Anodyne	F2	37	42
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CCC(CCF)CC1	ZINC000875084960	FD	On-Demand	Anodyne	PRSS1	17	42
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CCC(CCF)CC1	ZINC000875084960	FD	On-Demand	Anodyne	ACHE	27	44
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CCC(CCF)CC1	ZINC000875084960	FD	On-Demand	Anodyne	GRIN2B	51	38
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CCC(CCF)CC1	ZINC000875084960	FD	On-Demand	Anodyne	ST14	54	37
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CCC(CCF)CC1	ZINC000875084960	FD	On-Demand	Anodyne	TMPRSS11D	65	32
O=C(NCCCC1CCCCC1)N1Cc2cccnc2N2C[C@H](O)C[C@H]2C1	ZINC000875084961	FF	On-Demand	Anodyne	BMP1	40	35
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(C)nc2)C1	ZINC000875084976	DD	On-Demand	Anodyne	NAMPT	19	41
CNC(=O)CN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875084978	GC	On-Demand	Anodyne	CHRM2	18	42
CNC(=O)CN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875084978	GC	On-Demand	Anodyne	CHRM1	15	42
CNC(=O)CN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875084978	GC	On-Demand	Anodyne	DRD2	16	47
CNC(=O)CN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875084978	GC	On-Demand	Anodyne	DRD4	60	48
CNC(=O)CN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875084978	GC	On-Demand	Anodyne	ACHE	30	42
CNC(=O)CN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875084978	GC	On-Demand	Anodyne	CHRM3	22	42
CNC(=O)CN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875084978	GC	On-Demand	Anodyne	SIGMAR1	43	54
CNC(=O)CN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875084978	GC	On-Demand	Anodyne	CCR3	27	46
CNC(=O)CN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875084978	GC	On-Demand	Anodyne	MCHR1	35	47
CNC(=O)CN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875084978	GC	On-Demand	Anodyne	CCR8	24	43
CNC(=O)CN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875084978	GC	On-Demand	Anodyne	BIRC2	36	41
CCOC[C@H]1CN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)CCO1	ZINC000875084981	GC	On-Demand	Anodyne	TMPRSS11D	52	32
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CCO[C@@H](CCF)C1	ZINC000875084995	FC	On-Demand	Anodyne	TMPRSS11D	59	33
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CCO[C@H](CCF)C1	ZINC000875084996	FC	On-Demand	Anodyne	TMPRSS11D	59	33
O=C(Cc1ccccc1F)Oc1ccc(C(F)(F)F)cc1	ZINC000875084997	CH	On-Demand	Anodyne	PPARD	24	43
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN(CC(F)(F)F)C1	ZINC000875085011	FD	On-Demand	Anodyne	CACNA1I	66	36
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN(CC(F)(F)F)C1	ZINC000875085012	FD	On-Demand	Anodyne	CACNA1I	66	36
CNC(=O)CN1CCC(NC(=O)NNc2cccc(C)n2)CC1	ZINC000875085013	DC	On-Demand	Reactive	DRD4	21	41
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CCC[C@H](C(F)(F)F)C1	ZINC000875085014	GE	On-Demand	Anodyne	F2	32	40
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CCC[C@H](C(F)(F)F)C1	ZINC000875085014	GE	On-Demand	Anodyne	SFRP1	56	32
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CCC[C@H](C(F)(F)F)C1	ZINC000875085014	GE	On-Demand	Anodyne	WNT3	45	32
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CCC[C@H](C(F)(F)F)C1	ZINC000875085014	GE	On-Demand	Anodyne	TMPRSS11D	107	38
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CCC[C@@H](C(F)(F)F)C1	ZINC000875085015	GE	On-Demand	Anodyne	F2	32	40
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CCC[C@@H](C(F)(F)F)C1	ZINC000875085015	GE	On-Demand	Anodyne	SFRP1	56	32
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CCC[C@@H](C(F)(F)F)C1	ZINC000875085015	GE	On-Demand	Anodyne	WNT3	45	32
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CCC[C@@H](C(F)(F)F)C1	ZINC000875085015	GE	On-Demand	Anodyne	TMPRSS11D	107	38
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875085020	FC	On-Demand	Anodyne	TMPRSS11D	67	34
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(CC(F)(F)F)C1	ZINC000875085029	FC	On-Demand	Mild	CACNA1I	41	32
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(CC(F)(F)F)C1	ZINC000875085030	FC	On-Demand	Mild	CACNA1I	41	32
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(CC(F)(F)F)C1	ZINC000875085031	FC	On-Demand	Mild	CACNA1I	41	32
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(CC(F)(F)F)C1	ZINC000875085032	FC	On-Demand	Mild	CACNA1I	41	32
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1C[C@@H]2CCC[C@]2(CO)C1	ZINC000875085033	GC	On-Demand	Anodyne	TMPRSS11D	64	33
CC[C@@H](NC(=O)NCc1ccc(C)nc1)[C@H](O)c1ccccc1	ZINC000875085040	DF	On-Demand	Anodyne	NAMPT	15	50
CC[C@@H](NC(=O)NCc1ccc(C)nc1)[C@@H](O)c1ccccc1	ZINC000875085042	DF	On-Demand	Anodyne	NAMPT	15	50
CN1CCCC[C@H](N(C)C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1=O	ZINC000875085047	GC	On-Demand	Anodyne	FKBP1A	32	40
CN1CCCC[C@H](N(C)C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1=O	ZINC000875085047	GC	On-Demand	Anodyne	CCR5	22	41
CN1CCCC[C@H](N(C)C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1=O	ZINC000875085047	GC	On-Demand	Anodyne	TMPRSS11D	63	35
CN1CCCC[C@@H](N(C)C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1=O	ZINC000875085048	GC	On-Demand	Anodyne	FKBP1A	32	40
CN1CCCC[C@@H](N(C)C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1=O	ZINC000875085048	GC	On-Demand	Anodyne	CCR5	22	41
CN1CCCC[C@@H](N(C)C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1=O	ZINC000875085048	GC	On-Demand	Anodyne	TMPRSS11D	63	35
CO[C@@H]1C[C@@H]2CN(C(=O)NCc3ccc(C)nc3)Cc3cccnc3N2C1	ZINC000875085060	FE	On-Demand	Anodyne	NAMPT	24	43
CO[C@H]1C[C@H]2CN(C(=O)NCc3ccc(C)nc3)Cc3cccnc3N2C1	ZINC000875085061	FE	On-Demand	Anodyne	NAMPT	24	43
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)Oc3ccc(C(F)(F)F)cc3)c2)C[C@H](C)O1	ZINC000875085076	IH	On-Demand	Anodyne	CACNA1B	50	38
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)Oc3ccc(C(F)(F)F)cc3)c2)C[C@H](C)O1	ZINC000875085076	IH	On-Demand	Anodyne	AKR1C3	64	43
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)Oc3ccc(C(F)(F)F)cc3)c2)C[C@@H](C)O1	ZINC000875085077	IH	On-Demand	Anodyne	CACNA1B	50	38
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)Oc3ccc(C(F)(F)F)cc3)c2)C[C@@H](C)O1	ZINC000875085077	IH	On-Demand	Anodyne	AKR1C3	64	43
C[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)Oc3ccc(C(F)(F)F)cc3)c2)C[C@@H](C)O1	ZINC000875085078	IH	On-Demand	Anodyne	CACNA1B	50	38
C[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)Oc3ccc(C(F)(F)F)cc3)c2)C[C@@H](C)O1	ZINC000875085078	IH	On-Demand	Anodyne	AKR1C3	64	43
O=CN1CCCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)CC1	ZINC000875085083	FB	On-Demand	Anodyne	TMPRSS11D	79	32
CC(=O)[C@H]1CCCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000875085088	FD	On-Demand	Anodyne	FKBP1A	24	40
CC(=O)[C@H]1CCCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000875085088	FD	On-Demand	Anodyne	SLC6A1	43	32
CC(=O)[C@H]1CCCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000875085088	FD	On-Demand	Anodyne	DPP7	52	38
CC(=O)[C@H]1CCCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000875085088	FD	On-Demand	Anodyne	TMPRSS11D	97	37
CC(=O)[C@@H]1CCCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000875085089	FD	On-Demand	Anodyne	FKBP1A	24	40
CC(=O)[C@@H]1CCCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000875085089	FD	On-Demand	Anodyne	SLC6A1	43	32
CC(=O)[C@@H]1CCCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000875085089	FD	On-Demand	Anodyne	DPP7	52	38
CC(=O)[C@@H]1CCCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000875085089	FD	On-Demand	Anodyne	TMPRSS11D	97	37
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CC(c2ccccc2)C1	ZINC000875085107	FD	On-Demand	Anodyne	PLG	43	31
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CC(c2ccccc2)C1	ZINC000875085107	FD	On-Demand	Anodyne	TMPRSS11D	103	35
O=C(NCCNS(=O)(=O)Cc1ccccc1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875085123	GD	On-Demand	Anodyne	TMPRSS11D	42	31
O=C(NCCNS(=O)(=O)Cc1ccccc1)NC1([C@H]2CCCCO2)CCC1	ZINC000875085124	GD	On-Demand	Anodyne	TMPRSS11D	42	31
C[C@]1(C(F)(F)F)CCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000875085142	GE	On-Demand	Anodyne	EPHX2	19	42
C[C@]1(C(F)(F)F)CCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000875085142	GE	On-Demand	Anodyne	SLC12A5	45	32
C[C@]1(C(F)(F)F)CCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000875085142	GE	On-Demand	Anodyne	TMPRSS11D	61	31
CNC(=O)CN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875085146	FD	On-Demand	Anodyne	DRD4	33	52
CNC(=O)CN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875085146	FD	On-Demand	Anodyne	LTA4H	26	43
CNC(=O)CN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875085146	FD	On-Demand	Anodyne	SIGMAR1	25	47
CNC(=O)CN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875085146	FD	On-Demand	Anodyne	EPHX2	40	44
CNC(=O)CN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875085146	FD	On-Demand	Anodyne	CXCR3	17	40
CNC(=O)CN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875085146	FD	On-Demand	Anodyne	MCHR1	16	41
CNC(=O)CN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875085146	FD	On-Demand	Anodyne	BIRC2	42	38
CCC1(CC)CCCN1C(=O)NCc1ccc(C)nc1	ZINC000875085158	CG	On-Demand	Anodyne	NAMPT	40	41
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NC[C@H]2CCN(CC(F)(F)F)C2)c1	ZINC000875085159	GE	On-Demand	Anodyne	CACNA1I	49	33
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)c1	ZINC000875085160	GE	On-Demand	Anodyne	CACNA1I	49	33
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)c1	ZINC000875085161	GE	On-Demand	Anodyne	CACNA1I	49	33
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NC[C@H]2CCN(CC(F)(F)F)C2)c1	ZINC000875085162	GE	On-Demand	Anodyne	CACNA1I	49	33
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875085189	GC	On-Demand	Anodyne	TMPRSS11D	70	33
O=C(NCCNS(=O)(=O)Cc1ccccc1)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875085190	GC	On-Demand	Anodyne	TMPRSS11D	70	33
C=CC(C)(C)CCCNC(=O)C(=O)NC[C@H]1CCN(CC(F)(F)F)C1	ZINC000875085243	FE	On-Demand	Mild	CACNA1I	41	34
C=CC(C)(C)CCCNC(=O)C(=O)NC[C@@H]1CCN(CC(F)(F)F)C1	ZINC000875085244	FE	On-Demand	Mild	CACNA1I	41	34
O=CN1CCCN(C(=O)NCc2ccc(-n3cccn3)cc2)CC1	ZINC000875085274	ED	On-Demand	Anodyne	AMP1_PLAFQ	57	32
CC(C)(C)C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1	ZINC000875085279	GF	On-Demand	Anodyne	CCR5	25	41
CC(C)(C)C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1	ZINC000875085279	GF	On-Demand	Anodyne	EPHX2	15	41
CC(C)(C)C[C@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1	ZINC000875085280	GF	On-Demand	Anodyne	CCR5	25	41
CC(C)(C)C[C@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1	ZINC000875085280	GF	On-Demand	Anodyne	EPHX2	15	41
CC(C)(C)C[C@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccccc1	ZINC000875085321	EF	On-Demand	Anodyne	CACNA1H	24	41
CC(C)(C)C[C@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccccc1	ZINC000875085321	EF	On-Demand	Anodyne	GHRHR	58	35
CC(C)(C)C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccccc1	ZINC000875085322	EF	On-Demand	Anodyne	CACNA1H	24	41
CC(C)(C)C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccccc1	ZINC000875085322	EF	On-Demand	Anodyne	GHRHR	58	35
O=C(NCCO)C1CCN(C(=O)NCc2csc3ccccc23)CC1	ZINC000875085329	FD	On-Demand	Anodyne	EPHX2	22	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1csc2ccccc12	ZINC000875085331	EG	On-Demand	Anodyne	SLC6A3	44	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1csc2ccccc12	ZINC000875085332	EG	On-Demand	Anodyne	SLC6A3	44	37
CC(=O)C1CCN(C(=O)N[C@H](CC(C)(C)C)c2ccccc2)CC1	ZINC000875085377	EI	On-Demand	Anodyne	CCR5	30	45
CC(=O)C1CCN(C(=O)N[C@H](CC(C)(C)C)c2ccccc2)CC1	ZINC000875085377	EI	On-Demand	Anodyne	SFRP1	42	33
CC(=O)C1CCN(C(=O)N[C@@H](CC(C)(C)C)c2ccccc2)CC1	ZINC000875085378	EI	On-Demand	Anodyne	CCR5	30	45
CC(=O)C1CCN(C(=O)N[C@@H](CC(C)(C)C)c2ccccc2)CC1	ZINC000875085378	EI	On-Demand	Anodyne	SFRP1	42	33
COC(=O)C1(O)CN(C(=O)NCc2ccc(-n3cccn3)cc2)C1	ZINC000875085381	EC	On-Demand	Anodyne	AMP1_PLAFQ	52	37
Cc1ccc(C(=O)Oc2ccc(C(F)(F)F)cc2)cc1S(=O)(=O)N1CCOCC1	ZINC000875085382	IG	On-Demand	Anodyne	SRD5A1	20	52
Cc1ccc(C(=O)Oc2ccc(C(F)(F)F)cc2)cc1S(=O)(=O)N1CCOCC1	ZINC000875085382	IG	On-Demand	Anodyne	CNR2	20	55
Cc1ccc(C(=O)Oc2ccc(C(F)(F)F)cc2)cc1S(=O)(=O)N1CCOCC1	ZINC000875085382	IG	On-Demand	Anodyne	NR1H4	18	49
Cc1ccc(C(=O)Oc2ccc(C(F)(F)F)cc2)cc1S(=O)(=O)N1CCOCC1	ZINC000875085382	IG	On-Demand	Anodyne	EPHX2	18	46
Cc1ccc(C(=O)Oc2ccc(C(F)(F)F)cc2)cc1S(=O)(=O)N1CCOCC1	ZINC000875085382	IG	On-Demand	Anodyne	ACR	16	41
CC(C)(C)OC(=O)N1CCC(NC(=O)N(C2CC2)C2CC2)CC1	ZINC000875085400	DF	On-Demand	Anodyne	GPR119	34	41
O=C(Nc1ncc(Cl)cc1Cl)c1cc2n(n1)CCC2	ZINC000875085401	CF	On-Demand	Anodyne	CNR1	40	30
O=C(NCc1ccc(-n2cccn2)cc1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875085406	FF	On-Demand	Anodyne	AMP1_PLAFQ	49	35
CC[C@H](C)[C@H](NC(=O)OC)C(=O)Nc1ncc(Cl)cc1Cl	ZINC000875085416	EG	On-Demand	Anodyne	BMP1	18	40
O=C(NCc1ccc(-n2cccn2)cc1)N1CCC(CO)(CO)CC1	ZINC000875085429	ED	On-Demand	Anodyne	AMP1_PLAFQ	58	33
O=C(NCc1ccc(-n2cccn2)cc1)N1CCC(CO)(CO)CC1	ZINC000875085429	ED	On-Demand	Anodyne	NAMPT	32	40
CC(C)(C)C[C@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1ccc(F)cc1	ZINC000875085435	GH	On-Demand	Anodyne	CACNA1H	46	41
CC(C)(C)C[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1ccc(F)cc1	ZINC000875085436	GH	On-Demand	Anodyne	CACNA1H	46	41
CC(C)(C)C[C@@H](NC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)c1ccccc1	ZINC000875085449	GI	On-Demand	Anodyne	ETHR	60	36
CC(C)(C)C[C@@H](NC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)c1ccccc1	ZINC000875085450	GI	On-Demand	Anodyne	ETHR	60	36
CC(C)(C)C[C@H](NC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)c1ccccc1	ZINC000875085451	GI	On-Demand	Anodyne	ETHR	60	36
CC(C)(C)C[C@H](NC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)c1ccccc1	ZINC000875085452	GI	On-Demand	Anodyne	ETHR	60	36
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(-n2cccn2)cc1	ZINC000875085459	DE	On-Demand	Anodyne	AMP1_PLAFQ	60	44
CC(C)(C)OC(=O)N1CCC(NC(=O)NC2([C@@H]3CCCCO3)CCC2)CC1	ZINC000875085465	GG	On-Demand	Anodyne	EPHX2	16	48
CC(C)(C)OC(=O)N1CCC(NC(=O)NC2([C@H]3CCCCO3)CCC2)CC1	ZINC000875085466	GG	On-Demand	Anodyne	EPHX2	16	48
CC(C)(C)OC(=O)N1CCC(NC(=O)N2OC3CCC2CC3)CC1	ZINC000875085483	EF	On-Demand	Anodyne	GPR119	32	41
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875085489	EE	On-Demand	Anodyne	EPHX2	24	43
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875085489	EE	On-Demand	Anodyne	GPR119	25	40
CC(=O)NCCCNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875085532	ED	On-Demand	Mild	CTSF	50	34
CC(=O)NCCCNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875085533	ED	On-Demand	Mild	CTSF	50	34
CC(C)(C)OC(=O)N1CCC(NC(=O)N2CC[C@@H]3CC[C@@H](O)[C@@H]32)CC1	ZINC000875085540	FD	On-Demand	Anodyne	EPHX2	18	45
CC(C)(C)OC(=O)N1CCC(NC(=O)N2CC[C@@H]3CC[C@@H](O)[C@@H]32)CC1	ZINC000875085540	FD	On-Demand	Anodyne	GPR119	33	47
O=C(Nc1ncc(Cl)cc1Cl)C1CCS(=O)(=O)CC1	ZINC000875085557	DE	On-Demand	Anodyne	TYK2	47	36
CC(C)(C)OC(=O)N1CCC(NC(=O)N[C@H]2CCC[C@@H]2O)CC1	ZINC000875085561	ED	On-Demand	Anodyne	EPHX2	34	44
CC(C)(C)OC(=O)N1CCC(NC(=O)N[C@H]2CCC[C@@H]2O)CC1	ZINC000875085561	ED	On-Demand	Anodyne	GPR119	43	43
COc1cccc(C(C)(C)C(=O)Nc2nc(C)cc(C)n2)c1	ZINC000875085596	CG	On-Demand	Anodyne	KCNK3	21	40
CN(C)C(=O)C1CCC(C(=O)Nc2ncc(Cl)cc2Cl)CC1	ZINC000875085603	EG	On-Demand	Anodyne	TYK2	47	38
Cc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)Oc1ccc(C(F)(F)F)cc1	ZINC000875085604	IG	On-Demand	Anodyne	SLC6A9	21	44
Cc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)Oc1ccc(C(F)(F)F)cc1	ZINC000875085604	IG	On-Demand	Anodyne	NR1H4	16	44
Cc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)Oc1ccc(C(F)(F)F)cc1	ZINC000875085604	IG	On-Demand	Anodyne	EPHX2	15	54
Cc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)Oc1ccc(C(F)(F)F)cc1	ZINC000875085604	IG	On-Demand	Anodyne	PKM	35	40
COC(=O)C1(O)CN(C(=O)NCc2csc3ccccc23)C1	ZINC000875085615	DD	On-Demand	Anodyne	FFAR2	49	32
CN1CCN(C2CCN(C(=O)N[C@@H](CC(C)(C)C)c3ccccc3)CC2)CC1	ZINC000875085630	GH	On-Demand	Anodyne	CCR5	30	51
CN1CCN(C2CCN(C(=O)N[C@@H](CC(C)(C)C)c3ccccc3)CC2)CC1	ZINC000875085630	GH	On-Demand	Anodyne	CALCRL	40	37
CN1CCN(C2CCN(C(=O)N[C@@H](CC(C)(C)C)c3ccccc3)CC2)CC1	ZINC000875085630	GH	On-Demand	Anodyne	L3MBTL3	66	40
CN1CCN(C2CCN(C(=O)N[C@H](CC(C)(C)C)c3ccccc3)CC2)CC1	ZINC000875085631	GH	On-Demand	Anodyne	CCR5	30	51
CN1CCN(C2CCN(C(=O)N[C@H](CC(C)(C)C)c3ccccc3)CC2)CC1	ZINC000875085631	GH	On-Demand	Anodyne	CALCRL	40	37
CN1CCN(C2CCN(C(=O)N[C@H](CC(C)(C)C)c3ccccc3)CC2)CC1	ZINC000875085631	GH	On-Demand	Anodyne	L3MBTL3	66	40
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1nc(C)cc(C)n1	ZINC000875085644	CF	On-Demand	Anodyne	NQO2	26	41
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1nc(C)cc(C)n1	ZINC000875085644	CF	On-Demand	Anodyne	PPARD	42	42
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1nc(C)cc(C)n1	ZINC000875085644	CF	On-Demand	Anodyne	MTNR1A	25	42
C[C@@H](Oc1ccccc1)C(=O)Oc1ccc(C(F)(F)F)cc1	ZINC000875085656	DI	On-Demand	Anodyne	PPARA	18	51
C[C@@H](Oc1ccccc1)C(=O)Oc1ccc(C(F)(F)F)cc1	ZINC000875085656	DI	On-Demand	Anodyne	PPARD	31	41
C[C@@H](Oc1ccccc1)C(=O)Oc1ccc(C(F)(F)F)cc1	ZINC000875085656	DI	On-Demand	Anodyne	KIF11	15	49
CC(C)(C)OC(=O)N1CCC(NC(=O)N[C@]23CCCC[C@@H]2C3)CC1	ZINC000875085664	EG	On-Demand	Anodyne	EPHX2	25	54
CC(C)(C)OC(=O)N1CCC(NC(=O)N[C@@]23CCCC[C@@H]2C3)CC1	ZINC000875085665	EG	On-Demand	Anodyne	EPHX2	25	54
CC(C)(C)OC(=O)N1CCC(NC(=O)N[C@@]23CCCC[C@H]2C3)CC1	ZINC000875085666	EG	On-Demand	Anodyne	EPHX2	25	54
CC(C)(C)OC(=O)N1CCC(NC(=O)N[C@]23CCCC[C@H]2C3)CC1	ZINC000875085667	EG	On-Demand	Anodyne	EPHX2	25	54
CC(C)(C)OC(=O)N1CCC(NC(=O)NCC[C@H](O)C2CCCC2)CC1	ZINC000875085675	FF	On-Demand	Anodyne	EPHX2	24	47
CC(C)(C)OC(=O)N1CCC(NC(=O)NCC[C@@H](O)C2CCCC2)CC1	ZINC000875085676	FF	On-Demand	Anodyne	EPHX2	24	47
CC(C)(C)OC(=O)N1CCC(NC(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875085682	FE	On-Demand	Anodyne	EPHX2	19	47
CC(C)(C)OC(=O)N1CCC(NC(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875085682	FE	On-Demand	Anodyne	GPR119	39	43
CC(C)(C)OC(=O)N1CCC(NC(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875085683	FE	On-Demand	Anodyne	EPHX2	19	47
CC(C)(C)OC(=O)N1CCC(NC(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875085683	FE	On-Demand	Anodyne	GPR119	39	43
CC(=O)NCCCNC(=O)N1CCC[C@@]1(C)Cc1ccc(C)cc1	ZINC000875085684	EF	On-Demand	Anodyne	SLC12A5	70	44
CC(=O)NCCCNC(=O)N1CCC[C@]1(C)Cc1ccc(C)cc1	ZINC000875085685	EF	On-Demand	Anodyne	SLC12A5	70	44
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000875085695	GE	On-Demand	Anodyne	GPR119	25	41
CN(C(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)[C@@H]1CCCC[C@H]1O	ZINC000875085707	FE	On-Demand	Anodyne	GPR119	33	41
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875085708	FF	On-Demand	Anodyne	GPR119	34	40
CC(C)(C)OC(=O)N1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)CC1	ZINC000875085719	EF	On-Demand	Anodyne	EPHX2	20	48
CC(C)(C)OC(=O)N1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)CC1	ZINC000875085720	EF	On-Demand	Anodyne	EPHX2	20	48
CC(C)(C)OC(=O)N1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)CC1	ZINC000875085721	EF	On-Demand	Anodyne	EPHX2	20	48
CC(C)(C)OC(=O)N1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)CC1	ZINC000875085722	EF	On-Demand	Anodyne	EPHX2	20	48
CC[C@@H]1COCCN1CCNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875085726	GD	On-Demand	Anodyne	EPHX2	15	46
CC(C)(C)OC(=O)N1CCC(NC(=O)N[C@@H]2Cc3cncn3C2)CC1	ZINC000875085761	ED	On-Demand	Anodyne	GPR119	47	43
CC(C)(C)OC(=O)N1CCC(NC(=O)N[C@H]2Cc3cncn3C2)CC1	ZINC000875085796	ED	On-Demand	Anodyne	GPR119	47	43
COC(=O)c1cc(C(=O)Nc2nc(C)cc(C)n2)ccc1C	ZINC000875085804	CE	On-Demand	Anodyne	KCNK3	65	37
COC(=O)c1cc(C(=O)Nc2nc(C)cc(C)n2)ccc1C	ZINC000875085804	CE	On-Demand	Anodyne	KCNK9	45	37
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)[C@H]1CCCO1	ZINC000875085810	GE	On-Demand	Anodyne	DRD2	20	42
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)[C@H]1CCCO1	ZINC000875085810	GE	On-Demand	Anodyne	DRD4	36	40
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)[C@H]1CCCO1	ZINC000875085810	GE	On-Demand	Anodyne	ACHE	58	57
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)[C@H]1CCCO1	ZINC000875085810	GE	On-Demand	Anodyne	HTR4	33	41
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)[C@H]1CCCO1	ZINC000875085810	GE	On-Demand	Anodyne	SIGMAR1	47	42
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)[C@H]1CCCO1	ZINC000875085810	GE	On-Demand	Anodyne	MCHR1	22	44
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)[C@H]1CCCO1	ZINC000875085810	GE	On-Demand	Anodyne	CACNA1I	42	36
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCO1	ZINC000875085812	GE	On-Demand	Anodyne	DRD2	20	42
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCO1	ZINC000875085812	GE	On-Demand	Anodyne	DRD4	36	40
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCO1	ZINC000875085812	GE	On-Demand	Anodyne	ACHE	58	57
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCO1	ZINC000875085812	GE	On-Demand	Anodyne	HTR4	33	41
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCO1	ZINC000875085812	GE	On-Demand	Anodyne	SIGMAR1	47	42
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCO1	ZINC000875085812	GE	On-Demand	Anodyne	MCHR1	22	44
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCO1	ZINC000875085812	GE	On-Demand	Anodyne	CACNA1I	42	36
Cc1ccc(NCCCNC(=O)N2CCC[C@H](C(C)(C)O)C2)nc1	ZINC000875085823	EE	On-Demand	Anodyne	MAP3K12	16	40
Cc1ccc(NCCCNC(=O)N2CCC[C@@H](C(C)(C)O)C2)nc1	ZINC000875085825	EE	On-Demand	Anodyne	MAP3K12	16	40
CC(C)(C)OC(=O)N1CCC(NC(=O)N2CC=CC2)CC1	ZINC000875085852	CD	On-Demand	Anodyne	EPHX2	24	47
CC(C)(C)OC(=O)N1CCC(NC(=O)N2CC=CC2)CC1	ZINC000875085852	CD	On-Demand	Anodyne	GPR119	41	44
O=C(Nc1ncc(Cl)cc1Cl)c1ccccc1N1CCOCC1	ZINC000875085854	FG	On-Demand	Anodyne	MAPK9	38	42
O=C(Nc1ncc(Cl)cc1Cl)c1ccccc1N1CCOCC1	ZINC000875085854	FG	On-Demand	Anodyne	MAPK10	41	42
O=C(Nc1ncc(Cl)cc1Cl)c1ccccc1N1CCOCC1	ZINC000875085854	FG	On-Demand	Anodyne	SCN10A	15	43
O=C(Nc1ncc(Cl)cc1Cl)c1ccccc1N1CCOCC1	ZINC000875085854	FG	On-Demand	Anodyne	EPHB3	39	44
O=C(Nc1ncc(Cl)cc1Cl)c1ccccc1N1CCOCC1	ZINC000875085854	FG	On-Demand	Anodyne	STAT6	52	38
CC(=O)NCCCNC(=O)N1CCC[C@]1(C)Cc1ccc(F)c(F)c1	ZINC000875085872	FF	On-Demand	Anodyne	SLC12A5	60	40
CC(=O)NCCCNC(=O)N1CCC[C@@]1(C)Cc1ccc(F)c(F)c1	ZINC000875085874	FF	On-Demand	Anodyne	SLC12A5	60	40
CC(C)(C)OC(=O)N1CCC(NC(=O)NCC[C@@H](O)C(F)F)CC1	ZINC000875085883	FD	On-Demand	Anodyne	EPHX2	25	40
CC(C)(C)OC(=O)N1CCC(NC(=O)NCC[C@H](O)C(F)F)CC1	ZINC000875085884	FD	On-Demand	Anodyne	EPHX2	25	40
O=C(NCc1ccc(-n2cccn2)cc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875085888	FH	On-Demand	Anodyne	EPHX2	21	41
O=C(NCc1ccc(-n2cccn2)cc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875085888	FH	On-Demand	Anodyne	AMP1_PLAFQ	41	34
O=C(NCc1ccc(-n2cccn2)cc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875085889	FH	On-Demand	Anodyne	EPHX2	21	41
O=C(NCc1ccc(-n2cccn2)cc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875085889	FH	On-Demand	Anodyne	AMP1_PLAFQ	41	34
O=C(NCc1ccc(-n2cccn2)cc1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875085906	FE	On-Demand	Anodyne	AMP1_PLAFQ	45	33
O=C(NCc1ccc(-n2cccn2)cc1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875085908	FE	On-Demand	Anodyne	AMP1_PLAFQ	45	33
CC(=O)Nc1cccc(C(=O)Oc2ccc(C(F)(F)F)cc2)c1	ZINC000875085939	DH	On-Demand	Anodyne	TRPV1	19	46
CC(=O)Nc1cccc(C(=O)Oc2ccc(C(F)(F)F)cc2)c1	ZINC000875085939	DH	On-Demand	Anodyne	EPHX2	30	49
CC(=O)Nc1cccc(C(=O)Oc2ccc(C(F)(F)F)cc2)c1	ZINC000875085939	DH	On-Demand	Anodyne	ACR	76	53
CC(=O)Nc1cccc(C(=O)Oc2ccc(C(F)(F)F)cc2)c1	ZINC000875085939	DH	On-Demand	Anodyne	AKR1C3	33	50
CC(=O)Nc1cccc(C(=O)Oc2ccc(C(F)(F)F)cc2)c1	ZINC000875085939	DH	On-Demand	Anodyne	IMDH_CRYPV	43	36
CC(=O)Nc1cccc(C(=O)Oc2ccc(C(F)(F)F)cc2)c1	ZINC000875085939	DH	On-Demand	Anodyne	KCNK3	113	48
CC(=O)Nc1cccc(C(=O)Oc2ccc(C(F)(F)F)cc2)c1	ZINC000875085939	DH	On-Demand	Anodyne	KCNK9	70	36
CC[C@@H](NC(=O)NCCCNC(C)=O)[C@@H](O)c1ccccc1	ZINC000875085942	DD	On-Demand	Anodyne	C3AR1	44	32
CC[C@@H](NC(=O)NCCCNC(C)=O)[C@@H](O)c1ccccc1	ZINC000875085942	DD	On-Demand	Anodyne	MTNR1B	28	42
CC[C@@H](NC(=O)NCCCNC(C)=O)[C@H](O)c1ccccc1	ZINC000875085944	DD	On-Demand	Anodyne	C3AR1	44	32
CC[C@@H](NC(=O)NCCCNC(C)=O)[C@H](O)c1ccccc1	ZINC000875085944	DD	On-Demand	Anodyne	MTNR1B	28	42
CC(=O)NCCCNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875085951	ED	On-Demand	Anodyne	SCN2A	15	43
CC(=O)NCCCNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875085951	ED	On-Demand	Anodyne	FAAH	15	40
CC(C)(C)OC(=O)N1CCC(NC(=O)NCCN2CC[C@H](O)C2)CC1	ZINC000875085952	FC	On-Demand	Anodyne	CACNA1H	17	42
CC(C)(C)OC(=O)N1CCC(NC(=O)NCCN2CC[C@H](O)C2)CC1	ZINC000875085952	FC	On-Demand	Anodyne	EPHX2	21	48
CC(C)(C)OC(=O)N1CCC(NC(=O)NCCN2CC[C@@H](O)C2)CC1	ZINC000875085953	FC	On-Demand	Anodyne	CACNA1H	17	42
CC(C)(C)OC(=O)N1CCC(NC(=O)NCCN2CC[C@@H](O)C2)CC1	ZINC000875085953	FC	On-Demand	Anodyne	EPHX2	21	48
CC(C)(C)OC(=O)N1CCC(NC(=O)N2CC[C@H](c3ccc(O)cc3)C2)CC1	ZINC000875085972	GG	On-Demand	Anodyne	EPHX2	28	44
CC(C)(C)OC(=O)N1CCC(NC(=O)N2CC[C@H](c3ccc(O)cc3)C2)CC1	ZINC000875085972	GG	On-Demand	Anodyne	GPR119	46	44
CC(C)(C)OC(=O)N1CCC(NC(=O)N2CC[C@@H](c3ccc(O)cc3)C2)CC1	ZINC000875085973	GG	On-Demand	Anodyne	EPHX2	28	44
CC(C)(C)OC(=O)N1CCC(NC(=O)N2CC[C@@H](c3ccc(O)cc3)C2)CC1	ZINC000875085973	GG	On-Demand	Anodyne	GPR119	46	44
O=C(Nc1ncc(Cl)cc1Cl)[C@H]1CCCN1C(=O)OCC(F)(F)F	ZINC000875085977	GG	On-Demand	Anodyne	LGMN	71	39
O=C(Nc1ncc(Cl)cc1Cl)[C@@H]1CCCN1C(=O)OCC(F)(F)F	ZINC000875085978	GG	On-Demand	Anodyne	LGMN	71	39
CC(C)(C)C[C@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1ccccc1	ZINC000875085989	FG	On-Demand	Anodyne	CACNA1H	29	43
CC(C)(C)C[C@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1ccccc1	ZINC000875085989	FG	On-Demand	Anodyne	GHRHR	71	36
CC(C)(C)C[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1ccccc1	ZINC000875085990	FG	On-Demand	Anodyne	CACNA1H	29	43
CC(C)(C)C[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1ccccc1	ZINC000875085990	FG	On-Demand	Anodyne	GHRHR	71	36
O=C(NCc1ccc(-n2cccn2)cc1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875086015	GF	On-Demand	Anodyne	NAMPT	24	42
C[C@H](NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1)[C@H]1CCCO1	ZINC000875086025	GD	On-Demand	Anodyne	ETHR	60	45
C[C@H](NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1)[C@@H]1CCCO1	ZINC000875086027	GD	On-Demand	Anodyne	ETHR	60	45
C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875086030	FE	On-Demand	Anodyne	GPR119	37	40
C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875086034	FE	On-Demand	Anodyne	GPR119	37	40
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875086035	FE	On-Demand	Anodyne	GPR119	37	40
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCNC(C)=O)C[C@@H]1C2	ZINC000875086036	CC	On-Demand	Anodyne	EPHX2	19	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(-n3cccn3)cc2)C1	ZINC000875086041	FE	On-Demand	Anodyne	AMP1_PLAFQ	53	38
COc1ccccc1[C@H]1CCCN(C(=O)NCCCNC(C)=O)CC1	ZINC000875086054	EF	On-Demand	Anodyne	HTR1A	30	43
COc1ccccc1[C@H]1CCCN(C(=O)NCCCNC(C)=O)CC1	ZINC000875086054	EF	On-Demand	Anodyne	DRD2	35	45
COc1ccccc1[C@H]1CCCN(C(=O)NCCCNC(C)=O)CC1	ZINC000875086054	EF	On-Demand	Anodyne	DRD4	19	45
COc1ccccc1[C@H]1CCCN(C(=O)NCCCNC(C)=O)CC1	ZINC000875086054	EF	On-Demand	Anodyne	ADRA1D	21	40
COc1ccccc1[C@H]1CCCN(C(=O)NCCCNC(C)=O)CC1	ZINC000875086054	EF	On-Demand	Anodyne	ADRA1A	20	40
COc1ccccc1[C@H]1CCCN(C(=O)NCCCNC(C)=O)CC1	ZINC000875086054	EF	On-Demand	Anodyne	ADRA1B	15	40
COc1ccccc1[C@H]1CCCN(C(=O)NCCCNC(C)=O)CC1	ZINC000875086054	EF	On-Demand	Anodyne	MTNR1B	35	40
COc1ccccc1[C@H]1CCCN(C(=O)NCCCNC(C)=O)CC1	ZINC000875086054	EF	On-Demand	Anodyne	RBP4	34	41
COc1ccccc1[C@H]1CCCN(C(=O)NCCCNC(C)=O)CC1	ZINC000875086054	EF	On-Demand	Anodyne	ACKR3	41	30
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCNC(C)=O)CC1	ZINC000875086056	EF	On-Demand	Anodyne	HTR1A	30	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCNC(C)=O)CC1	ZINC000875086056	EF	On-Demand	Anodyne	DRD2	35	45
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCNC(C)=O)CC1	ZINC000875086056	EF	On-Demand	Anodyne	DRD4	19	45
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCNC(C)=O)CC1	ZINC000875086056	EF	On-Demand	Anodyne	ADRA1D	21	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCNC(C)=O)CC1	ZINC000875086056	EF	On-Demand	Anodyne	ADRA1A	20	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCNC(C)=O)CC1	ZINC000875086056	EF	On-Demand	Anodyne	ADRA1B	15	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCNC(C)=O)CC1	ZINC000875086056	EF	On-Demand	Anodyne	MTNR1B	35	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCNC(C)=O)CC1	ZINC000875086056	EF	On-Demand	Anodyne	RBP4	34	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCNC(C)=O)CC1	ZINC000875086056	EF	On-Demand	Anodyne	ACKR3	41	30
O=C(NCC[C@@H](O)C1CCCC1)NCc1ccc(-n2cccn2)cc1	ZINC000875086063	EF	On-Demand	Anodyne	AMP1_PLAFQ	53	37
O=C(NCC[C@H](O)C1CCCC1)NCc1ccc(-n2cccn2)cc1	ZINC000875086064	EF	On-Demand	Anodyne	AMP1_PLAFQ	53	37
CC(C)(C)OC(=O)N1CCC(NC(=O)N2Cc3cccc(O)c3C2)CC1	ZINC000875086107	FF	On-Demand	Clean	EPHX2	32	45
CC(C)(C)OC(=O)N1CCC(NC(=O)N2Cc3cccc(O)c3C2)CC1	ZINC000875086107	FF	On-Demand	Clean	GPR119	39	43
CC(=O)NCCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875086114	DD	On-Demand	Anodyne	ACE	46	43
CC(=O)NCCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875086114	DD	On-Demand	Anodyne	TRY1_BOVIN	52	37
CC(=O)NCCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875086114	DD	On-Demand	Anodyne	PREP	41	40
CC(=O)NCCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875086116	DD	On-Demand	Anodyne	ACE	46	43
CC(=O)NCCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875086116	DD	On-Demand	Anodyne	TRY1_BOVIN	52	37
CC(=O)NCCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875086116	DD	On-Demand	Anodyne	PREP	41	40
CC(=O)NCCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875086117	DD	On-Demand	Anodyne	ACE	46	43
CC(=O)NCCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875086117	DD	On-Demand	Anodyne	TRY1_BOVIN	52	37
CC(=O)NCCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875086117	DD	On-Demand	Anodyne	PREP	41	40
CC(=O)NCCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875086119	DD	On-Demand	Anodyne	ACE	46	43
CC(=O)NCCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875086119	DD	On-Demand	Anodyne	TRY1_BOVIN	52	37
CC(=O)NCCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875086119	DD	On-Demand	Anodyne	PREP	41	40
CN(C)C[C@@H]1CN(C(=O)NCc2ccc(-n3cccn3)cc2)C[C@H]1CN(C)C	ZINC000875086135	GD	On-Demand	Anodyne	AMP1_PLAFQ	52	37
O=C(NCCO)C1CCN(C(=O)NCc2ccc(-n3cccn3)cc2)CC1	ZINC000875086145	FC	On-Demand	Anodyne	AMP1_PLAFQ	41	37
Cn1nnnc1C1CCN(C(=O)N[C@@H](CC(C)(C)C)c2ccc(F)cc2)CC1	ZINC000875086152	GG	On-Demand	Anodyne	CCR3	54	34
Cn1nnnc1C1CCN(C(=O)N[C@H](CC(C)(C)C)c2ccc(F)cc2)CC1	ZINC000875086153	GG	On-Demand	Anodyne	CCR3	54	34
COC(=O)c1ccc(OC)c2c1CCN(C(=O)NCCCNC(C)=O)C2	ZINC000875086162	FD	On-Demand	Anodyne	MTNR1A	22	41
COC(=O)c1ccc(OC)c2c1CCN(C(=O)NCCCNC(C)=O)C2	ZINC000875086162	FD	On-Demand	Anodyne	MTNR1B	26	41
CC(C)(C)OC(=O)N1CCC(NC(=O)NC2CN(c3ccncn3)C2)CC1	ZINC000875086173	GD	On-Demand	Anodyne	GRIN2B	18	43
CC(C)(C)OC(=O)N1CCC(NC(=O)NC2CN(c3ccncn3)C2)CC1	ZINC000875086173	GD	On-Demand	Anodyne	GPR119	55	69
CC(C)(C)OC(=O)N1CCC(NC(=O)N[C@@H]2C[C@H](CO)C2)CC1	ZINC000875086180	ED	On-Demand	Anodyne	EPHX2	35	45
CC(C)(C)OC(=O)N1CCC(NC(=O)N[C@@H]2C[C@H](CO)C2)CC1	ZINC000875086180	ED	On-Demand	Anodyne	GPR119	35	40
COc1ccc(N2CCN(C(=O)C(=O)NCc3c[nH]nc3C)CC2)c(OC)c1	ZINC000875086221	GC	On-Demand	Clean	DRD3	46	37
CC(=O)NCCCNC(=O)NNc1cccc(C)n1	ZINC000875086222	CC	On-Demand	Reactive	MTNR1A	43	42
CC(=O)NCCCNC(=O)NNc1cccc(C)n1	ZINC000875086222	CC	On-Demand	Reactive	MTNR1B	41	42
CC(=O)NCCCNC(=O)NNc1cccc(C)n1	ZINC000875086222	CC	On-Demand	Reactive	GRM5	18	42
O=C(Nc1ncc(Cl)cc1Cl)C1CCN(C2CC2)CC1	ZINC000875086227	DG	On-Demand	Anodyne	TYK2	46	37
CN1C(=O)CC[C@H]1C(=O)Nc1ncc(Cl)cc1Cl	ZINC000875086238	CD	On-Demand	Anodyne	P2RX7	52	57
CC(=O)C1CCN(C(=O)NCCNc2ncc(Cl)cc2Cl)CC1	ZINC000875086255	FF	On-Demand	Anodyne	EPHX2	18	46
CC[C@H](C[C@H](C)O)NC(=O)NCc1csc2ccccc12	ZINC000875086268	DG	On-Demand	Anodyne	ANPEP	15	44
CC[C@H](C[C@H](C)O)NC(=O)NCc1csc2ccccc12	ZINC000875086268	DG	On-Demand	Anodyne	MMP8	15	42
CC(C)(C)OC(=O)N1CCC(NC(=O)N[C@]23C[C@H]2COC3(C)C)CC1	ZINC000875086285	FE	On-Demand	Anodyne	EPHX2	18	52
CC(C)(C)OC(=O)N1CCC(NC(=O)N[C@]23C[C@@H]2COC3(C)C)CC1	ZINC000875086286	FE	On-Demand	Anodyne	EPHX2	18	52
CC(C)(C)OC(=O)N1CCC(NC(=O)N[C@@]23C[C@H]2COC3(C)C)CC1	ZINC000875086287	FE	On-Demand	Anodyne	EPHX2	18	52
CC(C)(C)OC(=O)N1CCC(NC(=O)N[C@@]23C[C@@H]2COC3(C)C)CC1	ZINC000875086288	FE	On-Demand	Anodyne	EPHX2	18	52
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(-n2cccn2)cc1	ZINC000875086289	FE	On-Demand	Anodyne	SLC6A3	45	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(-n2cccn2)cc1	ZINC000875086290	FE	On-Demand	Anodyne	SLC6A3	45	38
CCCCCCCNC(=O)C(=O)NCc1c[nH]nc1C	ZINC000875086315	CD	On-Demand	Mild	ASAH1	95	38
O=C(NCc1ccc(-n2cccn2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875086338	DD	On-Demand	Anodyne	AMP1_PLAFQ	54	39
O=C(NCc1ccc(-n2cccn2)cc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875086359	DF	On-Demand	Anodyne	AMP1_PLAFQ	50	36
O=C(NCc1ccc(-n2cccn2)cc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875086360	DF	On-Demand	Anodyne	AMP1_PLAFQ	50	36
O=C(NCc1ccc(-n2cccn2)cc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875086361	DF	On-Demand	Anodyne	AMP1_PLAFQ	50	36
CN(Cc1ccns1)C(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875086371	FF	On-Demand	Anodyne	GPR119	44	40
CC(C)(C)OC(=O)N1CCC(NC(=O)N2CCC[C@H](C(C)(C)O)C2)CC1	ZINC000875086373	FF	On-Demand	Anodyne	GPR119	32	43
CC(C)(C)OC(=O)N1CCC(NC(=O)N2CCC[C@@H](C(C)(C)O)C2)CC1	ZINC000875086374	FF	On-Demand	Anodyne	GPR119	32	43
CC(C)(C)OC(=O)N1CCC(NC(=O)N[C@H]2Cc3ccccc3NC2=O)CC1	ZINC000875086375	GE	On-Demand	Anodyne	GPR119	38	40
CC(C)(C)OC(=O)N1CCC(NC(=O)N[C@H]2Cc3ccccc3NC2=O)CC1	ZINC000875086375	GE	On-Demand	Anodyne	SFRP1	59	41
CC(C)(C)OC(=O)N1CCC(NC(=O)N[C@@H]2Cc3ccccc3NC2=O)CC1	ZINC000875086376	GE	On-Demand	Anodyne	GPR119	38	40
CC(C)(C)OC(=O)N1CCC(NC(=O)N[C@@H]2Cc3ccccc3NC2=O)CC1	ZINC000875086376	GE	On-Demand	Anodyne	SFRP1	59	41
CC(C)(C)OC(=O)N1CCC(NC(=O)NC[C@H]2C[C@H](O)C2)CC1	ZINC000875086377	ED	On-Demand	Anodyne	CACNA1I	41	33
CC(C)(C)OC(=O)N1CCC(NC(=O)NC[C@H]2C[C@H](O)C2)CC1	ZINC000875086377	ED	On-Demand	Anodyne	GPR119	34	40
CC(C)(C)OC(=O)N1CCC(NC(=O)NC[C@@H]2C[C@H](O)C2)CC1	ZINC000875086378	ED	On-Demand	Anodyne	CACNA1I	41	33
CC(C)(C)OC(=O)N1CCC(NC(=O)NC[C@@H]2C[C@H](O)C2)CC1	ZINC000875086378	ED	On-Demand	Anodyne	GPR119	34	40
CC(C)(C)OC(=O)N1CCC(NC(=O)NCC2CC(O)C2)CC1	ZINC000875086379	ED	On-Demand	Anodyne	CACNA1I	41	33
CC(C)(C)OC(=O)N1CCC(NC(=O)NCC2CC(O)C2)CC1	ZINC000875086379	ED	On-Demand	Anodyne	GPR119	34	40
COc1ccccc1[C@@H]1CSCCCN1C(=O)NCCCNC(C)=O	ZINC000875086385	FE	On-Demand	Anodyne	HTR1A	21	41
CC(C)(C)OC(=O)N1CCC(NC(=O)N2CC(Cc3cccs3)C2)CC1	ZINC000875086427	GG	On-Demand	Anodyne	EPHX2	18	42
CC(C)(C)OC(=O)N1CCC(NC(=O)N2CC(Cc3cccs3)C2)CC1	ZINC000875086427	GG	On-Demand	Anodyne	GPR119	42	40
CONC(=O)C1CCN(C(=O)NCCNc2ncc(Cl)cc2Cl)CC1	ZINC000875086456	GD	On-Demand	Anodyne	EPHX2	19	49
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(C(=O)OC(C)(C)C)CC3)C[C@@H]1C2	ZINC000875086458	GE	On-Demand	Anodyne	EPHX2	25	53
CC(=O)NCCCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875086459	ED	On-Demand	Anodyne	MTNR1A	41	41
CC(=O)NCCCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875086459	ED	On-Demand	Anodyne	MTNR1B	40	41
CC(=O)NCCCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875086460	ED	On-Demand	Anodyne	MTNR1A	41	41
CC(=O)NCCCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875086460	ED	On-Demand	Anodyne	MTNR1B	40	41
O=C(NCc1ccc(-n2cccn2)cc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875086462	DF	On-Demand	Anodyne	AMP1_PLAFQ	50	36
C[C@H](NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)[C@@H]1CCCO1	ZINC000875086483	ED	On-Demand	Anodyne	OXTR	59	39
C[C@H](NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)[C@H]1CCCO1	ZINC000875086484	ED	On-Demand	Anodyne	OXTR	59	39
C[C@H](NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)[C@H]1CCCO1	ZINC000875086485	ED	On-Demand	Anodyne	OXTR	59	39
C[C@H](NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)[C@@H]1CCCO1	ZINC000875086486	ED	On-Demand	Anodyne	OXTR	59	39
C[C@@H](NC(=O)NCc1ccc(-n2cccn2)cc1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875086522	GF	On-Demand	Anodyne	AMP1_PLAFQ	55	43
C[C@@H](NC(=O)NCc1ccc(-n2cccn2)cc1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875086522	GF	On-Demand	Anodyne	GPR119	17	42
O=C(NCc1csc2ccccc12)N1CCC(CO)(CO)CC1	ZINC000875086531	EE	On-Demand	Anodyne	FFAR2	69	37
CC(=O)NCCCNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875086561	ED	On-Demand	Anodyne	OPRL1	18	46
CC(C)(C)OC(=O)N1CCC(NC(=O)NC(C)(C)[C@@H]2CCCCO2)CC1	ZINC000875086562	FG	On-Demand	Anodyne	EPHX2	18	44
CC(C)(C)OC(=O)N1CCC(NC(=O)NC(C)(C)[C@H]2CCCCO2)CC1	ZINC000875086564	FG	On-Demand	Anodyne	EPHX2	18	44
COC(=O)C1=NO[C@]2(CCN(C(=O)NCc3csc4ccccc34)C2)C1	ZINC000875086568	FF	On-Demand	Anodyne	FFAR2	49	32
O=C(Nc1ncc(Cl)cc1Cl)c1cn2c(n1)CCCC2	ZINC000875086569	DG	On-Demand	Anodyne	CNR1	51	31
COC(=O)C1=NO[C@@]2(CCN(C(=O)NCc3csc4ccccc34)C2)C1	ZINC000875086570	FF	On-Demand	Anodyne	FFAR2	49	32
O=C(NCc1ccc(-n2cccn2)cc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875086573	FF	On-Demand	Anodyne	AMP1_PLAFQ	41	33
O=C(NCc1ccc(-n2cccn2)cc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875086575	FF	On-Demand	Anodyne	AMP1_PLAFQ	41	33
CC(=O)NCCCNC(=O)N(C)C[C@H]1CCCCN1Cc1ccccc1	ZINC000875086598	FE	On-Demand	Anodyne	SIGMAR1	23	48
CC(C)(C)OC(=O)N1CCC(NC(=O)N2C[C@H](O)C[C@H]2C2CC2)CC1	ZINC000875086606	FD	On-Demand	Anodyne	GPR119	21	40
CC(C)(C)OC(=O)N1CCC(NC(=O)N2C[C@@H](O)C[C@H]2C2CC2)CC1	ZINC000875086607	FD	On-Demand	Anodyne	GPR119	21	40
CC(C)(C)OC(=O)N1CCC(NC(=O)N2C[C@H](O)C[C@@H]2C2CC2)CC1	ZINC000875086608	FD	On-Demand	Anodyne	GPR119	21	40
CC(C)(C)OC(=O)N1CCC(NC(=O)N2C[C@@H](O)C[C@@H]2C2CC2)CC1	ZINC000875086609	FD	On-Demand	Anodyne	GPR119	21	40
CC(C)(C)OC(=O)N1CCC(NC(=O)NC(C)(C)C(C)(C)O)CC1	ZINC000875086633	EE	On-Demand	Anodyne	EPHX2	29	41
CC(C)(C)OC(=O)N1CCC(NC(=O)NC(C)(C)C(C)(C)O)CC1	ZINC000875086633	EE	On-Demand	Anodyne	GPR119	33	40
NC(=O)c1ccc(N2CCN(C(=O)N[C@H]3CCc4ccc(Cl)cc43)CC2)nc1	ZINC000875086635	GE	On-Demand	Anodyne	HTR2A	20	40
NC(=O)c1ccc(N2CCN(C(=O)N[C@@H]3CCc4ccc(Cl)cc43)CC2)nc1	ZINC000875086636	GE	On-Demand	Anodyne	HTR2A	20	40
CC(C)(C)OC(=O)N1CCC(NC(=O)N2CC(c3ccccc3)C2)CC1	ZINC000875086638	FG	On-Demand	Anodyne	EPHX2	55	47
CC(C)(C)OC(=O)N1CCC(NC(=O)N2CC(c3ccccc3)C2)CC1	ZINC000875086638	FG	On-Demand	Anodyne	CCR8	29	45
CC(C)(C)OC(=O)N1CCC(NC(=O)N2CC(c3ccccc3)C2)CC1	ZINC000875086638	FG	On-Demand	Anodyne	GPR119	45	45
CC(C)(C)OC(=O)N1CCC(NC(=O)N2CC(c3ccccc3)C2)CC1	ZINC000875086638	FG	On-Demand	Anodyne	SFRP1	84	43
CC(C)(C)OC(=O)N1CCC(NC(=O)N2CC(c3ccccc3)C2)CC1	ZINC000875086638	FG	On-Demand	Anodyne	WNT3	69	39
CC(=O)NCCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875086647	FE	On-Demand	Reactive	TSHR	59	36
CC(=O)NCCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875086647	FE	On-Demand	Reactive	MAOB	31	42
CC(=O)NCCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875086647	FE	On-Demand	Reactive	LTA4H	42	49
CC(=O)NCCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875086647	FE	On-Demand	Reactive	CA1	18	49
CC(=O)NCCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875086647	FE	On-Demand	Reactive	SCN2A	28	46
CC(=O)NCCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875086647	FE	On-Demand	Reactive	MTNR1A	57	55
CC(=O)NCCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875086647	FE	On-Demand	Reactive	MTNR1B	55	55
CC(=O)NCCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875086647	FE	On-Demand	Reactive	FFAR1	37	43
CC[C@@H](NC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000875086674	GG	On-Demand	Anodyne	GRIN2B	17	40
CC[C@@H](NC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000875086674	GG	On-Demand	Anodyne	EPHX2	39	42
CC[C@@H](NC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000875086674	GG	On-Demand	Anodyne	CCR8	29	41
CC[C@@H](NC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000875086674	GG	On-Demand	Anodyne	GPR119	39	43
CC[C@@H](NC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)[C@H](O)c1ccccc1	ZINC000875086675	GG	On-Demand	Anodyne	GRIN2B	17	40
CC[C@@H](NC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)[C@H](O)c1ccccc1	ZINC000875086675	GG	On-Demand	Anodyne	EPHX2	39	42
CC[C@@H](NC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)[C@H](O)c1ccccc1	ZINC000875086675	GG	On-Demand	Anodyne	CCR8	29	41
CC[C@@H](NC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)[C@H](O)c1ccccc1	ZINC000875086675	GG	On-Demand	Anodyne	GPR119	39	43
CC(C)(C)C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccc(F)cc1	ZINC000875086740	GF	On-Demand	Anodyne	CACNA1G	37	40
CC(C)(C)C[C@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccc(F)cc1	ZINC000875086741	GF	On-Demand	Anodyne	CACNA1G	37	40
CC(=O)NCCCNC(=O)NC1CC(Nc2ccccc2)C1	ZINC000875086749	DD	On-Demand	Anodyne	EPHX2	23	43
O=C(NCc1ccc(-n2cccn2)cc1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875086806	GD	On-Demand	Anodyne	AMP1_PLAFQ	46	34
O=C(Nc1ncc(Cl)cc1Cl)c1cnc2n1CCCCC2	ZINC000875086809	EH	On-Demand	Anodyne	CNR1	50	31
CCOC(=O)CCCNC(=O)N[C@H](CC)[C@H](O)c1ccccc1	ZINC000875086834	DE	On-Demand	Anodyne	C3AR1	46	34
CCOC(=O)CCCNC(=O)N[C@@H](CC)[C@H](O)c1ccccc1	ZINC000875086835	DE	On-Demand	Anodyne	C3AR1	46	34
CCOC(=O)CCCNC(=O)N[C@@H](CC)[C@@H](O)c1ccccc1	ZINC000875086836	DE	On-Demand	Anodyne	C3AR1	46	34
CCOC(=O)CCCNC(=O)N[C@H](CC)[C@@H](O)c1ccccc1	ZINC000875086837	DE	On-Demand	Anodyne	C3AR1	46	34
CC(C)(C)OC(=O)N1CCC(NC(=O)N2CC(Cc3ccco3)C2)CC1	ZINC000875086883	FF	On-Demand	Anodyne	EPHX2	20	42
COc1ccc(OCCC(=O)Oc2ccc(C(F)(F)F)cc2)cc1	ZINC000875086975	EI	On-Demand	Anodyne	PPARD	50	43
COc1ccc(OCCC(=O)Oc2ccc(C(F)(F)F)cc2)cc1	ZINC000875086975	EI	On-Demand	Anodyne	LIPE	22	45
CCOC(=O)CCCNC(=O)N[C@@H]1C[C@H]2C[C@@]2(C(=O)OC)C1	ZINC000875086986	DC	On-Demand	Anodyne	EPHX2	26	49
O=C1CCN(C(=O)NCc2ccc(-n3cccn3)cc2)CCCCCCN1	ZINC000875086988	FE	On-Demand	Anodyne	AMP1_PLAFQ	41	34
CCOC(=O)CCCNC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875086992	EE	On-Demand	Anodyne	EPHX2	24	46
CCOC(=O)CCCNC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875086993	EE	On-Demand	Anodyne	EPHX2	24	46
CN(C)C[C@@H]1CN(C(=O)NCc2csc3ccccc23)C[C@H]1CN(C)C	ZINC000875087014	FF	On-Demand	Anodyne	FFAR2	49	32
COCCN(CC1CCN(C)CC1)C(=O)NCc1csc2ccccc12	ZINC000875087027	GG	On-Demand	Anodyne	FFAR2	59	33
C[C@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)[C@H]1CCCO1	ZINC000875087041	FB	On-Demand	Anodyne	L3MBTL3	68	43
C[C@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)[C@@H]1CCCO1	ZINC000875087042	FB	On-Demand	Anodyne	L3MBTL3	68	43
CONC(=O)C1CCN(C(=O)N[C@@H](CC(C)(C)C)c2ccccc2)CC1	ZINC000875087066	FG	On-Demand	Anodyne	CCR5	28	41
CONC(=O)C1CCN(C(=O)N[C@@H](CC(C)(C)C)c2ccccc2)CC1	ZINC000875087066	FG	On-Demand	Anodyne	AMY2	57	34
CONC(=O)C1CCN(C(=O)N[C@H](CC(C)(C)C)c2ccccc2)CC1	ZINC000875087067	FG	On-Demand	Anodyne	CCR5	28	41
CONC(=O)C1CCN(C(=O)N[C@H](CC(C)(C)C)c2ccccc2)CC1	ZINC000875087067	FG	On-Demand	Anodyne	AMY2	57	34
O=C(Nc1ncc(Cl)cc1Cl)c1cc2n(n1)CCCC2	ZINC000875087072	DG	On-Demand	Anodyne	CNR1	52	32
Cc1ccc(C(C)(C)CNC(=O)C(=O)NCc2ccc(N3CCCC3)cc2)nc1	ZINC000875087106	GF	On-Demand	Clean	NAMPT	49	34
CCOC(=O)CCCNC(=O)NNc1cccc(C)n1	ZINC000875087131	CD	On-Demand	Reactive	GRM5	15	41
CC(C)n1ncc(C(=O)Nc2ccccc2S(C)(=O)=O)c1Cl	ZINC000875087169	EF	On-Demand	Anodyne	EPHB3	48	40
CCOC(=O)CCCNC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875087172	CC	On-Demand	Anodyne	EPHX2	27	52
CCOC(=O)CCCNC(=O)N1CCCC[C@@H]1CNC(=O)NC	ZINC000875087185	EC	On-Demand	Anodyne	EPHX2	15	45
CCOC(=O)CCCNC(=O)N1CCCC[C@H]1CNC(=O)NC	ZINC000875087186	EC	On-Demand	Anodyne	EPHX2	15	45
CCOC(=O)CCCNC(=O)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875087247	CD	On-Demand	Anodyne	EPHX2	17	47
CCOC(=O)CCCNC(=O)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875087249	CD	On-Demand	Anodyne	EPHX2	17	47
CCOC(=O)CCCNC(=O)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875087250	CD	On-Demand	Anodyne	EPHX2	17	47
CCOC(=O)CCCNC(=O)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875087252	CD	On-Demand	Anodyne	EPHX2	17	47
O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@H](c1ccccn1)C1CCC1	ZINC000875087255	GF	On-Demand	Clean	TTK	27	40
O=C(NCc1ccc(N2CCCC2)cc1)C(=O)N[C@@H](c1ccccn1)C1CCC1	ZINC000875087256	GF	On-Demand	Clean	TTK	27	40
CC[C@@H](C(=O)Nc1nc(C)cc(C)n1)c1ccc(Br)cc1	ZINC000875087316	EH	On-Demand	Anodyne	KCNQ2	47	40
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H](C)[C@H]1CCCO1)CC2	ZINC000875087317	GD	On-Demand	Anodyne	SLC18A2	46	33
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H](C)[C@H]1CCCO1)CC2	ZINC000875087318	GD	On-Demand	Anodyne	SLC18A2	46	33
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H](C)[C@@H]1CCCO1)CC2	ZINC000875087319	GD	On-Demand	Anodyne	SLC18A2	46	33
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H](C)[C@@H]1CCCO1)CC2	ZINC000875087320	GD	On-Demand	Anodyne	SLC18A2	46	33
O=C(NCCc1cn2c(n1)CCCC2)C(=O)NCc1cccc2ncccc12	ZINC000875087354	GD	On-Demand	Anodyne	HNMT	60	33
O=C(NCc1ccc(-n2cccn2)cc1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875087371	FH	On-Demand	Anodyne	AMP1_PLAFQ	51	35
CO[C@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)Nc2ncccn2)C1	ZINC000875087488	FE	On-Demand	Anodyne	GRIN2B	22	45
CO[C@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)Nc2ncccn2)C1	ZINC000875087488	FE	On-Demand	Anodyne	SLC12A5	55	37
CO[C@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)Nc2ncccn2)C1	ZINC000875087489	FE	On-Demand	Anodyne	GRIN2B	22	45
CO[C@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)Nc2ncccn2)C1	ZINC000875087489	FE	On-Demand	Anodyne	SLC12A5	55	37
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)Nc2ncccn2)C1	ZINC000875087490	FE	On-Demand	Anodyne	GRIN2B	22	45
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)Nc2ncccn2)C1	ZINC000875087490	FE	On-Demand	Anodyne	SLC12A5	55	37
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)Nc2ncccn2)C1	ZINC000875087491	FE	On-Demand	Anodyne	GRIN2B	22	45
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)Nc2ncccn2)C1	ZINC000875087491	FE	On-Demand	Anodyne	SLC12A5	55	37
O=C(NCc1cccc2ncccc12)C(=O)NC[C@@H]1CCN(C2CC2)C1	ZINC000875087508	FD	On-Demand	Anodyne	CCR3	20	43
O=C(NCc1cccc2ncccc12)C(=O)NC[C@H]1CCN(C2CC2)C1	ZINC000875087509	FD	On-Demand	Anodyne	CCR3	20	43
CCC(CC)[C@H](NC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)c1ccccc1	ZINC000875087516	GI	On-Demand	Anodyne	ETHR	58	35
CCC(CC)[C@H](NC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)c1ccccc1	ZINC000875087517	GI	On-Demand	Anodyne	ETHR	58	35
CCC(CC)[C@@H](NC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)c1ccccc1	ZINC000875087518	GI	On-Demand	Anodyne	ETHR	58	35
CCC(CC)[C@@H](NC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)c1ccccc1	ZINC000875087519	GI	On-Demand	Anodyne	ETHR	58	35
CC(=O)C1CCN(C(=O)C(=O)NCc2cnn(Cc3ccccc3)c2)CC1	ZINC000875087535	FD	On-Demand	Anodyne	SIGMAR1	23	46
CC(=O)C1CCN(C(=O)C(=O)NCc2cnn(Cc3ccccc3)c2)CC1	ZINC000875087535	FD	On-Demand	Anodyne	PANC	50	40
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1cnn(Cc2ccccc2)c1	ZINC000875087551	FD	On-Demand	Mild	PANC	43	37
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1cnn(Cc2ccccc2)c1	ZINC000875087552	FD	On-Demand	Mild	PANC	43	37
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1ncccn1	ZINC000875087555	CE	On-Demand	Anodyne	NQO2	28	41
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1ncccn1	ZINC000875087555	CE	On-Demand	Anodyne	PPARD	46	43
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1ncccn1	ZINC000875087555	CE	On-Demand	Anodyne	MTNR1A	38	43
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1ncccn1	ZINC000875087555	CE	On-Demand	Anodyne	MTNR1B	40	41
CCOC(=O)CCCNC(=O)NC1([C@H]2CCCCO2)CCC1	ZINC000875087561	DE	On-Demand	Anodyne	EPHX2	21	50
CCOC(=O)CCCNC(=O)NC1([C@@H]2CCCCO2)CCC1	ZINC000875087564	DE	On-Demand	Anodyne	EPHX2	21	50
Cc1ccc(C(=O)Oc2ccc(C(F)(F)F)cc2)cc1NC(=O)c1ccco1	ZINC000875087598	GK	On-Demand	Anodyne	ACR	39	43
O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1cccc(F)c1F	ZINC000875087616	FE	On-Demand	Clean	P2RX7	21	42
O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1cccc(F)c1F	ZINC000875087616	FE	On-Demand	Clean	STAT6	32	41
COc1ccccc1NC(=O)COc1ccc(C(=O)Oc2ccc(C(F)(F)F)cc2)cc1OC	ZINC000875087640	JJ	On-Demand	Anodyne	PPARA	15	41
COc1ccccc1NC(=O)COc1ccc(C(=O)Oc2ccc(C(F)(F)F)cc2)cc1OC	ZINC000875087640	JJ	On-Demand	Anodyne	PPARD	58	39
COc1ccccc1NC(=O)COc1ccc(C(=O)Oc2ccc(C(F)(F)F)cc2)cc1OC	ZINC000875087640	JJ	On-Demand	Anodyne	MTTP	31	41
COc1ccccc1NC(=O)COc1ccc(C(=O)Oc2ccc(C(F)(F)F)cc2)cc1OC	ZINC000875087640	JJ	On-Demand	Anodyne	ACR	71	44
COc1ccccc1NC(=O)COc1ccc(C(=O)Oc2ccc(C(F)(F)F)cc2)cc1OC	ZINC000875087640	JJ	On-Demand	Anodyne	ABCG2	15	44
CCOC(=O)CCCNC(=O)NC1CC(C(=O)OC)C1	ZINC000875087657	CC	On-Demand	Anodyne	EPHX2	26	53
CCOC(=O)CCCNC(=O)NC1CC(Nc2ccccc2)C1	ZINC000875087671	DE	On-Demand	Anodyne	EPHX2	33	46
CCOC(=O)CCCNC(=O)N[C@@H]1CC(C)(C)CC[C@H]1O	ZINC000875087675	DD	On-Demand	Anodyne	EPHX2	22	50
O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1cccc2ncccc12	ZINC000875087676	GF	On-Demand	Clean	SCN2A	17	40
O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1cccc2ncccc12	ZINC000875087676	GF	On-Demand	Clean	HNMT	60	34
O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1cccc2ncccc12	ZINC000875087676	GF	On-Demand	Clean	SCN10A	18	40
O=C(Oc1ccc(C(F)(F)F)cc1)c1ccc(Br)c(S(=O)(=O)N2CCOCC2)c1	ZINC000875087712	JH	On-Demand	Anodyne	SRD5A1	15	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1Cc2ccccc2O1	ZINC000875087728	ED	On-Demand	Anodyne	SLC6A3	42	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1Cc2ccccc2O1	ZINC000875087729	ED	On-Demand	Anodyne	SLC6A3	42	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1Cc2ccccc2O1	ZINC000875087731	ED	On-Demand	Anodyne	SLC6A3	42	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1Cc2ccccc2O1	ZINC000875087733	ED	On-Demand	Anodyne	SLC6A3	42	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(N2CCCC2=O)c1	ZINC000875087736	FE	On-Demand	Anodyne	SLC6A4	21	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(N2CCCC2=O)c1	ZINC000875087738	FE	On-Demand	Anodyne	SLC6A4	21	41
COc1ccc(OCC(=O)Oc2ccc(C(F)(F)F)cc2)cc1	ZINC000875087739	EH	On-Demand	Anodyne	PPARD	61	50
COc1ccc(OCC(=O)Oc2ccc(C(F)(F)F)cc2)cc1	ZINC000875087739	EH	On-Demand	Anodyne	LIPE	22	44
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1nccc(C)n1	ZINC000875087767	CE	On-Demand	Anodyne	PPARD	42	42
O=C(CCCNC(=O)c1ccc(Cl)cc1)Oc1ccc(C(F)(F)F)cc1	ZINC000875087773	GI	On-Demand	Anodyne	GCGR	63	41
O=C(CCCNC(=O)c1ccc(Cl)cc1)Oc1ccc(C(F)(F)F)cc1	ZINC000875087773	GI	On-Demand	Anodyne	PPARD	19	47
O=C(CCCNC(=O)c1ccc(Cl)cc1)Oc1ccc(C(F)(F)F)cc1	ZINC000875087773	GI	On-Demand	Anodyne	ACR	17	42
O=C(CCCNC(=O)c1ccc(Cl)cc1)Oc1ccc(C(F)(F)F)cc1	ZINC000875087773	GI	On-Demand	Anodyne	GIPR	63	41
O=C1CCCN1c1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875087782	GG	On-Demand	Anodyne	PREP	21	41
O=C1CCCN1c1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875087782	GG	On-Demand	Anodyne	TMPRSS11D	40	31
O=C1CCCN1c1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875087783	GG	On-Demand	Anodyne	PREP	21	41
O=C1CCCN1c1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875087783	GG	On-Demand	Anodyne	TMPRSS11D	40	31
O=C1CCCN1c1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875087784	GG	On-Demand	Anodyne	PREP	21	41
O=C1CCCN1c1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875087784	GG	On-Demand	Anodyne	TMPRSS11D	40	31
O=C1CCCN1c1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875087785	GG	On-Demand	Anodyne	PREP	21	41
O=C1CCCN1c1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875087785	GG	On-Demand	Anodyne	TMPRSS11D	40	31
CC(=O)C1CCN(C(=O)C(=O)NCC2(c3ccccc3)CCCCC2)CC1	ZINC000875087802	FF	On-Demand	Anodyne	KCNA3	50	42
CC(=O)C1CCN(C(=O)C(=O)NCC2(c3ccccc3)CCCCC2)CC1	ZINC000875087802	FF	On-Demand	Anodyne	HCN1	54	33
CC(=O)C1CCN(C(=O)C(=O)NCC2(c3ccccc3)CCCCC2)CC1	ZINC000875087802	FF	On-Demand	Anodyne	HCN4	52	33
O=C(NC[C@@H]1CCN(C2CC2)C1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875087815	GD	On-Demand	Anodyne	CHRNA7	44	37
O=C(NC[C@@H]1CCN(C2CC2)C1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875087817	GD	On-Demand	Anodyne	CHRNA7	44	37
O=C(NC[C@H]1CCN(C2CC2)C1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875087819	GD	On-Demand	Anodyne	CHRNA7	44	37
O=C(NC[C@H]1CCN(C2CC2)C1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875087821	GD	On-Demand	Anodyne	CHRNA7	44	37
COc1ccccc1[C@@H]1[C@@H](C(=O)NCc2ccc(C(=O)N(C)C)cc2)CCC(=O)N1c1ccc(C)cc1	ZINC000875087841	JJ	On-Demand	Anodyne	MBTPS1	49	34
COc1ccccc1[C@@H]1[C@H](C(=O)NCc2ccc(C(=O)N(C)C)cc2)CCC(=O)N1c1ccc(C)cc1	ZINC000875087842	JJ	On-Demand	Anodyne	MBTPS1	49	34
CNC(=O)NNc1cccc(C)n1	ZINC000875087902	AC	On-Demand	Reactive	GRM5	21	50
CNC(=O)NNc1cccc(C)n1	ZINC000875087902	AC	On-Demand	Reactive	SORT1	17	44
O=C(NC[C@@H]1CCN(C2CC2)C1)C(=O)NCC1(c2cccc(Cl)c2)CCC1	ZINC000875087966	GE	On-Demand	Anodyne	CACNA1I	45	38
O=C(NC[C@H]1CCN(C2CC2)C1)C(=O)NCC1(c2cccc(Cl)c2)CCC1	ZINC000875087968	GE	On-Demand	Anodyne	CACNA1I	45	38
O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1ccc2cccnc2c1	ZINC000875087989	GF	On-Demand	Clean	NAMPT	49	42
O=C(NCc1ccc(N2CCCC2)cc1)C(=O)NCc1ccc2cccnc2c1	ZINC000875087989	GF	On-Demand	Clean	SUCNR1	40	35
CCOC(=O)CCCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875087991	ED	On-Demand	Anodyne	PDS	66	38
CCOC(=O)CCCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875087993	ED	On-Demand	Anodyne	PDS	66	38
C[C@H](NC(=O)C(=O)NCC1(c2ccccc2)CCCCC1)c1ccnn1C	ZINC000875087997	FF	On-Demand	Anodyne	KCNA3	44	39
C[C@H](NC(=O)C(=O)NCC1(c2ccccc2)CCCCC1)c1ccnn1C	ZINC000875087997	FF	On-Demand	Anodyne	SOAT1	15	49
C[C@H](NC(=O)C(=O)NCC1(c2ccccc2)CCCCC1)c1ccnn1C	ZINC000875087997	FF	On-Demand	Anodyne	HCN1	59	35
C[C@H](NC(=O)C(=O)NCC1(c2ccccc2)CCCCC1)c1ccnn1C	ZINC000875087997	FF	On-Demand	Anodyne	HCN4	51	35
CCC(CC)[C@@H](NC(=O)N1CCC(C(=O)NOC)CC1)c1ccccc1	ZINC000875088015	FG	On-Demand	Anodyne	XIAP	40	36
CCC(CC)[C@H](NC(=O)N1CCC(C(=O)NOC)CC1)c1ccccc1	ZINC000875088017	FG	On-Demand	Anodyne	XIAP	40	36
CCC(CC)[C@H](NC(=O)NC(c1ccnn1C)c1ccnn1C)c1ccccc1	ZINC000875088031	GH	On-Demand	Anodyne	TACR3	42	34
CCC(CC)[C@@H](NC(=O)NC(c1ccnn1C)c1ccnn1C)c1ccccc1	ZINC000875088033	GH	On-Demand	Anodyne	TACR3	42	34
O=C(NCC1(c2ccccc2)CCCCC1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875088034	GD	On-Demand	Anodyne	KCNA3	46	40
O=C(NCC1(c2ccccc2)CCCCC1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875088034	GD	On-Demand	Anodyne	NPFFR1	16	40
O=C(NCC1(c2ccccc2)CCCCC1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875088034	GD	On-Demand	Anodyne	HCN1	49	30
O=C(NCC1(c2ccccc2)CCCCC1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875088034	GD	On-Demand	Anodyne	HCN4	47	30
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](c2ccccc2)C(C)(C)C)C1	ZINC000875088076	EH	On-Demand	Anodyne	GHRHR	62	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](c2ccccc2)C(C)(C)C)C1	ZINC000875088076	EH	On-Demand	Anodyne	P2RY12	50	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](c2ccccc2)C(C)(C)C)C1	ZINC000875088076	EH	On-Demand	Anodyne	CTSK	40	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](c2ccccc2)C(C)(C)C)C1	ZINC000875088076	EH	On-Demand	Anodyne	AMY2	53	31
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](c2ccccc2)C(C)(C)C)C1	ZINC000875088077	EH	On-Demand	Anodyne	GHRHR	62	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](c2ccccc2)C(C)(C)C)C1	ZINC000875088077	EH	On-Demand	Anodyne	P2RY12	50	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](c2ccccc2)C(C)(C)C)C1	ZINC000875088077	EH	On-Demand	Anodyne	CTSK	40	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](c2ccccc2)C(C)(C)C)C1	ZINC000875088077	EH	On-Demand	Anodyne	AMY2	53	31
Cn1nc(Cl)c(C(=O)N[C@H](c2ccccc2)C2CC2)c1Cl	ZINC000875088108	DH	On-Demand	Anodyne	TACR3	43	48
Cn1nc(Cl)c(C(=O)N[C@@H](c2ccccc2)C2CC2)c1Cl	ZINC000875088109	DH	On-Demand	Anodyne	TACR3	43	48
CCOC(=O)CCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875088129	EE	On-Demand	Anodyne	F2	41	40
CCOC(=O)CCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875088129	EE	On-Demand	Anodyne	TRY1_BOVIN	49	35
CCOC(=O)CCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875088129	EE	On-Demand	Anodyne	DPP4	15	45
CCOC(=O)CCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875088129	EE	On-Demand	Anodyne	PREP	43	40
CCOC(=O)CCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875088130	EE	On-Demand	Anodyne	F2	41	40
CCOC(=O)CCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875088130	EE	On-Demand	Anodyne	TRY1_BOVIN	49	35
CCOC(=O)CCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875088130	EE	On-Demand	Anodyne	DPP4	15	45
CCOC(=O)CCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875088130	EE	On-Demand	Anodyne	PREP	43	40
CCOC(=O)CCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875088131	EE	On-Demand	Anodyne	F2	41	40
CCOC(=O)CCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875088131	EE	On-Demand	Anodyne	TRY1_BOVIN	49	35
CCOC(=O)CCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875088131	EE	On-Demand	Anodyne	DPP4	15	45
CCOC(=O)CCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875088131	EE	On-Demand	Anodyne	PREP	43	40
CCOC(=O)CCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875088132	EE	On-Demand	Anodyne	F2	41	40
CCOC(=O)CCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875088132	EE	On-Demand	Anodyne	TRY1_BOVIN	49	35
CCOC(=O)CCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875088132	EE	On-Demand	Anodyne	DPP4	15	45
CCOC(=O)CCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875088132	EE	On-Demand	Anodyne	PREP	43	40
CCCCCCCNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1	ZINC000875088149	EF	On-Demand	Mild	S1PR2	41	39
CCCCCCCNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1	ZINC000875088149	EF	On-Demand	Mild	SPHK1	24	41
CCCCCCCNC(=O)C(=O)NCc1ccc(N2CCCC2)cc1	ZINC000875088149	EF	On-Demand	Mild	ASAH1	95	38
CN1CC[C@H]2CN(C(=O)C(=O)NCc3cnn(Cc4ccccc4)c3)CC[C@@H]21	ZINC000875088199	GD	On-Demand	Anodyne	PANC	54	40
CN1CC[C@H]2CN(C(=O)C(=O)NCc3cnn(Cc4ccccc4)c3)CC[C@H]21	ZINC000875088200	GD	On-Demand	Anodyne	PANC	54	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)C(C)(C)C	ZINC000875088211	EH	On-Demand	Anodyne	SLC6A4	29	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)C(C)(C)C	ZINC000875088211	EH	On-Demand	Anodyne	SLC6A3	70	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)C(C)(C)C	ZINC000875088211	EH	On-Demand	Anodyne	Q82323_9DELA	49	30
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)C(C)(C)C	ZINC000875088212	EH	On-Demand	Anodyne	SLC6A4	29	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)C(C)(C)C	ZINC000875088212	EH	On-Demand	Anodyne	SLC6A3	70	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)C(C)(C)C	ZINC000875088212	EH	On-Demand	Anodyne	Q82323_9DELA	49	30
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)C(C)(C)C	ZINC000875088213	EH	On-Demand	Anodyne	SLC6A4	29	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)C(C)(C)C	ZINC000875088213	EH	On-Demand	Anodyne	SLC6A3	70	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)C(C)(C)C	ZINC000875088213	EH	On-Demand	Anodyne	Q82323_9DELA	49	30
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)C(C)(C)C	ZINC000875088214	EH	On-Demand	Anodyne	SLC6A4	29	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)C(C)(C)C	ZINC000875088214	EH	On-Demand	Anodyne	SLC6A3	70	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)C(C)(C)C	ZINC000875088214	EH	On-Demand	Anodyne	Q82323_9DELA	49	30
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2)C1	ZINC000875088228	FD	On-Demand	Mild	P2RY12	49	33
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(c2ccccc2)C1	ZINC000875088229	FD	On-Demand	Mild	P2RY12	49	33
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2)C1	ZINC000875088230	FD	On-Demand	Mild	P2RY12	49	33
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(c2ccccc2)C1	ZINC000875088231	FD	On-Demand	Mild	P2RY12	49	33
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN(C2CC2)C1	ZINC000875088254	EC	On-Demand	Anodyne	CACNA1I	42	33
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN(C2CC2)C1	ZINC000875088255	EC	On-Demand	Anodyne	CACNA1I	42	33
CCC(CC)[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccccc1	ZINC000875088267	EG	On-Demand	Anodyne	Q6PRC7_IXORI	41	34
CCC(CC)[C@H](NC(=O)N1CCCN(C=O)CC1)c1ccccc1	ZINC000875088268	EG	On-Demand	Anodyne	Q6PRC7_IXORI	41	34
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)Oc1ccc(C(F)(F)F)cc1	ZINC000875088273	IG	On-Demand	Anodyne	MMP13	17	45
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)Oc1ccc(C(F)(F)F)cc1	ZINC000875088273	IG	On-Demand	Anodyne	TGM2	23	42
CCC(CC)[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1ccccc1	ZINC000875088275	FG	On-Demand	Anodyne	CACNA1H	41	42
CCC(CC)[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1ccccc1	ZINC000875088275	FG	On-Demand	Anodyne	GHRHR	70	34
CCC(CC)[C@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1ccccc1	ZINC000875088277	FG	On-Demand	Anodyne	CACNA1H	41	42
CCC(CC)[C@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1ccccc1	ZINC000875088277	FG	On-Demand	Anodyne	GHRHR	70	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1	ZINC000875088295	FD	On-Demand	Clean	DPP7	40	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CCCC3)cc2)C1	ZINC000875088297	FD	On-Demand	Clean	DPP7	40	34
CCCCCCCNC(=O)C(=O)NCCc1cn2c(n1)CCCC2	ZINC000875088362	ED	On-Demand	Mild	ASAH1	90	37
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@@H](c1ccccc1)C(C)(C)C	ZINC000875088389	EI	On-Demand	Anodyne	TIMP3	76	35
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@H](c1ccccc1)C(C)(C)C	ZINC000875088392	EI	On-Demand	Anodyne	TIMP3	76	35
O=C(NC[C@@H]1Cc2ccccc2O1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875088396	EG	On-Demand	Anodyne	SMO	23	40
O=C(NC[C@H]1Cc2ccccc2O1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875088397	EG	On-Demand	Anodyne	SMO	23	40
O=C(NC[C@@H]1Cc2ccccc2O1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875088398	EG	On-Demand	Anodyne	SMO	23	40
O=C(NC[C@H]1Cc2ccccc2O1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875088399	EG	On-Demand	Anodyne	SMO	23	40
CCCCCCCNC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2)C1	ZINC000875088400	EF	On-Demand	Mild	HTR4	44	37
CCCCCCCNC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2)C1	ZINC000875088400	EF	On-Demand	Mild	P2RY12	67	38
CCCCCCCNC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2)C1	ZINC000875088400	EF	On-Demand	Mild	CHRM5	15	40
CCCCCCCNC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2)C1	ZINC000875088400	EF	On-Demand	Mild	ASAH1	90	37
CCCCCCCNC(=O)C(=O)NC[C@H]1CCN(c2ccccc2)C1	ZINC000875088401	EF	On-Demand	Mild	HTR4	44	37
CCCCCCCNC(=O)C(=O)NC[C@H]1CCN(c2ccccc2)C1	ZINC000875088401	EF	On-Demand	Mild	P2RY12	67	38
CCCCCCCNC(=O)C(=O)NC[C@H]1CCN(c2ccccc2)C1	ZINC000875088401	EF	On-Demand	Mild	CHRM5	15	40
CCCCCCCNC(=O)C(=O)NC[C@H]1CCN(c2ccccc2)C1	ZINC000875088401	EF	On-Demand	Mild	ASAH1	90	37
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2cnn(Cc3ccccc3)c2)C1	ZINC000875088402	FD	On-Demand	Anodyne	PANC	57	42
O=C(NCCCCC1CC1)C(=O)NCc1cnn(Cc2ccccc2)c1	ZINC000875088418	FE	On-Demand	Anodyne	ACHE	40	45
O=C(NCCCCC1CC1)C(=O)NCc1cnn(Cc2ccccc2)c1	ZINC000875088418	FE	On-Demand	Anodyne	SIGMAR1	18	40
O=C(NCCCCC1CC1)C(=O)NCc1cnn(Cc2ccccc2)c1	ZINC000875088418	FE	On-Demand	Anodyne	PANC	60	44
CN1CCN(C2CCN(C(=O)N[C@@H](c3ccccc3)C(C)(C)C)CC2)CC1	ZINC000875088446	FG	On-Demand	Anodyne	CCR1	19	40
CN1CCN(C2CCN(C(=O)N[C@@H](c3ccccc3)C(C)(C)C)CC2)CC1	ZINC000875088446	FG	On-Demand	Anodyne	CCR5	15	43
CN1CCN(C2CCN(C(=O)N[C@@H](c3ccccc3)C(C)(C)C)CC2)CC1	ZINC000875088446	FG	On-Demand	Anodyne	L3MBTL3	78	43
CN1CCN(C2CCN(C(=O)N[C@H](c3ccccc3)C(C)(C)C)CC2)CC1	ZINC000875088447	FG	On-Demand	Anodyne	CCR1	19	40
CN1CCN(C2CCN(C(=O)N[C@H](c3ccccc3)C(C)(C)C)CC2)CC1	ZINC000875088447	FG	On-Demand	Anodyne	CCR5	15	43
CN1CCN(C2CCN(C(=O)N[C@H](c3ccccc3)C(C)(C)C)CC2)CC1	ZINC000875088447	FG	On-Demand	Anodyne	L3MBTL3	78	43
O=C(Nc1ncccn1)[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875088450	CF	On-Demand	Anodyne	CHRNA7	41	36
O=C(Nc1ncccn1)[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875088450	CF	On-Demand	Anodyne	C3AR1	49	48
O=C(Nc1ncccn1)[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875088450	CF	On-Demand	Anodyne	NAMPT	42	39
O=C(Nc1ncccn1)[C@H](Cc1cccnc1)C1CCCC1	ZINC000875088451	CF	On-Demand	Anodyne	CHRNA7	41	36
O=C(Nc1ncccn1)[C@H](Cc1cccnc1)C1CCCC1	ZINC000875088451	CF	On-Demand	Anodyne	C3AR1	49	48
O=C(Nc1ncccn1)[C@H](Cc1cccnc1)C1CCCC1	ZINC000875088451	CF	On-Demand	Anodyne	NAMPT	42	39
C[C@H](CCc1ccc(F)cc1)C(=O)Nc1ccccc1S(C)(=O)=O	ZINC000875088470	EG	On-Demand	Anodyne	MMP2	18	47
C[C@H](CCc1ccc(F)cc1)C(=O)Nc1ccccc1S(C)(=O)=O	ZINC000875088470	EG	On-Demand	Anodyne	MMP3	31	47
C[C@H](CCc1ccc(F)cc1)C(=O)Nc1ccccc1S(C)(=O)=O	ZINC000875088470	EG	On-Demand	Anodyne	PSMB5	19	41
C[C@H](CCc1ccc(F)cc1)C(=O)Nc1ccccc1S(C)(=O)=O	ZINC000875088470	EG	On-Demand	Anodyne	LEF	43	34
C[C@@H](CCc1ccc(F)cc1)C(=O)Nc1ccccc1S(C)(=O)=O	ZINC000875088471	EG	On-Demand	Anodyne	MMP2	18	47
C[C@@H](CCc1ccc(F)cc1)C(=O)Nc1ccccc1S(C)(=O)=O	ZINC000875088471	EG	On-Demand	Anodyne	MMP3	31	47
C[C@@H](CCc1ccc(F)cc1)C(=O)Nc1ccccc1S(C)(=O)=O	ZINC000875088471	EG	On-Demand	Anodyne	PSMB5	19	41
C[C@@H](CCc1ccc(F)cc1)C(=O)Nc1ccccc1S(C)(=O)=O	ZINC000875088471	EG	On-Demand	Anodyne	LEF	43	34
O=C(N[C@@H](C1CCC1)[C@H]1CCOC1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875088477	GE	On-Demand	Anodyne	DRD4	25	43
O=C(N[C@@H](C1CCC1)[C@H]1CCOC1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875088477	GE	On-Demand	Anodyne	SIGMAR1	27	41
O=C(N[C@@H](C1CCC1)[C@H]1CCOC1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875088477	GE	On-Demand	Anodyne	BIRC2	44	51
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875088478	GE	On-Demand	Anodyne	DRD4	25	43
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875088478	GE	On-Demand	Anodyne	SIGMAR1	27	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875088478	GE	On-Demand	Anodyne	BIRC2	44	51
O=C(N[C@@H](C1CCC1)[C@@H]1CCOC1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875088479	GE	On-Demand	Anodyne	DRD4	25	43
O=C(N[C@@H](C1CCC1)[C@@H]1CCOC1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875088479	GE	On-Demand	Anodyne	SIGMAR1	27	41
O=C(N[C@@H](C1CCC1)[C@@H]1CCOC1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875088479	GE	On-Demand	Anodyne	BIRC2	44	51
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875088480	GE	On-Demand	Anodyne	DRD4	25	43
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875088480	GE	On-Demand	Anodyne	SIGMAR1	27	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875088480	GE	On-Demand	Anodyne	BIRC2	44	51
CCO[C@@H](C(=O)Nc1ccccc1S(C)(=O)=O)C1CCCC1	ZINC000875088482	EF	On-Demand	Anodyne	KCNQ2	40	33
CCO[C@@H](C(=O)Nc1ccccc1S(C)(=O)=O)C1CCCC1	ZINC000875088482	EF	On-Demand	Anodyne	AMY2	44	31
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)Nc2nccc(C)n2)C1	ZINC000875088521	GF	On-Demand	Anodyne	GRIN2B	19	40
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)Nc2nccc(C)n2)C1	ZINC000875088521	GF	On-Demand	Anodyne	SLC12A5	42	35
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)Nc2nccc(C)n2)C1	ZINC000875088523	GF	On-Demand	Anodyne	GRIN2B	19	40
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)Nc2nccc(C)n2)C1	ZINC000875088523	GF	On-Demand	Anodyne	SLC12A5	42	35
CO[C@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)Nc2nccc(C)n2)C1	ZINC000875088524	GF	On-Demand	Anodyne	GRIN2B	19	40
CO[C@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)Nc2nccc(C)n2)C1	ZINC000875088524	GF	On-Demand	Anodyne	SLC12A5	42	35
CO[C@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)Nc2nccc(C)n2)C1	ZINC000875088525	GF	On-Demand	Anodyne	GRIN2B	19	40
CO[C@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)Nc2nccc(C)n2)C1	ZINC000875088525	GF	On-Demand	Anodyne	SLC12A5	42	35
O=C(Nc1ncccn1)[C@@H]1CC[C@H](Cc2ccccc2)O1	ZINC000875088535	CE	On-Demand	Anodyne	LUCI_PHOPY	51	31
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2)C1	ZINC000875088561	FD	On-Demand	Anodyne	CACNA1I	59	36
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN(c2ccccc2)C1	ZINC000875088562	FD	On-Demand	Anodyne	CACNA1I	59	36
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccc(C(N)=O)cc2)CC1	ZINC000875088578	GG	On-Demand	Anodyne	HTR1A	17	42
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccc(C(N)=O)cc2)CC1	ZINC000875088578	GG	On-Demand	Anodyne	DRD2	21	45
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccc(C(N)=O)cc2)CC1	ZINC000875088578	GG	On-Demand	Anodyne	EPHX2	15	40
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccc(C(N)=O)cc2)CC1	ZINC000875088578	GG	On-Demand	Anodyne	TPSAB1	19	44
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccc(C(N)=O)cc2)CC1	ZINC000875088578	GG	On-Demand	Anodyne	MBTPS1	57	37
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccc(C(N)=O)cc2)CC1	ZINC000875088578	GG	On-Demand	Anodyne	TMPRSS11D	63	33
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccc(C(N)=O)cc2)CC1	ZINC000875088581	GG	On-Demand	Anodyne	HTR1A	17	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccc(C(N)=O)cc2)CC1	ZINC000875088581	GG	On-Demand	Anodyne	DRD2	21	45
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccc(C(N)=O)cc2)CC1	ZINC000875088581	GG	On-Demand	Anodyne	EPHX2	15	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccc(C(N)=O)cc2)CC1	ZINC000875088581	GG	On-Demand	Anodyne	TPSAB1	19	44
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccc(C(N)=O)cc2)CC1	ZINC000875088581	GG	On-Demand	Anodyne	MBTPS1	57	37
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccc(C(N)=O)cc2)CC1	ZINC000875088581	GG	On-Demand	Anodyne	TMPRSS11D	63	33
NC(=O)c1ccc(CNC(=O)N2C[C@@H]3[C@@H](C[C@H]3c3ccccc3)C2)cc1	ZINC000875088596	EF	On-Demand	Anodyne	FURIN	41	32
NC(=O)c1ccc(CNC(=O)N2C[C@@H]3[C@@H](C[C@H]3c3ccccc3)C2)cc1	ZINC000875088596	EF	On-Demand	Anodyne	TMPRSS11D	40	31
CN(C)C[C@@H]1CN(C(=O)NCc2ccc(C(N)=O)cc2)C[C@H]1CN(C)C	ZINC000875088628	FC	On-Demand	Anodyne	TPSAB1	16	42
C[C@@H]1CN(C(=O)NCc2ccc(C(N)=O)cc2)Cc2ccccc21	ZINC000875088629	DF	On-Demand	Anodyne	NAMPT	23	46
O=C(NCc1cccc(N2CCOC2=O)c1)C(=O)N1CCC[C@@H]1Cn1ccnc1	ZINC000875088633	GD	On-Demand	Anodyne	NOS2	51	35
CC(=O)N1CCC[C@@H](C(=O)NNC(=O)N[C@@H](c2ccccc2)C(C)(C)C)[C@H]1C	ZINC000875088642	GF	On-Demand	Reactive	ELANE	44	38
CC(=O)N1CCC[C@@H](C(=O)NNC(=O)N[C@@H](c2ccccc2)C(C)(C)C)[C@H]1C	ZINC000875088642	GF	On-Demand	Reactive	TRY1_BOVIN	40	33
CC(=O)N1CCC[C@@H](C(=O)NNC(=O)N[C@@H](c2ccccc2)C(C)(C)C)[C@H]1C	ZINC000875088642	GF	On-Demand	Reactive	XIAP	55	40
CC(=O)N1CCC[C@@H](C(=O)NNC(=O)N[C@H](c2ccccc2)C(C)(C)C)[C@H]1C	ZINC000875088645	GF	On-Demand	Reactive	ELANE	44	38
CC(=O)N1CCC[C@@H](C(=O)NNC(=O)N[C@H](c2ccccc2)C(C)(C)C)[C@H]1C	ZINC000875088645	GF	On-Demand	Reactive	TRY1_BOVIN	40	33
CC(=O)N1CCC[C@@H](C(=O)NNC(=O)N[C@H](c2ccccc2)C(C)(C)C)[C@H]1C	ZINC000875088645	GF	On-Demand	Reactive	XIAP	55	40
O=C(NC[C@@H]1CCN(C2CC2)C1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875088655	FD	On-Demand	Anodyne	OXTR	50	36
O=C(NC[C@@H]1CCN(C2CC2)C1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875088659	FD	On-Demand	Anodyne	OXTR	50	36
O=C(NC[C@H]1CCN(C2CC2)C1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875088662	FD	On-Demand	Anodyne	OXTR	50	36
O=C(NC[C@H]1CCN(C2CC2)C1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875088665	FD	On-Demand	Anodyne	OXTR	50	36
NC(=O)c1ccc(CNC(=O)N2CCC[C@@](F)(c3ccccc3)C2)cc1	ZINC000875088711	FF	On-Demand	Anodyne	NPSR1	27	41
NC(=O)c1ccc(CNC(=O)N2CCC[C@@](F)(c3ccccc3)C2)cc1	ZINC000875088711	FF	On-Demand	Anodyne	TMPRSS11D	47	31
NC(=O)c1ccc(CNC(=O)N2CCC[C@](F)(c3ccccc3)C2)cc1	ZINC000875088713	FF	On-Demand	Anodyne	NPSR1	27	41
NC(=O)c1ccc(CNC(=O)N2CCC[C@](F)(c3ccccc3)C2)cc1	ZINC000875088713	FF	On-Demand	Anodyne	TMPRSS11D	47	31
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875088738	FD	On-Demand	Mild	DRD2	18	49
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875088738	FD	On-Demand	Mild	DRD4	34	51
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875088738	FD	On-Demand	Mild	SLC6A1	73	34
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875088738	FD	On-Demand	Mild	SIGMAR1	35	44
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875088738	FD	On-Demand	Mild	CCR3	18	40
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875088738	FD	On-Demand	Mild	MCHR1	15	42
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875088738	FD	On-Demand	Mild	BIRC2	48	50
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875088739	FD	On-Demand	Mild	DRD2	18	49
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875088739	FD	On-Demand	Mild	DRD4	34	51
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875088739	FD	On-Demand	Mild	SLC6A1	73	34
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875088739	FD	On-Demand	Mild	SIGMAR1	35	44
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875088739	FD	On-Demand	Mild	CCR3	18	40
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875088739	FD	On-Demand	Mild	MCHR1	15	42
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875088739	FD	On-Demand	Mild	BIRC2	48	50
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875088740	FD	On-Demand	Mild	DRD2	18	49
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875088740	FD	On-Demand	Mild	DRD4	34	51
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875088740	FD	On-Demand	Mild	SLC6A1	73	34
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875088740	FD	On-Demand	Mild	SIGMAR1	35	44
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875088740	FD	On-Demand	Mild	CCR3	18	40
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875088740	FD	On-Demand	Mild	MCHR1	15	42
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875088740	FD	On-Demand	Mild	BIRC2	48	50
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875088741	FD	On-Demand	Mild	DRD2	18	49
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875088741	FD	On-Demand	Mild	DRD4	34	51
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875088741	FD	On-Demand	Mild	SLC6A1	73	34
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875088741	FD	On-Demand	Mild	SIGMAR1	35	44
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875088741	FD	On-Demand	Mild	CCR3	18	40
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875088741	FD	On-Demand	Mild	MCHR1	15	42
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875088741	FD	On-Demand	Mild	BIRC2	48	50
Cc1cncc([C@@H]2CCCN2C(=O)NCc2ccc(C(N)=O)cc2)c1	ZINC000875088742	EF	On-Demand	Anodyne	F2	27	45
Cc1cncc([C@@H]2CCCN2C(=O)NCc2ccc(C(N)=O)cc2)c1	ZINC000875088742	EF	On-Demand	Anodyne	TRYP_PIG	44	29
Cc1cncc([C@@H]2CCCN2C(=O)NCc2ccc(C(N)=O)cc2)c1	ZINC000875088742	EF	On-Demand	Anodyne	PREP	26	40
Cc1cncc([C@@H]2CCCN2C(=O)NCc2ccc(C(N)=O)cc2)c1	ZINC000875088742	EF	On-Demand	Anodyne	TMPRSS11D	63	36
Cc1cncc([C@H]2CCCN2C(=O)NCc2ccc(C(N)=O)cc2)c1	ZINC000875088744	EF	On-Demand	Anodyne	F2	27	45
Cc1cncc([C@H]2CCCN2C(=O)NCc2ccc(C(N)=O)cc2)c1	ZINC000875088744	EF	On-Demand	Anodyne	TRYP_PIG	44	29
Cc1cncc([C@H]2CCCN2C(=O)NCc2ccc(C(N)=O)cc2)c1	ZINC000875088744	EF	On-Demand	Anodyne	PREP	26	40
Cc1cncc([C@H]2CCCN2C(=O)NCc2ccc(C(N)=O)cc2)c1	ZINC000875088744	EF	On-Demand	Anodyne	TMPRSS11D	63	36
NC(=O)c1ccc(CNC(=O)N2CC[C@@]3(CCc4ccccc43)C2)cc1	ZINC000875088762	EF	On-Demand	Anodyne	GHRHR	17	40
NC(=O)c1ccc(CNC(=O)N2CC[C@]3(CCc4ccccc43)C2)cc1	ZINC000875088763	EF	On-Demand	Anodyne	GHRHR	17	40
O=C(NCCC[C@H]1C=CCC1)C(=O)NCc1cnn(Cc2ccccc2)c1	ZINC000875088776	FE	On-Demand	Anodyne	PANC	48	38
O=C(NCCC[C@@H]1C=CCC1)C(=O)NCc1cnn(Cc2ccccc2)c1	ZINC000875088777	FE	On-Demand	Anodyne	PANC	48	38
CCC(CC)[C@H](NC(=O)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1)c1ccccc1	ZINC000875088788	GG	On-Demand	Anodyne	XIAP	41	34
CCC(CC)[C@H](NC(=O)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1)c1ccccc1	ZINC000875088789	GG	On-Demand	Anodyne	XIAP	41	34
CCC(CC)[C@H](NC(=O)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1)c1ccccc1	ZINC000875088790	GG	On-Demand	Anodyne	XIAP	41	34
CCC(CC)[C@H](NC(=O)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1)c1ccccc1	ZINC000875088791	GG	On-Demand	Anodyne	XIAP	41	34
CONC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)C(C)(C)C)CC1	ZINC000875088823	EF	On-Demand	Anodyne	AMY2	57	34
CONC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)C(C)(C)C)CC1	ZINC000875088824	EF	On-Demand	Anodyne	AMY2	57	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2cnn(Cc3ccccc3)c2)C1	ZINC000875088829	FD	On-Demand	Anodyne	SIGMAR1	18	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2cnn(Cc3ccccc3)c2)C1	ZINC000875088829	FD	On-Demand	Anodyne	PANC	47	38
CN1CCN(C(=O)NCc2ccc(C(N)=O)cc2)CCC1(C)C	ZINC000875088838	DD	On-Demand	Anodyne	TPSAB1	17	48
O=C(NCC[C@@H]1CCSC1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875088856	GE	On-Demand	Anodyne	DRD4	28	46
O=C(NCC[C@@H]1CCSC1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875088856	GE	On-Demand	Anodyne	ACHE	35	45
O=C(NCC[C@@H]1CCSC1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875088856	GE	On-Demand	Anodyne	SLC6A1	53	32
O=C(NCC[C@@H]1CCSC1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875088856	GE	On-Demand	Anodyne	SIGMAR1	31	42
O=C(NCC[C@@H]1CCSC1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875088856	GE	On-Demand	Anodyne	CCR3	21	41
O=C(NCC[C@@H]1CCSC1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875088856	GE	On-Demand	Anodyne	BIRC2	32	43
O=C(NCC[C@@H]1CCSC1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875088857	GE	On-Demand	Anodyne	DRD4	28	46
O=C(NCC[C@@H]1CCSC1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875088857	GE	On-Demand	Anodyne	ACHE	35	45
O=C(NCC[C@@H]1CCSC1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875088857	GE	On-Demand	Anodyne	SLC6A1	53	32
O=C(NCC[C@@H]1CCSC1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875088857	GE	On-Demand	Anodyne	SIGMAR1	31	42
O=C(NCC[C@@H]1CCSC1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875088857	GE	On-Demand	Anodyne	CCR3	21	41
O=C(NCC[C@@H]1CCSC1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875088857	GE	On-Demand	Anodyne	BIRC2	32	43
O=C(NCC[C@H]1CCSC1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875088858	GE	On-Demand	Anodyne	DRD4	28	46
O=C(NCC[C@H]1CCSC1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875088858	GE	On-Demand	Anodyne	ACHE	35	45
O=C(NCC[C@H]1CCSC1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875088858	GE	On-Demand	Anodyne	SLC6A1	53	32
O=C(NCC[C@H]1CCSC1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875088858	GE	On-Demand	Anodyne	SIGMAR1	31	42
O=C(NCC[C@H]1CCSC1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875088858	GE	On-Demand	Anodyne	CCR3	21	41
O=C(NCC[C@H]1CCSC1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875088858	GE	On-Demand	Anodyne	BIRC2	32	43
O=C(NCC[C@H]1CCSC1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875088859	GE	On-Demand	Anodyne	DRD4	28	46
O=C(NCC[C@H]1CCSC1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875088859	GE	On-Demand	Anodyne	ACHE	35	45
O=C(NCC[C@H]1CCSC1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875088859	GE	On-Demand	Anodyne	SLC6A1	53	32
O=C(NCC[C@H]1CCSC1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875088859	GE	On-Demand	Anodyne	SIGMAR1	31	42
O=C(NCC[C@H]1CCSC1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875088859	GE	On-Demand	Anodyne	CCR3	21	41
O=C(NCC[C@H]1CCSC1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875088859	GE	On-Demand	Anodyne	BIRC2	32	43
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@@H]1N2C(=O)c1cnc(F)cc1C	ZINC000875088869	EG	On-Demand	Anodyne	HCRTR1	43	33
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@H]1N2C(=O)c1cnc(F)cc1C	ZINC000875088870	EG	On-Demand	Anodyne	HCRTR1	43	33
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@@H]1N2C(=O)c1cnc(F)cc1C	ZINC000875088871	EG	On-Demand	Anodyne	HCRTR1	43	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2cnn(Cc3ccccc3)c2)C1	ZINC000875088881	FD	On-Demand	Anodyne	SIGMAR1	18	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2cnn(Cc3ccccc3)c2)C1	ZINC000875088881	FD	On-Demand	Anodyne	PANC	47	38
O=C(NCc1cnn(Cc2ccccc2)c1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875088900	GD	On-Demand	Anodyne	PANC	47	38
O=C(NCc1cnn(Cc2ccccc2)c1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875088901	GD	On-Demand	Anodyne	PANC	47	38
O=C(NCc1cnn(Cc2ccccc2)c1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875088903	GD	On-Demand	Anodyne	PANC	47	38
O=C(NCc1cnn(Cc2ccccc2)c1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875088905	GD	On-Demand	Anodyne	PANC	47	38
O=C(NCC[C@H]1CCSC1)C(=O)NCc1cnn(Cc2ccccc2)c1	ZINC000875088907	FD	On-Demand	Anodyne	ACHE	22	43
O=C(NCC[C@@H]1CCSC1)C(=O)NCc1cnn(Cc2ccccc2)c1	ZINC000875088909	FD	On-Demand	Anodyne	ACHE	22	43
COCC(C)(C)CCNC(=O)C(=O)NCc1cnn(Cc2ccccc2)c1	ZINC000875088915	FD	On-Demand	Anodyne	PANC	50	40
NC(=O)c1ccc(CNC(=O)N2C[C@H]3CC=CC[C@H]3C2)cc1	ZINC000875088941	CD	On-Demand	Anodyne	TPSAB1	16	45
COc1ccc([C@@H]2CN(C(=O)NCc3ccc(C(N)=O)cc3)CCO2)cc1	ZINC000875088972	FE	On-Demand	Anodyne	MMP13	20	43
COc1ccc([C@@H]2CN(C(=O)NCc3ccc(C(N)=O)cc3)CCO2)cc1	ZINC000875088972	FE	On-Demand	Anodyne	MMP3	15	43
COc1ccc([C@@H]2CN(C(=O)NCc3ccc(C(N)=O)cc3)CCO2)cc1	ZINC000875088972	FE	On-Demand	Anodyne	MMP7	18	43
COc1ccc([C@@H]2CN(C(=O)NCc3ccc(C(N)=O)cc3)CCO2)cc1	ZINC000875088972	FE	On-Demand	Anodyne	MMP1	17	43
COc1ccc([C@@H]2CN(C(=O)NCc3ccc(C(N)=O)cc3)CCO2)cc1	ZINC000875088972	FE	On-Demand	Anodyne	PROKR1	54	32
CCC(CC)[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccccc1	ZINC000875088976	GH	On-Demand	Anodyne	CCR5	28	43
CCC(CC)[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccccc1	ZINC000875088976	GH	On-Demand	Anodyne	L3MBTL3	73	41
CCC(CC)[C@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccccc1	ZINC000875088977	GH	On-Demand	Anodyne	CCR5	28	43
CCC(CC)[C@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccccc1	ZINC000875088977	GH	On-Demand	Anodyne	L3MBTL3	73	41
C[C@H](CCc1ccc(F)cc1)C(=O)Nc1ncccn1	ZINC000875089005	CF	On-Demand	Anodyne	MMP3	17	46
C[C@H](CCc1ccc(F)cc1)C(=O)Nc1ncccn1	ZINC000875089005	CF	On-Demand	Anodyne	ACE2	41	37
C[C@H](CCc1ccc(F)cc1)C(=O)Nc1ncccn1	ZINC000875089005	CF	On-Demand	Anodyne	LEF	47	36
C[C@@H](CCc1ccc(F)cc1)C(=O)Nc1ncccn1	ZINC000875089007	CF	On-Demand	Anodyne	MMP3	17	46
C[C@@H](CCc1ccc(F)cc1)C(=O)Nc1ncccn1	ZINC000875089007	CF	On-Demand	Anodyne	ACE2	41	37
C[C@@H](CCc1ccc(F)cc1)C(=O)Nc1ncccn1	ZINC000875089007	CF	On-Demand	Anodyne	LEF	47	36
COc1ccc(C)cc1CNC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875089012	GE	On-Demand	Anodyne	SLC5A7	33	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC(C)(C)c1ccccc1	ZINC000875089022	EF	On-Demand	Anodyne	SLC6A4	29	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC(C)(C)c1ccccc1	ZINC000875089022	EF	On-Demand	Anodyne	SLC6A3	56	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC(C)(C)c1ccccc1	ZINC000875089022	EF	On-Demand	Anodyne	AMY2	43	29
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC(C)(C)c1ccccc1	ZINC000875089022	EF	On-Demand	Anodyne	CACNA1G	20	40
CS(=O)(=O)c1ccccc1NC(=O)[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875089038	FG	On-Demand	Anodyne	C3AR1	43	44
CS(=O)(=O)c1ccccc1NC(=O)[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875089038	FG	On-Demand	Anodyne	NAMPT	43	37
CS(=O)(=O)c1ccccc1NC(=O)[C@H](Cc1cccnc1)C1CCCC1	ZINC000875089039	FG	On-Demand	Anodyne	C3AR1	43	44
CS(=O)(=O)c1ccccc1NC(=O)[C@H](Cc1cccnc1)C1CCCC1	ZINC000875089039	FG	On-Demand	Anodyne	NAMPT	43	37
COc1ccc(C)cc1CNC(=O)C(=O)N[C@H](C)c1ccc(C(F)(F)F)nc1	ZINC000875089070	GF	On-Demand	Anodyne	TRPV1	73	35
COc1ccc(C)cc1CNC(=O)C(=O)N[C@@H](C)c1ccc(C(F)(F)F)nc1	ZINC000875089071	GF	On-Demand	Anodyne	TRPV1	73	35
CCCCCCCNC(=O)C(=O)NCc1cccc(N2CCOC2=O)c1	ZINC000875089075	FE	On-Demand	Mild	ASAH1	80	36
NC(=O)c1ccc(CNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)cc1	ZINC000875089090	FD	On-Demand	Anodyne	NPSR1	26	40
NC(=O)c1ccc(CNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)cc1	ZINC000875089090	FD	On-Demand	Anodyne	TMPRSS11D	52	31
NC(=O)c1ccc(CNC(=O)N2CCC[C@](O)(c3ccccc3)C2)cc1	ZINC000875089091	FD	On-Demand	Anodyne	NPSR1	26	40
NC(=O)c1ccc(CNC(=O)N2CCC[C@](O)(c3ccccc3)C2)cc1	ZINC000875089091	FD	On-Demand	Anodyne	TMPRSS11D	52	31
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089095	FC	On-Demand	Mild	DRD4	30	49
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089095	FC	On-Demand	Mild	SLC6A1	81	34
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089095	FC	On-Demand	Mild	SIGMAR1	33	42
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089095	FC	On-Demand	Mild	BIRC2	48	50
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089096	FC	On-Demand	Mild	DRD4	30	49
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089096	FC	On-Demand	Mild	SLC6A1	81	34
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089096	FC	On-Demand	Mild	SIGMAR1	33	42
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089096	FC	On-Demand	Mild	BIRC2	48	50
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875089097	FC	On-Demand	Mild	DRD4	30	49
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875089097	FC	On-Demand	Mild	SLC6A1	81	34
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875089097	FC	On-Demand	Mild	SIGMAR1	33	42
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875089097	FC	On-Demand	Mild	BIRC2	48	50
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875089098	FC	On-Demand	Mild	DRD4	30	49
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875089098	FC	On-Demand	Mild	SLC6A1	81	34
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875089098	FC	On-Demand	Mild	SIGMAR1	33	42
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875089098	FC	On-Demand	Mild	BIRC2	48	50
Cn1cnc(-c2nnc3n2CCN(C(=O)N[C@H](c2ccccc2)C(C)(C)C)C3)c1	ZINC000875089135	GF	On-Demand	Anodyne	P2RX7	26	40
Cn1cnc(-c2nnc3n2CCN(C(=O)N[C@@H](c2ccccc2)C(C)(C)C)C3)c1	ZINC000875089136	GF	On-Demand	Anodyne	P2RX7	26	40
CCC(CC)[C@@H](NC(=O)NNC(=O)[C@H]1CCC(=O)N1)c1ccccc1	ZINC000875089145	ED	On-Demand	Reactive	HDAC10	29	41
CCC(CC)[C@@H](NC(=O)NNC(=O)[C@H]1CCC(=O)N1)c1ccccc1	ZINC000875089145	ED	On-Demand	Reactive	HDAC2	17	41
CCC(CC)[C@@H](NC(=O)NNC(=O)[C@H]1CCC(=O)N1)c1ccccc1	ZINC000875089145	ED	On-Demand	Reactive	HDAC3	15	41
CCC(CC)[C@@H](NC(=O)NNC(=O)[C@H]1CCC(=O)N1)c1ccccc1	ZINC000875089145	ED	On-Demand	Reactive	HDAC6	22	41
CCC(CC)[C@@H](NC(=O)NNC(=O)[C@H]1CCC(=O)N1)c1ccccc1	ZINC000875089145	ED	On-Demand	Reactive	HDAC11	42	41
CCC(CC)[C@@H](NC(=O)NNC(=O)[C@@H]1CCC(=O)N1)c1ccccc1	ZINC000875089146	ED	On-Demand	Reactive	HDAC10	29	41
CCC(CC)[C@@H](NC(=O)NNC(=O)[C@@H]1CCC(=O)N1)c1ccccc1	ZINC000875089146	ED	On-Demand	Reactive	HDAC2	17	41
CCC(CC)[C@@H](NC(=O)NNC(=O)[C@@H]1CCC(=O)N1)c1ccccc1	ZINC000875089146	ED	On-Demand	Reactive	HDAC3	15	41
CCC(CC)[C@@H](NC(=O)NNC(=O)[C@@H]1CCC(=O)N1)c1ccccc1	ZINC000875089146	ED	On-Demand	Reactive	HDAC6	22	41
CCC(CC)[C@@H](NC(=O)NNC(=O)[C@@H]1CCC(=O)N1)c1ccccc1	ZINC000875089146	ED	On-Demand	Reactive	HDAC11	42	41
CCC(CC)[C@H](NC(=O)NNC(=O)[C@@H]1CCC(=O)N1)c1ccccc1	ZINC000875089147	ED	On-Demand	Reactive	HDAC10	29	41
CCC(CC)[C@H](NC(=O)NNC(=O)[C@@H]1CCC(=O)N1)c1ccccc1	ZINC000875089147	ED	On-Demand	Reactive	HDAC2	17	41
CCC(CC)[C@H](NC(=O)NNC(=O)[C@@H]1CCC(=O)N1)c1ccccc1	ZINC000875089147	ED	On-Demand	Reactive	HDAC3	15	41
CCC(CC)[C@H](NC(=O)NNC(=O)[C@@H]1CCC(=O)N1)c1ccccc1	ZINC000875089147	ED	On-Demand	Reactive	HDAC6	22	41
CCC(CC)[C@H](NC(=O)NNC(=O)[C@@H]1CCC(=O)N1)c1ccccc1	ZINC000875089147	ED	On-Demand	Reactive	HDAC11	42	41
CCC(CC)[C@H](NC(=O)NNC(=O)[C@H]1CCC(=O)N1)c1ccccc1	ZINC000875089148	ED	On-Demand	Reactive	HDAC10	29	41
CCC(CC)[C@H](NC(=O)NNC(=O)[C@H]1CCC(=O)N1)c1ccccc1	ZINC000875089148	ED	On-Demand	Reactive	HDAC2	17	41
CCC(CC)[C@H](NC(=O)NNC(=O)[C@H]1CCC(=O)N1)c1ccccc1	ZINC000875089148	ED	On-Demand	Reactive	HDAC3	15	41
CCC(CC)[C@H](NC(=O)NNC(=O)[C@H]1CCC(=O)N1)c1ccccc1	ZINC000875089148	ED	On-Demand	Reactive	HDAC6	22	41
CCC(CC)[C@H](NC(=O)NNC(=O)[C@H]1CCC(=O)N1)c1ccccc1	ZINC000875089148	ED	On-Demand	Reactive	HDAC11	42	41
O=C(NCCCCC1CC1)C(=O)NC[C@@H]1CCN(c2ccccc2)C1	ZINC000875089170	EE	On-Demand	Anodyne	ACHE	17	43
O=C(NCCCCC1CC1)C(=O)NC[C@@H]1CCN(c2ccccc2)C1	ZINC000875089170	EE	On-Demand	Anodyne	DRD3	23	43
O=C(NCCCCC1CC1)C(=O)NC[C@H]1CCN(c2ccccc2)C1	ZINC000875089171	EE	On-Demand	Anodyne	ACHE	17	43
O=C(NCCCCC1CC1)C(=O)NC[C@H]1CCN(c2ccccc2)C1	ZINC000875089171	EE	On-Demand	Anodyne	DRD3	23	43
O=C(CCc1ccc(N2CCCS2(=O)=O)cc1)Nc1ncccn1	ZINC000875089213	ED	On-Demand	Anodyne	CDK1	20	45
CN1CCC(CNC(=O)NCc2ccc(C(N)=O)cc2)(c2ccccc2)CC1	ZINC000875089237	GE	On-Demand	Anodyne	OPRM1	15	43
CN1CCC(CNC(=O)NCc2ccc(C(N)=O)cc2)(c2ccccc2)CC1	ZINC000875089237	GE	On-Demand	Anodyne	OPRD1	15	40
CN1CCC(CNC(=O)NCc2ccc(C(N)=O)cc2)(c2ccccc2)CC1	ZINC000875089237	GE	On-Demand	Anodyne	OPRK1	17	40
CN1CCC(CNC(=O)NCc2ccc(C(N)=O)cc2)(c2ccccc2)CC1	ZINC000875089237	GE	On-Demand	Anodyne	KCNA3	48	41
CN1CCC(CNC(=O)NCc2ccc(C(N)=O)cc2)(c2ccccc2)CC1	ZINC000875089237	GE	On-Demand	Anodyne	SOAT1	17	44
CN1CCC(CNC(=O)NCc2ccc(C(N)=O)cc2)(c2ccccc2)CC1	ZINC000875089237	GE	On-Demand	Anodyne	TPSAB1	16	46
CN1CCC(CNC(=O)NCc2ccc(C(N)=O)cc2)(c2ccccc2)CC1	ZINC000875089237	GE	On-Demand	Anodyne	NPFFR1	45	48
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@H]1N2C(=O)c1ccnc(N2CCOCC2)n1	ZINC000875089248	GE	On-Demand	Anodyne	HCRTR1	40	33
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@@H]1N2C(=O)c1ccnc(N2CCOCC2)n1	ZINC000875089249	GE	On-Demand	Anodyne	HCRTR1	40	33
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@@H]1N2C(=O)c1ccnc(N2CCOCC2)n1	ZINC000875089250	GE	On-Demand	Anodyne	HCRTR1	40	33
NC(=O)c1ccc(CNC(=O)N2CCN(c3ccc(F)cc3F)CC2)cc1	ZINC000875089255	FE	On-Demand	Anodyne	NPSR1	24	40
COc1ccc(C)cc1CNC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875089261	GC	On-Demand	Anodyne	L3MBTL3	51	38
NC(=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089270	FE	On-Demand	Anodyne	F2	60	50
NC(=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089270	FE	On-Demand	Anodyne	PLG	63	33
NC(=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089270	FE	On-Demand	Anodyne	KLKB1	42	42
NC(=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089270	FE	On-Demand	Anodyne	PRSS1	36	43
NC(=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089270	FE	On-Demand	Anodyne	TRY1_BOVIN	58	50
NC(=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089270	FE	On-Demand	Anodyne	TRYP_PIG	48	33
NC(=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089270	FE	On-Demand	Anodyne	DPP4	20	47
NC(=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089270	FE	On-Demand	Anodyne	PREP	38	46
NC(=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089270	FE	On-Demand	Anodyne	LGMN	50	35
NC(=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089270	FE	On-Demand	Anodyne	FURIN	38	40
NC(=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089270	FE	On-Demand	Anodyne	TPSAB1	18	47
NC(=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089270	FE	On-Demand	Anodyne	PROC	88	34
NC(=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089270	FE	On-Demand	Anodyne	TMPRSS11D	105	43
NC(=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089271	FE	On-Demand	Anodyne	F2	60	50
NC(=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089271	FE	On-Demand	Anodyne	PLG	63	33
NC(=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089271	FE	On-Demand	Anodyne	KLKB1	42	42
NC(=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089271	FE	On-Demand	Anodyne	PRSS1	36	43
NC(=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089271	FE	On-Demand	Anodyne	TRY1_BOVIN	58	50
NC(=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089271	FE	On-Demand	Anodyne	TRYP_PIG	48	33
NC(=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089271	FE	On-Demand	Anodyne	DPP4	20	47
NC(=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089271	FE	On-Demand	Anodyne	PREP	38	46
NC(=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089271	FE	On-Demand	Anodyne	LGMN	50	35
NC(=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089271	FE	On-Demand	Anodyne	FURIN	38	40
NC(=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089271	FE	On-Demand	Anodyne	TPSAB1	18	47
NC(=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089271	FE	On-Demand	Anodyne	PROC	88	34
NC(=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089271	FE	On-Demand	Anodyne	TMPRSS11D	105	43
NC(=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089272	FE	On-Demand	Anodyne	F2	60	50
NC(=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089272	FE	On-Demand	Anodyne	PLG	63	33
NC(=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089272	FE	On-Demand	Anodyne	KLKB1	42	42
NC(=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089272	FE	On-Demand	Anodyne	PRSS1	36	43
NC(=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089272	FE	On-Demand	Anodyne	TRY1_BOVIN	58	50
NC(=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089272	FE	On-Demand	Anodyne	TRYP_PIG	48	33
NC(=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089272	FE	On-Demand	Anodyne	DPP4	20	47
NC(=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089272	FE	On-Demand	Anodyne	PREP	38	46
NC(=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089272	FE	On-Demand	Anodyne	LGMN	50	35
NC(=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089272	FE	On-Demand	Anodyne	FURIN	38	40
NC(=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089272	FE	On-Demand	Anodyne	TPSAB1	18	47
NC(=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089272	FE	On-Demand	Anodyne	PROC	88	34
NC(=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089272	FE	On-Demand	Anodyne	TMPRSS11D	105	43
NC(=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089273	FE	On-Demand	Anodyne	F2	60	50
NC(=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089273	FE	On-Demand	Anodyne	PLG	63	33
NC(=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089273	FE	On-Demand	Anodyne	KLKB1	42	42
NC(=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089273	FE	On-Demand	Anodyne	PRSS1	36	43
NC(=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089273	FE	On-Demand	Anodyne	TRY1_BOVIN	58	50
NC(=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089273	FE	On-Demand	Anodyne	TRYP_PIG	48	33
NC(=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089273	FE	On-Demand	Anodyne	DPP4	20	47
NC(=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089273	FE	On-Demand	Anodyne	PREP	38	46
NC(=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089273	FE	On-Demand	Anodyne	LGMN	50	35
NC(=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089273	FE	On-Demand	Anodyne	FURIN	38	40
NC(=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089273	FE	On-Demand	Anodyne	TPSAB1	18	47
NC(=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089273	FE	On-Demand	Anodyne	PROC	88	34
NC(=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089273	FE	On-Demand	Anodyne	TMPRSS11D	105	43
NC(=O)c1ccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000875089277	EE	On-Demand	Anodyne	F2	17	40
NC(=O)c1ccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000875089277	EE	On-Demand	Anodyne	EPHX2	21	42
NC(=O)c1ccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000875089277	EE	On-Demand	Anodyne	TMPRSS11D	59	32
NC(=O)c1ccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000875089278	EE	On-Demand	Anodyne	F2	17	40
NC(=O)c1ccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000875089278	EE	On-Demand	Anodyne	EPHX2	21	42
NC(=O)c1ccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000875089278	EE	On-Demand	Anodyne	TMPRSS11D	59	32
O=C(NCc1ncc(Cl)s1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875089287	GE	On-Demand	Anodyne	DRD2	16	45
O=C(NCc1ncc(Cl)s1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875089287	GE	On-Demand	Anodyne	DRD4	38	46
O=C(NCc1ncc(Cl)s1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875089287	GE	On-Demand	Anodyne	SLC6A1	77	35
O=C(NCc1ncc(Cl)s1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875089287	GE	On-Demand	Anodyne	LTA4H	15	40
O=C(NCc1ncc(Cl)s1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875089287	GE	On-Demand	Anodyne	SIGMAR1	36	42
O=C(NCc1ncc(Cl)s1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875089287	GE	On-Demand	Anodyne	CCR3	24	41
O=C(NCc1ncc(Cl)s1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875089287	GE	On-Demand	Anodyne	CCR2	20	43
O=C(NCc1ncc(Cl)s1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875089287	GE	On-Demand	Anodyne	BIRC2	35	44
O=C(NCc1ncc(Cl)s1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089288	GE	On-Demand	Anodyne	DRD2	16	45
O=C(NCc1ncc(Cl)s1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089288	GE	On-Demand	Anodyne	DRD4	38	46
O=C(NCc1ncc(Cl)s1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089288	GE	On-Demand	Anodyne	SLC6A1	77	35
O=C(NCc1ncc(Cl)s1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089288	GE	On-Demand	Anodyne	LTA4H	15	40
O=C(NCc1ncc(Cl)s1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089288	GE	On-Demand	Anodyne	SIGMAR1	36	42
O=C(NCc1ncc(Cl)s1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089288	GE	On-Demand	Anodyne	CCR3	24	41
O=C(NCc1ncc(Cl)s1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089288	GE	On-Demand	Anodyne	CCR2	20	43
O=C(NCc1ncc(Cl)s1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089288	GE	On-Demand	Anodyne	BIRC2	35	44
CCOC(=O)[C@H](C)C1CN(C(=O)NCC(C)(C)c2ccccc2)C1	ZINC000875089312	EF	On-Demand	Anodyne	AMY2	58	34
O=C(NCc1cnn(Cc2ccccc2)c1)C(=O)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875089338	GD	On-Demand	Anodyne	PANC	48	38
O=C(NCc1cnn(Cc2ccccc2)c1)C(=O)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875089340	GD	On-Demand	Anodyne	PANC	48	38
O=C(NCc1cnn(Cc2ccccc2)c1)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875089342	GD	On-Demand	Anodyne	PANC	48	38
NC(=O)c1ccc(CNC(=O)N2Cc3cccnc3N3CCC[C@H]3C2)cc1	ZINC000875089343	FD	On-Demand	Anodyne	NAMPT	30	46
NC(=O)c1ccc(CNC(=O)N2Cc3cccnc3N3CCC[C@H]3C2)cc1	ZINC000875089343	FD	On-Demand	Anodyne	TMPRSS11D	40	33
O=C(NCc1cnn(Cc2ccccc2)c1)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875089344	GD	On-Demand	Anodyne	PANC	48	38
COc1ccc(C)cc1CNC(=O)C(=O)N1CCC[C@@H]1c1cncc(C)c1	ZINC000875089345	FF	On-Demand	Anodyne	HCRTR2	15	40
COc1ccc(C)cc1CNC(=O)C(=O)N1CCC[C@H]1c1cncc(C)c1	ZINC000875089347	FF	On-Demand	Anodyne	HCRTR2	15	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000875089358	FD	On-Demand	Anodyne	SLC6A1	63	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(c3ccccc3)C2)C1	ZINC000875089359	FD	On-Demand	Anodyne	SLC6A1	63	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000875089361	FD	On-Demand	Anodyne	SLC6A1	63	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(c3ccccc3)C2)C1	ZINC000875089363	FD	On-Demand	Anodyne	SLC6A1	63	33
CC(=O)[C@H]1CCCN(C(=O)N[C@H](c2ccccc2)C(C)(C)C)C1	ZINC000875089366	DH	On-Demand	Anodyne	SLC6A1	44	39
CC(=O)[C@H]1CCCN(C(=O)N[C@H](c2ccccc2)C(C)(C)C)C1	ZINC000875089366	DH	On-Demand	Anodyne	CCR5	26	40
CC(=O)[C@H]1CCCN(C(=O)N[C@H](c2ccccc2)C(C)(C)C)C1	ZINC000875089366	DH	On-Demand	Anodyne	DPP7	52	40
CC(=O)[C@H]1CCCN(C(=O)N[C@H](c2ccccc2)C(C)(C)C)C1	ZINC000875089366	DH	On-Demand	Anodyne	BIRC2	43	37
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](c2ccccc2)C(C)(C)C)C1	ZINC000875089368	DH	On-Demand	Anodyne	SLC6A1	44	39
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](c2ccccc2)C(C)(C)C)C1	ZINC000875089368	DH	On-Demand	Anodyne	CCR5	26	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](c2ccccc2)C(C)(C)C)C1	ZINC000875089368	DH	On-Demand	Anodyne	DPP7	52	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](c2ccccc2)C(C)(C)C)C1	ZINC000875089368	DH	On-Demand	Anodyne	BIRC2	43	37
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](c2ccccc2)C(C)(C)C)C1	ZINC000875089370	DH	On-Demand	Anodyne	SLC6A1	44	39
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](c2ccccc2)C(C)(C)C)C1	ZINC000875089370	DH	On-Demand	Anodyne	CCR5	26	40
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](c2ccccc2)C(C)(C)C)C1	ZINC000875089370	DH	On-Demand	Anodyne	DPP7	52	40
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](c2ccccc2)C(C)(C)C)C1	ZINC000875089370	DH	On-Demand	Anodyne	BIRC2	43	37
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](c2ccccc2)C(C)(C)C)C1	ZINC000875089372	DH	On-Demand	Anodyne	SLC6A1	44	39
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](c2ccccc2)C(C)(C)C)C1	ZINC000875089372	DH	On-Demand	Anodyne	CCR5	26	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](c2ccccc2)C(C)(C)C)C1	ZINC000875089372	DH	On-Demand	Anodyne	DPP7	52	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](c2ccccc2)C(C)(C)C)C1	ZINC000875089372	DH	On-Demand	Anodyne	BIRC2	43	37
O=C(NC1(C(=O)Nc2ncccn2)CC1)OCc1ccccc1	ZINC000875089432	DD	On-Demand	Anodyne	GRIN2B	21	44
O=C(NC1(C(=O)Nc2ncccn2)CC1)OCc1ccccc1	ZINC000875089432	DD	On-Demand	Anodyne	CTSK	25	54
O=C(NC1(C(=O)Nc2ncccn2)CC1)OCc1ccccc1	ZINC000875089432	DD	On-Demand	Anodyne	CAPNS1	56	35
O=C(NC1(C(=O)Nc2ncccn2)CC1)OCc1ccccc1	ZINC000875089432	DD	On-Demand	Anodyne	CAPN1	41	35
O=C(NC1(C(=O)Nc2ncccn2)CC1)OCc1ccccc1	ZINC000875089432	DD	On-Demand	Anodyne	CAPN2	64	36
O=C(NC1(C(=O)Nc2ncccn2)CC1)OCc1ccccc1	ZINC000875089432	DD	On-Demand	Anodyne	NPR	46	31
O=C(NC1(C(=O)Nc2ncccn2)CC1)OCc1ccccc1	ZINC000875089432	DD	On-Demand	Anodyne	NAAA	50	38
O=C(NC1(C(=O)Nc2ncccn2)CC1)OCc1ccccc1	ZINC000875089432	DD	On-Demand	Anodyne	SLC12A5	63	35
CC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)C(C)(C)C)CC1	ZINC000875089457	DH	On-Demand	Anodyne	CCR1	32	41
CC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)C(C)(C)C)CC1	ZINC000875089458	DH	On-Demand	Anodyne	CCR1	32	41
NC(=O)c1ccc(CNC(=O)NC2([C@@H]3CCCCO3)CCC2)cc1	ZINC000875089512	EE	On-Demand	Anodyne	PROC	40	33
NC(=O)c1ccc(CNC(=O)NC2([C@H]3CCCCO3)CCC2)cc1	ZINC000875089513	EE	On-Demand	Anodyne	PROC	40	33
CN1CCN(C(=O)NCc2ccc(C(N)=O)cc2)Cc2cccnc21	ZINC000875089526	ED	On-Demand	Anodyne	NAMPT	33	50
CCO[C@H](C(=O)N(C)c1ccccc1C(=O)OC)C1CCCC1	ZINC000875089529	DG	On-Demand	Anodyne	AMY2	44	30
CCO[C@@H](C(=O)N(C)c1ccccc1C(=O)OC)C1CCCC1	ZINC000875089530	DG	On-Demand	Anodyne	AMY2	44	30
COc1ccccc1[C@H]1CN(C(=O)NCc2ccc(C(N)=O)cc2)CCO1	ZINC000875089531	FE	On-Demand	Anodyne	MBTPS1	44	34
COc1ccccc1[C@@H]1CN(C(=O)NCc2ccc(C(N)=O)cc2)CCO1	ZINC000875089532	FE	On-Demand	Anodyne	MBTPS1	44	34
CCC[C@@H](CC)C(=O)Nc1ccccc1S(C)(=O)=O	ZINC000875089548	CF	On-Demand	Anodyne	MME	16	45
CCC[C@@H](CC)C(=O)Nc1ccccc1S(C)(=O)=O	ZINC000875089548	CF	On-Demand	Anodyne	KCNQ2	43	38
CCC[C@H](CC)C(=O)Nc1ccccc1S(C)(=O)=O	ZINC000875089549	CF	On-Demand	Anodyne	MME	16	45
CCC[C@H](CC)C(=O)Nc1ccccc1S(C)(=O)=O	ZINC000875089549	CF	On-Demand	Anodyne	KCNQ2	43	38
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@H]1N2C(=O)c1ccnn1CC1CCC1	ZINC000875089633	FG	On-Demand	Anodyne	HCRTR1	46	36
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@@H]1N2C(=O)c1ccnn1CC1CCC1	ZINC000875089634	FG	On-Demand	Anodyne	HCRTR1	46	36
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@@H]1N2C(=O)c1ccnn1CC1CCC1	ZINC000875089635	FG	On-Demand	Anodyne	HCRTR1	46	36
CCOC1CC2(C1)C[C@H]2C(=O)Nc1ccccc1S(C)(=O)=O	ZINC000875089689	DE	On-Demand	Anodyne	TIMP3	67	32
NC(=O)c1ccc(CNC(=O)N2CC3(CC(=O)N3Cc3ccccc3)C2)cc1	ZINC000875089697	GD	On-Demand	Anodyne	NAMPT	30	41
NC(=O)c1ccc(CNC(=O)N2CC3(CC(=O)N3Cc3ccccc3)C2)cc1	ZINC000875089697	GD	On-Demand	Anodyne	TMPRSS11D	44	31
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875089698	GC	On-Demand	Anodyne	CHRM2	17	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875089698	GC	On-Demand	Anodyne	DRD4	34	48
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875089698	GC	On-Demand	Anodyne	SLC6A1	50	33
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875089698	GC	On-Demand	Anodyne	CHRM3	19	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875089698	GC	On-Demand	Anodyne	SIGMAR1	51	47
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875089698	GC	On-Demand	Anodyne	CCR3	28	45
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875089698	GC	On-Demand	Anodyne	CCR2	16	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875089698	GC	On-Demand	Anodyne	MCHR1	15	48
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875089698	GC	On-Demand	Anodyne	BIRC2	41	47
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875089699	GC	On-Demand	Anodyne	CHRM2	17	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875089699	GC	On-Demand	Anodyne	DRD4	34	48
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875089699	GC	On-Demand	Anodyne	SLC6A1	50	33
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875089699	GC	On-Demand	Anodyne	CHRM3	19	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875089699	GC	On-Demand	Anodyne	SIGMAR1	51	47
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875089699	GC	On-Demand	Anodyne	CCR3	28	45
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875089699	GC	On-Demand	Anodyne	CCR2	16	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875089699	GC	On-Demand	Anodyne	MCHR1	15	48
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875089699	GC	On-Demand	Anodyne	BIRC2	41	47
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875089700	GD	On-Demand	Anodyne	HTR1A	56	52
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875089700	GD	On-Demand	Anodyne	DRD2	67	41
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875089700	GD	On-Demand	Anodyne	DRD4	55	39
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875089700	GD	On-Demand	Anodyne	ACHE	36	45
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875089700	GD	On-Demand	Anodyne	HTR2A	43	45
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875089700	GD	On-Demand	Anodyne	HTR2C	24	41
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875089700	GD	On-Demand	Anodyne	ADRA1A	42	39
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875089700	GD	On-Demand	Anodyne	DRD3	82	41
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875089700	GD	On-Demand	Anodyne	HTR7	37	44
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875089700	GD	On-Demand	Anodyne	SIGMAR1	78	46
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875089700	GD	On-Demand	Anodyne	BCHE	17	45
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875089700	GD	On-Demand	Anodyne	CACNA1G	37	42
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875089700	GD	On-Demand	Anodyne	NPFFR1	51	39
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875089701	GD	On-Demand	Anodyne	HTR1A	56	52
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875089701	GD	On-Demand	Anodyne	DRD2	67	41
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875089701	GD	On-Demand	Anodyne	DRD4	55	39
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875089701	GD	On-Demand	Anodyne	ACHE	36	45
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875089701	GD	On-Demand	Anodyne	HTR2A	43	45
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875089701	GD	On-Demand	Anodyne	HTR2C	24	41
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875089701	GD	On-Demand	Anodyne	ADRA1A	42	39
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875089701	GD	On-Demand	Anodyne	DRD3	82	41
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875089701	GD	On-Demand	Anodyne	HTR7	37	44
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875089701	GD	On-Demand	Anodyne	SIGMAR1	78	46
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875089701	GD	On-Demand	Anodyne	BCHE	17	45
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875089701	GD	On-Demand	Anodyne	CACNA1G	37	42
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875089701	GD	On-Demand	Anodyne	NPFFR1	51	39
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875089705	FD	On-Demand	Anodyne	DRD2	15	48
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875089705	FD	On-Demand	Anodyne	DRD4	40	49
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875089705	FD	On-Demand	Anodyne	SLC6A1	95	34
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875089705	FD	On-Demand	Anodyne	LTA4H	18	41
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875089705	FD	On-Demand	Anodyne	HRH3	23	40
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875089705	FD	On-Demand	Anodyne	SIGMAR1	43	50
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875089705	FD	On-Demand	Anodyne	CCR3	35	44
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875089705	FD	On-Demand	Anodyne	MLNR	47	35
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875089705	FD	On-Demand	Anodyne	CCR2	18	41
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875089705	FD	On-Demand	Anodyne	MCHR1	16	48
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875089705	FD	On-Demand	Anodyne	CACNA1G	20	40
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875089705	FD	On-Demand	Anodyne	BIRC2	46	51
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875089705	FD	On-Demand	Anodyne	WNT3	43	34
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875089706	FD	On-Demand	Anodyne	DRD2	15	48
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875089706	FD	On-Demand	Anodyne	DRD4	40	49
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875089706	FD	On-Demand	Anodyne	SLC6A1	95	34
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875089706	FD	On-Demand	Anodyne	LTA4H	18	41
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875089706	FD	On-Demand	Anodyne	HRH3	23	40
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875089706	FD	On-Demand	Anodyne	SIGMAR1	43	50
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875089706	FD	On-Demand	Anodyne	CCR3	35	44
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875089706	FD	On-Demand	Anodyne	MLNR	47	35
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875089706	FD	On-Demand	Anodyne	CCR2	18	41
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875089706	FD	On-Demand	Anodyne	MCHR1	16	48
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875089706	FD	On-Demand	Anodyne	CACNA1G	20	40
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875089706	FD	On-Demand	Anodyne	BIRC2	46	51
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875089706	FD	On-Demand	Anodyne	WNT3	43	34
COCC(C)(C)CCNC(=O)C(=O)NCc1cc(C)ccc1OC	ZINC000875089788	ED	On-Demand	Anodyne	MT-ND1	17	40
CN1CC[C@H]2CN(C(=O)NCc3ccc(C(N)=O)cc3)CC[C@@H]21	ZINC000875089790	DD	On-Demand	Anodyne	TPSAB1	18	44
CN1CC[C@H]2CN(C(=O)NCc3ccc(C(N)=O)cc3)CC[C@@H]21	ZINC000875089790	DD	On-Demand	Anodyne	TMPRSS11D	52	32
CN1CC[C@H]2CN(C(=O)NCc3ccc(C(N)=O)cc3)CC[C@H]21	ZINC000875089792	DD	On-Demand	Anodyne	TPSAB1	18	44
CN1CC[C@H]2CN(C(=O)NCc3ccc(C(N)=O)cc3)CC[C@H]21	ZINC000875089792	DD	On-Demand	Anodyne	TMPRSS11D	52	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089799	FD	On-Demand	Anodyne	DRD2	16	47
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089799	FD	On-Demand	Anodyne	DRD4	36	51
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089799	FD	On-Demand	Anodyne	SLC6A1	123	36
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089799	FD	On-Demand	Anodyne	LTA4H	17	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089799	FD	On-Demand	Anodyne	SIGMAR1	39	49
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089799	FD	On-Demand	Anodyne	CCR3	33	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089799	FD	On-Demand	Anodyne	MLNR	49	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089799	FD	On-Demand	Anodyne	CCR2	17	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089799	FD	On-Demand	Anodyne	CACNA1G	19	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089799	FD	On-Demand	Anodyne	BIRC2	44	52
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089800	FD	On-Demand	Anodyne	DRD2	16	47
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089800	FD	On-Demand	Anodyne	DRD4	36	51
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089800	FD	On-Demand	Anodyne	SLC6A1	123	36
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089800	FD	On-Demand	Anodyne	LTA4H	17	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089800	FD	On-Demand	Anodyne	SIGMAR1	39	49
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089800	FD	On-Demand	Anodyne	CCR3	33	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089800	FD	On-Demand	Anodyne	MLNR	49	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089800	FD	On-Demand	Anodyne	CCR2	17	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089800	FD	On-Demand	Anodyne	CACNA1G	19	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089800	FD	On-Demand	Anodyne	BIRC2	44	52
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089801	FD	On-Demand	Anodyne	DRD2	16	47
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089801	FD	On-Demand	Anodyne	DRD4	36	51
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089801	FD	On-Demand	Anodyne	SLC6A1	123	36
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089801	FD	On-Demand	Anodyne	LTA4H	17	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089801	FD	On-Demand	Anodyne	SIGMAR1	39	49
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089801	FD	On-Demand	Anodyne	CCR3	33	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089801	FD	On-Demand	Anodyne	MLNR	49	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089801	FD	On-Demand	Anodyne	CCR2	17	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089801	FD	On-Demand	Anodyne	CACNA1G	19	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089801	FD	On-Demand	Anodyne	BIRC2	44	52
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089802	FD	On-Demand	Anodyne	DRD2	16	47
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089802	FD	On-Demand	Anodyne	DRD4	36	51
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089802	FD	On-Demand	Anodyne	SLC6A1	123	36
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089802	FD	On-Demand	Anodyne	LTA4H	17	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089802	FD	On-Demand	Anodyne	SIGMAR1	39	49
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089802	FD	On-Demand	Anodyne	CCR3	33	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089802	FD	On-Demand	Anodyne	MLNR	49	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089802	FD	On-Demand	Anodyne	CCR2	17	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089802	FD	On-Demand	Anodyne	CACNA1G	19	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875089802	FD	On-Demand	Anodyne	BIRC2	44	52
COc1ccc(N2CCN(C(=O)NCc3ccc(C(N)=O)cc3)CC2)c(OC)c1	ZINC000875089820	GD	On-Demand	Clean	HTR1A	40	42
COc1ccc(N2CCN(C(=O)NCc3ccc(C(N)=O)cc3)CC2)c(OC)c1	ZINC000875089820	GD	On-Demand	Clean	DRD2	37	47
COc1ccc(N2CCN(C(=O)NCc3ccc(C(N)=O)cc3)CC2)c(OC)c1	ZINC000875089820	GD	On-Demand	Clean	DRD4	44	35
COc1ccc(N2CCN(C(=O)NCc3ccc(C(N)=O)cc3)CC2)c(OC)c1	ZINC000875089820	GD	On-Demand	Clean	HTR1B	17	42
COc1ccc(N2CCN(C(=O)NCc3ccc(C(N)=O)cc3)CC2)c(OC)c1	ZINC000875089820	GD	On-Demand	Clean	DRD3	53	47
COc1ccc(N2CCN(C(=O)NCc3ccc(C(N)=O)cc3)CC2)c(OC)c1	ZINC000875089820	GD	On-Demand	Clean	PDGFRB	57	39
COc1ccc(N2CCN(C(=O)NCc3ccc(C(N)=O)cc3)CC2)c(OC)c1	ZINC000875089820	GD	On-Demand	Clean	HTR7	33	42
NC(=O)c1ccc(CNC(=O)N[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000875089824	FF	On-Demand	Anodyne	PROC	55	38
NC(=O)c1ccc(CNC(=O)N[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000875089824	FF	On-Demand	Anodyne	NAMPT	69	42
NC(=O)c1ccc(CNC(=O)N[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000875089825	FF	On-Demand	Anodyne	PROC	55	38
NC(=O)c1ccc(CNC(=O)N[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000875089825	FF	On-Demand	Anodyne	NAMPT	69	42
CS(=O)(=O)c1ccccc1NC(=O)c1cccn(C2CC2)c1=O	ZINC000875089833	ED	On-Demand	Anodyne	CCR8	75	37
CC(=O)C1CCN(C(=O)NCc2ccc(C(N)=O)cc2)CC1	ZINC000875089854	DD	On-Demand	Anodyne	F2	17	40
CC(=O)C1CCN(C(=O)NCc2ccc(C(N)=O)cc2)CC1	ZINC000875089854	DD	On-Demand	Anodyne	EPHX2	19	45
CC(=O)C1CCN(C(=O)NCc2ccc(C(N)=O)cc2)CC1	ZINC000875089854	DD	On-Demand	Anodyne	TPSAB1	18	46
CC(=O)C1CCN(C(=O)NCc2ccc(C(N)=O)cc2)CC1	ZINC000875089854	DD	On-Demand	Anodyne	L3MBTL3	42	34
CC(=O)C1CCN(C(=O)NCc2ccc(C(N)=O)cc2)CC1	ZINC000875089854	DD	On-Demand	Anodyne	NAMPT	37	40
CC(=O)C1CCN(C(=O)NCc2ccc(C(N)=O)cc2)CC1	ZINC000875089854	DD	On-Demand	Anodyne	TMPRSS11D	47	33
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089876	GD	On-Demand	Anodyne	DRD2	26	51
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089876	GD	On-Demand	Anodyne	DRD4	42	52
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089876	GD	On-Demand	Anodyne	ACHE	36	40
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089876	GD	On-Demand	Anodyne	SLC6A1	91	33
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089876	GD	On-Demand	Anodyne	DRD3	25	51
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089876	GD	On-Demand	Anodyne	LTA4H	22	40
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089876	GD	On-Demand	Anodyne	SIGMAR1	38	45
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089876	GD	On-Demand	Anodyne	CCR3	25	41
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089876	GD	On-Demand	Anodyne	CCR2	16	40
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089876	GD	On-Demand	Anodyne	MCHR1	20	42
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089876	GD	On-Demand	Anodyne	BIRC2	41	45
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875089877	GD	On-Demand	Anodyne	DRD2	26	51
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875089877	GD	On-Demand	Anodyne	DRD4	42	52
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875089877	GD	On-Demand	Anodyne	ACHE	36	40
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875089877	GD	On-Demand	Anodyne	SLC6A1	91	33
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875089877	GD	On-Demand	Anodyne	DRD3	25	51
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875089877	GD	On-Demand	Anodyne	LTA4H	22	40
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875089877	GD	On-Demand	Anodyne	SIGMAR1	38	45
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875089877	GD	On-Demand	Anodyne	CCR3	25	41
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875089877	GD	On-Demand	Anodyne	CCR2	16	40
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875089877	GD	On-Demand	Anodyne	MCHR1	20	42
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875089877	GD	On-Demand	Anodyne	BIRC2	41	45
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875089885	ED	On-Demand	Anodyne	DRD2	15	48
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875089885	ED	On-Demand	Anodyne	DRD4	37	50
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875089885	ED	On-Demand	Anodyne	SLC6A1	48	33
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875089885	ED	On-Demand	Anodyne	SIGMAR1	55	46
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875089885	ED	On-Demand	Anodyne	CCR3	23	43
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875089885	ED	On-Demand	Anodyne	CCR2	15	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875089885	ED	On-Demand	Anodyne	BIRC2	40	47
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875089886	ED	On-Demand	Anodyne	DRD2	15	48
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875089886	ED	On-Demand	Anodyne	DRD4	37	50
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875089886	ED	On-Demand	Anodyne	SLC6A1	48	33
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875089886	ED	On-Demand	Anodyne	SIGMAR1	55	46
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875089886	ED	On-Demand	Anodyne	CCR3	23	43
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875089886	ED	On-Demand	Anodyne	CCR2	15	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875089886	ED	On-Demand	Anodyne	BIRC2	40	47
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875089887	ED	On-Demand	Anodyne	DRD2	15	48
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875089887	ED	On-Demand	Anodyne	DRD4	37	50
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875089887	ED	On-Demand	Anodyne	SLC6A1	48	33
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875089887	ED	On-Demand	Anodyne	SIGMAR1	55	46
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875089887	ED	On-Demand	Anodyne	CCR3	23	43
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875089887	ED	On-Demand	Anodyne	CCR2	15	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875089887	ED	On-Demand	Anodyne	BIRC2	40	47
O=C(N[C@H]1CC12CCC2)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089888	ED	On-Demand	Anodyne	DRD2	15	48
O=C(N[C@H]1CC12CCC2)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089888	ED	On-Demand	Anodyne	DRD4	37	50
O=C(N[C@H]1CC12CCC2)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089888	ED	On-Demand	Anodyne	SLC6A1	48	33
O=C(N[C@H]1CC12CCC2)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089888	ED	On-Demand	Anodyne	SIGMAR1	55	46
O=C(N[C@H]1CC12CCC2)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089888	ED	On-Demand	Anodyne	CCR3	23	43
O=C(N[C@H]1CC12CCC2)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089888	ED	On-Demand	Anodyne	CCR2	15	42
O=C(N[C@H]1CC12CCC2)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875089888	ED	On-Demand	Anodyne	BIRC2	40	47
Cn1ncc2c1CCC[C@@H]2NC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875089910	GF	On-Demand	Anodyne	AMP1_PLAFQ	18	40
Cn1ncc2c1CCC[C@H]2NC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875089911	GF	On-Demand	Anodyne	AMP1_PLAFQ	18	40
COc1ccc(C)cc1CNC(=O)C(=O)NC[C@@H]1c2ccccc2CN1C	ZINC000875089918	FD	On-Demand	Anodyne	DRD2	16	40
COc1ccc(C)cc1CNC(=O)C(=O)NC[C@@H]1c2ccccc2CN1C	ZINC000875089918	FD	On-Demand	Anodyne	DRD3	19	41
COc1ccc(C)cc1CNC(=O)C(=O)NC[C@H]1c2ccccc2CN1C	ZINC000875089919	FD	On-Demand	Anodyne	DRD2	16	40
COc1ccc(C)cc1CNC(=O)C(=O)NC[C@H]1c2ccccc2CN1C	ZINC000875089919	FD	On-Demand	Anodyne	DRD3	19	41
CC[C@]1(C(=O)Nc2ccc(-c3nc4ccccc4o3)cc2)CCNC1=O	ZINC000875089931	EG	On-Demand	Anodyne	FASN	18	40
CC[C@]1(C(=O)Nc2ccc(-c3nc4ccccc4o3)cc2)CCNC1=O	ZINC000875089931	EG	On-Demand	Anodyne	HPSE	58	40
NC(=O)c1ccc(CNC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)cc1	ZINC000875089933	ED	On-Demand	Anodyne	PROC	47	35
NC(=O)c1ccc(CNC(=O)N2CC[C@H]3CSC[C@@H]3C2)cc1	ZINC000875089935	DD	On-Demand	Anodyne	TPSAB1	16	43
NC(=O)c1ccc(CNC(=O)N2CC[C@@H]3CSC[C@@H]3C2)cc1	ZINC000875089936	DD	On-Demand	Anodyne	TPSAB1	16	43
NC(=O)c1ccc(CNC(=O)N2CC[C@H]3CSC[C@H]3C2)cc1	ZINC000875089937	DD	On-Demand	Anodyne	TPSAB1	16	43
NC(=O)c1ccc(CNC(=O)N2CC[C@@H]3CSC[C@H]3C2)cc1	ZINC000875089938	DD	On-Demand	Anodyne	TPSAB1	16	43
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(C(N)=O)cc2)C1	ZINC000875089942	DD	On-Demand	Anodyne	F2	22	43
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(C(N)=O)cc2)C1	ZINC000875089942	DD	On-Demand	Anodyne	DPP7	77	38
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(C(N)=O)cc2)C1	ZINC000875089942	DD	On-Demand	Anodyne	TPSAB1	15	43
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(C(N)=O)cc2)C1	ZINC000875089942	DD	On-Demand	Anodyne	PROC	46	36
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(C(N)=O)cc2)C1	ZINC000875089942	DD	On-Demand	Anodyne	TMPRSS11D	64	35
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(C(N)=O)cc2)C1	ZINC000875089943	DD	On-Demand	Anodyne	F2	22	43
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(C(N)=O)cc2)C1	ZINC000875089943	DD	On-Demand	Anodyne	DPP7	77	38
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(C(N)=O)cc2)C1	ZINC000875089943	DD	On-Demand	Anodyne	TPSAB1	15	43
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(C(N)=O)cc2)C1	ZINC000875089943	DD	On-Demand	Anodyne	PROC	46	36
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(C(N)=O)cc2)C1	ZINC000875089943	DD	On-Demand	Anodyne	TMPRSS11D	64	35
CCCCCCCNC(=O)C(=O)N[C@H]1CCCc2c1cnn2C	ZINC000875089962	DE	On-Demand	Mild	ASAH1	58	34
CCCCCCCNC(=O)C(=O)N[C@@H]1CCCc2c1cnn2C	ZINC000875089963	DE	On-Demand	Mild	ASAH1	58	34
NC(=O)c1ccc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)cc1	ZINC000875089970	FD	On-Demand	Anodyne	SIGMAR1	19	43
NC(=O)c1ccc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)cc1	ZINC000875089970	FD	On-Demand	Anodyne	FAAH	15	41
NC(=O)c1ccc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)cc1	ZINC000875089970	FD	On-Demand	Anodyne	NPFFR1	49	42
NC(=O)c1ccc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)cc1	ZINC000875089970	FD	On-Demand	Anodyne	NAMPT	23	40
NC(=O)c1ccc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)cc1	ZINC000875089970	FD	On-Demand	Anodyne	TMPRSS11D	50	35
NC(=O)c1ccc(CNC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)cc1	ZINC000875089973	GF	On-Demand	Anodyne	F2	22	45
NC(=O)c1ccc(CNC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)cc1	ZINC000875089973	GF	On-Demand	Anodyne	PLG	60	33
NC(=O)c1ccc(CNC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)cc1	ZINC000875089973	GF	On-Demand	Anodyne	KLKB1	45	33
NC(=O)c1ccc(CNC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)cc1	ZINC000875089973	GF	On-Demand	Anodyne	TRYP_PIG	48	33
NC(=O)c1ccc(CNC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)cc1	ZINC000875089973	GF	On-Demand	Anodyne	PROC	91	36
NC(=O)c1ccc(CNC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)cc1	ZINC000875089973	GF	On-Demand	Anodyne	TMPRSS11D	69	35
NC(=O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089974	FF	On-Demand	Anodyne	F2	51	47
NC(=O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089974	FF	On-Demand	Anodyne	PLG	62	32
NC(=O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089974	FF	On-Demand	Anodyne	KLKB1	42	40
NC(=O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089974	FF	On-Demand	Anodyne	PRSS1	27	41
NC(=O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089974	FF	On-Demand	Anodyne	OPRM1	16	41
NC(=O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089974	FF	On-Demand	Anodyne	TRY1_BOVIN	44	44
NC(=O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089974	FF	On-Demand	Anodyne	TRYP_PIG	47	32
NC(=O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089974	FF	On-Demand	Anodyne	CPT1A	24	42
NC(=O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089974	FF	On-Demand	Anodyne	PREP	32	43
NC(=O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089974	FF	On-Demand	Anodyne	LGMN	42	34
NC(=O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089974	FF	On-Demand	Anodyne	TPSAB1	16	48
NC(=O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089974	FF	On-Demand	Anodyne	PROC	89	35
NC(=O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089974	FF	On-Demand	Anodyne	TMPRSS11D	103	41
NC(=O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089975	FF	On-Demand	Anodyne	F2	51	47
NC(=O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089975	FF	On-Demand	Anodyne	PLG	62	32
NC(=O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089975	FF	On-Demand	Anodyne	KLKB1	42	40
NC(=O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089975	FF	On-Demand	Anodyne	PRSS1	27	41
NC(=O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089975	FF	On-Demand	Anodyne	OPRM1	16	41
NC(=O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089975	FF	On-Demand	Anodyne	TRY1_BOVIN	44	44
NC(=O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089975	FF	On-Demand	Anodyne	TRYP_PIG	47	32
NC(=O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089975	FF	On-Demand	Anodyne	CPT1A	24	42
NC(=O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089975	FF	On-Demand	Anodyne	PREP	32	43
NC(=O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089975	FF	On-Demand	Anodyne	LGMN	42	34
NC(=O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089975	FF	On-Demand	Anodyne	TPSAB1	16	48
NC(=O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089975	FF	On-Demand	Anodyne	PROC	89	35
NC(=O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875089975	FF	On-Demand	Anodyne	TMPRSS11D	103	41
NC(=O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089976	FF	On-Demand	Anodyne	F2	51	47
NC(=O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089976	FF	On-Demand	Anodyne	PLG	62	32
NC(=O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089976	FF	On-Demand	Anodyne	KLKB1	42	40
NC(=O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089976	FF	On-Demand	Anodyne	PRSS1	27	41
NC(=O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089976	FF	On-Demand	Anodyne	OPRM1	16	41
NC(=O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089976	FF	On-Demand	Anodyne	TRY1_BOVIN	44	44
NC(=O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089976	FF	On-Demand	Anodyne	TRYP_PIG	47	32
NC(=O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089976	FF	On-Demand	Anodyne	CPT1A	24	42
NC(=O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089976	FF	On-Demand	Anodyne	PREP	32	43
NC(=O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089976	FF	On-Demand	Anodyne	LGMN	42	34
NC(=O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089976	FF	On-Demand	Anodyne	TPSAB1	16	48
NC(=O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089976	FF	On-Demand	Anodyne	PROC	89	35
NC(=O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089976	FF	On-Demand	Anodyne	TMPRSS11D	103	41
NC(=O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089977	FF	On-Demand	Anodyne	F2	51	47
NC(=O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089977	FF	On-Demand	Anodyne	PLG	62	32
NC(=O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089977	FF	On-Demand	Anodyne	KLKB1	42	40
NC(=O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089977	FF	On-Demand	Anodyne	PRSS1	27	41
NC(=O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089977	FF	On-Demand	Anodyne	OPRM1	16	41
NC(=O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089977	FF	On-Demand	Anodyne	TRY1_BOVIN	44	44
NC(=O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089977	FF	On-Demand	Anodyne	TRYP_PIG	47	32
NC(=O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089977	FF	On-Demand	Anodyne	CPT1A	24	42
NC(=O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089977	FF	On-Demand	Anodyne	PREP	32	43
NC(=O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089977	FF	On-Demand	Anodyne	LGMN	42	34
NC(=O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089977	FF	On-Demand	Anodyne	TPSAB1	16	48
NC(=O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089977	FF	On-Demand	Anodyne	PROC	89	35
NC(=O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875089977	FF	On-Demand	Anodyne	TMPRSS11D	103	41
C[C@H]1CCC[C@@H](C2CN(C(=O)NCc3ccc(C(N)=O)cc3)C2)C1	ZINC000875090001	EF	On-Demand	Anodyne	PROC	47	34
CCO[C@@H](C(=O)Nc1nc2ccccc2nc1N1CCCC1)[C@@H]1CCOC1	ZINC000875090052	FF	On-Demand	Anodyne	KCNQ2	42	33
CCO[C@@H](C(=O)Nc1nc2ccccc2nc1N1CCCC1)[C@H]1CCOC1	ZINC000875090053	FF	On-Demand	Anodyne	KCNQ2	42	33
C#CC[C@@H](COC)NC(=O)C(=O)NCC1(N2CCSCC2)CCCC1	ZINC000875090055	FC	On-Demand	Mild	HCN1	51	33
C#CC[C@@H](COC)NC(=O)C(=O)NCC1(N2CCSCC2)CCCC1	ZINC000875090055	FC	On-Demand	Mild	HCN4	49	33
C#CC[C@H](COC)NC(=O)C(=O)NCC1(N2CCSCC2)CCCC1	ZINC000875090056	FC	On-Demand	Mild	HCN1	51	33
C#CC[C@H](COC)NC(=O)C(=O)NCC1(N2CCSCC2)CCCC1	ZINC000875090056	FC	On-Demand	Mild	HCN4	49	33
CC[C@H](NC(=O)c1c(Cl)nn(C)c1Cl)c1ccc(Cl)cc1	ZINC000875090089	EI	On-Demand	Anodyne	AKT3	19	40
CC[C@H](NC(=O)c1c(Cl)nn(C)c1Cl)c1ccc(Cl)cc1	ZINC000875090089	EI	On-Demand	Anodyne	TACR3	51	43
CC[C@H](NC(=O)c1c(Cl)nn(C)c1Cl)c1ccc(Cl)cc1	ZINC000875090089	EI	On-Demand	Anodyne	UTS2	49	40
CCOC1CC2(C1)C[C@H]2C(=O)N(Cc1ccccc1)c1ccccn1	ZINC000875090094	EH	On-Demand	Anodyne	TIMP3	48	36
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCC1(c2ccc(F)cc2)CC1	ZINC000875090099	GE	On-Demand	Anodyne	KCNA3	43	35
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCC1(c2ccc(F)cc2)CC1	ZINC000875090100	GE	On-Demand	Anodyne	KCNA3	43	35
O=C(NCC1(c2ccccc2)CCOCC1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875090101	GC	On-Demand	Anodyne	KCNA3	41	41
N#CCc1ccsc1C(=O)N1CCC[C@H]1c1ccccc1	ZINC000875090103	CH	On-Demand	Mild	PREP	57	37
N#CCc1ccsc1C(=O)N1CCC[C@@H]1c1ccccc1	ZINC000875090104	CH	On-Demand	Mild	PREP	57	37
C[C@@H](Cn1ccnc1)NC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875090110	GD	On-Demand	Anodyne	NPY2R	70	38
O=C(NCCCCC1CC1)C(=O)NCC1(c2ccccc2)CCOCC1	ZINC000875090111	FF	On-Demand	Anodyne	KCNA3	47	39
O=C(NCCCCC1CC1)C(=O)NCC1(c2ccccc2)CCOCC1	ZINC000875090111	FF	On-Demand	Anodyne	ICMT	46	37
NC(=O)CCOC(=O)[C@H]1COc2ccc(Cl)cc2C1	ZINC000875090121	CD	On-Demand	Anodyne	ROCK2	20	45
NC(=O)CCOC(=O)[C@@H]1COc2ccc(Cl)cc2C1	ZINC000875090122	CD	On-Demand	Anodyne	ROCK2	20	45
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccc3ncccc3c2)C1	ZINC000875090133	ED	On-Demand	Anodyne	HCRTR1	20	42
C[C@@H](Cn1ccnc1)NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875090146	FD	On-Demand	Anodyne	C3AR1	40	40
C[C@@H](Cn1ccnc1)NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875090148	FD	On-Demand	Anodyne	C3AR1	40	40
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCC2(c3ccc(F)cc3)CC2)C1	ZINC000875090156	ED	On-Demand	Anodyne	KCNA3	47	39
CCCCCCCNC(=O)C(=O)NCc1ccc2ncccc2c1	ZINC000875090169	EF	On-Demand	Mild	S1PR2	41	33
CCCCCCCNC(=O)C(=O)NCc1ccc2ncccc2c1	ZINC000875090169	EF	On-Demand	Mild	ASAH1	58	33
CCCCCCCNC(=O)C(=O)NCc1ccc2ncccc2c1	ZINC000875090169	EF	On-Demand	Mild	SUCNR1	40	36
NC(=O)c1ccc(CNC(=O)NC2CC(Nc3ccccc3)C2)cc1	ZINC000875090170	EE	On-Demand	Anodyne	LTA4H	16	41
NC(=O)c1ccc(CNC(=O)NC2CC(Nc3ccccc3)C2)cc1	ZINC000875090170	EE	On-Demand	Anodyne	EPHX2	15	46
NC(=O)c1ccc(CNC(=O)NC2CC(Nc3ccccc3)C2)cc1	ZINC000875090170	EE	On-Demand	Anodyne	PROC	41	35
O=C(NCC1(N2CCSCC2)CCCC1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875090190	GC	On-Demand	Anodyne	HCN1	50	30
O=C(NCC1(N2CCSCC2)CCCC1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875090190	GC	On-Demand	Anodyne	HCN4	48	30
C[C@@H](Cn1ccnc1)NC(=O)C(=O)NCc1cn(C(F)F)c2ccccc12	ZINC000875090199	GE	On-Demand	Anodyne	TBXAS1	20	40
C[C@@H](Cn1ccnc1)NC(=O)C(=O)NCc1ccc(C(C)(C)C)o1	ZINC000875090201	ED	On-Demand	Anodyne	TBXAS1	25	40
O=C(NCC1(c2ccccc2)CCOCC1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875090210	GE	On-Demand	Anodyne	KCNA3	40	38
O=C(NCC1(c2ccccc2)CCOCC1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875090211	GE	On-Demand	Anodyne	KCNA3	40	38
O=C(NCC1(c2ccccc2)CCOCC1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875090212	GE	On-Demand	Anodyne	KCNA3	40	38
O=C(NCC1(c2ccccc2)CCOCC1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875090213	GE	On-Demand	Anodyne	KCNA3	40	38
C[C@@H](Cn1ccnc1)NC(=O)C(=O)NCc1ccc(Br)cn1	ZINC000875090218	FC	On-Demand	Anodyne	TBXAS1	24	45
C=CC(C)(C)CCCNC(=O)C(=O)NCC1(c2ccccc2)CCOCC1	ZINC000875090231	FF	On-Demand	Mild	KCNA3	46	38
C=CC(C)(C)CCCNC(=O)C(=O)NCC1(c2ccccc2)CCOCC1	ZINC000875090231	FF	On-Demand	Mild	ICMT	83	41
COc1ccc(-c2nc(C)c(C(=O)OCCC(N)=O)s2)cc1OC	ZINC000875090241	FE	On-Demand	Anodyne	DCK	47	40
COc1ccc(-c2nc(C)c(C(=O)OCCC(N)=O)s2)cc1OC	ZINC000875090241	FE	On-Demand	Anodyne	PPARD	28	45
COc1ccc(-c2nc(C)c(C(=O)OCCC(N)=O)s2)cc1OC	ZINC000875090241	FE	On-Demand	Anodyne	ABCG2	17	40
O=C(NCC[C@H]1CCSC1)C(=O)NCC1(N2CCSCC2)CCCC1	ZINC000875090253	GD	On-Demand	Anodyne	HCN1	51	32
O=C(NCC[C@H]1CCSC1)C(=O)NCC1(N2CCSCC2)CCCC1	ZINC000875090253	GD	On-Demand	Anodyne	HCN4	49	32
O=C(NCC[C@@H]1CCSC1)C(=O)NCC1(N2CCSCC2)CCCC1	ZINC000875090254	GD	On-Demand	Anodyne	HCN1	51	32
O=C(NCC[C@@H]1CCSC1)C(=O)NCC1(N2CCSCC2)CCCC1	ZINC000875090254	GD	On-Demand	Anodyne	HCN4	49	32
N#CCc1ccsc1C(=O)Nc1ccc(N2CCCCC2)cc1C(N)=O	ZINC000875090270	FG	On-Demand	Mild	CSF1R	20	45
CN1CCN(C2CCN(C(=O)C(=O)NCc3ccc4ncccc4c3)CC2)CC1	ZINC000875090278	GD	On-Demand	Anodyne	CCR3	23	49
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2(c3ccc(F)cc3)CC2)C1	ZINC000875090307	ED	On-Demand	Anodyne	CACNA1G	26	47
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2(c3ccc(F)cc3)CC2)C1	ZINC000875090308	ED	On-Demand	Anodyne	CACNA1G	26	47
C=CC(C)(C)CCCNC(=O)C(=O)N[C@H](C)Cn1ccnc1	ZINC000875090309	DD	On-Demand	Mild	TBXAS1	20	44
C=CC(C)(C)CCCNC(=O)C(=O)N[C@@H](C)Cn1ccnc1	ZINC000875090310	DD	On-Demand	Mild	TBXAS1	20	44
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2(c3ccccc3)CCOCC2)C1	ZINC000875090331	FD	On-Demand	Anodyne	KCNA3	46	39
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2(c3ccccc3)CCOCC2)C1	ZINC000875090332	FD	On-Demand	Anodyne	KCNA3	46	39
CC(=O)C1CCN(C(=O)C(=O)NCC2(c3ccccc3)CCOCC2)CC1	ZINC000875090363	FD	On-Demand	Anodyne	KCNA3	48	40
CC(=O)C1CCN(C(=O)C(=O)NCC2(c3ccccc3)CCOCC2)CC1	ZINC000875090363	FD	On-Demand	Anodyne	ICMT	55	35
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1(c2ccccc2)CCOCC1	ZINC000875090377	FD	On-Demand	Mild	KCNA3	46	41
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1(c2ccccc2)CCOCC1	ZINC000875090378	FD	On-Demand	Mild	KCNA3	46	41
C[C@@H](Cn1ccnc1)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875090417	GD	On-Demand	Anodyne	DRD4	31	40
C[C@@H](Cn1ccnc1)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875090417	GD	On-Demand	Anodyne	ACHE	56	56
C[C@@H](Cn1ccnc1)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875090417	GD	On-Demand	Anodyne	HTR4	35	46
C[C@@H](Cn1ccnc1)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875090417	GD	On-Demand	Anodyne	TBXAS1	40	39
C[C@@H](Cn1ccnc1)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875090417	GD	On-Demand	Anodyne	SIGMAR1	35	42
C[C@@H](Cn1ccnc1)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875090417	GD	On-Demand	Anodyne	MCHR1	18	49
C[C@@H](Cn1ccnc1)NC(=O)C(=O)NCc1cc(C(F)(F)F)cc(Cl)n1	ZINC000875090454	GD	On-Demand	Anodyne	TBXAS1	18	41
C[C@@H](Cn1ccnc1)NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875090477	FD	On-Demand	Anodyne	OXTR	50	45
C[C@@H](Cn1ccnc1)NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875090479	FD	On-Demand	Anodyne	OXTR	50	45
NC(=O)c1ccc(CNC(=O)N2C[C@@H]3C[C@H]2CN3c2ccccc2)cc1	ZINC000875090486	FD	On-Demand	Anodyne	TMPRSS11D	48	33
CCC1(CC)CCCN1C(=O)NCc1ccc(C(N)=O)cc1	ZINC000875090487	DF	On-Demand	Anodyne	SLC12A5	56	34
CC[C@@H](NC(=O)c1sccc1CC#N)c1ccc(Cl)cc1	ZINC000875090503	DI	On-Demand	Mild	UTS2	48	39
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCC2(c3ccccc3)CCOCC2)C1	ZINC000875090509	FD	On-Demand	Anodyne	KCNA3	54	43
CCO[C@@H](C(=O)Nc1cccnc1Cl)C(C)C	ZINC000875090552	CF	On-Demand	Anodyne	G2YM83_BOTF4	78	41
O=C(Nc1ccc(NC(=O)[C@@H]2C[C@H]2c2ccco2)c(C(F)(F)F)c1)C1CC1	ZINC000875090553	GI	On-Demand	Anodyne	TYK2	51	34
COC(=O)N(C)NC(=O)NCc1cccc(CN(C)C)c1	ZINC000875090554	CD	On-Demand	Reactive	ROCK2	32	44
CC[C@]1(C(=O)Nc2ccc(S(=O)(=O)CC)cc2)CCNC1=O	ZINC000875090564	DD	On-Demand	Anodyne	RORC	40	35
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000875090575	GD	On-Demand	Anodyne	CCR5	18	44
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000875090575	GD	On-Demand	Anodyne	NAMPT	41	38
Cc1cc(C2(C(=O)Nc3cccnc3Cl)CCOCC2)on1	ZINC000875090577	DF	On-Demand	Anodyne	G2YM83_BOTF4	70	36
CCCCCCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1	ZINC000875090593	GE	On-Demand	Mild	NPY2R	49	34
CCCCCCCNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1	ZINC000875090593	GE	On-Demand	Mild	ASAH1	91	48
O=C(NC[C@@H]1CCCc2ccccc21)N1CCC(CO)(CO)CC1	ZINC000875090611	ED	On-Demand	Anodyne	HTR6	36	40
O=C(NC[C@H]1CCCc2ccccc21)N1CCC(CO)(CO)CC1	ZINC000875090612	ED	On-Demand	Anodyne	HTR6	36	40
COc1cccc(C(C)(C)C(=O)Nc2cccnc2Cl)c1	ZINC000875090637	DH	On-Demand	Anodyne	P2RY1	23	45
COc1cccc(C(C)(C)C(=O)Nc2cccnc2Cl)c1	ZINC000875090637	DH	On-Demand	Anodyne	G2YM83_BOTF4	69	35
CN(C)C[C@@H]1CN(C(=O)NCc2ccc(S(C)(=O)=O)cc2)C[C@H]1CN(C)C	ZINC000875090643	GC	On-Demand	Anodyne	CCR5	21	42
CN(C)C[C@@H]1CN(C(=O)NCc2ccc(S(C)(=O)=O)cc2)C[C@H]1CN(C)C	ZINC000875090643	GC	On-Demand	Anodyne	NAMPT	38	44
C[C@@H](Cn1ccnc1)NC(=O)C(=O)NCc1ncc(Cl)s1	ZINC000875090696	EC	On-Demand	Anodyne	TBXAS1	21	42
COCC(C)(C)CCNC(=O)C(=O)NCC1(c2ccccc2)CCOCC1	ZINC000875090699	GE	On-Demand	Anodyne	KCNA3	50	42
COCC(C)(C)CCNC(=O)C(=O)NCC1(c2ccccc2)CCOCC1	ZINC000875090699	GE	On-Demand	Anodyne	ICMT	88	44
C[C@H](NC(=O)C(=O)NCC1(c2ccccc2)CCOCC1)c1ccnn1C	ZINC000875090701	FD	On-Demand	Anodyne	KCNA3	43	39
C[C@H](NC(=O)C(=O)NCC1(c2ccccc2)CCOCC1)c1ccnn1C	ZINC000875090701	FD	On-Demand	Anodyne	SOAT1	16	44
O=C(NCc1ccc2ncccc2c1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875090709	GF	On-Demand	Anodyne	TMPRSS11D	56	33
O=C(NCc1ccc2ncccc2c1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875090711	GF	On-Demand	Anodyne	TMPRSS11D	56	33
O=C(NCc1ccc2ncccc2c1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875090713	GF	On-Demand	Anodyne	TMPRSS11D	56	33
O=C(NCc1ccc2ncccc2c1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875090716	GF	On-Demand	Anodyne	TMPRSS11D	56	33
CC(=O)C1CCN(C(=O)C(=O)NCC2(c3ccc(F)cc3)CC2)CC1	ZINC000875090737	ED	On-Demand	Anodyne	KCNA3	40	34
CC(=O)C1CCN(C(=O)C(=O)NCC2(c3ccc(F)cc3)CC2)CC1	ZINC000875090737	ED	On-Demand	Anodyne	CACNA1G	37	48
COCC(C)(C)CCNC(=O)C(=O)NCC1(N2CCSCC2)CCCC1	ZINC000875090760	GD	On-Demand	Anodyne	HCN1	52	33
COCC(C)(C)CCNC(=O)C(=O)NCC1(N2CCSCC2)CCCC1	ZINC000875090760	GD	On-Demand	Anodyne	HCN4	50	33
C[C@@H](Cn1ccnc1)NC(=O)C(=O)NCC1(c2cccc(Cl)c2)CCC1	ZINC000875090812	FE	On-Demand	Anodyne	TBXAS1	19	41
O=C(NCC1(N2CCSCC2)CCCC1)C(=O)N[C@H]1CC12CCC2	ZINC000875090822	FD	On-Demand	Anodyne	HCN1	50	31
O=C(NCC1(N2CCSCC2)CCCC1)C(=O)N[C@H]1CC12CCC2	ZINC000875090822	FD	On-Demand	Anodyne	HCN4	49	31
O=C(NCC1(N2CCSCC2)CCCC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875090824	FD	On-Demand	Anodyne	HCN1	50	31
O=C(NCC1(N2CCSCC2)CCCC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875090824	FD	On-Demand	Anodyne	HCN4	49	31
Cn1nc(Cl)c(C(=O)N2CCC[C@@H]2c2ccccc2)c1Cl	ZINC000875090829	DH	On-Demand	Anodyne	KCNA5	16	41
Cn1nc(Cl)c(C(=O)N2CCC[C@@H]2c2ccccc2)c1Cl	ZINC000875090829	DH	On-Demand	Anodyne	PREP	45	34
Cn1nc(Cl)c(C(=O)N2CCC[C@H]2c2ccccc2)c1Cl	ZINC000875090832	DH	On-Demand	Anodyne	KCNA5	16	41
Cn1nc(Cl)c(C(=O)N2CCC[C@H]2c2ccccc2)c1Cl	ZINC000875090832	DH	On-Demand	Anodyne	PREP	45	34
O=C(NCc1ccc(Cn2cccn2)cc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875090833	GH	On-Demand	Anodyne	EPHX2	22	43
O=C(NCc1ccc(Cn2cccn2)cc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875090835	GH	On-Demand	Anodyne	EPHX2	22	43
O=C(NCCO)C1CCN(C(=O)NCc2ccc(Cn3cccn3)cc2)CC1	ZINC000875090837	GC	On-Demand	Anodyne	EPHX2	17	43
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCN4CCC[C@H]4C3)cn2)cc1	ZINC000875090838	FF	On-Demand	Mild	ITK	15	48
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCN4CCC[C@H]4C3)cn2)cc1	ZINC000875090838	FF	On-Demand	Mild	PANC	49	36
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCN4CCC[C@@H]4C3)cn2)cc1	ZINC000875090840	FF	On-Demand	Mild	ITK	15	48
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCN4CCC[C@@H]4C3)cn2)cc1	ZINC000875090840	FF	On-Demand	Mild	PANC	49	36
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCN4CCC[C@H]4C3)cn2)cc1	ZINC000875090841	FF	On-Demand	Mild	ITK	15	48
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCN4CCC[C@H]4C3)cn2)cc1	ZINC000875090841	FF	On-Demand	Mild	PANC	49	36
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCN4CCC[C@@H]4C3)cn2)cc1	ZINC000875090842	FF	On-Demand	Mild	ITK	15	48
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCN4CCC[C@@H]4C3)cn2)cc1	ZINC000875090842	FF	On-Demand	Mild	PANC	49	36
CC[C@@H](NC(=O)NCc1ccnn1C)[C@@H](O)c1ccccc1	ZINC000875090843	DD	On-Demand	Anodyne	TACR3	42	33
CC[C@@H](NC(=O)NCc1ccnn1C)[C@H](O)c1ccccc1	ZINC000875090845	DD	On-Demand	Anodyne	TACR3	42	33
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875090851	GF	On-Demand	Anodyne	DRD4	27	45
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875090851	GF	On-Demand	Anodyne	ACHE	28	40
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875090851	GF	On-Demand	Anodyne	KCNH2	17	42
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875090851	GF	On-Demand	Anodyne	SIGMAR1	25	58
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875090851	GF	On-Demand	Anodyne	SSTR5	51	37
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875090851	GF	On-Demand	Anodyne	CCR3	55	47
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875090851	GF	On-Demand	Anodyne	CXCR3	37	42
O=C(NCCCCC1CC1)C(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875090851	GF	On-Demand	Anodyne	MCHR1	54	52
C[C@@H]1C[C@]1(C(=O)Nc1cccnc1Cl)C(=O)OC(C)(C)C	ZINC000875090867	DG	On-Demand	Anodyne	G2YM83_BOTF4	76	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCOCCc2ccccc2)C1	ZINC000875090880	FD	On-Demand	Anodyne	FKBP1A	54	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCOCCc2ccccc2)C1	ZINC000875090880	FD	On-Demand	Anodyne	SLC6A1	46	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCOCCc2ccccc2)C1	ZINC000875090880	FD	On-Demand	Anodyne	PREP	61	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCOCCc2ccccc2)C1	ZINC000875090881	FD	On-Demand	Anodyne	FKBP1A	54	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCOCCc2ccccc2)C1	ZINC000875090881	FD	On-Demand	Anodyne	SLC6A1	46	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCOCCc2ccccc2)C1	ZINC000875090881	FD	On-Demand	Anodyne	PREP	61	40
N#C[C@]1(C(=O)Nc2cccnc2Cl)CCCOC1	ZINC000875090892	CD	On-Demand	Mild	G2YM83_BOTF4	70	36
N#C[C@@]1(C(=O)Nc2cccnc2Cl)CCCOC1	ZINC000875090893	CD	On-Demand	Mild	G2YM83_BOTF4	70	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000875090904	FD	On-Demand	Anodyne	SLC6A4	27	50
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000875090904	FD	On-Demand	Anodyne	SLC6A3	49	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000875090904	FD	On-Demand	Anodyne	NAMPT	45	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000875090905	FD	On-Demand	Anodyne	SLC6A4	27	50
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000875090905	FD	On-Demand	Anodyne	SLC6A3	49	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000875090905	FD	On-Demand	Anodyne	NAMPT	45	37
O=C(NC[C@H]1CCCc2ccccc21)N[C@@H]1CCOC[C@H]1O	ZINC000875090908	DD	On-Demand	Anodyne	HTR6	21	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCNC(=O)c1cccs1	ZINC000875090915	FD	On-Demand	Anodyne	SLC6A3	40	43
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875090947	GD	On-Demand	Mild	DRD4	17	40
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875090947	GD	On-Demand	Mild	SIGMAR1	20	52
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875090947	GD	On-Demand	Mild	SSTR5	59	37
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875090947	GD	On-Demand	Mild	CCR3	28	42
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875090947	GD	On-Demand	Mild	MCHR1	45	46
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875090948	GD	On-Demand	Mild	DRD4	17	40
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875090948	GD	On-Demand	Mild	SIGMAR1	20	52
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875090948	GD	On-Demand	Mild	SSTR5	59	37
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875090948	GD	On-Demand	Mild	CCR3	28	42
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875090948	GD	On-Demand	Mild	MCHR1	45	46
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NCc1ccnn1C	ZINC000875090954	FF	On-Demand	Anodyne	SIGMAR1	15	44
CC(=O)N1CCC[C@@H]1C(=O)n1ccccc1=NC(C)C	ZINC000875090962	CD	On-Demand	Anodyne	PREP	79	40
Cn1nccc1CNC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875090963	DD	On-Demand	Anodyne	EPHX2	15	51
Cn1nccc1CNC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875090964	DD	On-Demand	Anodyne	EPHX2	15	51
COc1cccc(OC)c1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875090971	FF	On-Demand	Anodyne	HTR1A	27	46
COc1cccc(OC)c1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875090971	FF	On-Demand	Anodyne	DRD2	43	35
COc1cccc(OC)c1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875090971	FF	On-Demand	Anodyne	DRD4	42	33
COc1cccc(OC)c1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875090971	FF	On-Demand	Anodyne	DRD3	37	46
COc1cccc(OC)c1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875090971	FF	On-Demand	Anodyne	PREP	18	48
COc1cccc(OC)c1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875090971	FF	On-Demand	Anodyne	HCN1	44	37
COc1cccc(OC)c1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875090971	FF	On-Demand	Anodyne	L3MBTL3	72	38
COc1cccc(OC)c1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875090971	FF	On-Demand	Anodyne	HPGD	28	42
COc1cccc(OC)c1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875090971	FF	On-Demand	Anodyne	NAMPT	23	43
NC(=O)c1ccc(CN(C(=O)NCCOC(F)(F)C(F)(F)F)C2CC2)cc1	ZINC000875090986	GF	On-Demand	Anodyne	GCGR	18	41
NC(=O)c1ccc(CN(C(=O)NCCOC(F)(F)C(F)(F)F)C2CC2)cc1	ZINC000875090986	GF	On-Demand	Anodyne	GIPR	45	41
CC(=O)C1CCN(C(=O)C(=O)NCC2(N3CCSCC3)CCCC2)CC1	ZINC000875090993	GD	On-Demand	Anodyne	HCN1	55	34
CC(=O)C1CCN(C(=O)C(=O)NCC2(N3CCSCC3)CCCC2)CC1	ZINC000875090993	GD	On-Demand	Anodyne	HCN4	53	34
C[C@@H](Cn1ccnc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875091004	DB	On-Demand	Anodyne	TBXAS1	59	39
CC(C)[C@H](CNC(=O)C(=O)N[C@H](C)c1cc2cnccc2o1)c1ccccc1	ZINC000875091005	GH	On-Demand	Anodyne	KCNA5	18	44
C[C@@H](Cn1ccnc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875091006	DB	On-Demand	Anodyne	TBXAS1	59	39
CC(C)[C@H](CNC(=O)C(=O)N[C@@H](C)c1cc2cnccc2o1)c1ccccc1	ZINC000875091008	GH	On-Demand	Anodyne	KCNA5	18	44
O=C(NCC1(c2ccccc2)CCOCC1)C(=O)N[C@H]1CC12CCC2	ZINC000875091021	ED	On-Demand	Anodyne	KCNA3	44	39
O=C(NCC1(c2ccccc2)CCOCC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875091024	ED	On-Demand	Anodyne	KCNA3	44	39
O=C(NCCC[C@@H]1C=CCC1)C(=O)NCC1(c2ccccc2)CCOCC1	ZINC000875091027	FF	On-Demand	Anodyne	KCNA3	44	36
O=C(NCCC[C@H]1C=CCC1)C(=O)NCC1(c2ccccc2)CCOCC1	ZINC000875091029	FF	On-Demand	Anodyne	KCNA3	44	36
O=C(NCC[C@H]1CCSC1)C(=O)NCC1(c2ccccc2)CCOCC1	ZINC000875091043	GE	On-Demand	Anodyne	KCNA3	44	35
O=C(NCC[C@H]1CCSC1)C(=O)NCC1(c2ccccc2)CCOCC1	ZINC000875091043	GE	On-Demand	Anodyne	ICMT	46	34
O=C(NCC[C@@H]1CCSC1)C(=O)NCC1(c2ccccc2)CCOCC1	ZINC000875091045	GE	On-Demand	Anodyne	KCNA3	44	35
O=C(NCC[C@@H]1CCSC1)C(=O)NCC1(c2ccccc2)CCOCC1	ZINC000875091045	GE	On-Demand	Anodyne	ICMT	46	34
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1(N2CCSCC2)CCCC1	ZINC000875091064	GD	On-Demand	Mild	HCN1	54	34
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1(N2CCSCC2)CCCC1	ZINC000875091064	GD	On-Demand	Mild	HCN4	51	34
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1(N2CCSCC2)CCCC1	ZINC000875091065	GD	On-Demand	Mild	HCN1	54	34
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1(N2CCSCC2)CCCC1	ZINC000875091065	GD	On-Demand	Mild	HCN4	51	34
O=C(c1ccc(CNC(=O)C2(c3cccc(F)c3)CCCC2)cc1)N1CCCC1	ZINC000875091092	GI	On-Demand	Anodyne	L3MBTL3	44	34
O=C(c1ccc(CNC(=O)C2(c3cccc(F)c3)CCCC2)cc1)N1CCCC1	ZINC000875091092	GI	On-Demand	Anodyne	NAMPT	15	42
CCCCCCCNC(=O)C(=O)N[C@H](C)Cn1ccnc1	ZINC000875091106	CD	On-Demand	Mild	TBXAS1	33	49
CCCCCCCNC(=O)C(=O)N[C@H](C)Cn1ccnc1	ZINC000875091106	CD	On-Demand	Mild	ASAH1	80	36
CCCCCCCNC(=O)C(=O)N[C@@H](C)Cn1ccnc1	ZINC000875091107	CD	On-Demand	Mild	TBXAS1	33	49
CCCCCCCNC(=O)C(=O)N[C@@H](C)Cn1ccnc1	ZINC000875091107	CD	On-Demand	Mild	ASAH1	80	36
C#CC[C@@H](COC)NC(=O)C(=O)NCC1(c2ccccc2)CCOCC1	ZINC000875091114	FD	On-Demand	Mild	KCNA3	44	39
C#CC[C@H](COC)NC(=O)C(=O)NCC1(c2ccccc2)CCOCC1	ZINC000875091115	FD	On-Demand	Mild	KCNA3	44	39
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCc1ccc(C(N)=O)cc1)CC2	ZINC000875091118	GF	On-Demand	Anodyne	SLC18A2	47	35
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCc1ccc(C(N)=O)cc1)CC2	ZINC000875091118	GF	On-Demand	Anodyne	HCRTR1	17	52
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCc1ccc(C(N)=O)cc1)CC2	ZINC000875091118	GF	On-Demand	Anodyne	MTNR1B	16	48
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCc1ccc(C(N)=O)cc1)CC2	ZINC000875091118	GF	On-Demand	Anodyne	HCRTR2	15	46
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCc1ccc(C(N)=O)cc1)CC2	ZINC000875091120	GF	On-Demand	Anodyne	SLC18A2	47	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCc1ccc(C(N)=O)cc1)CC2	ZINC000875091120	GF	On-Demand	Anodyne	HCRTR1	17	52
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCc1ccc(C(N)=O)cc1)CC2	ZINC000875091120	GF	On-Demand	Anodyne	MTNR1B	16	48
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCc1ccc(C(N)=O)cc1)CC2	ZINC000875091120	GF	On-Demand	Anodyne	HCRTR2	15	46
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H](C)Cn1ccnc1)CC2	ZINC000875091126	GD	On-Demand	Anodyne	SLC18A2	49	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H](C)Cn1ccnc1)CC2	ZINC000875091128	GD	On-Demand	Anodyne	SLC18A2	49	34
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@@H](C)Cn1ccnc1)CC2	ZINC000875091130	GD	On-Demand	Anodyne	SLC18A2	49	34
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@H](C)Cn1ccnc1)CC2	ZINC000875091132	GD	On-Demand	Anodyne	SLC18A2	49	34
CCO[C@H]1COCC[C@@H]1CC(=O)N(Cc1ccccc1)c1ccccn1	ZINC000875091134	FG	On-Demand	Anodyne	TIMP3	48	36
CCO[C@H]1COCC[C@H]1CC(=O)N(Cc1ccccc1)c1ccccn1	ZINC000875091135	FG	On-Demand	Anodyne	TIMP3	48	36
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(S(C)(=O)=O)cc2)C1	ZINC000875091159	FD	On-Demand	Anodyne	CCR5	22	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(S(C)(=O)=O)cc2)C1	ZINC000875091159	FD	On-Demand	Anodyne	MAPK9	25	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(S(C)(=O)=O)cc2)C1	ZINC000875091159	FD	On-Demand	Anodyne	MAPK8	22	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(S(C)(=O)=O)cc2)C1	ZINC000875091159	FD	On-Demand	Anodyne	GPR119	23	43
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(S(C)(=O)=O)cc2)C1	ZINC000875091159	FD	On-Demand	Anodyne	NAMPT	31	41
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875091162	GE	On-Demand	Anodyne	DRD4	24	44
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875091162	GE	On-Demand	Anodyne	KCNH2	16	41
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875091162	GE	On-Demand	Anodyne	SIGMAR1	23	59
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875091162	GE	On-Demand	Anodyne	SSTR5	44	38
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875091162	GE	On-Demand	Anodyne	CCR3	37	45
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875091162	GE	On-Demand	Anodyne	CXCR3	34	42
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875091162	GE	On-Demand	Anodyne	MCHR1	50	51
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875091162	GE	On-Demand	Anodyne	CACNA1G	21	41
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875091163	GE	On-Demand	Anodyne	DRD4	24	44
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875091163	GE	On-Demand	Anodyne	KCNH2	16	41
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875091163	GE	On-Demand	Anodyne	SIGMAR1	23	59
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875091163	GE	On-Demand	Anodyne	SSTR5	44	38
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875091163	GE	On-Demand	Anodyne	CCR3	37	45
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875091163	GE	On-Demand	Anodyne	CXCR3	34	42
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875091163	GE	On-Demand	Anodyne	MCHR1	50	51
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875091163	GE	On-Demand	Anodyne	CACNA1G	21	41
CN(C)C[C@@H]1CN(C(=O)NC[C@H]2CCCc3ccccc32)C[C@H]1CN(C)C	ZINC000875091176	FE	On-Demand	Anodyne	HTR6	31	40
CN(C)C[C@@H]1CN(C(=O)NC[C@@H]2CCCc3ccccc32)C[C@H]1CN(C)C	ZINC000875091177	FE	On-Demand	Anodyne	HTR6	31	40
Cc1ccnn1CC(=O)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F	ZINC000875091185	FG	On-Demand	Anodyne	EPHX2	18	42
Cc1ccnn1CC(=O)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F	ZINC000875091185	FG	On-Demand	Anodyne	TYK2	43	35
CC[C@]1(C(=O)Nc2cccnc2Cl)CCNC1=O	ZINC000875091206	CD	On-Demand	Anodyne	G2YM83_BOTF4	79	42
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000875091210	ED	On-Demand	Anodyne	ANPEP	16	42
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000875091210	ED	On-Demand	Anodyne	CTSF	42	33
CC(C)(C(=O)Nc1cccnc1Cl)c1cccc(C(F)(F)F)n1	ZINC000875091227	EI	On-Demand	Anodyne	G2YM83_BOTF4	71	37
CC(=O)C1CCN(C(=O)C(=O)NCCCCOCCc2ccccc2)CC1	ZINC000875091238	FD	On-Demand	Anodyne	FKBP1A	42	39
CC(=O)C1CCN(C(=O)C(=O)NCCCCOCCc2ccccc2)CC1	ZINC000875091238	FD	On-Demand	Anodyne	AMP1_PLAFQ	24	40
O=C(COc1ccccc1O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875091256	FE	On-Demand	Anodyne	FABI	44	36
O=C(COc1ccccc1O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875091256	FE	On-Demand	Anodyne	L3MBTL3	65	38
CC(=O)N1CCC[C@@H]1C(=O)n1ccc(C)cc1=NC1CCCCC1	ZINC000875091266	EF	On-Demand	Anodyne	PREP	44	36
CCOC1CC2(C1)C[C@@H]2NC(=O)N(Cc1ccc(C(N)=O)cc1)C1CC1	ZINC000875091267	FE	On-Demand	Anodyne	TIMP3	42	30
CCOC1CC2(C1)C[C@H]2NC(=O)N(Cc1ccc(C(N)=O)cc1)C1CC1	ZINC000875091268	FE	On-Demand	Anodyne	TIMP3	42	30
Cn1nccc1CNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875091281	DD	On-Demand	Anodyne	CTSV	47	43
Cn1nccc1CNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875091282	DD	On-Demand	Anodyne	CTSV	47	43
O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875091294	JD	On-Demand	Anodyne	NAMPT	38	42
CCO[C@@H](C(=O)Nc1nc2ccccc2nc1N1CCCC1)C1CCOCC1	ZINC000875091309	GG	On-Demand	Anodyne	KCNQ2	44	36
COCC(C)(C)CCNC(=O)C(=O)NCC1(c2ccc(F)cc2)CC1	ZINC000875091326	FE	On-Demand	Anodyne	KCNA3	40	34
O=C(CC(F)(F)C(F)(F)F)N(Cc1ccccc1)c1ccccn1	ZINC000875091362	EI	On-Demand	Anodyne	MLYCD	18	40
Cn1nc(Cl)c(C(=O)Nc2ccc(N3CCCCC3)cc2C(N)=O)c1Cl	ZINC000875091363	GG	On-Demand	Anodyne	CSF1R	24	41
CCC(CC)(CNC(=O)N(Cc1ccc(C(N)=O)cc1)C1CC1)C(F)(F)F	ZINC000875091413	GH	On-Demand	Anodyne	GCGR	15	40
CCC(CC)(CNC(=O)N(Cc1ccc(C(N)=O)cc1)C1CC1)C(F)(F)F	ZINC000875091413	GH	On-Demand	Anodyne	GIPR	38	40
CC(=O)N1CCC[C@@H]1C(=O)n1ccccc1=NC1CCCCC1	ZINC000875091419	DE	On-Demand	Anodyne	PREP	77	38
CN1CC[C@H]2CN(C(=O)C(=O)NCC3(N4CCSCC4)CCCC3)CC[C@H]21	ZINC000875091440	GD	On-Demand	Anodyne	HCN1	51	33
CN1CC[C@H]2CN(C(=O)C(=O)NCC3(N4CCSCC4)CCCC3)CC[C@H]21	ZINC000875091440	GD	On-Demand	Anodyne	HCN4	50	33
CN1CC[C@H]2CN(C(=O)C(=O)NCC3(N4CCSCC4)CCCC3)CC[C@@H]21	ZINC000875091442	GD	On-Demand	Anodyne	HCN1	51	33
CN1CC[C@H]2CN(C(=O)C(=O)NCC3(N4CCSCC4)CCCC3)CC[C@@H]21	ZINC000875091442	GD	On-Demand	Anodyne	HCN4	50	33
O=C1C[C@H](C(F)(F)F)[C@@H](C(=O)Nc2cccnc2Cl)CN1	ZINC000875091492	DD	On-Demand	Anodyne	G2YM83_BOTF4	70	37
O=C1C[C@@H](C(F)(F)F)[C@@H](C(=O)Nc2cccnc2Cl)CN1	ZINC000875091493	DD	On-Demand	Anodyne	G2YM83_BOTF4	70	37
O=C1C[C@@H](C(F)(F)F)[C@H](C(=O)Nc2cccnc2Cl)CN1	ZINC000875091494	DD	On-Demand	Anodyne	G2YM83_BOTF4	70	37
O=C1C[C@H](C(F)(F)F)[C@H](C(=O)Nc2cccnc2Cl)CN1	ZINC000875091495	DD	On-Demand	Anodyne	G2YM83_BOTF4	70	37
O=C(NCCO)C1CCN(C(=O)NC[C@@H]2CCCc3ccccc32)CC1	ZINC000875091500	FD	On-Demand	Anodyne	HTR6	22	42
O=C(NCCO)C1CCN(C(=O)NC[C@@H]2CCCc3ccccc32)CC1	ZINC000875091500	FD	On-Demand	Anodyne	MTNR1A	15	42
O=C(NCCO)C1CCN(C(=O)NC[C@@H]2CCCc3ccccc32)CC1	ZINC000875091500	FD	On-Demand	Anodyne	MTNR1B	17	42
O=C(NCCO)C1CCN(C(=O)NC[C@H]2CCCc3ccccc32)CC1	ZINC000875091501	FD	On-Demand	Anodyne	HTR6	22	42
O=C(NCCO)C1CCN(C(=O)NC[C@H]2CCCc3ccccc32)CC1	ZINC000875091501	FD	On-Demand	Anodyne	MTNR1A	15	42
O=C(NCCO)C1CCN(C(=O)NC[C@H]2CCCc3ccccc32)CC1	ZINC000875091501	FD	On-Demand	Anodyne	MTNR1B	17	42
COC(=O)N(C)NC(=O)NC[C@H]1CCCc2ccccc21	ZINC000875091519	CE	On-Demand	Reactive	HTR6	27	42
COC(=O)N(C)NC(=O)NC[C@H]1CCCc2ccccc21	ZINC000875091519	CE	On-Demand	Reactive	MTNR1A	21	42
COC(=O)N(C)NC(=O)NC[C@H]1CCCc2ccccc21	ZINC000875091519	CE	On-Demand	Reactive	MTNR1B	21	42
COC(=O)N(C)NC(=O)NC[C@@H]1CCCc2ccccc21	ZINC000875091520	CE	On-Demand	Reactive	HTR6	27	42
COC(=O)N(C)NC(=O)NC[C@@H]1CCCc2ccccc21	ZINC000875091520	CE	On-Demand	Reactive	MTNR1A	21	42
COC(=O)N(C)NC(=O)NC[C@@H]1CCCc2ccccc21	ZINC000875091520	CE	On-Demand	Reactive	MTNR1B	21	42
CC(C)(C(=O)Nc1cccnc1Cl)[C@H]1CCCCO1	ZINC000875091527	CG	On-Demand	Anodyne	G2YM83_BOTF4	74	40
CC(C)(C(=O)Nc1cccnc1Cl)[C@@H]1CCCCO1	ZINC000875091528	CG	On-Demand	Anodyne	G2YM83_BOTF4	74	40
CN1CC[C@H]2CN(C(=O)C(=O)NCC3(c4ccccc4)CCOCC3)CC[C@@H]21	ZINC000875091552	GD	On-Demand	Anodyne	KCNA3	46	40
CN1CC[C@H]2CN(C(=O)C(=O)NCC3(c4ccccc4)CCOCC3)CC[C@H]21	ZINC000875091555	GD	On-Demand	Anodyne	KCNA3	46	40
O=C(NCc1ncc(Cl)s1)C(=O)NCC1(c2ccccc2)CCOCC1	ZINC000875091563	GE	On-Demand	Anodyne	KCNA3	41	35
C[C@H](NC(=O)C(=O)NCC1(N2CCSCC2)CCCC1)c1ccnn1C	ZINC000875091571	GD	On-Demand	Anodyne	HCN1	76	40
C[C@H](NC(=O)C(=O)NCC1(N2CCSCC2)CCCC1)c1ccnn1C	ZINC000875091571	GD	On-Demand	Anodyne	HCN4	58	40
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc3ncccc3c2)CC1	ZINC000875091573	ED	On-Demand	Anodyne	NAMPT	43	36
O=C(c1ccc(C(=O)n2ccccc2=NC2CCCCC2)cc1)N1CCOCC1	ZINC000875091574	GF	On-Demand	Anodyne	L3MBTL3	68	38
C[C@@H](Cn1ccnc1)NC(=O)C(=O)NCc1ncc(Br)s1	ZINC000875091576	FC	On-Demand	Anodyne	TBXAS1	15	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cn2cccn2)cc1	ZINC000875091588	FE	On-Demand	Anodyne	SLC6A3	48	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cn2cccn2)cc1	ZINC000875091589	FE	On-Demand	Anodyne	SLC6A3	48	39
O=C(NCC1(c2ccccc2)CCOCC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875091595	FE	On-Demand	Anodyne	KCNA3	44	39
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc3ncccc3c2)C1	ZINC000875091597	ED	On-Demand	Anodyne	NMT1	28	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc3ncccc3c2)C1	ZINC000875091597	ED	On-Demand	Anodyne	CCR3	16	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc3ncccc3c2)C1	ZINC000875091598	ED	On-Demand	Anodyne	NMT1	28	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc3ncccc3c2)C1	ZINC000875091598	ED	On-Demand	Anodyne	CCR3	16	43
CC(=O)N1CCC[C@@H]1C(=O)n1ccccc1=Nc1ccccc1	ZINC000875091599	DE	On-Demand	Anodyne	PREP	96	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2(N3CCSCC3)CCCC2)C1	ZINC000875091607	GD	On-Demand	Anodyne	HCN1	56	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2(N3CCSCC3)CCCC2)C1	ZINC000875091607	GD	On-Demand	Anodyne	HCN4	54	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2(N3CCSCC3)CCCC2)C1	ZINC000875091609	GD	On-Demand	Anodyne	HCN1	56	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2(N3CCSCC3)CCCC2)C1	ZINC000875091609	GD	On-Demand	Anodyne	HCN4	54	35
COc1ccccc1[C@@H]1CSCCCN1C(=O)NCc1ccc(C(N)=O)cc1	ZINC000875091622	GG	On-Demand	Anodyne	MBTPS1	40	32
COc1ccccc1[C@@H]1CSCCCN1C(=O)NCc1ccc(C(N)=O)cc1	ZINC000875091622	GG	On-Demand	Anodyne	TMPRSS11D	47	32
O=C(NCc1ccc(Cn2cccn2)cc1)N1CCC(CO)(CO)CC1	ZINC000875091624	FD	On-Demand	Anodyne	NAMPT	30	40
O=C(N[C@@H]1CCN2CCC[C@@H]2C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875091628	EE	On-Demand	Anodyne	EPHX2	20	44
O=C(N[C@@H]1CCN2CCC[C@H]2C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875091629	EE	On-Demand	Anodyne	EPHX2	20	44
O=C(N[C@@H]1CCN2CCC[C@@H]2C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875091630	EE	On-Demand	Anodyne	EPHX2	20	44
O=C(N[C@@H]1CCN2CCC[C@H]2C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875091631	EE	On-Demand	Anodyne	EPHX2	20	44
CC(=O)N(C)c1ccc(CNC(=O)N(Cc2ccc(C(N)=O)cc2)C2CC2)cc1	ZINC000875091662	GF	On-Demand	Anodyne	GIPR	48	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccnn1C	ZINC000875091669	CC	On-Demand	Anodyne	SLC6A3	67	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccnn1C	ZINC000875091670	CC	On-Demand	Anodyne	SLC6A3	67	39
CC(C)[C@H](CNC(=O)C(=O)NCc1ncc(Cl)s1)c1ccccc1	ZINC000875091672	FF	On-Demand	Anodyne	KCNA5	15	42
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCCOCCc2ccccc2)C1	ZINC000875091779	GE	On-Demand	Anodyne	FKBP1A	46	38
C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C(=O)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F	ZINC000875091787	FI	On-Demand	Anodyne	EPHX2	15	42
C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C(=O)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F	ZINC000875091787	FI	On-Demand	Anodyne	TYK2	45	35
C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C(=O)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F	ZINC000875091788	FI	On-Demand	Anodyne	EPHX2	15	42
C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C(=O)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F	ZINC000875091788	FI	On-Demand	Anodyne	TYK2	45	35
C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C(=O)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F	ZINC000875091789	FI	On-Demand	Anodyne	EPHX2	15	42
C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C(=O)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F	ZINC000875091789	FI	On-Demand	Anodyne	TYK2	45	35
C[C@@H]1CN(C(=O)NCc2ccc(S(C)(=O)=O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000875091800	GE	On-Demand	Anodyne	CCR5	18	40
C[C@@H]1CN(C(=O)NCc2ccc(S(C)(=O)=O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000875091800	GE	On-Demand	Anodyne	GPR119	25	40
C[C@@H]1CN(C(=O)NCc2ccc(S(C)(=O)=O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000875091800	GE	On-Demand	Anodyne	NAMPT	45	41
C[C@@H]1CN(C(=O)NCc2ccc(S(C)(=O)=O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000875091802	GE	On-Demand	Anodyne	CCR5	18	40
C[C@@H]1CN(C(=O)NCc2ccc(S(C)(=O)=O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000875091802	GE	On-Demand	Anodyne	GPR119	25	40
C[C@@H]1CN(C(=O)NCc2ccc(S(C)(=O)=O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000875091802	GE	On-Demand	Anodyne	NAMPT	45	41
O=C(N[C@@H]1CCSc2c(F)cccc21)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875091808	GH	On-Demand	Anodyne	CALCRL	38	40
O=C(N[C@@H]1CCSc2c(F)cccc21)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875091809	GH	On-Demand	Anodyne	CALCRL	38	40
O=C(N[C@H]1CCSc2c(F)cccc21)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875091810	GH	On-Demand	Anodyne	CALCRL	38	40
O=C(N[C@H]1CCSc2c(F)cccc21)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875091811	GH	On-Demand	Anodyne	CALCRL	38	40
Cc1nnc(NNC(=O)NC[C@H]2CCCc3ccccc32)n1C	ZINC000875091812	DD	On-Demand	Reactive	HTR6	23	42
Cc1nnc(NNC(=O)NC[C@@H]2CCCc3ccccc32)n1C	ZINC000875091813	DD	On-Demand	Reactive	HTR6	23	42
CC[C@@H]1COCCN1CCNC(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000875091816	FD	On-Demand	Anodyne	NAMPT	41	36
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H](c2ccccc2)C(C)C)C1	ZINC000875091837	EE	On-Demand	Anodyne	SLC6A1	62	38
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H](c2ccccc2)C(C)C)C1	ZINC000875091838	EE	On-Demand	Anodyne	SLC6A1	62	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H](c2ccccc2)C(C)C)C1	ZINC000875091839	EE	On-Demand	Anodyne	SLC6A1	62	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H](c2ccccc2)C(C)C)C1	ZINC000875091840	EE	On-Demand	Anodyne	SLC6A1	62	38
Cn1nccc1CNC(=O)N1CC[C@@H](c2cccc(Cl)c2)C1(C)C	ZINC000875091850	EH	On-Demand	Anodyne	MDM2	55	31
Cn1nccc1CNC(=O)N1CC[C@H](c2cccc(Cl)c2)C1(C)C	ZINC000875091851	EH	On-Demand	Anodyne	MDM2	55	31
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(CN(C)C)c1	ZINC000875091911	DE	On-Demand	Anodyne	ANPEP	18	44
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(CN(C)C)c1	ZINC000875091911	DE	On-Demand	Anodyne	ROCK2	15	42
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(CN(C)C)c1	ZINC000875091911	DE	On-Demand	Anodyne	PDS	51	33
CN1CCC(CNC(=O)N2CCC(CC(N)=O)CC2)(c2ccccc2)CC1	ZINC000875091918	FD	On-Demand	Anodyne	KCNA3	49	41
COc1ccccc1-n1nccc1[C@@H]1OCC[C@H]1C(=O)Nc1cccnc1Cl	ZINC000875091919	GH	On-Demand	Anodyne	G2YM83_BOTF4	44	31
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1c(Cl)cccc1Cl	ZINC000875091936	GI	On-Demand	Anodyne	AVPR2	19	40
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1c(Cl)cccc1Cl	ZINC000875091936	GI	On-Demand	Anodyne	P2RX7	16	41
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1c(Cl)cccc1Cl	ZINC000875091936	GI	On-Demand	Anodyne	PREP	23	51
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1c(Cl)cccc1Cl	ZINC000875091936	GI	On-Demand	Anodyne	EPHX2	17	41
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1c(Cl)cccc1Cl	ZINC000875091936	GI	On-Demand	Anodyne	DPP7	53	37
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1c(Cl)cccc1Cl	ZINC000875091936	GI	On-Demand	Anodyne	L3MBTL3	89	45
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1c(Cl)cccc1Cl	ZINC000875091936	GI	On-Demand	Anodyne	NAMPT	45	46
CCC[C@@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)OCC	ZINC000875091949	GD	On-Demand	Clean	NPY2R	62	35
CCC[C@H](CNC(=O)C(=O)NCc1ccc(N2CCOCC2)c(F)c1)OCC	ZINC000875091951	GD	On-Demand	Clean	NPY2R	62	35
CCCCCCCNC(=O)C(=O)NCCc1c(C)nn(C)c1C	ZINC000875091986	DD	On-Demand	Mild	ASAH1	84	36
CN1CC[C@H]2CN(C(=O)C(=O)NCCCCOCCc3ccccc3)CC[C@@H]21	ZINC000875092003	GD	On-Demand	Anodyne	CYSLTR2	47	32
CN1CC[C@H]2CN(C(=O)C(=O)NCCCCOCCc3ccccc3)CC[C@H]21	ZINC000875092005	GD	On-Demand	Anodyne	CYSLTR2	47	32
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(CN(C)C)c1	ZINC000875092013	ED	On-Demand	Anodyne	SLC6A4	30	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(CN(C)C)c1	ZINC000875092013	ED	On-Demand	Anodyne	SLC6A3	55	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(CN(C)C)c1	ZINC000875092014	ED	On-Demand	Anodyne	SLC6A4	30	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(CN(C)C)c1	ZINC000875092014	ED	On-Demand	Anodyne	SLC6A3	55	41
O=C1NCC[C@]1(C(=O)Nc1cccnc1Cl)C1CCCC1	ZINC000875092017	DE	On-Demand	Anodyne	G2YM83_BOTF4	70	37
O=C1NCC[C@@]1(C(=O)Nc1cccnc1Cl)C1CCCC1	ZINC000875092018	DE	On-Demand	Anodyne	G2YM83_BOTF4	70	37
N#CCc1ccsc1C(=O)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F	ZINC000875092080	GI	On-Demand	Mild	DHODH	15	41
CC[C@@H](NC(=O)NCc1cccc(CN(C)C)c1)[C@@H](O)c1ccccc1	ZINC000875092092	FG	On-Demand	Anodyne	ANPEP	15	42
CC[C@@H](NC(=O)NCc1cccc(CN(C)C)c1)[C@@H](O)c1ccccc1	ZINC000875092092	FG	On-Demand	Anodyne	PDS	58	36
CC[C@@H](NC(=O)NCc1cccc(CN(C)C)c1)[C@H](O)c1ccccc1	ZINC000875092094	FG	On-Demand	Anodyne	ANPEP	15	42
CC[C@@H](NC(=O)NCc1cccc(CN(C)C)c1)[C@H](O)c1ccccc1	ZINC000875092094	FG	On-Demand	Anodyne	PDS	58	36
Cn1nccc1CNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875092107	ED	On-Demand	Anodyne	FAAH	18	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cc(Br)ccc2F)C1	ZINC000875092125	GF	On-Demand	Anodyne	P2RX7	17	40
CCC1(CC)CCCN1C(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000875092130	EF	On-Demand	Anodyne	SLC12A5	44	44
CCC1(CC)CCCN1C(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000875092130	EF	On-Demand	Anodyne	NAMPT	67	41
COCC(C)(C)CCNC(=O)N(Cc1ccc(C(N)=O)cc1)C1CC1	ZINC000875092163	EF	On-Demand	Anodyne	GCGR	19	42
COCC(C)(C)CCNC(=O)N(Cc1ccc(C(N)=O)cc1)C1CC1	ZINC000875092163	EF	On-Demand	Anodyne	MBTPS1	45	33
NC(=O)CC1CCN(C(=O)N[C@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875092167	FE	On-Demand	Anodyne	GRIN2B	15	43
NC(=O)CC1CCN(C(=O)N[C@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875092167	FE	On-Demand	Anodyne	C3AR1	47	46
NC(=O)CC1CCN(C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875092168	FE	On-Demand	Anodyne	GRIN2B	15	43
NC(=O)CC1CCN(C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875092168	FE	On-Demand	Anodyne	C3AR1	47	46
Cn1nccc1CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875092225	EE	On-Demand	Mild	CTSV	47	33
Cn1nccc1CNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875092237	EE	On-Demand	Mild	CTSV	47	33
O=C(N[C@H]1CCN2CCC[C@H]2C1)N1Cc2cccc(O)c2C1	ZINC000875092238	DE	On-Demand	Clean	L3MBTL3	63	40
O=C(N[C@@H]1CCN2CCC[C@H]2C1)N1Cc2cccc(O)c2C1	ZINC000875092241	DE	On-Demand	Clean	L3MBTL3	63	40
O=C(N[C@H]1CCN2CCC[C@@H]2C1)N1Cc2cccc(O)c2C1	ZINC000875092243	DE	On-Demand	Clean	L3MBTL3	63	40
O=C(N[C@@H]1CCN2CCC[C@@H]2C1)N1Cc2cccc(O)c2C1	ZINC000875092245	DE	On-Demand	Clean	L3MBTL3	63	40
CC(C)(C)OC(=O)C1(C(=O)Nc2cccnc2Cl)CCSCC1	ZINC000875092260	FH	On-Demand	Anodyne	G2YM83_BOTF4	71	37
Cn1nc(Cl)c(C(=O)Nc2cccc(Cl)c2N2CCOCC2)c1Cl	ZINC000875092270	GG	On-Demand	Anodyne	EPHB3	31	41
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccnn2C)CC1	ZINC000875092297	EF	On-Demand	Anodyne	DRD2	15	43
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccnn2C)CC1	ZINC000875092297	EF	On-Demand	Anodyne	EPHX2	19	44
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccnn2C)CC1	ZINC000875092298	EF	On-Demand	Anodyne	DRD2	15	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccnn2C)CC1	ZINC000875092298	EF	On-Demand	Anodyne	EPHX2	19	44
CCCCCCCNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1	ZINC000875092352	GE	On-Demand	Mild	NPY2R	46	35
CCCCCCCNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1	ZINC000875092352	GE	On-Demand	Mild	ASAH1	90	38
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCCc3ccccc32)C1	ZINC000875092366	EF	On-Demand	Anodyne	ACE	17	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCCc3ccccc32)C1	ZINC000875092369	EF	On-Demand	Anodyne	ACE	17	41
O=C(Cc1ccc(Cl)cn1)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F	ZINC000875092373	GI	On-Demand	Anodyne	TYK2	52	38
CC[C@@H](NC(=O)NCc1ccc(S(C)(=O)=O)cc1)[C@@H](O)c1ccccc1	ZINC000875092386	GE	On-Demand	Anodyne	PTGS2	19	40
CC[C@@H](NC(=O)NCc1ccc(S(C)(=O)=O)cc1)[C@@H](O)c1ccccc1	ZINC000875092386	GE	On-Demand	Anodyne	ANPEP	15	43
CC[C@@H](NC(=O)NCc1ccc(S(C)(=O)=O)cc1)[C@@H](O)c1ccccc1	ZINC000875092386	GE	On-Demand	Anodyne	CTSF	42	35
CC[C@@H](NC(=O)NCc1ccc(S(C)(=O)=O)cc1)[C@@H](O)c1ccccc1	ZINC000875092386	GE	On-Demand	Anodyne	CCR5	19	48
CC[C@@H](NC(=O)NCc1ccc(S(C)(=O)=O)cc1)[C@@H](O)c1ccccc1	ZINC000875092386	GE	On-Demand	Anodyne	NAMPT	32	40
CC[C@@H](NC(=O)NCc1ccc(S(C)(=O)=O)cc1)[C@@H](O)c1ccccc1	ZINC000875092386	GE	On-Demand	Anodyne	PDS	42	34
CC[C@@H](NC(=O)NCc1ccc(S(C)(=O)=O)cc1)[C@H](O)c1ccccc1	ZINC000875092387	GE	On-Demand	Anodyne	PTGS2	19	40
CC[C@@H](NC(=O)NCc1ccc(S(C)(=O)=O)cc1)[C@H](O)c1ccccc1	ZINC000875092387	GE	On-Demand	Anodyne	ANPEP	15	43
CC[C@@H](NC(=O)NCc1ccc(S(C)(=O)=O)cc1)[C@H](O)c1ccccc1	ZINC000875092387	GE	On-Demand	Anodyne	CTSF	42	35
CC[C@@H](NC(=O)NCc1ccc(S(C)(=O)=O)cc1)[C@H](O)c1ccccc1	ZINC000875092387	GE	On-Demand	Anodyne	CCR5	19	48
CC[C@@H](NC(=O)NCc1ccc(S(C)(=O)=O)cc1)[C@H](O)c1ccccc1	ZINC000875092387	GE	On-Demand	Anodyne	NAMPT	32	40
CC[C@@H](NC(=O)NCc1ccc(S(C)(=O)=O)cc1)[C@H](O)c1ccccc1	ZINC000875092387	GE	On-Demand	Anodyne	PDS	42	34
COc1ccc2c(c1)CC[C@H]2C(=O)N(C)c1nc2ccccc2s1	ZINC000875092411	EH	On-Demand	Anodyne	PPARG	22	44
COc1ccc2c(c1)CC[C@H]2C(=O)N(C)c1nc2ccccc2s1	ZINC000875092411	EH	On-Demand	Anodyne	PPARD	30	44
CN(C(=O)[C@H](F)[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1nc2ccccc2s1	ZINC000875092425	GH	On-Demand	Anodyne	GPR119	27	40
CN(C(=O)[C@H](F)[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1nc2ccccc2s1	ZINC000875092427	GH	On-Demand	Anodyne	GPR119	27	40
C[C@H]1CCC[C@@H](C2CN(C(=O)NCc3ccc(S(C)(=O)=O)cc3)C2)C1	ZINC000875092433	FG	On-Demand	Anodyne	NAMPT	48	41
O=C(N[C@@H]1CCN2CCC[C@@H]2C1)N1CCC[C@@](F)(c2ccccc2)C1	ZINC000875092451	EG	On-Demand	Anodyne	EPHX2	18	44
O=C(N[C@@H]1CCN2CCC[C@H]2C1)N1CCC[C@@](F)(c2ccccc2)C1	ZINC000875092452	EG	On-Demand	Anodyne	EPHX2	18	44
O=C(N[C@@H]1CCN2CCC[C@@H]2C1)N1CCC[C@](F)(c2ccccc2)C1	ZINC000875092453	EG	On-Demand	Anodyne	EPHX2	18	44
O=C(N[C@@H]1CCN2CCC[C@H]2C1)N1CCC[C@](F)(c2ccccc2)C1	ZINC000875092454	EG	On-Demand	Anodyne	EPHX2	18	44
CN1CCC(CNC(=O)N[C@H]2CCN3CCC[C@H]3C2)(c2ccccc2)CC1	ZINC000875092455	FF	On-Demand	Anodyne	KCNA3	47	41
CN1CCC(CNC(=O)N[C@@H]2CCN3CCC[C@H]3C2)(c2ccccc2)CC1	ZINC000875092456	FF	On-Demand	Anodyne	KCNA3	47	41
CN1CCC(CNC(=O)N[C@H]2CCN3CCC[C@@H]3C2)(c2ccccc2)CC1	ZINC000875092457	FF	On-Demand	Anodyne	KCNA3	47	41
CN1CCC(CNC(=O)N[C@@H]2CCN3CCC[C@@H]3C2)(c2ccccc2)CC1	ZINC000875092458	FF	On-Demand	Anodyne	KCNA3	47	41
Cn1nccc1CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875092466	EE	On-Demand	Anodyne	CPT1A	46	32
Cn1nccc1CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875092468	EE	On-Demand	Anodyne	CPT1A	46	32
Cn1nccc1CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875092470	EE	On-Demand	Anodyne	CPT1A	46	32
Cn1nccc1CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875092472	EE	On-Demand	Anodyne	CPT1A	46	32
Cn1nccc1CNC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875092497	DE	On-Demand	Anodyne	EPHX2	22	41
Cn1nccc1CNC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875092499	DE	On-Demand	Anodyne	EPHX2	22	41
CN1Cc2ccccc2[C@@H]1CNC(=O)N(Cc1ccc(C(N)=O)cc1)C1CC1	ZINC000875092521	GF	On-Demand	Anodyne	GIPR	40	36
CN1Cc2ccccc2[C@H]1CNC(=O)N(Cc1ccc(C(N)=O)cc1)C1CC1	ZINC000875092523	GF	On-Demand	Anodyne	GIPR	40	36
O=C(N[C@@H]1CCN2CCC[C@H]2C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875092532	FE	On-Demand	Anodyne	DRD4	27	43
O=C(N[C@@H]1CCN2CCC[C@H]2C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875092532	FE	On-Demand	Anodyne	HRH3	15	44
O=C(N[C@@H]1CCN2CCC[C@H]2C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875092532	FE	On-Demand	Anodyne	SIGMAR1	32	45
O=C(N[C@@H]1CCN2CCC[C@H]2C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875092532	FE	On-Demand	Anodyne	CCR3	26	43
O=C(N[C@H]1CCN2CCC[C@H]2C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875092534	FE	On-Demand	Anodyne	DRD4	27	43
O=C(N[C@H]1CCN2CCC[C@H]2C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875092534	FE	On-Demand	Anodyne	HRH3	15	44
O=C(N[C@H]1CCN2CCC[C@H]2C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875092534	FE	On-Demand	Anodyne	SIGMAR1	32	45
O=C(N[C@H]1CCN2CCC[C@H]2C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875092534	FE	On-Demand	Anodyne	CCR3	26	43
O=C(N[C@H]1CCN2CCC[C@@H]2C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875092537	FE	On-Demand	Anodyne	DRD4	27	43
O=C(N[C@H]1CCN2CCC[C@@H]2C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875092537	FE	On-Demand	Anodyne	HRH3	15	44
O=C(N[C@H]1CCN2CCC[C@@H]2C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875092537	FE	On-Demand	Anodyne	SIGMAR1	32	45
O=C(N[C@H]1CCN2CCC[C@@H]2C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875092537	FE	On-Demand	Anodyne	CCR3	26	43
O=C(N[C@@H]1CCN2CCC[C@@H]2C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875092539	FE	On-Demand	Anodyne	DRD4	27	43
O=C(N[C@@H]1CCN2CCC[C@@H]2C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875092539	FE	On-Demand	Anodyne	HRH3	15	44
O=C(N[C@@H]1CCN2CCC[C@@H]2C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875092539	FE	On-Demand	Anodyne	SIGMAR1	32	45
O=C(N[C@@H]1CCN2CCC[C@@H]2C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875092539	FE	On-Demand	Anodyne	CCR3	26	43
O=C(NC[C@@H]1CCCc2ccccc21)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875092589	EG	On-Demand	Anodyne	HTR6	21	40
O=C(NC[C@H]1CCCc2ccccc21)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875092590	EG	On-Demand	Anodyne	HTR6	21	40
CN1CCN(C(=O)NCc2ccc(S(C)(=O)=O)cc2)CCC1(C)C	ZINC000875092591	FD	On-Demand	Anodyne	NAMPT	49	43
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCN2CCC[C@H]2C1	ZINC000875092633	GH	On-Demand	Reactive	LTA4H	56	50
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCN2CCC[C@H]2C1	ZINC000875092633	GH	On-Demand	Reactive	HRH3	15	46
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCN2CCC[C@H]2C1	ZINC000875092633	GH	On-Demand	Reactive	ADAM17	22	44
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCN2CCC[C@H]2C1	ZINC000875092633	GH	On-Demand	Reactive	SLC6A5	38	45
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCN2CCC[C@H]2C1	ZINC000875092633	GH	On-Demand	Reactive	EPHX2	26	45
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCN2CCC[C@H]2C1	ZINC000875092634	GH	On-Demand	Reactive	LTA4H	56	50
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCN2CCC[C@H]2C1	ZINC000875092634	GH	On-Demand	Reactive	HRH3	15	46
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCN2CCC[C@H]2C1	ZINC000875092634	GH	On-Demand	Reactive	ADAM17	22	44
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCN2CCC[C@H]2C1	ZINC000875092634	GH	On-Demand	Reactive	SLC6A5	38	45
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCN2CCC[C@H]2C1	ZINC000875092634	GH	On-Demand	Reactive	EPHX2	26	45
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCN2CCC[C@@H]2C1	ZINC000875092635	GH	On-Demand	Reactive	LTA4H	56	50
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCN2CCC[C@@H]2C1	ZINC000875092635	GH	On-Demand	Reactive	HRH3	15	46
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCN2CCC[C@@H]2C1	ZINC000875092635	GH	On-Demand	Reactive	ADAM17	22	44
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCN2CCC[C@@H]2C1	ZINC000875092635	GH	On-Demand	Reactive	SLC6A5	38	45
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCN2CCC[C@@H]2C1	ZINC000875092635	GH	On-Demand	Reactive	EPHX2	26	45
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCN2CCC[C@@H]2C1	ZINC000875092636	GH	On-Demand	Reactive	LTA4H	56	50
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCN2CCC[C@@H]2C1	ZINC000875092636	GH	On-Demand	Reactive	HRH3	15	46
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCN2CCC[C@@H]2C1	ZINC000875092636	GH	On-Demand	Reactive	ADAM17	22	44
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCN2CCC[C@@H]2C1	ZINC000875092636	GH	On-Demand	Reactive	SLC6A5	38	45
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCN2CCC[C@@H]2C1	ZINC000875092636	GH	On-Demand	Reactive	EPHX2	26	45
CN(C(=O)c1ccnc(N2CCOCC2)n1)c1nc2ccccc2s1	ZINC000875092664	FE	On-Demand	Anodyne	PIK3CA	22	41
CC[C@@H](NC(C)=O)C(=O)N(C)c1nc2ccccc2s1	ZINC000875092668	CE	On-Demand	Anodyne	TMPRSS6	49	32
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@H]1CCN3CCC[C@@H]3C1)CC2	ZINC000875092724	FF	On-Demand	Anodyne	SLC18A2	49	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@@H]1CCN3CCC[C@H]3C1)CC2	ZINC000875092725	FF	On-Demand	Anodyne	SLC18A2	49	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@@H]1CCN3CCC[C@@H]3C1)CC2	ZINC000875092726	FF	On-Demand	Anodyne	SLC18A2	49	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@H]1CCN3CCC[C@H]3C1)CC2	ZINC000875092727	FF	On-Demand	Anodyne	SLC18A2	49	37
Cn1cc([C@@H]2CN(Cc3ccccc3)C[C@H]2C(=O)Nc2cccnc2Cl)cn1	ZINC000875092788	GG	On-Demand	Anodyne	G2YM83_BOTF4	64	32
C[C@]1(C(=O)Nc2cccnc2Cl)C[C@H]2CC[C@H]1C2	ZINC000875092847	CG	On-Demand	Anodyne	G2YM83_BOTF4	81	46
Cn1nccc1CNC(=O)N1CC2(CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000875092869	FD	On-Demand	Anodyne	GPR119	29	40
NC(=O)c1ccc(CN(C(=O)NCc2ncc(Cl)s2)C2CC2)cc1	ZINC000875092871	FF	On-Demand	Anodyne	GIPR	40	36
N#Cc1cccc([C@H](NC(=O)N[C@H]2CCN3CCC[C@H]3C2)C(F)(F)F)c1	ZINC000875092913	FG	On-Demand	Mild	MCHR1	17	40
N#Cc1cccc([C@H](NC(=O)N[C@@H]2CCN3CCC[C@@H]3C2)C(F)(F)F)c1	ZINC000875092914	FG	On-Demand	Mild	MCHR1	17	40
N#Cc1cccc([C@H](NC(=O)N[C@@H]2CCN3CCC[C@H]3C2)C(F)(F)F)c1	ZINC000875092915	FG	On-Demand	Mild	MCHR1	17	40
N#Cc1cccc([C@H](NC(=O)N[C@H]2CCN3CCC[C@@H]3C2)C(F)(F)F)c1	ZINC000875092916	FG	On-Demand	Mild	MCHR1	17	40
CCc1nc2ccccc2c(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)c1C	ZINC000875092917	HI	On-Demand	Anodyne	ACHE	27	42
CCc1nc2ccccc2c(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)c1C	ZINC000875092917	HI	On-Demand	Anodyne	FABI	42	35
CCc1nc2ccccc2c(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)c1C	ZINC000875092917	HI	On-Demand	Anodyne	HTR3A	15	43
CCc1nc2ccccc2c(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)c1C	ZINC000875092917	HI	On-Demand	Anodyne	BCHE	39	42
CCc1nc2ccccc2c(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)c1C	ZINC000875092917	HI	On-Demand	Anodyne	TACR3	40	36
COc1cccc(C(C)(C)C(=O)N(C)c2nc3ccccc3s2)c1	ZINC000875092922	EI	On-Demand	Anodyne	LUCI_PHOPE	30	42
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@@H]1CCN3CCC[C@H]3C1)CC2	ZINC000875092925	FE	On-Demand	Anodyne	L3MBTL3	25	41
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@H]1CCN3CCC[C@H]3C1)CC2	ZINC000875092926	FE	On-Demand	Anodyne	L3MBTL3	25	41
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@H]1CCN3CCC[C@@H]3C1)CC2	ZINC000875092927	FE	On-Demand	Anodyne	L3MBTL3	25	41
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@@H]1CCN3CCC[C@@H]3C1)CC2	ZINC000875092928	FE	On-Demand	Anodyne	L3MBTL3	25	41
O=C(NCc1cccc(Oc2ccccc2)c1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875092966	GD	On-Demand	Anodyne	FAAH	27	46
O=C(NCc1cccc(Oc2ccccc2)c1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875092966	GD	On-Demand	Anodyne	AMP1_PLAFQ	29	45
O=C(NCc1cccc(Oc2ccccc2)c1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875092966	GD	On-Demand	Anodyne	CCR8	28	46
O=C(NCc1cccc(Oc2ccccc2)c1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875092966	GD	On-Demand	Anodyne	CRTM	51	39
O=C(NCc1cccc(Oc2ccccc2)c1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875092966	GD	On-Demand	Anodyne	PDS	42	33
O=C(N[C@H]1CCN2CCC[C@@H]2C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875093024	FF	On-Demand	Anodyne	SMO	39	45
O=C(N[C@H]1CCN2CCC[C@@H]2C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875093024	FF	On-Demand	Anodyne	ETHR	54	46
O=C(N[C@@H]1CCN2CCC[C@@H]2C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875093025	FF	On-Demand	Anodyne	SMO	39	45
O=C(N[C@@H]1CCN2CCC[C@@H]2C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875093025	FF	On-Demand	Anodyne	ETHR	54	46
O=C(N[C@H]1CCN2CCC[C@H]2C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875093026	FF	On-Demand	Anodyne	SMO	39	45
O=C(N[C@H]1CCN2CCC[C@H]2C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875093026	FF	On-Demand	Anodyne	ETHR	54	46
O=C(N[C@@H]1CCN2CCC[C@H]2C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875093027	FF	On-Demand	Anodyne	SMO	39	45
O=C(N[C@@H]1CCN2CCC[C@H]2C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875093027	FF	On-Demand	Anodyne	ETHR	54	46
CCO[C@H](C(=O)N(C)c1nc2ccccc2s1)C1CCCC1	ZINC000875093028	DH	On-Demand	Anodyne	ALOX5	20	41
CCO[C@H](C(=O)N(C)c1nc2ccccc2s1)C1CCCC1	ZINC000875093028	DH	On-Demand	Anodyne	AMY2	44	30
CCO[C@@H](C(=O)N(C)c1nc2ccccc2s1)C1CCCC1	ZINC000875093029	DH	On-Demand	Anodyne	ALOX5	20	41
CCO[C@@H](C(=O)N(C)c1nc2ccccc2s1)C1CCCC1	ZINC000875093029	DH	On-Demand	Anodyne	AMY2	44	30
O=C(N[C@H]1CCCc2occc21)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875093067	EG	On-Demand	Anodyne	EPHX2	16	40
O=C(N[C@H]1CCCc2occc21)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875093068	EG	On-Demand	Anodyne	EPHX2	16	40
O=C(N[C@@H]1CCCc2occc21)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875093069	EG	On-Demand	Anodyne	EPHX2	16	40
O=C(N[C@@H]1CCCc2occc21)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875093070	EG	On-Demand	Anodyne	EPHX2	16	40
O=C(N[C@@H]1CCN2CCC[C@@H]2C1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875093071	DE	On-Demand	Anodyne	L3MBTL3	40	34
O=C(N[C@@H]1CCN2CCC[C@@H]2C1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875093072	DE	On-Demand	Anodyne	L3MBTL3	40	34
O=C(N[C@@H]1CCN2CCC[C@@H]2C1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875093073	DE	On-Demand	Anodyne	L3MBTL3	40	34
O=C(N[C@@H]1CCN2CCC[C@@H]2C1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875093074	DE	On-Demand	Anodyne	L3MBTL3	40	34
CN(C(=O)c1ccc(C(=O)N2CCOCC2)cc1)c1nc2ccccc2s1	ZINC000875093105	GG	On-Demand	Anodyne	PIK3CA	19	40
CN(C(=O)c1ccc(C(=O)N2CCOCC2)cc1)c1nc2ccccc2s1	ZINC000875093105	GG	On-Demand	Anodyne	MTOR	22	40
CN(C(=O)c1ccc(C(=O)N2CCOCC2)cc1)c1nc2ccccc2s1	ZINC000875093105	GG	On-Demand	Anodyne	PIK3CG	16	40
O=C(N[C@@H]1CCN2CCC[C@@H]2C1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875093130	EF	On-Demand	Anodyne	OXTR	44	36
O=C(N[C@@H]1CCN2CCC[C@H]2C1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875093131	EF	On-Demand	Anodyne	OXTR	44	36
O=C(N[C@@H]1CCN2CCC[C@H]2C1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875093132	EF	On-Demand	Anodyne	OXTR	44	36
O=C(N[C@@H]1CCN2CCC[C@@H]2C1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875093133	EF	On-Demand	Anodyne	OXTR	44	36
N#Cc1ccc(N2CCN(C(=O)N[C@H]3CCN4CCC[C@H]4C3)CC2)cc1	ZINC000875093134	FE	On-Demand	Mild	L3MBTL3	48	38
N#Cc1ccc(N2CCN(C(=O)N[C@@H]3CCN4CCC[C@@H]4C3)CC2)cc1	ZINC000875093135	FE	On-Demand	Mild	L3MBTL3	48	38
N#Cc1ccc(N2CCN(C(=O)N[C@@H]3CCN4CCC[C@H]4C3)CC2)cc1	ZINC000875093136	FE	On-Demand	Mild	L3MBTL3	48	38
N#Cc1ccc(N2CCN(C(=O)N[C@H]3CCN4CCC[C@@H]4C3)CC2)cc1	ZINC000875093137	FE	On-Demand	Mild	L3MBTL3	48	38
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCN3CCC[C@H]3C2)C1	ZINC000875093149	CD	On-Demand	Anodyne	L3MBTL3	45	38
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCN3CCC[C@H]3C2)C1	ZINC000875093150	CD	On-Demand	Anodyne	L3MBTL3	45	38
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCN3CCC[C@@H]3C2)C1	ZINC000875093151	CD	On-Demand	Anodyne	L3MBTL3	45	38
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCN3CCC[C@@H]3C2)C1	ZINC000875093152	CD	On-Demand	Anodyne	L3MBTL3	45	38
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2CCN3CCC[C@@H]3C2)CC1	ZINC000875093173	FH	On-Demand	Anodyne	DRD2	15	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2CCN3CCC[C@@H]3C2)CC1	ZINC000875093173	FH	On-Demand	Anodyne	ADRA1D	25	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2CCN3CCC[C@@H]3C2)CC1	ZINC000875093173	FH	On-Demand	Anodyne	ADRA1A	21	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2CCN3CCC[C@@H]3C2)CC1	ZINC000875093173	FH	On-Demand	Anodyne	ADRA1B	22	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2CCN3CCC[C@@H]3C2)CC1	ZINC000875093173	FH	On-Demand	Anodyne	EPHX2	19	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CCN3CCC[C@@H]3C2)CC1	ZINC000875093174	FH	On-Demand	Anodyne	DRD2	15	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CCN3CCC[C@@H]3C2)CC1	ZINC000875093174	FH	On-Demand	Anodyne	ADRA1D	25	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CCN3CCC[C@@H]3C2)CC1	ZINC000875093174	FH	On-Demand	Anodyne	ADRA1A	21	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CCN3CCC[C@@H]3C2)CC1	ZINC000875093174	FH	On-Demand	Anodyne	ADRA1B	22	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CCN3CCC[C@@H]3C2)CC1	ZINC000875093174	FH	On-Demand	Anodyne	EPHX2	19	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CCN3CCC[C@H]3C2)CC1	ZINC000875093175	FH	On-Demand	Anodyne	DRD2	15	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CCN3CCC[C@H]3C2)CC1	ZINC000875093175	FH	On-Demand	Anodyne	ADRA1D	25	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CCN3CCC[C@H]3C2)CC1	ZINC000875093175	FH	On-Demand	Anodyne	ADRA1A	21	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CCN3CCC[C@H]3C2)CC1	ZINC000875093175	FH	On-Demand	Anodyne	ADRA1B	22	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CCN3CCC[C@H]3C2)CC1	ZINC000875093175	FH	On-Demand	Anodyne	EPHX2	19	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2CCN3CCC[C@H]3C2)CC1	ZINC000875093176	FH	On-Demand	Anodyne	DRD2	15	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2CCN3CCC[C@H]3C2)CC1	ZINC000875093176	FH	On-Demand	Anodyne	ADRA1D	25	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2CCN3CCC[C@H]3C2)CC1	ZINC000875093176	FH	On-Demand	Anodyne	ADRA1A	21	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2CCN3CCC[C@H]3C2)CC1	ZINC000875093176	FH	On-Demand	Anodyne	ADRA1B	22	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2CCN3CCC[C@H]3C2)CC1	ZINC000875093176	FH	On-Demand	Anodyne	EPHX2	19	41
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(Oc3ccccc3)c2)CC1	ZINC000875093190	GF	On-Demand	Anodyne	FKBP1A	22	45
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(Oc3ccccc3)c2)CC1	ZINC000875093190	GF	On-Demand	Anodyne	SIGMAR1	15	41
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(Oc3ccccc3)c2)CC1	ZINC000875093190	GF	On-Demand	Anodyne	MMP13	22	41
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(Oc3ccccc3)c2)CC1	ZINC000875093190	GF	On-Demand	Anodyne	CPT1A	32	41
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(Oc3ccccc3)c2)CC1	ZINC000875093190	GF	On-Demand	Anodyne	FAAH	32	44
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(Oc3ccccc3)c2)CC1	ZINC000875093190	GF	On-Demand	Anodyne	AMP1_PLAFQ	29	45
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(Oc3ccccc3)c2)CC1	ZINC000875093190	GF	On-Demand	Anodyne	CCR8	29	41
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(Oc3ccccc3)c2)CC1	ZINC000875093190	GF	On-Demand	Anodyne	CRTM	51	42
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(Oc3ccccc3)c2)CC1	ZINC000875093190	GF	On-Demand	Anodyne	PDS	48	34
CN(C(=O)[C@@H]1C[C@H]1c1ccsc1)c1nc2ccccc2s1	ZINC000875093191	DI	On-Demand	Anodyne	NPBWR1	70	43
O=C(N[C@@H]1CCN2CCC[C@H]2C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875093216	FD	On-Demand	Anodyne	SMO	34	40
O=C(N[C@@H]1CCN2CCC[C@H]2C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875093216	FD	On-Demand	Anodyne	ETHR	41	35
O=C(N[C@@H]1CCN2CCC[C@@H]2C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875093217	FD	On-Demand	Anodyne	SMO	34	40
O=C(N[C@@H]1CCN2CCC[C@@H]2C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875093217	FD	On-Demand	Anodyne	ETHR	41	35
O=C(N[C@@H]1CCN2CCC[C@H]2C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875093218	FD	On-Demand	Anodyne	SMO	34	40
O=C(N[C@@H]1CCN2CCC[C@H]2C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875093218	FD	On-Demand	Anodyne	ETHR	41	35
O=C(N[C@@H]1CCN2CCC[C@@H]2C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875093219	FD	On-Demand	Anodyne	SMO	34	40
O=C(N[C@@H]1CCN2CCC[C@@H]2C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875093219	FD	On-Demand	Anodyne	ETHR	41	35
CC(=O)C1CCN(C(=O)N[C@@H]2CCN3CCC[C@H]3C2)CC1	ZINC000875093253	CD	On-Demand	Anodyne	L3MBTL3	51	37
CC(=O)C1CCN(C(=O)N[C@H]2CCN3CCC[C@H]3C2)CC1	ZINC000875093254	CD	On-Demand	Anodyne	L3MBTL3	51	37
CC(=O)C1CCN(C(=O)N[C@@H]2CCN3CCC[C@@H]3C2)CC1	ZINC000875093255	CD	On-Demand	Anodyne	L3MBTL3	51	37
CC(=O)C1CCN(C(=O)N[C@H]2CCN3CCC[C@@H]3C2)CC1	ZINC000875093256	CD	On-Demand	Anodyne	L3MBTL3	51	37
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)N[C@@H]1CCN2CCC[C@H]2C1	ZINC000875093278	FG	On-Demand	Anodyne	CHRNA7	48	39
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)N[C@@H]1CCN2CCC[C@H]2C1	ZINC000875093278	FG	On-Demand	Anodyne	C3AR1	45	44
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)N[C@@H]1CCN2CCC[C@@H]2C1	ZINC000875093279	FG	On-Demand	Anodyne	CHRNA7	48	39
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)N[C@@H]1CCN2CCC[C@@H]2C1	ZINC000875093279	FG	On-Demand	Anodyne	C3AR1	45	44
O=C(N[C@@H]1CCN2CCC[C@H]2C1)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875093280	FG	On-Demand	Anodyne	CHRNA7	48	39
O=C(N[C@@H]1CCN2CCC[C@H]2C1)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875093280	FG	On-Demand	Anodyne	C3AR1	45	44
O=C(N[C@@H]1CCN2CCC[C@@H]2C1)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875093281	FG	On-Demand	Anodyne	CHRNA7	48	39
O=C(N[C@@H]1CCN2CCC[C@@H]2C1)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875093281	FG	On-Demand	Anodyne	C3AR1	45	44
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1COC(C)C	ZINC000875093309	DF	On-Demand	Anodyne	ANPEP	24	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1COC(C)C	ZINC000875093309	DF	On-Demand	Anodyne	CAPN2	54	33
CN(C(=O)c1cn2c(n1)COCC2)c1nc2ccccc2s1	ZINC000875093329	DE	On-Demand	Anodyne	CASR	18	40
O=C(NC[C@H]1CCN(CC(F)(F)F)C1)N1Cc2cccc(O)c2C1	ZINC000875093406	EE	On-Demand	Clean	CACNA1I	50	36
O=C(NC[C@@H]1CCN(CC(F)(F)F)C1)N1Cc2cccc(O)c2C1	ZINC000875093407	EE	On-Demand	Clean	CACNA1I	50	36
CN(C(=O)[C@H](F)[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1nc2ccccc2o1	ZINC000875093432	GG	On-Demand	Anodyne	GPR119	25	42
CN(C(=O)[C@H](F)[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1nc2ccccc2o1	ZINC000875093433	GG	On-Demand	Anodyne	GPR119	25	42
O=C(N[C@H](c1ccccc1)C(F)(F)F)N1CCC2(CCNC2=O)CC1	ZINC000875093453	FF	On-Demand	Anodyne	CACNA1H	44	39
O=C(N[C@H](c1ccccc1)C(F)(F)F)N1CCC2(CCNC2=O)CC1	ZINC000875093453	FF	On-Demand	Anodyne	GHRHR	70	36
O=C(N[C@@H](c1ccccc1)C(F)(F)F)N1CCC2(CCNC2=O)CC1	ZINC000875093454	FF	On-Demand	Anodyne	CACNA1H	44	39
O=C(N[C@@H](c1ccccc1)C(F)(F)F)N1CCC2(CCNC2=O)CC1	ZINC000875093454	FF	On-Demand	Anodyne	GHRHR	70	36
CC(=O)N1CCC[C@@H]1C(=O)Nc1cc([N+](=O)[O-])c(F)cc1F	ZINC000875093457	DD	On-Demand	Bother	LGMN	69	34
COC(=O)CC[C@@H]1CC[C@H](C(=O)N(C)c2nc3ccccc3o2)O1	ZINC000875093458	EE	On-Demand	Anodyne	FASN	19	41
CCOC(=O)[C@@H]1CC[C@H](C(=O)N(C)c2nc3ccccc3o2)C1	ZINC000875093461	DF	On-Demand	Anodyne	SSTR5	21	41
CCOC(=O)[C@@H]1CC[C@H](C(=O)N(C)c2nc3ccccc3o2)C1	ZINC000875093461	DF	On-Demand	Anodyne	FASN	40	49
O=C(NCCO)C1CCN(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)CC1	ZINC000875093466	FD	On-Demand	Anodyne	MTTP	34	45
O=C(NCCO)C1CCN(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)CC1	ZINC000875093466	FD	On-Demand	Anodyne	EPHX2	17	40
O=C(NCCO)C1CCN(C(=O)N[C@H](c2ccccc2)C(F)(F)F)CC1	ZINC000875093467	FD	On-Demand	Anodyne	MTTP	34	45
O=C(NCCO)C1CCN(C(=O)N[C@H](c2ccccc2)C(F)(F)F)CC1	ZINC000875093467	FD	On-Demand	Anodyne	EPHX2	17	40
O=C(NC1CCN(c2ccccn2)CC1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875093489	GG	On-Demand	Anodyne	CPT1A	17	45
O=C(NC1CCN(c2ccccn2)CC1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875093489	GG	On-Demand	Anodyne	EPHX2	15	40
O=C(NC1CCN(c2ccccn2)CC1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875093490	GG	On-Demand	Anodyne	CPT1A	17	45
O=C(NC1CCN(c2ccccn2)CC1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875093490	GG	On-Demand	Anodyne	EPHX2	15	40
O=C(NC1CCN(c2ccccn2)CC1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875093491	GG	On-Demand	Anodyne	CPT1A	17	45
O=C(NC1CCN(c2ccccn2)CC1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875093491	GG	On-Demand	Anodyne	EPHX2	15	40
O=C(NC1CCN(c2ccccn2)CC1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875093492	GG	On-Demand	Anodyne	CPT1A	17	45
O=C(NC1CCN(c2ccccn2)CC1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875093492	GG	On-Demand	Anodyne	EPHX2	15	40
CN(C)C[C@@H]1CN(C(=O)N[C@H](c2ccccc2)C(F)(F)F)C[C@H]1CN(C)C	ZINC000875093495	GF	On-Demand	Anodyne	CTSF	45	32
CN(C)C[C@@H]1CN(C(=O)N[C@H](c2ccccc2)C(F)(F)F)C[C@H]1CN(C)C	ZINC000875093495	GF	On-Demand	Anodyne	RBP4	42	40
CN(C)C[C@@H]1CN(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)C[C@H]1CN(C)C	ZINC000875093496	GF	On-Demand	Anodyne	CTSF	45	32
CN(C)C[C@@H]1CN(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)C[C@H]1CN(C)C	ZINC000875093496	GF	On-Demand	Anodyne	RBP4	42	40
CCOC(=O)N[C@H](CNC(=O)C(=O)NCC1CC=CC1)CC(C)C	ZINC000875093498	ED	On-Demand	Anodyne	CAPN1	17	40
CCOC(=O)N[C@H](CNC(=O)C(=O)NCC1CC=CC1)CC(C)C	ZINC000875093498	ED	On-Demand	Anodyne	CAPN2	48	40
CCOC(=O)N[C@@H](CNC(=O)C(=O)NCC1CC=CC1)CC(C)C	ZINC000875093499	ED	On-Demand	Anodyne	CAPN1	17	40
CCOC(=O)N[C@@H](CNC(=O)C(=O)NCC1CC=CC1)CC(C)C	ZINC000875093499	ED	On-Demand	Anodyne	CAPN2	48	40
COc1ccc(-c2nc(C(=O)OCCC(N)=O)cs2)cc1OC	ZINC000875093500	ED	On-Demand	Anodyne	DCK	42	45
COc1ccc(-c2nc(C(=O)OCCC(N)=O)cs2)cc1OC	ZINC000875093500	ED	On-Demand	Anodyne	PRKCZ	23	40
COc1ccc(-c2nc(C(=O)OCCC(N)=O)cs2)cc1OC	ZINC000875093500	ED	On-Demand	Anodyne	PPARD	17	41
COc1ccc(N2CCN(C(=O)N[C@H]3CCN4CCC[C@@H]4C3)CC2)c(OC)c1	ZINC000875093536	GE	On-Demand	Clean	DRD2	19	47
COc1ccc(N2CCN(C(=O)N[C@H]3CCN4CCC[C@@H]4C3)CC2)c(OC)c1	ZINC000875093536	GE	On-Demand	Clean	ADRA1D	30	47
COc1ccc(N2CCN(C(=O)N[C@H]3CCN4CCC[C@@H]4C3)CC2)c(OC)c1	ZINC000875093536	GE	On-Demand	Clean	ADRA1A	24	47
COc1ccc(N2CCN(C(=O)N[C@H]3CCN4CCC[C@@H]4C3)CC2)c(OC)c1	ZINC000875093536	GE	On-Demand	Clean	ADRA1B	23	47
COc1ccc(N2CCN(C(=O)N[C@@H]3CCN4CCC[C@@H]4C3)CC2)c(OC)c1	ZINC000875093537	GE	On-Demand	Clean	DRD2	19	47
COc1ccc(N2CCN(C(=O)N[C@@H]3CCN4CCC[C@@H]4C3)CC2)c(OC)c1	ZINC000875093537	GE	On-Demand	Clean	ADRA1D	30	47
COc1ccc(N2CCN(C(=O)N[C@@H]3CCN4CCC[C@@H]4C3)CC2)c(OC)c1	ZINC000875093537	GE	On-Demand	Clean	ADRA1A	24	47
COc1ccc(N2CCN(C(=O)N[C@@H]3CCN4CCC[C@@H]4C3)CC2)c(OC)c1	ZINC000875093537	GE	On-Demand	Clean	ADRA1B	23	47
COc1ccc(N2CCN(C(=O)N[C@H]3CCN4CCC[C@H]4C3)CC2)c(OC)c1	ZINC000875093538	GE	On-Demand	Clean	DRD2	19	47
COc1ccc(N2CCN(C(=O)N[C@H]3CCN4CCC[C@H]4C3)CC2)c(OC)c1	ZINC000875093538	GE	On-Demand	Clean	ADRA1D	30	47
COc1ccc(N2CCN(C(=O)N[C@H]3CCN4CCC[C@H]4C3)CC2)c(OC)c1	ZINC000875093538	GE	On-Demand	Clean	ADRA1A	24	47
COc1ccc(N2CCN(C(=O)N[C@H]3CCN4CCC[C@H]4C3)CC2)c(OC)c1	ZINC000875093538	GE	On-Demand	Clean	ADRA1B	23	47
COc1ccc(N2CCN(C(=O)N[C@@H]3CCN4CCC[C@H]4C3)CC2)c(OC)c1	ZINC000875093539	GE	On-Demand	Clean	DRD2	19	47
COc1ccc(N2CCN(C(=O)N[C@@H]3CCN4CCC[C@H]4C3)CC2)c(OC)c1	ZINC000875093539	GE	On-Demand	Clean	ADRA1D	30	47
COc1ccc(N2CCN(C(=O)N[C@@H]3CCN4CCC[C@H]4C3)CC2)c(OC)c1	ZINC000875093539	GE	On-Demand	Clean	ADRA1A	24	47
COc1ccc(N2CCN(C(=O)N[C@@H]3CCN4CCC[C@H]4C3)CC2)c(OC)c1	ZINC000875093539	GE	On-Demand	Clean	ADRA1B	23	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1COC(C)C	ZINC000875093541	FF	On-Demand	Anodyne	SLC6A4	29	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1COC(C)C	ZINC000875093541	FF	On-Demand	Anodyne	SLC6A3	59	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1COC(C)C	ZINC000875093542	FF	On-Demand	Anodyne	SLC6A4	29	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1COC(C)C	ZINC000875093542	FF	On-Demand	Anodyne	SLC6A3	59	40
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCN(CC(F)(F)F)C2)C1	ZINC000875093633	EB	On-Demand	Anodyne	CACNA1I	45	33
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)C1	ZINC000875093634	EB	On-Demand	Anodyne	CACNA1I	45	33
COC(=O)N(C)NC(=O)NC1CCN(c2ccccn2)CC1	ZINC000875093636	DC	On-Demand	Reactive	DRD4	28	43
COC(=O)N(C)NC(=O)NC1CCN(c2ccccn2)CC1	ZINC000875093636	DC	On-Demand	Reactive	EPHX2	24	43
COC(=O)N(C)NC(=O)NC1CCN(c2ccccn2)CC1	ZINC000875093636	DC	On-Demand	Reactive	Q59401_ENTCL	43	34
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H](c1ccccc1)C(F)(F)F	ZINC000875093640	GG	On-Demand	Anodyne	P2RY12	64	34
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H](c1ccccc1)C(F)(F)F	ZINC000875093640	GG	On-Demand	Anodyne	AMY2	46	32
COCCN(CC1CCN(C)CC1)C(=O)N[C@H](c1ccccc1)C(F)(F)F	ZINC000875093641	GG	On-Demand	Anodyne	P2RY12	64	34
COCCN(CC1CCN(C)CC1)C(=O)N[C@H](c1ccccc1)C(F)(F)F	ZINC000875093641	GG	On-Demand	Anodyne	AMY2	46	32
CONC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)C(F)(F)F)CC1	ZINC000875093668	FE	On-Demand	Anodyne	AMY2	47	33
CONC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)C(F)(F)F)CC1	ZINC000875093668	FE	On-Demand	Anodyne	MTTP	25	43
CONC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)CC1	ZINC000875093669	FE	On-Demand	Anodyne	AMY2	47	33
CONC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)CC1	ZINC000875093669	FE	On-Demand	Anodyne	MTTP	25	43
O=C(N[C@@H](c1ccccc1)C(F)(F)F)N[C@@H]1CC12CCC2	ZINC000875093689	CH	On-Demand	Anodyne	CTSS	17	41
O=C(N[C@H]1CC12CCC2)N[C@H](c1ccccc1)C(F)(F)F	ZINC000875093690	CH	On-Demand	Anodyne	CTSS	17	41
O=C(N[C@@H](c1ccccc1)C(F)(F)F)N[C@H]1CC12CCC2	ZINC000875093691	CH	On-Demand	Anodyne	CTSS	17	41
O=C(N[C@H](c1ccccc1)C(F)(F)F)N[C@@H]1CC12CCC2	ZINC000875093692	CH	On-Demand	Anodyne	CTSS	17	41
CCO[C@H](C(=O)N(C)c1nc2ccccc2o1)C1CCCC1	ZINC000875093695	DG	On-Demand	Anodyne	AMY2	42	29
CCO[C@@H](C(=O)N(C)c1nc2ccccc2o1)C1CCCC1	ZINC000875093696	DG	On-Demand	Anodyne	AMY2	42	29
O=C(NC1CC(Nc2ccccc2)C1)N[C@@H]1CCN2CCC[C@@H]2C1	ZINC000875093784	EF	On-Demand	Anodyne	LTA4H	15	42
O=C(NC1CC(Nc2ccccc2)C1)N[C@@H]1CCN2CCC[C@@H]2C1	ZINC000875093784	EF	On-Demand	Anodyne	EPHX2	18	41
O=C(NC1CC(Nc2ccccc2)C1)N[C@@H]1CCN2CCC[C@@H]2C1	ZINC000875093784	EF	On-Demand	Anodyne	L3MBTL3	43	35
O=C(NC1CC(Nc2ccccc2)C1)N[C@H]1CCN2CCC[C@H]2C1	ZINC000875093785	EF	On-Demand	Anodyne	LTA4H	15	42
O=C(NC1CC(Nc2ccccc2)C1)N[C@H]1CCN2CCC[C@H]2C1	ZINC000875093785	EF	On-Demand	Anodyne	EPHX2	18	41
O=C(NC1CC(Nc2ccccc2)C1)N[C@H]1CCN2CCC[C@H]2C1	ZINC000875093785	EF	On-Demand	Anodyne	L3MBTL3	43	35
O=C(NC1CC(Nc2ccccc2)C1)N[C@@H]1CCN2CCC[C@H]2C1	ZINC000875093786	EF	On-Demand	Anodyne	LTA4H	15	42
O=C(NC1CC(Nc2ccccc2)C1)N[C@@H]1CCN2CCC[C@H]2C1	ZINC000875093786	EF	On-Demand	Anodyne	EPHX2	18	41
O=C(NC1CC(Nc2ccccc2)C1)N[C@@H]1CCN2CCC[C@H]2C1	ZINC000875093786	EF	On-Demand	Anodyne	L3MBTL3	43	35
O=C(NC1CC(Nc2ccccc2)C1)N[C@H]1CCN2CCC[C@@H]2C1	ZINC000875093787	EF	On-Demand	Anodyne	LTA4H	15	42
O=C(NC1CC(Nc2ccccc2)C1)N[C@H]1CCN2CCC[C@@H]2C1	ZINC000875093787	EF	On-Demand	Anodyne	EPHX2	18	41
O=C(NC1CC(Nc2ccccc2)C1)N[C@H]1CCN2CCC[C@@H]2C1	ZINC000875093787	EF	On-Demand	Anodyne	L3MBTL3	43	35
O=C(N[C@@H]1CCN2CCC[C@H]2C1)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875093803	FE	On-Demand	Anodyne	CCR3	20	41
O=C(N[C@H]1CCN2CCC[C@H]2C1)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875093804	FE	On-Demand	Anodyne	CCR3	20	41
O=C(N[C@@H]1CCN2CCC[C@@H]2C1)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875093805	FE	On-Demand	Anodyne	CCR3	20	41
CN(C(=O)[C@@H]1OCC[C@@H]1NC(=O)OC(C)(C)C)c1nc2ccccc2o1	ZINC000875093820	FE	On-Demand	Anodyne	FASN	29	42
O=C(N[C@@H](c1ccccc1)C(F)(F)F)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875093821	GG	On-Demand	Anodyne	ETHR	64	42
O=C(N[C@@H](c1ccccc1)C(F)(F)F)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875093822	GG	On-Demand	Anodyne	ETHR	64	42
O=C(N[C@H](c1ccccc1)C(F)(F)F)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875093823	GG	On-Demand	Anodyne	ETHR	64	42
O=C(N[C@H](c1ccccc1)C(F)(F)F)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875093824	GG	On-Demand	Anodyne	ETHR	64	42
C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C(=O)N(C)c1nc2ccccc2o1	ZINC000875093833	CG	On-Demand	Anodyne	FASN	19	40
C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C(=O)N(C)c1nc2ccccc2o1	ZINC000875093834	CG	On-Demand	Anodyne	FASN	19	40
C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C(=O)N(C)c1nc2ccccc2o1	ZINC000875093835	CG	On-Demand	Anodyne	FASN	19	40
O=C(N[C@H](c1ccccc1)C(F)(F)F)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875093860	GE	On-Demand	Anodyne	RBP4	66	41
O=C(N[C@H](c1ccccc1)C(F)(F)F)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875093861	GE	On-Demand	Anodyne	RBP4	66	41
O=C(N[C@H](c1ccccc1)C(F)(F)F)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875093862	GE	On-Demand	Anodyne	RBP4	66	41
O=C(N[C@H](c1ccccc1)C(F)(F)F)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875093863	GE	On-Demand	Anodyne	RBP4	66	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)C(F)(F)F	ZINC000875093890	FG	On-Demand	Anodyne	SLC6A4	27	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)C(F)(F)F	ZINC000875093890	FG	On-Demand	Anodyne	SLC6A3	65	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)C(F)(F)F	ZINC000875093891	FG	On-Demand	Anodyne	SLC6A4	27	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)C(F)(F)F	ZINC000875093891	FG	On-Demand	Anodyne	SLC6A3	65	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)C(F)(F)F	ZINC000875093892	FG	On-Demand	Anodyne	SLC6A4	27	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)C(F)(F)F	ZINC000875093892	FG	On-Demand	Anodyne	SLC6A3	65	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)C(F)(F)F	ZINC000875093893	FG	On-Demand	Anodyne	SLC6A4	27	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)C(F)(F)F	ZINC000875093893	FG	On-Demand	Anodyne	SLC6A3	65	44
CC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)CC1	ZINC000875093897	EG	On-Demand	Anodyne	MTTP	28	42
CC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)CC1	ZINC000875093897	EG	On-Demand	Anodyne	RBP4	50	37
CC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)CC1	ZINC000875093897	EG	On-Demand	Anodyne	SFRP1	49	32
CC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)CC1	ZINC000875093897	EG	On-Demand	Anodyne	BIRC8	44	33
CC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)C(F)(F)F)CC1	ZINC000875093898	EG	On-Demand	Anodyne	MTTP	28	42
CC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)C(F)(F)F)CC1	ZINC000875093898	EG	On-Demand	Anodyne	RBP4	50	37
CC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)C(F)(F)F)CC1	ZINC000875093898	EG	On-Demand	Anodyne	SFRP1	49	32
CC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)C(F)(F)F)CC1	ZINC000875093898	EG	On-Demand	Anodyne	BIRC8	44	33
O=C(N[C@H]1CCN2CCC[C@@H]2C1)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875093906	FE	On-Demand	Anodyne	CCR3	20	41
O=C(CCc1nc2ccccc2n1-c1ccccc1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875094028	JJ	On-Demand	Anodyne	FABI	42	35
O=C(CCc1nc2ccccc2n1-c1ccccc1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875094028	JJ	On-Demand	Anodyne	HTR7	20	44
COC(=O)C1(O)CN(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094048	ED	On-Demand	Anodyne	CTSF	46	32
COC(=O)C1(O)CN(C(=O)N[C@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094049	ED	On-Demand	Anodyne	CTSF	46	32
CN(C(=O)c1cccc(OC(C)(C)C)c1)c1nc2ccccc2o1	ZINC000875094051	DI	On-Demand	Anodyne	PPARA	16	41
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)CC1	ZINC000875094052	FE	On-Demand	Anodyne	CTSF	67	36
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)CC1	ZINC000875094052	FE	On-Demand	Anodyne	RBP4	64	38
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)CC1	ZINC000875094052	FE	On-Demand	Anodyne	SFRP1	45	32
C[S@](=N)(=O)N1CCN(C(=O)N[C@H](c2ccccc2)C(F)(F)F)CC1	ZINC000875094054	FE	On-Demand	Anodyne	CTSF	67	36
C[S@](=N)(=O)N1CCN(C(=O)N[C@H](c2ccccc2)C(F)(F)F)CC1	ZINC000875094054	FE	On-Demand	Anodyne	RBP4	64	38
C[S@](=N)(=O)N1CCN(C(=O)N[C@H](c2ccccc2)C(F)(F)F)CC1	ZINC000875094054	FE	On-Demand	Anodyne	SFRP1	45	32
O=C(N[C@H](c1ccccc1)C(F)(F)F)N1CCC(CO)(CO)CC1	ZINC000875094058	EE	On-Demand	Anodyne	GHRHR	49	34
O=C(N[C@@H](c1ccccc1)C(F)(F)F)N1CCC(CO)(CO)CC1	ZINC000875094059	EE	On-Demand	Anodyne	GHRHR	49	34
COCC1CC(NC(=O)N[C@@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094068	DG	On-Demand	Anodyne	CTSF	42	32
COCC1CC(NC(=O)N[C@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094069	DG	On-Demand	Anodyne	CTSF	42	32
COCCNC(=O)c1ccccc1NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875094090	FE	On-Demand	Anodyne	G2YM83_BOTF4	45	32
COCCNC(=O)c1ccccc1NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875094090	FE	On-Demand	Anodyne	POLR1A	47	36
Cc1nnc(NNC(=O)NC[C@H]2CCN(CC(F)(F)F)C2)n1C	ZINC000875094097	EC	On-Demand	Reactive	CACNA1I	46	35
Cc1nnc(NNC(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)n1C	ZINC000875094098	EC	On-Demand	Reactive	CACNA1I	46	35
O=C(N[C@H]1CCN2CCC[C@H]2C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875094143	EF	On-Demand	Anodyne	HRH3	35	51
O=C(N[C@H]1CCN2CCC[C@H]2C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875094143	EF	On-Demand	Anodyne	CCR3	35	40
O=C(N[C@H]1CCN2CCC[C@H]2C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875094143	EF	On-Demand	Anodyne	EPHX2	30	46
O=C(N[C@H]1CCN2CCC[C@H]2C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875094143	EF	On-Demand	Anodyne	L3MBTL3	44	34
O=C(N[C@H]1CCN2CCC[C@@H]2C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875094144	EF	On-Demand	Anodyne	HRH3	35	51
O=C(N[C@H]1CCN2CCC[C@@H]2C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875094144	EF	On-Demand	Anodyne	CCR3	35	40
O=C(N[C@H]1CCN2CCC[C@@H]2C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875094144	EF	On-Demand	Anodyne	EPHX2	30	46
O=C(N[C@H]1CCN2CCC[C@@H]2C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875094144	EF	On-Demand	Anodyne	L3MBTL3	44	34
O=C(N[C@@H]1CCN2CCC[C@@H]2C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875094145	EF	On-Demand	Anodyne	HRH3	35	51
O=C(N[C@@H]1CCN2CCC[C@@H]2C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875094145	EF	On-Demand	Anodyne	CCR3	35	40
O=C(N[C@@H]1CCN2CCC[C@@H]2C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875094145	EF	On-Demand	Anodyne	EPHX2	30	46
O=C(N[C@@H]1CCN2CCC[C@@H]2C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875094145	EF	On-Demand	Anodyne	L3MBTL3	44	34
O=C(N[C@@H]1CCN2CCC[C@H]2C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875094146	EF	On-Demand	Anodyne	HRH3	35	51
O=C(N[C@@H]1CCN2CCC[C@H]2C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875094146	EF	On-Demand	Anodyne	CCR3	35	40
O=C(N[C@@H]1CCN2CCC[C@H]2C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875094146	EF	On-Demand	Anodyne	EPHX2	30	46
O=C(N[C@@H]1CCN2CCC[C@H]2C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875094146	EF	On-Demand	Anodyne	L3MBTL3	44	34
CN(C(=O)[C@H]1CCN(C(=O)c2ccccc2)C1)c1nc2ccccc2s1	ZINC000875094178	FG	On-Demand	Anodyne	SLC18A3	15	40
CN(C(=O)[C@H]1CCN(C(=O)c2ccccc2)C1)c1nc2ccccc2s1	ZINC000875094178	FG	On-Demand	Anodyne	L3MBTL3	40	34
N#Cc1cc(F)ccc1N1CCN(C(=O)N[C@@H]2CCN3CCC[C@H]3C2)CC1	ZINC000875094194	FE	On-Demand	Mild	CCR3	19	41
N#Cc1cc(F)ccc1N1CCN(C(=O)N[C@@H]2CCN3CCC[C@@H]3C2)CC1	ZINC000875094195	FE	On-Demand	Mild	CCR3	19	41
N#Cc1cc(F)ccc1N1CCN(C(=O)N[C@H]2CCN3CCC[C@H]3C2)CC1	ZINC000875094196	FE	On-Demand	Mild	CCR3	19	41
N#Cc1cc(F)ccc1N1CCN(C(=O)N[C@H]2CCN3CCC[C@@H]3C2)CC1	ZINC000875094197	FE	On-Demand	Mild	CCR3	19	41
O=C(NC[C@H]1CCN(CC(F)(F)F)C1)NNc1cccc(F)c1Cl	ZINC000875094212	FF	On-Demand	Reactive	CACNA1I	65	37
O=C(NC[C@@H]1CCN(CC(F)(F)F)C1)NNc1cccc(F)c1Cl	ZINC000875094213	FF	On-Demand	Reactive	CACNA1I	65	37
Cc1nn(C)c2ncc(NC(=O)c3cccc(N(C)C(=O)OC(C)(C)C)c3)cc12	ZINC000875094216	GH	On-Demand	Anodyne	KCNK3	44	34
CN(C)C[C@@H]1CN(C(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)C[C@H]1CN(C)C	ZINC000875094219	GD	On-Demand	Anodyne	CACNA1I	51	32
CN(C)C[C@@H]1CN(C(=O)NC[C@H]2CCN(CC(F)(F)F)C2)C[C@H]1CN(C)C	ZINC000875094220	GD	On-Demand	Anodyne	CACNA1I	51	32
O=C(N[C@@H](c1ccccc1)C(F)(F)F)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875094223	FH	On-Demand	Anodyne	RBP4	43	36
O=C(N[C@H](c1ccccc1)C(F)(F)F)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875094224	FH	On-Demand	Anodyne	RBP4	43	36
O=C(N[C@@H](c1ccccc1)C(F)(F)F)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875094225	FH	On-Demand	Anodyne	RBP4	43	36
O=C(N[C@H](c1ccccc1)C(F)(F)F)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875094226	FH	On-Demand	Anodyne	RBP4	43	36
N#CCc1ccsc1C(=O)N1CCC[C@H]1Cc1ccccc1	ZINC000875094231	DH	On-Demand	Mild	PREP	80	38
N#CCc1ccsc1C(=O)N1CCC[C@@H]1Cc1ccccc1	ZINC000875094232	DH	On-Demand	Mild	PREP	80	38
COCCNC(=O)c1ccccc1NC(=O)[C@]1(C2CCCC2)CCNC1=O	ZINC000875094243	FD	On-Demand	Anodyne	KCNA3	40	39
COCCNC(=O)c1ccccc1NC(=O)[C@]1(C2CCCC2)CCNC1=O	ZINC000875094243	FD	On-Demand	Anodyne	POLR1A	50	34
COCCNC(=O)c1ccccc1NC(=O)[C@@]1(C2CCCC2)CCNC1=O	ZINC000875094244	FD	On-Demand	Anodyne	KCNA3	40	39
COCCNC(=O)c1ccccc1NC(=O)[C@@]1(C2CCCC2)CCNC1=O	ZINC000875094244	FD	On-Demand	Anodyne	POLR1A	50	34
N#Cc1ccc(N2CCN(C(=O)N[C@@H](c3ccccc3)C(F)(F)F)CC2)cn1	ZINC000875094266	GG	On-Demand	Mild	PTAFR	19	40
N#Cc1ccc(N2CCN(C(=O)N[C@H](c3ccccc3)C(F)(F)F)CC2)cn1	ZINC000875094267	GG	On-Demand	Mild	PTAFR	19	40
COCCN(CC1CCN(C)CC1)C(=O)NC[C@@H]1CCN(CC(F)(F)F)C1	ZINC000875094269	GD	On-Demand	Anodyne	CACNA1I	55	35
COCCN(CC1CCN(C)CC1)C(=O)NC[C@H]1CCN(CC(F)(F)F)C1	ZINC000875094270	GD	On-Demand	Anodyne	CACNA1I	55	35
Cn1nnnc1C1CCN(C(=O)N[C@H](c2ccccc2)C(F)(F)F)CC1	ZINC000875094279	FE	On-Demand	Anodyne	PRCP	15	42
Cn1nnnc1C1CCN(C(=O)N[C@H](c2ccccc2)C(F)(F)F)CC1	ZINC000875094279	FE	On-Demand	Anodyne	RBP4	55	35
Cn1nnnc1C1CCN(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)CC1	ZINC000875094280	FE	On-Demand	Anodyne	PRCP	15	42
Cn1nnnc1C1CCN(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)CC1	ZINC000875094280	FE	On-Demand	Anodyne	RBP4	55	35
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1nc(Cl)c(Cl)c(Cl)c1Cl	ZINC000875094284	IJ	On-Demand	Anodyne	L3MBTL3	58	39
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1nc(Cl)c(Cl)c(Cl)c1Cl	ZINC000875094284	IJ	On-Demand	Anodyne	NAMPT	30	43
COCC(C)(C)CCNC(=O)N[C@H](c1ccccc1)C(F)(F)F	ZINC000875094285	EH	On-Demand	Anodyne	CTSF	43	35
COCC(C)(C)CCNC(=O)N[C@H](c1ccccc1)C(F)(F)F	ZINC000875094285	EH	On-Demand	Anodyne	CTSL	15	42
COCC(C)(C)CCNC(=O)N[C@@H](c1ccccc1)C(F)(F)F	ZINC000875094286	EH	On-Demand	Anodyne	CTSF	43	35
COCC(C)(C)CCNC(=O)N[C@@H](c1ccccc1)C(F)(F)F	ZINC000875094286	EH	On-Demand	Anodyne	CTSL	15	42
COc1cccc(C(C)(C)C(=O)N(C)c2nc3ccccc3o2)c1	ZINC000875094404	DH	On-Demand	Anodyne	PPARA	16	42
O=C(N[C@H](c1ccccc1)C(F)(F)F)N1CC[C@H]2CSC[C@H]2C1	ZINC000875094439	EH	On-Demand	Anodyne	RBP4	67	41
O=C(N[C@H](c1ccccc1)C(F)(F)F)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875094440	EH	On-Demand	Anodyne	RBP4	67	41
O=C(N[C@H](c1ccccc1)C(F)(F)F)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875094441	EH	On-Demand	Anodyne	RBP4	67	41
O=C(N[C@H](c1ccccc1)C(F)(F)F)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875094442	EH	On-Demand	Anodyne	RBP4	67	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094451	FG	On-Demand	Anodyne	P2RY12	111	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094451	FG	On-Demand	Anodyne	CTSF	43	33
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094451	FG	On-Demand	Anodyne	CTSK	40	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094451	FG	On-Demand	Anodyne	RBP4	46	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094453	FG	On-Demand	Anodyne	P2RY12	111	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094453	FG	On-Demand	Anodyne	CTSF	43	33
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094453	FG	On-Demand	Anodyne	CTSK	40	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094453	FG	On-Demand	Anodyne	RBP4	46	40
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@H](c1ccccc1)C(F)(F)F	ZINC000875094475	EH	On-Demand	Anodyne	TIMP3	72	34
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@@H](c1ccccc1)C(F)(F)F	ZINC000875094478	EH	On-Demand	Anodyne	TIMP3	72	34
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094480	EG	On-Demand	Anodyne	SLC6A1	50	38
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094480	EG	On-Demand	Anodyne	MTTP	26	42
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094480	EG	On-Demand	Anodyne	DPP7	48	39
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094480	EG	On-Demand	Anodyne	RBP4	41	37
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094480	EG	On-Demand	Anodyne	SFRP1	51	33
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094480	EG	On-Demand	Anodyne	WNT3	51	33
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094481	EG	On-Demand	Anodyne	SLC6A1	50	38
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094481	EG	On-Demand	Anodyne	MTTP	26	42
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094481	EG	On-Demand	Anodyne	DPP7	48	39
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094481	EG	On-Demand	Anodyne	RBP4	41	37
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094481	EG	On-Demand	Anodyne	SFRP1	51	33
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094481	EG	On-Demand	Anodyne	WNT3	51	33
CC(=O)[C@H]1CCCN(C(=O)N[C@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094482	EG	On-Demand	Anodyne	SLC6A1	50	38
CC(=O)[C@H]1CCCN(C(=O)N[C@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094482	EG	On-Demand	Anodyne	MTTP	26	42
CC(=O)[C@H]1CCCN(C(=O)N[C@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094482	EG	On-Demand	Anodyne	DPP7	48	39
CC(=O)[C@H]1CCCN(C(=O)N[C@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094482	EG	On-Demand	Anodyne	RBP4	41	37
CC(=O)[C@H]1CCCN(C(=O)N[C@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094482	EG	On-Demand	Anodyne	SFRP1	51	33
CC(=O)[C@H]1CCCN(C(=O)N[C@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094482	EG	On-Demand	Anodyne	WNT3	51	33
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094483	EG	On-Demand	Anodyne	SLC6A1	50	38
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094483	EG	On-Demand	Anodyne	MTTP	26	42
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094483	EG	On-Demand	Anodyne	DPP7	48	39
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094483	EG	On-Demand	Anodyne	RBP4	41	37
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094483	EG	On-Demand	Anodyne	SFRP1	51	33
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](c2ccccc2)C(F)(F)F)C1	ZINC000875094483	EG	On-Demand	Anodyne	WNT3	51	33
C[C@H](NC(=O)NCCCNc1ccccn1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875094495	GE	On-Demand	Anodyne	GPR119	21	40
C[C@@H](NC(=O)NCCCNc1ccccn1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875094496	GE	On-Demand	Anodyne	GPR119	21	40
Cn1cnnc1CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875094513	ED	On-Demand	Mild	CTSF	49	32
Cn1cnnc1CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875094513	ED	On-Demand	Mild	CTSV	48	33
Cn1cnnc1CNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875094514	ED	On-Demand	Mild	CTSF	49	32
Cn1cnnc1CNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875094514	ED	On-Demand	Mild	CTSV	48	33
O=C(NNc1cccc(F)c1Cl)NC1CCN(c2ccccn2)CC1	ZINC000875094535	FG	On-Demand	Reactive	EBP	21	41
O=C(NCCCNc1ccccn1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875094545	EG	On-Demand	Anodyne	GRIN2B	15	43
O=C(NCCCNc1ccccn1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875094545	EG	On-Demand	Anodyne	EPHX2	22	43
O=C(NCCCNc1ccccn1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875094546	EG	On-Demand	Anodyne	GRIN2B	15	43
O=C(NCCCNc1ccccn1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875094546	EG	On-Demand	Anodyne	EPHX2	22	43
O=C(NC1CCN(c2ccccn2)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875094549	GF	On-Demand	Anodyne	EPHX2	21	41
O=C(NC1CCN(c2ccccn2)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875094550	GF	On-Demand	Anodyne	EPHX2	21	41
Cc1nccnc1[C@@H](C)NC(=O)N[C@H](c1ccccc1)C(F)(F)F	ZINC000875094554	EG	On-Demand	Anodyne	CTSF	48	34
Cc1nccnc1[C@@H](C)NC(=O)N[C@H](c1ccccc1)C(F)(F)F	ZINC000875094554	EG	On-Demand	Anodyne	CTSL	15	40
Cc1nccnc1[C@H](C)NC(=O)N[C@@H](c1ccccc1)C(F)(F)F	ZINC000875094555	EG	On-Demand	Anodyne	CTSF	48	34
Cc1nccnc1[C@H](C)NC(=O)N[C@@H](c1ccccc1)C(F)(F)F	ZINC000875094555	EG	On-Demand	Anodyne	CTSL	15	40
Cc1nccnc1[C@@H](C)NC(=O)N[C@@H](c1ccccc1)C(F)(F)F	ZINC000875094556	EG	On-Demand	Anodyne	CTSF	48	34
Cc1nccnc1[C@@H](C)NC(=O)N[C@@H](c1ccccc1)C(F)(F)F	ZINC000875094556	EG	On-Demand	Anodyne	CTSL	15	40
Cc1nccnc1[C@H](C)NC(=O)N[C@H](c1ccccc1)C(F)(F)F	ZINC000875094557	EG	On-Demand	Anodyne	CTSF	48	34
Cc1nccnc1[C@H](C)NC(=O)N[C@H](c1ccccc1)C(F)(F)F	ZINC000875094557	EG	On-Demand	Anodyne	CTSL	15	40
Cn1nc(Cl)c(C(=O)N2CCC[C@@H]2Cc2ccccc2)c1Cl	ZINC000875094558	EH	On-Demand	Anodyne	GRIN2B	41	36
Cn1nc(Cl)c(C(=O)N2CCC[C@@H]2Cc2ccccc2)c1Cl	ZINC000875094558	EH	On-Demand	Anodyne	PREP	85	35
Cn1nc(Cl)c(C(=O)N2CCC[C@H]2Cc2ccccc2)c1Cl	ZINC000875094559	EH	On-Demand	Anodyne	GRIN2B	41	36
Cn1nc(Cl)c(C(=O)N2CCC[C@H]2Cc2ccccc2)c1Cl	ZINC000875094559	EH	On-Demand	Anodyne	PREP	85	35
CN1CCN(C2CCN(C(=O)N[C@@H](c3ccccc3)C(F)(F)F)CC2)CC1	ZINC000875094562	GF	On-Demand	Anodyne	CALCRL	41	39
CN1CCN(C2CCN(C(=O)N[C@@H](c3ccccc3)C(F)(F)F)CC2)CC1	ZINC000875094562	GF	On-Demand	Anodyne	BIRC8	46	34
CN1CCN(C2CCN(C(=O)N[C@@H](c3ccccc3)C(F)(F)F)CC2)CC1	ZINC000875094562	GF	On-Demand	Anodyne	L3MBTL3	77	42
CN1CCN(C2CCN(C(=O)N[C@H](c3ccccc3)C(F)(F)F)CC2)CC1	ZINC000875094563	GF	On-Demand	Anodyne	CALCRL	41	39
CN1CCN(C2CCN(C(=O)N[C@H](c3ccccc3)C(F)(F)F)CC2)CC1	ZINC000875094563	GF	On-Demand	Anodyne	BIRC8	46	34
CN1CCN(C2CCN(C(=O)N[C@H](c3ccccc3)C(F)(F)F)CC2)CC1	ZINC000875094563	GF	On-Demand	Anodyne	L3MBTL3	77	42
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1nc2ccccc2s1	ZINC000875094564	FG	On-Demand	Anodyne	NMT1	32	40
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1nc2ccccc2s1	ZINC000875094564	FG	On-Demand	Anodyne	TRY1_BOVIN	56	37
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1nc2ccccc2s1	ZINC000875094564	FG	On-Demand	Anodyne	MTTP	16	42
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1nc2ccccc2s1	ZINC000875094564	FG	On-Demand	Anodyne	ST14	48	34
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1nc2ccccc2s1	ZINC000875094564	FG	On-Demand	Anodyne	L3MBTL3	52	37
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1nc2ccccc2s1	ZINC000875094564	FG	On-Demand	Anodyne	NAMPT	50	51
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1nc2ccccc2s1	ZINC000875094564	FG	On-Demand	Anodyne	TMPRSS6	75	34
COc1ccc2c(c1)CC[C@H]2C(=O)N(C)c1nc2ccccc2o1	ZINC000875094583	DH	On-Demand	Anodyne	PPARA	30	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](c1ccccc1)C(F)(F)F	ZINC000875094587	DG	On-Demand	Anodyne	CTSF	53	35
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](c1ccccc1)C(F)(F)F	ZINC000875094587	DG	On-Demand	Anodyne	CTSK	28	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](c1ccccc1)C(F)(F)F	ZINC000875094587	DG	On-Demand	Anodyne	CTSL	17	44
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](c1ccccc1)C(F)(F)F	ZINC000875094590	DG	On-Demand	Anodyne	CTSF	53	35
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](c1ccccc1)C(F)(F)F	ZINC000875094590	DG	On-Demand	Anodyne	CTSK	28	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](c1ccccc1)C(F)(F)F	ZINC000875094590	DG	On-Demand	Anodyne	CTSL	17	44
COC(=O)N(C)NC(=O)NC[C@H]1CCN(CC(F)(F)F)C1	ZINC000875094591	DC	On-Demand	Reactive	CACNA1I	60	36
COC(=O)N(C)NC(=O)NC[C@@H]1CCN(CC(F)(F)F)C1	ZINC000875094592	DC	On-Demand	Reactive	CACNA1I	60	36
C[C@H](CCc1ccc(F)cc1)C(=O)N(C)c1nc2ccccc2o1	ZINC000875094597	EI	On-Demand	Anodyne	PPARA	15	41
C[C@@H](CCc1ccc(F)cc1)C(=O)N(C)c1nc2ccccc2o1	ZINC000875094598	EI	On-Demand	Anodyne	PPARA	15	41
O=CN1CCCN(C(=O)NC2CCN(c3ccccn3)CC2)CC1	ZINC000875094601	EC	On-Demand	Anodyne	EPHX2	16	43
COC(=O)[C@@H]1CO[C@H](CCC(=O)N(C)c2nc3ccccc3o2)C1	ZINC000875094602	EE	On-Demand	Anodyne	FASN	24	40
CCOC(=O)N[C@@H](CNC(=O)C(=O)NCc1cccc(F)c1F)CC(C)C	ZINC000875094603	GD	On-Demand	Anodyne	CTSB	30	40
CCOC(=O)N[C@@H](CNC(=O)C(=O)NCc1cccc(F)c1F)CC(C)C	ZINC000875094603	GD	On-Demand	Anodyne	CAPNS1	55	35
CCOC(=O)N[C@@H](CNC(=O)C(=O)NCc1cccc(F)c1F)CC(C)C	ZINC000875094603	GD	On-Demand	Anodyne	HLA-DRB1	57	36
CCOC(=O)N[C@@H](CNC(=O)C(=O)NCc1cccc(F)c1F)CC(C)C	ZINC000875094603	GD	On-Demand	Anodyne	CAPN1	60	40
CCOC(=O)N[C@@H](CNC(=O)C(=O)NCc1cccc(F)c1F)CC(C)C	ZINC000875094603	GD	On-Demand	Anodyne	CAPN2	115	40
CCOC(=O)N[C@H](CNC(=O)C(=O)NCc1cccc(F)c1F)CC(C)C	ZINC000875094604	GD	On-Demand	Anodyne	CTSB	30	40
CCOC(=O)N[C@H](CNC(=O)C(=O)NCc1cccc(F)c1F)CC(C)C	ZINC000875094604	GD	On-Demand	Anodyne	CAPNS1	55	35
CCOC(=O)N[C@H](CNC(=O)C(=O)NCc1cccc(F)c1F)CC(C)C	ZINC000875094604	GD	On-Demand	Anodyne	HLA-DRB1	57	36
CCOC(=O)N[C@H](CNC(=O)C(=O)NCc1cccc(F)c1F)CC(C)C	ZINC000875094604	GD	On-Demand	Anodyne	CAPN1	60	40
CCOC(=O)N[C@H](CNC(=O)C(=O)NCc1cccc(F)c1F)CC(C)C	ZINC000875094604	GD	On-Demand	Anodyne	CAPN2	115	40
CCO[C@@H](C(=O)Nc1cc([N+](=O)[O-])c(F)cc1F)C(C)C	ZINC000875094607	DF	On-Demand	Bother	COLA	48	40
COCCNC(=O)c1ccccc1NC(=O)c1ccnc(OCCN(C)C)c1	ZINC000875094655	GD	On-Demand	Anodyne	KIT	18	45
COCCNC(=O)c1ccccc1NC(=O)c1ccnc(OCCN(C)C)c1	ZINC000875094655	GD	On-Demand	Anodyne	BRAF	18	45
CCCCCCCNC(=O)C(=O)NCc1cc[nH]n1	ZINC000875094695	CD	On-Demand	Mild	ASAH1	95	38
COc1ccc([C@@H]2CCCN2C(=O)COC(=O)c2ccc(OCC(N)=O)cc2)cc1OC	ZINC000875094698	IE	On-Demand	Anodyne	FKBP1A	41	36
COc1ccc([C@@H]2CCCN2C(=O)COC(=O)c2ccc(OCC(N)=O)cc2)cc1OC	ZINC000875094698	IE	On-Demand	Anodyne	CPT1A	125	44
COc1ccc([C@@H]2CCCN2C(=O)COC(=O)c2ccc(OCC(N)=O)cc2)cc1OC	ZINC000875094698	IE	On-Demand	Anodyne	CPT2	43	37
CC(=O)C1CCN(C(=O)NCc2c[nH]nc2C)CC1	ZINC000875094736	CD	On-Demand	Anodyne	EPHX2	17	42
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCc1c[nH]nc1C)CC2	ZINC000875094784	EF	On-Demand	Anodyne	SLC18A2	46	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCc1c[nH]nc1C)CC2	ZINC000875094785	EF	On-Demand	Anodyne	SLC18A2	46	34
CN(C(=O)CSCC(=O)NCc1ccc(C(=O)N2CCCC2)cc1)C1CCCCC1	ZINC000875094794	IG	On-Demand	Anodyne	L3MBTL3	67	41
COc1ccccc1[C@H]1CCCN(C(=O)NCc2c[nH]nc2C)CC1	ZINC000875094806	EG	On-Demand	Anodyne	EPHX2	15	45
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2c[nH]nc2C)CC1	ZINC000875094807	EG	On-Demand	Anodyne	EPHX2	15	45
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1cc[nH]n1)CC2	ZINC000875094841	FD	On-Demand	Anodyne	SLC18A2	47	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1cc[nH]n1)CC2	ZINC000875094842	FD	On-Demand	Anodyne	SLC18A2	47	34
CC(=O)N1CCC[C@@H]1C(=O)O[C@@H](c1ccccc1)c1ccccn1	ZINC000875094916	DF	On-Demand	Anodyne	F2	24	46
CC(=O)N1CCC[C@@H]1C(=O)O[C@@H](c1ccccc1)c1ccccn1	ZINC000875094916	DF	On-Demand	Anodyne	FKBP1A	72	42
CC(=O)N1CCC[C@@H]1C(=O)O[C@@H](c1ccccc1)c1ccccn1	ZINC000875094916	DF	On-Demand	Anodyne	PREP	65	38
CC(=O)N1CCC[C@@H]1C(=O)O[C@H](c1ccccc1)c1ccccn1	ZINC000875094917	DF	On-Demand	Anodyne	F2	24	46
CC(=O)N1CCC[C@@H]1C(=O)O[C@H](c1ccccc1)c1ccccn1	ZINC000875094917	DF	On-Demand	Anodyne	FKBP1A	72	42
CC(=O)N1CCC[C@@H]1C(=O)O[C@H](c1ccccc1)c1ccccn1	ZINC000875094917	DF	On-Demand	Anodyne	PREP	65	38
O=C(CCCNC(=O)N1CCC[C@@](O)(c2ccccc2)C1)NC1CC1	ZINC000875094922	ED	On-Demand	Anodyne	EPHX2	21	44
O=C(CCCNC(=O)N1CCC[C@](O)(c2ccccc2)C1)NC1CC1	ZINC000875094923	ED	On-Demand	Anodyne	EPHX2	21	44
Cc1cc(/C=C(/C#N)C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)c(C)n1C1CCCCC1	ZINC000875094946	JK	On-Demand	Reactive	L3MBTL3	54	35
O=C(CCCNC(=O)NC1CC(Nc2ccccc2)C1)NC1CC1	ZINC000875094957	ED	On-Demand	Anodyne	EPHX2	27	46
O=C(CCCNC(=O)NC1CC(Nc2ccccc2)C1)NC1CC1	ZINC000875094957	ED	On-Demand	Anodyne	TNKS	40	31
COC(=O)/C=C\c1ccc(OC(=O)[C@H]2CCCN2C(C)=O)c(OC)c1	ZINC000875095028	ED	On-Demand	Anodyne	ACKR3	40	33
C[C@H](NC(=O)NC[C@H](O)Cc1cccc(Cl)c1)C(=O)N(C)C	ZINC000875095054	ED	On-Demand	Anodyne	CTSV	29	40
C[C@@H](NC(=O)NC[C@@H](O)Cc1cccc(Cl)c1)C(=O)N(C)C	ZINC000875095055	ED	On-Demand	Anodyne	CTSV	29	40
C[C@@H](NC(=O)NC[C@H](O)Cc1cccc(Cl)c1)C(=O)N(C)C	ZINC000875095056	ED	On-Demand	Anodyne	CTSV	29	40
COc1ccc(N2CCN(C(=O)NCc3c[nH]nc3C)CC2)c(OC)c1	ZINC000875095108	FD	On-Demand	Clean	HTR1A	35	41
COc1ccc(N2CCN(C(=O)NCc3c[nH]nc3C)CC2)c(OC)c1	ZINC000875095108	FD	On-Demand	Clean	DRD4	41	32
COc1ccc(N2CCN(C(=O)NCc3c[nH]nc3C)CC2)c(OC)c1	ZINC000875095108	FD	On-Demand	Clean	HTR1D	17	41
COc1ccc(N2CCN(C(=O)NCc3c[nH]nc3C)CC2)c(OC)c1	ZINC000875095108	FD	On-Demand	Clean	HTR1B	19	41
COc1ccc(N2CCN(C(=O)NCc3c[nH]nc3C)CC2)c(OC)c1	ZINC000875095108	FD	On-Demand	Clean	DRD3	50	38
COc1ccc(N2CCN(C(=O)NCc3c[nH]nc3C)CC2)c(OC)c1	ZINC000875095108	FD	On-Demand	Clean	PDGFRB	50	38
COc1ccc(N2CCN(C(=O)NCc3c[nH]nc3C)CC2)c(OC)c1	ZINC000875095108	FD	On-Demand	Clean	HTR7	27	40
COC(=O)c1ccc(OC)c2c1CCN(C(=O)NCCCC(=O)NC1CC1)C2	ZINC000875095128	GD	On-Demand	Anodyne	HTR4	22	40
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)C(=O)N(C)C	ZINC000875095200	ED	On-Demand	Anodyne	OPRL1	16	47
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)C(=O)N(C)C	ZINC000875095201	ED	On-Demand	Anodyne	OPRL1	16	47
COC(=O)/C=C\c1ccc(OC(=O)C2(F)CCOCC2)c(OC)c1	ZINC000875095359	EE	On-Demand	Anodyne	TUBB1	41	35
COc1ccccc1[C@H]1CCCN(C(=O)NCCCN(C)S(C)(=O)=O)CC1	ZINC000875095371	GE	On-Demand	Anodyne	DRD2	20	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCN(C)S(C)(=O)=O)CC1	ZINC000875095373	GE	On-Demand	Anodyne	DRD2	20	41
CC[C@@H](NC(=O)NCCCC(=O)NC1CC1)[C@H](O)c1ccccc1	ZINC000875095514	ED	On-Demand	Anodyne	EPHX2	15	46
CC[C@@H](NC(=O)NCCCC(=O)NC1CC1)[C@H](O)c1ccccc1	ZINC000875095514	ED	On-Demand	Anodyne	TNKS	45	33
CC[C@@H](NC(=O)NCCCC(=O)NC1CC1)[C@@H](O)c1ccccc1	ZINC000875095516	ED	On-Demand	Anodyne	EPHX2	15	46
CC[C@@H](NC(=O)NCCCC(=O)NC1CC1)[C@@H](O)c1ccccc1	ZINC000875095516	ED	On-Demand	Anodyne	TNKS	45	33
O=C(CCCNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)NC1CC1	ZINC000875095543	FD	On-Demand	Anodyne	DRD4	21	42
O=C(CCCNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)NC1CC1	ZINC000875095543	FD	On-Demand	Anodyne	SIGMAR1	26	49
CCO[C@@H](C(=O)Oc1ccc(/C=C\C(=O)OC)cc1OC)C(C)C	ZINC000875095615	EF	On-Demand	Anodyne	AKR1C3	21	41
CCO[C@@H](C(=O)Oc1ccc(/C=C/C(=O)OC)cc1OC)C(C)C	ZINC000875095617	EF	On-Demand	Anodyne	AKR1C3	21	41
CN1CCCC[C@H]1CCOC(=O)c1ccc(OCC(N)=O)cc1	ZINC000875095706	DD	On-Demand	Anodyne	HRH3	44	48
CN1CCCC[C@H]1CCOC(=O)c1ccc(OCC(N)=O)cc1	ZINC000875095706	DD	On-Demand	Anodyne	CPT1A	78	39
CN1CCCC[C@H]1CCOC(=O)c1ccc(OCC(N)=O)cc1	ZINC000875095706	DD	On-Demand	Anodyne	CHRNA10	72	43
CN1CCCC[C@H]1CCOC(=O)c1ccc(OCC(N)=O)cc1	ZINC000875095706	DD	On-Demand	Anodyne	ACKR3	71	38
CN1CCCC[C@@H]1CCOC(=O)c1ccc(OCC(N)=O)cc1	ZINC000875095711	DD	On-Demand	Anodyne	HRH3	44	48
CN1CCCC[C@@H]1CCOC(=O)c1ccc(OCC(N)=O)cc1	ZINC000875095711	DD	On-Demand	Anodyne	CPT1A	78	39
CN1CCCC[C@@H]1CCOC(=O)c1ccc(OCC(N)=O)cc1	ZINC000875095711	DD	On-Demand	Anodyne	CHRNA10	72	43
CN1CCCC[C@@H]1CCOC(=O)c1ccc(OCC(N)=O)cc1	ZINC000875095711	DD	On-Demand	Anodyne	ACKR3	71	38
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1ccccc1CSc1nc[nH]n1	ZINC000875095758	HG	On-Demand	Anodyne	MTTP	23	42
N#CCc1ccsc1C(=O)Nc1ccccc1N1CCCCCC1	ZINC000875095768	EI	On-Demand	Mild	KCNQ2	87	50
N#CCc1ccsc1C(=O)Nc1ccccc1N1CCCCCC1	ZINC000875095768	EI	On-Demand	Mild	CSF1R	26	55
COC(=O)[C@@H]1CCCCN1C(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875095785	GG	On-Demand	Anodyne	FKBP1A	65	39
COC(=O)[C@@H]1CCCCN1C(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875095785	GG	On-Demand	Anodyne	PREP	39	58
COC(=O)[C@@H]1CCCCN1C(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875095785	GG	On-Demand	Anodyne	WNT3	40	33
COc1ccc(CNC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)cn1	ZINC000875095790	FG	On-Demand	Anodyne	NAMPT	22	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2ccc(N3CCCCC3)cc2)C1	ZINC000875095814	GE	On-Demand	Anodyne	GPBAR1	25	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2ccc(N3CCCCC3)cc2)C1	ZINC000875095817	GE	On-Demand	Anodyne	GPBAR1	25	43
CCCCCCCNC(=O)C(=O)N[C@@H]1CCN2CCCC[C@@H]12	ZINC000875095883	DD	On-Demand	Mild	ASAH1	74	34
CCCCCCCNC(=O)C(=O)N[C@H]1CCN2CCCC[C@@H]12	ZINC000875095887	DD	On-Demand	Mild	ASAH1	74	34
CCCCCCCNC(=O)C(=O)N[C@@H]1CCN2CCCC[C@H]12	ZINC000875095889	DD	On-Demand	Mild	ASAH1	74	34
CCCCCCCNC(=O)C(=O)N[C@H]1CCN2CCCC[C@H]12	ZINC000875095893	DD	On-Demand	Mild	ASAH1	74	34
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nncn1-c1ccccc1	ZINC000875095925	FD	On-Demand	Anodyne	SLC6A4	27	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nncn1-c1ccccc1	ZINC000875095925	FD	On-Demand	Anodyne	SLC6A3	54	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nncn1-c1ccccc1	ZINC000875095928	FD	On-Demand	Anodyne	SLC6A4	27	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nncn1-c1ccccc1	ZINC000875095928	FD	On-Demand	Anodyne	SLC6A3	54	41
COC(=O)C1(O)CN(C(=O)NCc2cnn(Cc3ccccc3)c2)C1	ZINC000875095930	EC	On-Demand	Anodyne	PANC	54	41
N#Cc1ccc(Cn2cc(NC(=O)NC[C@@H]3CCN(C4CC4)C3)cn2)cc1	ZINC000875095966	FE	On-Demand	Mild	CCR3	37	43
N#Cc1ccc(Cn2cc(NC(=O)NC[C@@H]3CCN(C4CC4)C3)cn2)cc1	ZINC000875095966	FE	On-Demand	Mild	ITK	15	49
N#Cc1ccc(Cn2cc(NC(=O)NC[C@@H]3CCN(C4CC4)C3)cn2)cc1	ZINC000875095966	FE	On-Demand	Mild	PANC	54	37
N#Cc1ccc(Cn2cc(NC(=O)NC[C@H]3CCN(C4CC4)C3)cn2)cc1	ZINC000875095968	FE	On-Demand	Mild	CCR3	37	43
N#Cc1ccc(Cn2cc(NC(=O)NC[C@H]3CCN(C4CC4)C3)cn2)cc1	ZINC000875095968	FE	On-Demand	Mild	ITK	15	49
N#Cc1ccc(Cn2cc(NC(=O)NC[C@H]3CCN(C4CC4)C3)cn2)cc1	ZINC000875095968	FE	On-Demand	Mild	PANC	54	37
COC(=O)c1ccc(CC(=O)N2CCCc3cccc(F)c32)cn1	ZINC000875095983	EF	On-Demand	Anodyne	BDKRB1	23	40
COC(=O)[C@@H]1CCCCN1C(=O)c1sccc1CC#N	ZINC000875096034	CD	On-Demand	Mild	FKBP1A	62	38
COC(=O)[C@@H]1CCCCN1C(=O)c1sccc1CC#N	ZINC000875096034	CD	On-Demand	Mild	PREP	52	44
COC(=O)[C@@H]1CCCCN1C(=O)c1sccc1CC#N	ZINC000875096034	CD	On-Demand	Mild	LGMN	66	36
CN(c1ccccc1)S(=O)(=O)c1ccccc1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875096045	JH	On-Demand	Anodyne	CCR8	43	32
CN(c1ccccc1)S(=O)(=O)c1ccccc1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875096045	JH	On-Demand	Anodyne	LIMK2	17	40
CN(c1ccccc1)S(=O)(=O)c1ccccc1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875096045	JH	On-Demand	Anodyne	L3MBTL3	40	40
CN(c1ccccc1)S(=O)(=O)c1ccccc1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875096045	JH	On-Demand	Anodyne	NAMPT	42	39
CCN(CC)C(=O)CCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875096078	FF	On-Demand	Anodyne	TRY1_BOVIN	41	34
CCN(CC)C(=O)CCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875096078	FF	On-Demand	Anodyne	PREP	43	36
CCN(CC)C(=O)CCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875096079	FF	On-Demand	Anodyne	TRY1_BOVIN	41	34
CCN(CC)C(=O)CCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875096079	FF	On-Demand	Anodyne	PREP	43	36
CCN(CC)C(=O)CCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875096080	FF	On-Demand	Anodyne	TRY1_BOVIN	41	34
CCN(CC)C(=O)CCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875096080	FF	On-Demand	Anodyne	PREP	43	36
CCN(CC)C(=O)CCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875096081	FF	On-Demand	Anodyne	TRY1_BOVIN	41	34
CCN(CC)C(=O)CCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875096081	FF	On-Demand	Anodyne	PREP	43	36
O=C(CCCNC(=O)NNc1ccc(OCc2ccccc2)cc1)NC1CC1	ZINC000875096111	GF	On-Demand	Reactive	HRH2	27	41
O=C(CCCNC(=O)NNc1ccc(OCc2ccccc2)cc1)NC1CC1	ZINC000875096111	GF	On-Demand	Reactive	GRIN2B	19	41
O=C(CCCNC(=O)NNc1ccc(OCc2ccccc2)cc1)NC1CC1	ZINC000875096111	GF	On-Demand	Reactive	LTA4H	37	49
O=C(CCCNC(=O)NNc1ccc(OCc2ccccc2)cc1)NC1CC1	ZINC000875096111	GF	On-Demand	Reactive	SLC6A5	34	41
O=C(CCCNC(=O)NNc1ccc(OCc2ccccc2)cc1)NC1CC1	ZINC000875096111	GF	On-Demand	Reactive	EPHX2	33	47
O=C(CCCNC(=O)NNc1ccc(OCc2ccccc2)cc1)NC1CC1	ZINC000875096111	GF	On-Demand	Reactive	FFAR1	17	40
O=C(CCCNC(=O)NNc1ccc(OCc2ccccc2)cc1)NC1CC1	ZINC000875096111	GF	On-Demand	Reactive	POLG_WNV	40	29
O=C(CCCNC(=O)NNc1ccc(OCc2ccccc2)cc1)NC1CC1	ZINC000875096111	GF	On-Demand	Reactive	TNKS	51	33
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cc[nH]n1	ZINC000875096172	FD	On-Demand	Anodyne	DRD2	24	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cc[nH]n1	ZINC000875096172	FD	On-Demand	Anodyne	DRD4	51	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cc[nH]n1	ZINC000875096172	FD	On-Demand	Anodyne	ACHE	64	58
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cc[nH]n1	ZINC000875096172	FD	On-Demand	Anodyne	DRD3	21	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cc[nH]n1	ZINC000875096172	FD	On-Demand	Anodyne	SLC6A3	19	47
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cc[nH]n1	ZINC000875096172	FD	On-Demand	Anodyne	HTR4	33	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cc[nH]n1	ZINC000875096172	FD	On-Demand	Anodyne	GRIN2B	44	35
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cc[nH]n1	ZINC000875096172	FD	On-Demand	Anodyne	SIGMAR1	55	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cc[nH]n1	ZINC000875096172	FD	On-Demand	Anodyne	BCHE	20	50
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cc[nH]n1	ZINC000875096172	FD	On-Demand	Anodyne	CCR3	36	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cc[nH]n1	ZINC000875096172	FD	On-Demand	Anodyne	SCN5A	28	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cc[nH]n1	ZINC000875096172	FD	On-Demand	Anodyne	CACNA1G	28	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cc[nH]n1	ZINC000875096172	FD	On-Demand	Anodyne	SIRT3	40	31
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cc[nH]n1	ZINC000875096172	FD	On-Demand	Anodyne	SIRT2	45	33
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cc[nH]n1	ZINC000875096172	FD	On-Demand	Anodyne	SIRT1	41	34
COC(=O)/C=C\c1ccc(OC(=O)C2(C)CC(F)(F)C2)c(OC)c1	ZINC000875096175	EG	On-Demand	Anodyne	NR1H4	44	37
COC(=O)/C=C\c1ccc(OC(=O)C2(C)CC(F)(F)C2)c(OC)c1	ZINC000875096175	EG	On-Demand	Anodyne	TUBB1	42	36
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCC(=O)NC3CC3)C[C@@H]1C2	ZINC000875096179	DC	On-Demand	Anodyne	EPHX2	28	47
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cnn(Cc3ccccc3)c2)C1	ZINC000875096293	FE	On-Demand	Anodyne	PANC	48	38
O=C(NCCO)C1CCN(C(=O)NCc2cnn(Cc3ccccc3)c2)CC1	ZINC000875096295	GC	On-Demand	Anodyne	SIGMAR1	18	53
O=C(NCCO)C1CCN(C(=O)NCc2cnn(Cc3ccccc3)c2)CC1	ZINC000875096295	GC	On-Demand	Anodyne	EPHX2	23	42
O=C(NCCO)C1CCN(C(=O)NCc2cnn(Cc3ccccc3)c2)CC1	ZINC000875096295	GC	On-Demand	Anodyne	CACNA1G	25	40
CCC1(CC)CCCN1C(=O)NCc1nncn1-c1ccccc1	ZINC000875096307	EG	On-Demand	Anodyne	SLC12A5	44	33
COC(=O)/C=C\c1ccc(OC(=O)[C@@]2(CC(C)C)CCNC2=O)c(OC)c1	ZINC000875096348	GE	On-Demand	Anodyne	NR1H4	43	38
COC(=O)/C=C\c1ccc(OC(=O)[C@]2(CC(C)C)CCNC2=O)c(OC)c1	ZINC000875096349	GE	On-Demand	Anodyne	NR1H4	43	38
C[C@H](NC(=O)[C@@H](C)OC(=O)c1ccc(OCC(N)=O)cc1)c1ccc2c(c1)OCCO2	ZINC000875096352	ID	On-Demand	Anodyne	F7	17	48
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1ccc(O)cc1O	ZINC000875096353	EE	On-Demand	Anodyne	FABI	50	35
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1ccc(O)cc1O	ZINC000875096353	EE	On-Demand	Anodyne	L3MBTL3	80	40
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1ccc(O)cc1O	ZINC000875096353	EE	On-Demand	Anodyne	NAMPT	24	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000875096371	FE	On-Demand	Anodyne	P2RY12	70	36
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCN(c3ccccc3)C2)C1	ZINC000875096377	FE	On-Demand	Anodyne	P2RY12	70	36
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC[C@H]1CCN(C2CC2)C1	ZINC000875096468	FE	On-Demand	Anodyne	CCR3	31	41
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC[C@H]1CCN(C2CC2)C1	ZINC000875096468	FE	On-Demand	Anodyne	CACNA1I	53	39
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC[C@H]1CCN(C2CC2)C1	ZINC000875096469	FE	On-Demand	Anodyne	CCR3	31	41
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC[C@H]1CCN(C2CC2)C1	ZINC000875096469	FE	On-Demand	Anodyne	CACNA1I	53	39
O=C(NC[C@@H]1CCN(C2CC2)C1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875096470	FE	On-Demand	Anodyne	CCR3	31	41
O=C(NC[C@@H]1CCN(C2CC2)C1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875096470	FE	On-Demand	Anodyne	CACNA1I	53	39
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC[C@@H]1CCN(C2CC2)C1	ZINC000875096471	FE	On-Demand	Anodyne	CCR3	31	41
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC[C@@H]1CCN(C2CC2)C1	ZINC000875096471	FE	On-Demand	Anodyne	CACNA1I	53	39
COc1ccccc1[C@H]1CCCN(C(=O)N[C@H](C)C(=O)N(C)C)CC1	ZINC000875096627	EE	On-Demand	Anodyne	HTR1A	21	40
COc1ccccc1[C@H]1CCCN(C(=O)N[C@H](C)C(=O)N(C)C)CC1	ZINC000875096627	EE	On-Demand	Anodyne	RBP4	38	40
COc1ccccc1[C@H]1CCCN(C(=O)N[C@H](C)C(=O)N(C)C)CC1	ZINC000875096627	EE	On-Demand	Anodyne	Q6PRC7_IXORI	51	33
COc1ccccc1[C@H]1CCCN(C(=O)N[C@@H](C)C(=O)N(C)C)CC1	ZINC000875096629	EE	On-Demand	Anodyne	HTR1A	21	40
COc1ccccc1[C@H]1CCCN(C(=O)N[C@@H](C)C(=O)N(C)C)CC1	ZINC000875096629	EE	On-Demand	Anodyne	RBP4	38	40
COc1ccccc1[C@H]1CCCN(C(=O)N[C@@H](C)C(=O)N(C)C)CC1	ZINC000875096629	EE	On-Demand	Anodyne	Q6PRC7_IXORI	51	33
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H](C)C(=O)N(C)C)CC1	ZINC000875096631	EE	On-Demand	Anodyne	HTR1A	21	40
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H](C)C(=O)N(C)C)CC1	ZINC000875096631	EE	On-Demand	Anodyne	RBP4	38	40
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H](C)C(=O)N(C)C)CC1	ZINC000875096631	EE	On-Demand	Anodyne	Q6PRC7_IXORI	51	33
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H](C)C(=O)N(C)C)CC1	ZINC000875096633	EE	On-Demand	Anodyne	HTR1A	21	40
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H](C)C(=O)N(C)C)CC1	ZINC000875096633	EE	On-Demand	Anodyne	RBP4	38	40
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H](C)C(=O)N(C)C)CC1	ZINC000875096633	EE	On-Demand	Anodyne	Q6PRC7_IXORI	51	33
CC[C@@H](NC(=O)NCCCC(=O)N(CC)CC)[C@@H](O)c1ccccc1	ZINC000875096653	EE	On-Demand	Anodyne	C3AR1	43	31
COc1ccc(N2CCN(C(=O)C(=O)NCc3cc[nH]n3)CC2)c(OC)c1	ZINC000875096663	FC	On-Demand	Clean	DRD2	29	41
COc1ccc(N2CCN(C(=O)C(=O)NCc3cc[nH]n3)CC2)c(OC)c1	ZINC000875096663	FC	On-Demand	Clean	DRD4	40	32
COc1ccc(N2CCN(C(=O)C(=O)NCc3cc[nH]n3)CC2)c(OC)c1	ZINC000875096663	FC	On-Demand	Clean	DRD3	48	38
O=C(NC[C@H]1CCN(C2CC2)C1)NC1CC(Nc2ccccc2)C1	ZINC000875096679	EE	On-Demand	Anodyne	LTA4H	17	40
O=C(NC[C@@H]1CCN(C2CC2)C1)NC1CC(Nc2ccccc2)C1	ZINC000875096680	EE	On-Demand	Anodyne	LTA4H	17	40
COC(=O)[C@@H]1CCCN1C(=O)c1c(C(F)(F)F)coc1C	ZINC000875096696	DE	On-Demand	Anodyne	SFRP1	41	34
COC(=O)[C@@H]1CCCN1C(=O)c1c(C(F)(F)F)coc1C	ZINC000875096696	DE	On-Demand	Anodyne	WNT3	51	34
CN1CCN(C(=O)NCc2cnn(Cc3ccccc3)c2)CCC1(C)C	ZINC000875096751	FF	On-Demand	Anodyne	FAAH	15	40
COC(=O)/C=C\c1ccc(OC(=O)[C@@H](NC=O)C(C)C)c(OC)c1	ZINC000875096767	ED	On-Demand	Anodyne	NR1H4	38	40
COC(=O)/C=C\c1ccc(OC(=O)[C@@H](NC=O)C(C)C)c(OC)c1	ZINC000875096767	ED	On-Demand	Anodyne	TUBB1	46	36
O=C(NC[C@@H]1CCN(C2CC2)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875096812	EE	On-Demand	Anodyne	EPHX2	15	40
O=C(NC[C@@H]1CCN(C2CC2)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875096813	EE	On-Demand	Anodyne	EPHX2	15	40
O=C(NC[C@H]1CCN(C2CC2)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875096815	EE	On-Demand	Anodyne	EPHX2	15	40
O=C(NC[C@H]1CCN(C2CC2)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875096816	EE	On-Demand	Anodyne	EPHX2	15	40
O=C(NCCCCCCc1ccccc1)C(=O)NCc1cc[nH]n1	ZINC000875096856	ED	On-Demand	Anodyne	FAAH	69	44
O=C(NCCCCCCc1ccccc1)C(=O)NCc1cc[nH]n1	ZINC000875096856	ED	On-Demand	Anodyne	SLC6A5	23	41
O=C(NCCCCCCc1ccccc1)C(=O)NCc1cc[nH]n1	ZINC000875096856	ED	On-Demand	Anodyne	CES1	69	42
O=C(NCCCCCCc1ccccc1)C(=O)NCc1cc[nH]n1	ZINC000875096856	ED	On-Demand	Anodyne	AMP1_PLAFQ	37	45
COC(=O)/C=C\c1ccc(OC(=O)C2CCN(C(C)C)CC2)c(OC)c1	ZINC000875096864	FF	On-Demand	Anodyne	NR1H4	42	36
CC[C@@H](NC(=O)NCCCC(=O)N(CC)CC)[C@H](O)c1ccccc1	ZINC000875096885	EE	On-Demand	Anodyne	C3AR1	43	31
COC(=O)c1cc(NC(=O)c2ccnc(OCCN(C)C)c2)ccc1F	ZINC000875096898	FE	On-Demand	Anodyne	KCNK3	38	44
O=C(NCc1cnn(Cc2ccccc2)c1)N1CCC(CO)(CO)CC1	ZINC000875097017	FD	On-Demand	Anodyne	SIGMAR1	22	40
CCN(CC)C(=O)CCCNC(=O)N(CC)[C@H](C)[C@H](O)c1ccccc1	ZINC000875097044	FF	On-Demand	Anodyne	C3AR1	44	32
CCN(CC)C(=O)CCCNC(=O)N(CC)[C@H](C)[C@H](O)c1ccccc1	ZINC000875097044	FF	On-Demand	Anodyne	NPY5R	22	42
CCN(CC)C(=O)CCCNC(=O)N(CC)[C@@H](C)[C@H](O)c1ccccc1	ZINC000875097046	FF	On-Demand	Anodyne	C3AR1	44	32
CCN(CC)C(=O)CCCNC(=O)N(CC)[C@@H](C)[C@H](O)c1ccccc1	ZINC000875097046	FF	On-Demand	Anodyne	NPY5R	22	42
CCN(CC)C(=O)CCCNC(=O)N(CC)[C@@H](C)[C@@H](O)c1ccccc1	ZINC000875097048	FF	On-Demand	Anodyne	C3AR1	44	32
CCN(CC)C(=O)CCCNC(=O)N(CC)[C@@H](C)[C@@H](O)c1ccccc1	ZINC000875097048	FF	On-Demand	Anodyne	NPY5R	22	42
CCN(CC)C(=O)CCCNC(=O)N(CC)[C@H](C)[C@@H](O)c1ccccc1	ZINC000875097050	FF	On-Demand	Anodyne	C3AR1	44	32
CCN(CC)C(=O)CCCNC(=O)N(CC)[C@H](C)[C@@H](O)c1ccccc1	ZINC000875097050	FF	On-Demand	Anodyne	NPY5R	22	42
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)C(=O)NCc1cc[nH]n1	ZINC000875097066	FE	On-Demand	Anodyne	MDM2	55	31
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NC[C@H]1CCN(C2CC2)C1	ZINC000875097084	FE	On-Demand	Anodyne	CCR3	16	41
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NC[C@H]1CCN(C2CC2)C1	ZINC000875097084	FE	On-Demand	Anodyne	CACNA1I	70	36
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NC[C@@H]1CCN(C2CC2)C1	ZINC000875097088	FE	On-Demand	Anodyne	CCR3	16	41
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NC[C@@H]1CCN(C2CC2)C1	ZINC000875097088	FE	On-Demand	Anodyne	CACNA1I	70	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2ccccc2)C1	ZINC000875097122	FE	On-Demand	Anodyne	SLC6A4	28	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2ccccc2)C1	ZINC000875097122	FE	On-Demand	Anodyne	SLC6A3	53	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2ccccc2)C1	ZINC000875097128	FE	On-Demand	Anodyne	SLC6A4	28	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2ccccc2)C1	ZINC000875097128	FE	On-Demand	Anodyne	SLC6A3	53	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2ccccc2)C1	ZINC000875097132	FE	On-Demand	Anodyne	SLC6A4	28	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2ccccc2)C1	ZINC000875097132	FE	On-Demand	Anodyne	SLC6A3	53	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2ccccc2)C1	ZINC000875097134	FE	On-Demand	Anodyne	SLC6A4	28	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2ccccc2)C1	ZINC000875097134	FE	On-Demand	Anodyne	SLC6A3	53	42
CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H]1CCCN2C(=O)NC[C@H]1CCN(C2CC2)C1	ZINC000875097185	GF	On-Demand	Anodyne	CACNA1I	40	31
CC(C)(C)OC(=O)N1CC[C@@H]2[C@H]1CCCN2C(=O)NC[C@@H]1CCN(C2CC2)C1	ZINC000875097186	GF	On-Demand	Anodyne	CACNA1I	40	31
CC(C)(C)OC(=O)N1CC[C@@H]2[C@H]1CCCN2C(=O)NC[C@H]1CCN(C2CC2)C1	ZINC000875097188	GF	On-Demand	Anodyne	CACNA1I	40	31
CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H]1CCCN2C(=O)NC[C@@H]1CCN(C2CC2)C1	ZINC000875097190	GF	On-Demand	Anodyne	CACNA1I	40	31
Cc1ccccc1CN1CCO[C@@H](CNC(=O)C(=O)NCc2cc[nH]n2)C1	ZINC000875097199	FC	On-Demand	Anodyne	PDE8B	46	31
COC(=O)C1CCN(C(=O)[C@@H](C)OC(=O)c2ccc(OCC(N)=O)cc2)CC1	ZINC000875097223	GC	On-Demand	Anodyne	TRY2_BOVIN	15	41
COC(=O)C1CCN(C(=O)[C@@H](C)OC(=O)c2ccc(OCC(N)=O)cc2)CC1	ZINC000875097223	GC	On-Demand	Anodyne	PTR1	49	35
COC(=O)C1CCN(C(=O)[C@H](C)OC(=O)c2ccc(OCC(N)=O)cc2)CC1	ZINC000875097225	GC	On-Demand	Anodyne	TRY2_BOVIN	15	41
COC(=O)C1CCN(C(=O)[C@H](C)OC(=O)c2ccc(OCC(N)=O)cc2)CC1	ZINC000875097225	GC	On-Demand	Anodyne	PTR1	49	35
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1ccccc1-n1cnnn1	ZINC000875097226	GD	On-Demand	Anodyne	L3MBTL3	48	36
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1ccccc1-n1cnnn1	ZINC000875097226	GD	On-Demand	Anodyne	KCNJ1	45	32
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1ccccc1-n1cnnn1	ZINC000875097226	GD	On-Demand	Anodyne	NAMPT	22	41
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NCc3cc[nH]n3)C2)c1	ZINC000875097253	FC	On-Demand	Anodyne	PDE8B	42	30
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NCc3cc[nH]n3)C2)c1	ZINC000875097254	FC	On-Demand	Anodyne	PDE8B	42	30
NC(=O)COc1ccc(C(=O)OCCCO)cc1	ZINC000875097292	CC	On-Demand	Anodyne	PLA2G4B	84	41
NC(=O)COc1ccc(C(=O)OCCCO)cc1	ZINC000875097292	CC	On-Demand	Anodyne	ACR	62	35
NC(=O)COc1ccc(C(=O)OCCCO)cc1	ZINC000875097292	CC	On-Demand	Anodyne	SLC47A1	19	41
C[C@@H](NC(=O)N(C)C[C@H]1CCCCN1Cc1ccccc1)C(=O)N(C)C	ZINC000875097296	FE	On-Demand	Anodyne	ACE	38	40
C[C@@H](NC(=O)N(C)C[C@H]1CCCCN1Cc1ccccc1)C(=O)N(C)C	ZINC000875097296	FE	On-Demand	Anodyne	MME	16	40
C[C@@H](NC(=O)N(C)C[C@H]1CCCCN1Cc1ccccc1)C(=O)N(C)C	ZINC000875097296	FE	On-Demand	Anodyne	SIGMAR1	22	48
C[C@@H](NC(=O)N(C)C[C@H]1CCCCN1Cc1ccccc1)C(=O)N(C)C	ZINC000875097296	FE	On-Demand	Anodyne	BIRC2	30	41
COc1ccccc1[C@H]1CCCN(C(=O)NCCCC(=O)NC2CC2)CC1	ZINC000875097302	FG	On-Demand	Anodyne	HTR1A	24	42
COc1ccccc1[C@H]1CCCN(C(=O)NCCCC(=O)NC2CC2)CC1	ZINC000875097302	FG	On-Demand	Anodyne	DRD2	30	42
COc1ccccc1[C@H]1CCCN(C(=O)NCCCC(=O)NC2CC2)CC1	ZINC000875097302	FG	On-Demand	Anodyne	DRD4	17	43
COc1ccccc1[C@H]1CCCN(C(=O)NCCCC(=O)NC2CC2)CC1	ZINC000875097302	FG	On-Demand	Anodyne	HTR7	21	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCC(=O)NC2CC2)CC1	ZINC000875097303	FG	On-Demand	Anodyne	HTR1A	24	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCC(=O)NC2CC2)CC1	ZINC000875097303	FG	On-Demand	Anodyne	DRD2	30	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCC(=O)NC2CC2)CC1	ZINC000875097303	FG	On-Demand	Anodyne	DRD4	17	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCC(=O)NC2CC2)CC1	ZINC000875097303	FG	On-Demand	Anodyne	HTR7	21	42
C[C@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)[C@@H]1CCCO1	ZINC000875097306	EE	On-Demand	Mild	ITK	27	46
C[C@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)[C@@H]1CCCO1	ZINC000875097306	EE	On-Demand	Mild	PANC	57	38
C[C@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)[C@H]1CCCO1	ZINC000875097307	EE	On-Demand	Mild	ITK	27	46
C[C@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)[C@H]1CCCO1	ZINC000875097307	EE	On-Demand	Mild	PANC	57	38
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H](C)[C@H]2CCCO2)CC1	ZINC000875097323	EH	On-Demand	Anodyne	RBP4	40	40
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H](C)[C@@H]2CCCO2)CC1	ZINC000875097324	EH	On-Demand	Anodyne	RBP4	40	40
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H](C)[C@H]2CCCO2)CC1	ZINC000875097325	EH	On-Demand	Anodyne	RBP4	40	40
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H](C)[C@@H]2CCCO2)CC1	ZINC000875097326	EH	On-Demand	Anodyne	RBP4	40	40
O=C(CCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)NC1CC1	ZINC000875097359	ED	On-Demand	Anodyne	TNKS	44	30
O=C(CCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)NC1CC1	ZINC000875097360	ED	On-Demand	Anodyne	TNKS	44	30
O=C(CCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)NC1CC1	ZINC000875097361	ED	On-Demand	Anodyne	TNKS	44	30
O=C(CCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)NC1CC1	ZINC000875097362	ED	On-Demand	Anodyne	TNKS	44	30
O=C(CCCNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)NC1CC1	ZINC000875097364	FE	On-Demand	Anodyne	TNKS	45	31
COC(=O)/C=C\c1ccc(OC(=O)[C@]23CCCC[C@H]2C3)c(OC)c1	ZINC000875097370	EG	On-Demand	Anodyne	NR1H4	44	39
COC(=O)/C=C\c1ccc(OC(=O)[C@]23CCCC[C@@H]2C3)c(OC)c1	ZINC000875097371	EG	On-Demand	Anodyne	NR1H4	44	39
O=C(CCCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1)NC1CC1	ZINC000875097375	FD	On-Demand	Anodyne	PTGER4	17	42
O=C(CCCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1)NC1CC1	ZINC000875097376	FD	On-Demand	Anodyne	PTGER4	17	42
O=C(NC[C@@H]1CCN(CC(F)(F)F)C1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875097469	GE	On-Demand	Anodyne	CCR3	46	41
O=C(NC[C@@H]1CCN(CC(F)(F)F)C1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875097469	GE	On-Demand	Anodyne	CACNA1I	78	43
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC[C@H]1CCN(CC(F)(F)F)C1	ZINC000875097470	GE	On-Demand	Anodyne	CCR3	46	41
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC[C@H]1CCN(CC(F)(F)F)C1	ZINC000875097470	GE	On-Demand	Anodyne	CACNA1I	78	43
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC[C@H]1CCN(CC(F)(F)F)C1	ZINC000875097471	GE	On-Demand	Anodyne	CCR3	46	41
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC[C@H]1CCN(CC(F)(F)F)C1	ZINC000875097471	GE	On-Demand	Anodyne	CACNA1I	78	43
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC[C@@H]1CCN(CC(F)(F)F)C1	ZINC000875097472	GE	On-Demand	Anodyne	CCR3	46	41
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC[C@@H]1CCN(CC(F)(F)F)C1	ZINC000875097472	GE	On-Demand	Anodyne	CACNA1I	78	43
CC[C@@H]1CCCC[C@@H]1NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875097490	GG	On-Demand	Anodyne	ETHR	55	50
CC[C@@H]1CCCC[C@H]1NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875097492	GG	On-Demand	Anodyne	ETHR	55	50
CC[C@H]1CCCC[C@H]1NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875097495	GG	On-Demand	Anodyne	ETHR	55	50
CC[C@H]1CCCC[C@@H]1NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875097497	GG	On-Demand	Anodyne	ETHR	55	50
O=C(NCc1cnn(Cc2ccccc2)c1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875097508	FF	On-Demand	Anodyne	SIGMAR1	15	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)c2ccc(OCC(N)=O)cc2)CC1	ZINC000875097546	HC	On-Demand	Anodyne	P2RY12	61	38
CCOC(=O)N1CCN(C(=O)[C@H](C)OC(=O)c2ccc(OCC(N)=O)cc2)CC1	ZINC000875097553	HC	On-Demand	Anodyne	P2RY12	61	38
C[C@@H](NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)C(=O)N(C)C	ZINC000875097731	EC	On-Demand	Anodyne	Q6PRC7_IXORI	40	34
N#CCCN1CCN(C(=O)C(=O)NCCc2ccc(N3CCCCC3)cc2)CC1	ZINC000875097803	GD	On-Demand	Mild	CTSK	24	42
N#CCCN1CCN(C(=O)C(=O)NCCc2ccc(N3CCCCC3)cc2)CC1	ZINC000875097803	GD	On-Demand	Mild	CTSL	16	42
O=CN1CCCN(C(=O)NCc2cnn(Cc3ccccc3)c2)CC1	ZINC000875097814	ED	On-Demand	Anodyne	FAAH	16	42
COC(=O)[C@@H]1CCCN1C(=O)C(F)(F)c1cc(F)cc(F)c1	ZINC000875097834	DE	On-Demand	Anodyne	FKBP1A	40	42
COC(=O)[C@@H]1CCCN1C(=O)C(F)(F)c1cc(F)cc(F)c1	ZINC000875097834	DE	On-Demand	Anodyne	CELA1	42	32
COC(=O)[C@@H]1CCCN1C(=O)C(F)(F)c1cc(F)cc(F)c1	ZINC000875097834	DE	On-Demand	Anodyne	WNT3	40	31
COC(=O)[C@@H]1CCCCN1C(=O)c1c(C(F)(F)F)coc1C	ZINC000875097838	DF	On-Demand	Anodyne	WNT3	48	34
COc1cc(NC(=O)[C@H]2C[C@H]2C)c(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)cc1OC	ZINC000875097853	JG	On-Demand	Anodyne	L3MBTL3	41	34
COc1cc(NC(=O)[C@H]2C[C@@H]2C)c(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)cc1OC	ZINC000875097854	JG	On-Demand	Anodyne	L3MBTL3	41	34
COc1cc(NC(=O)[C@@H]2C[C@H]2C)c(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)cc1OC	ZINC000875097856	JG	On-Demand	Anodyne	L3MBTL3	41	34
O=C(NCc1cnn(Cc2ccccc2)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875097907	GH	On-Demand	Anodyne	SIGMAR1	19	40
O=C(NCc1cnn(Cc2ccccc2)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875097907	GH	On-Demand	Anodyne	PREP	38	40
O=C(NCc1cnn(Cc2ccccc2)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875097907	GH	On-Demand	Anodyne	EPHX2	25	43
O=C(NCc1cnn(Cc2ccccc2)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875097908	GH	On-Demand	Anodyne	SIGMAR1	19	40
O=C(NCc1cnn(Cc2ccccc2)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875097908	GH	On-Demand	Anodyne	PREP	38	40
O=C(NCc1cnn(Cc2ccccc2)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875097908	GH	On-Demand	Anodyne	EPHX2	25	43
O=C(NCc1nncn1-c1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875097909	FF	On-Demand	Anodyne	EPHX2	21	41
O=C(NCc1nncn1-c1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875097910	FF	On-Demand	Anodyne	EPHX2	21	41
O=C(NCc1cnn(Cc2ccccc2)c1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875097930	GF	On-Demand	Anodyne	PANC	43	37
O=C(NCc1cnn(Cc2ccccc2)c1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875097931	GF	On-Demand	Anodyne	PANC	43	37
CCCCCCCNC(=O)C(=O)N[C@H]1CCCN(c2ncccn2)C1	ZINC000875097981	ED	On-Demand	Mild	ASAH1	78	33
CCCCCCCNC(=O)C(=O)N[C@@H]1CCCN(c2ncccn2)C1	ZINC000875097982	ED	On-Demand	Mild	ASAH1	78	33
C[C@@H]1CN(C(=O)NCc2cnn(Cc3ccccc3)c2)CC[C@@H](C(F)(F)F)O1	ZINC000875098098	GG	On-Demand	Anodyne	PANC	51	38
C[C@@H]1CN(C(=O)NCc2cnn(Cc3ccccc3)c2)CC[C@H](C(F)(F)F)O1	ZINC000875098099	GG	On-Demand	Anodyne	PANC	51	38
O=C(/C=C\c1ccc(O)cc1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875098105	FF	On-Demand	Anodyne	FABI	43	37
O=C(/C=C\c1ccc(O)cc1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875098105	FF	On-Demand	Anodyne	F3	19	41
O=C(/C=C\c1ccc(O)cc1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875098105	FF	On-Demand	Anodyne	L3MBTL3	54	37
O=C(/C=C/c1ccc(O)cc1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875098106	FF	On-Demand	Anodyne	FABI	43	37
O=C(/C=C/c1ccc(O)cc1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875098106	FF	On-Demand	Anodyne	F3	19	41
O=C(/C=C/c1ccc(O)cc1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875098106	FF	On-Demand	Anodyne	L3MBTL3	54	37
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NC[C@@H]2CCN(C3CC3)C2)[C@@H](O)C1	ZINC000875098116	GD	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NC[C@@H]2CCN(C3CC3)C2)[C@H](O)C1	ZINC000875098117	GD	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NC[C@H]2CCN(C3CC3)C2)[C@@H](O)C1	ZINC000875098118	GD	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NC[C@H]2CCN(C3CC3)C2)[C@H](O)C1	ZINC000875098119	GD	On-Demand	Anodyne	CACNA1I	41	32
NC(=O)CCOC(=O)C1(c2ccccc2)CCC1	ZINC000875098146	BD	On-Demand	Anodyne	SLC12A5	47	33
Cn1nc(Cl)c(C(=O)N2CCC[C@@H]2c2ccc(F)cc2)c1Cl	ZINC000875098213	EH	On-Demand	Anodyne	KCNA5	21	52
Cn1nc(Cl)c(C(=O)N2CCC[C@H]2c2ccc(F)cc2)c1Cl	ZINC000875098214	EH	On-Demand	Anodyne	KCNA5	21	52
COCCN(CC1CCN(C)CC1)C(=O)NCc1cnn(Cc2ccccc2)c1	ZINC000875098215	GE	On-Demand	Anodyne	ACHE	37	41
COCCN(CC1CCN(C)CC1)C(=O)NCc1cnn(Cc2ccccc2)c1	ZINC000875098215	GE	On-Demand	Anodyne	HTR4	32	41
COCCN(CC1CCN(C)CC1)C(=O)NCc1cnn(Cc2ccccc2)c1	ZINC000875098215	GE	On-Demand	Anodyne	SIGMAR1	18	43
COCCN(CC1CCN(C)CC1)C(=O)NCc1cnn(Cc2ccccc2)c1	ZINC000875098215	GE	On-Demand	Anodyne	PANC	47	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cnn(Cc2ccccc2)c1	ZINC000875098222	FE	On-Demand	Anodyne	SLC6A4	26	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cnn(Cc2ccccc2)c1	ZINC000875098222	FE	On-Demand	Anodyne	SLC6A3	53	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cnn(Cc2ccccc2)c1	ZINC000875098222	FE	On-Demand	Anodyne	PANC	48	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cnn(Cc2ccccc2)c1	ZINC000875098223	FE	On-Demand	Anodyne	SLC6A4	26	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cnn(Cc2ccccc2)c1	ZINC000875098223	FE	On-Demand	Anodyne	SLC6A3	53	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cnn(Cc2ccccc2)c1	ZINC000875098223	FE	On-Demand	Anodyne	PANC	48	38
O=C(NCCc1ccc(N2CCCCC2)cc1)C(=O)NCC1CC=CC1	ZINC000875098228	FE	On-Demand	Anodyne	GPBAR1	22	40
O=C(NCCc1ccc(N2CCCCC2)cc1)C(=O)NCC1CC=CC1	ZINC000875098228	FE	On-Demand	Anodyne	L3MBTL3	37	40
COC(=O)[C@@H]1CCCN1C(=O)c1sccc1CC#N	ZINC000875098241	CD	On-Demand	Mild	FKBP1A	45	35
COC(=O)[C@@H]1CCCN1C(=O)c1sccc1CC#N	ZINC000875098241	CD	On-Demand	Mild	PREP	64	36
COC(=O)[C@@H]1CCCN1C(=O)c1sccc1CC#N	ZINC000875098241	CD	On-Demand	Mild	LGMN	71	36
O=C(NC[C@@H]1CCN(C2CC2)C1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875098266	EE	On-Demand	Anodyne	TMPRSS11D	45	32
O=C(NC[C@@H]1CCN(C2CC2)C1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875098267	EE	On-Demand	Anodyne	TMPRSS11D	45	32
O=C(NC[C@@H]1CCN(C2CC2)C1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875098268	EE	On-Demand	Anodyne	TMPRSS11D	45	32
O=C(NC[C@@H]1CCN(C2CC2)C1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875098269	EE	On-Demand	Anodyne	TMPRSS11D	45	32
COC(=O)[C@@H]1CCCN1C(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875098302	FF	On-Demand	Anodyne	FKBP1A	44	36
COC(=O)[C@@H]1CCCN1C(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875098302	FF	On-Demand	Anodyne	PREP	43	59
COC(=O)[C@@H]1CCCN1C(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875098302	FF	On-Demand	Anodyne	SFRP1	42	35
COC(=O)[C@@H]1CCCN1C(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875098302	FF	On-Demand	Anodyne	WNT3	40	34
O=C(NCc1cnn(Cc2ccccc2)c1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875098312	GE	On-Demand	Anodyne	PANC	43	37
O=C(NCc1cnn(Cc2ccccc2)c1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875098314	GE	On-Demand	Anodyne	PANC	43	37
CCN(CC)C(=O)CCCNC(=O)NC1CC(C(=O)OC)C1	ZINC000875098422	DC	On-Demand	Anodyne	EPHX2	24	46
O=C(NCCc1ccc(N2CCCCC2)cc1)C(=O)N[C@H]1CCCn2nccc21	ZINC000875098423	GE	On-Demand	Anodyne	GPBAR1	23	42
O=C(NCCc1ccc(N2CCCCC2)cc1)C(=O)N[C@@H]1CCCn2nccc21	ZINC000875098425	GE	On-Demand	Anodyne	GPBAR1	23	42
CCN1CC[C@H](CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C1	ZINC000875098433	FE	On-Demand	Mild	CCR3	65	47
CCN1CC[C@H](CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C1	ZINC000875098433	FE	On-Demand	Mild	ITK	16	49
CCN1CC[C@H](CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C1	ZINC000875098433	FE	On-Demand	Mild	PANC	54	37
O=C(NC[C@H]1CCN(C2CC2)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875098437	FD	On-Demand	Anodyne	DRD4	28	42
O=C(NC[C@H]1CCN(C2CC2)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875098437	FD	On-Demand	Anodyne	ACHE	33	44
O=C(NC[C@H]1CCN(C2CC2)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875098437	FD	On-Demand	Anodyne	SIGMAR1	37	41
O=C(NC[C@H]1CCN(C2CC2)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875098437	FD	On-Demand	Anodyne	CCR3	29	42
O=C(NC[C@@H]1CCN(C2CC2)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875098438	FD	On-Demand	Anodyne	DRD4	28	42
O=C(NC[C@@H]1CCN(C2CC2)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875098438	FD	On-Demand	Anodyne	ACHE	33	44
O=C(NC[C@@H]1CCN(C2CC2)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875098438	FD	On-Demand	Anodyne	SIGMAR1	37	41
O=C(NC[C@@H]1CCN(C2CC2)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875098438	FD	On-Demand	Anodyne	CCR3	29	42
CC[C@@H]1CCCC[C@@H]1NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875098500	FD	On-Demand	Anodyne	L3MBTL3	42	39
CC[C@H]1CCCC[C@H]1NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875098501	FD	On-Demand	Anodyne	L3MBTL3	42	39
CC[C@@H]1CCCC[C@H]1NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875098502	FD	On-Demand	Anodyne	L3MBTL3	42	39
CC[C@H]1CCCC[C@@H]1NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875098503	FD	On-Demand	Anodyne	L3MBTL3	42	39
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1CCN(CC(F)(F)F)C1	ZINC000875098525	DC	On-Demand	Anodyne	CACNA1I	47	35
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1CCN(CC(F)(F)F)C1	ZINC000875098526	DC	On-Demand	Anodyne	CACNA1I	47	35
COC(=O)[C@@H]1CCCN1C(=O)c1cnn(-c2cccc(F)c2)c1C(F)(F)F	ZINC000875098600	GF	On-Demand	Anodyne	PREP	32	47
CS(=O)(=O)NC1CN(C(=O)NCc2ccc(N3CCCC3)cc2)C1	ZINC000875098645	FC	On-Demand	Clean	NAMPT	33	40
CC[C@H](C[C@H](C)O)NC(=O)NCc1cnn(Cc2ccccc2)c1	ZINC000875098658	EE	On-Demand	Anodyne	ANPEP	20	42
CC[C@H](C[C@H](C)O)NC(=O)NCc1cnn(Cc2ccccc2)c1	ZINC000875098658	EE	On-Demand	Anodyne	PDS	43	34
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1	ZINC000875098661	JI	On-Demand	Bother	L3MBTL3	32	47
O=CN1CCCN(C(=O)NCc2ccc(N3CCCC3)cc2)CC1	ZINC000875098678	ED	On-Demand	Clean	NAMPT	20	40
O=C(NCc1ccc(N2CCCC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875098692	ED	On-Demand	Clean	L3MBTL3	23	40
O=C(NCc1ccc(N2CCCC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875098692	ED	On-Demand	Clean	NAMPT	26	43
O=C(NCCN1CC[C@H](O)C1)NCc1ccc(N2CCCC2)cc1	ZINC000875098712	ED	On-Demand	Clean	SLC6A1	43	32
O=C(NCCN1CC[C@H](O)C1)NCc1ccc(N2CCCC2)cc1	ZINC000875098712	ED	On-Demand	Clean	CCR3	24	44
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc(N2CCCC2)cc1	ZINC000875098713	ED	On-Demand	Clean	SLC6A1	43	32
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc(N2CCCC2)cc1	ZINC000875098713	ED	On-Demand	Clean	CCR3	24	44
COC(=O)[C@@H]1CCCN1C(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875098761	GD	On-Demand	Anodyne	F2	50	38
COC(=O)[C@@H]1CCCN1C(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875098761	GD	On-Demand	Anodyne	ACE	51	47
COC(=O)[C@@H]1CCCN1C(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875098761	GD	On-Demand	Anodyne	FKBP1A	97	48
COC(=O)[C@@H]1CCCN1C(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875098761	GD	On-Demand	Anodyne	CELA1	28	56
COC(=O)[C@@H]1CCCN1C(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875098761	GD	On-Demand	Anodyne	ELANE	32	42
COC(=O)[C@@H]1CCCN1C(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875098761	GD	On-Demand	Anodyne	CTRA_BOVIN	64	35
COC(=O)[C@@H]1CCCN1C(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875098761	GD	On-Demand	Anodyne	TRY1_BOVIN	60	36
COC(=O)[C@@H]1CCCN1C(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875098761	GD	On-Demand	Anodyne	CTSG	44	35
COC(=O)[C@@H]1CCCN1C(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875098761	GD	On-Demand	Anodyne	PREP	111	56
COC(=O)[C@@H]1CCCN1C(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875098761	GD	On-Demand	Anodyne	CELA2A	53	35
COC(=O)[C@@H]1CCCN1C(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875098761	GD	On-Demand	Anodyne	LGMN	84	47
COC(=O)[C@@H]1CCCN1C(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875098761	GD	On-Demand	Anodyne	ACE2	22	42
COC(=O)[C@@H]1CCCN1C(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875098761	GD	On-Demand	Anodyne	KLK5	27	50
COC(=O)[C@@H]1CCCN1C(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875098761	GD	On-Demand	Anodyne	SLC12A5	49	38
COC(=O)[C@@H]1CCCN1C(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875098761	GD	On-Demand	Anodyne	Q9NAW4_PLAFA	37	41
COC(=O)[C@@H]1CCCN1C(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875098761	GD	On-Demand	Anodyne	TMPRSS11D	57	36
COC(=O)[C@@H]1CCCN1C(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875098762	GD	On-Demand	Anodyne	F2	50	38
COC(=O)[C@@H]1CCCN1C(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875098762	GD	On-Demand	Anodyne	ACE	51	47
COC(=O)[C@@H]1CCCN1C(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875098762	GD	On-Demand	Anodyne	FKBP1A	97	48
COC(=O)[C@@H]1CCCN1C(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875098762	GD	On-Demand	Anodyne	CELA1	28	56
COC(=O)[C@@H]1CCCN1C(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875098762	GD	On-Demand	Anodyne	ELANE	32	42
COC(=O)[C@@H]1CCCN1C(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875098762	GD	On-Demand	Anodyne	CTRA_BOVIN	64	35
COC(=O)[C@@H]1CCCN1C(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875098762	GD	On-Demand	Anodyne	TRY1_BOVIN	60	36
COC(=O)[C@@H]1CCCN1C(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875098762	GD	On-Demand	Anodyne	CTSG	44	35
COC(=O)[C@@H]1CCCN1C(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875098762	GD	On-Demand	Anodyne	PREP	111	56
COC(=O)[C@@H]1CCCN1C(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875098762	GD	On-Demand	Anodyne	CELA2A	53	35
COC(=O)[C@@H]1CCCN1C(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875098762	GD	On-Demand	Anodyne	LGMN	84	47
COC(=O)[C@@H]1CCCN1C(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875098762	GD	On-Demand	Anodyne	ACE2	22	42
COC(=O)[C@@H]1CCCN1C(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875098762	GD	On-Demand	Anodyne	KLK5	27	50
COC(=O)[C@@H]1CCCN1C(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875098762	GD	On-Demand	Anodyne	SLC12A5	49	38
COC(=O)[C@@H]1CCCN1C(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875098762	GD	On-Demand	Anodyne	Q9NAW4_PLAFA	37	41
COC(=O)[C@@H]1CCCN1C(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875098762	GD	On-Demand	Anodyne	TMPRSS11D	57	36
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@H]2CCN(C3CC3)C2)CC1	ZINC000875098769	FG	On-Demand	Anodyne	DRD2	18	42
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@H]2CCN(C3CC3)C2)CC1	ZINC000875098769	FG	On-Demand	Anodyne	ADRA1D	16	40
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@H]2CCN(C3CC3)C2)CC1	ZINC000875098769	FG	On-Demand	Anodyne	CCR3	22	44
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@H]2CCN(C3CC3)C2)CC1	ZINC000875098769	FG	On-Demand	Anodyne	EBP	19	40
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@H]2CCN(C3CC3)C2)CC1	ZINC000875098770	FG	On-Demand	Anodyne	DRD2	18	42
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@H]2CCN(C3CC3)C2)CC1	ZINC000875098770	FG	On-Demand	Anodyne	ADRA1D	16	40
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@H]2CCN(C3CC3)C2)CC1	ZINC000875098770	FG	On-Demand	Anodyne	CCR3	22	44
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@H]2CCN(C3CC3)C2)CC1	ZINC000875098770	FG	On-Demand	Anodyne	EBP	19	40
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@@H]2CCN(C3CC3)C2)CC1	ZINC000875098771	FG	On-Demand	Anodyne	DRD2	18	42
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@@H]2CCN(C3CC3)C2)CC1	ZINC000875098771	FG	On-Demand	Anodyne	ADRA1D	16	40
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@@H]2CCN(C3CC3)C2)CC1	ZINC000875098771	FG	On-Demand	Anodyne	CCR3	22	44
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@@H]2CCN(C3CC3)C2)CC1	ZINC000875098771	FG	On-Demand	Anodyne	EBP	19	40
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@@H]2CCN(C3CC3)C2)CC1	ZINC000875098772	FG	On-Demand	Anodyne	DRD2	18	42
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@@H]2CCN(C3CC3)C2)CC1	ZINC000875098772	FG	On-Demand	Anodyne	ADRA1D	16	40
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@@H]2CCN(C3CC3)C2)CC1	ZINC000875098772	FG	On-Demand	Anodyne	CCR3	22	44
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@@H]2CCN(C3CC3)C2)CC1	ZINC000875098772	FG	On-Demand	Anodyne	EBP	19	40
O=C(NC[C@@H]1CCN(c2ccccc2)C1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875098773	GG	On-Demand	Anodyne	F2	26	40
O=C(NC[C@@H]1CCN(c2ccccc2)C1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875098774	GG	On-Demand	Anodyne	F2	26	40
O=C(NC[C@@H]1CCN(c2ccccc2)C1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875098775	GG	On-Demand	Anodyne	F2	26	40
O=C(NC[C@@H]1CCN(c2ccccc2)C1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875098776	GG	On-Demand	Anodyne	F2	26	40
CCN(CC)C(=O)CCCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875098792	GF	On-Demand	Anodyne	FKBP1A	37	40
CCN(CC)C(=O)CCCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875098793	GF	On-Demand	Anodyne	FKBP1A	37	40
CCN(CC)C(=O)CCCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875098794	GF	On-Demand	Anodyne	FKBP1A	37	40
CCN(CC)C(=O)CCCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875098795	GF	On-Demand	Anodyne	FKBP1A	37	40
CCN1CC[C@H](CNC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875098797	FF	On-Demand	Mild	CCR3	33	42
CCN1CC[C@H](CNC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875098797	FF	On-Demand	Mild	MCHR1	33	42
CCN1CC[C@H](CNC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875098797	FF	On-Demand	Mild	CACNA1I	55	36
CCN1CC[C@H](CNC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875098798	FF	On-Demand	Mild	CCR3	33	42
CCN1CC[C@H](CNC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875098798	FF	On-Demand	Mild	MCHR1	33	42
CCN1CC[C@H](CNC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875098798	FF	On-Demand	Mild	CACNA1I	55	36
O=C(NCc1ccc(N2CCCC2)cc1)N1CC[C@H]2CC[C@@H](C1)S2(=O)=O	ZINC000875098876	GE	On-Demand	Clean	L3MBTL3	43	37
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(Oc2ccccn2)cc1	ZINC000875098891	EG	On-Demand	Anodyne	ACACA	44	43
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(Oc2ccccn2)cc1	ZINC000875098891	EG	On-Demand	Anodyne	ACACB	64	51
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(Oc2ccccn2)cc1	ZINC000875098891	EG	On-Demand	Anodyne	CAPNS1	53	33
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(Oc2ccccn2)cc1	ZINC000875098891	EG	On-Demand	Anodyne	CAPN1	56	39
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(Oc2ccccn2)cc1	ZINC000875098891	EG	On-Demand	Anodyne	CAPN2	71	36
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(Oc2ccccn2)cc1	ZINC000875098891	EG	On-Demand	Anodyne	NPR	50	34
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(Oc2ccccn2)cc1	ZINC000875098891	EG	On-Demand	Anodyne	HPN	67	34
O=C(NC[C@H]1C[C@H](O)C1)NCC1(c2ccccc2)CCCCC1	ZINC000875098902	DF	On-Demand	Anodyne	KCNA3	48	39
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(N3CCCC3)cc2)C1	ZINC000875098922	FF	On-Demand	Clean	DPP7	40	35
O=C(N[C@@H]1CCN2CCCC[C@@H]12)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875098973	FD	On-Demand	Anodyne	SLC18A3	38	51
O=C(N[C@@H]1CCN2CCCC[C@H]12)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875098974	FD	On-Demand	Anodyne	SLC18A3	38	51
O=C(N[C@@H]1CCN2CCCC[C@H]12)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875098975	FD	On-Demand	Anodyne	SLC18A3	38	51
O=C(N[C@@H]1CCN2CCCC[C@@H]12)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875098976	FD	On-Demand	Anodyne	SLC18A3	38	51
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)[C@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2	ZINC000875098983	JH	On-Demand	Anodyne	F2	46	46
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)[C@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2	ZINC000875098983	JH	On-Demand	Anodyne	TRY1_BOVIN	34	42
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)[C@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2	ZINC000875098983	JH	On-Demand	Anodyne	PREP	49	51
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)[C@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2	ZINC000875098983	JH	On-Demand	Anodyne	LGMN	43	38
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)[C@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2	ZINC000875098983	JH	On-Demand	Anodyne	EPHX2	15	40
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)[C@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2	ZINC000875098983	JH	On-Demand	Anodyne	L3MBTL3	60	38
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)[C@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2	ZINC000875098983	JH	On-Demand	Anodyne	TMPRSS11D	78	42
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)[C@@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2	ZINC000875098984	JH	On-Demand	Anodyne	F2	46	46
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)[C@@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2	ZINC000875098984	JH	On-Demand	Anodyne	TRY1_BOVIN	34	42
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)[C@@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2	ZINC000875098984	JH	On-Demand	Anodyne	PREP	49	51
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)[C@@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2	ZINC000875098984	JH	On-Demand	Anodyne	LGMN	43	38
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)[C@@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2	ZINC000875098984	JH	On-Demand	Anodyne	EPHX2	15	40
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)[C@@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2	ZINC000875098984	JH	On-Demand	Anodyne	L3MBTL3	60	38
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)[C@@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2	ZINC000875098984	JH	On-Demand	Anodyne	TMPRSS11D	78	42
CCO[C@@H](C(=O)Oc1ccc(Oc2ccccn2)cc1)C(C)C	ZINC000875098992	DH	On-Demand	Anodyne	ACACB	16	41
O=C(NCc1ccc(N2CCCC2)cc1)N1CC(c2ccccc2)C1	ZINC000875099029	EH	On-Demand	Clean	PREP	22	42
O=C(NCc1ccc(N2CCCC2)cc1)N1CC(c2ccccc2)C1	ZINC000875099029	EH	On-Demand	Clean	EPHX2	16	40
O=C(NCc1ccc(N2CCCC2)cc1)N1CC(c2ccccc2)C1	ZINC000875099029	EH	On-Demand	Clean	DPP7	48	38
O=C(NCc1ccc(N2CCCC2)cc1)N1CC(c2ccccc2)C1	ZINC000875099029	EH	On-Demand	Clean	ADAM10	41	34
O=C(NCc1ccc(N2CCCC2)cc1)N1CC(c2ccccc2)C1	ZINC000875099029	EH	On-Demand	Clean	NPSR1	28	42
O=C(NCc1ccc(N2CCCC2)cc1)N1CC(c2ccccc2)C1	ZINC000875099029	EH	On-Demand	Clean	NAMPT	30	46
Cc1nnc(NNC(=O)NCC2(c3ccccc3)CCCCC2)n1C	ZINC000875099071	EF	On-Demand	Reactive	KCNA3	48	39
O=C(NCc1ccc(N2CCCC2)cc1)N1Cc2cccc(O)c2C1	ZINC000875099078	EG	On-Demand	Clean	MAPK1	15	41
O=C(NCc1ccc(N2CCCC2)cc1)N1Cc2cccc(O)c2C1	ZINC000875099078	EG	On-Demand	Clean	NAMPT	28	51
O=C(NCc1ccc(N2CCCC2)cc1)NCc1nc(C2CCOCC2)n[nH]1	ZINC000875099120	GE	On-Demand	Clean	MTOR	22	40
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)N[C@@H]1CCN2CCCC[C@H]12	ZINC000875099122	GD	On-Demand	Anodyne	CPT1A	16	40
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)N[C@H]1CCN2CCCC[C@H]12	ZINC000875099123	GD	On-Demand	Anodyne	CPT1A	16	40
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)N[C@H]1CCN2CCCC[C@@H]12	ZINC000875099124	GD	On-Demand	Anodyne	CPT1A	16	40
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)N[C@@H]1CCN2CCCC[C@@H]12	ZINC000875099125	GD	On-Demand	Anodyne	CPT1A	16	40
CC(C)(C)OC(=O)N1CCN(CCCNC(=O)C(=O)NCC2CC=CC2)CC1	ZINC000875099150	GD	On-Demand	Anodyne	DRD2	19	44
CC(C)(C)OC(=O)N1CCN(CCCNC(=O)C(=O)NCC2CC=CC2)CC1	ZINC000875099150	GD	On-Demand	Anodyne	CACNA1I	46	37
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3CCN4CCCC[C@@H]34)CC2)CC1	ZINC000875099178	GB	On-Demand	Anodyne	L3MBTL3	89	48
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3CCN4CCCC[C@H]34)CC2)CC1	ZINC000875099179	GB	On-Demand	Anodyne	L3MBTL3	89	48
CN1CCN(C2CCN(C(=O)C(=O)N[C@H]3CCN4CCCC[C@@H]34)CC2)CC1	ZINC000875099180	GB	On-Demand	Anodyne	L3MBTL3	89	48
CN1CCN(C2CCN(C(=O)C(=O)N[C@H]3CCN4CCCC[C@H]34)CC2)CC1	ZINC000875099181	GB	On-Demand	Anodyne	L3MBTL3	89	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(N2CCCC2)cc1	ZINC000875099186	FF	On-Demand	Clean	SLC6A3	49	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(N2CCCC2)cc1	ZINC000875099187	FF	On-Demand	Clean	SLC6A3	49	38
Cc1cc(C)c2cc(C(=O)NCc3ccc(C(=O)N4CCCC4)cc3)sc2n1	ZINC000875099210	GI	On-Demand	Anodyne	CHRM4	15	43
Cc1cc(C)c2cc(C(=O)NCc3ccc(C(=O)N4CCCC4)cc3)sc2n1	ZINC000875099210	GI	On-Demand	Anodyne	NAMPT	42	43
O=C(N[C@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H]1CCN2CCCC[C@@H]12	ZINC000875099215	GE	On-Demand	Anodyne	CHRNA7	48	38
O=C(N[C@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H]1CCN2CCCC[C@@H]12	ZINC000875099215	GE	On-Demand	Anodyne	C3AR1	44	43
O=C(N[C@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H]1CCN2CCCC[C@H]12	ZINC000875099216	GE	On-Demand	Anodyne	CHRNA7	48	38
O=C(N[C@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H]1CCN2CCCC[C@H]12	ZINC000875099216	GE	On-Demand	Anodyne	C3AR1	44	43
O=C(N[C@H]1CCN2CCCC[C@H]12)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875099217	GE	On-Demand	Anodyne	CHRNA7	48	38
O=C(N[C@H]1CCN2CCCC[C@H]12)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875099217	GE	On-Demand	Anodyne	C3AR1	44	43
O=C(N[C@H]1CCN2CCCC[C@@H]12)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875099218	GE	On-Demand	Anodyne	CHRNA7	48	38
O=C(N[C@H]1CCN2CCCC[C@@H]12)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875099218	GE	On-Demand	Anodyne	C3AR1	44	43
Cn1cc(CCNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cn1	ZINC000875099237	ED	On-Demand	Anodyne	PREP	59	37
Cn1cc(CCNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cn1	ZINC000875099238	ED	On-Demand	Anodyne	PREP	59	37
Cn1cc(CCNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cn1	ZINC000875099239	ED	On-Demand	Anodyne	PREP	59	37
Cn1cc(CCNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cn1	ZINC000875099240	ED	On-Demand	Anodyne	PREP	59	37
O=C(NCc1ccc(N2CCCC2)cc1)N1CCc2nc(C3CC3)ncc2C1	ZINC000875099247	GG	On-Demand	Clean	MAPK1	18	46
O=C(NCc1ccc(N2CCCC2)cc1)N1CCc2nc(C3CC3)ncc2C1	ZINC000875099247	GG	On-Demand	Clean	NAMPT	28	42
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H](C)c1cc(F)ccc1OC	ZINC000875099267	GF	On-Demand	Anodyne	ACKR3	68	36
COCCN(CC1CCN(C)CC1)C(=O)N[C@H](C)c1cc(F)ccc1OC	ZINC000875099268	GF	On-Demand	Anodyne	ACKR3	68	36
O=C(NCc1ccc(N2CCCC2)cc1)N1C[C@H](O)C[C@H]1C1CC1	ZINC000875099274	EE	On-Demand	Clean	VHL	42	36
O=C(NCc1ccc(N2CCCC2)cc1)N1C[C@H](O)C[C@@H]1C1CC1	ZINC000875099275	EE	On-Demand	Clean	VHL	42	36
O=C(NCc1ccc(N2CCCC2)cc1)N1C[C@@H](O)C[C@H]1C1CC1	ZINC000875099276	EE	On-Demand	Clean	VHL	42	36
O=C(NCc1ccc(N2CCCC2)cc1)N1C[C@@H](O)C[C@@H]1C1CC1	ZINC000875099277	EE	On-Demand	Clean	VHL	42	36
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)[C@@H]1CSCCS1	ZINC000875099293	FE	On-Demand	Anodyne	L3MBTL3	71	39
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)[C@H]1CSCCS1	ZINC000875099294	FE	On-Demand	Anodyne	L3MBTL3	71	39
CC(C)(C)OC(=O)N1CCN(CCNC(=O)C(=O)NCC2CC=CC2)CC1	ZINC000875099299	GC	On-Demand	Anodyne	CACNA1I	52	38
CC(=O)N1CCC[C@@H]1C(=O)Oc1ccc(Oc2ccccn2)cc1	ZINC000875099310	EF	On-Demand	Anodyne	FKBP1A	43	41
CC(=O)N1CCC[C@@H]1C(=O)Oc1ccc(Oc2ccccn2)cc1	ZINC000875099310	EF	On-Demand	Anodyne	PREP	53	37
O=C(NCc1ccc(N2CCCC2)cc1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875099338	GG	On-Demand	Clean	NAMPT	30	46
O=C(NCCO)C1CCN(C(=O)NCc2ccc(N3CCCC3)cc2)CC1	ZINC000875099339	FD	On-Demand	Clean	EPHX2	21	47
O=C(NCc1ccc(N2CCCC2)cc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875099344	FH	On-Demand	Clean	EPHX2	22	42
O=C(NCc1ccc(N2CCCC2)cc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875099345	FH	On-Demand	Clean	EPHX2	22	42
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)N[C@H]1CCN2CCCC[C@@H]12	ZINC000875099352	FD	On-Demand	Anodyne	SLC18A3	49	39
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)N[C@H]1CCN2CCCC[C@H]12	ZINC000875099353	FD	On-Demand	Anodyne	SLC18A3	49	39
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)N[C@@H]1CCN2CCCC[C@H]12	ZINC000875099354	FD	On-Demand	Anodyne	SLC18A3	49	39
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)N[C@@H]1CCN2CCCC[C@@H]12	ZINC000875099355	FD	On-Demand	Anodyne	SLC18A3	49	39
O=C(NCc1ccc(Br)s1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875099365	GI	On-Demand	Anodyne	EPHX2	19	40
O=C(NCc1ccc(Br)s1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875099366	GI	On-Demand	Anodyne	EPHX2	19	40
CN1CCN(C2CCN(C(=O)N[C@@H]3C[C@H]4C[C@H]3[C@H]3CCC[C@@H]34)CC2)CC1	ZINC000875099398	FE	On-Demand	Anodyne	L3MBTL3	43	39
CN1CCN(C2CCN(C(=O)N[C@@H]3C[C@H]4C[C@H]3[C@@H]3CCC[C@@H]43)CC2)CC1	ZINC000875099399	FE	On-Demand	Anodyne	L3MBTL3	43	39
CN1CCN(C2CCN(C(=O)N[C@@H]3C[C@H]4C[C@H]3[C@H]3CCC[C@H]34)CC2)CC1	ZINC000875099400	FE	On-Demand	Anodyne	L3MBTL3	43	39
CN1CCN(C2CCN(C(=O)N[C@@H]3C[C@H]4C[C@H]3[C@@H]3CCC[C@H]43)CC2)CC1	ZINC000875099401	FE	On-Demand	Anodyne	L3MBTL3	43	39
NC(=O)CCOC(=O)COc1ccc(N2CCCC2=O)cc1	ZINC000875099410	DC	On-Demand	Anodyne	PLA2G4B	41	32
O=C(NCc1ccc(N2CCCC2)cc1)N1CC=CC1	ZINC000875099490	CE	On-Demand	Clean	NAMPT	32	42
C[C@@]1(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)Cc2ccccc2C(=O)O1	ZINC000875099504	GF	On-Demand	Anodyne	AVPR2	23	40
C[C@@]1(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)Cc2ccccc2C(=O)O1	ZINC000875099504	GF	On-Demand	Anodyne	L3MBTL3	44	34
C[C@@]1(CO)CN(C(=O)NCc2ccc(N3CCCC3)cc2)C[C@]1(C)CO	ZINC000875099546	FD	On-Demand	Clean	NAMPT	34	41
O=C(NCC1(c2ccccc2)CCCCC1)N1CCC(CO)(CO)CC1	ZINC000875099551	FF	On-Demand	Anodyne	KCNA3	46	38
O=C(NCC1(c2ccccc2)CCCCC1)N1CCC(CO)(CO)CC1	ZINC000875099551	FF	On-Demand	Anodyne	EPHX2	15	42
O=C(NCC1(c2ccccc2)CCCCC1)N1CCC(CO)(CO)CC1	ZINC000875099551	FF	On-Demand	Anodyne	SMO	15	48
O=C(NCC1(c2ccccc2)CCCCC1)N1CCC(CO)(CO)CC1	ZINC000875099551	FF	On-Demand	Anodyne	NPFFR1	17	41
O=C(NCC1(c2ccccc2)CCCCC1)N1CCC(CO)(CO)CC1	ZINC000875099551	FF	On-Demand	Anodyne	HCN1	49	30
O=C(NCC1(c2ccccc2)CCCCC1)N1CCC(CO)(CO)CC1	ZINC000875099551	FF	On-Demand	Anodyne	HCN4	46	30
O=C(NCc1ccc(N2CCCC2)cc1)N1OC2CCC1CC2	ZINC000875099556	DG	On-Demand	Clean	L3MBTL3	44	38
O=CN1CCCN(C(=O)NCC2(c3ccccc3)CCCCC2)CC1	ZINC000875099577	EF	On-Demand	Anodyne	KCNA3	45	36
O=CN1CCCN(C(=O)NCC2(c3ccccc3)CCCCC2)CC1	ZINC000875099577	EF	On-Demand	Anodyne	SMO	16	46
O=C(Oc1ccc(Oc2ccccn2)cc1)C1(F)CCOCC1	ZINC000875099585	DG	On-Demand	Anodyne	LIPE	19	40
COCCN(CCOC)C(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875099593	FF	On-Demand	Anodyne	HSD17B2	16	40
CS(=O)(=O)N[C@@H]1CCCC[C@H]1NC(=O)NCc1ccc(N2CCCC2)cc1	ZINC000875099653	GD	On-Demand	Clean	NAMPT	48	37
O=C(NCc1ccc(N2CCCC2)cc1)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875099664	FE	On-Demand	Clean	L3MBTL3	67	38
O=C(NCc1ccc(N2CCCC2)cc1)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875099665	FE	On-Demand	Clean	L3MBTL3	67	38
O=C(NCC[C@@H](O)COCc1ccccc1)NCc1ccc(N2CCCC2)cc1	ZINC000875099672	GG	On-Demand	Clean	SLC12A5	41	31
Cc1n[nH]c(C)c1CC(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875099719	EE	On-Demand	Anodyne	P2RX7	33	65
Cc1n[nH]c(C)c1CC(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875099719	EE	On-Demand	Anodyne	L3MBTL3	52	34
Cc1n[nH]c(C)c1CC(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875099719	EE	On-Demand	Anodyne	NAMPT	17	40
NC(=O)CCOC(=O)CCc1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000875099724	FC	On-Demand	Anodyne	TGM2	46	38
NC(=O)CCOC(=O)CCc1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000875099724	FC	On-Demand	Anodyne	F13A1	57	40
NC(=O)CCOC(=O)CCc1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000875099724	FC	On-Demand	Anodyne	NAMPT	32	40
COC(=O)N(C)NC(=O)NCC1(c2ccccc2)CCCCC1	ZINC000875099729	DF	On-Demand	Reactive	KCNA3	54	44
COC(=O)N(C)NC(=O)NCC1(c2ccccc2)CCCCC1	ZINC000875099729	DF	On-Demand	Reactive	NMBR	46	36
COC(=O)N(C)NC(=O)NCC1(c2ccccc2)CCCCC1	ZINC000875099729	DF	On-Demand	Reactive	HCN1	50	31
COC(=O)N(C)NC(=O)NCC1(c2ccccc2)CCCCC1	ZINC000875099729	DF	On-Demand	Reactive	HCN4	48	31
O=C(NCCO)C1CCN(C(=O)NCC2(c3ccccc3)CCCCC2)CC1	ZINC000875099759	GE	On-Demand	Anodyne	KCNA3	47	42
O=C(NCCO)C1CCN(C(=O)NCC2(c3ccccc3)CCCCC2)CC1	ZINC000875099759	GE	On-Demand	Anodyne	EPHX2	25	41
O=C(NCCO)C1CCN(C(=O)NCC2(c3ccccc3)CCCCC2)CC1	ZINC000875099759	GE	On-Demand	Anodyne	CACNA1G	23	55
O=C(NCCO)C1CCN(C(=O)NCC2(c3ccccc3)CCCCC2)CC1	ZINC000875099759	GE	On-Demand	Anodyne	SMO	17	49
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(N2CCCC2)cc1	ZINC000875099804	DF	On-Demand	Clean	ANPEP	15	40
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(N2CCCC2)cc1	ZINC000875099804	DF	On-Demand	Clean	KCNQ2	24	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cc(F)ccc1OC	ZINC000875099822	FF	On-Demand	Anodyne	SLC6A4	20	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cc(F)ccc1OC	ZINC000875099822	FF	On-Demand	Anodyne	SLC6A3	43	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cc(F)ccc1OC	ZINC000875099823	FF	On-Demand	Anodyne	SLC6A4	20	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cc(F)ccc1OC	ZINC000875099823	FF	On-Demand	Anodyne	SLC6A3	43	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cc(F)ccc1OC	ZINC000875099824	FF	On-Demand	Anodyne	SLC6A4	20	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cc(F)ccc1OC	ZINC000875099824	FF	On-Demand	Anodyne	SLC6A3	43	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cc(F)ccc1OC	ZINC000875099825	FF	On-Demand	Anodyne	SLC6A4	20	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cc(F)ccc1OC	ZINC000875099825	FF	On-Demand	Anodyne	SLC6A3	43	43
CCCCCOc1ccc(C(=O)CCC(=O)N(C)OC)cc1	ZINC000875099879	DG	On-Demand	Anodyne	PLA2G4A	29	48
CCCCCOc1ccc(C(=O)CCC(=O)N(C)OC)cc1	ZINC000875099879	DG	On-Demand	Anodyne	PLA2G4B	109	48
CCCCCOc1ccc(C(=O)CCC(=O)N(C)OC)cc1	ZINC000875099879	DG	On-Demand	Anodyne	ESRRG	42	31
CCCCCOc1ccc(C(=O)CCC(=O)N(C)OC)cc1	ZINC000875099879	DG	On-Demand	Anodyne	ACR	16	41
O=C(Nc1nc2cc(C(F)(F)F)ccc2s1)C1(F)CCOCC1	ZINC000875099883	EH	On-Demand	Anodyne	CSNK1D	36	47
O=C(NCCc1cnccn1)C(=O)N1CC[C@@H](Oc2cccc(Cl)c2)C1	ZINC000875099886	FD	On-Demand	Anodyne	CCR3	27	40
O=CN1CCCN(C(=O)NCC2(N3CCSCC3)CCCC2)CC1	ZINC000875099906	FD	On-Demand	Anodyne	HCN1	50	31
O=CN1CCCN(C(=O)NCC2(N3CCSCC3)CCCC2)CC1	ZINC000875099906	FD	On-Demand	Anodyne	HCN4	48	31
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875099919	FE	On-Demand	Anodyne	CHRM2	21	44
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875099919	FE	On-Demand	Anodyne	CHRM1	24	46
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875099919	FE	On-Demand	Anodyne	ACE	52	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875099919	FE	On-Demand	Anodyne	DRD2	20	48
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875099919	FE	On-Demand	Anodyne	DRD4	40	51
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875099919	FE	On-Demand	Anodyne	SLC6A1	76	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875099919	FE	On-Demand	Anodyne	CHRM3	24	44
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875099919	FE	On-Demand	Anodyne	SIGMAR1	39	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875099919	FE	On-Demand	Anodyne	SSTR5	48	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875099919	FE	On-Demand	Anodyne	CCR3	30	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875099919	FE	On-Demand	Anodyne	CCR2	16	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875099919	FE	On-Demand	Anodyne	MCHR1	19	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875099919	FE	On-Demand	Anodyne	BIRC2	53	53
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875099922	FE	On-Demand	Anodyne	CHRM2	21	44
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875099922	FE	On-Demand	Anodyne	CHRM1	24	46
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875099922	FE	On-Demand	Anodyne	ACE	52	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875099922	FE	On-Demand	Anodyne	DRD2	20	48
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875099922	FE	On-Demand	Anodyne	DRD4	40	51
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875099922	FE	On-Demand	Anodyne	SLC6A1	76	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875099922	FE	On-Demand	Anodyne	CHRM3	24	44
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875099922	FE	On-Demand	Anodyne	SIGMAR1	39	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875099922	FE	On-Demand	Anodyne	SSTR5	48	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875099922	FE	On-Demand	Anodyne	CCR3	30	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875099922	FE	On-Demand	Anodyne	CCR2	16	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875099922	FE	On-Demand	Anodyne	MCHR1	19	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875099922	FE	On-Demand	Anodyne	BIRC2	53	53
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875099924	FD	On-Demand	Anodyne	CHRM2	19	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875099924	FD	On-Demand	Anodyne	CHRM1	15	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875099924	FD	On-Demand	Anodyne	DRD2	15	50
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875099924	FD	On-Demand	Anodyne	DRD4	39	50
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875099924	FD	On-Demand	Anodyne	ACHE	30	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875099924	FD	On-Demand	Anodyne	SLC6A1	72	34
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875099924	FD	On-Demand	Anodyne	CHRM3	21	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875099924	FD	On-Demand	Anodyne	SIGMAR1	58	47
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875099924	FD	On-Demand	Anodyne	CCR3	36	51
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875099924	FD	On-Demand	Anodyne	NPFFR2	31	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875099924	FD	On-Demand	Anodyne	CCR2	17	45
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875099924	FD	On-Demand	Anodyne	EPHX2	28	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875099924	FD	On-Demand	Anodyne	MCHR1	18	47
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875099924	FD	On-Demand	Anodyne	BIRC2	42	48
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875099924	FD	On-Demand	Anodyne	NPFFR1	41	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875099925	FD	On-Demand	Anodyne	CHRM2	19	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875099925	FD	On-Demand	Anodyne	CHRM1	15	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875099925	FD	On-Demand	Anodyne	DRD2	15	50
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875099925	FD	On-Demand	Anodyne	DRD4	39	50
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875099925	FD	On-Demand	Anodyne	ACHE	30	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875099925	FD	On-Demand	Anodyne	SLC6A1	72	34
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875099925	FD	On-Demand	Anodyne	CHRM3	21	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875099925	FD	On-Demand	Anodyne	SIGMAR1	58	47
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875099925	FD	On-Demand	Anodyne	CCR3	36	51
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875099925	FD	On-Demand	Anodyne	NPFFR2	31	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875099925	FD	On-Demand	Anodyne	CCR2	17	45
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875099925	FD	On-Demand	Anodyne	EPHX2	28	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875099925	FD	On-Demand	Anodyne	MCHR1	18	47
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875099925	FD	On-Demand	Anodyne	BIRC2	42	48
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875099925	FD	On-Demand	Anodyne	NPFFR1	41	40
C#CC[C@H](CCOC)NC(=O)NCCNc1nc2ccccc2s1	ZINC000875099932	EE	On-Demand	Mild	TMPRSS6	50	33
C#CC[C@@H](CCOC)NC(=O)NCCNc1nc2ccccc2s1	ZINC000875099933	EE	On-Demand	Mild	TMPRSS6	50	33
Cc1nnc(NNC(=O)NCC2(N3CCSCC3)CCCC2)n1C	ZINC000875099939	FD	On-Demand	Reactive	HCN1	55	35
Cc1nnc(NNC(=O)NCC2(N3CCSCC3)CCCC2)n1C	ZINC000875099939	FD	On-Demand	Reactive	HCN4	52	35
COC(=O)C1(O)CN(C(=O)NCC2(N3CCSCC3)CCCC2)C1	ZINC000875099940	FC	On-Demand	Anodyne	HCN1	53	34
COC(=O)C1(O)CN(C(=O)NCC2(N3CCSCC3)CCCC2)C1	ZINC000875099940	FC	On-Demand	Anodyne	HCN4	51	34
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCc1cnccn1)CC2	ZINC000875099950	GD	On-Demand	Anodyne	SLC18A2	46	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCc1cnccn1)CC2	ZINC000875099951	GD	On-Demand	Anodyne	SLC18A2	46	34
O=CN1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875099961	ED	On-Demand	Anodyne	CHRM2	15	40
O=CN1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875099961	ED	On-Demand	Anodyne	DRD4	36	49
O=CN1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875099961	ED	On-Demand	Anodyne	SLC6A1	101	35
O=CN1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875099961	ED	On-Demand	Anodyne	CHRM3	17	40
O=CN1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875099961	ED	On-Demand	Anodyne	SIGMAR1	45	46
O=CN1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875099961	ED	On-Demand	Anodyne	CCR3	34	55
O=CN1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875099961	ED	On-Demand	Anodyne	FAAH	18	40
O=CN1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875099961	ED	On-Demand	Anodyne	CCR2	19	47
O=CN1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875099961	ED	On-Demand	Anodyne	EPHX2	18	42
O=CN1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875099961	ED	On-Demand	Anodyne	BIRC2	42	48
O=CN1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875099962	ED	On-Demand	Anodyne	CHRM2	15	40
O=CN1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875099962	ED	On-Demand	Anodyne	DRD4	36	49
O=CN1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875099962	ED	On-Demand	Anodyne	SLC6A1	101	35
O=CN1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875099962	ED	On-Demand	Anodyne	CHRM3	17	40
O=CN1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875099962	ED	On-Demand	Anodyne	SIGMAR1	45	46
O=CN1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875099962	ED	On-Demand	Anodyne	CCR3	34	55
O=CN1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875099962	ED	On-Demand	Anodyne	FAAH	18	40
O=CN1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875099962	ED	On-Demand	Anodyne	CCR2	19	47
O=CN1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875099962	ED	On-Demand	Anodyne	EPHX2	18	42
O=CN1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875099962	ED	On-Demand	Anodyne	BIRC2	42	48
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)C(=O)NCCc1cnccn1	ZINC000875099964	GF	On-Demand	Anodyne	MDM2	42	32
CN1CC[C@H]2CN(C(=O)NCC3(N4CCSCC4)CCCC3)CC[C@H]21	ZINC000875099975	FE	On-Demand	Anodyne	HCN1	55	34
CN1CC[C@H]2CN(C(=O)NCC3(N4CCSCC4)CCCC3)CC[C@H]21	ZINC000875099975	FE	On-Demand	Anodyne	HCN4	53	34
CN1CC[C@H]2CN(C(=O)NCC3(N4CCSCC4)CCCC3)CC[C@@H]21	ZINC000875099977	FE	On-Demand	Anodyne	HCN1	55	34
CN1CC[C@H]2CN(C(=O)NCC3(N4CCSCC4)CCCC3)CC[C@@H]21	ZINC000875099977	FE	On-Demand	Anodyne	HCN4	53	34
O=C(NCCc1cnccn1)C(=O)N[C@H]1CCCCCN(Cc2ccccc2)C1	ZINC000875100011	GD	On-Demand	Anodyne	DRD2	15	45
O=C(NCCc1cnccn1)C(=O)N[C@H]1CCCCCN(Cc2ccccc2)C1	ZINC000875100011	GD	On-Demand	Anodyne	DRD4	33	45
O=C(NCCc1cnccn1)C(=O)N[C@H]1CCCCCN(Cc2ccccc2)C1	ZINC000875100011	GD	On-Demand	Anodyne	ACHE	19	41
O=C(NCCc1cnccn1)C(=O)N[C@H]1CCCCCN(Cc2ccccc2)C1	ZINC000875100011	GD	On-Demand	Anodyne	HRH2	39	42
O=C(NCCc1cnccn1)C(=O)N[C@H]1CCCCCN(Cc2ccccc2)C1	ZINC000875100011	GD	On-Demand	Anodyne	HRH3	17	42
O=C(NCCc1cnccn1)C(=O)N[C@H]1CCCCCN(Cc2ccccc2)C1	ZINC000875100011	GD	On-Demand	Anodyne	SIGMAR1	29	47
O=C(NCCc1cnccn1)C(=O)N[C@H]1CCCCCN(Cc2ccccc2)C1	ZINC000875100011	GD	On-Demand	Anodyne	BIRC2	34	48
O=C(NCCc1cnccn1)C(=O)N[C@@H]1CCCCCN(Cc2ccccc2)C1	ZINC000875100012	GD	On-Demand	Anodyne	DRD2	15	45
O=C(NCCc1cnccn1)C(=O)N[C@@H]1CCCCCN(Cc2ccccc2)C1	ZINC000875100012	GD	On-Demand	Anodyne	DRD4	33	45
O=C(NCCc1cnccn1)C(=O)N[C@@H]1CCCCCN(Cc2ccccc2)C1	ZINC000875100012	GD	On-Demand	Anodyne	ACHE	19	41
O=C(NCCc1cnccn1)C(=O)N[C@@H]1CCCCCN(Cc2ccccc2)C1	ZINC000875100012	GD	On-Demand	Anodyne	HRH2	39	42
O=C(NCCc1cnccn1)C(=O)N[C@@H]1CCCCCN(Cc2ccccc2)C1	ZINC000875100012	GD	On-Demand	Anodyne	HRH3	17	42
O=C(NCCc1cnccn1)C(=O)N[C@@H]1CCCCCN(Cc2ccccc2)C1	ZINC000875100012	GD	On-Demand	Anodyne	SIGMAR1	29	47
O=C(NCCc1cnccn1)C(=O)N[C@@H]1CCCCCN(Cc2ccccc2)C1	ZINC000875100012	GD	On-Demand	Anodyne	BIRC2	34	48
O=C(Nc1nc2cc(Cl)ccc2s1)C1(F)CCOCC1	ZINC000875100027	DG	On-Demand	Anodyne	CSNK1D	27	40
COC(=O)C1(O)CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875100028	EC	On-Demand	Anodyne	DRD2	22	51
COC(=O)C1(O)CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875100028	EC	On-Demand	Anodyne	DRD4	43	53
COC(=O)C1(O)CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875100028	EC	On-Demand	Anodyne	ACHE	29	40
COC(=O)C1(O)CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875100028	EC	On-Demand	Anodyne	SLC6A1	73	33
COC(=O)C1(O)CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875100028	EC	On-Demand	Anodyne	DRD3	15	51
COC(=O)C1(O)CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875100028	EC	On-Demand	Anodyne	LTA4H	31	42
COC(=O)C1(O)CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875100028	EC	On-Demand	Anodyne	SIGMAR1	55	48
COC(=O)C1(O)CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875100028	EC	On-Demand	Anodyne	CCR3	37	43
COC(=O)C1(O)CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875100028	EC	On-Demand	Anodyne	CCR2	15	41
COC(=O)C1(O)CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875100028	EC	On-Demand	Anodyne	EPHX2	17	40
COC(=O)C1(O)CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875100028	EC	On-Demand	Anodyne	MCHR1	22	44
COC(=O)C1(O)CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875100028	EC	On-Demand	Anodyne	BIRC2	42	48
COC(=O)C1(O)CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875100028	EC	On-Demand	Anodyne	SLC12A5	52	35
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875100029	EC	On-Demand	Anodyne	DRD2	22	51
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875100029	EC	On-Demand	Anodyne	DRD4	43	53
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875100029	EC	On-Demand	Anodyne	ACHE	29	40
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875100029	EC	On-Demand	Anodyne	SLC6A1	73	33
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875100029	EC	On-Demand	Anodyne	DRD3	15	51
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875100029	EC	On-Demand	Anodyne	LTA4H	31	42
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875100029	EC	On-Demand	Anodyne	SIGMAR1	55	48
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875100029	EC	On-Demand	Anodyne	CCR3	37	43
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875100029	EC	On-Demand	Anodyne	CCR2	15	41
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875100029	EC	On-Demand	Anodyne	EPHX2	17	40
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875100029	EC	On-Demand	Anodyne	MCHR1	22	44
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875100029	EC	On-Demand	Anodyne	BIRC2	42	48
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875100029	EC	On-Demand	Anodyne	SLC12A5	52	35
O=C(CCCOC1CCOCC1)Nc1nc2cc(C(F)(F)F)ccc2s1	ZINC000875100034	GI	On-Demand	Anodyne	CSNK1D	48	50
C[C@H](NC(=O)C(=O)NCCCCC1CC1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000875100050	GF	On-Demand	Anodyne	EPHX2	44	39
C[C@H](NC(=O)C(=O)NCCCCC1CC1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000875100050	GF	On-Demand	Anodyne	F7	22	42
C[C@@H](NC(=O)NCCNc1nc2ccccc2s1)c1ccns1	ZINC000875100056	EG	On-Demand	Anodyne	CSNK1D	19	40
C[C@@H](NC(=O)NCCNc1nc2ccccc2s1)c1ccns1	ZINC000875100056	EG	On-Demand	Anodyne	ST14	40	35
C[C@@H](NC(=O)NCCNc1nc2ccccc2s1)c1ccns1	ZINC000875100056	EG	On-Demand	Anodyne	TMPRSS6	57	35
CON(C)C(=O)c1ccccc1SCC(=O)Nc1cccc(C#N)c1	ZINC000875100057	FF	On-Demand	Mild	MCHR1	21	41
CON(C)C(=O)c1ccccc1SCC(=O)Nc1cccc(C#N)c1	ZINC000875100057	FF	On-Demand	Mild	ENPP1	55	31
CON(C)C(=O)c1ccccc1SCC(=O)Nc1cccc(C#N)c1	ZINC000875100057	FF	On-Demand	Mild	FAS	43	35
O=C(NCCc1cnccn1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875100063	FD	On-Demand	Anodyne	C3AR1	39	42
O=C(NCCc1cnccn1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875100064	FD	On-Demand	Anodyne	C3AR1	39	42
COCCN(CC1CCN(C)CC1)C(=O)NCCOc1ccc(F)cc1	ZINC000875100075	FE	On-Demand	Anodyne	ACKR3	46	34
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875100088	ED	On-Demand	Anodyne	DRD4	39	47
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875100088	ED	On-Demand	Anodyne	ACHE	20	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875100088	ED	On-Demand	Anodyne	SLC6A1	54	32
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875100088	ED	On-Demand	Anodyne	SIGMAR1	41	45
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875100088	ED	On-Demand	Anodyne	CCR3	34	44
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875100088	ED	On-Demand	Anodyne	MCHR1	21	48
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875100088	ED	On-Demand	Anodyne	BIRC2	39	46
O=C(CCCOC1CCOCC1)Nc1nc2cc(Cl)ccc2s1	ZINC000875100092	FH	On-Demand	Anodyne	CSNK1D	42	42
O=C(CCCOC1CCOCC1)Nc1nc2cc(Cl)ccc2s1	ZINC000875100092	FH	On-Demand	Anodyne	MAPK1	46	33
O=C1CC[C@H](C(=O)Nc2nc3cc(C(F)(F)F)ccc3s2)O1	ZINC000875100093	EF	On-Demand	Anodyne	CSNK1D	35	44
C#CC[C@H](COC)NC(=O)NCCNc1nc2ccccc2s1	ZINC000875100098	EE	On-Demand	Mild	TMPRSS6	44	32
C#CC[C@@H](COC)NC(=O)NCCNc1nc2ccccc2s1	ZINC000875100099	EE	On-Demand	Mild	TMPRSS6	44	32
O=C(NCCO)C1CCN(C(=O)NCCOc2ccc(F)cc2)CC1	ZINC000875100100	FC	On-Demand	Anodyne	EPHX2	18	45
O=C(NCCO)C1CCN(C(=O)NCCOc2ccc(F)cc2)CC1	ZINC000875100100	FC	On-Demand	Anodyne	CACNA1G	37	44
O=C(NCCc1cnccn1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875100112	GD	On-Demand	Anodyne	DRD2	21	42
O=C(NCCc1cnccn1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875100112	GD	On-Demand	Anodyne	DRD4	42	43
O=C(NCCc1cnccn1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875100112	GD	On-Demand	Anodyne	ACHE	61	64
O=C(NCCc1cnccn1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875100112	GD	On-Demand	Anodyne	DRD3	17	42
O=C(NCCc1cnccn1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875100112	GD	On-Demand	Anodyne	GRIN2B	29	41
O=C(NCCc1cnccn1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875100112	GD	On-Demand	Anodyne	SIGMAR1	54	47
O=C(NCCc1cnccn1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875100112	GD	On-Demand	Anodyne	SSTR5	40	36
O=C(NCCc1cnccn1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875100112	GD	On-Demand	Anodyne	FAAH	20	48
O=C(NCCc1cnccn1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875100112	GD	On-Demand	Anodyne	CXCR3	18	42
O=C(NCCc1cnccn1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875100112	GD	On-Demand	Anodyne	MCHR1	23	42
O=C(NCCOc1ccc(F)cc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875100113	FF	On-Demand	Anodyne	EPHX2	21	40
O=C(NCCOc1ccc(F)cc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875100114	FF	On-Demand	Anodyne	EPHX2	21	40
COC(=O)[C@@]12C[C@@H](NC(=O)NCC3(N4CCSCC4)CCCC3)C[C@@H]1C2	ZINC000875100167	GD	On-Demand	Anodyne	HCN1	54	34
COC(=O)[C@@]12C[C@@H](NC(=O)NCC3(N4CCSCC4)CCCC3)C[C@@H]1C2	ZINC000875100167	GD	On-Demand	Anodyne	HCN4	52	34
CON(C)C(=O)c1ccccc1SCC(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O	ZINC000875100170	IF	On-Demand	Anodyne	FPR2	41	45
CCn1ncc(CNC(=O)NCCNc2nc3ccccc3s2)n1	ZINC000875100173	ED	On-Demand	Anodyne	BCL2L1	15	40
CCn1ncc(CNC(=O)NCCNc2nc3ccccc3s2)n1	ZINC000875100173	ED	On-Demand	Anodyne	TMPRSS6	44	30
NC(=O)[C@@H]1CC[C@H](CCC(=O)Nc2nc3cc(C(F)(F)F)ccc3s2)O1	ZINC000875100184	GG	On-Demand	Anodyne	CSNK1D	43	50
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCc1cnccn1	ZINC000875100187	ED	On-Demand	Anodyne	CAPN1	22	43
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCc1cnccn1	ZINC000875100187	ED	On-Demand	Anodyne	CAPN2	48	43
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCc1cnccn1	ZINC000875100187	ED	On-Demand	Anodyne	AMP1_PLAFQ	40	42
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCc1cnccn1	ZINC000875100188	ED	On-Demand	Anodyne	CAPN1	22	43
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCc1cnccn1	ZINC000875100188	ED	On-Demand	Anodyne	CAPN2	48	43
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCc1cnccn1	ZINC000875100188	ED	On-Demand	Anodyne	AMP1_PLAFQ	40	42
CC[C@@H]1COCCN1CCNC(=O)NCCOc1ccc(F)cc1	ZINC000875100191	ED	On-Demand	Anodyne	EPHX2	18	42
CCOC(=O)c1cc(CNC(=O)NCC2(N3CCSCC3)CCCC2)on1	ZINC000875100205	GE	On-Demand	Anodyne	HCN1	71	39
CCOC(=O)c1cc(CNC(=O)NCC2(N3CCSCC3)CCCC2)on1	ZINC000875100205	GE	On-Demand	Anodyne	HCN4	58	38
O=C(NCCC[C@@H]1CCOC1=O)NCCNc1nc2ccccc2s1	ZINC000875100210	FE	On-Demand	Anodyne	TMPRSS6	47	30
O=C(NCCC[C@H]1CCOC1=O)NCCNc1nc2ccccc2s1	ZINC000875100211	FE	On-Demand	Anodyne	TMPRSS6	47	30
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100233	DD	On-Demand	Anodyne	DRD2	17	48
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100233	DD	On-Demand	Anodyne	DRD4	36	48
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100233	DD	On-Demand	Anodyne	ACHE	31	42
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100233	DD	On-Demand	Anodyne	HRH2	19	45
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100233	DD	On-Demand	Anodyne	SLC6A1	50	33
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100233	DD	On-Demand	Anodyne	SIGMAR1	45	46
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100233	DD	On-Demand	Anodyne	CCR3	49	44
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100233	DD	On-Demand	Anodyne	CCR2	18	42
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100233	DD	On-Demand	Anodyne	EPHX2	18	48
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100233	DD	On-Demand	Anodyne	MCHR1	19	46
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100233	DD	On-Demand	Anodyne	BIRC2	41	47
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100234	DD	On-Demand	Anodyne	DRD2	17	48
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100234	DD	On-Demand	Anodyne	DRD4	36	48
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100234	DD	On-Demand	Anodyne	ACHE	31	42
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100234	DD	On-Demand	Anodyne	HRH2	19	45
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100234	DD	On-Demand	Anodyne	SLC6A1	50	33
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100234	DD	On-Demand	Anodyne	SIGMAR1	45	46
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100234	DD	On-Demand	Anodyne	CCR3	49	44
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100234	DD	On-Demand	Anodyne	CCR2	18	42
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100234	DD	On-Demand	Anodyne	EPHX2	18	48
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100234	DD	On-Demand	Anodyne	MCHR1	19	46
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100234	DD	On-Demand	Anodyne	BIRC2	41	47
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100239	EE	On-Demand	Anodyne	DRD4	32	47
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100239	EE	On-Demand	Anodyne	SLC6A1	43	32
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100239	EE	On-Demand	Anodyne	CHRM3	17	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100239	EE	On-Demand	Anodyne	SIGMAR1	33	44
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100239	EE	On-Demand	Anodyne	CCR3	24	42
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100239	EE	On-Demand	Anodyne	MCHR1	15	45
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100239	EE	On-Demand	Anodyne	BIRC2	55	53
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100240	EE	On-Demand	Anodyne	DRD4	32	47
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100240	EE	On-Demand	Anodyne	SLC6A1	43	32
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100240	EE	On-Demand	Anodyne	CHRM3	17	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100240	EE	On-Demand	Anodyne	SIGMAR1	33	44
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100240	EE	On-Demand	Anodyne	CCR3	24	42
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100240	EE	On-Demand	Anodyne	MCHR1	15	45
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100240	EE	On-Demand	Anodyne	BIRC2	55	53
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCOc1ccc(F)cc1	ZINC000875100246	ED	On-Demand	Anodyne	SLC6A4	26	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCOc1ccc(F)cc1	ZINC000875100246	ED	On-Demand	Anodyne	SLC6A3	53	43
CCCCCCCNC(=O)C(=O)NCCc1cnccn1	ZINC000875100265	CD	On-Demand	Mild	FAAH	16	40
CCCCCCCNC(=O)C(=O)NCCc1cnccn1	ZINC000875100265	CD	On-Demand	Mild	ASAH1	90	35
O=C(NCCc1cnccn1)C(=O)NCc1ccc(Cl)c(C(F)(F)F)c1	ZINC000875100275	GE	On-Demand	Anodyne	RAF1	20	41
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCc3cnccn3)C2)cc1	ZINC000875100279	FC	On-Demand	Anodyne	DRD4	29	45
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCc3cnccn3)C2)cc1	ZINC000875100279	FC	On-Demand	Anodyne	SSTR5	50	40
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCc3cnccn3)C2)cc1	ZINC000875100279	FC	On-Demand	Anodyne	UTS2R	21	40
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCc3cnccn3)C2)cc1	ZINC000875100279	FC	On-Demand	Anodyne	CCR2	15	43
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCc3cnccn3)C2)cc1	ZINC000875100279	FC	On-Demand	Anodyne	MCHR1	32	42
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCc3cnccn3)C2)cc1	ZINC000875100280	FC	On-Demand	Anodyne	DRD4	29	45
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCc3cnccn3)C2)cc1	ZINC000875100280	FC	On-Demand	Anodyne	SSTR5	50	40
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCc3cnccn3)C2)cc1	ZINC000875100280	FC	On-Demand	Anodyne	UTS2R	21	40
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCc3cnccn3)C2)cc1	ZINC000875100280	FC	On-Demand	Anodyne	CCR2	15	43
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCc3cnccn3)C2)cc1	ZINC000875100280	FC	On-Demand	Anodyne	MCHR1	32	42
O=C(NCCc1cnccn1)C(=O)N[C@H](c1ccc(F)cc1)C1CCCCC1	ZINC000875100298	GF	On-Demand	Anodyne	C3AR1	28	41
O=C(NCCc1cnccn1)C(=O)N[C@@H](c1ccc(F)cc1)C1CCCCC1	ZINC000875100299	GF	On-Demand	Anodyne	C3AR1	28	41
CON(C)C(=O)c1ccccc1SCC(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000875100309	GI	On-Demand	Anodyne	ENPP1	54	34
CON(C)C(=O)c1ccccc1SCC(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000875100309	GI	On-Demand	Anodyne	FAS	48	38
Cc1nnc(NNC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)n1C	ZINC000875100317	ED	On-Demand	Reactive	DRD4	35	45
Cc1nnc(NNC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)n1C	ZINC000875100317	ED	On-Demand	Reactive	SLC6A1	94	35
Cc1nnc(NNC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)n1C	ZINC000875100317	ED	On-Demand	Reactive	SIGMAR1	32	42
Cc1nnc(NNC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)n1C	ZINC000875100317	ED	On-Demand	Reactive	CCR3	46	41
Cc1nnc(NNC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)n1C	ZINC000875100317	ED	On-Demand	Reactive	BIRC2	43	45
Cc1nnc(NNC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)n1C	ZINC000875100318	ED	On-Demand	Reactive	DRD4	35	45
Cc1nnc(NNC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)n1C	ZINC000875100318	ED	On-Demand	Reactive	SLC6A1	94	35
Cc1nnc(NNC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)n1C	ZINC000875100318	ED	On-Demand	Reactive	SIGMAR1	32	42
Cc1nnc(NNC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)n1C	ZINC000875100318	ED	On-Demand	Reactive	CCR3	46	41
Cc1nnc(NNC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)n1C	ZINC000875100318	ED	On-Demand	Reactive	BIRC2	43	45
Cn1nc(Cl)c(C(=O)N(Cc2ccccc2)C2CC2)c1Cl	ZINC000875100322	DH	On-Demand	Anodyne	SLC6A9	28	47
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875100323	GD	On-Demand	Anodyne	CHRM2	15	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875100323	GD	On-Demand	Anodyne	DRD4	31	48
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875100323	GD	On-Demand	Anodyne	ACHE	31	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875100323	GD	On-Demand	Anodyne	CHRM3	20	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875100323	GD	On-Demand	Anodyne	SIGMAR1	35	46
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875100323	GD	On-Demand	Anodyne	CCR3	41	44
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875100323	GD	On-Demand	Anodyne	CCR2	28	45
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875100323	GD	On-Demand	Anodyne	MCHR1	18	43
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875100323	GD	On-Demand	Anodyne	BIRC2	37	44
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875100324	GD	On-Demand	Anodyne	CHRM2	15	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875100324	GD	On-Demand	Anodyne	DRD4	31	48
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875100324	GD	On-Demand	Anodyne	ACHE	31	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875100324	GD	On-Demand	Anodyne	CHRM3	20	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875100324	GD	On-Demand	Anodyne	SIGMAR1	35	46
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875100324	GD	On-Demand	Anodyne	CCR3	41	44
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875100324	GD	On-Demand	Anodyne	CCR2	28	45
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875100324	GD	On-Demand	Anodyne	MCHR1	18	43
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875100324	GD	On-Demand	Anodyne	BIRC2	37	44
COC(=O)[C@@]12C[C@@H](NC(=O)NCCOc3ccc(F)cc3)C[C@@H]1C2	ZINC000875100329	ED	On-Demand	Anodyne	EPHX2	20	48
CCO[C@@H](C(=O)Nc1nc2cc(C(F)(F)F)ccc2s1)[C@@H]1CCOC1	ZINC000875100341	FH	On-Demand	Anodyne	CSNK1D	38	44
CCO[C@@H](C(=O)Nc1nc2cc(C(F)(F)F)ccc2s1)[C@H]1CCOC1	ZINC000875100343	FH	On-Demand	Anodyne	CSNK1D	38	44
O=C(CN1CCCCC(=O)C1=O)Nc1nc2cc(Cl)ccc2s1	ZINC000875100349	FE	On-Demand	Anodyne	CSNK1D	42	43
CC(=O)N(C)c1ccc(CNC(=O)NCCNc2nc3ccccc3s2)cc1	ZINC000875100351	GG	On-Demand	Anodyne	CSNK1D	20	41
CON(C)C(=O)c1cc([N+](=O)[O-])ccc1N1CCC(Cc2ccccc2)CC1	ZINC000875100370	GH	On-Demand	Bother	GRIN2B	47	48
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1nccs1	ZINC000875100388	GE	On-Demand	Anodyne	DRD2	21	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1nccs1	ZINC000875100388	GE	On-Demand	Anodyne	DRD4	44	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1nccs1	ZINC000875100388	GE	On-Demand	Anodyne	ACHE	63	61
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1nccs1	ZINC000875100388	GE	On-Demand	Anodyne	DRD3	18	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1nccs1	ZINC000875100388	GE	On-Demand	Anodyne	HTR4	23	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1nccs1	ZINC000875100388	GE	On-Demand	Anodyne	GRIN2B	24	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1nccs1	ZINC000875100388	GE	On-Demand	Anodyne	SIGMAR1	54	46
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1nccs1	ZINC000875100388	GE	On-Demand	Anodyne	BCHE	17	48
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1nccs1	ZINC000875100388	GE	On-Demand	Anodyne	MCHR1	19	47
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1nccs1	ZINC000875100388	GE	On-Demand	Anodyne	SIRT3	43	36
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1nccs1	ZINC000875100388	GE	On-Demand	Anodyne	SIRT2	47	36
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1nccs1	ZINC000875100388	GE	On-Demand	Anodyne	SIRT1	43	38
COC(=O)C1(NC(=O)c2cnn(-c3cccc(F)c3)c2C(F)(F)F)CCCC1	ZINC000875100393	GG	On-Demand	Anodyne	NTSR2	20	40
COC(=O)C1(NC(=O)c2cnn(-c3cccc(F)c3)c2C(F)(F)F)CCCC1	ZINC000875100393	GG	On-Demand	Anodyne	MST1R	39	40
CC[C@@H]1COCCN1CCNC(=O)NCc1ccc(NC(=O)NC(C)C)cc1	ZINC000875100398	GE	On-Demand	Anodyne	MTOR	52	41
CCC1(CC)CCCN1C(=O)NCc1cccc(C(=O)NC)c1	ZINC000875100424	DF	On-Demand	Anodyne	CHRM3	15	44
COc1ccc(C)cc1CNC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875100452	ED	On-Demand	Anodyne	EPHX2	40	53
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Br)s1	ZINC000875100467	FF	On-Demand	Anodyne	SLC6A4	33	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Br)s1	ZINC000875100467	FF	On-Demand	Anodyne	SLC6A3	61	46
CC(=O)[C@H]1CCCN(C(=O)NCC2(N3CCSCC3)CCCC2)C1	ZINC000875100468	FE	On-Demand	Anodyne	HCN1	60	37
CC(=O)[C@H]1CCCN(C(=O)NCC2(N3CCSCC3)CCCC2)C1	ZINC000875100468	FE	On-Demand	Anodyne	HCN4	57	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Br)s1	ZINC000875100469	FF	On-Demand	Anodyne	SLC6A4	33	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Br)s1	ZINC000875100469	FF	On-Demand	Anodyne	SLC6A3	61	46
CC(=O)[C@@H]1CCCN(C(=O)NCC2(N3CCSCC3)CCCC2)C1	ZINC000875100472	FE	On-Demand	Anodyne	HCN1	60	37
CC(=O)[C@@H]1CCCN(C(=O)NCC2(N3CCSCC3)CCCC2)C1	ZINC000875100472	FE	On-Demand	Anodyne	HCN4	57	37
COc1ccc(C)cc1CNC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875100497	EF	On-Demand	Anodyne	EPHX2	16	40
COc1ccc(C)cc1CNC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875100498	EF	On-Demand	Anodyne	EPHX2	16	40
CC(=O)C1CCN(C(=O)NCC2(N3CCSCC3)CCCC2)CC1	ZINC000875100505	FE	On-Demand	Anodyne	SMO	15	40
CC(=O)C1CCN(C(=O)NCC2(N3CCSCC3)CCCC2)CC1	ZINC000875100505	FE	On-Demand	Anodyne	HCN1	56	35
CC(=O)C1CCN(C(=O)NCC2(N3CCSCC3)CCCC2)CC1	ZINC000875100505	FE	On-Demand	Anodyne	HCN4	53	35
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(OC)c(F)c1	ZINC000875100511	FE	On-Demand	Anodyne	ACKR3	68	35
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OC)c(F)c1	ZINC000875100553	CE	On-Demand	Anodyne	PPARA	15	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OC)c(F)c1	ZINC000875100553	CE	On-Demand	Anodyne	ANPEP	15	41
O=C(NCCc1cnccn1)C(=O)N1CCc2ccc(C(F)(F)F)cc2C1	ZINC000875100561	GD	On-Demand	Anodyne	CCR2	22	40
CON(C)C(=O)c1cc(S(=O)(=O)N(Cc2ccccc2)c2ccccc2)ccc1Cl	ZINC000875100578	II	On-Demand	Anodyne	MMP13	16	42
CON(C)C(=O)c1cc(S(=O)(=O)N(Cc2ccccc2)c2ccccc2)ccc1Cl	ZINC000875100578	II	On-Demand	Anodyne	MMP9	19	45
CON(C)C(=O)c1cc(S(=O)(=O)N(Cc2ccccc2)c2ccccc2)ccc1Cl	ZINC000875100578	II	On-Demand	Anodyne	MMP1	17	45
CON(C)C(=O)c1cc(S(=O)(=O)N(Cc2ccccc2)c2ccccc2)ccc1Cl	ZINC000875100578	II	On-Demand	Anodyne	TRPM8	46	43
CON(C)C(=O)c1cc(S(=O)(=O)N(Cc2ccccc2)c2ccccc2)ccc1Cl	ZINC000875100578	II	On-Demand	Anodyne	LIMK2	26	43
O=C(Cc1cc2c(cc1Br)OCCO2)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875100584	JG	On-Demand	Anodyne	NOS2	51	35
O=C(Cc1cc2c(cc1Br)OCCO2)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875100584	JG	On-Demand	Anodyne	L3MBTL3	55	35
NC(=O)[C@@H]1CC[C@H](CCC(=O)Nc2nc3cc(Cl)ccc3s2)O1	ZINC000875100590	FF	On-Demand	Anodyne	CSNK1D	36	42
O=C1CC[C@H](C(=O)Nc2nc3cc(Cl)ccc3s2)O1	ZINC000875100626	CF	On-Demand	Anodyne	CSNK1D	23	40
C=CCN(c1cccc(C(F)(F)F)c1)S(=O)(=O)c1ccc(Cl)c(C(=O)N(C)OC)c1	ZINC000875100630	JI	On-Demand	Mild	CACNA1B	40	34
O=C1CCN(C(=O)NCCOc2ccc(F)cc2)CCCCCCN1	ZINC000875100635	FE	On-Demand	Anodyne	HRH3	19	41
CC[C@@H](NC(=O)NCc1ccc(OC)c(F)c1)[C@@H](O)c1ccccc1	ZINC000875100673	EG	On-Demand	Anodyne	PPARA	16	42
CC[C@@H](NC(=O)NCc1ccc(OC)c(F)c1)[C@@H](O)c1ccccc1	ZINC000875100673	EG	On-Demand	Anodyne	CTSD	16	41
CC[C@@H](NC(=O)NCc1ccc(OC)c(F)c1)[C@@H](O)c1ccccc1	ZINC000875100673	EG	On-Demand	Anodyne	HCRTR2	15	40
CC[C@@H](NC(=O)NCc1ccc(OC)c(F)c1)[C@@H](O)c1ccccc1	ZINC000875100673	EG	On-Demand	Anodyne	PDS	56	36
CC[C@@H](NC(=O)NCc1ccc(OC)c(F)c1)[C@H](O)c1ccccc1	ZINC000875100675	EG	On-Demand	Anodyne	PPARA	16	42
CC[C@@H](NC(=O)NCc1ccc(OC)c(F)c1)[C@H](O)c1ccccc1	ZINC000875100675	EG	On-Demand	Anodyne	CTSD	16	41
CC[C@@H](NC(=O)NCc1ccc(OC)c(F)c1)[C@H](O)c1ccccc1	ZINC000875100675	EG	On-Demand	Anodyne	HCRTR2	15	40
CC[C@@H](NC(=O)NCc1ccc(OC)c(F)c1)[C@H](O)c1ccccc1	ZINC000875100675	EG	On-Demand	Anodyne	PDS	56	36
CC[C@@H](NC(=O)NCc1cccc(C(=O)NC)c1)c1cccc(OC)c1OC	ZINC000875100697	GG	On-Demand	Anodyne	ROCK2	19	41
CC[C@@H](NC(=O)NCc1cccc(C(=O)NC)c1)c1cccc(OC)c1OC	ZINC000875100697	GG	On-Demand	Anodyne	PDS	45	34
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cl)s1	ZINC000875100699	EF	On-Demand	Anodyne	SLC6A4	38	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cl)s1	ZINC000875100699	EF	On-Demand	Anodyne	SLC6A3	70	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cl)s1	ZINC000875100700	EF	On-Demand	Anodyne	SLC6A4	38	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cl)s1	ZINC000875100700	EF	On-Demand	Anodyne	SLC6A3	70	45
CC[C@H](C[C@H](C)O)NC(=O)NCc1cc(C)ccc1OC	ZINC000875100713	CE	On-Demand	Anodyne	ANPEP	15	46
O=C(NCC1(N2CCSCC2)CCCC1)N1CCC(CO)(CO)CC1	ZINC000875100731	FD	On-Demand	Anodyne	HCN1	49	30
O=C(NCC1(N2CCSCC2)CCCC1)N1CCC(CO)(CO)CC1	ZINC000875100731	FD	On-Demand	Anodyne	HCN4	47	30
O=C(NCCO)C1CCN(C(=O)NCc2ccc(Cl)s2)CC1	ZINC000875100778	ED	On-Demand	Anodyne	EPHX2	18	49
CC(C)(C)NS(=O)(=O)CCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875100786	GD	On-Demand	Anodyne	TRY1_BOVIN	47	35
CC(C)(C)NS(=O)(=O)CCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875100786	GD	On-Demand	Anodyne	TMPRSS11D	47	33
CC(C)(C)NS(=O)(=O)CCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875100787	GD	On-Demand	Anodyne	TRY1_BOVIN	47	35
CC(C)(C)NS(=O)(=O)CCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875100787	GD	On-Demand	Anodyne	TMPRSS11D	47	33
CC(C)(C)NS(=O)(=O)CCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875100789	GD	On-Demand	Anodyne	TRY1_BOVIN	47	35
CC(C)(C)NS(=O)(=O)CCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875100789	GD	On-Demand	Anodyne	TMPRSS11D	47	33
CC(C)(C)NS(=O)(=O)CCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875100790	GD	On-Demand	Anodyne	TRY1_BOVIN	47	35
CC(C)(C)NS(=O)(=O)CCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875100790	GD	On-Demand	Anodyne	TMPRSS11D	47	33
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](C)N1CCc2ccccc21	ZINC000875100819	DE	On-Demand	Anodyne	KCNQ2	42	32
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](C)N1CCc2ccccc21	ZINC000875100820	DE	On-Demand	Anodyne	KCNQ2	42	32
CON(C)C(=O)c1ccc(Cl)c(S(=O)(=O)N2CCC(Cc3ccccc3)CC2)c1	ZINC000875100837	IH	On-Demand	Anodyne	HRH1	15	42
CON(C)C(=O)c1ccc(Cl)c(S(=O)(=O)N2CCC(Cc3ccccc3)CC2)c1	ZINC000875100837	IH	On-Demand	Anodyne	GRIN2B	56	42
CON(C)C(=O)c1ccc(Cl)c(S(=O)(=O)N2CCC(Cc3ccccc3)CC2)c1	ZINC000875100837	IH	On-Demand	Anodyne	SIGMAR1	19	48
CON(C)C(=O)c1ccc(Cl)c(S(=O)(=O)N2CCC(Cc3ccccc3)CC2)c1	ZINC000875100837	IH	On-Demand	Anodyne	CCR3	54	39
CON(C)C(=O)c1ccc(Cl)c(S(=O)(=O)N2CCC(Cc3ccccc3)CC2)c1	ZINC000875100837	IH	On-Demand	Anodyne	CCR5	23	45
CON(C)C(=O)c1ccc(Cl)c(S(=O)(=O)N2CCC(Cc3ccccc3)CC2)c1	ZINC000875100837	IH	On-Demand	Anodyne	CACNA1I	42	37
COC(=O)N(C)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100862	DD	On-Demand	Reactive	DRD2	23	53
COC(=O)N(C)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100862	DD	On-Demand	Reactive	DRD4	51	55
COC(=O)N(C)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100862	DD	On-Demand	Reactive	ACHE	36	41
COC(=O)N(C)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100862	DD	On-Demand	Reactive	HRH2	21	40
COC(=O)N(C)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100862	DD	On-Demand	Reactive	SLC6A1	95	35
COC(=O)N(C)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100862	DD	On-Demand	Reactive	DRD3	19	53
COC(=O)N(C)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100862	DD	On-Demand	Reactive	LTA4H	33	43
COC(=O)N(C)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100862	DD	On-Demand	Reactive	SIGMAR1	58	47
COC(=O)N(C)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100862	DD	On-Demand	Reactive	CCR3	49	44
COC(=O)N(C)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100862	DD	On-Demand	Reactive	CCR5	27	43
COC(=O)N(C)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100862	DD	On-Demand	Reactive	UTS2R	22	41
COC(=O)N(C)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100862	DD	On-Demand	Reactive	SLC18A3	16	40
COC(=O)N(C)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100862	DD	On-Demand	Reactive	PREP	47	34
COC(=O)N(C)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100862	DD	On-Demand	Reactive	MLNR	42	35
COC(=O)N(C)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100862	DD	On-Demand	Reactive	CCR2	15	40
COC(=O)N(C)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100862	DD	On-Demand	Reactive	EPHX2	18	42
COC(=O)N(C)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100862	DD	On-Demand	Reactive	MCHR1	32	46
COC(=O)N(C)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875100862	DD	On-Demand	Reactive	BIRC2	45	49
COC(=O)N(C)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100863	DD	On-Demand	Reactive	DRD2	23	53
COC(=O)N(C)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100863	DD	On-Demand	Reactive	DRD4	51	55
COC(=O)N(C)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100863	DD	On-Demand	Reactive	ACHE	36	41
COC(=O)N(C)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100863	DD	On-Demand	Reactive	HRH2	21	40
COC(=O)N(C)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100863	DD	On-Demand	Reactive	SLC6A1	95	35
COC(=O)N(C)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100863	DD	On-Demand	Reactive	DRD3	19	53
COC(=O)N(C)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100863	DD	On-Demand	Reactive	LTA4H	33	43
COC(=O)N(C)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100863	DD	On-Demand	Reactive	SIGMAR1	58	47
COC(=O)N(C)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100863	DD	On-Demand	Reactive	CCR3	49	44
COC(=O)N(C)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100863	DD	On-Demand	Reactive	CCR5	27	43
COC(=O)N(C)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100863	DD	On-Demand	Reactive	UTS2R	22	41
COC(=O)N(C)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100863	DD	On-Demand	Reactive	SLC18A3	16	40
COC(=O)N(C)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100863	DD	On-Demand	Reactive	PREP	47	34
COC(=O)N(C)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100863	DD	On-Demand	Reactive	MLNR	42	35
COC(=O)N(C)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100863	DD	On-Demand	Reactive	CCR2	15	40
COC(=O)N(C)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100863	DD	On-Demand	Reactive	EPHX2	18	42
COC(=O)N(C)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100863	DD	On-Demand	Reactive	MCHR1	32	46
COC(=O)N(C)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875100863	DD	On-Demand	Reactive	BIRC2	45	49
COC(=O)N(C)NC(=O)NCC1(N2CCSCC2)CCCC1	ZINC000875100876	ED	On-Demand	Reactive	HCN1	61	39
COC(=O)N(C)NC(=O)NCC1(N2CCSCC2)CCCC1	ZINC000875100876	ED	On-Demand	Reactive	HCN4	57	38
C[C@@H](NC(=O)NCCNc1nc2ccccc2s1)c1ccnn1C	ZINC000875100878	EF	On-Demand	Anodyne	ST14	50	35
C[C@@H](NC(=O)NCCNc1nc2ccccc2s1)c1ccnn1C	ZINC000875100878	EF	On-Demand	Anodyne	TMPRSS6	73	35
C[C@H](NC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000875100881	GF	On-Demand	Anodyne	EPHX2	44	42
CON(C)C(=O)[C@H](CCSC)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000875100886	JD	On-Demand	Bother	BCL2L1	116	39
CON(C)C(=O)[C@H](CCSC)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000875100886	JD	On-Demand	Bother	BCL2	100	39
CON(C)C(=O)[C@H](CCSC)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000875100886	JD	On-Demand	Bother	BCL2L2	45	33
N#C[C@@]1(C(=O)Nc2nc3cc(C(F)(F)F)ccc3s2)CCCOC1	ZINC000875100914	FH	On-Demand	Mild	CSNK1D	31	41
N#C[C@]1(C(=O)Nc2nc3cc(C(F)(F)F)ccc3s2)CCCOC1	ZINC000875100915	FH	On-Demand	Mild	CSNK1D	31	41
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875100921	GD	On-Demand	Anodyne	DRD4	31	48
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875100921	GD	On-Demand	Anodyne	SLC6A1	92	35
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875100921	GD	On-Demand	Anodyne	HRH3	15	41
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875100921	GD	On-Demand	Anodyne	SIGMAR1	33	54
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875100921	GD	On-Demand	Anodyne	CCR3	32	45
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875100921	GD	On-Demand	Anodyne	CCR2	17	42
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875100921	GD	On-Demand	Anodyne	EPHX2	31	43
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875100921	GD	On-Demand	Anodyne	MCHR1	15	44
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875100921	GD	On-Demand	Anodyne	CACNA1G	38	45
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875100921	GD	On-Demand	Anodyne	BIRC2	37	47
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875100922	GD	On-Demand	Anodyne	DRD4	31	48
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875100922	GD	On-Demand	Anodyne	SLC6A1	92	35
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875100922	GD	On-Demand	Anodyne	HRH3	15	41
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875100922	GD	On-Demand	Anodyne	SIGMAR1	33	54
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875100922	GD	On-Demand	Anodyne	CCR3	32	45
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875100922	GD	On-Demand	Anodyne	CCR2	17	42
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875100922	GD	On-Demand	Anodyne	EPHX2	31	43
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875100922	GD	On-Demand	Anodyne	MCHR1	15	44
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875100922	GD	On-Demand	Anodyne	CACNA1G	38	45
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875100922	GD	On-Demand	Anodyne	BIRC2	37	47
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H](C)N2CCc3ccccc3C2)C1	ZINC000875100931	FE	On-Demand	Anodyne	ACE	16	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H](C)N2CCc3ccccc3C2)C1	ZINC000875100931	FE	On-Demand	Anodyne	NOD2	40	39
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H](C)N2CCc3ccccc3C2)C1	ZINC000875100932	FE	On-Demand	Anodyne	ACE	16	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H](C)N2CCc3ccccc3C2)C1	ZINC000875100932	FE	On-Demand	Anodyne	NOD2	40	39
COc1ccc(N2CCN(C(=O)C(=O)NCCc3cnccn3)CC2)c(OC)c1	ZINC000875100946	GC	On-Demand	Clean	HTR1A	30	42
COc1ccc(N2CCN(C(=O)C(=O)NCCc3cnccn3)CC2)c(OC)c1	ZINC000875100946	GC	On-Demand	Clean	DRD2	27	42
COc1ccc(N2CCN(C(=O)C(=O)NCCc3cnccn3)CC2)c(OC)c1	ZINC000875100946	GC	On-Demand	Clean	DRD4	46	36
COc1ccc(N2CCN(C(=O)C(=O)NCCc3cnccn3)CC2)c(OC)c1	ZINC000875100946	GC	On-Demand	Clean	ADRA1D	21	40
COc1ccc(N2CCN(C(=O)C(=O)NCCc3cnccn3)CC2)c(OC)c1	ZINC000875100946	GC	On-Demand	Clean	ADRA1A	19	40
COc1ccc(N2CCN(C(=O)C(=O)NCCc3cnccn3)CC2)c(OC)c1	ZINC000875100946	GC	On-Demand	Clean	DRD3	48	41
COc1ccc(N2CCN(C(=O)C(=O)NCCc3cnccn3)CC2)c(OC)c1	ZINC000875100946	GC	On-Demand	Clean	PDGFRB	41	38
CCO[C@@H](C(=O)Nc1nc2cc(Cl)ccc2s1)C1CCOCC1	ZINC000875100948	FH	On-Demand	Anodyne	CSNK1D	36	40
COc1ccc(C)cc1CNC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875100961	DF	On-Demand	Anodyne	EPHX2	16	41
COc1ccc(C)cc1CNC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875100962	DF	On-Demand	Anodyne	EPHX2	16	41
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(Cl)s1	ZINC000875101033	FF	On-Demand	Anodyne	CACNA1I	48	32
O=C(NCCCCCCc1ccccc1)C(=O)NCc1nccs1	ZINC000875101078	EF	On-Demand	Anodyne	MAP1	56	45
O=C(NCCCCCCc1ccccc1)C(=O)NCc1nccs1	ZINC000875101078	EF	On-Demand	Anodyne	FAAH	73	45
O=C(NCCCCCCc1ccccc1)C(=O)NCc1nccs1	ZINC000875101078	EF	On-Demand	Anodyne	CES1	72	41
O=C(NCCCCCCc1ccccc1)C(=O)NCc1nccs1	ZINC000875101078	EF	On-Demand	Anodyne	AMP1_PLAFQ	25	45
COC(=O)CCCCCNC(=O)NC1CC(C(=O)OC)C1	ZINC000875101094	DC	On-Demand	Anodyne	EPHX2	39	68
CON(C)C(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc2ccccc2c1	ZINC000875101114	HF	On-Demand	Anodyne	MMP13	44	41
CON(C)C(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc2ccccc2c1	ZINC000875101114	HF	On-Demand	Anodyne	ADAM17	25	41
CON(C)C(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc2ccccc2c1	ZINC000875101114	HF	On-Demand	Anodyne	MMP3	69	65
CON(C)C(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc2ccccc2c1	ZINC000875101114	HF	On-Demand	Anodyne	MMP8	51	65
CON(C)C(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc2ccccc2c1	ZINC000875101114	HF	On-Demand	Anodyne	MMP9	37	41
CON(C)C(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc2ccccc2c1	ZINC000875101114	HF	On-Demand	Anodyne	ADAM9	66	40
CON(C)C(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc2ccccc2c1	ZINC000875101114	HF	On-Demand	Anodyne	MMP7	49	37
CON(C)C(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc2ccccc2c1	ZINC000875101114	HF	On-Demand	Anodyne	MMP1	56	41
CON(C)C(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc2ccccc2c1	ZINC000875101114	HF	On-Demand	Anodyne	AKR1C3	16	44
Cc1nccnc1[C@@H](C)NC(=O)NCCNc1nc2ccccc2s1	ZINC000875101120	FF	On-Demand	Anodyne	ST14	40	35
Cc1nccnc1[C@@H](C)NC(=O)NCCNc1nc2ccccc2s1	ZINC000875101120	FF	On-Demand	Anodyne	TMPRSS6	56	35
Cc1nccnc1[C@H](C)NC(=O)NCCNc1nc2ccccc2s1	ZINC000875101122	FF	On-Demand	Anodyne	ST14	40	35
Cc1nccnc1[C@H](C)NC(=O)NCCNc1nc2ccccc2s1	ZINC000875101122	FF	On-Demand	Anodyne	TMPRSS6	56	35
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2(N3CCSCC3)CCCC2)C1	ZINC000875101127	GE	On-Demand	Anodyne	HCN1	58	36
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2(N3CCSCC3)CCCC2)C1	ZINC000875101127	GE	On-Demand	Anodyne	HCN4	54	36
CONC(=O)C1CCN(C(=O)NCC2(N3CCSCC3)CCCC2)CC1	ZINC000875101141	GD	On-Demand	Anodyne	HCN1	53	33
CONC(=O)C1CCN(C(=O)NCC2(N3CCSCC3)CCCC2)CC1	ZINC000875101141	GD	On-Demand	Anodyne	HCN4	51	33
CN1CCC(CNC(=O)NCCS(=O)(=O)NC2CC2)(c2ccccc2)CC1	ZINC000875101178	GD	On-Demand	Anodyne	KCNA3	48	39
CN1CCC(CNC(=O)NCCS(=O)(=O)NC2CC2)(c2ccccc2)CC1	ZINC000875101178	GD	On-Demand	Anodyne	SLC6A9	23	43
CN1CCC(CNC(=O)NCCS(=O)(=O)NC2CC2)(c2ccccc2)CC1	ZINC000875101178	GD	On-Demand	Anodyne	SOAT1	15	40
CCOc1ccc(S(=O)(=O)NCC(=O)N(C)OC)cc1	ZINC000875101182	DC	On-Demand	Anodyne	MMP13	49	52
CCOc1ccc(S(=O)(=O)NCC(=O)N(C)OC)cc1	ZINC000875101182	DC	On-Demand	Anodyne	ADAM17	24	46
CCOc1ccc(S(=O)(=O)NCC(=O)N(C)OC)cc1	ZINC000875101182	DC	On-Demand	Anodyne	MMP2	26	52
CCOc1ccc(S(=O)(=O)NCC(=O)N(C)OC)cc1	ZINC000875101182	DC	On-Demand	Anodyne	MMP3	21	43
CCOc1ccc(S(=O)(=O)NCC(=O)N(C)OC)cc1	ZINC000875101182	DC	On-Demand	Anodyne	MMP8	20	50
CCOc1ccc(S(=O)(=O)NCC(=O)N(C)OC)cc1	ZINC000875101182	DC	On-Demand	Anodyne	MMP14	22	52
CCOc1ccc(S(=O)(=O)NCC(=O)N(C)OC)cc1	ZINC000875101182	DC	On-Demand	Anodyne	MMP9	35	50
CCOc1ccc(S(=O)(=O)NCC(=O)N(C)OC)cc1	ZINC000875101182	DC	On-Demand	Anodyne	MMP12	23	50
CCOc1ccc(S(=O)(=O)NCC(=O)N(C)OC)cc1	ZINC000875101182	DC	On-Demand	Anodyne	MMP7	19	43
CCOc1ccc(S(=O)(=O)NCC(=O)N(C)OC)cc1	ZINC000875101182	DC	On-Demand	Anodyne	ADAMTS4	25	42
CCOc1ccc(S(=O)(=O)NCC(=O)N(C)OC)cc1	ZINC000875101182	DC	On-Demand	Anodyne	MMP1	27	52
O=C(Cc1ccc(O)cc1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875101241	EE	On-Demand	Anodyne	FABI	57	43
O=C(Cc1ccc(O)cc1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875101241	EE	On-Demand	Anodyne	MLYCD	18	40
O=C(Cc1ccc(O)cc1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875101241	EE	On-Demand	Anodyne	L3MBTL3	81	41
O=C(Cc1ccc(O)cc1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875101241	EE	On-Demand	Anodyne	NAMPT	18	45
COc1ccc(C)cc1CNC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875101265	EH	On-Demand	Anodyne	EPHX2	23	44
COc1ccc(C)cc1CNC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875101266	EH	On-Demand	Anodyne	EPHX2	23	44
CS(=O)(=O)Nc1cc2ccccc2cc1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875101300	JG	On-Demand	Anodyne	L3MBTL3	48	39
CS(=O)(=O)Nc1cc2ccccc2cc1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875101300	JG	On-Demand	Anodyne	NAMPT	47	38
COCC(C)(C)CCNC(=O)C(=O)NCc1cc(Cl)ccc1OC	ZINC000875101315	FE	On-Demand	Anodyne	MT-ND1	17	40
CC(C)(C)NS(=O)(=O)CCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875101354	GE	On-Demand	Anodyne	FKBP1A	29	42
CC(C)(C)NS(=O)(=O)CCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875101355	GE	On-Demand	Anodyne	FKBP1A	29	42
CC(C)(C)NS(=O)(=O)CCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875101356	GE	On-Demand	Anodyne	FKBP1A	29	42
CC(C)(C)NS(=O)(=O)CCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875101357	GE	On-Demand	Anodyne	FKBP1A	29	42
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H](C)N2CCc3ccccc32)C1	ZINC000875101362	FE	On-Demand	Anodyne	ACE	23	46
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H](C)N2CCc3ccccc32)C1	ZINC000875101363	FE	On-Demand	Anodyne	ACE	23	46
COC(=O)N(C)NC(=O)NCC1(c2ccccc2)CCOCC1	ZINC000875101434	DD	On-Demand	Reactive	KCNA3	52	45
COC(=O)N(C)NC(=O)NCC1(c2ccccc2)CCOCC1	ZINC000875101434	DD	On-Demand	Reactive	SOAT1	15	44
COC(=O)N(C)NC(=O)NCC1(c2ccccc2)CCOCC1	ZINC000875101434	DD	On-Demand	Reactive	ICMT	64	42
COC(=O)N(C)NC(=O)NCc1ccc(OC)c(F)c1	ZINC000875101466	CD	On-Demand	Reactive	MT-ND1	23	40
O=C(CCSc1ccccc1Br)Nc1ccccc1C(=O)NC1CC1	ZINC000875101470	HI	On-Demand	Anodyne	TNKS	50	32
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(C)ccc1OC	ZINC000875101478	EE	On-Demand	Anodyne	SLC6A4	28	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(C)ccc1OC	ZINC000875101478	EE	On-Demand	Anodyne	SLC6A3	54	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(C)ccc1OC	ZINC000875101479	EE	On-Demand	Anodyne	SLC6A4	28	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(C)ccc1OC	ZINC000875101479	EE	On-Demand	Anodyne	SLC6A3	54	40
CC[C@@H]1COCCN1CCNC(=O)NCC1(c2ccccc2)CCOCC1	ZINC000875101488	GE	On-Demand	Anodyne	KCNA3	41	36
CC[C@@H]1COCCN1CCNC(=O)NCC1(c2ccccc2)CCOCC1	ZINC000875101488	GE	On-Demand	Anodyne	SOAT1	15	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(NC(=O)NC(C)C)cc1	ZINC000875101513	GE	On-Demand	Anodyne	SLC6A3	48	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(NC(=O)NC(C)C)cc1	ZINC000875101514	GE	On-Demand	Anodyne	SLC6A3	48	42
O=CN1CCCN(C(=O)NCC2(c3ccccc3)CCOCC2)CC1	ZINC000875101530	ED	On-Demand	Anodyne	KCNA3	44	37
CC[C@@H](NC(C)=O)C(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F	ZINC000875101540	FH	On-Demand	Reactive	KCNQ2	40	33
CC[C@@H](NC(C)=O)C(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F	ZINC000875101546	FH	On-Demand	Reactive	KCNQ2	40	33
CN1CC[C@H]2CN(C(=O)NCc3cccc(S(N)(=O)=O)c3)CC[C@H]21	ZINC000875101565	FC	On-Demand	Anodyne	ST14	47	31
CN1CC[C@H]2CN(C(=O)NCc3cccc(S(N)(=O)=O)c3)CC[C@@H]21	ZINC000875101568	FC	On-Demand	Anodyne	ST14	47	31
CN1CCN(C(=O)NCC2(c3ccccc3)CCOCC2)CCC1(C)C	ZINC000875101569	FF	On-Demand	Anodyne	KCNA3	45	38
CN1CCN(C(=O)NCC2(c3ccccc3)CCOCC2)CCC1(C)C	ZINC000875101569	FF	On-Demand	Anodyne	ICMT	79	36
CN1CCN(C(=O)NCC2(c3ccccc3)CCOCC2)CCC1(C)C	ZINC000875101569	FF	On-Demand	Anodyne	SMO	15	41
C[C@@H](Cn1ccnc1)NC(=O)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875101573	GF	On-Demand	Anodyne	ABL1	15	45
O=C(NCCO)C1CCN(C(=O)NCC2(c3ccc(F)cc3)CC2)CC1	ZINC000875101576	FD	On-Demand	Anodyne	CACNA1G	42	54
C[C@@H](CNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)N(C)C	ZINC000875101584	ED	On-Demand	Mild	ITK	19	52
CC[C@H](C[C@H](C)O)NC(=O)NCC1(N2CCSCC2)CCCC1	ZINC000875101589	EE	On-Demand	Anodyne	HCN1	67	37
CC[C@H](C[C@H](C)O)NC(=O)NCC1(N2CCSCC2)CCCC1	ZINC000875101589	EE	On-Demand	Anodyne	HCN4	54	37
CN1CCN(C(=O)c2ccccc2NC(=O)c2c(Cl)nn(C)c2Cl)CC1	ZINC000875101602	GE	On-Demand	Anodyne	G2YM83_BOTF4	60	35
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NCc3nccs3)C2)c1	ZINC000875101644	GD	On-Demand	Anodyne	DRD4	23	41
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NCc3nccs3)C2)c1	ZINC000875101644	GD	On-Demand	Anodyne	PDE8B	24	40
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NCc3nccs3)C2)c1	ZINC000875101645	GD	On-Demand	Anodyne	DRD4	23	41
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NCc3nccs3)C2)c1	ZINC000875101645	GD	On-Demand	Anodyne	PDE8B	24	40
COc1ccccc1N(Cc1ccccc1)S(=O)(=O)c1cc(C(=O)N(C)OC)ccc1Cl	ZINC000875101663	JI	On-Demand	Anodyne	LIMK2	23	41
NS(=O)(=O)c1cccc(CNC(=O)N2C[C@@H]3[C@@H](C[C@H]3c3ccccc3)C2)c1	ZINC000875101690	GE	On-Demand	Anodyne	CA2	24	41
NS(=O)(=O)c1cccc(CNC(=O)N2C[C@@H]3[C@@H](C[C@H]3c3ccccc3)C2)c1	ZINC000875101690	GE	On-Demand	Anodyne	CA1	19	41
NS(=O)(=O)c1cccc(CNC(=O)N2C[C@@H]3[C@@H](C[C@H]3c3ccccc3)C2)c1	ZINC000875101690	GE	On-Demand	Anodyne	CA7	27	41
NS(=O)(=O)c1cccc(CNC(=O)N2C[C@@H]3[C@@H](C[C@H]3c3ccccc3)C2)c1	ZINC000875101690	GE	On-Demand	Anodyne	CA5B	35	41
NS(=O)(=O)c1cccc(CNC(=O)N2C[C@@H]3[C@@H](C[C@H]3c3ccccc3)C2)c1	ZINC000875101690	GE	On-Demand	Anodyne	CA5A	40	41
NS(=O)(=O)c1cccc(CNC(=O)N2C[C@@H]3[C@@H](C[C@H]3c3ccccc3)C2)c1	ZINC000875101690	GE	On-Demand	Anodyne	NAMPT	20	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1(c2ccccc2)CCOCC1	ZINC000875101699	FE	On-Demand	Anodyne	KCNA3	50	39
Cn1ncc2c1CCC[C@H]2NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875101713	FE	On-Demand	Anodyne	SIGMAR1	18	43
Cn1ncc2c1CCC[C@@H]2NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875101715	FE	On-Demand	Anodyne	SIGMAR1	18	43
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)[C@H]1CCCN1c1ncnc2ccccc12	ZINC000875101717	IG	On-Demand	Anodyne	F2	29	42
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)[C@H]1CCCN1c1ncnc2ccccc12	ZINC000875101717	IG	On-Demand	Anodyne	PREP	29	46
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)[C@H]1CCCN1c1ncnc2ccccc12	ZINC000875101717	IG	On-Demand	Anodyne	L3MBTL3	54	35
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)[C@H]1CCCN1c1ncnc2ccccc12	ZINC000875101717	IG	On-Demand	Anodyne	TMPRSS11D	68	36
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)[C@@H]1CCCN1c1ncnc2ccccc12	ZINC000875101723	IG	On-Demand	Anodyne	F2	29	42
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)[C@@H]1CCCN1c1ncnc2ccccc12	ZINC000875101723	IG	On-Demand	Anodyne	PREP	29	46
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)[C@@H]1CCCN1c1ncnc2ccccc12	ZINC000875101723	IG	On-Demand	Anodyne	L3MBTL3	54	35
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)[C@@H]1CCCN1c1ncnc2ccccc12	ZINC000875101723	IG	On-Demand	Anodyne	TMPRSS11D	68	36
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)C(=O)N[C@@H](CF)c2ccc(F)cc2)C1	ZINC000875101746	GE	On-Demand	Anodyne	GPR119	35	44
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)C(=O)N[C@@H](CF)c2ccc(F)cc2)C1	ZINC000875101747	GE	On-Demand	Anodyne	GPR119	35	44
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)C(=O)N[C@H](CF)c2ccc(F)cc2)C1	ZINC000875101748	GE	On-Demand	Anodyne	GPR119	35	44
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)C(=O)N[C@H](CF)c2ccc(F)cc2)C1	ZINC000875101749	GE	On-Demand	Anodyne	GPR119	35	44
COC(=O)[C@@]12C[C@@H](NC(=O)NCC3(c4ccccc4)CCOCC3)C[C@@H]1C2	ZINC000875101762	FE	On-Demand	Anodyne	KCNA3	51	42
O=C(NCC1(c2ccccc2)CCOCC1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875101771	GE	On-Demand	Anodyne	KCNA3	40	35
COc1ccc(C)cc1CNC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875101800	DE	On-Demand	Anodyne	TACR1	25	40
COc1ccc(C)cc1CNC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875101800	DE	On-Demand	Anodyne	EPHX2	18	42
COc1ccc(C)cc1CNC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875101802	DE	On-Demand	Anodyne	TACR1	25	40
COc1ccc(C)cc1CNC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875101802	DE	On-Demand	Anodyne	EPHX2	18	42
O=C(NCc1ccc(Cl)s1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875101833	EI	On-Demand	Anodyne	EPHX2	21	44
O=C(NCc1ccc(Cl)s1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875101835	EI	On-Demand	Anodyne	EPHX2	21	44
O=C(NCCCCCCc1ccccc1)C(=O)NCc1nnc2n1CCCC2	ZINC000875101884	GE	On-Demand	Anodyne	ACE	27	41
O=C(NCCCCCCc1ccccc1)C(=O)NCc1nnc2n1CCCC2	ZINC000875101884	GE	On-Demand	Anodyne	FKBP1A	26	43
O=C(NCCCCCCc1ccccc1)C(=O)NCc1nnc2n1CCCC2	ZINC000875101884	GE	On-Demand	Anodyne	PREP	43	35
O=C(NCCCCCCc1ccccc1)C(=O)NCc1nnc2n1CCCC2	ZINC000875101884	GE	On-Demand	Anodyne	FAAH	46	40
O=C(NCCCCCCc1ccccc1)C(=O)NCc1nnc2n1CCCC2	ZINC000875101884	GE	On-Demand	Anodyne	CES1	45	34
O=C(NCCCCCCc1ccccc1)C(=O)NCc1nnc2n1CCCC2	ZINC000875101884	GE	On-Demand	Anodyne	AMP1_PLAFQ	21	41
O=C(NCCCCCCc1ccccc1)C(=O)NCc1nnc2n1CCCC2	ZINC000875101884	GE	On-Demand	Anodyne	DAGLA	15	40
COC(=O)CCCCCNC(=O)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875101898	CE	On-Demand	Anodyne	EPHX2	27	51
COC(=O)CCCCCNC(=O)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875101899	CE	On-Demand	Anodyne	EPHX2	27	51
COC(=O)CCCCCNC(=O)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875101900	CE	On-Demand	Anodyne	EPHX2	27	51
COC(=O)CCCCCNC(=O)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875101901	CE	On-Demand	Anodyne	EPHX2	27	51
COC(=O)CCCCCNC(=O)N[C@@H]1C[C@H]2C[C@@]2(C(=O)OC)C1	ZINC000875101915	ED	On-Demand	Anodyne	EPHX2	36	58
O=C(c1ccccc1NC(=O)C(F)(F)c1cc(F)cc(F)c1)N1CCOCC1	ZINC000875101925	GG	On-Demand	Anodyne	EPHX2	18	48
O=C1N[C@H](C(=O)Nc2nc3cc(C(F)(F)F)ccc3s2)CO1	ZINC000875101935	EE	On-Demand	Anodyne	TRPV1	15	40
O=C1N[C@H](C(=O)Nc2nc3cc(C(F)(F)F)ccc3s2)CO1	ZINC000875101935	EE	On-Demand	Anodyne	CSNK1D	37	43
O=C(NC[C@H]1C[C@H](O)C1)NCC1(N2CCSCC2)CCCC1	ZINC000875101940	ED	On-Demand	Anodyne	HCN1	53	32
O=C(NC[C@H]1C[C@H](O)C1)NCC1(N2CCSCC2)CCCC1	ZINC000875101940	ED	On-Demand	Anodyne	HCN4	51	32
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1nccs1)CC2	ZINC000875101951	GD	On-Demand	Anodyne	SLC18A2	45	33
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1nccs1)CC2	ZINC000875101952	GD	On-Demand	Anodyne	SLC18A2	45	33
COc1ccc(N2CCN(C(=O)C(=O)NCc3nccs3)CC2)c(OC)c1	ZINC000875101963	GD	On-Demand	Clean	DRD4	40	32
COc1ccc(N2CCN(C(=O)C(=O)NCc3nccs3)CC2)c(OC)c1	ZINC000875101963	GD	On-Demand	Clean	DRD3	44	36
COc1ccc(N2CCN(C(=O)C(=O)NCc3nccs3)CC2)c(OC)c1	ZINC000875101963	GD	On-Demand	Clean	PDGFRB	45	38
O=C(NCc1ccc(N2CCSCC2)cc1)N1C[C@H](O)C[C@H]1C1CC1	ZINC000875102041	FE	On-Demand	Clean	VHL	42	34
O=C(NCc1ccc(N2CCSCC2)cc1)N1C[C@H](O)C[C@@H]1C1CC1	ZINC000875102042	FE	On-Demand	Clean	VHL	42	34
O=C(NCc1ccc(N2CCSCC2)cc1)N1C[C@@H](O)C[C@H]1C1CC1	ZINC000875102043	FE	On-Demand	Clean	VHL	42	34
O=C(NCc1ccc(N2CCSCC2)cc1)N1C[C@@H](O)C[C@@H]1C1CC1	ZINC000875102044	FE	On-Demand	Clean	VHL	42	34
O=C(NCCO)C1CCN(C(=O)NCC2(c3ccccc3)CCOCC2)CC1	ZINC000875102100	GD	On-Demand	Anodyne	KCNA3	47	41
O=C(NCCO)C1CCN(C(=O)NCC2(c3ccccc3)CCOCC2)CC1	ZINC000875102100	GD	On-Demand	Anodyne	CACNA1G	15	45
O=C(NCCO)C1CCN(C(=O)NCC2(c3ccccc3)CCOCC2)CC1	ZINC000875102100	GD	On-Demand	Anodyne	SMO	16	43
COC(=O)N(C)NC(=O)NCC1(c2ccc(F)cc2)CCCC1	ZINC000875102102	DF	On-Demand	Reactive	KCNA3	45	36
COC(=O)N(C)NC(=O)NCC1(c2ccc(F)cc2)CCCC1	ZINC000875102102	DF	On-Demand	Reactive	NMBR	42	33
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)C(=O)NCc2cccc(F)c2F)C1	ZINC000875102143	GD	On-Demand	Anodyne	GPR119	41	61
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)C(=O)NCc2cccc(F)c2F)C1	ZINC000875102144	GD	On-Demand	Anodyne	GPR119	41	61
Cn1nnnc1C1CCN(C(=O)NCC2(N3CCSCC3)CCCC2)CC1	ZINC000875102236	GD	On-Demand	Anodyne	SMO	17	43
Cn1nnnc1C1CCN(C(=O)NCC2(N3CCSCC3)CCCC2)CC1	ZINC000875102236	GD	On-Demand	Anodyne	HCN1	43	33
Cn1nnnc1C1CCN(C(=O)NCC2(N3CCSCC3)CCCC2)CC1	ZINC000875102236	GD	On-Demand	Anodyne	HCN4	40	31
Cn1nc(Cl)c(C(=O)Nc2ccccc2C(=O)N2CCOCC2)c1Cl	ZINC000875102258	GE	On-Demand	Anodyne	G2YM83_BOTF4	53	33
C[C@@H]1CN(C(=O)NCc2cccc(S(N)(=O)=O)c2)Cc2ccccc21	ZINC000875102265	FE	On-Demand	Anodyne	NAMPT	27	47
O=C(NCC1(c2ccccc2)CCOCC1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875102280	GH	On-Demand	Anodyne	KCNA3	43	36
CCC1(CC)CCCN1C(=O)NCc1cccc(S(N)(=O)=O)c1	ZINC000875102281	EE	On-Demand	Anodyne	SLC12A5	66	43
COc1ccccc1[C@H]1CCCN(C(=O)NCCC(=O)N(C)C)CC1	ZINC000875102308	EE	On-Demand	Anodyne	HTR1A	22	40
COc1ccccc1[C@H]1CCCN(C(=O)NCCC(=O)N(C)C)CC1	ZINC000875102308	EE	On-Demand	Anodyne	DRD2	20	44
COc1ccccc1[C@H]1CCCN(C(=O)NCCC(=O)N(C)C)CC1	ZINC000875102308	EE	On-Demand	Anodyne	RBP4	28	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCCC(=O)N(C)C)CC1	ZINC000875102309	EE	On-Demand	Anodyne	HTR1A	22	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCCC(=O)N(C)C)CC1	ZINC000875102309	EE	On-Demand	Anodyne	DRD2	20	44
COc1ccccc1[C@@H]1CCCN(C(=O)NCCC(=O)N(C)C)CC1	ZINC000875102309	EE	On-Demand	Anodyne	RBP4	28	40
NS(=O)(=O)c1cccc(CNC(=O)N2C[C@H]3CC=CC[C@H]3C2)c1	ZINC000875102356	ED	On-Demand	Anodyne	NAMPT	29	40
O=C(NCC1(c2ccccc2)CCOCC1)N1CCC(CO)(CO)CC1	ZINC000875102370	FD	On-Demand	Anodyne	KCNA3	45	39
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F	ZINC000875102381	GH	On-Demand	Reactive	CELA1	42	36
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F	ZINC000875102381	GH	On-Demand	Reactive	ELANE	58	41
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F	ZINC000875102381	GH	On-Demand	Reactive	TRY1_BOVIN	58	36
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F	ZINC000875102381	GH	On-Demand	Reactive	LGMN	77	36
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F	ZINC000875102381	GH	On-Demand	Reactive	HCRTR2	18	40
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccccc1S[C@@H](Cl)C(F)(F)F	ZINC000875102381	GH	On-Demand	Reactive	XIAP	49	44
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F	ZINC000875102382	GH	On-Demand	Reactive	CELA1	42	36
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F	ZINC000875102382	GH	On-Demand	Reactive	ELANE	58	41
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F	ZINC000875102382	GH	On-Demand	Reactive	TRY1_BOVIN	58	36
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F	ZINC000875102382	GH	On-Demand	Reactive	LGMN	77	36
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F	ZINC000875102382	GH	On-Demand	Reactive	HCRTR2	18	40
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccccc1S[C@H](Cl)C(F)(F)F	ZINC000875102382	GH	On-Demand	Reactive	XIAP	49	44
O=C(NC[C@H]1C[C@H](O)C1)NCC1(c2ccccc2)CCOCC1	ZINC000875102396	DD	On-Demand	Anodyne	KCNA3	45	39
COc1ccc(C)cc1CNC(=O)N(C)OCC(F)(F)F	ZINC000875102430	DF	On-Demand	Anodyne	PPARA	17	42
COc1ccc(C)cc1CNC(=O)N(C)OCC(F)(F)F	ZINC000875102430	DF	On-Demand	Anodyne	PPARD	19	41
COc1ccc(C)cc1CNC(=O)N(C)OCC(F)(F)F	ZINC000875102430	DF	On-Demand	Anodyne	MT-ND1	21	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(C(=O)NC)c1	ZINC000875102435	DD	On-Demand	Anodyne	ANPEP	19	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(C(=O)NC)c1	ZINC000875102435	DD	On-Demand	Anodyne	ROCK2	16	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(C(=O)NC)c1	ZINC000875102435	DD	On-Demand	Anodyne	PDS	48	35
O=C(NCCO)C1CCN(C(=O)NCC2(c3ccc(F)cc3)CCCC2)CC1	ZINC000875102446	GE	On-Demand	Anodyne	CACNA1G	43	60
COc1ccc(C)cc1CNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875102466	GH	On-Demand	Anodyne	KCNA3	42	36
COC(=O)N(C)NC(=O)NCc1cc(C)ccc1OC	ZINC000875102492	CD	On-Demand	Reactive	MT-ND1	17	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)c(F)c1	ZINC000875102496	EE	On-Demand	Anodyne	SLC6A4	30	51
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)c(F)c1	ZINC000875102496	EE	On-Demand	Anodyne	SLC6A3	54	51
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)c(F)c1	ZINC000875102497	EE	On-Demand	Anodyne	SLC6A4	30	51
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)c(F)c1	ZINC000875102497	EE	On-Demand	Anodyne	SLC6A3	54	51
COCCN(CC1CCN(C)CC1)C(=O)NCc1cc(C)ccc1OC	ZINC000875102501	FF	On-Demand	Anodyne	ACKR3	63	33
CC[C@@H](NC(=O)NCc1cccc(C(=O)NC)c1)[C@@H](O)c1ccccc1	ZINC000875102508	FE	On-Demand	Anodyne	PDS	53	36
CC[C@@H](NC(=O)NCc1cccc(C(=O)NC)c1)[C@H](O)c1ccccc1	ZINC000875102509	FE	On-Demand	Anodyne	PDS	53	36
O=C(NCC1CCCC1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875102530	FH	On-Demand	Anodyne	GRIN2B	21	40
O=C(NCC1CCCC1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875102530	FH	On-Demand	Anodyne	CPT1A	33	40
O=C(NCC1CCCC1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875102530	FH	On-Demand	Anodyne	SMO	25	44
CCCCCCCNC(=O)C(=O)NCc1nccs1	ZINC000875102549	CD	On-Demand	Mild	MAP1	30	40
CCCCCCCNC(=O)C(=O)NCc1nccs1	ZINC000875102549	CD	On-Demand	Mild	ASAH1	91	38
C[S@](=N)(=O)N1CCN(C(=O)NCC2(N3CCSCC3)CCCC2)CC1	ZINC000875102553	GD	On-Demand	Anodyne	HCN1	49	30
C[S@](=N)(=O)N1CCN(C(=O)NCC2(N3CCSCC3)CCCC2)CC1	ZINC000875102553	GD	On-Demand	Anodyne	HCN4	47	30
Cc1ccccc1CN1CCO[C@@H](CNC(=O)C(=O)NCc2nccs2)C1	ZINC000875102555	GD	On-Demand	Anodyne	PDE8B	26	42
CC[C@@H](NC(=O)C(=O)NCc1nccs1)c1cccc(OC)c1OC	ZINC000875102574	FE	On-Demand	Anodyne	MAP1	43	38
O=C(NCc1ccc(N2CCSCC2)cc1)N1Cc2cccc(O)c2C1	ZINC000875102594	FG	On-Demand	Clean	NAMPT	24	46
CC[C@H](C[C@H](C)O)NC(=O)NCC1(c2ccccc2)CCOCC1	ZINC000875102595	EF	On-Demand	Anodyne	KCNA3	44	39
CC[C@H](C[C@H](C)O)NC(=O)NCC1(c2ccccc2)CCOCC1	ZINC000875102595	EF	On-Demand	Anodyne	ICMT	60	36
NC(=O)C[C@H](NC(=O)c1ccccc1Cl)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875102617	JD	On-Demand	Anodyne	GRB2	45	33
NC(=O)C[C@H](NC(=O)c1ccccc1Cl)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875102617	JD	On-Demand	Anodyne	F2R	50	31
NC(=O)C[C@H](NC(=O)c1ccccc1Cl)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875102617	JD	On-Demand	Anodyne	FURIN	58	44
NC(=O)C[C@H](NC(=O)c1ccccc1Cl)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875102617	JD	On-Demand	Anodyne	DPP7	53	37
NC(=O)C[C@H](NC(=O)c1ccccc1Cl)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875102617	JD	On-Demand	Anodyne	PROC	62	36
NC(=O)C[C@H](NC(=O)c1ccccc1Cl)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875102617	JD	On-Demand	Anodyne	TMPRSS11D	69	37
NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875102618	JD	On-Demand	Anodyne	GRB2	45	33
NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875102618	JD	On-Demand	Anodyne	F2R	50	31
NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875102618	JD	On-Demand	Anodyne	FURIN	58	44
NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875102618	JD	On-Demand	Anodyne	DPP7	53	37
NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875102618	JD	On-Demand	Anodyne	PROC	62	36
NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875102618	JD	On-Demand	Anodyne	TMPRSS11D	69	37
C[C@@H](CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F)N(C)C	ZINC000875102630	EE	On-Demand	Mild	CTSF	46	34
C[C@@H](CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F)N(C)C	ZINC000875102630	EE	On-Demand	Mild	CTSL	18	40
COC(=O)C1(O)CN(C(=O)NCC2(c3ccc(F)cc3)CC2)C1	ZINC000875102669	DC	On-Demand	Anodyne	KCNA3	44	35
CCO[C@H](C(=O)NNc1ccccc1C)C1CCCC1	ZINC000875102680	CG	On-Demand	Reactive	AMY2	45	32
O=C(NCC1(c2ccc(F)cc2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875102682	FG	On-Demand	Anodyne	CACNA1G	16	41
O=C(NCC1(c2ccc(F)cc2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875102683	FG	On-Demand	Anodyne	CACNA1G	16	41
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1cnn(-c2ccccc2)c1C(F)(F)F	ZINC000875102710	II	On-Demand	Anodyne	MST1R	41	39
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1cnn(-c2ccccc2)c1C(F)(F)F	ZINC000875102710	II	On-Demand	Anodyne	MTTP	22	46
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1cnn(-c2ccccc2)c1C(F)(F)F	ZINC000875102710	II	On-Demand	Anodyne	SCD1	17	41
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1cnn(-c2ccccc2)c1C(F)(F)F	ZINC000875102710	II	On-Demand	Anodyne	SCD	20	41
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1cnn(-c2ccccc2)c1C(F)(F)F	ZINC000875102710	II	On-Demand	Anodyne	NAMPT	40	41
NS(=O)(=O)c1cccc(CNC(=O)N2CC[C@@H]3CSC[C@H]3C2)c1	ZINC000875102721	FD	On-Demand	Anodyne	ST14	51	32
NS(=O)(=O)c1cccc(CNC(=O)N2CC[C@@H]3CSC[C@@H]3C2)c1	ZINC000875102722	FD	On-Demand	Anodyne	ST14	51	32
NS(=O)(=O)c1cccc(CNC(=O)N2CC[C@H]3CSC[C@H]3C2)c1	ZINC000875102723	FD	On-Demand	Anodyne	ST14	51	32
NS(=O)(=O)c1cccc(CNC(=O)N2CC[C@H]3CSC[C@@H]3C2)c1	ZINC000875102724	FD	On-Demand	Anodyne	ST14	51	32
NS(=O)(=O)c1cccc(CNC(=O)N2CCC[C@@](F)(c3ccccc3)C2)c1	ZINC000875102749	GF	On-Demand	Anodyne	SLC12A5	58	39
NS(=O)(=O)c1cccc(CNC(=O)N2CCC[C@](F)(c3ccccc3)C2)c1	ZINC000875102750	GF	On-Demand	Anodyne	SLC12A5	58	39
COC(=O)C1(O)CN(C(=O)NCC2(c3ccccc3)CCOCC2)C1	ZINC000875102758	EC	On-Demand	Anodyne	KCNA3	51	43
COC(=O)C1(O)CN(C(=O)NCC2(c3ccccc3)CCOCC2)C1	ZINC000875102758	EC	On-Demand	Anodyne	ICMT	43	31
O=C(NCC1(c2ccccc2)CCOCC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875102763	GH	On-Demand	Anodyne	KCNA3	48	37
O=C(NCC1(c2ccccc2)CCOCC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875102763	GH	On-Demand	Anodyne	EPHX2	30	40
O=C(NCC1(c2ccccc2)CCOCC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875102763	GH	On-Demand	Anodyne	SMO	22	47
O=C(NCC1(c2ccccc2)CCOCC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875102764	GH	On-Demand	Anodyne	KCNA3	48	37
O=C(NCC1(c2ccccc2)CCOCC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875102764	GH	On-Demand	Anodyne	EPHX2	30	40
O=C(NCC1(c2ccccc2)CCOCC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875102764	GH	On-Demand	Anodyne	SMO	22	47
O=C(NCC[C@H](O)C1CCCC1)NCC1(c2ccccc2)CCOCC1	ZINC000875102841	FF	On-Demand	Anodyne	KCNA3	46	38
O=C(NCC[C@@H](O)C1CCCC1)NCC1(c2ccccc2)CCOCC1	ZINC000875102842	FF	On-Demand	Anodyne	KCNA3	46	38
COC(=O)[C@@]12C[C@@H](NC(=O)NCC3(c4ccc(F)cc4)CC3)C[C@@H]1C2	ZINC000875102848	EE	On-Demand	Anodyne	KCNA3	45	38
COC(=O)N(C)NC(=O)NCC1(c2ccc(F)cc2)CC1	ZINC000875102849	CD	On-Demand	Reactive	KCNA3	46	37
CC(C)[C@H]1CC[C@@H](C)C[C@@H]1OCC(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875102852	HI	On-Demand	Anodyne	SERPINE1	49	47
CC(C)[C@H]1CC[C@@H](C)C[C@@H]1OCC(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875102852	HI	On-Demand	Anodyne	L3MBTL3	45	35
CC(C)[C@H]1CC[C@@H](C)C[C@H]1OCC(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875102853	HI	On-Demand	Anodyne	SERPINE1	49	47
CC(C)[C@H]1CC[C@@H](C)C[C@H]1OCC(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875102853	HI	On-Demand	Anodyne	L3MBTL3	45	35
O=C(NCC1(c2ccccc2)CCOCC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875102866	GG	On-Demand	Anodyne	KCNA3	45	34
O=C(NCC1(c2ccccc2)CCOCC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875102866	GG	On-Demand	Anodyne	SMO	18	45
O=C(NCC1(c2ccccc2)CCOCC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875102867	GG	On-Demand	Anodyne	KCNA3	45	34
O=C(NCC1(c2ccccc2)CCOCC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875102867	GG	On-Demand	Anodyne	SMO	18	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1(c2ccc(F)cc2)CC1	ZINC000875102874	EF	On-Demand	Anodyne	SLC6A4	20	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1(c2ccc(F)cc2)CC1	ZINC000875102874	EF	On-Demand	Anodyne	SLC6A3	41	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1(c2ccc(F)cc2)CC1	ZINC000875102874	EF	On-Demand	Anodyne	KCNA3	44	35
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1(c2ccc(F)cc2)CC1	ZINC000875102874	EF	On-Demand	Anodyne	CACNA1G	16	41
O=C(NCCN1CC[C@H](O)C1)NCc1ccc(N2CCSCC2)cc1	ZINC000875102895	FD	On-Demand	Clean	CCR3	15	42
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc(N2CCSCC2)cc1	ZINC000875102896	FD	On-Demand	Clean	CCR3	15	42
COc1cccc(C(C)(C)C(=O)NNc2ccccc2C)c1	ZINC000875102898	CG	On-Demand	Reactive	AKR1C3	18	40
COc1cccc(C(C)(C)C(=O)NNc2ccccc2C)c1	ZINC000875102898	CG	On-Demand	Reactive	AKR1C2	40	40
COCCN(CC1CCN(C)CC1)C(=O)NCC1(c2ccc(F)cc2)CC1	ZINC000875102909	GF	On-Demand	Anodyne	KCNA3	44	35
Cc1nnc(NNC(=O)NCC2(c3ccccc3)CCOCC2)n1C	ZINC000875102927	ED	On-Demand	Reactive	KCNA3	46	39
Cc1nnc(NNC(=O)NCC2(c3ccccc3)CCOCC2)n1C	ZINC000875102927	ED	On-Demand	Reactive	SOAT1	15	42
NS(=O)(=O)c1cccc(CNC(=O)N2CC[C@@]3(CCc4ccccc43)C2)c1	ZINC000875102946	GE	On-Demand	Anodyne	OXTR	49	37
NS(=O)(=O)c1cccc(CNC(=O)N2CC[C@]3(CCc4ccccc43)C2)c1	ZINC000875102947	GE	On-Demand	Anodyne	OXTR	49	37
O=C(NCC1(c2ccccc2)CCOCC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875102961	FG	On-Demand	Anodyne	KCNA3	43	36
CCCCCCCNC(=O)C(=O)NCc1nnc2n1CCCC2	ZINC000875102964	DD	On-Demand	Mild	ASAH1	60	31
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2(c3ccccc3)CCOCC2)C1	ZINC000875102975	FF	On-Demand	Anodyne	KCNA3	49	38
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2(c3ccccc3)CCOCC2)C1	ZINC000875102975	FF	On-Demand	Anodyne	SOAT1	15	40
O=C(NCC1(c2ccccc2)CCOCC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875102977	EG	On-Demand	Anodyne	KCNA3	44	37
O=C(NCC1(c2ccccc2)CCOCC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875102978	EG	On-Demand	Anodyne	KCNA3	44	37
O=C(NCC1(c2ccccc2)CCOCC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875102979	EG	On-Demand	Anodyne	KCNA3	44	37
O=C(NCC1(c2ccccc2)CCOCC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875102980	EG	On-Demand	Anodyne	KCNA3	44	37
CC(C)(C)OC(=O)N[C@@H](CNC(=O)C(=O)NCc1cccc(F)c1F)C1CC1	ZINC000875102990	GE	On-Demand	Anodyne	PAPA1_CARPA	30	42
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875102996	FF	On-Demand	Anodyne	ACE	43	35
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875102996	FF	On-Demand	Anodyne	MME	68	38
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875102996	FF	On-Demand	Anodyne	ANPEP	47	40
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875102996	FF	On-Demand	Anodyne	MMP3	43	40
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875102996	FF	On-Demand	Anodyne	FURIN	45	34
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875102996	FF	On-Demand	Anodyne	CAPN1	42	41
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875102996	FF	On-Demand	Anodyne	CAPN2	88	41
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875102996	FF	On-Demand	Anodyne	ACE2	50	34
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875102996	FF	On-Demand	Anodyne	AMP1_PLAFQ	58	38
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875102996	FF	On-Demand	Anodyne	PDS	56	36
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875102997	FF	On-Demand	Anodyne	ACE	43	35
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875102997	FF	On-Demand	Anodyne	MME	68	38
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875102997	FF	On-Demand	Anodyne	ANPEP	47	40
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875102997	FF	On-Demand	Anodyne	MMP3	43	40
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875102997	FF	On-Demand	Anodyne	FURIN	45	34
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875102997	FF	On-Demand	Anodyne	CAPN1	42	41
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875102997	FF	On-Demand	Anodyne	CAPN2	88	41
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875102997	FF	On-Demand	Anodyne	ACE2	50	34
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875102997	FF	On-Demand	Anodyne	AMP1_PLAFQ	58	38
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875102997	FF	On-Demand	Anodyne	PDS	56	36
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875102998	FF	On-Demand	Anodyne	ACE	43	35
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875102998	FF	On-Demand	Anodyne	MME	68	38
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875102998	FF	On-Demand	Anodyne	ANPEP	47	40
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875102998	FF	On-Demand	Anodyne	MMP3	43	40
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875102998	FF	On-Demand	Anodyne	FURIN	45	34
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875102998	FF	On-Demand	Anodyne	CAPN1	42	41
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875102998	FF	On-Demand	Anodyne	CAPN2	88	41
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875102998	FF	On-Demand	Anodyne	ACE2	50	34
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875102998	FF	On-Demand	Anodyne	AMP1_PLAFQ	58	38
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875102998	FF	On-Demand	Anodyne	PDS	56	36
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875102999	FF	On-Demand	Anodyne	ACE	43	35
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875102999	FF	On-Demand	Anodyne	MME	68	38
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875102999	FF	On-Demand	Anodyne	ANPEP	47	40
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875102999	FF	On-Demand	Anodyne	MMP3	43	40
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875102999	FF	On-Demand	Anodyne	FURIN	45	34
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875102999	FF	On-Demand	Anodyne	CAPN1	42	41
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875102999	FF	On-Demand	Anodyne	CAPN2	88	41
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875102999	FF	On-Demand	Anodyne	ACE2	50	34
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875102999	FF	On-Demand	Anodyne	AMP1_PLAFQ	58	38
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875102999	FF	On-Demand	Anodyne	PDS	56	36
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ncc(-c3ccccc3)o2)C1	ZINC000875103044	FF	On-Demand	Anodyne	NPPA	22	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1ccccc1)C(C)C	ZINC000875103058	EG	On-Demand	Anodyne	SLC6A4	29	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1ccccc1)C(C)C	ZINC000875103058	EG	On-Demand	Anodyne	SLC6A3	68	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1ccccc1)C(C)C	ZINC000875103059	EG	On-Demand	Anodyne	SLC6A4	29	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1ccccc1)C(C)C	ZINC000875103059	EG	On-Demand	Anodyne	SLC6A3	68	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1ccccc1)C(C)C	ZINC000875103060	EG	On-Demand	Anodyne	SLC6A4	29	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1ccccc1)C(C)C	ZINC000875103060	EG	On-Demand	Anodyne	SLC6A3	68	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1ccccc1)C(C)C	ZINC000875103061	EG	On-Demand	Anodyne	SLC6A4	29	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1ccccc1)C(C)C	ZINC000875103061	EG	On-Demand	Anodyne	SLC6A3	68	45
C[C@H](O)c1ccc(CNC(=O)C(=O)N2CCc3nc(C(C)(C)C)ncc3C2)cc1	ZINC000875103063	GE	On-Demand	Anodyne	MAPK1	37	41
COCC(C)(C)CCNC(=O)C(=O)N[C@H](c1ccccc1)C1CCCC1	ZINC000875103065	FG	On-Demand	Anodyne	AMY2	44	30
COCC(C)(C)CCNC(=O)C(=O)N[C@@H](c1ccccc1)C1CCCC1	ZINC000875103066	FG	On-Demand	Anodyne	AMY2	44	30
C[C@H](O)c1ccc(CNC(=O)C(=O)N2CCC(N3CCN(C)CC3)CC2)cc1	ZINC000875103073	GC	On-Demand	Anodyne	L3MBTL3	60	40
CN1CCN(C(=O)NCc2ncc(-c3ccccc3)o2)CCC1(C)C	ZINC000875103132	EF	On-Demand	Anodyne	NPPA	24	44
C[C@H](O)c1ccc(CNC(=O)C(=O)N2C[C@H]3C[C@@H](O)C[C@H]2C3)cc1	ZINC000875103310	EC	On-Demand	Anodyne	VHL	42	33
C[C@H](O)c1ccc(CNC(=O)C(=O)N2C[C@H]3C[C@H](O)C[C@H]2C3)cc1	ZINC000875103312	EC	On-Demand	Anodyne	VHL	42	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ncc(-c2ccccc2)o1	ZINC000875103331	FF	On-Demand	Anodyne	SLC6A4	25	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ncc(-c2ccccc2)o1	ZINC000875103331	FF	On-Demand	Anodyne	SLC6A3	53	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ncc(-c2ccccc2)o1	ZINC000875103332	FF	On-Demand	Anodyne	SLC6A4	25	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ncc(-c2ccccc2)o1	ZINC000875103332	FF	On-Demand	Anodyne	SLC6A3	53	42
CC[C@@H](NC(C)=O)C(=O)NNc1ccccc1C	ZINC000875103341	BD	On-Demand	Reactive	PAPA1_CARPA	23	40
CCOC(=O)[C@@H]1CN(C(=O)NCc2ncc(-c3ccccc3)o2)CCC1(F)F	ZINC000875103353	GG	On-Demand	Anodyne	NPPA	29	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc([C@H](C)O)cc2)C1	ZINC000875103361	ED	On-Demand	Anodyne	DPP7	55	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc([C@H](C)O)cc2)C1	ZINC000875103362	ED	On-Demand	Anodyne	DPP7	55	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc([C@@H](C)O)cc2)C1	ZINC000875103363	ED	On-Demand	Anodyne	DPP7	55	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc([C@@H](C)O)cc2)C1	ZINC000875103364	ED	On-Demand	Anodyne	DPP7	55	35
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3ccc([C@@H](C)O)cc3)C2)cc1	ZINC000875103371	GE	On-Demand	Anodyne	DRD4	30	45
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3ccc([C@@H](C)O)cc3)C2)cc1	ZINC000875103371	GE	On-Demand	Anodyne	SIGMAR1	21	48
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3ccc([C@@H](C)O)cc3)C2)cc1	ZINC000875103371	GE	On-Demand	Anodyne	CCR3	27	40
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3ccc([C@@H](C)O)cc3)C2)cc1	ZINC000875103371	GE	On-Demand	Anodyne	CCR2	22	48
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3ccc([C@@H](C)O)cc3)C2)cc1	ZINC000875103371	GE	On-Demand	Anodyne	MCHR1	36	52
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3ccc([C@@H](C)O)cc3)C2)cc1	ZINC000875103371	GE	On-Demand	Anodyne	BIRC2	44	39
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3ccc([C@H](C)O)cc3)C2)cc1	ZINC000875103372	GE	On-Demand	Anodyne	DRD4	30	45
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3ccc([C@H](C)O)cc3)C2)cc1	ZINC000875103372	GE	On-Demand	Anodyne	SIGMAR1	21	48
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3ccc([C@H](C)O)cc3)C2)cc1	ZINC000875103372	GE	On-Demand	Anodyne	CCR3	27	40
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3ccc([C@H](C)O)cc3)C2)cc1	ZINC000875103372	GE	On-Demand	Anodyne	CCR2	22	48
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3ccc([C@H](C)O)cc3)C2)cc1	ZINC000875103372	GE	On-Demand	Anodyne	MCHR1	36	52
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3ccc([C@H](C)O)cc3)C2)cc1	ZINC000875103372	GE	On-Demand	Anodyne	BIRC2	44	39
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3ccc([C@@H](C)O)cc3)C2)cc1	ZINC000875103373	GE	On-Demand	Anodyne	DRD4	30	45
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3ccc([C@@H](C)O)cc3)C2)cc1	ZINC000875103373	GE	On-Demand	Anodyne	SIGMAR1	21	48
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3ccc([C@@H](C)O)cc3)C2)cc1	ZINC000875103373	GE	On-Demand	Anodyne	CCR3	27	40
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3ccc([C@@H](C)O)cc3)C2)cc1	ZINC000875103373	GE	On-Demand	Anodyne	CCR2	22	48
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3ccc([C@@H](C)O)cc3)C2)cc1	ZINC000875103373	GE	On-Demand	Anodyne	MCHR1	36	52
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3ccc([C@@H](C)O)cc3)C2)cc1	ZINC000875103373	GE	On-Demand	Anodyne	BIRC2	44	39
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3ccc([C@H](C)O)cc3)C2)cc1	ZINC000875103374	GE	On-Demand	Anodyne	DRD4	30	45
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3ccc([C@H](C)O)cc3)C2)cc1	ZINC000875103374	GE	On-Demand	Anodyne	SIGMAR1	21	48
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3ccc([C@H](C)O)cc3)C2)cc1	ZINC000875103374	GE	On-Demand	Anodyne	CCR3	27	40
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3ccc([C@H](C)O)cc3)C2)cc1	ZINC000875103374	GE	On-Demand	Anodyne	CCR2	22	48
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3ccc([C@H](C)O)cc3)C2)cc1	ZINC000875103374	GE	On-Demand	Anodyne	MCHR1	36	52
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3ccc([C@H](C)O)cc3)C2)cc1	ZINC000875103374	GE	On-Demand	Anodyne	BIRC2	44	39
CCCCCCCNC(=O)C(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875103387	DE	On-Demand	Mild	GRIA1	43	36
CCCCCCCNC(=O)C(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875103387	DE	On-Demand	Mild	S1PR2	61	43
CCCCCCCNC(=O)C(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875103387	DE	On-Demand	Mild	ASAH1	103	39
CCCCCCCNC(=O)C(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875103387	DE	On-Demand	Mild	CQSS	40	33
CCCCCCCNC(=O)C(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875103388	DE	On-Demand	Mild	GRIA1	43	36
CCCCCCCNC(=O)C(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875103388	DE	On-Demand	Mild	S1PR2	61	43
CCCCCCCNC(=O)C(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875103388	DE	On-Demand	Mild	ASAH1	103	39
CCCCCCCNC(=O)C(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875103388	DE	On-Demand	Mild	CQSS	40	33
COC(=O)N(C)NC(=O)NC[C@@H](c1ccccc1)C(C)C	ZINC000875103413	CE	On-Demand	Reactive	KCNA5	17	42
COC(=O)N(C)NC(=O)NC[C@H](c1ccccc1)C(C)C	ZINC000875103414	CE	On-Demand	Reactive	KCNA5	17	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(N2CCSCC2)cc1	ZINC000875103421	GE	On-Demand	Clean	SLC6A3	40	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(N2CCSCC2)cc1	ZINC000875103422	GE	On-Demand	Clean	SLC6A3	40	37
CON(C)C(=O)c1cc(S(=O)(=O)N(Cc2ccccc2)c2ccccc2Cl)ccc1Cl	ZINC000875103480	JK	On-Demand	Anodyne	MMP9	17	48
CON(C)C(=O)c1cc(S(=O)(=O)N(Cc2ccccc2)c2ccccc2Cl)ccc1Cl	ZINC000875103480	JK	On-Demand	Anodyne	TRPM8	44	33
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1ccc(-n2cncn2)nc1	ZINC000875103489	GD	On-Demand	Anodyne	NAMPT	50	43
CC[C@H](C)NC(=O)CCNC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875103542	GD	On-Demand	Anodyne	NPY2R	65	39
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2Cc3ccccc32)C1	ZINC000875103550	DD	On-Demand	Anodyne	MTNR1B	17	44
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2Cc3ccccc32)C1	ZINC000875103551	DD	On-Demand	Anodyne	MTNR1B	17	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2Cc3ccccc32)C1	ZINC000875103552	DD	On-Demand	Anodyne	MTNR1B	17	44
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2Cc3ccccc32)C1	ZINC000875103553	DD	On-Demand	Anodyne	MTNR1B	17	44
O=C(NCc1cccc(Oc2ccccc2)c1)N1CCC2(CCNC2=O)CC1	ZINC000875103560	GG	On-Demand	Anodyne	CACNA1H	46	33
O=C(NCc1cccc(Oc2ccccc2)c1)N1CCC2(CCNC2=O)CC1	ZINC000875103560	GG	On-Demand	Anodyne	FAAH	24	46
O=C(NCc1cccc(Oc2ccccc2)c1)N1CCC2(CCNC2=O)CC1	ZINC000875103560	GG	On-Demand	Anodyne	AMP1_PLAFQ	22	41
O=C(NCc1cccc(Oc2ccccc2)c1)N1CCC2(CCNC2=O)CC1	ZINC000875103560	GG	On-Demand	Anodyne	CCR8	27	44
O=C(NCc1cccc(Oc2ccccc2)c1)N1CCC2(CCNC2=O)CC1	ZINC000875103560	GG	On-Demand	Anodyne	NPSR1	25	40
O=C(NCc1cccc(Oc2ccccc2)c1)N1CCC2(CCNC2=O)CC1	ZINC000875103560	GG	On-Demand	Anodyne	CRTM	43	36
CCCCCCCNC(=O)C(=O)NC[C@@H]1Cc2ccccc21	ZINC000875103566	DF	On-Demand	Mild	MTNR1A	25	51
CCCCCCCNC(=O)C(=O)NC[C@@H]1Cc2ccccc21	ZINC000875103566	DF	On-Demand	Mild	MTNR1B	27	51
CCCCCCCNC(=O)C(=O)NC[C@@H]1Cc2ccccc21	ZINC000875103566	DF	On-Demand	Mild	ASAH1	89	36
CCCCCCCNC(=O)C(=O)NC[C@H]1Cc2ccccc21	ZINC000875103567	DF	On-Demand	Mild	MTNR1A	25	51
CCCCCCCNC(=O)C(=O)NC[C@H]1Cc2ccccc21	ZINC000875103567	DF	On-Demand	Mild	MTNR1B	27	51
CCCCCCCNC(=O)C(=O)NC[C@H]1Cc2ccccc21	ZINC000875103567	DF	On-Demand	Mild	ASAH1	89	36
N#Cc1ccc(N2CCN(C(=O)C(=O)NC[C@H]3Cc4ccccc43)CC2)cc1	ZINC000875103572	FD	On-Demand	Mild	SSTR1	44	40
N#Cc1ccc(N2CCN(C(=O)C(=O)NC[C@@H]3Cc4ccccc43)CC2)cc1	ZINC000875103573	FD	On-Demand	Mild	SSTR1	44	40
O=C(NCc1ncc(-c2ccccc2)o1)NC[C@H]1C[C@H](O)C1	ZINC000875103663	DD	On-Demand	Anodyne	NPPA	22	40
CONC(=O)C1CCN(C(=O)NCc2cccc(Oc3ccccc3)c2)CC1	ZINC000875103715	GG	On-Demand	Anodyne	F2	19	46
CONC(=O)C1CCN(C(=O)NCc2cccc(Oc3ccccc3)c2)CC1	ZINC000875103715	GG	On-Demand	Anodyne	FKBP1A	31	48
CONC(=O)C1CCN(C(=O)NCc2cccc(Oc3ccccc3)c2)CC1	ZINC000875103715	GG	On-Demand	Anodyne	LTA4H	22	40
CONC(=O)C1CCN(C(=O)NCc2cccc(Oc3ccccc3)c2)CC1	ZINC000875103715	GG	On-Demand	Anodyne	MMP13	28	42
CONC(=O)C1CCN(C(=O)NCc2cccc(Oc3ccccc3)c2)CC1	ZINC000875103715	GG	On-Demand	Anodyne	MTNR1B	18	41
CONC(=O)C1CCN(C(=O)NCc2cccc(Oc3ccccc3)c2)CC1	ZINC000875103715	GG	On-Demand	Anodyne	FAAH	29	47
CONC(=O)C1CCN(C(=O)NCc2cccc(Oc3ccccc3)c2)CC1	ZINC000875103715	GG	On-Demand	Anodyne	EPHX2	33	42
CONC(=O)C1CCN(C(=O)NCc2cccc(Oc3ccccc3)c2)CC1	ZINC000875103715	GG	On-Demand	Anodyne	AMP1_PLAFQ	28	44
CONC(=O)C1CCN(C(=O)NCc2cccc(Oc3ccccc3)c2)CC1	ZINC000875103715	GG	On-Demand	Anodyne	CCR8	31	40
CONC(=O)C1CCN(C(=O)NCc2cccc(Oc3ccccc3)c2)CC1	ZINC000875103715	GG	On-Demand	Anodyne	CRTM	49	38
COc1ccc([C@@H]2CN(C(=O)C(=O)NC[C@@H]3Cc4ccccc43)CCO2)cc1	ZINC000875103759	GE	On-Demand	Anodyne	MTNR1A	15	44
COc1ccc([C@@H]2CN(C(=O)C(=O)NC[C@@H]3Cc4ccccc43)CCO2)cc1	ZINC000875103759	GE	On-Demand	Anodyne	MTNR1B	21	41
COc1ccc([C@@H]2CN(C(=O)C(=O)NC[C@H]3Cc4ccccc43)CCO2)cc1	ZINC000875103760	GE	On-Demand	Anodyne	MTNR1A	15	44
COc1ccc([C@@H]2CN(C(=O)C(=O)NC[C@H]3Cc4ccccc43)CCO2)cc1	ZINC000875103760	GE	On-Demand	Anodyne	MTNR1B	21	41
O=C(NCCOC1CCCC1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875103778	GE	On-Demand	Anodyne	ETHR	61	51
CC[C@H](C[C@H](C)O)NC(=O)NCc1ncc(-c2ccccc2)o1	ZINC000875103885	DF	On-Demand	Anodyne	NPPA	23	43
O=C(NCc1cccc(Oc2ccccc2)c1)N1CCC(CO)(CO)CC1	ZINC000875103908	FF	On-Demand	Anodyne	HRH2	17	41
O=C(NCc1cccc(Oc2ccccc2)c1)N1CCC(CO)(CO)CC1	ZINC000875103908	FF	On-Demand	Anodyne	MMP13	22	40
O=C(NCc1cccc(Oc2ccccc2)c1)N1CCC(CO)(CO)CC1	ZINC000875103908	FF	On-Demand	Anodyne	FAAH	31	52
O=C(NCc1cccc(Oc2ccccc2)c1)N1CCC(CO)(CO)CC1	ZINC000875103908	FF	On-Demand	Anodyne	S1PR2	25	40
O=C(NCc1cccc(Oc2ccccc2)c1)N1CCC(CO)(CO)CC1	ZINC000875103908	FF	On-Demand	Anodyne	EPHX2	18	44
O=C(NCc1cccc(Oc2ccccc2)c1)N1CCC(CO)(CO)CC1	ZINC000875103908	FF	On-Demand	Anodyne	AMP1_PLAFQ	27	46
O=C(NCc1cccc(Oc2ccccc2)c1)N1CCC(CO)(CO)CC1	ZINC000875103908	FF	On-Demand	Anodyne	CCR8	28	47
O=C(NCc1cccc(Oc2ccccc2)c1)N1CCC(CO)(CO)CC1	ZINC000875103908	FF	On-Demand	Anodyne	CRTM	52	40
O=C(NCc1cccc(Oc2ccccc2)c1)N1CCC(CO)(CO)CC1	ZINC000875103908	FF	On-Demand	Anodyne	PDS	43	33
CCOc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)N(C)OC)c2C)cc1	ZINC000875103911	FG	On-Demand	Reactive	CACNA2D1	42	35
CCOc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)N(C)OC)c2C)cc1	ZINC000875103912	FG	On-Demand	Reactive	CACNA2D1	42	35
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1Cc2ccccc21	ZINC000875103962	DD	On-Demand	Anodyne	MTNR1A	19	44
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1Cc2ccccc21	ZINC000875103962	DD	On-Demand	Anodyne	MTNR1B	24	44
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1Cc2ccccc21	ZINC000875103963	DD	On-Demand	Anodyne	MTNR1A	19	44
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1Cc2ccccc21	ZINC000875103963	DD	On-Demand	Anodyne	MTNR1B	24	44
CN1CCN(C2CCN(C(=O)C(=O)NC[C@@H]3Cc4ccccc43)CC2)CC1	ZINC000875103991	FC	On-Demand	Anodyne	L3MBTL3	67	40
CN1CCN(C2CCN(C(=O)C(=O)NC[C@H]3Cc4ccccc43)CC2)CC1	ZINC000875103992	FC	On-Demand	Anodyne	L3MBTL3	67	40
O=CN1CCCN(C(=O)NCc2cccc(Oc3ccccc3)c2)CC1	ZINC000875103993	FF	On-Demand	Anodyne	FAAH	31	53
O=CN1CCCN(C(=O)NCc2cccc(Oc3ccccc3)c2)CC1	ZINC000875103993	FF	On-Demand	Anodyne	AMP1_PLAFQ	24	44
O=CN1CCCN(C(=O)NCc2cccc(Oc3ccccc3)c2)CC1	ZINC000875103993	FF	On-Demand	Anodyne	CRTM	51	41
O=CN1CCCN(C(=O)NCc2cccc(Oc3ccccc3)c2)CC1	ZINC000875103993	FF	On-Demand	Anodyne	PDS	44	32
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1Cc2ccccc21	ZINC000875104004	DC	On-Demand	Mild	MTNR1A	15	41
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1Cc2ccccc21	ZINC000875104004	DC	On-Demand	Mild	MTNR1B	19	41
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1Cc2ccccc21	ZINC000875104005	DC	On-Demand	Mild	MTNR1A	15	41
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1Cc2ccccc21	ZINC000875104005	DC	On-Demand	Mild	MTNR1B	19	41
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1Cc2ccccc21	ZINC000875104006	DC	On-Demand	Mild	MTNR1A	15	41
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1Cc2ccccc21	ZINC000875104006	DC	On-Demand	Mild	MTNR1B	19	41
CON(C)C(=O)c1cc(Br)ccc1OCc1ccccc1	ZINC000875104028	FH	On-Demand	Anodyne	PTGER2	17	42
CON(C)C(=O)c1cc(Br)ccc1OCc1ccccc1	ZINC000875104028	FH	On-Demand	Anodyne	PTGER1	70	45
CON(C)C(=O)c1cc(Br)ccc1OCc1ccccc1	ZINC000875104028	FH	On-Demand	Anodyne	PTGER3	16	42
C[C@H](O)c1ccc(CNC(=O)C(=O)N2CCc3nc(C4CC4)ncc3C2)cc1	ZINC000875104048	GD	On-Demand	Anodyne	MAPK1	42	40
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1Cc2ccccc21	ZINC000875104107	DC	On-Demand	Mild	MTNR1A	15	41
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1Cc2ccccc21	ZINC000875104107	DC	On-Demand	Mild	MTNR1B	19	41
O=C(NCC1CCC1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875104123	DG	On-Demand	Anodyne	F2	32	48
O=C(NCC1CCC1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875104123	DG	On-Demand	Anodyne	PRSS1	15	44
O=C(NCC1CCC1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875104123	DG	On-Demand	Anodyne	FKBP1A	34	41
O=C(NCC1CCC1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875104123	DG	On-Demand	Anodyne	CPT1A	76	34
O=C(NCC1CCC1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875104123	DG	On-Demand	Anodyne	PREP	40	36
O=C(NCC1CCC1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875104127	DG	On-Demand	Anodyne	F2	32	48
O=C(NCC1CCC1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875104127	DG	On-Demand	Anodyne	PRSS1	15	44
O=C(NCC1CCC1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875104127	DG	On-Demand	Anodyne	FKBP1A	34	41
O=C(NCC1CCC1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875104127	DG	On-Demand	Anodyne	CPT1A	76	34
O=C(NCC1CCC1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875104127	DG	On-Demand	Anodyne	PREP	40	36
O=C(NCC1CCC1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875104129	DG	On-Demand	Anodyne	F2	32	48
O=C(NCC1CCC1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875104129	DG	On-Demand	Anodyne	PRSS1	15	44
O=C(NCC1CCC1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875104129	DG	On-Demand	Anodyne	FKBP1A	34	41
O=C(NCC1CCC1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875104129	DG	On-Demand	Anodyne	CPT1A	76	34
O=C(NCC1CCC1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875104129	DG	On-Demand	Anodyne	PREP	40	36
O=C(NCC1CCC1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875104133	DG	On-Demand	Anodyne	F2	32	48
O=C(NCC1CCC1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875104133	DG	On-Demand	Anodyne	PRSS1	15	44
O=C(NCC1CCC1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875104133	DG	On-Demand	Anodyne	FKBP1A	34	41
O=C(NCC1CCC1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875104133	DG	On-Demand	Anodyne	CPT1A	76	34
O=C(NCC1CCC1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875104133	DG	On-Demand	Anodyne	PREP	40	36
CC[C@H](C)NC(=O)CCNC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875104187	GD	On-Demand	Anodyne	ACE	31	42
CC[C@H](C)NC(=O)CCNC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875104189	GD	On-Demand	Anodyne	ACE	31	42
CC[C@H](C)NC(=O)CCNC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875104192	GD	On-Demand	Anodyne	ACE	31	42
CC[C@H](C)NC(=O)CCNC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875104193	GD	On-Demand	Anodyne	ACE	31	42
O=C(NCCCCC1CC1)C(=O)NC[C@@H]1Cc2ccccc21	ZINC000875104240	DE	On-Demand	Anodyne	MTNR1A	19	44
O=C(NCCCCC1CC1)C(=O)NC[C@@H]1Cc2ccccc21	ZINC000875104240	DE	On-Demand	Anodyne	MTNR1B	18	44
O=C(NCc1ncc(-c2ccccc2)o1)N1CCC(CO)(CO)CC1	ZINC000875104242	ED	On-Demand	Anodyne	NPPA	23	42
O=C(NCCCCC1CC1)C(=O)NC[C@H]1Cc2ccccc21	ZINC000875104243	DE	On-Demand	Anodyne	MTNR1A	19	44
O=C(NCCCCC1CC1)C(=O)NC[C@H]1Cc2ccccc21	ZINC000875104243	DE	On-Demand	Anodyne	MTNR1B	18	44
CCOC(=O)N[C@@H](CNC(=O)N1CC=CC1)CC(C)C	ZINC000875104247	CD	On-Demand	Anodyne	CAPN2	67	33
CCOC(=O)N[C@H](CNC(=O)N1CC=CC1)CC(C)C	ZINC000875104249	CD	On-Demand	Anodyne	CAPN2	67	33
C[C@H](O)c1ccc(CNC(=O)C(=O)NCc2ccccc2CC(F)(F)F)cc1	ZINC000875104260	GF	On-Demand	Anodyne	TRPV1	46	34
C[C@H](O)c1ccc(CNC(=O)C(=O)NCc2ccccc2CC(F)(F)F)cc1	ZINC000875104260	GF	On-Demand	Anodyne	AMP1_PLAFQ	50	38
C[C@H](O)c1ccc(CNC(=O)C(=O)NCCn2ccc(C(F)(F)F)n2)cc1	ZINC000875104290	GD	On-Demand	Anodyne	TRPV1	40	32
C[C@H](O)c1ccc(CNC(=O)C(=O)NCCn2ccc(C(F)(F)F)n2)cc1	ZINC000875104290	GD	On-Demand	Anodyne	CARM1	40	34
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@@H]1CCCOC1	ZINC000875104299	GD	On-Demand	Anodyne	CHRM2	15	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@@H]1CCCOC1	ZINC000875104299	GD	On-Demand	Anodyne	DRD2	24	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@@H]1CCCOC1	ZINC000875104299	GD	On-Demand	Anodyne	DRD4	42	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@@H]1CCCOC1	ZINC000875104299	GD	On-Demand	Anodyne	ACHE	63	59
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@@H]1CCCOC1	ZINC000875104299	GD	On-Demand	Anodyne	DRD3	20	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@@H]1CCCOC1	ZINC000875104299	GD	On-Demand	Anodyne	HTR4	45	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@@H]1CCCOC1	ZINC000875104299	GD	On-Demand	Anodyne	CHRM3	18	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@@H]1CCCOC1	ZINC000875104299	GD	On-Demand	Anodyne	SIGMAR1	58	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@@H]1CCCOC1	ZINC000875104299	GD	On-Demand	Anodyne	CACNA1I	55	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@H]1CCCOC1	ZINC000875104302	GD	On-Demand	Anodyne	CHRM2	15	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@H]1CCCOC1	ZINC000875104302	GD	On-Demand	Anodyne	DRD2	24	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@H]1CCCOC1	ZINC000875104302	GD	On-Demand	Anodyne	DRD4	42	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@H]1CCCOC1	ZINC000875104302	GD	On-Demand	Anodyne	ACHE	63	59
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@H]1CCCOC1	ZINC000875104302	GD	On-Demand	Anodyne	DRD3	20	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@H]1CCCOC1	ZINC000875104302	GD	On-Demand	Anodyne	HTR4	45	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@H]1CCCOC1	ZINC000875104302	GD	On-Demand	Anodyne	CHRM3	18	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@H]1CCCOC1	ZINC000875104302	GD	On-Demand	Anodyne	SIGMAR1	58	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@H]1CCCOC1	ZINC000875104302	GD	On-Demand	Anodyne	CACNA1I	55	40
CC(=O)N1CCC[C@@H]1C(=O)NNc1ccccc1C	ZINC000875104320	CD	On-Demand	Reactive	F2	44	38
CC(=O)N1CCC[C@@H]1C(=O)NNc1ccccc1C	ZINC000875104320	CD	On-Demand	Reactive	OPRM1	25	42
CC(=O)N1CCC[C@@H]1C(=O)NNc1ccccc1C	ZINC000875104320	CD	On-Demand	Reactive	OPRD1	15	42
CC(=O)N1CCC[C@@H]1C(=O)NNc1ccccc1C	ZINC000875104320	CD	On-Demand	Reactive	CELA1	46	42
CC(=O)N1CCC[C@@H]1C(=O)NNc1ccccc1C	ZINC000875104320	CD	On-Demand	Reactive	ELANE	56	38
CC(=O)N1CCC[C@@H]1C(=O)NNc1ccccc1C	ZINC000875104320	CD	On-Demand	Reactive	TRY1_BOVIN	48	37
CC(=O)N1CCC[C@@H]1C(=O)NNc1ccccc1C	ZINC000875104320	CD	On-Demand	Reactive	PREP	64	36
CC(=O)N1CCC[C@@H]1C(=O)NNc1ccccc1C	ZINC000875104320	CD	On-Demand	Reactive	LGMN	87	39
CC(=O)N1CCC[C@@H]1C(=O)NNc1ccccc1C	ZINC000875104320	CD	On-Demand	Reactive	XIAP	52	46
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@H]2Cc3ccccc32)C1	ZINC000875104340	DD	On-Demand	Anodyne	MTNR1A	20	46
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@H]2Cc3ccccc32)C1	ZINC000875104340	DD	On-Demand	Anodyne	MTNR1B	24	46
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@@H]2Cc3ccccc32)C1	ZINC000875104346	DD	On-Demand	Anodyne	MTNR1A	20	46
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@@H]2Cc3ccccc32)C1	ZINC000875104346	DD	On-Demand	Anodyne	MTNR1B	24	46
O=C(NCc1ncc(-c2ccccc2)o1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875104348	FH	On-Demand	Anodyne	EPHX2	28	41
O=C(NCc1ncc(-c2ccccc2)o1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875104351	FH	On-Demand	Anodyne	EPHX2	28	41
O=C(NCCCCCCc1ccccc1)C(=O)NC[C@H]1CCCOC1	ZINC000875104373	EE	On-Demand	Anodyne	FAAH	64	38
O=C(NCCCCCCc1ccccc1)C(=O)NC[C@H]1CCCOC1	ZINC000875104373	EE	On-Demand	Anodyne	CES1	69	38
O=C(NCCCCCCc1ccccc1)C(=O)NC[C@H]1CCCOC1	ZINC000875104373	EE	On-Demand	Anodyne	AMP1_PLAFQ	19	42
O=C(NCCCCCCc1ccccc1)C(=O)NC[C@@H]1CCCOC1	ZINC000875104375	EE	On-Demand	Anodyne	FAAH	64	38
O=C(NCCCCCCc1ccccc1)C(=O)NC[C@@H]1CCCOC1	ZINC000875104375	EE	On-Demand	Anodyne	CES1	69	38
O=C(NCCCCCCc1ccccc1)C(=O)NC[C@@H]1CCCOC1	ZINC000875104375	EE	On-Demand	Anodyne	AMP1_PLAFQ	19	42
CC(C)(C)CCNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875104407	CD	On-Demand	Anodyne	CACNA1H	15	47
CC(C)(C)CCNC(=O)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875104416	FH	On-Demand	Anodyne	ABL1	15	45
COCCN(CC1CCN(C)CC1)C(=O)NCCC(C)(C)C	ZINC000875104443	DE	On-Demand	Anodyne	CACNA1I	51	38
Cc1cc(C(N)=O)ccc1NC(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875104453	EG	On-Demand	Anodyne	NPY5R	32	41
Cc1cc(C(N)=O)ccc1NC(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875104454	EG	On-Demand	Anodyne	NPY5R	32	41
CC(=O)[C@H]1CCCN(C(=O)NCCc2ccc3ccccc3c2)C1	ZINC000875104461	DG	On-Demand	Anodyne	HRH3	15	45
CC(=O)[C@H]1CCCN(C(=O)NCCc2ccc3ccccc3c2)C1	ZINC000875104461	DG	On-Demand	Anodyne	NMT1	35	41
CC(=O)[C@H]1CCCN(C(=O)NCCc2ccc3ccccc3c2)C1	ZINC000875104461	DG	On-Demand	Anodyne	CCR3	43	40
CC(=O)[C@H]1CCCN(C(=O)NCCc2ccc3ccccc3c2)C1	ZINC000875104461	DG	On-Demand	Anodyne	DPP7	54	48
CC(=O)[C@H]1CCCN(C(=O)NCCc2ccc3ccccc3c2)C1	ZINC000875104461	DG	On-Demand	Anodyne	GPBAR1	24	40
CC(=O)[C@@H]1CCCN(C(=O)NCCc2ccc3ccccc3c2)C1	ZINC000875104462	DG	On-Demand	Anodyne	HRH3	15	45
CC(=O)[C@@H]1CCCN(C(=O)NCCc2ccc3ccccc3c2)C1	ZINC000875104462	DG	On-Demand	Anodyne	NMT1	35	41
CC(=O)[C@@H]1CCCN(C(=O)NCCc2ccc3ccccc3c2)C1	ZINC000875104462	DG	On-Demand	Anodyne	CCR3	43	40
CC(=O)[C@@H]1CCCN(C(=O)NCCc2ccc3ccccc3c2)C1	ZINC000875104462	DG	On-Demand	Anodyne	DPP7	54	48
CC(=O)[C@@H]1CCCN(C(=O)NCCc2ccc3ccccc3c2)C1	ZINC000875104462	DG	On-Demand	Anodyne	GPBAR1	24	40
Cc1cc(C(N)=O)ccc1NC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875104470	FF	On-Demand	Anodyne	KCNH2	41	36
Cc1cc(C(N)=O)ccc1NC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875104470	FF	On-Demand	Anodyne	PRSS2	64	33
Cc1cc(C(N)=O)ccc1NC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875104470	FF	On-Demand	Anodyne	CHEK2	40	44
Cc1cc(C(N)=O)ccc1NC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875104470	FF	On-Demand	Anodyne	EPHX2	23	42
Cc1cc(C(N)=O)ccc1NC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875104470	FF	On-Demand	Anodyne	SCD1	16	43
CC(=O)C1CCN(C(=O)NCCc2ccc3ccccc3c2)CC1	ZINC000875104471	DG	On-Demand	Anodyne	HTR4	21	42
CC(=O)C1CCN(C(=O)NCCc2ccc3ccccc3c2)CC1	ZINC000875104471	DG	On-Demand	Anodyne	CXCR4	41	32
CC(=O)C1CCN(C(=O)NCCc2ccc3ccccc3c2)CC1	ZINC000875104471	DG	On-Demand	Anodyne	EPHX2	24	40
Cc1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(C(N)=O)cc3C)C2)cc1	ZINC000875104502	FF	On-Demand	Anodyne	DRD4	36	48
Cc1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(C(N)=O)cc3C)C2)cc1	ZINC000875104502	FF	On-Demand	Anodyne	ACHE	15	40
Cc1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(C(N)=O)cc3C)C2)cc1	ZINC000875104502	FF	On-Demand	Anodyne	SIGMAR1	20	46
Cc1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(C(N)=O)cc3C)C2)cc1	ZINC000875104502	FF	On-Demand	Anodyne	SSTR5	47	41
Cc1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(C(N)=O)cc3C)C2)cc1	ZINC000875104502	FF	On-Demand	Anodyne	CHEK2	29	41
Cc1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(C(N)=O)cc3C)C2)cc1	ZINC000875104502	FF	On-Demand	Anodyne	CCR3	56	48
Cc1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(C(N)=O)cc3C)C2)cc1	ZINC000875104502	FF	On-Demand	Anodyne	UTS2R	24	43
Cc1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(C(N)=O)cc3C)C2)cc1	ZINC000875104502	FF	On-Demand	Anodyne	CCR2	16	47
Cc1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(C(N)=O)cc3C)C2)cc1	ZINC000875104502	FF	On-Demand	Anodyne	MCHR1	44	45
Cc1ccc(CN2CC[C@H](NC(=O)Nc3ccc(C(N)=O)cc3C)C2)cc1	ZINC000875104503	FF	On-Demand	Anodyne	DRD4	36	48
Cc1ccc(CN2CC[C@H](NC(=O)Nc3ccc(C(N)=O)cc3C)C2)cc1	ZINC000875104503	FF	On-Demand	Anodyne	ACHE	15	40
Cc1ccc(CN2CC[C@H](NC(=O)Nc3ccc(C(N)=O)cc3C)C2)cc1	ZINC000875104503	FF	On-Demand	Anodyne	SIGMAR1	20	46
Cc1ccc(CN2CC[C@H](NC(=O)Nc3ccc(C(N)=O)cc3C)C2)cc1	ZINC000875104503	FF	On-Demand	Anodyne	SSTR5	47	41
Cc1ccc(CN2CC[C@H](NC(=O)Nc3ccc(C(N)=O)cc3C)C2)cc1	ZINC000875104503	FF	On-Demand	Anodyne	CHEK2	29	41
Cc1ccc(CN2CC[C@H](NC(=O)Nc3ccc(C(N)=O)cc3C)C2)cc1	ZINC000875104503	FF	On-Demand	Anodyne	CCR3	56	48
Cc1ccc(CN2CC[C@H](NC(=O)Nc3ccc(C(N)=O)cc3C)C2)cc1	ZINC000875104503	FF	On-Demand	Anodyne	UTS2R	24	43
Cc1ccc(CN2CC[C@H](NC(=O)Nc3ccc(C(N)=O)cc3C)C2)cc1	ZINC000875104503	FF	On-Demand	Anodyne	CCR2	16	47
Cc1ccc(CN2CC[C@H](NC(=O)Nc3ccc(C(N)=O)cc3C)C2)cc1	ZINC000875104503	FF	On-Demand	Anodyne	MCHR1	44	45
C[C@H](O)c1ccc(CNC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000875104600	GF	On-Demand	Anodyne	NAMPT	44	37
C[C@H](O)c1ccc(CNC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000875104608	GF	On-Demand	Anodyne	NAMPT	44	37
C[C@H](O)c1ccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875104646	GE	On-Demand	Anodyne	F2	38	41
C[C@H](O)c1ccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875104646	GE	On-Demand	Anodyne	CCR5	18	42
C[C@H](O)c1ccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875104646	GE	On-Demand	Anodyne	XIAP	39	40
C[C@H](O)c1ccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875104646	GE	On-Demand	Anodyne	TMPRSS11D	66	38
C[C@H](O)c1ccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875104647	GE	On-Demand	Anodyne	F2	38	41
C[C@H](O)c1ccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875104647	GE	On-Demand	Anodyne	CCR5	18	42
C[C@H](O)c1ccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875104647	GE	On-Demand	Anodyne	XIAP	39	40
C[C@H](O)c1ccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875104647	GE	On-Demand	Anodyne	TMPRSS11D	66	38
C[C@@H](NC(=O)N1C[C@H]2C(=O)N(C)C(=O)[C@H]2C1)C(c1ccccc1)c1ccccc1	ZINC000875104649	GE	On-Demand	Anodyne	BIRC8	54	32
C[C@H](O)c1ccc(CNC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875104650	GE	On-Demand	Anodyne	F2	38	41
C[C@H](O)c1ccc(CNC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875104650	GE	On-Demand	Anodyne	CCR5	18	42
C[C@H](O)c1ccc(CNC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875104650	GE	On-Demand	Anodyne	XIAP	39	40
C[C@H](O)c1ccc(CNC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875104650	GE	On-Demand	Anodyne	TMPRSS11D	66	38
C[C@H](NC(=O)N1C[C@H]2C(=O)N(C)C(=O)[C@H]2C1)C(c1ccccc1)c1ccccc1	ZINC000875104651	GE	On-Demand	Anodyne	BIRC8	54	32
C[C@H](O)c1ccc(CNC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875104652	GE	On-Demand	Anodyne	F2	38	41
C[C@H](O)c1ccc(CNC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875104652	GE	On-Demand	Anodyne	CCR5	18	42
C[C@H](O)c1ccc(CNC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875104652	GE	On-Demand	Anodyne	XIAP	39	40
C[C@H](O)c1ccc(CNC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875104652	GE	On-Demand	Anodyne	TMPRSS11D	66	38
C[C@H](O)c1ccc(CNC(=O)C(=O)NCc2ccc(OC(F)F)cc2F)cc1	ZINC000875104745	GE	On-Demand	Anodyne	TRPV1	90	36
CCCCCCCNC(=O)C(=O)NC[C@H]1CCCOC1	ZINC000875104763	CD	On-Demand	Mild	LASR	46	34
CCCCCCCNC(=O)C(=O)NC[C@@H]1CCCOC1	ZINC000875104764	CD	On-Demand	Mild	LASR	46	34
NC(=O)CCOC(=O)[C@H]1CCCN(C(=O)c2cccc3ccccc23)C1	ZINC000875104812	FE	On-Demand	Anodyne	SLC6A1	70	35
NC(=O)CCOC(=O)[C@@H]1CCCN(C(=O)c2cccc3ccccc23)C1	ZINC000875104813	FE	On-Demand	Anodyne	SLC6A1	70	35
Cc1cc(C(N)=O)ccc1NC(=O)NC[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000875104834	GF	On-Demand	Anodyne	DRD4	18	48
Cc1cc(C(N)=O)ccc1NC(=O)NC[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000875104834	GF	On-Demand	Anodyne	LPL	42	32
Cc1cc(C(N)=O)ccc1NC(=O)NC[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000875104834	GF	On-Demand	Anodyne	NPFFR1	40	33
Cc1cc(C(N)=O)ccc1NC(=O)NC[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000875104835	GF	On-Demand	Anodyne	DRD4	18	48
Cc1cc(C(N)=O)ccc1NC(=O)NC[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000875104835	GF	On-Demand	Anodyne	LPL	42	32
Cc1cc(C(N)=O)ccc1NC(=O)NC[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000875104835	GF	On-Demand	Anodyne	NPFFR1	40	33
Cc1cc(C(N)=O)ccc1NC(=O)NC[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000875104836	GF	On-Demand	Anodyne	DRD4	18	48
Cc1cc(C(N)=O)ccc1NC(=O)NC[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000875104836	GF	On-Demand	Anodyne	LPL	42	32
Cc1cc(C(N)=O)ccc1NC(=O)NC[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000875104836	GF	On-Demand	Anodyne	NPFFR1	40	33
Cc1cc(C(N)=O)ccc1NC(=O)NC[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000875104837	GF	On-Demand	Anodyne	DRD4	18	48
Cc1cc(C(N)=O)ccc1NC(=O)NC[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000875104837	GF	On-Demand	Anodyne	LPL	42	32
Cc1cc(C(N)=O)ccc1NC(=O)NC[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000875104837	GF	On-Demand	Anodyne	NPFFR1	40	33
Cc1cc(C(N)=O)ccc1NC(=O)N1CCc2ccc(Cl)c(C)c2C1	ZINC000875104844	FH	On-Demand	Anodyne	P2RY14	45	34
Cc1cc(C(N)=O)ccc1NC(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875104845	FG	On-Demand	Anodyne	C3AR1	37	40
Cc1cc(C(N)=O)ccc1NC(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875104846	FG	On-Demand	Anodyne	C3AR1	37	40
COc1ccc(N2CCN(C(=O)Nc3ccc(C(N)=O)cc3C)CC2)c(OC)c1	ZINC000875104861	GE	On-Demand	Clean	HTR1A	16	44
COc1ccc(N2CCN(C(=O)Nc3ccc(C(N)=O)cc3C)CC2)c(OC)c1	ZINC000875104861	GE	On-Demand	Clean	HTR1B	15	44
COc1ccc(N2CCN(C(=O)Nc3ccc(C(N)=O)cc3C)CC2)c(OC)c1	ZINC000875104861	GE	On-Demand	Clean	PDGFRB	53	42
COc1ccc(N2CCN(C(=O)Nc3ccc(C(N)=O)cc3C)CC2)c(OC)c1	ZINC000875104861	GE	On-Demand	Clean	RBP4	18	45
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)C(c1ccccc1)c1ccccc1	ZINC000875104936	GF	On-Demand	Anodyne	GHRHR	49	33
O=C(NC[C@@H]1Cc2ccccc21)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875105051	GE	On-Demand	Anodyne	SMO	36	45
O=C(NC[C@@H]1Cc2ccccc21)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875105051	GE	On-Demand	Anodyne	ETHR	58	44
O=C(NC[C@H]1Cc2ccccc21)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875105052	GE	On-Demand	Anodyne	SMO	36	45
O=C(NC[C@H]1Cc2ccccc21)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875105052	GE	On-Demand	Anodyne	ETHR	58	44
C[C@@H](NC(=O)N1CC2(CCN(C(=O)OC(C)(C)C)CC2)C1)c1ccc(C#N)cc1	ZINC000875105053	GH	On-Demand	Mild	GPR119	23	41
CCOC(=O)C1CCC(NC(=O)C(=O)N2CCC[C@H]2c2cncc(C)c2)CC1	ZINC000875105088	GE	On-Demand	Anodyne	SSTR5	30	41
CCOC(=O)C1CCC(NC(=O)C(=O)N2CCC[C@@H]2c2cncc(C)c2)CC1	ZINC000875105089	GE	On-Demand	Anodyne	SSTR5	30	41
O=C(NCc1cccc(Oc2ccccc2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875105119	EG	On-Demand	Anodyne	FAAH	24	40
O=C(NCc1cccc(Oc2ccccc2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875105119	EG	On-Demand	Anodyne	AMP1_PLAFQ	27	47
O=C(NCc1cccc(Oc2ccccc2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875105119	EG	On-Demand	Anodyne	CRTM	57	41
O=C(NCc1cccc(Oc2ccccc2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875105119	EG	On-Demand	Anodyne	PDS	54	35
Cc1cc(C(N)=O)ccc1NC(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875105121	FF	On-Demand	Anodyne	NPY2R	41	40
Cc1cc(C(N)=O)ccc1NC(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875105121	FF	On-Demand	Anodyne	SLC6A9	17	40
Cc1cc(C(N)=O)ccc1NC(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875105121	FF	On-Demand	Anodyne	WDR5	26	41
CC[C@@H](NC(=O)C(=O)NC[C@H]1Cc2ccccc21)c1cccc(OC)c1OC	ZINC000875105154	GF	On-Demand	Anodyne	MTNR1A	25	41
CC[C@@H](NC(=O)C(=O)NC[C@H]1Cc2ccccc21)c1cccc(OC)c1OC	ZINC000875105154	GF	On-Demand	Anodyne	MTNR1B	27	41
CC[C@@H](NC(=O)C(=O)NC[C@@H]1Cc2ccccc21)c1cccc(OC)c1OC	ZINC000875105156	GF	On-Demand	Anodyne	MTNR1A	25	41
CC[C@@H](NC(=O)C(=O)NC[C@@H]1Cc2ccccc21)c1cccc(OC)c1OC	ZINC000875105156	GF	On-Demand	Anodyne	MTNR1B	27	41
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCC2CCC2)[C@H](O)C1	ZINC000875105168	ED	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCC2CCC2)[C@@H](O)C1	ZINC000875105171	ED	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NCC2CCC2)[C@H](O)C1	ZINC000875105174	ED	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NCC2CCC2)[C@@H](O)C1	ZINC000875105176	ED	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)CCNC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875105219	DG	On-Demand	Anodyne	EPHX2	15	50
CC(C)(C)CCNC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875105222	DG	On-Demand	Anodyne	EPHX2	15	50
COCCN(CC1CCN(C)CC1)C(=O)NCC1CCC1	ZINC000875105278	CD	On-Demand	Anodyne	CACNA1I	55	34
C[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)C(c1ccccc1)c1ccccc1	ZINC000875105290	GH	On-Demand	Anodyne	CACNA1H	39	41
C[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)C(c1ccccc1)c1ccccc1	ZINC000875105290	GH	On-Demand	Anodyne	GHRHR	69	34
Cc1ccc(CNC(=O)C(=O)N[C@H](C)COc2ccccc2)o1	ZINC000875105300	DD	On-Demand	Anodyne	PDS	50	39
Cc1ccc(CNC(=O)C(=O)N[C@@H](C)COc2ccccc2)o1	ZINC000875105302	DD	On-Demand	Anodyne	PDS	50	39
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NC[C@H]3CCCOC3)C2)c1	ZINC000875105330	GC	On-Demand	Anodyne	AVPR1B	21	40
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NC[C@H]3CCCOC3)C2)c1	ZINC000875105330	GC	On-Demand	Anodyne	CCR3	17	42
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NC[C@@H]3CCCOC3)C2)c1	ZINC000875105331	GC	On-Demand	Anodyne	AVPR1B	21	40
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NC[C@@H]3CCCOC3)C2)c1	ZINC000875105331	GC	On-Demand	Anodyne	CCR3	17	42
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NC[C@@H]3CCCOC3)C2)c1	ZINC000875105333	GC	On-Demand	Anodyne	AVPR1B	21	40
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NC[C@@H]3CCCOC3)C2)c1	ZINC000875105333	GC	On-Demand	Anodyne	CCR3	17	42
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NC[C@H]3CCCOC3)C2)c1	ZINC000875105334	GC	On-Demand	Anodyne	AVPR1B	21	40
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NC[C@H]3CCCOC3)C2)c1	ZINC000875105334	GC	On-Demand	Anodyne	CCR3	17	42
Cc1cc(C(N)=O)ccc1NC(=O)N1CCC(C)(N2CCCC2)CC1	ZINC000875105336	EF	On-Demand	Anodyne	CCR5	26	42
O=C(NCCO)C1CCN(C(=O)NCCc2ccc3ccccc3c2)CC1	ZINC000875105357	FD	On-Demand	Anodyne	MTNR1A	23	42
O=C(NCCO)C1CCN(C(=O)NCCc2ccc3ccccc3c2)CC1	ZINC000875105357	FD	On-Demand	Anodyne	MTNR1B	19	41
O=C(NCCO)C1CCN(C(=O)NCCc2ccc3ccccc3c2)CC1	ZINC000875105357	FD	On-Demand	Anodyne	EPHX2	19	43
CN1CC[C@H]2CN(C(=O)NCCc3ccc4ccccc4c3)CC[C@@H]21	ZINC000875105370	EG	On-Demand	Anodyne	CXCR4	43	33
CN1CC[C@H]2CN(C(=O)NCCc3ccc4ccccc4c3)CC[C@H]21	ZINC000875105401	EG	On-Demand	Anodyne	CXCR4	43	33
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)COc2ccccc2)CC1	ZINC000875105418	ED	On-Demand	Anodyne	CPT1A	58	35
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)COc2ccccc2)CC1	ZINC000875105421	ED	On-Demand	Anodyne	CPT1A	58	35
O=C(NC[C@H]1CCCOC1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875105462	GD	On-Demand	Anodyne	SMO	31	44
O=C(NC[C@H]1CCCOC1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875105462	GD	On-Demand	Anodyne	ETHR	56	49
O=C(NCC1CCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875105487	CF	On-Demand	Anodyne	F2	41	49
O=C(NCC1CCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875105487	CF	On-Demand	Anodyne	PRSS1	21	47
O=C(NCC1CCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875105487	CF	On-Demand	Anodyne	ACE	40	40
O=C(NCC1CCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875105487	CF	On-Demand	Anodyne	PREP	59	39
O=C(NCC1CCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875105488	CF	On-Demand	Anodyne	F2	41	49
O=C(NCC1CCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875105488	CF	On-Demand	Anodyne	PRSS1	21	47
O=C(NCC1CCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875105488	CF	On-Demand	Anodyne	ACE	40	40
O=C(NCC1CCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875105488	CF	On-Demand	Anodyne	PREP	59	39
O=C(NCC1CCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875105489	CF	On-Demand	Anodyne	F2	41	49
O=C(NCC1CCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875105489	CF	On-Demand	Anodyne	PRSS1	21	47
O=C(NCC1CCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875105489	CF	On-Demand	Anodyne	ACE	40	40
O=C(NCC1CCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875105489	CF	On-Demand	Anodyne	PREP	59	39
Cn1nnnc1C1CCN(C(=O)NCCc2ccc3ccccc3c2)CC1	ZINC000875105490	FE	On-Demand	Anodyne	CXCR4	43	33
O=C(NCC1CCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875105491	CF	On-Demand	Anodyne	F2	41	49
O=C(NCC1CCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875105491	CF	On-Demand	Anodyne	PRSS1	21	47
O=C(NCC1CCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875105491	CF	On-Demand	Anodyne	ACE	40	40
O=C(NCC1CCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875105491	CF	On-Demand	Anodyne	PREP	59	39
Cc1cc(C(N)=O)ccc1NC(=O)NCc1cccc(OC(C)(C)C)c1	ZINC000875105519	FH	On-Demand	Anodyne	ROCK2	27	44
Cc1cc(C(N)=O)ccc1NC(=O)N1CCC(CCF)CC1	ZINC000875105528	DF	On-Demand	Anodyne	ST14	62	38
Cc1cc(C(N)=O)ccc1NC(=O)N1CCC(CCF)CC1	ZINC000875105528	DF	On-Demand	Anodyne	RBP4	41	37
Cc1cc(C(N)=O)ccc1NC(=O)NCC1(c2ccccc2)CCN(C)CC1	ZINC000875105532	GF	On-Demand	Anodyne	KCNA3	43	37
Cc1cc(C(N)=O)ccc1NC(=O)NCC1(c2ccccc2)CCN(C)CC1	ZINC000875105532	GF	On-Demand	Anodyne	SOAT1	18	44
Cc1cc(C(N)=O)ccc1NC(=O)NCC1(c2ccccc2)CCN(C)CC1	ZINC000875105532	GF	On-Demand	Anodyne	NPFFR1	19	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)COc2ccccc2)C1	ZINC000875105549	ED	On-Demand	Anodyne	SLC6A1	42	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)COc2ccccc2)C1	ZINC000875105549	ED	On-Demand	Anodyne	CPT1A	59	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)COc2ccccc2)C1	ZINC000875105549	ED	On-Demand	Anodyne	DPP7	48	37
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)COc2ccccc2)C1	ZINC000875105551	ED	On-Demand	Anodyne	SLC6A1	42	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)COc2ccccc2)C1	ZINC000875105551	ED	On-Demand	Anodyne	CPT1A	59	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)COc2ccccc2)C1	ZINC000875105551	ED	On-Demand	Anodyne	DPP7	48	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)COc2ccccc2)C1	ZINC000875105553	ED	On-Demand	Anodyne	SLC6A1	42	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)COc2ccccc2)C1	ZINC000875105553	ED	On-Demand	Anodyne	CPT1A	59	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)COc2ccccc2)C1	ZINC000875105553	ED	On-Demand	Anodyne	DPP7	48	37
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)COc2ccccc2)C1	ZINC000875105555	ED	On-Demand	Anodyne	SLC6A1	42	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)COc2ccccc2)C1	ZINC000875105555	ED	On-Demand	Anodyne	CPT1A	59	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)COc2ccccc2)C1	ZINC000875105555	ED	On-Demand	Anodyne	DPP7	48	37
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2Cc3ccccc32)CC1	ZINC000875105565	DD	On-Demand	Anodyne	MTNR1A	16	48
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2Cc3ccccc32)CC1	ZINC000875105565	DD	On-Demand	Anodyne	MTNR1B	19	48
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2Cc3ccccc32)CC1	ZINC000875105567	DD	On-Demand	Anodyne	MTNR1A	16	48
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2Cc3ccccc32)CC1	ZINC000875105567	DD	On-Demand	Anodyne	MTNR1B	19	48
C[C@H](O)c1ccc(CNC(=O)C(=O)N[C@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000875105634	GF	On-Demand	Anodyne	TRPV1	52	31
C[C@H](O)c1ccc(CNC(=O)C(=O)N[C@@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000875105638	GF	On-Demand	Anodyne	TRPV1	52	31
Cc1cc(C(N)=O)ccc1NC(=O)N1CCN(c2cccc(F)c2)CC1	ZINC000875105645	FF	On-Demand	Anodyne	LIMK2	19	41
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NC[C@H]1Cc2ccccc21	ZINC000875105652	ED	On-Demand	Anodyne	MTNR1A	15	47
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NC[C@H]1Cc2ccccc21	ZINC000875105652	ED	On-Demand	Anodyne	MTNR1B	19	47
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NC[C@@H]1Cc2ccccc21	ZINC000875105653	ED	On-Demand	Anodyne	MTNR1A	15	47
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NC[C@@H]1Cc2ccccc21	ZINC000875105653	ED	On-Demand	Anodyne	MTNR1B	19	47
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NC[C@@H]1Cc2ccccc21	ZINC000875105654	ED	On-Demand	Anodyne	MTNR1A	15	47
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NC[C@@H]1Cc2ccccc21	ZINC000875105654	ED	On-Demand	Anodyne	MTNR1B	19	47
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NC[C@H]1Cc2ccccc21	ZINC000875105656	ED	On-Demand	Anodyne	MTNR1A	15	47
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NC[C@H]1Cc2ccccc21	ZINC000875105656	ED	On-Demand	Anodyne	MTNR1B	19	47
C[C@H](NC(=O)C(=O)NCCOC1CCCC1)c1ccc(C(F)(F)F)nc1	ZINC000875105658	FE	On-Demand	Anodyne	TRPV1	58	37
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)Cc2ccccc2C)C1	ZINC000875105699	ED	On-Demand	Anodyne	ACE	22	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)Cc2ccccc2C)C1	ZINC000875105699	ED	On-Demand	Anodyne	SLC6A1	53	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)Cc2ccccc2C)C1	ZINC000875105700	ED	On-Demand	Anodyne	ACE	22	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)Cc2ccccc2C)C1	ZINC000875105700	ED	On-Demand	Anodyne	SLC6A1	53	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)Cc2ccccc2C)C1	ZINC000875105701	ED	On-Demand	Anodyne	ACE	22	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)Cc2ccccc2C)C1	ZINC000875105701	ED	On-Demand	Anodyne	SLC6A1	53	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)Cc2ccccc2C)C1	ZINC000875105702	ED	On-Demand	Anodyne	ACE	22	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)Cc2ccccc2C)C1	ZINC000875105702	ED	On-Demand	Anodyne	SLC6A1	53	34
O=C(NCC1CCC1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875105747	CE	On-Demand	Anodyne	ADRB1	21	40
O=C(NCC1CCC1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875105747	CE	On-Demand	Anodyne	CACNA1I	50	39
O=C(NCC1CCC1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875105748	CE	On-Demand	Anodyne	ADRB1	21	40
O=C(NCC1CCC1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875105748	CE	On-Demand	Anodyne	CACNA1I	50	39
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1Cc2ccccc21	ZINC000875105777	DC	On-Demand	Mild	MTNR1A	15	40
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1Cc2ccccc21	ZINC000875105777	DC	On-Demand	Mild	MTNR1B	19	40
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1Cc2ccccc21	ZINC000875105780	DC	On-Demand	Mild	MTNR1A	15	40
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1Cc2ccccc21	ZINC000875105780	DC	On-Demand	Mild	MTNR1B	19	40
Cc1cc(C(N)=O)ccc1NC(=O)NCCC1CCN(C(C)C)CC1	ZINC000875105781	EF	On-Demand	Anodyne	SIRT3	54	33
Cc1cc(C(N)=O)ccc1NC(=O)NCCC1CCN(C(C)C)CC1	ZINC000875105781	EF	On-Demand	Anodyne	SIRT2	55	34
Cc1cc(C(N)=O)ccc1NC(=O)NCCC1CCN(C(C)C)CC1	ZINC000875105781	EF	On-Demand	Anodyne	SIRT1	54	33
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1Cc2ccccc21	ZINC000875105783	DC	On-Demand	Mild	MTNR1A	15	40
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1Cc2ccccc21	ZINC000875105783	DC	On-Demand	Mild	MTNR1B	19	40
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1Cc2ccccc21	ZINC000875105786	DC	On-Demand	Mild	MTNR1A	15	40
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1Cc2ccccc21	ZINC000875105786	DC	On-Demand	Mild	MTNR1B	19	40
CCCCCCCNC(=O)C(=O)NCc1ccn(-c2ccccc2)n1	ZINC000875105792	EF	On-Demand	Mild	ASAH1	91	38
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)C(=O)NC[C@@H]1CCCOC1	ZINC000875105797	GE	On-Demand	Anodyne	SIGMAR1	15	41
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)C(=O)NC[C@H]1CCCOC1	ZINC000875105799	GE	On-Demand	Anodyne	SIGMAR1	15	41
CN1CCN(C2CCN(C(=O)NCCc3ccc4ccccc4c3)CC2)CC1	ZINC000875105855	GF	On-Demand	Anodyne	CXCR4	41	33
CN1CCN(C2CCN(C(=O)NCCc3ccc4ccccc4c3)CC2)CC1	ZINC000875105855	GF	On-Demand	Anodyne	CCR3	58	41
CN1CCN(C2CCN(C(=O)NCCc3ccc4ccccc4c3)CC2)CC1	ZINC000875105855	GF	On-Demand	Anodyne	EPHX2	15	41
CN1CCN(C2CCN(C(=O)NCCc3ccc4ccccc4c3)CC2)CC1	ZINC000875105855	GF	On-Demand	Anodyne	L3MBTL3	97	40
CCOC(=O)C1CCC(NC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000875105874	GE	On-Demand	Anodyne	OXTR	56	41
CCOC(=O)C1CCC(NC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000875105874	GE	On-Demand	Anodyne	GHRHR	54	38
CCOC(=O)C1CCC(NC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000875105878	GE	On-Demand	Anodyne	OXTR	56	41
CCOC(=O)C1CCC(NC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000875105878	GE	On-Demand	Anodyne	GHRHR	54	38
Cc1cc(C(N)=O)ccc1NC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875105898	GH	On-Demand	Anodyne	DRD2	24	46
Cc1cc(C(N)=O)ccc1NC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875105898	GH	On-Demand	Anodyne	DRD4	60	44
Cc1cc(C(N)=O)ccc1NC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875105898	GH	On-Demand	Anodyne	ACHE	68	61
Cc1cc(C(N)=O)ccc1NC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875105898	GH	On-Demand	Anodyne	OPRM1	15	46
Cc1cc(C(N)=O)ccc1NC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875105898	GH	On-Demand	Anodyne	DRD3	17	44
Cc1cc(C(N)=O)ccc1NC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875105898	GH	On-Demand	Anodyne	OPRD1	17	46
Cc1cc(C(N)=O)ccc1NC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875105898	GH	On-Demand	Anodyne	SIGMAR1	50	46
Cc1cc(C(N)=O)ccc1NC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875105898	GH	On-Demand	Anodyne	SSTR5	46	37
Cc1cc(C(N)=O)ccc1NC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875105898	GH	On-Demand	Anodyne	NPY1R	21	41
Cc1cc(C(N)=O)ccc1NC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875105898	GH	On-Demand	Anodyne	CHEK2	29	45
Cc1cc(C(N)=O)ccc1NC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875105898	GH	On-Demand	Anodyne	BCHE	19	48
Cc1cc(C(N)=O)ccc1NC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875105898	GH	On-Demand	Anodyne	CCR3	89	48
Cc1cc(C(N)=O)ccc1NC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875105898	GH	On-Demand	Anodyne	ST14	64	41
Cc1cc(C(N)=O)ccc1NC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875105898	GH	On-Demand	Anodyne	MCHR1	46	42
Cc1cc(C(N)=O)ccc1NC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875105898	GH	On-Demand	Anodyne	CACNA1I	55	40
Cc1cc(C(N)=O)ccc1NC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875105898	GH	On-Demand	Anodyne	SIRT3	52	33
Cc1cc(C(N)=O)ccc1NC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875105898	GH	On-Demand	Anodyne	SIRT2	53	33
Cc1cc(C(N)=O)ccc1NC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875105898	GH	On-Demand	Anodyne	SIRT1	52	33
Cc1cc(C(N)=O)ccc1NC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875105898	GH	On-Demand	Anodyne	NPFFR1	47	39
COC(=O)C1(O)CN(C(=O)NCCc2ccc3ccccc3c2)C1	ZINC000875105924	ED	On-Demand	Anodyne	MTNR1A	42	36
COc1ccccc1[C@H]1CCCN(C(=O)Nc2ccc(C(N)=O)cc2C)CC1	ZINC000875105931	GH	On-Demand	Anodyne	RBP4	50	47
COc1ccccc1[C@H]1CCCN(C(=O)Nc2ccc(C(N)=O)cc2C)CC1	ZINC000875105931	GH	On-Demand	Anodyne	SMO	16	42
COc1ccccc1[C@@H]1CCCN(C(=O)Nc2ccc(C(N)=O)cc2C)CC1	ZINC000875105932	GH	On-Demand	Anodyne	RBP4	50	47
COc1ccccc1[C@@H]1CCCN(C(=O)Nc2ccc(C(N)=O)cc2C)CC1	ZINC000875105932	GH	On-Demand	Anodyne	SMO	16	42
O=C(NCCO)C1CCN(C(=O)NCc2cccc(Oc3ccccc3)c2)CC1	ZINC000875105938	GF	On-Demand	Anodyne	LTA4H	17	40
O=C(NCCO)C1CCN(C(=O)NCc2cccc(Oc3ccccc3)c2)CC1	ZINC000875105938	GF	On-Demand	Anodyne	FAAH	27	47
O=C(NCCO)C1CCN(C(=O)NCc2cccc(Oc3ccccc3)c2)CC1	ZINC000875105938	GF	On-Demand	Anodyne	EPHX2	31	44
O=C(NCCO)C1CCN(C(=O)NCc2cccc(Oc3ccccc3)c2)CC1	ZINC000875105938	GF	On-Demand	Anodyne	AMP1_PLAFQ	28	44
O=C(NCCO)C1CCN(C(=O)NCc2cccc(Oc3ccccc3)c2)CC1	ZINC000875105938	GF	On-Demand	Anodyne	CRTM	50	41
CONC(=O)C1CCN(C(=O)NCCc2ccc3ccccc3c2)CC1	ZINC000875105971	FE	On-Demand	Anodyne	CXCR4	49	33
CONC(=O)C1CCN(C(=O)NCCc2ccc3ccccc3c2)CC1	ZINC000875105971	FE	On-Demand	Anodyne	MTNR1A	39	43
CONC(=O)C1CCN(C(=O)NCCc2ccc3ccccc3c2)CC1	ZINC000875105971	FE	On-Demand	Anodyne	EPHX2	26	41
O=C1OC[C@H]2CN(C(=O)NCCc3ccc4ccccc4c3)C[C@@H]12	ZINC000875105975	DE	On-Demand	Anodyne	LUXR	15	42
CCN(CCNC(=O)OC(C)(C)C)C(=O)C(=O)NC[C@@H]1Cc2ccccc21	ZINC000875105985	GD	On-Demand	Anodyne	MTNR1B	15	42
CCN(CCNC(=O)OC(C)(C)C)C(=O)C(=O)NC[C@H]1Cc2ccccc21	ZINC000875105986	GD	On-Demand	Anodyne	MTNR1B	15	42
COC(=O)CCCCCCNC(=O)N[C@@H]1C[C@H](CO)C1	ZINC000875105989	CD	On-Demand	Anodyne	EPHX2	36	67
CCOc1ccc([C@@H](NC(=O)N2CCC(C(C)=O)CC2)c2ccccc2)cc1	ZINC000875105995	GI	On-Demand	Anodyne	P2RY12	16	41
CCOc1ccc([C@@H](NC(=O)N2CCC(C(C)=O)CC2)c2ccccc2)cc1	ZINC000875105995	GI	On-Demand	Anodyne	CCR5	42	39
CCOc1ccc([C@@H](NC(=O)N2CCC(C(C)=O)CC2)c2ccccc2)cc1	ZINC000875105995	GI	On-Demand	Anodyne	XIAP	46	36
CCOc1ccc([C@@H](NC(=O)N2CCC(C(C)=O)CC2)c2ccccc2)cc1	ZINC000875105995	GI	On-Demand	Anodyne	BIRC8	46	34
COC(=O)CCCCCCNC(=O)NCc1ccc(Br)cn1	ZINC000875105996	FF	On-Demand	Anodyne	EPHX2	19	45
COC(=O)CCCCCCNC(=O)N1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O	ZINC000875106002	FG	On-Demand	Anodyne	ASAH1	59	32
COC(=O)CCCCCCNC(=O)N1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O	ZINC000875106003	FG	On-Demand	Anodyne	ASAH1	59	32
COC(=O)CCCCCCNC(=O)N1CCCC[C@@H]1[C@H]1CCCC[C@H]1O	ZINC000875106004	FG	On-Demand	Anodyne	ASAH1	59	32
COC(=O)CCCCCCNC(=O)N1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O	ZINC000875106005	FG	On-Demand	Anodyne	ASAH1	59	32
COC(=O)CCCCCCNC(=O)N1CC=CC1	ZINC000875106006	CD	On-Demand	Anodyne	ASAH1	68	33
COC(=O)CCCCCCNC(=O)N1CC(c2ccccc2)C1	ZINC000875106017	DF	On-Demand	Anodyne	EPHX2	27	44
CC[C@@H]1COCCN1CCNC(=O)NCCOc1cccc(F)c1	ZINC000875106021	ED	On-Demand	Anodyne	HRH2	27	41
CC[C@@H]1COCCN1CCNC(=O)NCCOc1cccc(F)c1	ZINC000875106021	ED	On-Demand	Anodyne	EPHX2	24	42
CC[C@@H]1COCCN1CCNC(=O)NCCOc1cccc(F)c1	ZINC000875106021	ED	On-Demand	Anodyne	CHRNA10	30	40
COC(=O)CCCCCCNC(=O)NCC1CC=CC1	ZINC000875106032	CE	On-Demand	Anodyne	EPHX2	36	57
COC(=O)CCCCCCNC(=O)N1[C@H]2CC[C@H]1CC(F)(F)C2	ZINC000875106040	EG	On-Demand	Anodyne	EPHX2	23	48
COC(=O)CCCCCCNC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875106049	CD	On-Demand	Anodyne	EPHX2	36	56
COC(=O)CCCCCCNC(=O)NC[C@@H]1C[C@H](O)C1	ZINC000875106050	CD	On-Demand	Anodyne	EPHX2	36	56
COC(=O)CCCCCCNC(=O)NCC1CC(O)C1	ZINC000875106051	CD	On-Demand	Anodyne	EPHX2	36	56
C[C@H](NC(=O)C(=O)NC[C@H](C)N1CCCCC1)c1cc2cnccc2o1	ZINC000875106060	FD	On-Demand	Anodyne	NAMPT	16	42
C[C@H](NC(=O)C(=O)NC[C@@H](C)N1CCCCC1)c1cc2cnccc2o1	ZINC000875106061	FD	On-Demand	Anodyne	NAMPT	16	42
O=C(NCCO)C1CCN(C(=O)NCCOc2cccc(F)c2)CC1	ZINC000875106064	FC	On-Demand	Anodyne	MTNR1A	16	42
O=C(NCCO)C1CCN(C(=O)NCCOc2cccc(F)c2)CC1	ZINC000875106064	FC	On-Demand	Anodyne	EPHX2	24	44
O=C(NCCO)C1CCN(C(=O)NCCOc2cccc(F)c2)CC1	ZINC000875106064	FC	On-Demand	Anodyne	CHRNA10	32	41
O=C(NCCO)C1CCN(C(=O)NCCOc2cccc(F)c2)CC1	ZINC000875106064	FC	On-Demand	Anodyne	CACNA1G	34	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875106077	FD	On-Demand	Anodyne	ACE	41	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875106077	FD	On-Demand	Anodyne	OPRM1	25	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875106077	FD	On-Demand	Anodyne	MME	34	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875106077	FD	On-Demand	Anodyne	REN	51	38
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875106077	FD	On-Demand	Anodyne	DPP7	40	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875106078	FD	On-Demand	Anodyne	ACE	41	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875106078	FD	On-Demand	Anodyne	OPRM1	25	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875106078	FD	On-Demand	Anodyne	MME	34	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875106078	FD	On-Demand	Anodyne	REN	51	38
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875106078	FD	On-Demand	Anodyne	DPP7	40	37
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875106079	FD	On-Demand	Anodyne	ACE	41	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875106079	FD	On-Demand	Anodyne	OPRM1	25	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875106079	FD	On-Demand	Anodyne	MME	34	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875106079	FD	On-Demand	Anodyne	REN	51	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875106079	FD	On-Demand	Anodyne	DPP7	40	37
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875106080	FD	On-Demand	Anodyne	ACE	41	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875106080	FD	On-Demand	Anodyne	OPRM1	25	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875106080	FD	On-Demand	Anodyne	MME	34	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875106080	FD	On-Demand	Anodyne	REN	51	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875106080	FD	On-Demand	Anodyne	DPP7	40	37
Cc1cc(C(N)=O)ccc1NC(=O)N1CCC(C)(N2CCCCC2)CC1	ZINC000875106136	FF	On-Demand	Anodyne	CCR5	25	43
C=CC(C)(C)CCNC(=O)C(=O)N[C@@H](C)COc1ccccc1	ZINC000875106162	DE	On-Demand	Mild	PDS	42	36
C=CC(C)(C)CCNC(=O)C(=O)N[C@H](C)COc1ccccc1	ZINC000875106164	DE	On-Demand	Mild	PDS	42	36
Cc1cc(C(N)=O)ccc1NC(=O)N1CCC(Cc2nccs2)CC1	ZINC000875106175	FG	On-Demand	Anodyne	SIRT3	44	32
Cc1cc(C(N)=O)ccc1NC(=O)N1CCC(Cc2nccs2)CC1	ZINC000875106175	FG	On-Demand	Anodyne	SIRT2	42	32
Cc1cc(C(N)=O)ccc1NC(=O)N1CCC(Cc2nccs2)CC1	ZINC000875106175	FG	On-Demand	Anodyne	SIRT1	40	31
Cc1scc(CNC(=O)C(=O)N[C@H](C)COc2ccccc2)c1C	ZINC000875106177	EF	On-Demand	Anodyne	PDS	46	37
Cc1scc(CNC(=O)C(=O)N[C@@H](C)COc2ccccc2)c1C	ZINC000875106182	EF	On-Demand	Anodyne	PDS	46	37
O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1CC2(CCCO2)C1	ZINC000875106198	GF	On-Demand	Clean	STAT6	52	32
Cc1cc(C(N)=O)ccc1NC(=O)N1CCc2ccc(C(F)(F)F)cc2C1	ZINC000875106225	GH	On-Demand	Anodyne	CCR2	26	44
O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N(C1CC1)C1CC1	ZINC000875106239	GG	On-Demand	Clean	STAT6	47	33
CCn1nncc1CNC(=O)C(=O)N[C@H](C)COc1ccccc1	ZINC000875106249	EC	On-Demand	Anodyne	PDS	69	41
Cc1cccc(CN2CCO[C@@H](CNC(=O)Nc3ccc(C(N)=O)cc3C)C2)c1	ZINC000875106250	GE	On-Demand	Anodyne	DRD4	21	40
Cc1cccc(CN2CCO[C@@H](CNC(=O)Nc3ccc(C(N)=O)cc3C)C2)c1	ZINC000875106250	GE	On-Demand	Anodyne	CCR3	15	56
CCn1nncc1CNC(=O)C(=O)N[C@@H](C)COc1ccccc1	ZINC000875106251	EC	On-Demand	Anodyne	PDS	69	41
Cc1cccc(CN2CCO[C@H](CNC(=O)Nc3ccc(C(N)=O)cc3C)C2)c1	ZINC000875106252	GE	On-Demand	Anodyne	DRD4	21	40
Cc1cccc(CN2CCO[C@H](CNC(=O)Nc3ccc(C(N)=O)cc3C)C2)c1	ZINC000875106252	GE	On-Demand	Anodyne	CCR3	15	56
C[C@@H]1[C@@H](O)C[C@@H]2CC[C@@H]1N2C(=O)C(=O)N[C@H](C)COc1ccccc1	ZINC000875106278	ED	On-Demand	Anodyne	SLC6A3	21	41
CC(=O)C1CCN(C(=O)C(=O)N[C@H](Cc2ccccc2)CN(C)C)CC1	ZINC000875106280	FD	On-Demand	Anodyne	MME	55	38
CC(=O)C1CCN(C(=O)C(=O)N[C@H](Cc2ccccc2)CN(C)C)CC1	ZINC000875106280	FD	On-Demand	Anodyne	CAPNS1	44	33
CC(=O)C1CCN(C(=O)C(=O)N[C@H](Cc2ccccc2)CN(C)C)CC1	ZINC000875106280	FD	On-Demand	Anodyne	CAPN1	46	41
CC(=O)C1CCN(C(=O)C(=O)N[C@H](Cc2ccccc2)CN(C)C)CC1	ZINC000875106280	FD	On-Demand	Anodyne	AMP1_PLAFQ	15	40
C[C@H]1[C@@H]2CC[C@@H](C[C@H]1O)N2C(=O)C(=O)N[C@H](C)COc1ccccc1	ZINC000875106281	ED	On-Demand	Anodyne	SLC6A3	21	41
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](Cc2ccccc2)CN(C)C)CC1	ZINC000875106282	FD	On-Demand	Anodyne	MME	55	38
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](Cc2ccccc2)CN(C)C)CC1	ZINC000875106282	FD	On-Demand	Anodyne	CAPNS1	44	33
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](Cc2ccccc2)CN(C)C)CC1	ZINC000875106282	FD	On-Demand	Anodyne	CAPN1	46	41
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](Cc2ccccc2)CN(C)C)CC1	ZINC000875106282	FD	On-Demand	Anodyne	AMP1_PLAFQ	15	40
O=C(NCCc1ccc2ccccc2c1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875106287	GG	On-Demand	Anodyne	SMO	40	41
O=C(NCCc1ccc2ccccc2c1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875106287	GG	On-Demand	Anodyne	ETHR	57	33
O=C(NCCc1ccc2ccccc2c1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875106291	GG	On-Demand	Anodyne	SMO	40	41
O=C(NCCc1ccc2ccccc2c1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875106291	GG	On-Demand	Anodyne	ETHR	57	33
COC(=O)CCCCCCNC(=O)NCC1COC1	ZINC000875106300	CD	On-Demand	Anodyne	EPHX2	28	53
COC(=O)CCCCCCNC(=O)NC[C@@H]1CC2(CCOCC2)CO1	ZINC000875106302	FD	On-Demand	Anodyne	EPHX2	21	47
COC(=O)CCCCCCNC(=O)NC[C@H]1CC2(CCOCC2)CO1	ZINC000875106303	FD	On-Demand	Anodyne	EPHX2	21	47
COC(=O)CCCCCCNC(=O)NCC(C)(C)F	ZINC000875106315	CE	On-Demand	Anodyne	EPHX2	28	55
O=C(NCCc1ccc(N2CCCCC2)cc1)N[C@H]1CCC[C@@H]1O	ZINC000875106321	EE	On-Demand	Anodyne	GPBAR1	21	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCOc2cccc(F)c2)C1	ZINC000875106326	EE	On-Demand	Anodyne	PDS	34	40
O=C1CCN(C(=O)NCCOc2cccc(F)c2)CCCCCCN1	ZINC000875106330	FE	On-Demand	Anodyne	HRH2	36	43
COC(=O)CCCCCCNC(=O)N1CCC(Oc2ccccc2F)CC1	ZINC000875106331	GH	On-Demand	Anodyne	DRD2	22	40
COC(=O)CCCCCCNC(=O)N1CCC(Oc2ccccc2F)CC1	ZINC000875106331	GH	On-Demand	Anodyne	DRD3	42	40
COC(=O)CCCCCCNC(=O)N1CCC(Oc2ccccc2F)CC1	ZINC000875106331	GH	On-Demand	Anodyne	EPHX2	27	44
COC(=O)CCCCCCNC(=O)N1CCC(Oc2ccccc2F)CC1	ZINC000875106331	GH	On-Demand	Anodyne	SCD1	35	53
COC(=O)CCCCCCNC(=O)N1CCC(Oc2ccccc2F)CC1	ZINC000875106331	GH	On-Demand	Anodyne	ASAH1	53	34
COC(=O)CCCCCCNC(=O)NC1CCC(C)(N(C)C)CC1	ZINC000875106336	EF	On-Demand	Anodyne	EPHX2	35	67
COC(=O)N(C)NC(=O)NCCOc1cccc(F)c1	ZINC000875106338	CD	On-Demand	Reactive	MTNR1A	38	48
COC(=O)N(C)NC(=O)NCCOc1cccc(F)c1	ZINC000875106338	CD	On-Demand	Reactive	MTNR1B	25	48
COC(=O)CCCCCCNC(=O)N[C@@H]1C[C@H]1C(F)(F)F	ZINC000875106343	DE	On-Demand	Anodyne	EPHX2	32	57
COC(=O)CCCCCCNC(=O)N1CC[C@H](c2ccc(OC)c(F)c2)C1	ZINC000875106348	GG	On-Demand	Anodyne	ADRA1A	41	37
COC(=O)CCCCCCNC(=O)N1CC[C@H](c2ccc(OC)c(F)c2)C1	ZINC000875106348	GG	On-Demand	Anodyne	ASAH1	42	34
COC(=O)CCCCCCNC(=O)N1CC[C@@H](c2ccc(OC)c(F)c2)C1	ZINC000875106349	GG	On-Demand	Anodyne	ADRA1A	41	37
COC(=O)CCCCCCNC(=O)N1CC[C@@H](c2ccc(OC)c(F)c2)C1	ZINC000875106349	GG	On-Demand	Anodyne	ASAH1	42	34
O=C(NCCc1ccc(N2CCCCC2)cc1)N(C1CC1)C1CC1	ZINC000875106370	EH	On-Demand	Anodyne	GPBAR1	25	41
O=C(NCCc1ccc(N2CCCCC2)cc1)N(C1CC1)C1CC1	ZINC000875106370	EH	On-Demand	Anodyne	L3MBTL3	34	40
COC(=O)CCCCCCNC(=O)N[C@@H]1C[C@H]1C1CCOCC1	ZINC000875106376	EE	On-Demand	Anodyne	EPHX2	26	55
COC(=O)CCCCCCNC(=O)N1CCN(c2ccc(F)cc2C#N)CC1	ZINC000875106378	GF	On-Demand	Mild	HTR1A	22	41
COC(=O)CCCCCCNC(=O)N1CCN(c2ccc(F)cc2C#N)CC1	ZINC000875106378	GF	On-Demand	Mild	DRD2	26	40
COC(=O)CCCCCCNC(=O)N1CCN(c2ccc(F)cc2C#N)CC1	ZINC000875106378	GF	On-Demand	Mild	DRD4	21	40
COC(=O)CCCCCCNC(=O)N1CCN(c2ccc(F)cc2C#N)CC1	ZINC000875106378	GF	On-Demand	Mild	ADRA1D	22	40
COC(=O)CCCCCCNC(=O)N1CCN(c2ccc(F)cc2C#N)CC1	ZINC000875106378	GF	On-Demand	Mild	DRD3	46	40
COC(=O)CCCCCCNC(=O)N1CCN(c2ccc(F)cc2C#N)CC1	ZINC000875106378	GF	On-Demand	Mild	P2RY12	17	44
COC(=O)CCCCCCNC(=O)N1CCN(c2ccc(F)cc2C#N)CC1	ZINC000875106378	GF	On-Demand	Mild	HTR7	25	40
COCCN(CC1CCN(C)CC1)C(=O)NCCOc1cccc(F)c1	ZINC000875106379	FE	On-Demand	Anodyne	CHRNA10	63	46
COCCN(CC1CCN(C)CC1)C(=O)NCCOc1cccc(F)c1	ZINC000875106379	FE	On-Demand	Anodyne	ACKR3	69	38
C#C[C@@H]1CC[C@@H](NC(=O)NCCCCCCC(=O)OC)CC1	ZINC000875106380	DF	On-Demand	Mild	EPHX2	30	70
COC(=O)CCCCCCNC(=O)N[C@]12CCCC[C@H]1C2	ZINC000875106382	CF	On-Demand	Anodyne	EPHX2	37	58
COC(=O)CCCCCCNC(=O)N[C@]12CCCC[C@@H]1C2	ZINC000875106383	CF	On-Demand	Anodyne	EPHX2	37	58
COC(=O)CCCCCCNC(=O)N[C@@]12CCCC[C@@H]1C2	ZINC000875106384	CF	On-Demand	Anodyne	EPHX2	37	58
COC(=O)CCCCCCNC(=O)N[C@@]12CCCC[C@H]1C2	ZINC000875106385	CF	On-Demand	Anodyne	EPHX2	37	58
O=C(NCC1CCC1)NC1CC(Nc2ccccc2)C1	ZINC000875106484	CF	On-Demand	Anodyne	EPHX2	26	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(C#N)cc1	ZINC000875106519	EE	On-Demand	Mild	SLC6A3	41	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(C#N)cc1	ZINC000875106520	EE	On-Demand	Mild	SLC6A3	41	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(C#N)cc1	ZINC000875106521	EE	On-Demand	Mild	SLC6A3	41	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(C#N)cc1	ZINC000875106522	EE	On-Demand	Mild	SLC6A3	41	39
COC(=O)N(C)NC(=O)NCCc1ccc2ccccc2c1	ZINC000875106530	DE	On-Demand	Reactive	NQO2	37	41
COC(=O)N(C)NC(=O)NCCc1ccc2ccccc2c1	ZINC000875106530	DE	On-Demand	Reactive	MTNR1A	79	44
COC(=O)N(C)NC(=O)NCCc1ccc2ccccc2c1	ZINC000875106530	DE	On-Demand	Reactive	MTNR1B	56	41
Cc1cc(C(N)=O)ccc1NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875106540	FE	On-Demand	Anodyne	FAAH	20	45
O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1CC=CC1	ZINC000875106552	FF	On-Demand	Clean	EPHX2	15	41
O=C(NCc1ccc(N2CCOCC2)cc1C(F)(F)F)N1CC=CC1	ZINC000875106552	FF	On-Demand	Clean	STAT6	54	34
COC(=O)CCCCCCNC(=O)NC[C@@H]1C[C@H]2CCC[C@@H]2O1	ZINC000875106574	EE	On-Demand	Anodyne	EPHX2	26	49
COC(=O)CCCCCCNC(=O)NC[C@@H]1C[C@@H]2CCC[C@@H]2O1	ZINC000875106576	EE	On-Demand	Anodyne	EPHX2	26	49
COC(=O)CCCCCCNC(=O)NC[C@@H]1C[C@H]2CCC[C@H]2O1	ZINC000875106578	EE	On-Demand	Anodyne	EPHX2	26	49
O=CN1CCCN(C(=O)NCCc2ccc3ccccc3c2)CC1	ZINC000875106579	EE	On-Demand	Anodyne	DPP7	20	45
COC(=O)CCCCCCNC(=O)NC[C@@H]1C[C@@H]2CCC[C@H]2O1	ZINC000875106580	EE	On-Demand	Anodyne	EPHX2	26	49
O=C(NCCc1ccc(N2CCCCC2)cc1)NC1CN(c2ccncn2)C1	ZINC000875106584	GE	On-Demand	Anodyne	GPBAR1	21	43
COC(=O)CCCCCCNC(=O)NC1CCN(c2ccccc2C#N)CC1	ZINC000875106586	GF	On-Demand	Mild	HTR1A	34	43
COC(=O)CCCCCCNC(=O)NC1CCN(c2ccccc2C#N)CC1	ZINC000875106586	GF	On-Demand	Mild	DRD2	39	43
COC(=O)CCCCCCNC(=O)NC1CCN(c2ccccc2C#N)CC1	ZINC000875106586	GF	On-Demand	Mild	DRD4	30	41
COC(=O)CCCCCCNC(=O)NC1CCN(c2ccccc2C#N)CC1	ZINC000875106586	GF	On-Demand	Mild	DRD3	56	40
COC(=O)CCCCCCNC(=O)NC1CCN(c2ccccc2C#N)CC1	ZINC000875106586	GF	On-Demand	Mild	HTR7	32	43
COC(=O)CCCCCCNC(=O)NC1CCN(c2ccccc2C#N)CC1	ZINC000875106586	GF	On-Demand	Mild	NPY1R	21	43
COC(=O)CCCCCCNC(=O)NC1CCN(c2ccccc2C#N)CC1	ZINC000875106586	GF	On-Demand	Mild	EPHX2	28	55
COC(=O)CCCCCCNC(=O)N[C@@H]1Cc2cncn2C1	ZINC000875106592	DD	On-Demand	Anodyne	EPHX2	16	54
COC(=O)CCCCCCNC(=O)N[C@H]1Cc2cncn2C1	ZINC000875106594	DD	On-Demand	Anodyne	EPHX2	16	54
COC(=O)CCCCCCNC(=O)N[C@H]1Cc2ccccc2NC1=O	ZINC000875106611	ED	On-Demand	Anodyne	EPHX2	22	46
COC(=O)CCCCCCNC(=O)N[C@@H]1Cc2ccccc2NC1=O	ZINC000875106612	ED	On-Demand	Anodyne	EPHX2	22	46
COC(=O)CCCCCCNC(=O)NCc1ncc(Cl)s1	ZINC000875106619	EF	On-Demand	Anodyne	EPHX2	23	46
COC(=O)CCCCCCNC(=O)NCc1ccc(C)o1	ZINC000875106634	CF	On-Demand	Anodyne	EPHX2	19	45
COC(=O)C1(O)CN(C(=O)NCCOc2cccc(F)c2)C1	ZINC000875106657	DC	On-Demand	Anodyne	MTNR1A	16	44
CCOc1ccc([C@@H](NC(=O)N[C@@H]2CCOC[C@H]2O)c2ccccc2)cc1	ZINC000875106664	FF	On-Demand	Anodyne	XIAP	42	34
COC(=O)CCCCCCNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875106669	GG	On-Demand	Anodyne	EPHX2	23	43
COC(=O)CCCCCCNC(=O)NC1(C)CC(F)(F)C1	ZINC000875106670	DF	On-Demand	Anodyne	EPHX2	32	58
COC(=O)CCCCCCNC(=O)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875106675	DD	On-Demand	Anodyne	EPHX2	21	46
COC(=O)CCCCCCNC(=O)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875106676	DD	On-Demand	Anodyne	EPHX2	21	46
COC(=O)CCCCCCNC(=O)NN(C)C(=O)OC	ZINC000875106683	CD	On-Demand	Reactive	EPHX2	18	51
COC(=O)CCCCCCNC(=O)N[C@@H]1CCO[C@H]1c1ccncc1	ZINC000875106686	EE	On-Demand	Anodyne	EPHX2	18	50
CCOC(=O)N[C@H](CNC(=O)N1CC(c2ccccc2)C1)CC(C)C	ZINC000875106692	EF	On-Demand	Anodyne	KLK3	58	32
CCOC(=O)N[C@H](CNC(=O)N1CC(c2ccccc2)C1)CC(C)C	ZINC000875106692	EF	On-Demand	Anodyne	CTSB	44	37
CCOC(=O)N[C@H](CNC(=O)N1CC(c2ccccc2)C1)CC(C)C	ZINC000875106692	EF	On-Demand	Anodyne	CTSK	53	41
CCOC(=O)N[C@H](CNC(=O)N1CC(c2ccccc2)C1)CC(C)C	ZINC000875106692	EF	On-Demand	Anodyne	CTSL	23	41
CCOC(=O)N[C@H](CNC(=O)N1CC(c2ccccc2)C1)CC(C)C	ZINC000875106692	EF	On-Demand	Anodyne	CAPNS1	62	37
CCOC(=O)N[C@H](CNC(=O)N1CC(c2ccccc2)C1)CC(C)C	ZINC000875106692	EF	On-Demand	Anodyne	HLA-DRB1	65	39
CCOC(=O)N[C@H](CNC(=O)N1CC(c2ccccc2)C1)CC(C)C	ZINC000875106692	EF	On-Demand	Anodyne	CTSS	17	41
CCOC(=O)N[C@H](CNC(=O)N1CC(c2ccccc2)C1)CC(C)C	ZINC000875106692	EF	On-Demand	Anodyne	CAPN1	78	38
CCOC(=O)N[C@H](CNC(=O)N1CC(c2ccccc2)C1)CC(C)C	ZINC000875106692	EF	On-Demand	Anodyne	CAPN2	134	39
CCOC(=O)N[C@H](CNC(=O)N1CC(c2ccccc2)C1)CC(C)C	ZINC000875106692	EF	On-Demand	Anodyne	NPR	56	32
CCOC(=O)N[C@@H](CNC(=O)N1CC(c2ccccc2)C1)CC(C)C	ZINC000875106693	EF	On-Demand	Anodyne	KLK3	58	32
CCOC(=O)N[C@@H](CNC(=O)N1CC(c2ccccc2)C1)CC(C)C	ZINC000875106693	EF	On-Demand	Anodyne	CTSB	44	37
CCOC(=O)N[C@@H](CNC(=O)N1CC(c2ccccc2)C1)CC(C)C	ZINC000875106693	EF	On-Demand	Anodyne	CTSK	53	41
CCOC(=O)N[C@@H](CNC(=O)N1CC(c2ccccc2)C1)CC(C)C	ZINC000875106693	EF	On-Demand	Anodyne	CTSL	23	41
CCOC(=O)N[C@@H](CNC(=O)N1CC(c2ccccc2)C1)CC(C)C	ZINC000875106693	EF	On-Demand	Anodyne	CAPNS1	62	37
CCOC(=O)N[C@@H](CNC(=O)N1CC(c2ccccc2)C1)CC(C)C	ZINC000875106693	EF	On-Demand	Anodyne	HLA-DRB1	65	39
CCOC(=O)N[C@@H](CNC(=O)N1CC(c2ccccc2)C1)CC(C)C	ZINC000875106693	EF	On-Demand	Anodyne	CTSS	17	41
CCOC(=O)N[C@@H](CNC(=O)N1CC(c2ccccc2)C1)CC(C)C	ZINC000875106693	EF	On-Demand	Anodyne	CAPN1	78	38
CCOC(=O)N[C@@H](CNC(=O)N1CC(c2ccccc2)C1)CC(C)C	ZINC000875106693	EF	On-Demand	Anodyne	CAPN2	134	39
CCOC(=O)N[C@@H](CNC(=O)N1CC(c2ccccc2)C1)CC(C)C	ZINC000875106693	EF	On-Demand	Anodyne	NPR	56	32
CC(C)(C)OC(=O)N1CC[C@H]2[C@H]1CCCN2C(=O)NCC1CCC1	ZINC000875106720	EF	On-Demand	Anodyne	PREP	18	44
CC(C)(C)OC(=O)N1CC[C@H]2[C@H]1CCCN2C(=O)NCC1CCC1	ZINC000875106720	EF	On-Demand	Anodyne	CACNA1I	43	34
CC(C)(C)OC(=O)N1CC[C@H]2[C@@H]1CCCN2C(=O)NCC1CCC1	ZINC000875106721	EF	On-Demand	Anodyne	PREP	18	44
CC(C)(C)OC(=O)N1CC[C@H]2[C@@H]1CCCN2C(=O)NCC1CCC1	ZINC000875106721	EF	On-Demand	Anodyne	CACNA1I	43	34
CC(C)(C)OC(=O)N1CC[C@@H]2[C@H]1CCCN2C(=O)NCC1CCC1	ZINC000875106722	EF	On-Demand	Anodyne	PREP	18	44
CC(C)(C)OC(=O)N1CC[C@@H]2[C@H]1CCCN2C(=O)NCC1CCC1	ZINC000875106722	EF	On-Demand	Anodyne	CACNA1I	43	34
CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H]1CCCN2C(=O)NCC1CCC1	ZINC000875106723	EF	On-Demand	Anodyne	PREP	18	44
CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H]1CCCN2C(=O)NCC1CCC1	ZINC000875106723	EF	On-Demand	Anodyne	CACNA1I	43	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NC[C@@H]1CCCOC1)CC2	ZINC000875106744	GD	On-Demand	Anodyne	SLC18A2	45	33
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NC[C@@H]1CCCOC1)CC2	ZINC000875106745	GD	On-Demand	Anodyne	SLC18A2	45	33
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NC[C@H]1CCCOC1)CC2	ZINC000875106746	GD	On-Demand	Anodyne	SLC18A2	45	33
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NC[C@H]1CCCOC1)CC2	ZINC000875106747	GD	On-Demand	Anodyne	SLC18A2	45	33
CC(C)(C)CC(C)(C)NC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1	ZINC000875106774	FG	On-Demand	Bother	SLC6A9	15	51
CC(C)(C)CC(C)(C)NC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1	ZINC000875106774	FG	On-Demand	Bother	WDR5	35	40
CC(C)(C)CCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875106802	DG	On-Demand	Anodyne	FKBP1A	29	42
CC(C)(C)CCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875106802	DG	On-Demand	Anodyne	TRY1_BOVIN	42	35
CC(C)(C)CCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875106802	DG	On-Demand	Anodyne	WNT3	41	34
CC(C)(C)CCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875106803	DG	On-Demand	Anodyne	FKBP1A	29	42
CC(C)(C)CCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875106803	DG	On-Demand	Anodyne	TRY1_BOVIN	42	35
CC(C)(C)CCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875106803	DG	On-Demand	Anodyne	WNT3	41	34
CC(C)(C)CCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875106804	DG	On-Demand	Anodyne	FKBP1A	29	42
CC(C)(C)CCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875106804	DG	On-Demand	Anodyne	TRY1_BOVIN	42	35
CC(C)(C)CCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875106804	DG	On-Demand	Anodyne	WNT3	41	34
CC(C)(C)CCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875106805	DG	On-Demand	Anodyne	FKBP1A	29	42
CC(C)(C)CCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875106805	DG	On-Demand	Anodyne	TRY1_BOVIN	42	35
CC(C)(C)CCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875106805	DG	On-Demand	Anodyne	WNT3	41	34
Cc1cc(C(N)=O)ccc1NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875106806	GG	On-Demand	Anodyne	F11	41	33
CON(C)C(=O)c1ccc(S(=O)(=O)N2CCC[C@@H](C)C2)cc1	ZINC000875106813	ED	On-Demand	Anodyne	NAMPT	15	46
CON(C)C(=O)c1ccc(S(=O)(=O)N2CCC[C@H](C)C2)cc1	ZINC000875106814	ED	On-Demand	Anodyne	NAMPT	15	46
O=C(NCCc1ccc(N2CCCCC2)cc1)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875106815	GF	On-Demand	Anodyne	GPBAR1	22	41
O=C(NCCc1ccc(N2CCCCC2)cc1)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875106815	GF	On-Demand	Anodyne	L3MBTL3	53	40
O=C(NCCc1ccc(N2CCCCC2)cc1)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875106817	GF	On-Demand	Anodyne	GPBAR1	22	41
O=C(NCCc1ccc(N2CCCCC2)cc1)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875106817	GF	On-Demand	Anodyne	L3MBTL3	53	40
CC(C)(C)CCNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875106818	EG	On-Demand	Mild	ITK	18	53
CC(C)(C)CCNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875106818	EG	On-Demand	Mild	PANC	56	38
CC(C)(C)CCNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875106842	EH	On-Demand	Anodyne	OPRL1	15	46
COC(=O)CCCCCCNC(=O)N(C1CC1)C1CC1	ZINC000875106867	CE	On-Demand	Anodyne	EPHX2	21	49
Cc1cc(C(N)=O)ccc1NC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875106872	FD	On-Demand	Anodyne	L3MBTL3	86	46
COC(=O)CCCCCCNC(=O)NCc1cc(C)ccc1O	ZINC000875106883	DF	On-Demand	Clean	EPHX2	15	45
COC(=O)CCCCCCNC(=O)N1[C@H]2CC[C@H]1CC1(CC1)C2	ZINC000875106886	DG	On-Demand	Anodyne	EPHX2	23	49
COC(=O)CCCCCCNC(=O)NC1(C)COC1	ZINC000875106888	CD	On-Demand	Anodyne	EPHX2	33	59
CCOc1ccc([C@@H](NC(=O)NC[C@H]2C[C@H](O)C2)c2ccccc2)cc1	ZINC000875106892	FG	On-Demand	Anodyne	PDS	45	35
COC(=O)CCCCCCNC(=O)N[C@@H]1C[C@@H](C)O[C@H]1C	ZINC000875106912	DD	On-Demand	Anodyne	EPHX2	29	55
COC(=O)CCCCCCNC(=O)N[C@@H]1C[C@@H](C)O[C@@H]1C	ZINC000875106914	DD	On-Demand	Anodyne	EPHX2	29	55
COC(=O)CCCCCCNC(=O)N[C@@H]1C[C@H](C)O[C@H]1C	ZINC000875106917	DD	On-Demand	Anodyne	EPHX2	29	55
COC(=O)CCCCCCNC(=O)N[C@@H]1C[C@H](C)O[C@@H]1C	ZINC000875106919	DD	On-Demand	Anodyne	EPHX2	29	55
Cc1ccc(CN2CCO[C@H](CNC(=O)Nc3ccc(C(N)=O)cc3C)C2)cc1	ZINC000875106926	GE	On-Demand	Anodyne	DRD4	20	46
CN(C)C[C@@H]1CN(C(=O)NCCOc2cccc(F)c2)C[C@H]1CN(C)C	ZINC000875106968	FD	On-Demand	Anodyne	CHRNA10	27	40
COC(=O)CCCCCCNC(=O)NC(C)(C)C(C)(C)O	ZINC000875106969	DD	On-Demand	Anodyne	EPHX2	19	51
COC(=O)CCCCCCNC(=O)NC[C@@H]1CCCC12CC2	ZINC000875106970	DF	On-Demand	Anodyne	EPHX2	27	55
COC(=O)CCCCCCNC(=O)NC[C@H]1CCCC12CC2	ZINC000875106971	DF	On-Demand	Anodyne	EPHX2	27	55
COC(=O)CCCCCCNC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875106972	GG	On-Demand	Anodyne	SMO	36	42
COC(=O)CCCCCCNC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875106972	GG	On-Demand	Anodyne	ETHR	64	49
COC(=O)CCCCCCNC(=O)N(C)[C@@H]1CCCC[C@H]1O	ZINC000875106973	DE	On-Demand	Anodyne	EPHX2	16	52
COC(=O)CCCCCCNC(=O)N1CCC2(CCSCC2)CC1	ZINC000875106974	FG	On-Demand	Anodyne	EPHX2	19	47
CON(C)C(=O)[C@H]1CC(=O)N(Cc2ccccc2Cl)C1	ZINC000875106982	CD	On-Demand	Anodyne	P2RX7	27	45
COC(=O)CCCCCCNC(=O)N[C@@H]1COCC[C@H]1O	ZINC000875106984	DC	On-Demand	Anodyne	EPHX2	31	57
O=C(NCCc1ccc2ccccc2c1)N1CCC(CO)(CO)CC1	ZINC000875106985	EE	On-Demand	Anodyne	NPFFR2	18	42
O=C(NCCc1ccc2ccccc2c1)N1CCC(CO)(CO)CC1	ZINC000875106985	EE	On-Demand	Anodyne	NPFFR1	23	42
COCC(C)(C)CCNC(=O)C(=O)N[C@@H](C)COc1ccccc1	ZINC000875106987	ED	On-Demand	Anodyne	PDS	59	36
COCC(C)(C)CCNC(=O)C(=O)N[C@H](C)COc1ccccc1	ZINC000875106989	ED	On-Demand	Anodyne	PDS	59	36
O=C(NCC1CCC1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875107001	FG	On-Demand	Anodyne	SMO	25	46
C[C@@H](NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1)c1ccc(C#N)cc1	ZINC000875107010	EG	On-Demand	Mild	CTRB_BOVIN	44	32
C[C@H](NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1)c1ccc(C#N)cc1	ZINC000875107011	EG	On-Demand	Mild	CTRB_BOVIN	44	32
CC(C)(C)CC(C)(C)NC(=O)/C=C\c1ccc(O)cc1	ZINC000875107012	CH	On-Demand	Anodyne	HDAC8	19	51
CC(C)(C)CC(C)(C)NC(=O)/C=C\c1ccc(O)cc1	ZINC000875107012	CH	On-Demand	Anodyne	F3	26	47
CC(C)(C)CC(C)(C)NC(=O)/C=C\c1ccc(O)cc1	ZINC000875107012	CH	On-Demand	Anodyne	MMP2	15	51
CC(C)(C)CC(C)(C)NC(=O)/C=C\c1ccc(O)cc1	ZINC000875107012	CH	On-Demand	Anodyne	MMP9	15	51
CC(C)(C)CC(C)(C)NC(=O)/C=C\c1ccc(O)cc1	ZINC000875107012	CH	On-Demand	Anodyne	SSSIM	17	53
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2ccc(C#N)cc2)C1	ZINC000875107013	EE	On-Demand	Mild	CTRB_BOVIN	52	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2ccc(C#N)cc2)C1	ZINC000875107014	EE	On-Demand	Mild	CTRB_BOVIN	52	37
CCOC(=O)N[C@H](CNC(=O)N1CCC[C@@H](C(C)(C)O)C1)CC(C)C	ZINC000875107025	FE	On-Demand	Anodyne	REN	15	42
CCOC(=O)N[C@H](CNC(=O)N1CCC[C@H](C(C)(C)O)C1)CC(C)C	ZINC000875107026	FE	On-Demand	Anodyne	REN	15	42
CCOC(=O)N[C@@H](CNC(=O)N1CCC[C@@H](C(C)(C)O)C1)CC(C)C	ZINC000875107027	FE	On-Demand	Anodyne	REN	15	42
CCOC(=O)N[C@@H](CNC(=O)N1CCC[C@H](C(C)(C)O)C1)CC(C)C	ZINC000875107028	FE	On-Demand	Anodyne	REN	15	42
CCOC(=O)N[C@H](CNC(=O)N1Cc2cccc(O)c2C1)CC(C)C	ZINC000875107098	EF	On-Demand	Clean	HLA-DRB1	45	33
CCOC(=O)N[C@H](CNC(=O)N1Cc2cccc(O)c2C1)CC(C)C	ZINC000875107098	EF	On-Demand	Clean	CAPN2	83	36
CCOC(=O)N[C@@H](CNC(=O)N1Cc2cccc(O)c2C1)CC(C)C	ZINC000875107099	EF	On-Demand	Clean	HLA-DRB1	45	33
CCOC(=O)N[C@@H](CNC(=O)N1Cc2cccc(O)c2C1)CC(C)C	ZINC000875107099	EF	On-Demand	Clean	CAPN2	83	36
N#Cc1ccc(Cn2cc(NC(=O)NCC3CCC3)cn2)cc1	ZINC000875107100	DF	On-Demand	Mild	CCR3	33	43
N#Cc1ccc(Cn2cc(NC(=O)NCC3CCC3)cn2)cc1	ZINC000875107100	DF	On-Demand	Mild	ITK	21	52
N#Cc1ccc(Cn2cc(NC(=O)NCC3CCC3)cn2)cc1	ZINC000875107100	DF	On-Demand	Mild	PANC	58	39
CC[C@H](C[C@H](C)O)NC(=O)NCCOc1cccc(F)c1	ZINC000875107113	CE	On-Demand	Anodyne	HRH2	24	45
CC[C@H](C[C@H](C)O)NC(=O)NCCOc1cccc(F)c1	ZINC000875107113	CE	On-Demand	Anodyne	MTNR1A	19	42
CC[C@H](C[C@H](C)O)NC(=O)NCCOc1cccc(F)c1	ZINC000875107113	CE	On-Demand	Anodyne	PDS	69	45
COC(=O)CCCCCCNC(=O)NCc1csc(C)c1C	ZINC000875107120	EG	On-Demand	Anodyne	EPHX2	21	47
CN1CCCC[C@H]1CCOC(=O)c1occc1-c1ccccc1	ZINC000875107128	DH	On-Demand	Anodyne	HRH1	22	41
CN1CCCC[C@H]1CCOC(=O)c1occc1-c1ccccc1	ZINC000875107128	DH	On-Demand	Anodyne	CHRM4	20	41
CN1CCCC[C@H]1CCOC(=O)c1occc1-c1ccccc1	ZINC000875107128	DH	On-Demand	Anodyne	CHRM5	34	41
CN1CCCC[C@H]1CCOC(=O)c1occc1-c1ccccc1	ZINC000875107128	DH	On-Demand	Anodyne	CHRM3	16	41
CN1CCCC[C@H]1CCOC(=O)c1occc1-c1ccccc1	ZINC000875107128	DH	On-Demand	Anodyne	HCRTR1	23	42
CN1CCCC[C@H]1CCOC(=O)c1occc1-c1ccccc1	ZINC000875107128	DH	On-Demand	Anodyne	CHRNA10	58	40
CN1CCCC[C@H]1CCOC(=O)c1occc1-c1ccccc1	ZINC000875107128	DH	On-Demand	Anodyne	ACKR3	69	36
CN1CCCC[C@@H]1CCOC(=O)c1occc1-c1ccccc1	ZINC000875107129	DH	On-Demand	Anodyne	HRH1	22	41
CN1CCCC[C@@H]1CCOC(=O)c1occc1-c1ccccc1	ZINC000875107129	DH	On-Demand	Anodyne	CHRM4	20	41
CN1CCCC[C@@H]1CCOC(=O)c1occc1-c1ccccc1	ZINC000875107129	DH	On-Demand	Anodyne	CHRM5	34	41
CN1CCCC[C@@H]1CCOC(=O)c1occc1-c1ccccc1	ZINC000875107129	DH	On-Demand	Anodyne	CHRM3	16	41
CN1CCCC[C@@H]1CCOC(=O)c1occc1-c1ccccc1	ZINC000875107129	DH	On-Demand	Anodyne	HCRTR1	23	42
CN1CCCC[C@@H]1CCOC(=O)c1occc1-c1ccccc1	ZINC000875107129	DH	On-Demand	Anodyne	CHRNA10	58	40
CN1CCCC[C@@H]1CCOC(=O)c1occc1-c1ccccc1	ZINC000875107129	DH	On-Demand	Anodyne	ACKR3	69	36
COC(=O)CCCCCCNC(=O)N[C@]12C[C@H]1COC2(C)C	ZINC000875107141	DD	On-Demand	Anodyne	EPHX2	33	57
COC(=O)CCCCCCNC(=O)N[C@@]12C[C@H]1COC2(C)C	ZINC000875107142	DD	On-Demand	Anodyne	EPHX2	33	57
COC(=O)CCCCCCNC(=O)N[C@]12C[C@@H]1COC2(C)C	ZINC000875107143	DD	On-Demand	Anodyne	EPHX2	33	57
COC(=O)CCCCCCNC(=O)N[C@@]12C[C@@H]1COC2(C)C	ZINC000875107144	DD	On-Demand	Anodyne	EPHX2	33	57
COC(=O)CCCCCCNC(=O)NC[C@@H]1Cc2ccccc2CO1	ZINC000875107148	EF	On-Demand	Anodyne	EPHX2	15	43
COC(=O)CCCCCCNC(=O)NC[C@@H]1CC[C@H]2C[C@@H]2C1	ZINC000875107154	DF	On-Demand	Anodyne	EPHX2	30	51
COC(=O)CCCCCCNC(=O)NC[C@@H]1CC[C@@H]2C[C@@H]2C1	ZINC000875107155	DF	On-Demand	Anodyne	EPHX2	30	51
COC(=O)CCCCCCNC(=O)NC[C@@H]1CC[C@H]2C[C@H]2C1	ZINC000875107156	DF	On-Demand	Anodyne	EPHX2	30	51
COC(=O)CCCCCCNC(=O)NC[C@@H]1CC[C@@H]2C[C@H]2C1	ZINC000875107157	DF	On-Demand	Anodyne	EPHX2	30	51
COC(=O)CCCCCCNC(=O)N1Cc2cccc(OC)c2C1	ZINC000875107165	EF	On-Demand	Anodyne	HTR1A	26	41
COC(=O)CCCCCCNC(=O)N1Cc2cccc(OC)c2C1	ZINC000875107165	EF	On-Demand	Anodyne	DRD2	27	41
COC(=O)CCCCCCNC(=O)N1Cc2cccc(OC)c2C1	ZINC000875107165	EF	On-Demand	Anodyne	DRD3	43	41
COC(=O)CCCCCCNC(=O)N1Cc2cccc(OC)c2C1	ZINC000875107165	EF	On-Demand	Anodyne	HTR7	15	41
COC(=O)CCCCCCNC(=O)N1Cc2cccc(OC)c2C1	ZINC000875107165	EF	On-Demand	Anodyne	SSTR1	40	32
COC(=O)CCCCCCNC(=O)N1C[C@H]2C(=O)N(C)C(=O)[C@H]2C1	ZINC000875107172	EC	On-Demand	Anodyne	ASAH1	56	32
O=C(NCCc1ccc(N2CCCCC2)cc1)NCCN1CC[C@H](O)C1	ZINC000875107196	FD	On-Demand	Anodyne	CCR3	21	43
O=C(NCCc1ccc(N2CCCCC2)cc1)NCCN1CC[C@H](O)C1	ZINC000875107196	FD	On-Demand	Anodyne	GPBAR1	24	40
O=C(NCCc1ccc(N2CCCCC2)cc1)NCCN1CC[C@H](O)C1	ZINC000875107196	FD	On-Demand	Anodyne	L3MBTL3	41	42
O=C(NCCc1ccc(N2CCCCC2)cc1)NCCN1CC[C@@H](O)C1	ZINC000875107197	FD	On-Demand	Anodyne	CCR3	21	43
O=C(NCCc1ccc(N2CCCCC2)cc1)NCCN1CC[C@@H](O)C1	ZINC000875107197	FD	On-Demand	Anodyne	GPBAR1	24	40
O=C(NCCc1ccc(N2CCCCC2)cc1)NCCN1CC[C@@H](O)C1	ZINC000875107197	FD	On-Demand	Anodyne	L3MBTL3	41	42
COC(=O)CCCCCCNC(=O)NC(C)(C)[C@@H]1CCCCO1	ZINC000875107200	EF	On-Demand	Anodyne	EPHX2	17	54
COC(=O)CCCCCCNC(=O)NC(C)(C)[C@H]1CCCCO1	ZINC000875107201	EF	On-Demand	Anodyne	EPHX2	17	54
COC(=O)CCCCCCNC(=O)N[C@@H]1CC12CCC2	ZINC000875107209	CE	On-Demand	Anodyne	EPHX2	34	60
COC(=O)CCCCCCNC(=O)N[C@H]1CC12CCC2	ZINC000875107210	CE	On-Demand	Anodyne	EPHX2	34	60
O=C(NC[C@H]1CCCOC1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875107243	ED	On-Demand	Anodyne	OXTR	49	36
O=C(NC[C@H]1CCCOC1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875107245	ED	On-Demand	Anodyne	OXTR	49	36
CCc1nccn1C[C@H]1CCCN1C(=O)C(=O)N[C@@H](C)COc1ccccc1	ZINC000875107247	GE	On-Demand	Anodyne	CPT1A	48	34
CCc1nccn1C[C@H]1CCCN1C(=O)C(=O)N[C@H](C)COc1ccccc1	ZINC000875107248	GE	On-Demand	Anodyne	CPT1A	48	34
O=C(NCC1CCC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875107277	CE	On-Demand	Anodyne	CCR1	22	40
O=C(NCC1CCC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875107277	CE	On-Demand	Anodyne	EPHX2	27	45
O=C(NCC1CCC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875107277	CE	On-Demand	Anodyne	SMO	15	43
O=C(NCC1CCC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875107278	CE	On-Demand	Anodyne	CCR1	22	40
O=C(NCC1CCC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875107278	CE	On-Demand	Anodyne	EPHX2	27	45
O=C(NCC1CCC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875107278	CE	On-Demand	Anodyne	SMO	15	43
COC(=O)CCCCCCNC(=O)NCc1cccnc1C	ZINC000875107314	DE	On-Demand	Anodyne	EPHX2	17	44
COC(=O)CCCCCCNC(=O)N[C@@H]1C[C@H]1c1ccsc1	ZINC000875107328	DG	On-Demand	Anodyne	EPHX2	30	49
O=C(NCCc1ccc(N2CCCCC2)cc1)N1CC=CC1	ZINC000875107339	CF	On-Demand	Anodyne	CTSL	15	40
O=C(NCCc1ccc(N2CCCCC2)cc1)N1CC=CC1	ZINC000875107339	CF	On-Demand	Anodyne	L3MBTL3	35	40
O=C(NCCc1ccc(N2CCCCC2)cc1)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875107340	FF	On-Demand	Anodyne	L3MBTL3	35	40
COC(=O)CCCCCCNC(=O)N[C@@H]1[C@H](C)O[C@@H](C)[C@@H]1C	ZINC000875107341	DE	On-Demand	Anodyne	EPHX2	18	54
COC(=O)CCCCCCNC(=O)N[C@@H]1[C@H](C)O[C@H](C)[C@H]1C	ZINC000875107342	DE	On-Demand	Anodyne	EPHX2	18	54
COC(=O)CCCCCCNC(=O)N[C@@H]1[C@H](C)O[C@@H](C)[C@H]1C	ZINC000875107343	DE	On-Demand	Anodyne	EPHX2	18	54
COC(=O)CCCCCCNC(=O)N[C@@H]1[C@H](C)O[C@H](C)[C@@H]1C	ZINC000875107344	DE	On-Demand	Anodyne	EPHX2	18	54
COC(=O)CCCCCCNC(=O)N[C@@H]1C[C@@H](OC)C1	ZINC000875107353	CD	On-Demand	Anodyne	EPHX2	39	70
COC(=O)CCCCCCNC(=O)NCc1ncc(Br)s1	ZINC000875107354	GF	On-Demand	Anodyne	EPHX2	23	50
COC(=O)CCCCCCNC(=O)N1CCCC[C@@H]1[C@@H]1C[C@H](C)CC[C@H]1O	ZINC000875107360	GG	On-Demand	Anodyne	ASAH1	59	32
COC(=O)CCCCCCNC(=O)N1CCCC[C@@H]1[C@@H]1C[C@H](C)CC[C@@H]1O	ZINC000875107361	GG	On-Demand	Anodyne	ASAH1	59	32
COC(=O)CCCCCCNC(=O)N1CCCC[C@@H]1[C@@H]1C[C@@H](C)CC[C@H]1O	ZINC000875107362	GG	On-Demand	Anodyne	ASAH1	59	32
COC(=O)CCCCCCNC(=O)N1CCCC[C@@H]1[C@@H]1C[C@@H](C)CC[C@@H]1O	ZINC000875107363	GG	On-Demand	Anodyne	ASAH1	59	32
COC(=O)CCCCCCNC(=O)NC[C@H]1CC(C)(C)CO1	ZINC000875107364	DE	On-Demand	Anodyne	EPHX2	29	52
COC(=O)CCCCCCNC(=O)NC[C@@H]1CC(C)(C)CO1	ZINC000875107365	DE	On-Demand	Anodyne	EPHX2	29	52
COC(=O)CCCCCCNC(=O)N[C@@H]1CCCn2nccc21	ZINC000875107388	DE	On-Demand	Anodyne	EPHX2	16	52
COC(=O)CCCCCCNC(=O)N[C@H]1CCCn2nccc21	ZINC000875107389	DE	On-Demand	Anodyne	EPHX2	16	52
COC(=O)[C@@]12C[C@@H](NC(=O)NCCOc3cccc(F)c3)C[C@@H]1C2	ZINC000875107398	ED	On-Demand	Anodyne	HRH2	25	43
COC(=O)CCCCCCNC(=O)N1Cc2cccc(O)c2C1	ZINC000875107410	DF	On-Demand	Clean	ASAH1	54	32
COC(=O)CCCCCCNC(=O)NCc1cccc2[nH]ccc12	ZINC000875107411	EG	On-Demand	Anodyne	EPHX2	15	43
COC(=O)CCCCCCNC(=O)NCc1cccc(F)c1F	ZINC000875107412	EF	On-Demand	Anodyne	EPHX2	18	46
COC(=O)CCCCCCNC(=O)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875107427	ED	On-Demand	Anodyne	ASAH1	42	33
COC(=O)CCCCCCNC(=O)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875107428	ED	On-Demand	Anodyne	ASAH1	42	33
COC(=O)CCCCCCNC(=O)N[C@@H]1[C@H]2C[C@@H]3CO[C@H]1[C@H]3C2	ZINC000875107439	DD	On-Demand	Anodyne	EPHX2	21	46
COC(=O)CCCCCCNC(=O)N[C@@H]1[C@@H]2C[C@@H]3[C@@H]1OC[C@@H]3C2	ZINC000875107440	DD	On-Demand	Anodyne	EPHX2	21	46
COC(=O)CCCCCCNC(=O)N[C@@H]1[C@@H]2C[C@H]3[C@H](CO[C@H]31)C2	ZINC000875107441	DD	On-Demand	Anodyne	EPHX2	21	46
COC(=O)CCCCCCNC(=O)N[C@@H]1[C@H]2C[C@@H]3CO[C@@H]1[C@H]3C2	ZINC000875107442	DD	On-Demand	Anodyne	EPHX2	21	46
COC(=O)CCCCCCNC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875107445	ED	On-Demand	Anodyne	ASAH1	45	30
COC(=O)CCCCCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875107447	FG	On-Demand	Anodyne	TRY1_BOVIN	44	33
COC(=O)CCCCCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875107448	FG	On-Demand	Anodyne	TRY1_BOVIN	44	33
COC(=O)CCCCCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875107449	FG	On-Demand	Anodyne	TRY1_BOVIN	44	33
COC(=O)CCCCCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875107450	FG	On-Demand	Anodyne	TRY1_BOVIN	44	33
COC(=O)CCCCCCNC(=O)NCc1ccc2cccnc2c1	ZINC000875107480	EG	On-Demand	Anodyne	HDAC9	15	47
COC(=O)CCCCCCNC(=O)NCc1ccc2cccnc2c1	ZINC000875107480	EG	On-Demand	Anodyne	SUCNR1	45	37
COC(=O)CCCCCCNC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875107483	FF	On-Demand	Anodyne	EPHX2	21	52
COC(=O)CCCCCCNC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875107484	FF	On-Demand	Anodyne	EPHX2	21	52
CCOc1ccc([C@@H](NC(=O)N2CCCN(C=O)CC2)c2ccccc2)cc1	ZINC000875107495	GG	On-Demand	Anodyne	P2RY12	16	42
COC(=O)CCCCCCNC(=O)NC1CN(c2ccncn2)C1	ZINC000875107497	ED	On-Demand	Anodyne	EPHX2	18	55
COC(=O)CCCCCCNC(=O)N[C@H]1Cc2ccc(C#N)cc2C1	ZINC000875107498	EE	On-Demand	Mild	EPHX2	15	52
COC(=O)CCCCCCNC(=O)N[C@@H]1Cc2ccc(C#N)cc2C1	ZINC000875107499	EE	On-Demand	Mild	EPHX2	15	52
COC(=O)CCCCCCNC(=O)N[C@@H]1CC(C)(C)CC[C@H]1O	ZINC000875107506	EE	On-Demand	Anodyne	EPHX2	32	55
C/C=C\CNC(=O)NCCCCCCC(=O)OC	ZINC000875107507	CD	On-Demand	Anodyne	EPHX2	27	64
C/C=C/CNC(=O)NCCCCCCC(=O)OC	ZINC000875107508	CD	On-Demand	Anodyne	EPHX2	27	64
COC(=O)CCCCCCNC(=O)N1C[C@@H](OC)C[C@@]1(C)CO	ZINC000875107509	ED	On-Demand	Anodyne	EPHX2	15	45
COC(=O)CCCCCCNC(=O)N1C[C@H](OC)C[C@@]1(C)CO	ZINC000875107510	ED	On-Demand	Anodyne	EPHX2	15	45
COC(=O)CCCCCCNC(=O)N1C[C@H](OC)C[C@]1(C)CO	ZINC000875107511	ED	On-Demand	Anodyne	EPHX2	15	45
COC(=O)CCCCCCNC(=O)N1C[C@@H](OC)C[C@]1(C)CO	ZINC000875107512	ED	On-Demand	Anodyne	EPHX2	15	45
COC(=O)CCCCCCNC(=O)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875107513	EG	On-Demand	Anodyne	EPHX2	15	40
COC(=O)CCCCCCNC(=O)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875107513	EG	On-Demand	Anodyne	ASAH1	61	33
COC(=O)CCCCCCNC(=O)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875107514	EG	On-Demand	Anodyne	EPHX2	15	40
COC(=O)CCCCCCNC(=O)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875107514	EG	On-Demand	Anodyne	ASAH1	61	33
C[C@@]1(CO)CN(C(=O)NCCc2ccc(N3CCCCC3)cc2)C[C@]1(C)CO	ZINC000875107524	GE	On-Demand	Anodyne	CTSK	23	41
C[C@@]1(CO)CN(C(=O)NCCc2ccc(N3CCCCC3)cc2)C[C@]1(C)CO	ZINC000875107524	GE	On-Demand	Anodyne	CTSL	17	41
C[C@@]1(CO)CN(C(=O)NCCc2ccc(N3CCCCC3)cc2)C[C@]1(C)CO	ZINC000875107524	GE	On-Demand	Anodyne	L3MBTL3	29	41
COC(=O)CCCCCCNC(=O)N1CC[C@H](O)[C@H]2CCCC[C@@H]21	ZINC000875107527	EE	On-Demand	Anodyne	ASAH1	63	32
COC(=O)CCCCCCNC(=O)N1CC[C@H](O)[C@@H]2CCCC[C@H]21	ZINC000875107528	EE	On-Demand	Anodyne	ASAH1	63	32
COC(=O)CCCCCCNC(=O)N1CC[C@H](O)[C@@H]2CCCC[C@@H]21	ZINC000875107529	EE	On-Demand	Anodyne	ASAH1	63	32
COC(=O)CCCCCCNC(=O)N1CC[C@H](O)[C@H]2CCCC[C@H]21	ZINC000875107530	EE	On-Demand	Anodyne	ASAH1	63	32
O=C(NCCOc1cccc(F)c1)NC[C@H]1C[C@H](O)C1	ZINC000875107549	CD	On-Demand	Anodyne	HRH2	26	41
COC(=O)CCCCCCNC(=O)N1CCN(S(=O)(=O)C2CC2)CC1	ZINC000875107571	GC	On-Demand	Anodyne	EPHX2	16	45
COC(=O)CCCCCCNC(=O)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875107572	DD	On-Demand	Anodyne	EPHX2	16	44
COC(=O)CCCCCCNC(=O)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875107572	DD	On-Demand	Anodyne	ASAH1	40	33
C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCCc1ccc(N2CCCCC2)cc1	ZINC000875107574	FG	On-Demand	Anodyne	L3MBTL3	33	40
C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)NCCc1ccc(N2CCCCC2)cc1	ZINC000875107575	FG	On-Demand	Anodyne	L3MBTL3	33	40
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCCc1ccc(N2CCCCC2)cc1	ZINC000875107576	FG	On-Demand	Anodyne	L3MBTL3	33	40
COC(=O)CCCCCCNC(=O)N[C@@H]1CCCC[C@@H]1F	ZINC000875107577	DF	On-Demand	Anodyne	EPHX2	28	67
COC(=O)CCCCCCNC(=O)NC[C@@H]1COCCN1C	ZINC000875107583	DC	On-Demand	Anodyne	EPHX2	30	50
COC(=O)CCCCCCNC(=O)NC[C@H]1COCCN1C	ZINC000875107584	DC	On-Demand	Anodyne	EPHX2	30	50
COC(=O)CCCCCCNC(=O)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875107591	DE	On-Demand	Anodyne	EPHX2	27	51
COC(=O)CCCCCCNC(=O)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875107592	DE	On-Demand	Anodyne	EPHX2	27	51
COC(=O)CCCCCCNC(=O)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875107593	DE	On-Demand	Anodyne	EPHX2	27	51
COC(=O)CCCCCCNC(=O)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875107594	DE	On-Demand	Anodyne	EPHX2	27	51
COC(=O)CCCCCCNC(=O)N[C@H]1CCN(C2CCC2)C1=O	ZINC000875107599	ED	On-Demand	Anodyne	EPHX2	19	55
COC(=O)CCCCCCNC(=O)N[C@@H]1CCN(C2CCC2)C1=O	ZINC000875107600	ED	On-Demand	Anodyne	EPHX2	19	55
COC(=O)CCCCCCNC(=O)N(C)C[C@@H]1C[C@H](O)C1	ZINC000875107607	DD	On-Demand	Anodyne	EPHX2	15	46
COC(=O)CCCCCCNC(=O)N[C@@H]1CCCC12CC2	ZINC000875107613	CF	On-Demand	Anodyne	EPHX2	30	62
COC(=O)CCCCCCNC(=O)N[C@H]1CCCC12CC2	ZINC000875107614	CF	On-Demand	Anodyne	EPHX2	30	62
O=C(NCCOc1cccc(F)c1)N1CCC(CO)(CO)CC1	ZINC000875107621	EC	On-Demand	Anodyne	CACNA1H	40	34
COC(=O)CCCCCCNC(=O)N[C@@H]1CCOC[C@@H]1O	ZINC000875107625	DC	On-Demand	Anodyne	EPHX2	29	56
COC(=O)CCCCCCNC(=O)N[C@H]1CCOC[C@H]1O	ZINC000875107626	DC	On-Demand	Anodyne	EPHX2	29	56
COC(=O)CCCCCCNC(=O)N[C@H]1CCOC[C@@H]1O	ZINC000875107627	DC	On-Demand	Anodyne	EPHX2	29	56
COC(=O)CCCCCCNC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875107628	DC	On-Demand	Anodyne	EPHX2	29	56
COC(=O)CCCCCCNC(=O)N1CCc2c(F)ccc(C(=O)OC)c2C1	ZINC000875107630	GF	On-Demand	Anodyne	ASAH1	42	32
COC(=O)CCCCCCNC(=O)N1CCC(F)(F)C[C@H]1C	ZINC000875107631	DF	On-Demand	Anodyne	EPHX2	16	45
COC(=O)CCCCCCNC(=O)N1CCC(F)(F)C[C@@H]1C	ZINC000875107632	DF	On-Demand	Anodyne	EPHX2	16	45
COC(=O)CCCCCCNC(=O)NCc1ccc(O)c(Cl)c1	ZINC000875107634	EF	On-Demand	Anodyne	EPHX2	15	44
COC(=O)CCCCCCNC(=O)NCc1ccc(O)c(Cl)c1	ZINC000875107634	EF	On-Demand	Anodyne	NCE103	17	49
COC(=O)CCCCCCNC(=O)NC1([C@@H]2CCCCO2)CCC1	ZINC000875107635	EF	On-Demand	Anodyne	EPHX2	26	51
COC(=O)CCCCCCNC(=O)NC1([C@H]2CCCCO2)CCC1	ZINC000875107636	EF	On-Demand	Anodyne	EPHX2	26	51
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCOc1cccc(F)c1	ZINC000875107638	ED	On-Demand	Anodyne	SLC6A4	22	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCOc1cccc(F)c1	ZINC000875107638	ED	On-Demand	Anodyne	SLC6A3	42	45
COC(=O)CCCCCCNC(=O)N1CCN(c2cccc3[nH]ccc23)CC1	ZINC000875107639	GG	On-Demand	Anodyne	HTR1A	35	40
COC(=O)CCCCCCNC(=O)N1CCN(c2cccc3[nH]ccc23)CC1	ZINC000875107639	GG	On-Demand	Anodyne	DRD2	31	43
COC(=O)CCCCCCNC(=O)N1CCN(c2cccc3[nH]ccc23)CC1	ZINC000875107639	GG	On-Demand	Anodyne	HTR1D	16	40
COC(=O)CCCCCCNC(=O)N1CCN(c2cccc3[nH]ccc23)CC1	ZINC000875107639	GG	On-Demand	Anodyne	HTR1B	18	40
COC(=O)CCCCCCNC(=O)N1CCN(c2cccc3[nH]ccc23)CC1	ZINC000875107639	GG	On-Demand	Anodyne	DRD3	56	39
COC(=O)CCCCCCNC(=O)NC[C@@H]1CCC12CCOCC2	ZINC000875107647	EF	On-Demand	Anodyne	EPHX2	23	49
COC(=O)CCCCCCNC(=O)NC[C@H]1CCC12CCOCC2	ZINC000875107648	EF	On-Demand	Anodyne	EPHX2	23	49
COC(=O)CCCCCCNC(=O)NCC1(C)C[C@@H]2C[C@H]2C1	ZINC000875107649	DF	On-Demand	Anodyne	EPHX2	39	59
COC(=O)CCCCCCNC(=O)NC[C@@]1(C)C[C@@H]2C[C@@H]2C1	ZINC000875107650	DF	On-Demand	Anodyne	EPHX2	39	59
COC(=O)CCCCCCNC(=O)NCC1(C)C[C@H]2C[C@@H]2C1	ZINC000875107651	DF	On-Demand	Anodyne	EPHX2	39	59
COC(=O)CCCCCCNC(=O)N1[C@H]2CC[C@H]1CC1(C2)CC1(F)F	ZINC000875107652	FG	On-Demand	Anodyne	EPHX2	17	45
COC(=O)CCCCCCNC(=O)N1CC[C@H]2CC[C@@H](C1)S2	ZINC000875107661	EF	On-Demand	Anodyne	EPHX2	16	43
CS(=O)(=O)NC1CN(C(=O)NCCc2ccc(N3CCCCC3)cc2)C1	ZINC000875107662	GD	On-Demand	Anodyne	CTSL	15	41
COC(=O)CCCCCCNC(=O)Nc1cnn(C2CCN(C)CC2)c1	ZINC000875107667	FE	On-Demand	Anodyne	EPHX2	15	44
COC(=O)CCCCCCNC(=O)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875107687	FG	On-Demand	Anodyne	EPHX2	20	53
COC(=O)CCCCCCNC(=O)N[C@@H]1COC[C@@H]1O	ZINC000875107693	CC	On-Demand	Anodyne	EPHX2	28	58
O=C(NCCc1ccc(N2CCCCC2)cc1)N1CCC[C@@H]1Cn1ccnc1	ZINC000875107695	GG	On-Demand	Anodyne	NOS2	35	41
COC(=O)CCCCCCNC(=O)N[C@@H]1C[C@@H](SC)C1	ZINC000875107706	DE	On-Demand	Anodyne	EPHX2	33	65
COC(=O)CCCCCCNC(=O)N[C@@H]1CO[C@H](C2CC2)C1	ZINC000875107714	DD	On-Demand	Anodyne	EPHX2	28	62
COC(=O)CCCCCCNC(=O)N[C@H]1CO[C@H](C2CC2)C1	ZINC000875107715	DD	On-Demand	Anodyne	EPHX2	28	62
COC(=O)CCCCCCNC(=O)N[C@@H]1CO[C@@H](C2CC2)C1	ZINC000875107716	DD	On-Demand	Anodyne	EPHX2	28	62
COC(=O)CCCCCCNC(=O)N[C@H]1CO[C@@H](C2CC2)C1	ZINC000875107717	DD	On-Demand	Anodyne	EPHX2	28	62
CC(C)(C)CC(C)(C)NC(=O)c1cc(S(=O)(=O)Nc2ccccc2F)ccc1Cl	ZINC000875107724	IK	On-Demand	Anodyne	GRM4	16	44
CC(C)(C)CC(C)(C)NC(=O)c1cc(S(=O)(=O)Nc2ccccc2F)ccc1Cl	ZINC000875107724	IK	On-Demand	Anodyne	PRTN3	58	38
CC(C)(C)CC(C)(C)NC(=O)c1cc(S(=O)(=O)Nc2ccccc2F)ccc1Cl	ZINC000875107724	IK	On-Demand	Anodyne	CCR2	19	42
CCCCCCCNC(=O)C(=O)NCCN1CCN(S(C)(=O)=O)CC1	ZINC000875107796	GB	On-Demand	Mild	ASAH1	68	34
O=C(NCc1cccc(NC(=O)c2cccc(F)c2)c1)C(=O)N[C@@H]1CC12CCC2	ZINC000875107807	GF	On-Demand	Anodyne	KCNK3	76	46
O=C(NCc1cccc(NC(=O)c2cccc(F)c2)c1)C(=O)N[C@@H]1CC12CCC2	ZINC000875107807	GF	On-Demand	Anodyne	KCNK9	36	43
O=C(NCc1cccc(NC(=O)c2cccc(F)c2)c1)C(=O)N[C@H]1CC12CCC2	ZINC000875107808	GF	On-Demand	Anodyne	KCNK3	76	46
O=C(NCc1cccc(NC(=O)c2cccc(F)c2)c1)C(=O)N[C@H]1CC12CCC2	ZINC000875107808	GF	On-Demand	Anodyne	KCNK9	36	43
CON(C)C(=O)c1c2c(nc3ccccc13)CC[C@@H](C(C)(C)C)C2	ZINC000875107829	EI	On-Demand	Anodyne	ACHE	40	37
CON(C)C(=O)c1c2c(nc3ccccc13)CC[C@@H](C(C)(C)C)C2	ZINC000875107829	EI	On-Demand	Anodyne	BCHE	66	35
CON(C)C(=O)c1c2c(nc3ccccc13)CC[C@@H](C(C)(C)C)C2	ZINC000875107829	EI	On-Demand	Anodyne	PANC	46	34
CON(C)C(=O)c1c2c(nc3ccccc13)CC[C@H](C(C)(C)C)C2	ZINC000875107830	EI	On-Demand	Anodyne	ACHE	40	37
CON(C)C(=O)c1c2c(nc3ccccc13)CC[C@H](C(C)(C)C)C2	ZINC000875107830	EI	On-Demand	Anodyne	BCHE	66	35
CON(C)C(=O)c1c2c(nc3ccccc13)CC[C@H](C(C)(C)C)C2	ZINC000875107830	EI	On-Demand	Anodyne	PANC	46	34
CC(C)(C)OC(=O)N1CCN(CCCNC(=O)N2CC=CC2)CC1	ZINC000875107869	ED	On-Demand	Anodyne	DRD2	16	45
Cc1nccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)n1	ZINC000875107885	GD	On-Demand	Anodyne	DRD2	21	42
Cc1nccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)n1	ZINC000875107885	GD	On-Demand	Anodyne	DRD4	47	42
Cc1nccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)n1	ZINC000875107885	GD	On-Demand	Anodyne	ACHE	65	58
Cc1nccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)n1	ZINC000875107885	GD	On-Demand	Anodyne	DRD3	20	41
Cc1nccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)n1	ZINC000875107885	GD	On-Demand	Anodyne	HTR4	17	40
Cc1nccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)n1	ZINC000875107885	GD	On-Demand	Anodyne	SIGMAR1	45	44
Cc1nccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)n1	ZINC000875107885	GD	On-Demand	Anodyne	SSTR5	43	36
Cc1nccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)n1	ZINC000875107885	GD	On-Demand	Anodyne	BCHE	19	48
Cc1nccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)n1	ZINC000875107885	GD	On-Demand	Anodyne	SIRT3	51	32
Cc1nccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)n1	ZINC000875107885	GD	On-Demand	Anodyne	SIRT2	52	32
Cc1nccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)n1	ZINC000875107885	GD	On-Demand	Anodyne	SIRT1	52	40
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCCC(=O)NC2CCCCC2)c1	ZINC000875107886	GE	On-Demand	Anodyne	SSTR5	30	41
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCCC(=O)NC2CCCCC2)c1	ZINC000875107887	GE	On-Demand	Anodyne	SSTR5	30	41
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1ccnc(C)n1)CC2	ZINC000875107894	GD	On-Demand	Anodyne	HCRTR1	15	45
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1ccnc(C)n1)CC2	ZINC000875107894	GD	On-Demand	Anodyne	HCRTR2	17	40
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1ccnc(C)n1)CC2	ZINC000875107895	GD	On-Demand	Anodyne	HCRTR1	15	45
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1ccnc(C)n1)CC2	ZINC000875107895	GD	On-Demand	Anodyne	HCRTR2	17	40
NC(=O)CCOC(=O)Cn1c(Cc2ccccc2)nc2ccccc21	ZINC000875107914	EE	On-Demand	Anodyne	PDE6D	40	36
Cc1nccc(CNC(=O)C(=O)N2CCN(c3ccc(F)cc3F)CC2)n1	ZINC000875107921	GD	On-Demand	Anodyne	NPY2R	43	37
O=C(NCc1cccc(NC(=O)c2ccc(F)cc2)c1)C(=O)N[C@@H]1CC12CCC2	ZINC000875107988	GF	On-Demand	Anodyne	SSTR3	20	43
O=C(NCc1cccc(NC(=O)c2ccc(F)cc2)c1)C(=O)N[C@@H]1CC12CCC2	ZINC000875107988	GF	On-Demand	Anodyne	KCNK3	57	45
O=C(NCc1cccc(NC(=O)c2ccc(F)cc2)c1)C(=O)N[C@H]1CC12CCC2	ZINC000875107989	GF	On-Demand	Anodyne	SSTR3	20	43
O=C(NCc1cccc(NC(=O)c2ccc(F)cc2)c1)C(=O)N[C@H]1CC12CCC2	ZINC000875107989	GF	On-Demand	Anodyne	KCNK3	57	45
Cc1nccc(CNC(=O)C(=O)N2CC[C@@H](c3cccc(Cl)c3)C2(C)C)n1	ZINC000875108019	GF	On-Demand	Anodyne	MDM2	51	33
Cc1nccc(CNC(=O)C(=O)N2CC[C@H](c3cccc(Cl)c3)C2(C)C)n1	ZINC000875108022	GF	On-Demand	Anodyne	MDM2	51	33
CCCCCCCNC(=O)C(=O)NCCc1nccs1	ZINC000875108037	CD	On-Demand	Mild	MAP1	20	40
CCCCCCCNC(=O)C(=O)NCCc1nccs1	ZINC000875108037	CD	On-Demand	Mild	ASAH1	91	38
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCc1nccs1)CC2	ZINC000875108067	GD	On-Demand	Anodyne	SLC18A2	45	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCc1nccs1)CC2	ZINC000875108068	GD	On-Demand	Anodyne	SLC18A2	45	34
CC(C)(C)CC(C)(C)NC(=O)[C@H](CC(N)=O)NC(=O)c1ccccc1Cl	ZINC000875108075	GF	On-Demand	Anodyne	ECR	46	38
CC(C)(C)CC(C)(C)NC(=O)[C@@H](CC(N)=O)NC(=O)c1ccccc1Cl	ZINC000875108076	GF	On-Demand	Anodyne	ECR	46	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2CCCCCCC2)C1	ZINC000875108080	DE	On-Demand	Anodyne	DPP7	15	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2CCCCCCC2)C1	ZINC000875108081	DE	On-Demand	Anodyne	DPP7	15	43
CN(Cc1ccns1)C(=O)NCCCN1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875108274	GE	On-Demand	Anodyne	DRD2	16	40
COc1cc(CNC(=O)N2CCCN(C=O)CC2)ccc1OCC(=O)N(C)C	ZINC000875108275	GC	On-Demand	Anodyne	PDE6A	40	31
COc1cc(CNC(=O)N(C)OCC(F)(F)F)ccc1OCC(=O)N(C)C	ZINC000875108296	GD	On-Demand	Anodyne	PDE6A	40	32
COc1cc(CNC(=O)N(C)OCC(F)(F)F)ccc1OCC(=O)N(C)C	ZINC000875108296	GD	On-Demand	Anodyne	MT-ND1	24	41
COc1cc(CNC(=O)N(C)OCC(F)(F)F)ccc1OCC(=O)N(C)C	ZINC000875108296	GD	On-Demand	Anodyne	DRTS_TRYCR	42	29
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NCc3ccnc(C)n3)C2)c1	ZINC000875108300	GC	On-Demand	Anodyne	PDE8B	60	33
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NCc3ccnc(C)n3)C2)c1	ZINC000875108301	GC	On-Demand	Anodyne	PDE8B	60	33
O=C(N[C@@H]1CCN2CCCC[C@H]12)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875108333	EE	On-Demand	Anodyne	EPHX2	26	48
O=C(N[C@@H]1CCN2CCCC[C@@H]12)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875108334	EE	On-Demand	Anodyne	EPHX2	26	48
O=C(N[C@@H]1CCN2CCCC[C@H]12)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875108335	EE	On-Demand	Anodyne	EPHX2	26	48
O=C(N[C@@H]1CCN2CCCC[C@@H]12)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875108336	EE	On-Demand	Anodyne	EPHX2	26	48
NC(=O)CCOC(=O)c1cn(Cc2ccccc2)c2ccccc12	ZINC000875108385	DF	On-Demand	Anodyne	CNR1	17	54
NC(=O)CCOC(=O)c1cn(Cc2ccccc2)c2ccccc12	ZINC000875108385	DF	On-Demand	Anodyne	CNR2	25	54
NC(=O)CCOC(=O)c1cn(Cc2ccccc2)c2ccccc12	ZINC000875108385	DF	On-Demand	Anodyne	PLA2G2A	75	47
NC(=O)CCOC(=O)c1cn(Cc2ccccc2)c2ccccc12	ZINC000875108385	DF	On-Demand	Anodyne	F2RL3	20	48
CCCCCCCNC(=O)C(=O)NCc1cn2ccc(C)cc2n1	ZINC000875108399	EE	On-Demand	Mild	ASAH1	92	37
CON(C)C(=O)CN1C(=O)S/C(=C/c2cccs2)C1=O	ZINC000875108403	DD	On-Demand	Anodyne	AKR1B1	48	43
CON(C)C(=O)CN1C(=O)S/C(=C\c2cccs2)C1=O	ZINC000875108404	DD	On-Demand	Anodyne	AKR1B1	48	43
CC(C)(C)OC(=O)N1CCN(CCCNC(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875108474	GD	On-Demand	Anodyne	GPR119	42	39
CC(C)(C)OC(=O)N1CCN(CCCNC(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875108475	GD	On-Demand	Anodyne	GPR119	42	39
C#CC[C@@H](COC)NC(=O)C(=O)NCc1cccc(COc2ccccc2)c1	ZINC000875108494	GE	On-Demand	Mild	MAOB	20	42
C#CC[C@@H](COC)NC(=O)C(=O)NCc1cccc(COc2ccccc2)c1	ZINC000875108494	GE	On-Demand	Mild	PTGER3	40	35
C#CC[C@@H](COC)NC(=O)C(=O)NCc1cccc(COc2ccccc2)c1	ZINC000875108494	GE	On-Demand	Mild	GYS1	40	31
C#CC[C@@H](COC)NC(=O)C(=O)NCc1cccc(COc2ccccc2)c1	ZINC000875108494	GE	On-Demand	Mild	FFAR1	33	40
C#CC[C@@H](COC)NC(=O)C(=O)NCc1cccc(COc2ccccc2)c1	ZINC000875108494	GE	On-Demand	Mild	PDS	71	38
C#CC[C@H](COC)NC(=O)C(=O)NCc1cccc(COc2ccccc2)c1	ZINC000875108495	GE	On-Demand	Mild	MAOB	20	42
C#CC[C@H](COC)NC(=O)C(=O)NCc1cccc(COc2ccccc2)c1	ZINC000875108495	GE	On-Demand	Mild	PTGER3	40	35
C#CC[C@H](COC)NC(=O)C(=O)NCc1cccc(COc2ccccc2)c1	ZINC000875108495	GE	On-Demand	Mild	GYS1	40	31
C#CC[C@H](COC)NC(=O)C(=O)NCc1cccc(COc2ccccc2)c1	ZINC000875108495	GE	On-Demand	Mild	FFAR1	33	40
C#CC[C@H](COC)NC(=O)C(=O)NCc1cccc(COc2ccccc2)c1	ZINC000875108495	GE	On-Demand	Mild	PDS	71	38
Cc1nccc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)n1	ZINC000875108624	ED	On-Demand	Anodyne	SIRT3	53	33
Cc1nccc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)n1	ZINC000875108624	ED	On-Demand	Anodyne	SIRT2	54	34
Cc1nccc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)n1	ZINC000875108624	ED	On-Demand	Anodyne	SIRT1	53	38
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(COc3ccccc3)c2)CC1	ZINC000875108633	GF	On-Demand	Anodyne	ADAM17	44	36
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(COc3ccccc3)c2)CC1	ZINC000875108633	GF	On-Demand	Anodyne	CPT1A	48	42
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(COc3ccccc3)c2)CC1	ZINC000875108633	GF	On-Demand	Anodyne	GYS1	46	34
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(COc3ccccc3)c2)CC1	ZINC000875108633	GF	On-Demand	Anodyne	PDS	55	35
Cc1nccc(CNC(=O)C(=O)NCCCCCCc2ccccc2)n1	ZINC000875108636	FE	On-Demand	Anodyne	SCNN1A	52	38
Cc1nccc(CNC(=O)C(=O)NCCCCCCc2ccccc2)n1	ZINC000875108636	FE	On-Demand	Anodyne	SCN2A	17	40
Cc1nccc(CNC(=O)C(=O)NCCCCCCc2ccccc2)n1	ZINC000875108636	FE	On-Demand	Anodyne	FAAH	75	41
Cc1nccc(CNC(=O)C(=O)NCCCCCCc2ccccc2)n1	ZINC000875108636	FE	On-Demand	Anodyne	CES1	75	42
Cc1nccc(CNC(=O)C(=O)NCCCCCCc2ccccc2)n1	ZINC000875108636	FE	On-Demand	Anodyne	AMP1_PLAFQ	27	44
Cc1nccc(CNC(=O)C(=O)NCCCCCCc2ccccc2)n1	ZINC000875108636	FE	On-Demand	Anodyne	CES1D	43	32
O=C(NCC[C@H]1CCSC1)C(=O)NCc1cccc(COc2ccccc2)c1	ZINC000875108647	GG	On-Demand	Anodyne	PDS	42	32
O=C(NCC[C@@H]1CCSC1)C(=O)NCc1cccc(COc2ccccc2)c1	ZINC000875108648	GG	On-Demand	Anodyne	PDS	42	32
CC(=O)C1CCN(C(=O)C(=O)NCCC(=O)NC2CCCCC2)CC1	ZINC000875108672	FC	On-Demand	Anodyne	EPHX2	21	44
Cc1nccc(CNC(=O)C(=O)NC[C@H]2CN(Cc3ccccc3C)CCO2)n1	ZINC000875108676	GC	On-Demand	Anodyne	PDE8B	67	34
Cc1nccc(CNC(=O)C(=O)NC[C@@H]2CN(Cc3ccccc3C)CCO2)n1	ZINC000875108677	GC	On-Demand	Anodyne	PDE8B	67	34
CN1CCN(C2CCN(C(=O)C(=O)NCC3CCCCCCC3)CC2)CC1	ZINC000875108698	GD	On-Demand	Anodyne	L3MBTL3	52	41
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)NCC1CCCCCCC1	ZINC000875108701	GG	On-Demand	Anodyne	ROCK1	26	40
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)NCC1CCCCCCC1	ZINC000875108701	GG	On-Demand	Anodyne	ROCK2	19	40
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCN4CCCC[C@@H]34)cn2)cc1	ZINC000875108763	FF	On-Demand	Mild	ITK	18	47
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCN4CCCC[C@@H]34)cn2)cc1	ZINC000875108763	FF	On-Demand	Mild	PANC	41	36
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCN4CCCC[C@@H]34)cn2)cc1	ZINC000875108764	FF	On-Demand	Mild	ITK	18	47
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCN4CCCC[C@@H]34)cn2)cc1	ZINC000875108764	FF	On-Demand	Mild	PANC	41	36
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCN4CCCC[C@H]34)cn2)cc1	ZINC000875108765	FF	On-Demand	Mild	ITK	18	47
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCN4CCCC[C@H]34)cn2)cc1	ZINC000875108765	FF	On-Demand	Mild	PANC	41	36
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCN4CCCC[C@H]34)cn2)cc1	ZINC000875108766	FF	On-Demand	Mild	ITK	18	47
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCN4CCCC[C@H]34)cn2)cc1	ZINC000875108766	FF	On-Demand	Mild	PANC	41	36
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccnc(C)n3)CC2)c(OC)c1	ZINC000875108826	GC	On-Demand	Clean	DRD4	40	31
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccnc(C)n3)CC2)c(OC)c1	ZINC000875108826	GC	On-Demand	Clean	ADRA1D	19	40
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccnc(C)n3)CC2)c(OC)c1	ZINC000875108826	GC	On-Demand	Clean	ADRA1A	19	40
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccnc(C)n3)CC2)c(OC)c1	ZINC000875108826	GC	On-Demand	Clean	PDGFRB	45	38
CON(C)C(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1	ZINC000875108851	GH	On-Demand	Bother	GSTM2	42	36
CCC1(CC)CCCN1C(=O)NCc1ccc(OCC(N)=O)c(OC)c1	ZINC000875108852	FE	On-Demand	Anodyne	DRTS_TRYCR	43	29
CCCCCCCNC(=O)C(=O)NCc1ccnc(C)n1	ZINC000875108901	CD	On-Demand	Mild	ASAH1	85	36
Cc1ccc(OC[C@H](C)NC(=O)C(=O)N[C@H](c2ccccn2)C2CCC2)cc1	ZINC000875108902	GF	On-Demand	Anodyne	TTK	26	43
Cc1ccc(OC[C@H](C)NC(=O)C(=O)N[C@@H](c2ccccn2)C2CCC2)cc1	ZINC000875108905	GF	On-Demand	Anodyne	TTK	26	43
Cc1ccc(OC[C@@H](C)NC(=O)C(=O)N[C@@H](c2ccccn2)C2CCC2)cc1	ZINC000875108907	GF	On-Demand	Anodyne	TTK	26	43
Cc1ccc(OC[C@@H](C)NC(=O)C(=O)N[C@H](c2ccccn2)C2CCC2)cc1	ZINC000875108909	GF	On-Demand	Anodyne	TTK	26	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc[nH]n1	ZINC000875108928	CC	On-Demand	Anodyne	SLC6A3	56	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc[nH]n1	ZINC000875108929	CC	On-Demand	Anodyne	SLC6A3	56	39
Cn1nccc1C(NC(=O)C(=O)NCC1CCCCCCC1)c1ccnn1C	ZINC000875108936	GD	On-Demand	Anodyne	CACNA1I	40	32
CCC1(CC)CCCN1C(=O)NCc1ccc(OCC(=O)N(C)C)c(OC)c1	ZINC000875108998	GG	On-Demand	Anodyne	PDE6A	41	32
O=C(N[C@@H]1CCCN(c2ncccn2)C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875109082	FF	On-Demand	Anodyne	EPHX2	15	44
O=C(N[C@H]1CCCN(c2ncccn2)C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875109083	FF	On-Demand	Anodyne	EPHX2	15	44
O=C(N[C@@H]1CCCN(c2ncccn2)C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875109084	FF	On-Demand	Anodyne	EPHX2	15	44
O=C(N[C@H]1CCCN(c2ncccn2)C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875109085	FF	On-Demand	Anodyne	EPHX2	15	44
O=C(N[C@@H](c1ccccc1)C1CCCCC1)N1CCC(CO)(CO)CC1	ZINC000875109112	FG	On-Demand	Anodyne	CTSS	23	43
O=C(N[C@H](c1ccccc1)C1CCCCC1)N1CCC(CO)(CO)CC1	ZINC000875109113	FG	On-Demand	Anodyne	CTSS	23	43
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NCc1cc[nH]n1	ZINC000875109114	EF	On-Demand	Anodyne	SIGMAR1	16	46
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NCc1cc[nH]n1	ZINC000875109114	EF	On-Demand	Anodyne	CPT1A	51	35
O=C(NCc1cc[nH]n1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875109119	CE	On-Demand	Anodyne	EPHX2	21	40
O=C(NCc1cc[nH]n1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875109120	CE	On-Demand	Anodyne	EPHX2	21	40
CC(C)(C)OC(=O)N[C@@H]1CCCCCN(C(=O)NCc2cc[nH]n2)C1	ZINC000875109165	FE	On-Demand	Anodyne	REN	49	36
O=C(NCc1cc[nH]n1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875109183	DD	On-Demand	Anodyne	PDS	47	37
O=C(NCc1cc[nH]n1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875109184	DD	On-Demand	Anodyne	PDS	47	37
CCCCCCCNC(=O)C(=O)NCc1cccc2c1OCCCO2	ZINC000875109193	EF	On-Demand	Mild	MTNR1A	28	55
CCCCCCCNC(=O)C(=O)NCc1cccc2c1OCCCO2	ZINC000875109193	EF	On-Demand	Mild	ASAH1	57	32
CCOc1ccccc1OCc1nnc(SCC(=O)N2CCN(Cc3cccc(C)c3)CC2)n1N	ZINC000875109194	JF	On-Demand	Anodyne	SSTR5	56	35
O=C(NCc1cc[nH]n1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875109199	DD	On-Demand	Anodyne	CPT1A	42	35
O=C(NCc1cc[nH]n1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875109200	DD	On-Demand	Anodyne	CPT1A	42	35
O=C(NCc1cc[nH]n1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875109201	DD	On-Demand	Anodyne	CPT1A	42	35
O=C(NCc1cc[nH]n1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875109202	DD	On-Demand	Anodyne	CPT1A	42	35
CON(C)C(=O)c1ccccc1-c1ccc(C(F)(F)F)cc1	ZINC000875109204	DI	On-Demand	Anodyne	MTTP	106	44
O=C(N[C@@H]1CCN2CCCC[C@@H]12)N1Cc2cccc(O)c2C1	ZINC000875109228	DE	On-Demand	Clean	SLC18A3	56	36
O=C(N[C@@H]1CCN2CCCC[C@@H]12)N1Cc2cccc(O)c2C1	ZINC000875109228	DE	On-Demand	Clean	L3MBTL3	46	35
O=C(N[C@H]1CCN2CCCC[C@@H]12)N1Cc2cccc(O)c2C1	ZINC000875109229	DE	On-Demand	Clean	SLC18A3	56	36
O=C(N[C@H]1CCN2CCCC[C@@H]12)N1Cc2cccc(O)c2C1	ZINC000875109229	DE	On-Demand	Clean	L3MBTL3	46	35
O=C(N[C@@H]1CCN2CCCC[C@H]12)N1Cc2cccc(O)c2C1	ZINC000875109230	DE	On-Demand	Clean	SLC18A3	56	36
O=C(N[C@@H]1CCN2CCCC[C@H]12)N1Cc2cccc(O)c2C1	ZINC000875109230	DE	On-Demand	Clean	L3MBTL3	46	35
O=C(N[C@H]1CCN2CCCC[C@H]12)N1Cc2cccc(O)c2C1	ZINC000875109231	DE	On-Demand	Clean	SLC18A3	56	36
O=C(N[C@H]1CCN2CCCC[C@H]12)N1Cc2cccc(O)c2C1	ZINC000875109231	DE	On-Demand	Clean	L3MBTL3	46	35
O=C(N[C@H]1CCCN(c2ncccn2)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875109251	GE	On-Demand	Anodyne	EPHX2	18	41
O=C(N[C@@H]1CCCN(c2ncccn2)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875109252	GE	On-Demand	Anodyne	EPHX2	18	41
O=C(N[C@H]1CCCN(c2ncccn2)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875109253	GE	On-Demand	Anodyne	EPHX2	18	41
O=C(N[C@@H]1CCCN(c2ncccn2)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875109254	GE	On-Demand	Anodyne	EPHX2	18	41
O=CN1CCCN(C(=O)NCc2ccc(COc3ccccc3)cc2)CC1	ZINC000875109350	FF	On-Demand	Anodyne	PREP	18	40
O=CN1CCCN(C(=O)NCc2ccc(COc3ccccc3)cc2)CC1	ZINC000875109350	FF	On-Demand	Anodyne	DPP7	25	48
O=CN1CCCN(C(=O)NCc2ccc(COc3ccccc3)cc2)CC1	ZINC000875109350	FF	On-Demand	Anodyne	NAMPT	18	40
O=C(OCC(=O)C1CCCCC1)c1occc1-c1ccccc1	ZINC000875109367	DI	On-Demand	Anodyne	AMY2	43	30
O=C(NCCCCC1CC1)C(=O)NCc1ccccc1-n1ccnc1	ZINC000875109372	EE	On-Demand	Anodyne	NOS2	59	31
CN1CC[C@H]2CN(C(=O)C(=O)NCCCCn3ccnc3)CC[C@@H]21	ZINC000875109388	EC	On-Demand	Anodyne	TBXAS1	22	42
CN1CC[C@H]2CN(C(=O)C(=O)NCCCCn3ccnc3)CC[C@@H]21	ZINC000875109388	EC	On-Demand	Anodyne	QPCT	32	40
CN1CC[C@H]2CN(C(=O)C(=O)NCCCCn3ccnc3)CC[C@H]21	ZINC000875109392	EC	On-Demand	Anodyne	TBXAS1	22	42
CN1CC[C@H]2CN(C(=O)C(=O)NCCCCn3ccnc3)CC[C@H]21	ZINC000875109392	EC	On-Demand	Anodyne	QPCT	32	40
CN1CCC(CNC(=O)NCC(=O)NCc2ccccc2)(c2ccccc2)CC1	ZINC000875109414	GE	On-Demand	Anodyne	KCNA3	49	42
CN1CCC(CNC(=O)NCC(=O)NCc2ccccc2)(c2ccccc2)CC1	ZINC000875109414	GE	On-Demand	Anodyne	NPFFR2	36	41
CN1CCC(CNC(=O)NCC(=O)NCc2ccccc2)(c2ccccc2)CC1	ZINC000875109414	GE	On-Demand	Anodyne	SOAT1	17	43
CN1CCC(CNC(=O)NCC(=O)NCc2ccccc2)(c2ccccc2)CC1	ZINC000875109414	GE	On-Demand	Anodyne	NPFFR1	48	55
O=C(NCC[C@H]1CCSC1)C(=O)NCc1ccccc1N1CCCC1	ZINC000875109426	FE	On-Demand	Anodyne	KCNQ2	66	39
O=C(NCC[C@H]1CCSC1)C(=O)NCc1ccccc1N1CCCC1	ZINC000875109426	FE	On-Demand	Anodyne	SCN2A	17	40
O=C(NCC[C@@H]1CCSC1)C(=O)NCc1ccccc1N1CCCC1	ZINC000875109427	FE	On-Demand	Anodyne	KCNQ2	66	39
O=C(NCC[C@@H]1CCSC1)C(=O)NCc1ccccc1N1CCCC1	ZINC000875109427	FE	On-Demand	Anodyne	SCN2A	17	40
COCC(C)(C)CCNC(=O)C(=O)NCc1ccccc1N1CCCC1	ZINC000875109476	FE	On-Demand	Anodyne	KCNQ2	74	42
COCC(C)(C)CCNC(=O)C(=O)NCc1ccccc1N1CCCC1	ZINC000875109476	FE	On-Demand	Anodyne	SCN2A	18	42
COCC(C)(C)CCNC(=O)C(=O)NCc1ccccc1N1CCCC1	ZINC000875109476	FE	On-Demand	Anodyne	SCN10A	15	42
O=C(NCc1ccccc1N1CCCC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875109499	FE	On-Demand	Anodyne	KCNQ2	72	41
O=C(NCc1ccccc1N1CCCC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875109499	FE	On-Demand	Anodyne	SCN2A	17	42
O=C(NCCCCn1ccnc1)C(=O)NCC1(c2cccc(Cl)c2)CCC1	ZINC000875109523	GF	On-Demand	Anodyne	TBXAS1	46	49
O=C(NCCCCn1ccnc1)C(=O)NCC1(c2cccc(Cl)c2)CCC1	ZINC000875109523	GF	On-Demand	Anodyne	HMOX2	48	35
O=C(NCCCCn1ccnc1)C(=O)NCC1(c2cccc(Cl)c2)CCC1	ZINC000875109523	GF	On-Demand	Anodyne	QPCT	35	40
O=C(NCCC[C@H]1C=CCC1)C(=O)NCc1ccccc1N1CCCC1	ZINC000875109528	FF	On-Demand	Anodyne	KCNQ2	63	38
O=C(NCCC[C@@H]1C=CCC1)C(=O)NCc1ccccc1N1CCCC1	ZINC000875109530	FF	On-Demand	Anodyne	KCNQ2	63	38
N#Cc1cc(F)ccc1N1CCN(C(=O)C(=O)NCCCCn2ccnc2)CC1	ZINC000875109539	GD	On-Demand	Mild	TBXAS1	32	43
COc1ccc(N2CCN(C(=O)C(=O)NCCn3cccn3)CC2)c(OC)c1	ZINC000875109545	GC	On-Demand	Clean	HTR1A	56	44
COc1ccc(N2CCN(C(=O)C(=O)NCCn3cccn3)CC2)c(OC)c1	ZINC000875109545	GC	On-Demand	Clean	DRD2	46	46
COc1ccc(N2CCN(C(=O)C(=O)NCCn3cccn3)CC2)c(OC)c1	ZINC000875109545	GC	On-Demand	Clean	DRD4	49	38
COc1ccc(N2CCN(C(=O)C(=O)NCCn3cccn3)CC2)c(OC)c1	ZINC000875109545	GC	On-Demand	Clean	ADRA1D	33	42
COc1ccc(N2CCN(C(=O)C(=O)NCCn3cccn3)CC2)c(OC)c1	ZINC000875109545	GC	On-Demand	Clean	ADRA1A	33	42
COc1ccc(N2CCN(C(=O)C(=O)NCCn3cccn3)CC2)c(OC)c1	ZINC000875109545	GC	On-Demand	Clean	DRD3	67	42
COc1ccc(N2CCN(C(=O)C(=O)NCCn3cccn3)CC2)c(OC)c1	ZINC000875109545	GC	On-Demand	Clean	PDGFRB	48	37
COc1ccc(N2CCN(C(=O)C(=O)NCCn3cccn3)CC2)c(OC)c1	ZINC000875109545	GC	On-Demand	Clean	HTR7	43	39
CC(C)(C)N1CCC(NC(=O)C(=O)NCc2ccnc(-c3ccccc3)c2)CC1	ZINC000875109549	GF	On-Demand	Anodyne	HPGDS	36	40
CC[C@@H](NC(=O)NCC(=O)NCc1ccccc1)c1cccc(OC)c1OC	ZINC000875109554	GF	On-Demand	Anodyne	MME	18	41
CC[C@@H](NC(=O)NCC(=O)NCc1ccccc1)c1cccc(OC)c1OC	ZINC000875109554	GF	On-Demand	Anodyne	PDS	64	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCCO[C@@H]2c2ccccc2)C1	ZINC000875109558	FE	On-Demand	Anodyne	SLC6A1	53	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCCO[C@@H]2c2ccccc2)C1	ZINC000875109560	FE	On-Demand	Anodyne	SLC6A1	53	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCCO[C@H]2c2ccccc2)C1	ZINC000875109563	FE	On-Demand	Anodyne	SLC6A1	53	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCCO[C@H]2c2ccccc2)C1	ZINC000875109565	FE	On-Demand	Anodyne	SLC6A1	53	32
C[C@]1(C(F)(F)F)CCN(C(=O)N[C@H]2COc3ccccc3C2)C1	ZINC000875109577	EF	On-Demand	Anodyne	EPHX2	18	42
C[C@]1(C(F)(F)F)CCN(C(=O)N[C@@H]2COc3ccccc3C2)C1	ZINC000875109590	EF	On-Demand	Anodyne	EPHX2	18	42
CC[C@@H](NC(=O)NCc1ccc(OC)c(O)c1)c1cccc(OC)c1OC	ZINC000875109610	FG	On-Demand	Anodyne	INHA	40	33
CC[C@@H](NC(=O)NCc1ccc(OC)c(O)c1)c1cccc(OC)c1OC	ZINC000875109610	FG	On-Demand	Anodyne	TRPV1	16	40
C[C@@H](Cc1ccccc1Cl)NC(=O)NCCCN1CCC[C@H]1C(N)=O	ZINC000875109624	FD	On-Demand	Anodyne	ACE	23	46
C[C@@H](Cc1ccccc1Cl)NC(=O)NCCCN1CCC[C@H]1C(N)=O	ZINC000875109624	FD	On-Demand	Anodyne	OPRM1	18	42
C[C@@H](Cc1ccccc1Cl)NC(=O)NCCCN1CCC[C@H]1C(N)=O	ZINC000875109624	FD	On-Demand	Anodyne	TRY1_BOVIN	43	35
C[C@@H](Cc1ccccc1Cl)NC(=O)NCCCN1CCC[C@H]1C(N)=O	ZINC000875109624	FD	On-Demand	Anodyne	NTSR1	68	32
C[C@@H](Cc1ccccc1Cl)NC(=O)NCCCN1CCC[C@H]1C(N)=O	ZINC000875109624	FD	On-Demand	Anodyne	NTSR2	59	33
C[C@@H](Cc1ccccc1Cl)NC(=O)NCCCN1CCC[C@H]1C(N)=O	ZINC000875109624	FD	On-Demand	Anodyne	XIAP	42	36
C[C@@H](Cc1ccccc1Cl)NC(=O)NCCCN1CCC[C@H]1C(N)=O	ZINC000875109624	FD	On-Demand	Anodyne	BRCA1	51	31
C[C@H](Cc1ccccc1Cl)NC(=O)NCCCN1CCC[C@H]1C(N)=O	ZINC000875109625	FD	On-Demand	Anodyne	ACE	23	46
C[C@H](Cc1ccccc1Cl)NC(=O)NCCCN1CCC[C@H]1C(N)=O	ZINC000875109625	FD	On-Demand	Anodyne	OPRM1	18	42
C[C@H](Cc1ccccc1Cl)NC(=O)NCCCN1CCC[C@H]1C(N)=O	ZINC000875109625	FD	On-Demand	Anodyne	TRY1_BOVIN	43	35
C[C@H](Cc1ccccc1Cl)NC(=O)NCCCN1CCC[C@H]1C(N)=O	ZINC000875109625	FD	On-Demand	Anodyne	NTSR1	68	32
C[C@H](Cc1ccccc1Cl)NC(=O)NCCCN1CCC[C@H]1C(N)=O	ZINC000875109625	FD	On-Demand	Anodyne	NTSR2	59	33
C[C@H](Cc1ccccc1Cl)NC(=O)NCCCN1CCC[C@H]1C(N)=O	ZINC000875109625	FD	On-Demand	Anodyne	XIAP	42	36
C[C@H](Cc1ccccc1Cl)NC(=O)NCCCN1CCC[C@H]1C(N)=O	ZINC000875109625	FD	On-Demand	Anodyne	BRCA1	51	31
C[C@@H](c1ccc(S(C)(=O)=O)cc1)N(C)C(=O)c1sccc1CC#N	ZINC000875109633	FG	On-Demand	Mild	CTSF	40	37
C[C@H](Cc1ccccc1Cl)NC(=O)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875109649	DF	On-Demand	Anodyne	ACE	18	45
C[C@@H](Cc1ccccc1Cl)NC(=O)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875109650	DF	On-Demand	Anodyne	ACE	18	45
C[C@@H](Cc1ccccc1Cl)NC(=O)N1CC[C@H]2CC[C@@H](C1)S2(=O)=O	ZINC000875109670	FF	On-Demand	Anodyne	ACE	16	43
C[C@@H](Cc1ccccc1Cl)NC(=O)N1CC[C@H]2CC[C@@H](C1)S2(=O)=O	ZINC000875109670	FF	On-Demand	Anodyne	DPP7	18	40
C[C@H](Cc1ccccc1Cl)NC(=O)N1CC[C@H]2CC[C@@H](C1)S2(=O)=O	ZINC000875109671	FF	On-Demand	Anodyne	ACE	16	43
C[C@H](Cc1ccccc1Cl)NC(=O)N1CC[C@H]2CC[C@@H](C1)S2(=O)=O	ZINC000875109671	FF	On-Demand	Anodyne	DPP7	18	40
C[C@@H]1C[C@@H]1CNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875109716	CE	On-Demand	Anodyne	PDS	54	38
C[C@@H]1C[C@H]1CNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875109717	CE	On-Demand	Anodyne	PDS	54	38
C[C@@H]1C[C@@H]1CNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875109718	CE	On-Demand	Anodyne	PDS	54	38
C[C@@H]1C[C@H]1CNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875109719	CE	On-Demand	Anodyne	PDS	54	38
C[C@@H]1C[C@H]1CNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875109720	DG	On-Demand	Mild	CTSF	43	33
C[C@@H]1C[C@H]1CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875109721	DG	On-Demand	Mild	CTSF	43	33
C[C@@H]1C[C@@H]1CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875109722	DG	On-Demand	Mild	CTSF	43	33
C[C@@H]1C[C@@H]1CNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875109723	DG	On-Demand	Mild	CTSF	43	33
O=C(N[C@H]1CCN2CCCC[C@H]12)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875109742	EE	On-Demand	Anodyne	SLC18A3	48	36
O=C(N[C@@H]1CCN2CCCC[C@H]12)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875109743	EE	On-Demand	Anodyne	SLC18A3	48	36
O=C(N[C@@H]1CCN2CCCC[C@@H]12)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875109744	EE	On-Demand	Anodyne	SLC18A3	48	36
O=C(N[C@H]1CCN2CCCC[C@@H]12)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875109745	EE	On-Demand	Anodyne	SLC18A3	48	36
CCCCCCCNC(=O)C(=O)N[C@H](C)c1cn(C)nc1C	ZINC000875109823	DD	On-Demand	Mild	ASAH1	96	38
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1cn(C)nc1C	ZINC000875109825	DD	On-Demand	Mild	ASAH1	96	38
O=C(N[C@H](c1ccccc1)C1CCCCC1)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875109840	EH	On-Demand	Anodyne	TTK	15	41
O=C(N[C@H](c1ccccc1)C1CCCCC1)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875109844	EH	On-Demand	Anodyne	TTK	15	41
O=C(N[C@@H](c1ccccc1)C1CCCCC1)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875109846	EH	On-Demand	Anodyne	TTK	15	41
O=C(N[C@@H](c1ccccc1)C1CCCCC1)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875109848	EH	On-Demand	Anodyne	TTK	15	41
O=C(NCCO)C1CCN(C(=O)N[C@@H](c2ccccc2)C2CCCCC2)CC1	ZINC000875109860	GF	On-Demand	Anodyne	EPHX2	20	46
O=C(NCCO)C1CCN(C(=O)N[C@H](c2ccccc2)C2CCCCC2)CC1	ZINC000875109861	GF	On-Demand	Anodyne	EPHX2	20	46
CC(C)(C)OC(=O)N1CCC2(CC1)CN(C(=O)NCc1cc[nH]n1)C2	ZINC000875109866	ED	On-Demand	Anodyne	GPR119	30	41
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(OC)c(O)c1	ZINC000875109897	FD	On-Demand	Anodyne	ACKR3	64	33
CC[C@@H](NC(=O)NCc1ccc(OC)c(O)c1)[C@H](O)c1ccccc1	ZINC000875109915	EF	On-Demand	Anodyne	INHA	41	33
CC[C@@H](NC(=O)NCc1ccc(OC)c(O)c1)[C@H](O)c1ccccc1	ZINC000875109915	EF	On-Demand	Anodyne	PPARA	15	41
CC[C@@H](NC(=O)NCc1ccc(OC)c(O)c1)[C@H](O)c1ccccc1	ZINC000875109915	EF	On-Demand	Anodyne	CDK4	18	40
CC[C@@H](NC(=O)NCc1ccc(OC)c(O)c1)[C@H](O)c1ccccc1	ZINC000875109915	EF	On-Demand	Anodyne	PDS	42	34
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCCn2ccnc2)C1	ZINC000875109916	DC	On-Demand	Anodyne	TBXAS1	28	42
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCCn2ccnc2)C1	ZINC000875109916	DC	On-Demand	Anodyne	QPCT	37	42
CC[C@@H](NC(=O)NCc1ccc(OC)c(O)c1)[C@@H](O)c1ccccc1	ZINC000875109922	EF	On-Demand	Anodyne	INHA	41	33
CC[C@@H](NC(=O)NCc1ccc(OC)c(O)c1)[C@@H](O)c1ccccc1	ZINC000875109922	EF	On-Demand	Anodyne	PPARA	15	41
CC[C@@H](NC(=O)NCc1ccc(OC)c(O)c1)[C@@H](O)c1ccccc1	ZINC000875109922	EF	On-Demand	Anodyne	CDK4	18	40
CC[C@@H](NC(=O)NCc1ccc(OC)c(O)c1)[C@@H](O)c1ccccc1	ZINC000875109922	EF	On-Demand	Anodyne	PDS	42	34
COc1ccc([C@@H]2CN(C(=O)NCc3ccc(OC)c(O)c3)CCO2)cc1	ZINC000875109945	FF	On-Demand	Anodyne	MMP13	16	40
CCCCCCCNC(=O)C(=O)NCc1ccccc1N1CCCC1	ZINC000875109980	EF	On-Demand	Mild	HTR1A	31	46
CCCCCCCNC(=O)C(=O)NCc1ccccc1N1CCCC1	ZINC000875109980	EF	On-Demand	Mild	DRD2	37	42
CCCCCCCNC(=O)C(=O)NCc1ccccc1N1CCCC1	ZINC000875109980	EF	On-Demand	Mild	AVPR2	17	40
CCCCCCCNC(=O)C(=O)NCc1ccccc1N1CCCC1	ZINC000875109980	EF	On-Demand	Mild	DRD3	64	41
CCCCCCCNC(=O)C(=O)NCc1ccccc1N1CCCC1	ZINC000875109980	EF	On-Demand	Mild	KCNQ2	82	43
CCCCCCCNC(=O)C(=O)NCc1ccccc1N1CCCC1	ZINC000875109980	EF	On-Demand	Mild	SCN2A	23	44
CCCCCCCNC(=O)C(=O)NCc1ccccc1N1CCCC1	ZINC000875109980	EF	On-Demand	Mild	SCN10A	15	44
CCCCCCCNC(=O)C(=O)NCc1ccccc1N1CCCC1	ZINC000875109980	EF	On-Demand	Mild	ASAH1	93	39
O=C(COC(=O)c1occc1-c1ccccc1)NCC1CC1	ZINC000875109989	CF	On-Demand	Anodyne	VCP	49	36
O=C(NCCCCn1ccnc1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875109991	DD	On-Demand	Anodyne	TBXAS1	36	45
O=C(NCCCCn1ccnc1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875109991	DD	On-Demand	Anodyne	QPCT	34	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)COc2cccc(F)c2)C1	ZINC000875110008	FD	On-Demand	Anodyne	CCR5	41	31
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)COc2cccc(F)c2)C1	ZINC000875110008	FD	On-Demand	Anodyne	CHRNA10	49	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)COc2cccc(F)c2)C1	ZINC000875110010	FD	On-Demand	Anodyne	CCR5	41	31
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)COc2cccc(F)c2)C1	ZINC000875110010	FD	On-Demand	Anodyne	CHRNA10	49	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)COc2cccc(F)c2)C1	ZINC000875110012	FD	On-Demand	Anodyne	CCR5	41	31
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)COc2cccc(F)c2)C1	ZINC000875110012	FD	On-Demand	Anodyne	CHRNA10	49	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)COc2cccc(F)c2)C1	ZINC000875110013	FD	On-Demand	Anodyne	CCR5	41	31
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)COc2cccc(F)c2)C1	ZINC000875110013	FD	On-Demand	Anodyne	CHRNA10	49	41
O=C(NCCCCn1ccnc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875110026	FD	On-Demand	Anodyne	TBXAS1	31	43
O=C(NCCCCn1ccnc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875110026	FD	On-Demand	Anodyne	QPCT	31	40
O=C(NCCCCn1ccnc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875110027	FD	On-Demand	Anodyne	TBXAS1	31	43
O=C(NCCCCn1ccnc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875110027	FD	On-Demand	Anodyne	QPCT	31	40
Cc1ccc(OC[C@H](C)NC(=O)C(=O)N2CCC[C@@H]2Cn2ccnc2)cc1	ZINC000875110040	FD	On-Demand	Anodyne	CYP26A1	52	33
Cc1ccc(OC[C@@H](C)NC(=O)C(=O)N2CCC[C@@H]2Cn2ccnc2)cc1	ZINC000875110041	FD	On-Demand	Anodyne	CYP26A1	52	33
O=C(NCc1ccccc1N1CCCC1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875110057	GC	On-Demand	Anodyne	KCNQ2	74	42
O=C(NCc1ccccc1N1CCCC1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875110057	GC	On-Demand	Anodyne	SCN2A	18	42
CC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875110076	FH	On-Demand	Anodyne	SLC6A3	27	49
CC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875110076	FH	On-Demand	Anodyne	PRCP	20	42
CC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875110076	FH	On-Demand	Anodyne	CCR5	23	40
CC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875110076	FH	On-Demand	Anodyne	BIRC8	57	37
CC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875110078	FH	On-Demand	Anodyne	SLC6A3	27	49
CC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875110078	FH	On-Demand	Anodyne	PRCP	20	42
CC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875110078	FH	On-Demand	Anodyne	CCR5	23	40
CC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875110078	FH	On-Demand	Anodyne	BIRC8	57	37
O=C(NCCCCn1ccnc1)C(=O)NCc1ncc(Br)s1	ZINC000875110094	GD	On-Demand	Anodyne	TBXAS1	41	51
O=C(NCCCCn1ccnc1)C(=O)NCc1ncc(Br)s1	ZINC000875110094	GD	On-Demand	Anodyne	HMOX2	47	36
O=C(NCCCCn1ccnc1)C(=O)NCc1ncc(Br)s1	ZINC000875110094	GD	On-Demand	Anodyne	QPCT	31	40
O=C(NCc1ccccc1N1CCCC1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875110096	GF	On-Demand	Anodyne	KCNQ2	68	38
O=C(NCc1ccccc1N1CCCC1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875110097	GF	On-Demand	Anodyne	KCNQ2	68	38
O=C(NCCc1ccc(N2CCCCC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875110098	GD	On-Demand	Anodyne	L3MBTL3	29	43
CON(C)C(=O)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000875110131	EC	On-Demand	Anodyne	CNR2	15	47
C[C@@H]1C[C@@H]1CNC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875110139	CE	On-Demand	Anodyne	EPHX2	15	46
C[C@@H]1C[C@@H]1CNC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875110140	CE	On-Demand	Anodyne	EPHX2	15	46
C[C@@H]1C[C@H]1CNC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875110141	CE	On-Demand	Anodyne	EPHX2	15	46
C[C@@H]1C[C@H]1CNC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875110142	CE	On-Demand	Anodyne	EPHX2	15	46
O=C(N[C@@H](c1ccccc1)C1CCCCC1)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875110206	FI	On-Demand	Anodyne	BIRC8	44	33
O=C(N[C@@H](c1ccccc1)C1CCCCC1)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875110207	FI	On-Demand	Anodyne	BIRC8	44	33
O=C(N[C@H](c1ccccc1)C1CCCCC1)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875110208	FI	On-Demand	Anodyne	BIRC8	44	33
O=C(N[C@H](c1ccccc1)C1CCCCC1)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875110209	FI	On-Demand	Anodyne	BIRC8	44	33
CONC(=O)C1CCN(C(=O)N[C@@H]2COc3ccccc3C2)CC1	ZINC000875110210	ED	On-Demand	Anodyne	EPHX2	22	41
CONC(=O)C1CCN(C(=O)N[C@H]2COc3ccccc3C2)CC1	ZINC000875110211	ED	On-Demand	Anodyne	EPHX2	22	41
CC(=O)C1CCN(C(=O)N[C@@H]2COc3ccccc3C2)CC1	ZINC000875110213	DE	On-Demand	Anodyne	EPHX2	23	44
CC(=O)C1CCN(C(=O)N[C@H]2COc3ccccc3C2)CC1	ZINC000875110214	DE	On-Demand	Anodyne	EPHX2	23	44
O=C(N[C@H]1COc2ccccc2C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875110228	FE	On-Demand	Anodyne	SMO	34	40
O=C(N[C@H]1COc2ccccc2C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875110228	FE	On-Demand	Anodyne	ETHR	40	33
O=C(N[C@H]1COc2ccccc2C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875110231	FE	On-Demand	Anodyne	SMO	34	40
O=C(N[C@H]1COc2ccccc2C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875110231	FE	On-Demand	Anodyne	ETHR	40	33
O=C(NCc1cc[nH]n1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875110239	DE	On-Demand	Anodyne	CPT1A	102	38
O=C(NCc1cc[nH]n1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875110240	DE	On-Demand	Anodyne	CPT1A	102	38
O=C(NCc1cc[nH]n1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875110241	DE	On-Demand	Anodyne	CPT1A	102	38
O=C(NCc1cc[nH]n1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875110242	DE	On-Demand	Anodyne	CPT1A	102	38
O=C(NCCN1CC[C@@H](O)C1)N[C@@H](c1ccccc1)C1CCCCC1	ZINC000875110253	EF	On-Demand	Anodyne	SLC6A1	44	38
O=C(NCCN1CC[C@@H](O)C1)N[C@@H](c1ccccc1)C1CCCCC1	ZINC000875110253	EF	On-Demand	Anodyne	OPRK1	24	52
O=C(NCCN1CC[C@@H](O)C1)N[C@@H](c1ccccc1)C1CCCCC1	ZINC000875110253	EF	On-Demand	Anodyne	CCR5	45	38
O=C(NCCN1CC[C@@H](O)C1)N[C@@H](c1ccccc1)C1CCCCC1	ZINC000875110253	EF	On-Demand	Anodyne	BIRC2	26	40
O=C(NCCN1CC[C@H](O)C1)N[C@@H](c1ccccc1)C1CCCCC1	ZINC000875110254	EF	On-Demand	Anodyne	SLC6A1	44	38
O=C(NCCN1CC[C@H](O)C1)N[C@@H](c1ccccc1)C1CCCCC1	ZINC000875110254	EF	On-Demand	Anodyne	OPRK1	24	52
O=C(NCCN1CC[C@H](O)C1)N[C@@H](c1ccccc1)C1CCCCC1	ZINC000875110254	EF	On-Demand	Anodyne	CCR5	45	38
O=C(NCCN1CC[C@H](O)C1)N[C@@H](c1ccccc1)C1CCCCC1	ZINC000875110254	EF	On-Demand	Anodyne	BIRC2	26	40
O=C(NCCN1CC[C@H](O)C1)N[C@H](c1ccccc1)C1CCCCC1	ZINC000875110255	EF	On-Demand	Anodyne	SLC6A1	44	38
O=C(NCCN1CC[C@H](O)C1)N[C@H](c1ccccc1)C1CCCCC1	ZINC000875110255	EF	On-Demand	Anodyne	OPRK1	24	52
O=C(NCCN1CC[C@H](O)C1)N[C@H](c1ccccc1)C1CCCCC1	ZINC000875110255	EF	On-Demand	Anodyne	CCR5	45	38
O=C(NCCN1CC[C@H](O)C1)N[C@H](c1ccccc1)C1CCCCC1	ZINC000875110255	EF	On-Demand	Anodyne	BIRC2	26	40
O=C(NCCN1CC[C@@H](O)C1)N[C@H](c1ccccc1)C1CCCCC1	ZINC000875110256	EF	On-Demand	Anodyne	SLC6A1	44	38
O=C(NCCN1CC[C@@H](O)C1)N[C@H](c1ccccc1)C1CCCCC1	ZINC000875110256	EF	On-Demand	Anodyne	OPRK1	24	52
O=C(NCCN1CC[C@@H](O)C1)N[C@H](c1ccccc1)C1CCCCC1	ZINC000875110256	EF	On-Demand	Anodyne	CCR5	45	38
O=C(NCCN1CC[C@@H](O)C1)N[C@H](c1ccccc1)C1CCCCC1	ZINC000875110256	EF	On-Demand	Anodyne	BIRC2	26	40
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCn1cccn1)CC2	ZINC000875110287	FD	On-Demand	Anodyne	SLC18A2	46	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCn1cccn1)CC2	ZINC000875110289	FD	On-Demand	Anodyne	SLC18A2	46	35
Cc1ccc(OC[C@@H](C)NC(=O)C(=O)N[C@H](C)c2cnc(C)s2)cc1	ZINC000875110292	FF	On-Demand	Anodyne	ACACB	50	39
Cc1ccc(OC[C@@H](C)NC(=O)C(=O)N[C@@H](C)c2cnc(C)s2)cc1	ZINC000875110310	FF	On-Demand	Anodyne	ACACB	50	39
Cc1ccc(OC[C@H](C)NC(=O)C(=O)N[C@H](C)c2cnc(C)s2)cc1	ZINC000875110312	FF	On-Demand	Anodyne	ACACB	50	39
Cc1ccc(OC[C@H](C)NC(=O)C(=O)N[C@@H](C)c2cnc(C)s2)cc1	ZINC000875110314	FF	On-Demand	Anodyne	ACACB	50	39
C[C@H](Cc1ccccc1Cl)NC(=O)N1CCO[C@@H](C(F)F)CC1	ZINC000875110316	EG	On-Demand	Anodyne	CTSS	22	41
C[C@@H](Cc1ccccc1Cl)NC(=O)N1CCO[C@H](C(F)F)CC1	ZINC000875110318	EG	On-Demand	Anodyne	CTSS	22	41
C[C@H](Cc1ccccc1Cl)NC(=O)N1CCO[C@H](C(F)F)CC1	ZINC000875110319	EG	On-Demand	Anodyne	CTSS	22	41
C[C@@H](Cc1ccccc1Cl)NC(=O)N1CCO[C@@H](C(F)F)CC1	ZINC000875110321	EG	On-Demand	Anodyne	CTSS	22	41
CCC1(CC)CCCN1C(=O)NCc1ccc(OC)c(O)c1	ZINC000875110354	DG	On-Demand	Anodyne	SLC12A5	45	36
Cn1nnnc1C1CCN(C(=O)N[C@@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875110371	GG	On-Demand	Anodyne	PRCP	27	45
Cn1nnnc1C1CCN(C(=O)N[C@@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875110371	GG	On-Demand	Anodyne	CCR3	54	35
Cn1nnnc1C1CCN(C(=O)N[C@@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875110371	GG	On-Demand	Anodyne	BIRC8	45	33
Cn1nnnc1C1CCN(C(=O)N[C@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875110372	GG	On-Demand	Anodyne	PRCP	27	45
Cn1nnnc1C1CCN(C(=O)N[C@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875110372	GG	On-Demand	Anodyne	CCR3	54	35
Cn1nnnc1C1CCN(C(=O)N[C@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875110372	GG	On-Demand	Anodyne	BIRC8	45	33
CON(C)C(=O)c1ccccc1OCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000875110387	GG	On-Demand	Anodyne	KDR	17	45
CON(C)C(=O)c1ccccc1OCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000875110387	GG	On-Demand	Anodyne	KCNK3	64	44
CON(C)C(=O)c1ccccc1OCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000875110387	GG	On-Demand	Anodyne	KCNK9	54	44
CON(C)C(=O)c1ccccc1OCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000875110387	GG	On-Demand	Anodyne	PDS	41	40
COc1ccc([C@@H]2CN(C(=O)C(=O)NCc3cccc4c3OCO4)CCO2)cc1	ZINC000875110418	GD	On-Demand	Anodyne	EDNRB	65	38
COc1ccc([C@@H]2CN(C(=O)C(=O)NCc3cccc4c3OCO4)CCO2)cc1	ZINC000875110418	GD	On-Demand	Anodyne	EDNRA	57	38
COc1ccc([C@@H]2CN(C(=O)C(=O)NCc3cccc4c3OCO4)CCO2)cc1	ZINC000875110418	GD	On-Demand	Anodyne	BMP1	40	33
O=C(NCCCOCCc1ccccc1)C(=O)NCc1cccc2ncccc12	ZINC000875110424	GF	On-Demand	Anodyne	MTNR1A	33	40
O=C(NCCCOCCc1ccccc1)C(=O)NCc1cccc2ncccc12	ZINC000875110424	GF	On-Demand	Anodyne	MTNR1B	36	40
O=C(NCCCOCCc1ccccc1)C(=O)NCc1cccc2ncccc12	ZINC000875110424	GF	On-Demand	Anodyne	AMP1_PLAFQ	44	38
O=C(NCc1ncc(Cl)s1)C(=O)NCc1ccccc1N1CCCC1	ZINC000875110430	GE	On-Demand	Anodyne	KCNQ2	71	45
O=C(NCc1ncc(Cl)s1)C(=O)NCc1ccccc1N1CCCC1	ZINC000875110430	GE	On-Demand	Anodyne	SCN2A	22	50
O=C(NCc1ncc(Cl)s1)C(=O)NCc1ccccc1N1CCCC1	ZINC000875110430	GE	On-Demand	Anodyne	SCN10A	26	50
O=C(NCc1ccccc1-n1ccnc1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875110432	FD	On-Demand	Anodyne	NOS2	68	33
O=C(NCc1ccccc1-n1ccnc1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875110433	FD	On-Demand	Anodyne	NOS2	68	33
O=C(NCc1ccccc1-n1ccnc1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875110434	FD	On-Demand	Anodyne	NOS2	68	33
O=C(NCc1ccccc1-n1ccnc1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875110435	FD	On-Demand	Anodyne	NOS2	68	33
COc1ccc([C@@H]2CCCN2C(=O)COC(=O)c2occc2-c2ccccc2)cc1OC	ZINC000875110436	II	On-Demand	Anodyne	CPT1A	112	42
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCCCn1ccnc1	ZINC000875110439	FD	On-Demand	Anodyne	TBXAS1	47	47
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCCCn1ccnc1	ZINC000875110439	FD	On-Demand	Anodyne	QPCT	42	43
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCCCn1ccnc1	ZINC000875110440	FD	On-Demand	Anodyne	TBXAS1	47	47
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCCCn1ccnc1	ZINC000875110440	FD	On-Demand	Anodyne	QPCT	42	43
O=C(NCc1ccccc1-n1ccnc1)C(=O)N[C@H]1CC12CCC2	ZINC000875110442	DD	On-Demand	Anodyne	NOS2	68	32
O=C(NCc1ccccc1-n1ccnc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875110443	DD	On-Demand	Anodyne	NOS2	68	32
O=C(NCCCCn1ccnc1)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875110445	GD	On-Demand	Anodyne	TBXAS1	41	44
O=C(NCCCCn1ccnc1)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875110445	GD	On-Demand	Anodyne	QPCT	34	40
O=C(NCCCCn1ccnc1)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875110445	GD	On-Demand	Anodyne	NAMPT	21	40
CC(=O)C1CCN(C(=O)C(=O)NCCCOCCc2ccccc2)CC1	ZINC000875110446	FD	On-Demand	Anodyne	FKBP1A	41	38
O=C(NCCCCn1ccnc1)C(=O)NCC[C@@H]1CCSC1	ZINC000875110458	DD	On-Demand	Anodyne	TBXAS1	33	45
O=C(NCCCCn1ccnc1)C(=O)NCC[C@@H]1CCSC1	ZINC000875110458	DD	On-Demand	Anodyne	QPCT	37	41
O=C(NCCCCn1ccnc1)C(=O)NCC[C@H]1CCSC1	ZINC000875110459	DD	On-Demand	Anodyne	TBXAS1	33	45
O=C(NCCCCn1ccnc1)C(=O)NCC[C@H]1CCSC1	ZINC000875110459	DD	On-Demand	Anodyne	QPCT	37	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccccc2-n2ccnc2)C1	ZINC000875110460	FD	On-Demand	Anodyne	NOS2	78	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccccc2-n2ccnc2)C1	ZINC000875110461	FD	On-Demand	Anodyne	NOS2	78	34
O=C(NCCCCn1ccnc1)C(=O)NCCC[C@H]1C=CCC1	ZINC000875110463	DD	On-Demand	Anodyne	TBXAS1	36	45
O=C(NCCCCn1ccnc1)C(=O)NCCC[C@H]1C=CCC1	ZINC000875110463	DD	On-Demand	Anodyne	QPCT	32	41
O=C(NCCCCn1ccnc1)C(=O)NCCC[C@@H]1C=CCC1	ZINC000875110464	DD	On-Demand	Anodyne	TBXAS1	36	45
O=C(NCCCCn1ccnc1)C(=O)NCCC[C@@H]1C=CCC1	ZINC000875110464	DD	On-Demand	Anodyne	QPCT	32	41
CCOC(=O)N1CCN(C(=O)[C@H](C)OC(=O)c2occc2-c2ccccc2)CC1	ZINC000875110471	HF	On-Demand	Anodyne	P2RY12	179	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)c2occc2-c2ccccc2)CC1	ZINC000875110472	HF	On-Demand	Anodyne	P2RY12	179	40
O=C(NCCCCn1ccnc1)C(=O)NCc1cn(C(F)F)c2ccccc12	ZINC000875110478	GE	On-Demand	Anodyne	TBXAS1	44	45
C#CC[C@@H](COC)NC(=O)C(=O)NCc1ccccc1N1CCCC1	ZINC000875110501	ED	On-Demand	Mild	KCNQ2	70	38
C#CC[C@H](COC)NC(=O)C(=O)NCc1ccccc1N1CCCC1	ZINC000875110503	ED	On-Demand	Mild	KCNQ2	70	38
O=C(NC1CC(Nc2ccccc2)C1)N[C@H]1CCN2CCCC[C@@H]12	ZINC000875110504	EF	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NC1CC(Nc2ccccc2)C1)N[C@H]1CCN2CCCC[C@@H]12	ZINC000875110504	EF	On-Demand	Anodyne	SLC18A3	62	36
O=C(NC1CC(Nc2ccccc2)C1)N[C@@H]1CCN2CCCC[C@@H]12	ZINC000875110506	EF	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NC1CC(Nc2ccccc2)C1)N[C@@H]1CCN2CCCC[C@@H]12	ZINC000875110506	EF	On-Demand	Anodyne	SLC18A3	62	36
O=C(NC1CC(Nc2ccccc2)C1)N[C@@H]1CCN2CCCC[C@H]12	ZINC000875110508	EF	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NC1CC(Nc2ccccc2)C1)N[C@@H]1CCN2CCCC[C@H]12	ZINC000875110508	EF	On-Demand	Anodyne	SLC18A3	62	36
O=C(NC1CC(Nc2ccccc2)C1)N[C@H]1CCN2CCCC[C@H]12	ZINC000875110510	EF	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NC1CC(Nc2ccccc2)C1)N[C@H]1CCN2CCCC[C@H]12	ZINC000875110510	EF	On-Demand	Anodyne	SLC18A3	62	36
C[C@@H]1C[C@H]1CNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875110532	DF	On-Demand	Mild	ITK	18	52
C[C@@H]1C[C@H]1CNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875110532	DF	On-Demand	Mild	PANC	55	37
C[C@@H]1C[C@@H]1CNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875110533	DF	On-Demand	Mild	ITK	18	52
C[C@@H]1C[C@@H]1CNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875110533	DF	On-Demand	Mild	PANC	55	37
C[C@H]1C[C@H]1CNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875110535	DF	On-Demand	Mild	ITK	18	52
C[C@H]1C[C@H]1CNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875110535	DF	On-Demand	Mild	PANC	55	37
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(NC(=O)C3CCCC3)c2)CC1	ZINC000875110538	GE	On-Demand	Anodyne	EPHX2	27	40
Cc1nn(C)cc1[C@H](C)NC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875110635	FF	On-Demand	Anodyne	FAAH	48	43
Cc1nn(C)cc1[C@H](C)NC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875110635	FF	On-Demand	Anodyne	CES1	41	33
Cc1nn(C)cc1[C@H](C)NC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875110635	FF	On-Demand	Anodyne	AMP1_PLAFQ	22	43
Cc1nn(C)cc1[C@@H](C)NC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875110636	FF	On-Demand	Anodyne	FAAH	48	43
Cc1nn(C)cc1[C@@H](C)NC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875110636	FF	On-Demand	Anodyne	CES1	41	33
Cc1nn(C)cc1[C@@H](C)NC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875110636	FF	On-Demand	Anodyne	AMP1_PLAFQ	22	43
O=C(NCc1ccc(COc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875110643	GF	On-Demand	Anodyne	ADAM17	33	41
O=C(NCc1ccc(COc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875110643	GF	On-Demand	Anodyne	EPHX2	19	41
O=C(NCc1ccc(COc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875110643	GF	On-Demand	Anodyne	FFAR1	23	40
O=C(NCc1ccc(COc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875110643	GF	On-Demand	Anodyne	NAMPT	32	44
O=C(NCc1ccc(COc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875110643	GF	On-Demand	Anodyne	PDS	44	37
CON(C)C(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	ZINC000875110660	GD	On-Demand	Anodyne	MMP13	40	44
CON(C)C(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	ZINC000875110660	GD	On-Demand	Anodyne	ADAM17	27	42
CON(C)C(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	ZINC000875110660	GD	On-Demand	Anodyne	MMP2	22	44
CON(C)C(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	ZINC000875110660	GD	On-Demand	Anodyne	MMP3	67	62
CON(C)C(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	ZINC000875110660	GD	On-Demand	Anodyne	MMP8	55	62
CON(C)C(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	ZINC000875110660	GD	On-Demand	Anodyne	MMP9	32	42
CON(C)C(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	ZINC000875110660	GD	On-Demand	Anodyne	ADAM9	56	40
CON(C)C(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	ZINC000875110660	GD	On-Demand	Anodyne	MMP7	48	44
CON(C)C(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	ZINC000875110660	GD	On-Demand	Anodyne	MMP1	52	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)c(O)c1	ZINC000875110681	ED	On-Demand	Anodyne	SLC6A4	29	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)c(O)c1	ZINC000875110681	ED	On-Demand	Anodyne	SLC6A3	51	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)c(O)c1	ZINC000875110683	ED	On-Demand	Anodyne	SLC6A4	29	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)c(O)c1	ZINC000875110683	ED	On-Demand	Anodyne	SLC6A3	51	42
CN(C[C@@H]1C[C@H](O)C1)C(=O)N[C@H](c1ccccc1)C1CCCCC1	ZINC000875110695	EH	On-Demand	Anodyne	OPRK1	19	43
CN(C[C@@H]1C[C@H](O)C1)C(=O)N[C@H](c1ccccc1)C1CCCCC1	ZINC000875110695	EH	On-Demand	Anodyne	AMY2	44	30
C[C@@H](Cc1ccccc1Cl)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875110697	DG	On-Demand	Anodyne	BIRC2	41	36
CN(C[C@@H]1C[C@H](O)C1)C(=O)N[C@@H](c1ccccc1)C1CCCCC1	ZINC000875110698	EH	On-Demand	Anodyne	OPRK1	19	43
CN(C[C@@H]1C[C@H](O)C1)C(=O)N[C@@H](c1ccccc1)C1CCCCC1	ZINC000875110698	EH	On-Demand	Anodyne	AMY2	44	30
C[C@@H](Cc1ccccc1Cl)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875110699	DG	On-Demand	Anodyne	BIRC2	41	36
C[C@H](Cc1ccccc1Cl)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875110701	DG	On-Demand	Anodyne	BIRC2	41	36
C[C@H](Cc1ccccc1Cl)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875110703	DG	On-Demand	Anodyne	BIRC2	41	36
O=C(NCCn1cccn1)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875110704	FC	On-Demand	Anodyne	NPY2R	62	34
C[C@H](Cc1ccccc1Cl)NC(=O)N1CC=CC1	ZINC000875110734	CF	On-Demand	Anodyne	CXCL8	47	36
C[C@@H](Cc1ccccc1Cl)NC(=O)N1CC=CC1	ZINC000875110736	CF	On-Demand	Anodyne	CXCL8	47	36
C[C@H](Cc1ccccc1Cl)NC(=O)N(C1CC1)C1CC1	ZINC000875110776	CH	On-Demand	Anodyne	MME	15	45
C[C@H](Cc1ccccc1Cl)NC(=O)N(C1CC1)C1CC1	ZINC000875110776	CH	On-Demand	Anodyne	CXCL8	46	35
C[C@@H](Cc1ccccc1Cl)NC(=O)N(C1CC1)C1CC1	ZINC000875110777	CH	On-Demand	Anodyne	MME	15	45
C[C@@H](Cc1ccccc1Cl)NC(=O)N(C1CC1)C1CC1	ZINC000875110777	CH	On-Demand	Anodyne	CXCL8	46	35
C[C@@H](Cc1ccccc1Cl)NC(=O)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875110785	FF	On-Demand	Anodyne	ACE	15	43
C[C@@H](Cc1ccccc1Cl)NC(=O)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875110785	FF	On-Demand	Anodyne	MC4R	65	36
C[C@@H](Cc1ccccc1Cl)NC(=O)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875110785	FF	On-Demand	Anodyne	CYP51A1	15	41
C[C@@H](Cc1ccccc1Cl)NC(=O)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875110785	FF	On-Demand	Anodyne	DPP7	27	40
C[C@@H](Cc1ccccc1Cl)NC(=O)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875110785	FF	On-Demand	Anodyne	CALCRL	49	40
C[C@H](Cc1ccccc1Cl)NC(=O)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875110786	FF	On-Demand	Anodyne	ACE	15	43
C[C@H](Cc1ccccc1Cl)NC(=O)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875110786	FF	On-Demand	Anodyne	MC4R	65	36
C[C@H](Cc1ccccc1Cl)NC(=O)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875110786	FF	On-Demand	Anodyne	CYP51A1	15	41
C[C@H](Cc1ccccc1Cl)NC(=O)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875110786	FF	On-Demand	Anodyne	DPP7	27	40
C[C@H](Cc1ccccc1Cl)NC(=O)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875110786	FF	On-Demand	Anodyne	CALCRL	49	40
C[C@H](Cc1ccccc1Cl)NC(=O)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875110787	FF	On-Demand	Anodyne	ACE	15	43
C[C@H](Cc1ccccc1Cl)NC(=O)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875110787	FF	On-Demand	Anodyne	MC4R	65	36
C[C@H](Cc1ccccc1Cl)NC(=O)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875110787	FF	On-Demand	Anodyne	CYP51A1	15	41
C[C@H](Cc1ccccc1Cl)NC(=O)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875110787	FF	On-Demand	Anodyne	DPP7	27	40
C[C@H](Cc1ccccc1Cl)NC(=O)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875110787	FF	On-Demand	Anodyne	CALCRL	49	40
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)CC1	ZINC000875110794	GE	On-Demand	Anodyne	CCR5	15	41
CC(=O)C1CCN(C(=O)C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)CC1	ZINC000875110795	GE	On-Demand	Anodyne	CCR5	15	41
O=C(NCCCCn1ccnc1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875110806	FD	On-Demand	Anodyne	TBXAS1	28	41
O=C(NCCCCn1ccnc1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875110807	FD	On-Demand	Anodyne	TBXAS1	28	41
CC(C)(C)N1CCC(NC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000875110808	GE	On-Demand	Anodyne	OXTR	47	36
CC(C)(C)N1CCC(NC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000875110809	GE	On-Demand	Anodyne	OXTR	47	36
O=C(NCc1ccccc1N1CCCC1)C(=O)N[C@H]1CC12CCC2	ZINC000875110816	ED	On-Demand	Anodyne	KCNQ2	72	41
O=C(NCc1ccccc1N1CCCC1)C(=O)N[C@H]1CC12CCC2	ZINC000875110816	ED	On-Demand	Anodyne	SCN2A	17	42
O=C(NCc1ccccc1N1CCCC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875110817	ED	On-Demand	Anodyne	KCNQ2	72	41
O=C(NCc1ccccc1N1CCCC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875110817	ED	On-Demand	Anodyne	SCN2A	17	42
O=C(NCCCCn1ccnc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875110820	CC	On-Demand	Anodyne	TBXAS1	28	43
O=C(NCCCCn1ccnc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875110820	CC	On-Demand	Anodyne	QPCT	38	42
O=C(NCCCCn1ccnc1)C(=O)N[C@H]1CC12CCC2	ZINC000875110821	CC	On-Demand	Anodyne	TBXAS1	28	43
O=C(NCCCCn1ccnc1)C(=O)N[C@H]1CC12CCC2	ZINC000875110821	CC	On-Demand	Anodyne	QPCT	38	42
CC(C)(C)N1CCC(NC(=O)C(=O)NCc2cccc(F)c2F)CC1	ZINC000875110827	FD	On-Demand	Anodyne	P2RX7	40	38
COc1ccc([C@@H]2CN(C(=O)C(=O)NCCCCn3ccnc3)CCO2)cc1	ZINC000875110834	GD	On-Demand	Anodyne	NOS2	54	36
COc1ccc([C@@H]2CN(C(=O)C(=O)NCCCCn3ccnc3)CCO2)cc1	ZINC000875110834	GD	On-Demand	Anodyne	QPCT	39	49
O=C(NCCc1ccc(N2CCCCC2)cc1)N1OC2CCC1CC2	ZINC000875110838	EG	On-Demand	Anodyne	GPBAR1	23	44
O=C(NCCc1ccc(N2CCCCC2)cc1)N1OC2CCC1CC2	ZINC000875110838	EG	On-Demand	Anodyne	L3MBTL3	46	43
O=C(NCCCCn1ccnc1)C(=O)NCc1ccc(OC(F)F)cc1F	ZINC000875110839	GD	On-Demand	Anodyne	TBXAS1	48	45
O=C(NCCCCn1ccnc1)C(=O)NCc1ccc(OC(F)F)cc1F	ZINC000875110839	GD	On-Demand	Anodyne	QPCT	39	43
O=C(NCCc1ccc(N2CCCCC2)cc1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875110840	GH	On-Demand	Anodyne	L3MBTL3	33	40
CCCCCCCNC(=O)C(=O)NC1CCN(C(C)(C)C)CC1	ZINC000875110842	EE	On-Demand	Mild	ASAH1	61	33
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccccc2-n2ccnc2)C1	ZINC000875110844	FD	On-Demand	Anodyne	NOS2	49	31
O=C(NCc1ccccc1-n1ccnc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875110848	GE	On-Demand	Anodyne	NOS2	64	33
O=C(NCc1ccccc1-n1ccnc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875110849	GE	On-Demand	Anodyne	NOS2	64	33
C[C@H](NC(=O)C(=O)NCCCOCCc1ccccc1)c1ccnn1C	ZINC000875110856	FD	On-Demand	Anodyne	CAPN2	53	35
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(OC)c(O)c2)C1	ZINC000875110874	ED	On-Demand	Anodyne	TRPV1	16	40
C[C@@H](Cc1ccccc1Cl)NC(=O)NC1(C)COC1	ZINC000875110894	CE	On-Demand	Anodyne	CXCL8	47	36
C[C@H](Cc1ccccc1Cl)NC(=O)NC1(C)COC1	ZINC000875110895	CE	On-Demand	Anodyne	CXCL8	47	36
C[C@H](Cc1ccccc1Cl)NC(=O)N1OC2CCC1CC2	ZINC000875110925	DH	On-Demand	Anodyne	ACE	17	45
C[C@H](Cc1ccccc1Cl)NC(=O)N1OC2CCC1CC2	ZINC000875110925	DH	On-Demand	Anodyne	OPRL1	42	39
C[C@@H](Cc1ccccc1Cl)NC(=O)N1OC2CCC1CC2	ZINC000875110926	DH	On-Demand	Anodyne	ACE	17	45
C[C@@H](Cc1ccccc1Cl)NC(=O)N1OC2CCC1CC2	ZINC000875110926	DH	On-Demand	Anodyne	OPRL1	42	39
CC(=O)Nc1ccc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)cc1C	ZINC000875110946	GJ	On-Demand	Anodyne	KCNK3	96	40
CC(=O)Nc1ccc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)cc1C	ZINC000875110946	GJ	On-Demand	Anodyne	KCNK9	49	39
O=C(NCc1ccccc1N1CCCC1)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875110950	GE	On-Demand	Anodyne	KCNQ2	70	37
O=C(NCc1ccccc1N1CCCC1)C(=O)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875110951	GE	On-Demand	Anodyne	KCNQ2	70	37
O=C(NCc1ccccc1N1CCCC1)C(=O)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875110952	GE	On-Demand	Anodyne	KCNQ2	70	37
O=C(NCc1ccccc1N1CCCC1)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875110953	GE	On-Demand	Anodyne	KCNQ2	70	37
CON(C)C(=O)/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1	ZINC000875110956	EH	On-Demand	Anodyne	AHR	15	43
O=C(NCc1cc[nH]n1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875110995	DD	On-Demand	Anodyne	FAAH	19	41
O=C(NCCO)C1CCN(C(=O)N[C@@H]2COc3ccccc3C2)CC1	ZINC000875110999	EC	On-Demand	Anodyne	EPHX2	22	40
O=C(NCCO)C1CCN(C(=O)N[C@H]2COc3ccccc3C2)CC1	ZINC000875111000	EC	On-Demand	Anodyne	EPHX2	22	40
O=C(NCCCOCCc1ccccc1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875111010	GC	On-Demand	Anodyne	AMP1_PLAFQ	17	40
CN1CCN(C2CCN(C(=O)N[C@@H]3COc4ccccc4C3)CC2)CC1	ZINC000875111021	FD	On-Demand	Anodyne	EPHX2	18	42
CN1CCN(C2CCN(C(=O)N[C@@H]3COc4ccccc4C3)CC2)CC1	ZINC000875111021	FD	On-Demand	Anodyne	L3MBTL3	65	40
CN1CCN(C2CCN(C(=O)N[C@H]3COc4ccccc4C3)CC2)CC1	ZINC000875111023	FD	On-Demand	Anodyne	EPHX2	18	42
CN1CCN(C2CCN(C(=O)N[C@H]3COc4ccccc4C3)CC2)CC1	ZINC000875111023	FD	On-Demand	Anodyne	L3MBTL3	65	40
C[C@H](NC(=O)C(=O)NCCCCn1ccnc1)c1ccc(C(F)(F)F)nc1	ZINC000875111026	GE	On-Demand	Anodyne	TBXAS1	36	49
C[C@H](NC(=O)C(=O)NCCCCn1ccnc1)c1ccc(C(F)(F)F)nc1	ZINC000875111026	GE	On-Demand	Anodyne	QPCT	34	43
O=C(NCCCCn1ccnc1)C(=O)NCc1cccc2ncccc12	ZINC000875111030	FD	On-Demand	Anodyne	CYP19A1	15	59
O=C(NCCCCn1ccnc1)C(=O)NCc1cccc2ncccc12	ZINC000875111030	FD	On-Demand	Anodyne	TBXAS1	54	46
O=C(NCCCCn1ccnc1)C(=O)NCc1cccc2ncccc12	ZINC000875111030	FD	On-Demand	Anodyne	HMOX2	48	37
O=C(NCCCCn1ccnc1)C(=O)NCc1cccc2ncccc12	ZINC000875111030	FD	On-Demand	Anodyne	QPCT	42	42
COc1ccccc1[C@H]1CN(C(=O)C(=O)NCCCCn2ccnc2)CCO1	ZINC000875111033	GD	On-Demand	Anodyne	QPCT	44	47
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NCCCCn2ccnc2)CCO1	ZINC000875111035	GD	On-Demand	Anodyne	QPCT	44	47
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCc2ccccc2N2CCCC2)c1	ZINC000875111039	GF	On-Demand	Anodyne	KCNQ2	65	35
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCc2ccccc2N2CCCC2)c1	ZINC000875111039	GF	On-Demand	Anodyne	SCN2A	20	46
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCc2ccccc2N2CCCC2)c1	ZINC000875111039	GF	On-Demand	Anodyne	SCN10A	25	46
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCc2ccccc2N2CCCC2)c1	ZINC000875111040	GF	On-Demand	Anodyne	KCNQ2	65	35
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCc2ccccc2N2CCCC2)c1	ZINC000875111040	GF	On-Demand	Anodyne	SCN2A	20	46
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCc2ccccc2N2CCCC2)c1	ZINC000875111040	GF	On-Demand	Anodyne	SCN10A	25	46
Cc1nn(C)cc1[C@@H](C)NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875111067	GE	On-Demand	Anodyne	C3AR1	40	40
Cc1nn(C)cc1[C@H](C)NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875111068	GE	On-Demand	Anodyne	C3AR1	40	40
Cc1nn(C)cc1[C@@H](C)NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875111069	GE	On-Demand	Anodyne	C3AR1	40	40
Cc1nn(C)cc1[C@H](C)NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875111070	GE	On-Demand	Anodyne	C3AR1	40	40
O=C(N[C@H]1COc2ccccc2C1)N1CCC(CO)(CO)CC1	ZINC000875111072	DC	On-Demand	Anodyne	EPHX2	16	50
CCCCCCCNC(=O)C(=O)NCCn1cccn1	ZINC000875111086	CD	On-Demand	Mild	ASAH1	96	42
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)NCc1cc[nH]n1	ZINC000875111100	EH	On-Demand	Anodyne	MDM2	69	31
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCCn1cccn1	ZINC000875111101	GD	On-Demand	Anodyne	DRD2	29	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCCn1cccn1	ZINC000875111101	GD	On-Demand	Anodyne	DRD4	50	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCCn1cccn1	ZINC000875111101	GD	On-Demand	Anodyne	ACHE	68	62
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCCn1cccn1	ZINC000875111101	GD	On-Demand	Anodyne	HRH1	16	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCCn1cccn1	ZINC000875111101	GD	On-Demand	Anodyne	DRD3	27	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCCn1cccn1	ZINC000875111101	GD	On-Demand	Anodyne	SLC6A3	15	49
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCCn1cccn1	ZINC000875111101	GD	On-Demand	Anodyne	SIGMAR1	64	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCCn1cccn1	ZINC000875111101	GD	On-Demand	Anodyne	BCHE	20	50
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCCn1cccn1	ZINC000875111101	GD	On-Demand	Anodyne	CCR3	37	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCCn1cccn1	ZINC000875111101	GD	On-Demand	Anodyne	CACNA1G	33	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCCn1cccn1	ZINC000875111101	GD	On-Demand	Anodyne	CYP2J2	44	32
COCC(C)(C)CCNC(=O)C(=O)N[C@H](C)COc1cccc(F)c1	ZINC000875111112	FD	On-Demand	Anodyne	PDS	54	40
COCC(C)(C)CCNC(=O)C(=O)N[C@@H](C)COc1cccc(F)c1	ZINC000875111113	FD	On-Demand	Anodyne	PDS	54	40
C[C@H](Cc1ccccc1Cl)NC(=O)N1C[C@@H](O)C[C@@H]1C1CC1	ZINC000875111146	DF	On-Demand	Anodyne	ACE	15	41
C[C@H](Cc1ccccc1Cl)NC(=O)N1C[C@H](O)C[C@@H]1C1CC1	ZINC000875111147	DF	On-Demand	Anodyne	ACE	15	41
C[C@H](Cc1ccccc1Cl)NC(=O)N1C[C@@H](O)C[C@H]1C1CC1	ZINC000875111148	DF	On-Demand	Anodyne	ACE	15	41
C[C@H](Cc1ccccc1Cl)NC(=O)N1C[C@H](O)C[C@H]1C1CC1	ZINC000875111149	DF	On-Demand	Anodyne	ACE	15	41
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)COc2cccc(F)c2)CC1	ZINC000875111159	FD	On-Demand	Anodyne	CHRNA10	32	41
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)COc2cccc(F)c2)CC1	ZINC000875111160	FD	On-Demand	Anodyne	CHRNA10	32	41
O=CN1CCCN(C(=O)N[C@@H](c2ccccc2)C2CCCCC2)CC1	ZINC000875111209	EG	On-Demand	Anodyne	CTSS	19	43
O=CN1CCCN(C(=O)N[C@H](c2ccccc2)C2CCCCC2)CC1	ZINC000875111210	EG	On-Demand	Anodyne	CTSS	19	43
NC(=O)CCOC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000875111231	CD	On-Demand	Bother	CACNA1D	53	35
O=C(N[C@@H](c1ccccc1)C1CCCCC1)N(CCO)CCOCCO	ZINC000875111233	FE	On-Demand	Anodyne	AMY2	47	32
O=C(N[C@H](c1ccccc1)C1CCCCC1)N(CCO)CCOCCO	ZINC000875111234	FE	On-Demand	Anodyne	AMY2	47	32
Cc1nn(C)cc1[C@@H](C)NC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875111235	GD	On-Demand	Anodyne	NPY2R	62	38
Cc1nn(C)cc1[C@H](C)NC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875111236	GD	On-Demand	Anodyne	NPY2R	62	38
O=C(N[C@H]1COc2ccccc2C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875111246	EG	On-Demand	Anodyne	EPHX2	21	42
O=C(N[C@H]1COc2ccccc2C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875111248	EG	On-Demand	Anodyne	EPHX2	21	42
O=C(N[C@H]1COc2ccccc2C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875111266	GG	On-Demand	Anodyne	SMO	44	49
O=C(N[C@H]1COc2ccccc2C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875111266	GG	On-Demand	Anodyne	ETHR	56	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCOCCc2ccccc2)C1	ZINC000875111283	FD	On-Demand	Anodyne	FKBP1A	56	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCOCCc2ccccc2)C1	ZINC000875111283	FD	On-Demand	Anodyne	SLC6A1	47	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCOCCc2ccccc2)C1	ZINC000875111283	FD	On-Demand	Anodyne	PREP	62	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCOCCc2ccccc2)C1	ZINC000875111283	FD	On-Demand	Anodyne	DPP7	36	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCOCCc2ccccc2)C1	ZINC000875111285	FD	On-Demand	Anodyne	FKBP1A	56	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCOCCc2ccccc2)C1	ZINC000875111285	FD	On-Demand	Anodyne	SLC6A1	47	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCOCCc2ccccc2)C1	ZINC000875111285	FD	On-Demand	Anodyne	PREP	62	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCOCCc2ccccc2)C1	ZINC000875111285	FD	On-Demand	Anodyne	DPP7	36	40
O=C(NCCCCn1ccnc1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875111317	EC	On-Demand	Anodyne	TBXAS1	20	41
O=C(NCCCCn1ccnc1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875111319	EC	On-Demand	Anodyne	TBXAS1	20	41
O=C(NCCCCn1ccnc1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875111320	EC	On-Demand	Anodyne	TBXAS1	20	41
O=C(NCCCCn1ccnc1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875111322	EC	On-Demand	Anodyne	TBXAS1	20	41
O=C(CNC(=O)N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1)NCc1ccccc1	ZINC000875111345	GF	On-Demand	Anodyne	CCR1	19	42
CC(=O)C1CCN(C(=O)C(=O)NCc2ccccc2-n2ccnc2)CC1	ZINC000875111352	FD	On-Demand	Anodyne	NOS2	83	34
COC(=O)[C@@]12C[C@@H](NC(=O)NCC(=O)NCc3ccccc3)C[C@@H]1C2	ZINC000875111362	EC	On-Demand	Anodyne	EPHX2	17	43
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccccc3-n3ccnc3)CC[C@H]21	ZINC000875111374	FD	On-Demand	Anodyne	NOS2	78	32
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccccc3-n3ccnc3)CC[C@@H]21	ZINC000875111376	FD	On-Demand	Anodyne	NOS2	78	32
O=C(NCCCCn1ccnc1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875111386	GE	On-Demand	Anodyne	TBXAS1	45	41
O=C(NCCCCn1ccnc1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875111386	GE	On-Demand	Anodyne	QPCT	30	40
O=C(NCCCCn1ccnc1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875111387	GE	On-Demand	Anodyne	TBXAS1	45	41
O=C(NCCCCn1ccnc1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875111387	GE	On-Demand	Anodyne	QPCT	30	40
C#CC[C@H](COC)NC(=O)C(=O)NCCCCn1ccnc1	ZINC000875111388	DB	On-Demand	Mild	TBXAS1	33	40
C#CC[C@H](COC)NC(=O)C(=O)NCCCCn1ccnc1	ZINC000875111388	DB	On-Demand	Mild	QPCT	36	42
C#CC[C@@H](COC)NC(=O)C(=O)NCCCCn1ccnc1	ZINC000875111389	DB	On-Demand	Mild	TBXAS1	33	40
C#CC[C@@H](COC)NC(=O)C(=O)NCCCCn1ccnc1	ZINC000875111389	DB	On-Demand	Mild	QPCT	36	42
O=C(NCCCCn1ccnc1)C(=O)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875111391	ED	On-Demand	Anodyne	QPCT	27	40
O=C(NCCCCn1ccnc1)C(=O)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875111392	ED	On-Demand	Anodyne	QPCT	27	40
O=C(NCCCCn1ccnc1)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875111393	ED	On-Demand	Anodyne	QPCT	27	40
O=C(NCCCCn1ccnc1)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875111394	ED	On-Demand	Anodyne	QPCT	27	40
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NCc2ccccc2N2CCCC2)CC1	ZINC000875111396	GC	On-Demand	Anodyne	KCNQ2	72	40
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NCc2ccccc2N2CCCC2)CC1	ZINC000875111396	GC	On-Demand	Anodyne	SCN2A	17	40
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1ccccc1N1CCCC1	ZINC000875111398	FD	On-Demand	Mild	KCNQ2	69	37
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1ccccc1N1CCCC1	ZINC000875111398	FD	On-Demand	Mild	SCN2A	17	40
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1ccccc1N1CCCC1	ZINC000875111399	FD	On-Demand	Mild	KCNQ2	69	37
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1ccccc1N1CCCC1	ZINC000875111399	FD	On-Demand	Mild	SCN2A	17	40
COc1ccc(CN(C)C(=O)[C@H](C)OC(=O)c2occc2-c2ccccc2)cc1F	ZINC000875111400	HI	On-Demand	Anodyne	GYS1	31	40
COc1ccc(CN(C)C(=O)[C@@H](C)OC(=O)c2occc2-c2ccccc2)cc1F	ZINC000875111401	HI	On-Demand	Anodyne	GYS1	31	40
CCCCCCCNC(=O)C(=O)NCc1cccc2c1OCO2	ZINC000875111402	DE	On-Demand	Mild	MTNR1A	28	49
CCCCCCCNC(=O)C(=O)NCc1cccc2c1OCO2	ZINC000875111402	DE	On-Demand	Mild	ASAH1	79	33
CC(=O)Nc1cccc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)c1C	ZINC000875111406	GJ	On-Demand	Anodyne	KCNK3	58	36
O=C(N[C@@H](c1ccccc1)c1ccc(F)cc1)N1CCC2(CCNC2=O)CC1	ZINC000875111419	GG	On-Demand	Anodyne	CACNA1H	58	42
O=C(N[C@H](c1ccccc1)c1ccc(F)cc1)N1CCC2(CCNC2=O)CC1	ZINC000875111420	GG	On-Demand	Anodyne	CACNA1H	58	42
C[C@@H](Cc1ccccc1Cl)NC(=O)N1C[C@@](C)(CO)[C@@](C)(CO)C1	ZINC000875111421	FE	On-Demand	Anodyne	MME	19	41
C[C@H](Cc1ccccc1Cl)NC(=O)N1C[C@@](C)(CO)[C@@](C)(CO)C1	ZINC000875111422	FE	On-Demand	Anodyne	MME	19	41
CON(C)C(=O)c1ccc(COc2ccc(Cl)cc2)cc1	ZINC000875111423	DH	On-Demand	Anodyne	ALOX5	15	46
CON(C)C(=O)c1ccc(COc2ccc(Cl)cc2)cc1	ZINC000875111423	DH	On-Demand	Anodyne	MAOB	26	42
CON(C)C(=O)c1ccc(COc2ccc(Cl)cc2)cc1	ZINC000875111423	DH	On-Demand	Anodyne	SLC6A5	34	42
C[C@@H](Cc1ccccc1Cl)NC(=O)NCCN1CC[C@@H](O)C1	ZINC000875111426	ED	On-Demand	Anodyne	SLC6A1	63	35
C[C@@H](Cc1ccccc1Cl)NC(=O)NCCN1CC[C@@H](O)C1	ZINC000875111426	ED	On-Demand	Anodyne	CYP51A1	15	40
C[C@@H](Cc1ccccc1Cl)NC(=O)NCCN1CC[C@H](O)C1	ZINC000875111427	ED	On-Demand	Anodyne	SLC6A1	63	35
C[C@@H](Cc1ccccc1Cl)NC(=O)NCCN1CC[C@H](O)C1	ZINC000875111427	ED	On-Demand	Anodyne	CYP51A1	15	40
C[C@H](Cc1ccccc1Cl)NC(=O)NCCN1CC[C@H](O)C1	ZINC000875111428	ED	On-Demand	Anodyne	SLC6A1	63	35
C[C@H](Cc1ccccc1Cl)NC(=O)NCCN1CC[C@H](O)C1	ZINC000875111428	ED	On-Demand	Anodyne	CYP51A1	15	40
C[C@H](Cc1ccccc1Cl)NC(=O)NCCN1CC[C@@H](O)C1	ZINC000875111429	ED	On-Demand	Anodyne	SLC6A1	63	35
C[C@H](Cc1ccccc1Cl)NC(=O)NCCN1CC[C@@H](O)C1	ZINC000875111429	ED	On-Demand	Anodyne	CYP51A1	15	40
CON(C)C(=O)c1c2c(nc3ccccc13)CCN(C)C2	ZINC000875111447	CD	On-Demand	Anodyne	ACHE	60	41
CON(C)C(=O)c1c2c(nc3ccccc13)CCN(C)C2	ZINC000875111447	CD	On-Demand	Anodyne	HTR3A	17	41
CON(C)C(=O)c1c2c(nc3ccccc13)CCN(C)C2	ZINC000875111447	CD	On-Demand	Anodyne	BCHE	100	41
C[C@@H](Cc1ccccc1Cl)NC(=O)N1[C@H]2CC[C@H]1[C@H](C)C(=O)C2	ZINC000875111455	EG	On-Demand	Anodyne	BIRC8	43	30
C[C@H](Cc1ccccc1Cl)NC(=O)N1[C@H]2CC[C@H]1[C@@H](C)C(=O)C2	ZINC000875111456	EG	On-Demand	Anodyne	BIRC8	43	30
C[C@@H](Cc1ccccc1Cl)NC(=O)N1[C@H]2CC[C@H]1[C@@H](C)C(=O)C2	ZINC000875111457	EG	On-Demand	Anodyne	BIRC8	43	30
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)COc2ccc(F)cc2F)C1	ZINC000875111458	FD	On-Demand	Anodyne	CCR3	40	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)COc2ccc(F)cc2F)C1	ZINC000875111459	FD	On-Demand	Anodyne	CCR3	40	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)COc2ccc(F)cc2F)C1	ZINC000875111460	FD	On-Demand	Anodyne	CCR3	40	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)COc2ccc(F)cc2F)C1	ZINC000875111461	FD	On-Demand	Anodyne	CCR3	40	33
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)Cc2ccccc2Cl)C1	ZINC000875111481	FG	On-Demand	Anodyne	Q6PRC7_IXORI	45	33
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)Cc2ccccc2Cl)C1	ZINC000875111483	FG	On-Demand	Anodyne	Q6PRC7_IXORI	45	33
CONC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875111486	GG	On-Demand	Anodyne	SLC6A3	39	44
CONC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875111486	GG	On-Demand	Anodyne	PRCP	20	41
CONC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875111486	GG	On-Demand	Anodyne	XIAP	49	36
CONC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875111486	GG	On-Demand	Anodyne	CACNA1G	40	38
CONC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875111486	GG	On-Demand	Anodyne	BIRC8	56	34
CONC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875111487	GG	On-Demand	Anodyne	SLC6A3	39	44
CONC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875111487	GG	On-Demand	Anodyne	PRCP	20	41
CONC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875111487	GG	On-Demand	Anodyne	XIAP	49	36
CONC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875111487	GG	On-Demand	Anodyne	CACNA1G	40	38
CONC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875111487	GG	On-Demand	Anodyne	BIRC8	56	34
C[C@H](Cc1ccccc1Cl)NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875111489	FD	On-Demand	Anodyne	EPHX2	27	45
C[C@@H](Cc1ccccc1Cl)NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875111490	FD	On-Demand	Anodyne	EPHX2	27	45
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OC)c(O)c1	ZINC000875111498	CD	On-Demand	Anodyne	ANPEP	15	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OC)c(O)c1	ZINC000875111498	CD	On-Demand	Anodyne	TRPV1	21	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OC)c(O)c1	ZINC000875111498	CD	On-Demand	Anodyne	CDK4	23	42
COCC(C)(C)CCNC(=O)C(=O)N[C@@H](C)COc1cccc(C)c1	ZINC000875111502	FE	On-Demand	Anodyne	PDS	56	39
COCC(C)(C)CCNC(=O)C(=O)N[C@H](C)COc1cccc(C)c1	ZINC000875111503	FE	On-Demand	Anodyne	PDS	56	39
Cc1nn(C)cc1[C@H](C)NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875111514	FE	On-Demand	Anodyne	OXTR	46	37
Cc1nn(C)cc1[C@H](C)NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875111515	FE	On-Demand	Anodyne	OXTR	46	37
Cc1nn(C)cc1[C@@H](C)NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875111516	FE	On-Demand	Anodyne	OXTR	46	37
Cc1nn(C)cc1[C@@H](C)NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875111517	FE	On-Demand	Anodyne	OXTR	46	37
O=C(NCc1ccc(COc2ccccc2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875111518	EF	On-Demand	Anodyne	GRIN2B	31	41
O=C(NCc1ccc(COc2ccccc2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875111518	EF	On-Demand	Anodyne	ADAM17	24	42
O=C(NCc1ccc(COc2ccccc2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875111518	EF	On-Demand	Anodyne	FFAR1	24	40
O=C(NCc1ccc(COc2ccccc2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875111518	EF	On-Demand	Anodyne	PDS	56	40
O=C(NCCn1cccn1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875111540	FD	On-Demand	Anodyne	C3AR1	39	41
O=C(NCCn1cccn1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875111541	FD	On-Demand	Anodyne	C3AR1	39	41
O=C(N[C@@H](c1ccccc1)C1CCCCC1)N1CCC(CCO)(CCO)CC1	ZINC000875111563	GH	On-Demand	Anodyne	CTSS	20	41
O=C(N[C@H](c1ccccc1)C1CCCCC1)N1CCC(CCO)(CCO)CC1	ZINC000875111564	GH	On-Demand	Anodyne	CTSS	20	41
CCCCCCCNC(=O)C(=O)NC[C@H]1CCCCO1	ZINC000875111654	CD	On-Demand	Mild	LASR	44	32
CCCCCCCNC(=O)C(=O)NC[C@@H]1CCCCO1	ZINC000875111655	CD	On-Demand	Mild	LASR	44	32
O=C(N[C@@H](c1ccccc1)c1ccc(F)cc1)N1CCC(CO)(CO)CC1	ZINC000875111663	FF	On-Demand	Anodyne	SLC6A3	17	40
O=C(N[C@H](c1ccccc1)c1ccc(F)cc1)N1CCC(CO)(CO)CC1	ZINC000875111664	FF	On-Demand	Anodyne	SLC6A3	17	40
C[C@H](Cc1ccccc1Cl)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875111689	EE	On-Demand	Anodyne	MME	16	42
C[C@@H](Cc1ccccc1Cl)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875111691	EE	On-Demand	Anodyne	MME	16	42
O=C(NCCO)C1CCN(C(=O)N[C@@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875111698	GE	On-Demand	Anodyne	CCR5	16	42
O=C(NCCO)C1CCN(C(=O)N[C@@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875111698	GE	On-Demand	Anodyne	EPHX2	21	43
O=C(NCCO)C1CCN(C(=O)N[C@@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875111698	GE	On-Demand	Anodyne	XIAP	46	34
O=C(NCCO)C1CCN(C(=O)N[C@@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875111698	GE	On-Demand	Anodyne	CACNA1G	43	42
O=C(NCCO)C1CCN(C(=O)N[C@@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875111698	GE	On-Demand	Anodyne	BIRC8	53	32
O=C(NCCO)C1CCN(C(=O)N[C@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875111700	GE	On-Demand	Anodyne	CCR5	16	42
O=C(NCCO)C1CCN(C(=O)N[C@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875111700	GE	On-Demand	Anodyne	EPHX2	21	43
O=C(NCCO)C1CCN(C(=O)N[C@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875111700	GE	On-Demand	Anodyne	XIAP	46	34
O=C(NCCO)C1CCN(C(=O)N[C@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875111700	GE	On-Demand	Anodyne	CACNA1G	43	42
O=C(NCCO)C1CCN(C(=O)N[C@H](c2ccccc2)c2ccc(F)cc2)CC1	ZINC000875111700	GE	On-Demand	Anodyne	BIRC8	53	32
C[C@@H](Cc1ccccc1Cl)NC(=O)N1C[C@@H]2CCC[C@]2(CO)C1	ZINC000875111705	EG	On-Demand	Anodyne	ACE	18	42
C[C@H](Cc1ccccc1Cl)NC(=O)N1C[C@@H]2CCC[C@]2(CO)C1	ZINC000875111707	EG	On-Demand	Anodyne	ACE	18	42
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCc1ccccc1N1CCCC1	ZINC000875111717	GE	On-Demand	Anodyne	KCNQ2	71	38
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCc1ccccc1N1CCCC1	ZINC000875111717	GE	On-Demand	Anodyne	SCN2A	17	41
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCc1ccccc1N1CCCC1	ZINC000875111720	GE	On-Demand	Anodyne	KCNQ2	71	38
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCc1ccccc1N1CCCC1	ZINC000875111720	GE	On-Demand	Anodyne	SCN2A	17	41
CC(C)(C)N1CCC(NC(=O)C(=O)N[C@@H](c2ccccn2)C2CCC2)CC1	ZINC000875111738	FE	On-Demand	Anodyne	TTK	28	43
CC(C)(C)N1CCC(NC(=O)C(=O)N[C@H](c2ccccn2)C2CCC2)CC1	ZINC000875111740	FE	On-Demand	Anodyne	TTK	28	43
O=C(NCCCCn1ccnc1)C(=O)NC[C@H]1CCN1C1CCCCCC1	ZINC000875111748	GD	On-Demand	Anodyne	TBXAS1	22	41
O=C(NCCCCn1ccnc1)C(=O)NC[C@H]1CCN1C1CCCCCC1	ZINC000875111748	GD	On-Demand	Anodyne	QPCT	28	47
O=C(NCCCCn1ccnc1)C(=O)NC[C@@H]1CCN1C1CCCCCC1	ZINC000875111750	GD	On-Demand	Anodyne	TBXAS1	22	41
O=C(NCCCCn1ccnc1)C(=O)NC[C@@H]1CCN1C1CCCCCC1	ZINC000875111750	GD	On-Demand	Anodyne	QPCT	28	47
CN1CCN(C2CCN(C(=O)C(=O)NCc3cccc4c3OCO4)CC2)CC1	ZINC000875111761	GC	On-Demand	Anodyne	L3MBTL3	46	38
O=C(NCCCCC1CC1)C(=O)NCc1ccccc1N1CCCC1	ZINC000875111766	EF	On-Demand	Anodyne	HTR1A	19	41
O=C(NCCCCC1CC1)C(=O)NCc1ccccc1N1CCCC1	ZINC000875111766	EF	On-Demand	Anodyne	DRD3	60	40
O=C(NCCCCC1CC1)C(=O)NCc1ccccc1N1CCCC1	ZINC000875111766	EF	On-Demand	Anodyne	KCNQ2	74	42
O=C(NCCCCC1CC1)C(=O)NCc1ccccc1N1CCCC1	ZINC000875111766	EF	On-Demand	Anodyne	SCN2A	18	42
O=C(NCc1ccccc1-n1ccnc1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875111784	FD	On-Demand	Anodyne	NOS2	77	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCn2ccnc2)C1	ZINC000875111800	DC	On-Demand	Anodyne	TBXAS1	24	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCn2ccnc2)C1	ZINC000875111800	DC	On-Demand	Anodyne	QPCT	37	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCn2ccnc2)C1	ZINC000875111801	DC	On-Demand	Anodyne	TBXAS1	24	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCn2ccnc2)C1	ZINC000875111801	DC	On-Demand	Anodyne	QPCT	37	42
O=C1CCN(C(=O)C(=O)NCCCCn2ccnc2)CCCCCCN1	ZINC000875111802	FC	On-Demand	Anodyne	TBXAS1	38	43
O=C(NCCCCn1ccnc1)C(=O)NCc1ccc(Br)cn1	ZINC000875111803	GD	On-Demand	Anodyne	TBXAS1	49	48
O=C(NCCCCn1ccnc1)C(=O)NCc1ccc(Br)cn1	ZINC000875111803	GD	On-Demand	Anodyne	HMOX2	49	41
O=C(NCCCCn1ccnc1)C(=O)NCc1ccc(Br)cn1	ZINC000875111803	GD	On-Demand	Anodyne	QPCT	37	42
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NC1CCN(C(C)(C)C)CC1	ZINC000875111804	FF	On-Demand	Anodyne	ACE	56	40
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NC1CCN(C(C)(C)C)CC1	ZINC000875111804	FF	On-Demand	Anodyne	GHRHR	40	31
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NC1CCN(C(C)(C)C)CC1	ZINC000875111804	FF	On-Demand	Anodyne	MME	34	40
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NC1CCN(C(C)(C)C)CC1	ZINC000875111804	FF	On-Demand	Anodyne	SIGMAR1	22	42
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NC1CCN(C(C)(C)C)CC1	ZINC000875111804	FF	On-Demand	Anodyne	MMP2	19	45
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NC1CCN(C(C)(C)C)CC1	ZINC000875111804	FF	On-Demand	Anodyne	MMP3	28	45
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NC1CCN(C(C)(C)C)CC1	ZINC000875111804	FF	On-Demand	Anodyne	XIAP	46	35
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NC1CCN(C(C)(C)C)CC1	ZINC000875111804	FF	On-Demand	Anodyne	BIRC2	55	41
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NC1CCN(C(C)(C)C)CC1	ZINC000875111805	FF	On-Demand	Anodyne	ACE	56	40
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NC1CCN(C(C)(C)C)CC1	ZINC000875111805	FF	On-Demand	Anodyne	GHRHR	40	31
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NC1CCN(C(C)(C)C)CC1	ZINC000875111805	FF	On-Demand	Anodyne	MME	34	40
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NC1CCN(C(C)(C)C)CC1	ZINC000875111805	FF	On-Demand	Anodyne	SIGMAR1	22	42
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NC1CCN(C(C)(C)C)CC1	ZINC000875111805	FF	On-Demand	Anodyne	MMP2	19	45
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NC1CCN(C(C)(C)C)CC1	ZINC000875111805	FF	On-Demand	Anodyne	MMP3	28	45
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NC1CCN(C(C)(C)C)CC1	ZINC000875111805	FF	On-Demand	Anodyne	XIAP	46	35
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NC1CCN(C(C)(C)C)CC1	ZINC000875111805	FF	On-Demand	Anodyne	BIRC2	55	41
CC(=O)C1CCN(C(=O)C(=O)NCc2ccccc2N2CCCC2)CC1	ZINC000875111811	FD	On-Demand	Anodyne	MC4R	19	40
CC(=O)C1CCN(C(=O)C(=O)NCc2ccccc2N2CCCC2)CC1	ZINC000875111811	FD	On-Demand	Anodyne	KCNQ2	75	41
CC(=O)C1CCN(C(=O)C(=O)NCc2ccccc2N2CCCC2)CC1	ZINC000875111811	FD	On-Demand	Anodyne	SCN2A	18	44
CC(=O)C1CCN(C(=O)C(=O)NCc2ccccc2N2CCCC2)CC1	ZINC000875111811	FD	On-Demand	Anodyne	SCN10A	15	44
N#Cc1ccc(N2CCN(C(=O)C(=O)NCCCCn3ccnc3)CC2)cc1	ZINC000875111821	GC	On-Demand	Mild	TBXAS1	35	43
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCc2ccccc2-n2ccnc2)c1	ZINC000875111823	GF	On-Demand	Anodyne	NOS2	67	36
O=C(NC[C@H]1C[C@H](O)C1)N[C@H](c1ccccc1)c1ccc(F)cc1	ZINC000875111862	EF	On-Demand	Anodyne	SLC6A3	15	40
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H](c1ccccc1)c1ccc(F)cc1	ZINC000875111863	EF	On-Demand	Anodyne	SLC6A3	15	40
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCc2ccccc2-n2ccnc2)c1	ZINC000875111866	GF	On-Demand	Anodyne	NOS2	67	36
CCCCCCCNC(=O)C(=O)NCc1ccccc1-n1ccnc1	ZINC000875111869	EF	On-Demand	Mild	ASAH1	78	36
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccccc3N3CCCC3)CC[C@@H]21	ZINC000875111876	FD	On-Demand	Anodyne	KCNQ2	69	37
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccccc3N3CCCC3)CC[C@@H]21	ZINC000875111876	FD	On-Demand	Anodyne	SCN2A	17	40
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccccc3N3CCCC3)CC[C@H]21	ZINC000875111877	FD	On-Demand	Anodyne	KCNQ2	69	37
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccccc3N3CCCC3)CC[C@H]21	ZINC000875111877	FD	On-Demand	Anodyne	SCN2A	17	40
C[C@@H](Cc1cccc(Br)c1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875111883	GE	On-Demand	Anodyne	CTSV	41	32
C[C@@H](Cc1cccc(Br)c1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875111884	GE	On-Demand	Anodyne	CTSV	41	32
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875111887	FD	On-Demand	Anodyne	SLC6A1	43	32
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875111887	FD	On-Demand	Anodyne	KCNQ2	72	39
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875111887	FD	On-Demand	Anodyne	SCN2A	17	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875111888	FD	On-Demand	Anodyne	SLC6A1	43	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875111888	FD	On-Demand	Anodyne	KCNQ2	72	39
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875111888	FD	On-Demand	Anodyne	SCN2A	17	42
CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1CN2C(=O)C(=O)NCCCCn1ccnc1	ZINC000875111891	GC	On-Demand	Anodyne	TBXAS1	24	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)Cc2cccc(Br)c2)C1	ZINC000875111905	GE	On-Demand	Anodyne	DPP7	42	30
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)Cc2cccc(Br)c2)C1	ZINC000875111906	GE	On-Demand	Anodyne	DPP7	42	30
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)Cc2cccc(Br)c2)C1	ZINC000875111907	GE	On-Demand	Anodyne	DPP7	42	30
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)Cc2cccc(Br)c2)C1	ZINC000875111908	GE	On-Demand	Anodyne	DPP7	42	30
CN(C)C[C@@H]1CN(C(=O)C(=O)NCCCCn2ccnc2)C[C@H]1CN(C)C	ZINC000875111913	GB	On-Demand	Anodyne	TBXAS1	29	44
CN(C)C[C@@H]1CN(C(=O)C(=O)NCCCCn2ccnc2)C[C@H]1CN(C)C	ZINC000875111913	GB	On-Demand	Anodyne	QPCT	35	40
O=C(NCCCCn1ccnc1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875111923	FD	On-Demand	Anodyne	TBXAS1	44	44
O=C(NCCCCn1ccnc1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875111923	FD	On-Demand	Anodyne	CYP24A1	44	36
O=C(NCCCCn1ccnc1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875111923	FD	On-Demand	Anodyne	QPCT	33	40
O=C(NCCCCn1ccnc1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875111923	FD	On-Demand	Anodyne	CYP27B1	57	36
O=C(NCCCCn1ccnc1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875111924	FD	On-Demand	Anodyne	TBXAS1	44	44
O=C(NCCCCn1ccnc1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875111924	FD	On-Demand	Anodyne	CYP24A1	44	36
O=C(NCCCCn1ccnc1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875111924	FD	On-Demand	Anodyne	QPCT	33	40
O=C(NCCCCn1ccnc1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875111924	FD	On-Demand	Anodyne	CYP27B1	57	36
O=C(NCCCCn1ccnc1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875111925	FD	On-Demand	Anodyne	TBXAS1	44	44
O=C(NCCCCn1ccnc1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875111925	FD	On-Demand	Anodyne	CYP24A1	44	36
O=C(NCCCCn1ccnc1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875111925	FD	On-Demand	Anodyne	QPCT	33	40
O=C(NCCCCn1ccnc1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875111925	FD	On-Demand	Anodyne	CYP27B1	57	36
O=C(NCCCCn1ccnc1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875111926	FD	On-Demand	Anodyne	TBXAS1	44	44
O=C(NCCCCn1ccnc1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875111926	FD	On-Demand	Anodyne	CYP24A1	44	36
O=C(NCCCCn1ccnc1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875111926	FD	On-Demand	Anodyne	QPCT	33	40
O=C(NCCCCn1ccnc1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875111926	FD	On-Demand	Anodyne	CYP27B1	57	36
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCCCCn2ccnc2)c1	ZINC000875111927	FD	On-Demand	Anodyne	TBXAS1	27	44
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCCCCn2ccnc2)c1	ZINC000875111928	FD	On-Demand	Anodyne	TBXAS1	27	44
O=C(NCCCCn1ccnc1)C(=O)NCc1ncc(Cl)s1	ZINC000875111943	ED	On-Demand	Anodyne	TBXAS1	48	57
O=C(NCCCCn1ccnc1)C(=O)NCc1ncc(Cl)s1	ZINC000875111943	ED	On-Demand	Anodyne	HMOX2	50	35
O=C(NCCCCn1ccnc1)C(=O)NCc1ncc(Cl)s1	ZINC000875111943	ED	On-Demand	Anodyne	QPCT	34	41
CC(C)(C)CC(C)(C)NC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1Br	ZINC000875111947	JJ	On-Demand	Anodyne	EPHX2	15	42
O=C(NCc1ccccc1N1CCCC1)C(=O)NCc1cccc2ncccc12	ZINC000875111951	GF	On-Demand	Anodyne	HTR1A	21	43
O=C(NCc1ccccc1N1CCCC1)C(=O)NCc1cccc2ncccc12	ZINC000875111951	GF	On-Demand	Anodyne	DRD3	18	43
O=C(NCc1ccccc1N1CCCC1)C(=O)NCc1cccc2ncccc12	ZINC000875111951	GF	On-Demand	Anodyne	KCNQ2	75	42
O=C(NCc1ccccc1N1CCCC1)C(=O)NCc1cccc2ncccc12	ZINC000875111951	GF	On-Demand	Anodyne	SCN2A	21	44
O=C(NCc1ccccc1N1CCCC1)C(=O)NCc1cccc2ncccc12	ZINC000875111951	GF	On-Demand	Anodyne	HNMT	53	37
O=C(NCc1ccccc1N1CCCC1)C(=O)NCc1cccc2ncccc12	ZINC000875111951	GF	On-Demand	Anodyne	SCN10A	27	44
COc1cccc(/C=C(/CC(=O)N(C)OC)c2nc3ccccc3s2)c1	ZINC000875111954	FI	On-Demand	Anodyne	ROCK2	15	40
COc1cccc(/C=C(\CC(=O)N(C)OC)c2nc3ccccc3s2)c1	ZINC000875111955	FI	On-Demand	Anodyne	ROCK2	15	40
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875111957	FD	On-Demand	Anodyne	KCNQ2	66	37
O=C(NCc1ccccc1N1CCCC1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875111966	FE	On-Demand	Anodyne	KCNQ2	60	38
O=C(NCc1ccccc1N1CCCC1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875111967	FE	On-Demand	Anodyne	KCNQ2	60	38
O=C(NCc1ccccc1N1CCCC1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875111968	FE	On-Demand	Anodyne	KCNQ2	60	38
O=C(NCc1ccccc1N1CCCC1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875111969	FE	On-Demand	Anodyne	KCNQ2	60	38
CCC1CCC(CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875111972	DD	On-Demand	Anodyne	CACNA1I	41	32
CCC1CCC(CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875111973	DD	On-Demand	Anodyne	CACNA1I	41	32
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3cc([N+](=O)[O-])ccc3C)CC2)c(OC)c1	ZINC000875111984	JH	On-Demand	Mild	EPHX2	17	51
C[C@]1(C(F)(F)F)CCN(C(=O)NCCS(=O)(=O)NCc2ccccc2)C1	ZINC000875111985	GE	On-Demand	Anodyne	EPHX2	18	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2ccccc2C(F)(F)F)C1	ZINC000875112001	FE	On-Demand	Anodyne	RBP4	56	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2ccccc2C(F)(F)F)C1	ZINC000875112001	FE	On-Demand	Anodyne	SFRP1	80	32
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2ccccc2C(F)(F)F)C1	ZINC000875112001	FE	On-Demand	Anodyne	WNT3	59	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2ccccc2C(F)(F)F)C1	ZINC000875112002	FE	On-Demand	Anodyne	RBP4	56	38
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2ccccc2C(F)(F)F)C1	ZINC000875112002	FE	On-Demand	Anodyne	SFRP1	80	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2ccccc2C(F)(F)F)C1	ZINC000875112002	FE	On-Demand	Anodyne	WNT3	59	32
CN1CC[C@H]2CN(C(=O)NCCS(=O)(=O)NCc3ccccc3)CC[C@H]21	ZINC000875112004	GC	On-Demand	Anodyne	TMPRSS11D	59	31
CN1CC[C@H]2CN(C(=O)NCCS(=O)(=O)NCc3ccccc3)CC[C@@H]21	ZINC000875112006	GC	On-Demand	Anodyne	TMPRSS11D	59	31
C[C@@H](NC(=O)N1CCN(C)C(C)(C)CC1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000875112011	GG	On-Demand	Anodyne	EPHX2	44	43
C=CCc1ccc(OC(=O)C[C@@H](NC(=O)c2ccccc2)c2ccccc2)c(OC)c1	ZINC000875112028	HJ	On-Demand	Mild	PRSS1	18	47
C=CCc1ccc(OC(=O)C[C@@H](NC(=O)c2ccccc2)c2ccccc2)c(OC)c1	ZINC000875112028	HJ	On-Demand	Mild	UTS2	65	35
C=CCc1ccc(OC(=O)C[C@H](NC(=O)c2ccccc2)c2ccccc2)c(OC)c1	ZINC000875112029	HJ	On-Demand	Mild	PRSS1	18	47
C=CCc1ccc(OC(=O)C[C@H](NC(=O)c2ccccc2)c2ccccc2)c(OC)c1	ZINC000875112029	HJ	On-Demand	Mild	UTS2	65	35
C=CCc1ccc(OC(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)cc2)c(OC)c1	ZINC000875112036	IH	On-Demand	Mild	TGM2	54	44
C=CCc1ccc(OC(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)cc2)c(OC)c1	ZINC000875112036	IH	On-Demand	Mild	F13A1	62	39
O=C(NCCc1ccccc1C(F)(F)F)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875112037	GF	On-Demand	Anodyne	RBP4	80	38
O=C(NCCc1ccccc1C(F)(F)F)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875112038	GF	On-Demand	Anodyne	RBP4	80	38
O=C(NCCc1ccccc1C(F)(F)F)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875112039	GF	On-Demand	Anodyne	RBP4	80	38
O=C(NCCc1ccccc1C(F)(F)F)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875112040	GF	On-Demand	Anodyne	RBP4	80	38
C[C@@H](CN(C)C(=O)C(=O)N[C@H](C)Cc1ccsc1)NC(=O)OC(C)(C)C	ZINC000875112046	GE	On-Demand	Anodyne	PAPA1_CARPA	31	51
C[C@@H](CN(C)C(=O)C(=O)N[C@H](C)Cc1ccsc1)NC(=O)OC(C)(C)C	ZINC000875112046	GE	On-Demand	Anodyne	FPR1	45	37
C[C@@H](Cc1ccsc1)NC(=O)C(=O)N(C)C[C@@H](C)NC(=O)OC(C)(C)C	ZINC000875112047	GE	On-Demand	Anodyne	PAPA1_CARPA	31	51
C[C@@H](Cc1ccsc1)NC(=O)C(=O)N(C)C[C@@H](C)NC(=O)OC(C)(C)C	ZINC000875112047	GE	On-Demand	Anodyne	FPR1	45	37
C[C@@H](CN(C)C(=O)C(=O)N[C@@H](C)Cc1ccsc1)NC(=O)OC(C)(C)C	ZINC000875112048	GE	On-Demand	Anodyne	PAPA1_CARPA	31	51
C[C@@H](CN(C)C(=O)C(=O)N[C@@H](C)Cc1ccsc1)NC(=O)OC(C)(C)C	ZINC000875112048	GE	On-Demand	Anodyne	FPR1	45	37
CCOC(=O)[C@H](C)C1CN(C(=O)NCCOc2cccc(Cl)c2)C1	ZINC000875112063	FF	On-Demand	Anodyne	PDS	68	40
CCO[C@@H](C(=O)Nc1ccccc1S(=O)(=O)N1CCOCC1)C1CCCC1	ZINC000875112081	GE	On-Demand	Anodyne	LPL	46	41
CCO[C@@H](C(=O)Nc1ccccc1S(=O)(=O)N1CCOCC1)C1CCCC1	ZINC000875112081	GE	On-Demand	Anodyne	CNR2	15	42
CCO[C@@H](C(=O)Nc1ccccc1S(=O)(=O)N1CCOCC1)C1CCCC1	ZINC000875112081	GE	On-Demand	Anodyne	CTSD	28	40
CCO[C@@H](C(=O)Nc1ccccc1S(=O)(=O)N1CCOCC1)C1CCCC1	ZINC000875112081	GE	On-Demand	Anodyne	KCNQ2	42	33
CCO[C@@H](C(=O)Nc1ccccc1S(=O)(=O)N1CCOCC1)C1CCCC1	ZINC000875112081	GE	On-Demand	Anodyne	REN	35	40
CCO[C@@H](C(=O)Nc1ccccc1S(=O)(=O)N1CCOCC1)C1CCCC1	ZINC000875112081	GE	On-Demand	Anodyne	CTSE	40	40
CCO[C@@H](C(=O)Nc1ccccc1S(=O)(=O)N1CCOCC1)C1CCCC1	ZINC000875112081	GE	On-Demand	Anodyne	PGA5	49	40
CCO[C@@H](C(=O)Nc1ccccc1S(=O)(=O)N1CCOCC1)C1CCCC1	ZINC000875112081	GE	On-Demand	Anodyne	LIPG	19	41
C=CCc1ccc(OC(=O)c2ccc(C(=O)OC)cc2)c(OC)c1	ZINC000875112121	EG	On-Demand	Mild	ACR	62	72
O=C(NCCO)C1CCN(C(=O)NCCOc2cccc(Cl)c2)CC1	ZINC000875112125	FD	On-Demand	Anodyne	HRH2	30	42
O=C(NCCO)C1CCN(C(=O)NCCOc2cccc(Cl)c2)CC1	ZINC000875112125	FD	On-Demand	Anodyne	MTNR1A	15	42
O=C(NCCO)C1CCN(C(=O)NCCOc2cccc(Cl)c2)CC1	ZINC000875112125	FD	On-Demand	Anodyne	EPHX2	30	53
CN1CCN(C2CCN(C(=O)C(=O)NC[C@@H]3CCCCO3)CC2)CC1	ZINC000875112135	FB	On-Demand	Anodyne	L3MBTL3	46	40
CN1CCN(C2CCN(C(=O)C(=O)NC[C@H]3CCCCO3)CC2)CC1	ZINC000875112136	FB	On-Demand	Anodyne	L3MBTL3	46	40
Cc1ccn(C[C@H](C)C(=O)Nc2ccccc2S(=O)(=O)N2CCOCC2)n1	ZINC000875112141	GD	On-Demand	Anodyne	LPL	46	43
Cc1ccn(C[C@H](C)C(=O)Nc2ccccc2S(=O)(=O)N2CCOCC2)n1	ZINC000875112141	GD	On-Demand	Anodyne	LIPG	19	43
CCCCCCn1nc(C(=O)N(C)C(C)C)c2ccccc2c1=O	ZINC000875112159	EG	On-Demand	Anodyne	CNR2	15	45
O=C(NCCO)C1CCN(C(=O)NCc2cc3ccccc3o2)CC1	ZINC000875112175	ED	On-Demand	Anodyne	EPHX2	25	45
O=C(NC1CCN(C(=O)CCc2ccccc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875112186	GF	On-Demand	Anodyne	GRIN2B	18	46
O=C(NC1CCN(C(=O)CCc2ccccc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875112186	GF	On-Demand	Anodyne	SIGMAR1	16	42
O=C(NC1CCN(C(=O)CCc2ccccc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875112186	GF	On-Demand	Anodyne	C3AR1	48	46
O=C(NC1CCN(C(=O)CCc2ccccc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875112186	GF	On-Demand	Anodyne	EPHX2	37	51
O=C(NC1CCN(C(=O)CCc2ccccc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875112187	GF	On-Demand	Anodyne	GRIN2B	18	46
O=C(NC1CCN(C(=O)CCc2ccccc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875112187	GF	On-Demand	Anodyne	SIGMAR1	16	42
O=C(NC1CCN(C(=O)CCc2ccccc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875112187	GF	On-Demand	Anodyne	C3AR1	48	46
O=C(NC1CCN(C(=O)CCc2ccccc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875112187	GF	On-Demand	Anodyne	EPHX2	37	51
O=C(NC1CCN(C(=O)CCc2ccccc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875112188	GF	On-Demand	Anodyne	GRIN2B	18	46
O=C(NC1CCN(C(=O)CCc2ccccc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875112188	GF	On-Demand	Anodyne	SIGMAR1	16	42
O=C(NC1CCN(C(=O)CCc2ccccc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875112188	GF	On-Demand	Anodyne	C3AR1	48	46
O=C(NC1CCN(C(=O)CCc2ccccc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875112188	GF	On-Demand	Anodyne	EPHX2	37	51
O=C(NC1CCN(C(=O)CCc2ccccc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875112189	GF	On-Demand	Anodyne	GRIN2B	18	46
O=C(NC1CCN(C(=O)CCc2ccccc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875112189	GF	On-Demand	Anodyne	SIGMAR1	16	42
O=C(NC1CCN(C(=O)CCc2ccccc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875112189	GF	On-Demand	Anodyne	C3AR1	48	46
O=C(NC1CCN(C(=O)CCc2ccccc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875112189	GF	On-Demand	Anodyne	EPHX2	37	51
CCO[C@@H](C(=O)Nc1ccccc1S(=O)(=O)N1CCOCC1)[C@@H]1CCOC1	ZINC000875112191	GD	On-Demand	Anodyne	LPL	32	40
CCO[C@@H](C(=O)Nc1ccccc1S(=O)(=O)N1CCOCC1)[C@@H]1CCOC1	ZINC000875112191	GD	On-Demand	Anodyne	PGA5	44	36
CCO[C@@H](C(=O)Nc1ccccc1S(=O)(=O)N1CCOCC1)[C@H]1CCOC1	ZINC000875112192	GD	On-Demand	Anodyne	LPL	32	40
CCO[C@@H](C(=O)Nc1ccccc1S(=O)(=O)N1CCOCC1)[C@H]1CCOC1	ZINC000875112192	GD	On-Demand	Anodyne	PGA5	44	36
CC[C@H](C[C@H](C)O)NC(=O)NCc1cc2ccccc2o1	ZINC000875112196	CF	On-Demand	Anodyne	ANPEP	15	41
O=C(NCCS(=O)(=O)NCc1ccccc1)N1Cc2cccc(O)c2C1	ZINC000875112208	GD	On-Demand	Clean	NAMPT	23	48
O=C(Cc1ccc(Cl)cn1)Nc1ccccc1S(=O)(=O)N1CCOCC1	ZINC000875112216	GD	On-Demand	Anodyne	KCNQ2	17	40
COC(=O)C1(O)CN(C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)C1	ZINC000875112220	GC	On-Demand	Anodyne	GRIN2B	18	48
COC(=O)C1(O)CN(C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)C1	ZINC000875112220	GC	On-Demand	Anodyne	SIGMAR1	22	44
COC(=O)C1(O)CN(C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)C1	ZINC000875112220	GC	On-Demand	Anodyne	C3AR1	52	51
COC(=O)C1(O)CN(C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)C1	ZINC000875112220	GC	On-Demand	Anodyne	EPHX2	35	42
COC(=O)C1(O)CN(C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)C1	ZINC000875112220	GC	On-Demand	Anodyne	CCR8	50	35
O=C(NCCc1ccccc1C(F)(F)F)C(=O)N1CCC(CO)(CO)CC1	ZINC000875112273	GC	On-Demand	Anodyne	RBP4	54	39
O=C(NCCOc1cccc(Cl)c1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875112282	GE	On-Demand	Anodyne	CACNA1I	52	38
O=C(NCCOc1cccc(Cl)c1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875112282	GE	On-Demand	Anodyne	PDS	41	34
C[C@H](NC(=O)NC(C)(C)[C@H]1CCCCO1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000875112304	GH	On-Demand	Anodyne	EPHX2	41	39
C[C@@H](NC(=O)NC(C)(C)[C@@H]1CCCCO1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000875112305	GH	On-Demand	Anodyne	EPHX2	41	39
C[C@H](NC(=O)NC(C)(C)[C@@H]1CCCCO1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000875112306	GH	On-Demand	Anodyne	EPHX2	41	39
C[C@@H](NC(=O)NC(C)(C)[C@H]1CCCCO1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000875112307	GH	On-Demand	Anodyne	EPHX2	41	39
CC(=O)C1CCN(C(=O)C(=O)NCCc2ccccc2C(F)(F)F)CC1	ZINC000875112311	FE	On-Demand	Anodyne	EPHX2	16	42
CC(=O)C1CCN(C(=O)C(=O)NCCc2ccccc2C(F)(F)F)CC1	ZINC000875112311	FE	On-Demand	Anodyne	RBP4	60	43
CC(=O)C1CCN(C(=O)C(=O)NCCc2ccccc2C(F)(F)F)CC1	ZINC000875112311	FE	On-Demand	Anodyne	SFRP1	115	36
CC(=O)C1CCN(C(=O)C(=O)NCCc2ccccc2C(F)(F)F)CC1	ZINC000875112311	FE	On-Demand	Anodyne	WNT3	80	36
CN1CC[C@H]2CN(C(=O)C(=O)NCCc3ccccc3C(F)(F)F)CC[C@H]21	ZINC000875112320	GD	On-Demand	Anodyne	RBP4	79	37
CN1CC[C@H]2CN(C(=O)C(=O)NCCc3ccccc3C(F)(F)F)CC[C@@H]21	ZINC000875112321	GD	On-Demand	Anodyne	RBP4	79	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCOc1c(C)cccc1C	ZINC000875112342	EE	On-Demand	Anodyne	SLC6A3	45	38
CC[C@H](C[C@H](C)O)NC(=O)NCCOc1cccc(Cl)c1	ZINC000875112367	DF	On-Demand	Anodyne	HRH2	26	45
CC[C@H](C[C@H](C)O)NC(=O)NCCOc1cccc(Cl)c1	ZINC000875112367	DF	On-Demand	Anodyne	MTNR1A	20	42
CC[C@H](C[C@H](C)O)NC(=O)NCCOc1cccc(Cl)c1	ZINC000875112367	DF	On-Demand	Anodyne	PDS	92	47
CC(=O)[C@H]1CCCN(C(=O)NCCS(=O)(=O)NCc2ccccc2)C1	ZINC000875112409	FD	On-Demand	Anodyne	PREP	31	40
CC(=O)[C@H]1CCCN(C(=O)NCCS(=O)(=O)NCc2ccccc2)C1	ZINC000875112409	FD	On-Demand	Anodyne	DPP7	59	41
CC(=O)[C@H]1CCCN(C(=O)NCCS(=O)(=O)NCc2ccccc2)C1	ZINC000875112409	FD	On-Demand	Anodyne	TMPRSS11D	78	35
CC(=O)[C@@H]1CCCN(C(=O)NCCS(=O)(=O)NCc2ccccc2)C1	ZINC000875112410	FD	On-Demand	Anodyne	PREP	31	40
CC(=O)[C@@H]1CCCN(C(=O)NCCS(=O)(=O)NCc2ccccc2)C1	ZINC000875112410	FD	On-Demand	Anodyne	DPP7	59	41
CC(=O)[C@@H]1CCCN(C(=O)NCCS(=O)(=O)NCc2ccccc2)C1	ZINC000875112410	FD	On-Demand	Anodyne	TMPRSS11D	78	35
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@@H]1CCCCO1	ZINC000875112414	GE	On-Demand	Anodyne	CHRM2	15	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@@H]1CCCCO1	ZINC000875112414	GE	On-Demand	Anodyne	DRD2	21	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@@H]1CCCCO1	ZINC000875112414	GE	On-Demand	Anodyne	DRD4	45	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@@H]1CCCCO1	ZINC000875112414	GE	On-Demand	Anodyne	ACHE	63	61
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@@H]1CCCCO1	ZINC000875112414	GE	On-Demand	Anodyne	DRD3	15	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@@H]1CCCCO1	ZINC000875112414	GE	On-Demand	Anodyne	CHRM3	17	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@@H]1CCCCO1	ZINC000875112414	GE	On-Demand	Anodyne	SIGMAR1	59	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@@H]1CCCCO1	ZINC000875112414	GE	On-Demand	Anodyne	CCR3	29	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@@H]1CCCCO1	ZINC000875112414	GE	On-Demand	Anodyne	MCHR1	22	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@@H]1CCCCO1	ZINC000875112414	GE	On-Demand	Anodyne	PDE8B	21	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@@H]1CCCCO1	ZINC000875112414	GE	On-Demand	Anodyne	CACNA1I	48	39
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@H]1CCCCO1	ZINC000875112415	GE	On-Demand	Anodyne	CHRM2	15	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@H]1CCCCO1	ZINC000875112415	GE	On-Demand	Anodyne	DRD2	21	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@H]1CCCCO1	ZINC000875112415	GE	On-Demand	Anodyne	DRD4	45	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@H]1CCCCO1	ZINC000875112415	GE	On-Demand	Anodyne	ACHE	63	61
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@H]1CCCCO1	ZINC000875112415	GE	On-Demand	Anodyne	DRD3	15	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@H]1CCCCO1	ZINC000875112415	GE	On-Demand	Anodyne	CHRM3	17	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@H]1CCCCO1	ZINC000875112415	GE	On-Demand	Anodyne	SIGMAR1	59	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@H]1CCCCO1	ZINC000875112415	GE	On-Demand	Anodyne	CCR3	29	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@H]1CCCCO1	ZINC000875112415	GE	On-Demand	Anodyne	MCHR1	22	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@H]1CCCCO1	ZINC000875112415	GE	On-Demand	Anodyne	PDE8B	21	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@H]1CCCCO1	ZINC000875112415	GE	On-Demand	Anodyne	CACNA1I	48	39
COc1ccc(N2CCN(C(=O)C(=O)NC[C@@H]3CCCCO3)CC2)c(OC)c1	ZINC000875112438	GD	On-Demand	Clean	DRD4	41	32
COc1ccc(N2CCN(C(=O)C(=O)NC[C@H]3CCCCO3)CC2)c(OC)c1	ZINC000875112439	GD	On-Demand	Clean	DRD4	41	32
O=C(NCCOc1cccc(Cl)c1)N1CCC(CO)(CO)CC1	ZINC000875112444	ED	On-Demand	Anodyne	CACNA1H	42	34
O=C(NCCOc1cccc(Cl)c1)N1CCC(CO)(CO)CC1	ZINC000875112444	ED	On-Demand	Anodyne	HRH2	29	43
O=C(NCCOc1cccc(Cl)c1)N1CCC(CO)(CO)CC1	ZINC000875112444	ED	On-Demand	Anodyne	EPHX2	27	44
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000875112451	GG	On-Demand	Anodyne	EPHX2	50	45
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000875112454	GG	On-Demand	Anodyne	EPHX2	50	45
O=C(CCc1ccccc1)N1CCC(NC(=O)N2Cc3cccc(O)c3C2)CC1	ZINC000875112456	GG	On-Demand	Clean	DRD4	15	43
O=C(CCc1ccccc1)N1CCC(NC(=O)N2Cc3cccc(O)c3C2)CC1	ZINC000875112456	GG	On-Demand	Clean	GRIN2B	24	45
O=C(CCc1ccccc1)N1CCC(NC(=O)N2Cc3cccc(O)c3C2)CC1	ZINC000875112456	GG	On-Demand	Clean	SIGMAR1	19	44
O=C(CCc1ccccc1)N1CCC(NC(=O)N2Cc3cccc(O)c3C2)CC1	ZINC000875112456	GG	On-Demand	Clean	C3AR1	47	46
O=C(CCc1ccccc1)N1CCC(NC(=O)N2Cc3cccc(O)c3C2)CC1	ZINC000875112456	GG	On-Demand	Clean	PREP	46	40
O=C(CCc1ccccc1)N1CCC(NC(=O)N2Cc3cccc(O)c3C2)CC1	ZINC000875112456	GG	On-Demand	Clean	EPHX2	34	41
O=C(NC[C@H]1CCCCO1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875112459	ED	On-Demand	Anodyne	OXTR	52	37
O=C(NC[C@H]1CCCCO1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875112460	ED	On-Demand	Anodyne	OXTR	52	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc2ccccc2o1	ZINC000875112477	EF	On-Demand	Anodyne	SLC6A4	26	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc2ccccc2o1	ZINC000875112477	EF	On-Demand	Anodyne	SLC6A3	48	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc2ccccc2o1	ZINC000875112478	EF	On-Demand	Anodyne	SLC6A4	26	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc2ccccc2o1	ZINC000875112478	EF	On-Demand	Anodyne	SLC6A3	48	40
Cc1nnc(NNC(=O)NCCOc2cccc(Cl)c2)n1C	ZINC000875112489	DD	On-Demand	Reactive	HRH2	25	40
C=CCc1ccc(OC(=O)c2ccc(OC(F)F)cc2)c(OC)c1	ZINC000875112497	EI	On-Demand	Mild	ACR	45	63
O=C(NC[C@H]1CCCCO1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875112500	GD	On-Demand	Anodyne	SMO	34	40
O=C(NC[C@H]1CCCCO1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875112500	GD	On-Demand	Anodyne	ETHR	64	52
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NC[C@H]3CCCCO3)C2)c1	ZINC000875112517	GC	On-Demand	Anodyne	DRD4	36	45
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NC[C@H]3CCCCO3)C2)c1	ZINC000875112517	GC	On-Demand	Anodyne	CHRM3	15	44
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NC[C@H]3CCCCO3)C2)c1	ZINC000875112517	GC	On-Demand	Anodyne	CCR3	15	46
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NC[C@H]3CCCCO3)C2)c1	ZINC000875112517	GC	On-Demand	Anodyne	PDE8B	26	43
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NC[C@@H]3CCCCO3)C2)c1	ZINC000875112518	GC	On-Demand	Anodyne	DRD4	36	45
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NC[C@@H]3CCCCO3)C2)c1	ZINC000875112518	GC	On-Demand	Anodyne	CHRM3	15	44
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NC[C@@H]3CCCCO3)C2)c1	ZINC000875112518	GC	On-Demand	Anodyne	CCR3	15	46
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NC[C@@H]3CCCCO3)C2)c1	ZINC000875112518	GC	On-Demand	Anodyne	PDE8B	26	43
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NC[C@@H]3CCCCO3)C2)c1	ZINC000875112519	GC	On-Demand	Anodyne	DRD4	36	45
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NC[C@@H]3CCCCO3)C2)c1	ZINC000875112519	GC	On-Demand	Anodyne	CHRM3	15	44
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NC[C@@H]3CCCCO3)C2)c1	ZINC000875112519	GC	On-Demand	Anodyne	CCR3	15	46
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NC[C@@H]3CCCCO3)C2)c1	ZINC000875112519	GC	On-Demand	Anodyne	PDE8B	26	43
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NC[C@H]3CCCCO3)C2)c1	ZINC000875112520	GC	On-Demand	Anodyne	DRD4	36	45
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NC[C@H]3CCCCO3)C2)c1	ZINC000875112520	GC	On-Demand	Anodyne	CHRM3	15	44
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NC[C@H]3CCCCO3)C2)c1	ZINC000875112520	GC	On-Demand	Anodyne	CCR3	15	46
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NC[C@H]3CCCCO3)C2)c1	ZINC000875112520	GC	On-Demand	Anodyne	PDE8B	26	43
COC(=O)N(C)NC(=O)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000875112525	FD	On-Demand	Reactive	DRD4	18	42
COC(=O)N(C)NC(=O)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000875112525	FD	On-Demand	Reactive	GRIN2B	36	49
COC(=O)N(C)NC(=O)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000875112525	FD	On-Demand	Reactive	SIGMAR1	24	43
COC(=O)N(C)NC(=O)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000875112525	FD	On-Demand	Reactive	C3AR1	49	47
COC(=O)N(C)NC(=O)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000875112525	FD	On-Demand	Reactive	PREP	48	39
COC(=O)N(C)NC(=O)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000875112525	FD	On-Demand	Reactive	EPHX2	42	48
COC(=O)N(C)NC(=O)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000875112525	FD	On-Demand	Reactive	MCHR1	16	40
COC(=O)N(C)NC(=O)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000875112525	FD	On-Demand	Reactive	CCR8	59	36
N#CCc1ccsc1C(=O)Nc1ccccc1S(=O)(=O)N1CCOCC1	ZINC000875112534	GE	On-Demand	Mild	LPL	27	40
C[C@@H](NC(=O)N1Cc2cccc(O)c2C1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000875112537	GG	On-Demand	Clean	EPHX2	41	41
C[C@H](NC(=O)N1Cc2cccc(O)c2C1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000875112538	GG	On-Demand	Clean	EPHX2	41	41
COC(=O)N(C)NC(=O)NCCOc1cccc(Cl)c1	ZINC000875112569	DD	On-Demand	Reactive	HRH2	26	42
COC(=O)N(C)NC(=O)NCCOc1cccc(Cl)c1	ZINC000875112569	DD	On-Demand	Reactive	MTNR1A	38	48
COC(=O)N(C)NC(=O)NCCOc1cccc(Cl)c1	ZINC000875112569	DD	On-Demand	Reactive	MTNR1B	27	48
COC(=O)N(C)NC(=O)NCCOc1cccc(Cl)c1	ZINC000875112569	DD	On-Demand	Reactive	PDS	49	40
C=CCN(c1ccc(OC)cc1)S(=O)(=O)c1ccc(Cl)c(C(=O)N(C)C(C)C)c1	ZINC000875112572	II	On-Demand	Mild	BMP1	58	40
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000875112590	GE	On-Demand	Anodyne	GRIN2B	18	44
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000875112590	GE	On-Demand	Anodyne	CCR1	17	41
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000875112590	GE	On-Demand	Anodyne	C3AR1	48	46
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000875112590	GE	On-Demand	Anodyne	EPHX2	34	47
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000875112590	GE	On-Demand	Anodyne	CCR8	55	37
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000875112590	GE	On-Demand	Anodyne	BIRC2	22	40
Cc1ccccc1CN1CCO[C@@H](CNC(=O)C(=O)NC[C@H]2CCCCO2)C1	ZINC000875112593	GC	On-Demand	Anodyne	DRD4	16	44
Cc1ccccc1CN1CCO[C@@H](CNC(=O)C(=O)NC[C@H]2CCCCO2)C1	ZINC000875112593	GC	On-Demand	Anodyne	SLC6A1	58	36
Cc1ccccc1CN1CCO[C@@H](CNC(=O)C(=O)NC[C@H]2CCCCO2)C1	ZINC000875112593	GC	On-Demand	Anodyne	PDE8B	26	45
Cc1ccccc1CN1CCO[C@@H](CNC(=O)C(=O)NC[C@@H]2CCCCO2)C1	ZINC000875112594	GC	On-Demand	Anodyne	DRD4	16	44
Cc1ccccc1CN1CCO[C@@H](CNC(=O)C(=O)NC[C@@H]2CCCCO2)C1	ZINC000875112594	GC	On-Demand	Anodyne	SLC6A1	58	36
Cc1ccccc1CN1CCO[C@@H](CNC(=O)C(=O)NC[C@@H]2CCCCO2)C1	ZINC000875112594	GC	On-Demand	Anodyne	PDE8B	26	45
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1ccc(NC(=O)NC2CC2)cc1	ZINC000875112684	FG	On-Demand	Anodyne	EPHX2	52	47
CCOC(=O)N1CCN(S(=O)(=O)c2cc(C(=O)N(C)C(C)C)c(Cl)cc2Cl)CC1	ZINC000875112685	JF	On-Demand	Anodyne	TGM2	33	41
CCOC(=O)N1CCN(S(=O)(=O)c2cc(C(=O)N(C)C(C)C)c(Cl)cc2Cl)CC1	ZINC000875112685	JF	On-Demand	Anodyne	F13A1	41	41
Cc1ccnn1CC(=O)Nc1ccccc1S(=O)(=O)N1CCOCC1	ZINC000875112746	FC	On-Demand	Anodyne	LPL	47	44
Cc1ccnn1CC(=O)Nc1ccccc1S(=O)(=O)N1CCOCC1	ZINC000875112746	FC	On-Demand	Anodyne	LIPG	19	44
C=CC(C)(C)CCCNC(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875112781	EG	On-Demand	Mild	MAPK14	15	42
CC(=O)[C@H]1CCCN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875112794	EE	On-Demand	Anodyne	DRD4	25	44
CC(=O)[C@H]1CCCN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875112794	EE	On-Demand	Anodyne	MAPK14	27	43
CC(=O)[C@H]1CCCN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875112794	EE	On-Demand	Anodyne	PREP	34	41
CC(=O)[C@H]1CCCN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875112794	EE	On-Demand	Anodyne	EPHX2	19	42
CC(=O)[C@H]1CCCN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875112794	EE	On-Demand	Anodyne	DPP7	42	37
CC(=O)[C@@H]1CCCN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875112795	EE	On-Demand	Anodyne	DRD4	25	44
CC(=O)[C@@H]1CCCN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875112795	EE	On-Demand	Anodyne	MAPK14	27	43
CC(=O)[C@@H]1CCCN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875112795	EE	On-Demand	Anodyne	PREP	34	41
CC(=O)[C@@H]1CCCN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875112795	EE	On-Demand	Anodyne	EPHX2	19	42
CC(=O)[C@@H]1CCCN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875112795	EE	On-Demand	Anodyne	DPP7	42	37
COC(=O)N(C)NC(=O)NCc1cc(Cl)ccc1OC	ZINC000875112800	DD	On-Demand	Reactive	MT-ND1	17	40
CS[C@@H]1C[C@@H](NC(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875112803	EE	On-Demand	Anodyne	MAPK14	28	45
CS[C@@H]1C[C@@H](NC(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875112803	EE	On-Demand	Anodyne	EPHX2	21	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cc(Cl)ccc2OC)C1	ZINC000875112807	FF	On-Demand	Anodyne	F2	20	41
O=CN1CCCN(C(=O)N[C@@H](c2ccc(F)cc2)C2CCCC2)CC1	ZINC000875112816	EF	On-Demand	Anodyne	CTSS	16	43
O=CN1CCCN(C(=O)N[C@H](c2ccc(F)cc2)C2CCCC2)CC1	ZINC000875112817	EF	On-Demand	Anodyne	CTSS	16	43
C=CCc1ccc(OC(=O)c2ccc(OC[C@@H]3CCCO3)cc2)c(OC)c1	ZINC000875112836	FI	On-Demand	Mild	ACR	21	54
C=CCc1ccc(OC(=O)c2ccc(OC[C@H]3CCCO3)cc2)c(OC)c1	ZINC000875112837	FI	On-Demand	Mild	ACR	21	54
CN1CCN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)Cc2cccnc21	ZINC000875112841	GE	On-Demand	Anodyne	HPGDS	42	32
O=C(NCc1cccc(C(=O)NC2CC2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875112851	DD	On-Demand	Anodyne	MAPK11	22	42
O=C(NCc1cccc(C(=O)NC2CC2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875112851	DD	On-Demand	Anodyne	MAPK14	23	45
O=C(NCc1cccc(C(=O)NC2CC2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875112851	DD	On-Demand	Anodyne	PLAU	15	43
O=C(NCc1cccc(C(=O)NC2CC2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875112851	DD	On-Demand	Anodyne	ST14	15	43
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)C1	ZINC000875112873	FG	On-Demand	Anodyne	EPHX2	47	39
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)C1	ZINC000875112875	FG	On-Demand	Anodyne	EPHX2	47	39
O=CN1CCCN(C(=O)NCCOc2cccc(Cl)c2)CC1	ZINC000875112885	ED	On-Demand	Anodyne	HRH2	31	43
C[C@H](NC(=O)N1C[C@H]2CC=CC[C@H]2C1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000875112886	FH	On-Demand	Anodyne	EPHX2	46	43
C[C@@H](NC(=O)N1C[C@H]2CC=CC[C@H]2C1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000875112887	FH	On-Demand	Anodyne	EPHX2	46	43
C=CCc1ccc(OC(=O)c2ccc(C=NOC)cc2)c(OC)c1	ZINC000875112896	EH	On-Demand	Mild	ACR	23	66
CC(=O)C1CCN(C(=O)NCCS(=O)(=O)NCc2ccccc2)CC1	ZINC000875112904	FD	On-Demand	Anodyne	GRIN2B	40	36
CC(=O)C1CCN(C(=O)NCCS(=O)(=O)NCc2ccccc2)CC1	ZINC000875112904	FD	On-Demand	Anodyne	EPHX2	27	42
CC(=O)C1CCN(C(=O)NCCS(=O)(=O)NCc2ccccc2)CC1	ZINC000875112904	FD	On-Demand	Anodyne	TMPRSS11D	45	32
C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C(=O)Nc1ccccc1S(=O)(=O)N1CCOCC1	ZINC000875112926	FD	On-Demand	Anodyne	LPL	48	45
C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C(=O)Nc1ccccc1S(=O)(=O)N1CCOCC1	ZINC000875112926	FD	On-Demand	Anodyne	EPHX2	16	44
C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C(=O)Nc1ccccc1S(=O)(=O)N1CCOCC1	ZINC000875112926	FD	On-Demand	Anodyne	LIPG	19	45
C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C(=O)Nc1ccccc1S(=O)(=O)N1CCOCC1	ZINC000875112927	FD	On-Demand	Anodyne	LPL	48	45
C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C(=O)Nc1ccccc1S(=O)(=O)N1CCOCC1	ZINC000875112927	FD	On-Demand	Anodyne	EPHX2	16	44
C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C(=O)Nc1ccccc1S(=O)(=O)N1CCOCC1	ZINC000875112927	FD	On-Demand	Anodyne	LIPG	19	45
C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C(=O)Nc1ccccc1S(=O)(=O)N1CCOCC1	ZINC000875112929	FD	On-Demand	Anodyne	LPL	48	45
C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C(=O)Nc1ccccc1S(=O)(=O)N1CCOCC1	ZINC000875112929	FD	On-Demand	Anodyne	EPHX2	16	44
C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C(=O)Nc1ccccc1S(=O)(=O)N1CCOCC1	ZINC000875112929	FD	On-Demand	Anodyne	LIPG	19	45
CCN(CCNC(=O)OC(C)(C)C)C(=O)C(=O)N[C@H](C)Cc1ccsc1	ZINC000875112930	GE	On-Demand	Anodyne	PAPA1_CARPA	32	48
CCN(CCNC(=O)OC(C)(C)C)C(=O)C(=O)N[C@@H](C)Cc1ccsc1	ZINC000875112931	GE	On-Demand	Anodyne	PAPA1_CARPA	32	48
O=C(NCc1cc2ccccc2o1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875112954	EI	On-Demand	Anodyne	EPHX2	23	47
O=C(NCc1cc2ccccc2o1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875112954	EI	On-Demand	Anodyne	SMO	28	40
O=C(NCc1cc2ccccc2o1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875112955	EI	On-Demand	Anodyne	EPHX2	23	47
O=C(NCc1cc2ccccc2o1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875112955	EI	On-Demand	Anodyne	SMO	28	40
CCCCCCCNC(=O)C(=O)N[C@H](C)Cc1ccsc1	ZINC000875112960	DF	On-Demand	Mild	GRIA1	56	40
CCCCCCCNC(=O)C(=O)N[C@H](C)Cc1ccsc1	ZINC000875112960	DF	On-Demand	Mild	CAPN2	28	41
CCCCCCCNC(=O)C(=O)N[C@H](C)Cc1ccsc1	ZINC000875112960	DF	On-Demand	Mild	ASAH1	81	36
CCCCCCCNC(=O)C(=O)N[C@@H](C)Cc1ccsc1	ZINC000875112961	DF	On-Demand	Mild	GRIA1	56	40
CCCCCCCNC(=O)C(=O)N[C@@H](C)Cc1ccsc1	ZINC000875112961	DF	On-Demand	Mild	CAPN2	28	41
CCCCCCCNC(=O)C(=O)N[C@@H](C)Cc1ccsc1	ZINC000875112961	DF	On-Demand	Mild	ASAH1	81	36
O=C(NCCOc1cccc(Cl)c1)NC[C@H]1C[C@H](O)C1	ZINC000875112964	CD	On-Demand	Anodyne	HRH2	27	44
O=C(NCCOc1cccc(Cl)c1)NC[C@H]1C[C@H](O)C1	ZINC000875112964	CD	On-Demand	Anodyne	PDS	44	39
COC(=O)C1(O)CN(C(=O)NCCOc2cccc(Cl)c2)C1	ZINC000875112965	EC	On-Demand	Anodyne	HRH2	26	40
COC(=O)C1(O)CN(C(=O)NCCOc2cccc(Cl)c2)C1	ZINC000875112965	EC	On-Demand	Anodyne	MTNR1A	17	44
O=CN1CCCN(C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)CC1	ZINC000875112970	GD	On-Demand	Anodyne	GRIN2B	16	47
O=CN1CCCN(C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)CC1	ZINC000875112970	GD	On-Demand	Anodyne	SIGMAR1	20	45
O=CN1CCCN(C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)CC1	ZINC000875112970	GD	On-Demand	Anodyne	C3AR1	51	49
O=CN1CCCN(C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)CC1	ZINC000875112970	GD	On-Demand	Anodyne	PREP	48	41
O=CN1CCCN(C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)CC1	ZINC000875112970	GD	On-Demand	Anodyne	MLNR	18	41
O=CN1CCCN(C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)CC1	ZINC000875112970	GD	On-Demand	Anodyne	EPHX2	35	44
C=CCc1ccc(OC(=O)c2ccc(OC(F)F)c(OC)c2)c(OC)c1	ZINC000875112991	FI	On-Demand	Mild	PDE4D	18	41
C=CCc1ccc(OC(=O)c2ccc(OC(F)F)c(OC)c2)c(OC)c1	ZINC000875112991	FI	On-Demand	Mild	ACR	22	61
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000875112997	FD	On-Demand	Anodyne	GRIN2B	31	52
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000875112997	FD	On-Demand	Anodyne	SIGMAR1	18	43
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000875112997	FD	On-Demand	Anodyne	C3AR1	48	47
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000875112997	FD	On-Demand	Anodyne	EPHX2	47	47
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000875112997	FD	On-Demand	Anodyne	CCR8	48	35
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000875113008	FD	On-Demand	Anodyne	EPHX2	47	43
COCC(C)(C)CCNC(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875113023	EE	On-Demand	Anodyne	MAPK14	24	47
O=CN1CCCN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000875113025	EC	On-Demand	Anodyne	DRD4	22	44
O=C(NC1CC1)c1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875113029	GF	On-Demand	Anodyne	F2	32	41
O=C(NC1CC1)c1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875113029	GF	On-Demand	Anodyne	DRD4	20	43
O=C(NC1CC1)c1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875113029	GF	On-Demand	Anodyne	PREP	40	42
O=C(NC1CC1)c1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875113029	GF	On-Demand	Anodyne	TMPRSS11D	67	37
O=C(NC1CC1)c1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875113030	GF	On-Demand	Anodyne	F2	32	41
O=C(NC1CC1)c1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875113030	GF	On-Demand	Anodyne	DRD4	20	43
O=C(NC1CC1)c1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875113030	GF	On-Demand	Anodyne	PREP	40	42
O=C(NC1CC1)c1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875113030	GF	On-Demand	Anodyne	TMPRSS11D	67	37
O=C(NC1CC1)c1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875113031	GF	On-Demand	Anodyne	F2	32	41
O=C(NC1CC1)c1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875113031	GF	On-Demand	Anodyne	DRD4	20	43
O=C(NC1CC1)c1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875113031	GF	On-Demand	Anodyne	PREP	40	42
O=C(NC1CC1)c1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875113031	GF	On-Demand	Anodyne	TMPRSS11D	67	37
O=C(NC1CC1)c1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875113032	GF	On-Demand	Anodyne	F2	32	41
O=C(NC1CC1)c1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875113032	GF	On-Demand	Anodyne	DRD4	20	43
O=C(NC1CC1)c1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875113032	GF	On-Demand	Anodyne	PREP	40	42
O=C(NC1CC1)c1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875113032	GF	On-Demand	Anodyne	TMPRSS11D	67	37
O=C(NCc1cccc(C(=O)NC2CC2)c1)NCc1ccc(C(F)(F)F)s1	ZINC000875113033	GH	On-Demand	Anodyne	MAPK14	21	41
O=C(NCc1cccc(C(=O)NC2CC2)c1)NCc1ccc(C(F)(F)F)s1	ZINC000875113033	GH	On-Demand	Anodyne	CCR2	61	39
O=C(N[C@@H](c1ccc(F)cc1)C1CCCC1)N1CCC(CO)(CO)CC1	ZINC000875113034	FF	On-Demand	Anodyne	CTSS	19	43
O=C(N[C@H](c1ccc(F)cc1)C1CCCC1)N1CCC(CO)(CO)CC1	ZINC000875113035	FF	On-Demand	Anodyne	CTSS	19	43
CN1Cc2ccccc2[C@@H]1CNC(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875113036	GF	On-Demand	Anodyne	MAPK14	20	41
CN1Cc2ccccc2[C@H]1CNC(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875113037	GF	On-Demand	Anodyne	MAPK14	20	41
O=C(NCC[C@@H]1CCSC1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875113038	EF	On-Demand	Anodyne	MAPK14	16	41
O=C(NCC[C@@H]1CCSC1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875113038	EF	On-Demand	Anodyne	ST14	21	40
O=C(NCC[C@H]1CCSC1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875113039	EF	On-Demand	Anodyne	MAPK14	16	41
O=C(NCC[C@H]1CCSC1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875113039	EF	On-Demand	Anodyne	ST14	21	40
C[C@@H]1CN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)CC[C@H](C(F)(F)F)O1	ZINC000875113059	GF	On-Demand	Anodyne	DRD4	18	40
C[C@@H]1CN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)CC[C@H](C(F)(F)F)O1	ZINC000875113059	GF	On-Demand	Anodyne	MAPK14	24	41
C[C@@H]1CN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)CC[C@H](C(F)(F)F)O1	ZINC000875113059	GF	On-Demand	Anodyne	CCR2	53	38
C[C@@H]1CN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)CC[C@@H](C(F)(F)F)O1	ZINC000875113060	GF	On-Demand	Anodyne	DRD4	18	40
C[C@@H]1CN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)CC[C@@H](C(F)(F)F)O1	ZINC000875113060	GF	On-Demand	Anodyne	MAPK14	24	41
C[C@@H]1CN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)CC[C@@H](C(F)(F)F)O1	ZINC000875113060	GF	On-Demand	Anodyne	CCR2	53	38
C[C@@H](NC(=O)NC1(C)CC(F)(F)C1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000875113063	FH	On-Demand	Anodyne	EPHX2	51	42
C[C@@H](NC(=O)NC1(C)CC(F)(F)C1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000875113063	FH	On-Demand	Anodyne	F7	17	40
C[C@H](NC(=O)NC1(C)CC(F)(F)C1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000875113064	FH	On-Demand	Anodyne	EPHX2	51	42
C[C@H](NC(=O)NC1(C)CC(F)(F)C1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000875113064	FH	On-Demand	Anodyne	F7	17	40
O=C(NCc1cccc(C(=O)NC2CC2)c1)NC[C@H]1CC2(CCOCC2)CO1	ZINC000875113074	GD	On-Demand	Anodyne	MAPK14	17	42
O=C(NCc1cccc(C(=O)NC2CC2)c1)NC[C@@H]1CC2(CCOCC2)CO1	ZINC000875113075	GD	On-Demand	Anodyne	MAPK14	17	42
CC(=O)N(C)c1ccc(CNC(=O)NCc2cccc(C(=O)NC3CC3)c2)cc1	ZINC000875113081	GF	On-Demand	Anodyne	MAPK14	27	44
COc1ccc([C@@H]2CN(C(=O)C(=O)N[C@H](C)Cc3ccsc3)CCO2)cc1	ZINC000875113083	GE	On-Demand	Anodyne	NPBWR1	47	32
COc1ccc([C@@H]2CN(C(=O)C(=O)N[C@@H](C)Cc3ccsc3)CCO2)cc1	ZINC000875113084	GE	On-Demand	Anodyne	NPBWR1	47	32
Cn1cc(CCNC(=O)NCc2cccc(C(=O)NC3CC3)c2)c2cccnc21	ZINC000875113088	GF	On-Demand	Anodyne	CNR2	19	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(S(=O)(=O)N(C)C)cc1	ZINC000875113110	GD	On-Demand	Anodyne	SLC6A3	41	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(S(=O)(=O)N(C)C)cc1	ZINC000875113111	GD	On-Demand	Anodyne	SLC6A3	41	37
CC[C@H](C[C@H](C)O)NC(=O)NCCOc1ccc2c(c1)OCO2	ZINC000875113113	DD	On-Demand	Anodyne	EDNRB	41	39
CC[C@H](C[C@H](C)O)NC(=O)NCCOc1ccc2c(c1)OCO2	ZINC000875113113	DD	On-Demand	Anodyne	EDNRA	42	40
CC[C@H](C[C@H](C)O)NC(=O)NCCOc1ccc2c(c1)OCO2	ZINC000875113113	DD	On-Demand	Anodyne	BMP1	42	36
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccc(Cl)s1	ZINC000875113121	EF	On-Demand	Anodyne	SLC6A4	29	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccc(Cl)s1	ZINC000875113121	EF	On-Demand	Anodyne	SLC6A3	52	42
CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875113134	EE	On-Demand	Anodyne	TIMP3	53	32
CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875113134	EE	On-Demand	Anodyne	PDS	41	31
O=C(NCCc1ccc(OCc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875113144	GF	On-Demand	Anodyne	MAOB	18	41
O=C(NCCc1ccc(OCc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875113144	GF	On-Demand	Anodyne	CYSLTR1	15	40
O=C(NCCc1ccc(OCc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875113144	GF	On-Demand	Anodyne	LTA4H	35	40
O=C(NCCc1ccc(OCc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875113144	GF	On-Demand	Anodyne	ADAM17	32	43
O=C(NCCc1ccc(OCc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875113144	GF	On-Demand	Anodyne	FAAH	15	41
O=C(NCCc1ccc(OCc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875113144	GF	On-Demand	Anodyne	SLC6A5	40	39
O=C(NCCc1ccc(OCc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875113144	GF	On-Demand	Anodyne	DPP7	15	43
O=C(NCCc1ccc(OCc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875113144	GF	On-Demand	Anodyne	TAAR1	16	49
O=C(NCCc1ccc(OCc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875113144	GF	On-Demand	Anodyne	FFAR1	39	48
O=C(NCCc1ccc(OCc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875113144	GF	On-Demand	Anodyne	FFAR4	48	39
O=C(NCCc1ccc(OCc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875113144	GF	On-Demand	Anodyne	SLC12A5	45	33
CN1CCC(CNC(=O)NCC(C)(C)C(N)=O)(c2ccccc2)CC1	ZINC000875113169	ED	On-Demand	Anodyne	KCNA3	48	41
CN1CCC(CNC(=O)NCC(C)(C)C(N)=O)(c2ccccc2)CC1	ZINC000875113169	ED	On-Demand	Anodyne	SOAT1	18	43
CN1CCC(CNC(=O)NCC(C)(C)C(N)=O)(c2ccccc2)CC1	ZINC000875113169	ED	On-Demand	Anodyne	NPFFR1	26	45
CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)c1	ZINC000875113172	GF	On-Demand	Anodyne	SLC6A3	46	37
CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)c1	ZINC000875113172	GF	On-Demand	Anodyne	TIMP3	40	31
CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)c1	ZINC000875113173	GF	On-Demand	Anodyne	SLC6A3	46	37
CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)c1	ZINC000875113173	GF	On-Demand	Anodyne	TIMP3	40	31
O=C(NC1CC1)c1cccc(CNC(=O)N2CCC[C@](O)(c3ccccc3)C2)c1	ZINC000875113188	GF	On-Demand	Anodyne	DRD4	20	43
O=C(NC1CC1)c1cccc(CNC(=O)N2CCC[C@](O)(c3ccccc3)C2)c1	ZINC000875113188	GF	On-Demand	Anodyne	CCR2	28	41
O=C(NC1CC1)c1cccc(CNC(=O)N2CCC[C@](O)(c3ccccc3)C2)c1	ZINC000875113188	GF	On-Demand	Anodyne	EPHX2	19	45
O=C(NC1CC1)c1cccc(CNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)c1	ZINC000875113190	GF	On-Demand	Anodyne	DRD4	20	43
O=C(NC1CC1)c1cccc(CNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)c1	ZINC000875113190	GF	On-Demand	Anodyne	CCR2	28	41
O=C(NC1CC1)c1cccc(CNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)c1	ZINC000875113190	GF	On-Demand	Anodyne	EPHX2	19	45
O=C(NC1CC1)c1cccc(CNC(=O)N2Cc3cccc(O)c3C2)c1	ZINC000875113196	FF	On-Demand	Clean	DRD4	15	41
O=C(NC1CC1)c1cccc(CNC(=O)N2Cc3cccc(O)c3C2)c1	ZINC000875113196	FF	On-Demand	Clean	MAPK14	18	43
O=C(NC1CC1)c1cccc(CNC(=O)N2Cc3cccc(O)c3C2)c1	ZINC000875113196	FF	On-Demand	Clean	NAMPT	22	41
O=C(N[C@@H](c1ccc(F)cc1)C1CCCC1)N1CCC2(CCNC2=O)CC1	ZINC000875113197	FG	On-Demand	Anodyne	CACNA1H	52	41
O=C(N[C@H](c1ccc(F)cc1)C1CCCC1)N1CCC2(CCNC2=O)CC1	ZINC000875113198	FG	On-Demand	Anodyne	CACNA1H	52	41
CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)NNc2cccc(C)n2)c1	ZINC000875113199	FG	On-Demand	Reactive	ANPEP	15	40
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000875113205	GG	On-Demand	Anodyne	DRD4	24	42
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000875113205	GG	On-Demand	Anodyne	MAPK14	27	42
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000875113205	GG	On-Demand	Anodyne	CCR3	58	46
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000875113205	GG	On-Demand	Anodyne	UTS2R	22	46
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000875113205	GG	On-Demand	Anodyne	CCR2	50	43
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000875113205	GG	On-Demand	Anodyne	EPHX2	40	50
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC000875113205	GG	On-Demand	Anodyne	MCHR1	20	42
CCOC1CC2(C1)C[C@H]2C(=O)Nc1sc(C)c(-c2ccccc2)c1C(N)=O	ZINC000875113223	GH	On-Demand	Anodyne	TIMP3	73	35
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(S(=O)(=O)N(C)C)cc2)C1	ZINC000875113229	GD	On-Demand	Anodyne	CCR5	19	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(S(=O)(=O)N(C)C)cc2)C1	ZINC000875113229	GD	On-Demand	Anodyne	NAMPT	30	41
CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875113234	GE	On-Demand	Anodyne	CCR3	53	38
CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875113234	GE	On-Demand	Anodyne	EPHX2	21	41
CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875113234	GE	On-Demand	Anodyne	BIRC2	41	37
COCCN1CCC(NC(=O)C(=O)NCc2ccc(C(C)(C)C)o2)CC1	ZINC000875113246	FD	On-Demand	Anodyne	HTR4	45	37
COCCN1CCC(NC(=O)C(=O)NCc2ccc(C(C)(C)C)o2)CC1	ZINC000875113246	FD	On-Demand	Anodyne	CACNA1I	45	40
CC(=O)C1CCN(C(=O)NCCc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875113258	GH	On-Demand	Anodyne	ADRB1	18	43
CC(=O)C1CCN(C(=O)NCCc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875113258	GH	On-Demand	Anodyne	ALOX5	15	43
CC(=O)C1CCN(C(=O)NCCc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875113258	GH	On-Demand	Anodyne	MAOB	21	40
CC(=O)C1CCN(C(=O)NCCc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875113258	GH	On-Demand	Anodyne	GRIN2B	36	41
CC(=O)C1CCN(C(=O)NCCc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875113258	GH	On-Demand	Anodyne	ADRB3	15	43
CC(=O)C1CCN(C(=O)NCCc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875113258	GH	On-Demand	Anodyne	LTA4H	57	43
CC(=O)C1CCN(C(=O)NCCc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875113258	GH	On-Demand	Anodyne	HRH3	17	49
CC(=O)C1CCN(C(=O)NCCc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875113258	GH	On-Demand	Anodyne	SIGMAR1	18	44
CC(=O)C1CCN(C(=O)NCCc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875113258	GH	On-Demand	Anodyne	MMP13	18	44
CC(=O)C1CCN(C(=O)NCCc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875113258	GH	On-Demand	Anodyne	CACNA1B	28	40
CC(=O)C1CCN(C(=O)NCCc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875113258	GH	On-Demand	Anodyne	ADAM17	46	41
CC(=O)C1CCN(C(=O)NCCc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875113258	GH	On-Demand	Anodyne	MMP2	15	40
CC(=O)C1CCN(C(=O)NCCc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875113258	GH	On-Demand	Anodyne	FAAH	22	42
CC(=O)C1CCN(C(=O)NCCc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875113258	GH	On-Demand	Anodyne	SLC6A5	48	43
CC(=O)C1CCN(C(=O)NCCc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875113258	GH	On-Demand	Anodyne	EPHX2	30	50
CC(=O)C1CCN(C(=O)NCCc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875113258	GH	On-Demand	Anodyne	DPP7	20	44
CC(=O)C1CCN(C(=O)NCCc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875113258	GH	On-Demand	Anodyne	TAAR1	18	50
CC(=O)C1CCN(C(=O)NCCc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875113258	GH	On-Demand	Anodyne	FFAR1	44	46
CC(=O)C1CCN(C(=O)NCCc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875113258	GH	On-Demand	Anodyne	FFAR4	45	38
CO[C@@H]1CC[C@@H](C)N(C(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875113274	EE	On-Demand	Anodyne	DRD4	42	33
CO[C@@H]1CC[C@@H](C)N(C(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875113274	EE	On-Demand	Anodyne	MAPK14	22	46
CO[C@@H]1CC[C@@H](C)N(C(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875113274	EE	On-Demand	Anodyne	MCHR1	15	40
O=C1CCN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)CCCCCCN1	ZINC000875113280	GE	On-Demand	Anodyne	CHRM3	15	40
O=C1CCN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)CCCCCCN1	ZINC000875113280	GE	On-Demand	Anodyne	BDKRB1	26	42
CN(C)S(=O)(=O)c1ccc(CNC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875113304	GD	On-Demand	Clean	NAMPT	42	58
CN(C)S(=O)(=O)c1ccc(CNC(=O)NC2(C)CC(F)(F)C2)cc1	ZINC000875113308	FD	On-Demand	Anodyne	NAMPT	44	37
O=C(NCc1cccc(C(=O)NC2CC2)c1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875113312	GE	On-Demand	Anodyne	MAPK14	30	42
O=C(NCc1cccc(C(=O)NC2CC2)c1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875113312	GE	On-Demand	Anodyne	CCR2	46	36
O=C(NCc1cccc(C(=O)NC2CC2)c1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875113313	GE	On-Demand	Anodyne	MAPK14	30	42
O=C(NCc1cccc(C(=O)NC2CC2)c1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875113313	GE	On-Demand	Anodyne	CCR2	46	36
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875113317	ED	On-Demand	Anodyne	MAPK14	24	43
O=C(NCc1cccc(C(=O)NC2CC2)c1)NC1CC(Nc2ccccc2)C1	ZINC000875113319	GG	On-Demand	Anodyne	DRD4	16	41
O=C(NCc1cccc(C(=O)NC2CC2)c1)NC1CC(Nc2ccccc2)C1	ZINC000875113319	GG	On-Demand	Anodyne	MAPK14	15	45
O=C(NCc1cccc(C(=O)NC2CC2)c1)NC1CC(Nc2ccccc2)C1	ZINC000875113319	GG	On-Demand	Anodyne	EPHX2	30	44
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)NCc1nnc2n1CCCC2	ZINC000875113327	GH	On-Demand	Anodyne	MDM2	109	34
CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)NC2(C)CC(F)(F)C2)c1	ZINC000875113342	FH	On-Demand	Anodyne	ANPEP	15	42
O=C1OC[C@H]2CN(C(=O)NCCc3ccc(OCc4ccccc4)cc3)C[C@@H]12	ZINC000875113363	GF	On-Demand	Anodyne	NAAA	19	48
O=C1OC[C@H]2CN(C(=O)NCCc3ccc(OCc4ccccc4)cc3)C[C@@H]12	ZINC000875113363	GF	On-Demand	Anodyne	FFAR1	28	42
Cn1nnnc1C1CCN(C(=O)N[C@@H](c2ccc(F)cc2)C2CCCC2)CC1	ZINC000875113366	GG	On-Demand	Anodyne	CCR3	52	33
Cn1nnnc1C1CCN(C(=O)N[C@H](c2ccc(F)cc2)C2CCCC2)CC1	ZINC000875113368	GG	On-Demand	Anodyne	CCR3	52	33
COc1ccccc1N(Cc1ccccc1)S(=O)(=O)c1cc(C(=O)N(C)C(C)C)ccc1Cl	ZINC000875113369	JK	On-Demand	Anodyne	LIMK2	25	41
O=C(NCCOC(F)(F)C(F)(F)F)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875113377	GF	On-Demand	Anodyne	DRD4	15	41
O=C(NCCOC(F)(F)C(F)(F)F)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875113377	GF	On-Demand	Anodyne	MAPK14	18	44
O=C(NCCOC(F)(F)C(F)(F)F)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875113377	GF	On-Demand	Anodyne	CCR2	52	38
CN1CCN(C2CCN(C(=O)NCc3cccc(C(=O)NC4CC4)c3)CC2)CC1	ZINC000875113378	GD	On-Demand	Anodyne	MAPK14	27	43
CN1CCN(C2CCN(C(=O)NCc3cccc(C(=O)NC4CC4)c3)CC2)CC1	ZINC000875113378	GD	On-Demand	Anodyne	SLC6A5	33	42
CN1CCN(C2CCN(C(=O)NCc3cccc(C(=O)NC4CC4)c3)CC2)CC1	ZINC000875113378	GD	On-Demand	Anodyne	L3MBTL3	77	41
CONC(=O)C1CCN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000875113410	FD	On-Demand	Anodyne	PLG	17	40
CONC(=O)C1CCN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000875113410	FD	On-Demand	Anodyne	DRD4	41	32
CONC(=O)C1CCN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000875113410	FD	On-Demand	Anodyne	MAPK14	22	48
CONC(=O)C1CCN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000875113410	FD	On-Demand	Anodyne	EPHX2	34	45
CONC(=O)C1CCN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000875113410	FD	On-Demand	Anodyne	ST14	44	40
CONC(=O)C1CCN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000875113410	FD	On-Demand	Anodyne	MCHR1	15	41
O=C(NCc1cccc(C(=O)NC2CC2)c1)NCc1ncc(Cl)s1	ZINC000875113414	FF	On-Demand	Anodyne	MAPK14	38	42
C=CCN(c1cccc(C(F)(F)F)c1)S(=O)(=O)c1ccc(Cl)c(C(=O)N(C)C(C)C)c1	ZINC000875113421	JK	On-Demand	Mild	CACNA1B	48	36
O=CN1CCCN(C(=O)NCCc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875113425	GF	On-Demand	Anodyne	ADRB1	36	42
O=CN1CCCN(C(=O)NCCc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875113425	GF	On-Demand	Anodyne	ADRB3	31	42
O=CN1CCCN(C(=O)NCCc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875113425	GF	On-Demand	Anodyne	LTA4H	38	41
O=CN1CCCN(C(=O)NCCc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875113425	GF	On-Demand	Anodyne	FAAH	16	44
O=CN1CCCN(C(=O)NCCc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875113425	GF	On-Demand	Anodyne	SLC6A5	45	38
O=CN1CCCN(C(=O)NCCc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875113425	GF	On-Demand	Anodyne	DPP7	22	48
O=CN1CCCN(C(=O)NCCc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875113425	GF	On-Demand	Anodyne	TAAR1	16	47
O=CN1CCCN(C(=O)NCCc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875113425	GF	On-Demand	Anodyne	FFAR1	33	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(Cl)ccc1OC	ZINC000875113429	FF	On-Demand	Anodyne	SLC6A2	17	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(Cl)ccc1OC	ZINC000875113429	FF	On-Demand	Anodyne	SLC6A4	38	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(Cl)ccc1OC	ZINC000875113429	FF	On-Demand	Anodyne	SLC6A3	59	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(Cl)ccc1OC	ZINC000875113431	FF	On-Demand	Anodyne	SLC6A2	17	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(Cl)ccc1OC	ZINC000875113431	FF	On-Demand	Anodyne	SLC6A4	38	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(Cl)ccc1OC	ZINC000875113431	FF	On-Demand	Anodyne	SLC6A3	59	42
O=C(NCc1cccc(C(=O)NC2CC2)c1)NCc1ccnc(F)c1	ZINC000875113435	EE	On-Demand	Anodyne	MAPK14	42	43
O=C(NCc1cccc(C(=O)NC2CC2)c1)NCc1ccnc(F)c1	ZINC000875113435	EE	On-Demand	Anodyne	MAPK13	67	33
O=C(NCc1cccc(C(=O)NC2CC2)c1)NCc1ccnc(F)c1	ZINC000875113435	EE	On-Demand	Anodyne	KDM4E	31	40
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3cccc(C(=O)NC4CC4)c3)C[C@@H]1C2	ZINC000875113451	FD	On-Demand	Anodyne	MAPK14	15	46
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3cccc(C(=O)NC4CC4)c3)C[C@@H]1C2	ZINC000875113451	FD	On-Demand	Anodyne	EPHX2	23	41
O=C(NCCOc1ccc2c(c1)OCO2)N1Cc2cccc(O)c2C1	ZINC000875113459	EE	On-Demand	Clean	BMP1	56	34
O=C(NCc1cccc(C(=O)NC2CC2)c1)NCc1noc2cc(F)ccc12	ZINC000875113465	GF	On-Demand	Anodyne	MAPK14	34	40
O=C(NCc1cccc(C(=O)NC2CC2)c1)NCc1noc2cc(F)ccc12	ZINC000875113465	GF	On-Demand	Anodyne	MCHR1	18	42
CN(C)S(=O)(=O)c1ccc(CNC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875113473	FC	On-Demand	Anodyne	NAMPT	40	46
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(NC(=O)[C@H](C)CC)c1	ZINC000875113481	EG	On-Demand	Anodyne	ANPEP	39	47
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(NC(=O)[C@H](C)CC)c1	ZINC000875113481	EG	On-Demand	Anodyne	CAPN2	42	34
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(NC(=O)[C@H](C)CC)c1	ZINC000875113481	EG	On-Demand	Anodyne	PDS	47	32
CN(C)S(=O)(=O)c1ccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875113482	FD	On-Demand	Anodyne	NPY2R	24	48
CN(C)S(=O)(=O)c1ccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875113482	FD	On-Demand	Anodyne	NAMPT	44	45
CN(C)S(=O)(=O)c1ccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875113484	FD	On-Demand	Anodyne	NPY2R	24	48
CN(C)S(=O)(=O)c1ccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875113484	FD	On-Demand	Anodyne	NAMPT	44	45
CC(=O)C1CCN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000875113493	EE	On-Demand	Anodyne	CHRM3	15	42
CC(=O)C1CCN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000875113493	EE	On-Demand	Anodyne	MAPK14	32	47
CC(=O)C1CCN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000875113493	EE	On-Demand	Anodyne	MAPK13	56	32
CC(=O)C1CCN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000875113493	EE	On-Demand	Anodyne	EPHX2	35	40
CC(=O)C1CCN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000875113493	EE	On-Demand	Anodyne	MCHR1	15	40
CCOC(=O)C1=CC[C@H](NC(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875113508	FE	On-Demand	Anodyne	MAPK14	24	45
CCOC(=O)C1=CC[C@H](NC(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875113508	FE	On-Demand	Anodyne	EPHX2	17	52
CCOC(=O)C1=CC[C@@H](NC(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875113510	FE	On-Demand	Anodyne	MAPK14	24	45
CCOC(=O)C1=CC[C@@H](NC(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875113510	FE	On-Demand	Anodyne	EPHX2	17	52
C[C@@H](Cc1ccsc1)NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875113516	GD	On-Demand	Anodyne	L3MBTL3	77	42
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N(C)C(C)C)c2c1	ZINC000875113518	DJ	On-Demand	Anodyne	DHODH	27	48
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N(C)C(C)C)c2c1	ZINC000875113518	DJ	On-Demand	Anodyne	TSPO	27	52
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N(C)C(C)C)c2c1	ZINC000875113518	DJ	On-Demand	Anodyne	PRS	64	42
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N(C)C(C)C)c2c1	ZINC000875113518	DJ	On-Demand	Anodyne	TACR3	23	46
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N(C)C(C)C)c2c1	ZINC000875113518	DJ	On-Demand	Anodyne	MT-CO2	59	44
CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)NN(C)C(=O)OC)c1	ZINC000875113519	EE	On-Demand	Reactive	ANPEP	19	42
CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)NN(C)C(=O)OC)c1	ZINC000875113519	EE	On-Demand	Reactive	PDS	41	33
O=C(NC[C@H]1CC=CCC1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875113527	EF	On-Demand	Anodyne	OXTR	51	36
O=C(NC[C@@H]1CC=CCC1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875113528	EF	On-Demand	Anodyne	OXTR	51	36
O=C(NC[C@@H]1CC=CCC1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875113529	EF	On-Demand	Anodyne	OXTR	51	36
O=C(NC[C@H]1CC=CCC1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875113530	EF	On-Demand	Anodyne	OXTR	51	36
O=C(NC[C@H]1C[C@H](O)C1)N[C@H](COc1ccccc1F)c1ccccc1	ZINC000875113532	FG	On-Demand	Anodyne	MAN1B1	47	43
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H](COc1ccccc1F)c1ccccc1	ZINC000875113533	FG	On-Demand	Anodyne	MAN1B1	47	43
CC(=O)C1CCN(C(=O)N[C@@H](COc2ccccc2F)c2ccccc2)CC1	ZINC000875113534	GH	On-Demand	Anodyne	CCR5	22	41
CC(=O)C1CCN(C(=O)N[C@H](COc2ccccc2F)c2ccccc2)CC1	ZINC000875113540	GH	On-Demand	Anodyne	CCR5	22	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCCOc2ccc3c(c2)OCO3)C1	ZINC000875113557	FD	On-Demand	Anodyne	EDNRB	65	39
CCOC(=O)[C@H](C)C1CN(C(=O)NCCOc2ccc3c(c2)OCO3)C1	ZINC000875113557	FD	On-Demand	Anodyne	EDNRA	65	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCCOc2ccc3c(c2)OCO3)C1	ZINC000875113557	FD	On-Demand	Anodyne	BMP1	64	39
CCOC(=O)[C@H](C)C1CN(C(=O)NCCOc2ccc3c(c2)OCO3)C1	ZINC000875113557	FD	On-Demand	Anodyne	NOS2	42	34
COC(=O)N(C)NC(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875113562	DC	On-Demand	Reactive	PLG	15	41
COC(=O)N(C)NC(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875113562	DC	On-Demand	Reactive	MAPK14	30	49
COC(=O)N(C)NC(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875113562	DC	On-Demand	Reactive	ROCK2	20	43
COC(=O)N(C)NC(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875113562	DC	On-Demand	Reactive	ST14	15	41
COC(=O)N(C)NC(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875113562	DC	On-Demand	Reactive	MCHR1	17	42
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000875113566	FF	On-Demand	Anodyne	EPHX2	54	52
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000875113567	FF	On-Demand	Anodyne	EPHX2	54	52
C[C@]1(C(F)(F)F)CN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)CCO1	ZINC000875113576	GE	On-Demand	Anodyne	CCR2	54	37
COCCN1CCC(NC(=O)C(=O)N[C@H](C)c2cc3cnccc3o2)CC1	ZINC000875113591	FD	On-Demand	Anodyne	HTR4	43	37
COCCN1CCC(NC(=O)C(=O)N[C@H](C)c2cc3cnccc3o2)CC1	ZINC000875113591	FD	On-Demand	Anodyne	SSTR5	50	36
COCCN1CCC(NC(=O)C(=O)N[C@H](C)c2cc3cnccc3o2)CC1	ZINC000875113591	FD	On-Demand	Anodyne	PDK1	42	37
COCCN1CCC(NC(=O)C(=O)N[C@@H](C)c2cc3cnccc3o2)CC1	ZINC000875113592	FD	On-Demand	Anodyne	HTR4	43	37
COCCN1CCC(NC(=O)C(=O)N[C@@H](C)c2cc3cnccc3o2)CC1	ZINC000875113592	FD	On-Demand	Anodyne	SSTR5	50	36
COCCN1CCC(NC(=O)C(=O)N[C@@H](C)c2cc3cnccc3o2)CC1	ZINC000875113592	FD	On-Demand	Anodyne	PDK1	42	37
C=CCc1ccc(OC(=O)c2ccc(N3CCCC3=O)cc2)c(OC)c1	ZINC000875113611	FH	On-Demand	Mild	ACR	18	57
O=C(NCC[C@@H]1CCCS1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875113619	EF	On-Demand	Anodyne	MAPK14	15	41
O=C(NCC[C@H]1CCCS1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875113620	EF	On-Demand	Anodyne	MAPK14	15	41
O=C(NC1CC1)c1cccc(CNC(=O)N2C[C@H]3CC=CC[C@H]3C2)c1	ZINC000875113629	EF	On-Demand	Anodyne	DRD4	18	44
O=C(NC1CC1)c1cccc(CNC(=O)N2C[C@H]3CC=CC[C@H]3C2)c1	ZINC000875113629	EF	On-Demand	Anodyne	MAPK14	22	43
CN(C)S(=O)(=O)c1ccc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875113630	GD	On-Demand	Anodyne	NAMPT	46	44
CN(C)S(=O)(=O)c1ccc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875113631	GD	On-Demand	Anodyne	NAMPT	46	44
O=C(NCc1cccc(C(=O)NC2CC2)c1)N[C@H]1CC12CCC2	ZINC000875113636	DE	On-Demand	Anodyne	MAPK14	17	43
O=C(NCc1cccc(C(=O)NC2CC2)c1)N[C@@H]1CC12CCC2	ZINC000875113638	DE	On-Demand	Anodyne	MAPK14	17	43
COCC1CC(NC(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875113640	ED	On-Demand	Anodyne	PLG	16	43
COCC1CC(NC(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875113640	ED	On-Demand	Anodyne	MAPK11	26	40
COCC1CC(NC(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875113640	ED	On-Demand	Anodyne	MAPK14	29	49
COCC1CC(NC(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875113640	ED	On-Demand	Anodyne	ROCK2	17	45
COCC1CC(NC(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875113640	ED	On-Demand	Anodyne	EPHX2	27	41
COCC1CC(NC(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875113640	ED	On-Demand	Anodyne	ST14	17	43
O=C(NCc1nnc2n1CCCC2)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875113646	FD	On-Demand	Anodyne	DPP7	23	41
O=C(NCc1nnc2n1CCCC2)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875113648	FD	On-Demand	Anodyne	DPP7	23	41
CN1CC[C@H]2CN(C(=O)NCc3cccc(C(=O)NC4CC4)c3)CC[C@H]21	ZINC000875113649	FD	On-Demand	Anodyne	DRD4	40	31
CN1CC[C@H]2CN(C(=O)NCc3cccc(C(=O)NC4CC4)c3)CC[C@H]21	ZINC000875113649	FD	On-Demand	Anodyne	MAPK14	26	42
CN1CC[C@H]2CN(C(=O)NCc3cccc(C(=O)NC4CC4)c3)CC[C@@H]21	ZINC000875113653	FD	On-Demand	Anodyne	DRD4	40	31
CN1CC[C@H]2CN(C(=O)NCc3cccc(C(=O)NC4CC4)c3)CC[C@@H]21	ZINC000875113653	FD	On-Demand	Anodyne	MAPK14	26	42
CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)NC2CC(C(=O)OC)C2)c1	ZINC000875113654	FE	On-Demand	Anodyne	ANPEP	15	41
CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)NC2CC(C(=O)OC)C2)c1	ZINC000875113654	FE	On-Demand	Anodyne	TIMP3	53	32
CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)N(C)OCC(F)(F)F)c1	ZINC000875113659	FG	On-Demand	Anodyne	CARM1	43	35
CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)N(C)OCC(F)(F)F)c1	ZINC000875113659	FG	On-Demand	Anodyne	PDS	53	36
O=C(NC1CC1)c1cccc(CNC(=O)N2C[C@@H]3C[C@H]2CN3c2ccccc2)c1	ZINC000875113661	GF	On-Demand	Anodyne	DRD4	20	45
COCCN(CC1CCN(C)CC1)C(=O)NCCOc1ccc2c(c1)OCO2	ZINC000875113665	GD	On-Demand	Anodyne	EDNRB	56	38
COCCN(CC1CCN(C)CC1)C(=O)NCCOc1ccc2c(c1)OCO2	ZINC000875113665	GD	On-Demand	Anodyne	EDNRA	53	39
COCCN(CC1CCN(C)CC1)C(=O)NCCOc1ccc2c(c1)OCO2	ZINC000875113665	GD	On-Demand	Anodyne	CHRNA10	16	47
COCCN(CC1CCN(C)CC1)C(=O)NCCOc1ccc2c(c1)OCO2	ZINC000875113665	GD	On-Demand	Anodyne	MCHR1	19	42
O=C(NCc1cccc(C(=O)NC2CC2)c1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875113667	GG	On-Demand	Anodyne	MAPK14	15	41
O=C(NCc1cccc(C(=O)NC2CC2)c1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875113667	GG	On-Demand	Anodyne	CCR2	41	38
CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875113668	FF	On-Demand	Anodyne	ST14	78	35
CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875113674	FF	On-Demand	Anodyne	ST14	78	35
C[C@@H](Cc1ccsc1)NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875113705	GG	On-Demand	Anodyne	C3AR1	38	46
C[C@@H](Cc1ccsc1)NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875113707	GG	On-Demand	Anodyne	C3AR1	38	46
COCCN1CCC(NC(=O)C(=O)N2CCc3ccc(Cl)c(C)c3C2)CC1	ZINC000875113708	GD	On-Demand	Anodyne	HTR4	41	40
Cc1nccnc1[C@@H](C)NC(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875113715	FE	On-Demand	Anodyne	MAPK14	40	44
Cc1nccnc1[C@@H](C)NC(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875113715	FE	On-Demand	Anodyne	MAPK13	47	34
Cc1nccnc1[C@@H](C)NC(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875113715	FE	On-Demand	Anodyne	ROCK2	18	40
Cc1nccnc1[C@H](C)NC(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875113717	FE	On-Demand	Anodyne	MAPK14	40	44
Cc1nccnc1[C@H](C)NC(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875113717	FE	On-Demand	Anodyne	MAPK13	47	34
Cc1nccnc1[C@H](C)NC(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875113717	FE	On-Demand	Anodyne	ROCK2	18	40
CC(=O)C1CCN(C(=O)C(=O)NCc2ccccc2OCC(F)(F)F)CC1	ZINC000875113740	GE	On-Demand	Anodyne	EPHX2	21	43
CC(C)(C)OC(=O)C1CC(NC(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875113742	GE	On-Demand	Anodyne	MAPK14	23	45
CC(C)(C)OC(=O)C1CC(NC(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875113742	GE	On-Demand	Anodyne	EPHX2	23	40
CC(C)c1ccc(OCCNC(=O)N2CCC(C(=O)NCCO)CC2)cc1	ZINC000875113745	GD	On-Demand	Anodyne	EPHX2	15	47
C=CCc1ccc(OC(=O)[C@H](C)NC(=O)c2ccccc2)c(OC)c1	ZINC000875113751	EG	On-Demand	Mild	PRSS1	20	52
C=CCc1ccc(OC(=O)[C@@H](C)NC(=O)c2ccccc2)c(OC)c1	ZINC000875113753	EG	On-Demand	Mild	PRSS1	20	52
COCCN1CCC(NC(=O)C(=O)NCCCCC2CC2)CC1	ZINC000875113754	EC	On-Demand	Anodyne	DRD2	24	41
COCCN1CCC(NC(=O)C(=O)NCCCCC2CC2)CC1	ZINC000875113754	EC	On-Demand	Anodyne	DRD3	46	41
O=C(NCc1cccc(C(=O)NC2CC2)c1)NC[C@@H]1CC(=O)c2ccccc2O1	ZINC000875113755	GE	On-Demand	Anodyne	MAPK14	21	42
O=C(NCc1cccc(C(=O)NC2CC2)c1)NC[C@H]1CC(=O)c2ccccc2O1	ZINC000875113757	GE	On-Demand	Anodyne	MAPK14	21	42
COC(=O)N(C)NC(=O)NCCOc1ccc2c(c1)OCO2	ZINC000875113763	DC	On-Demand	Reactive	HRH2	18	43
COC(=O)N(C)NC(=O)NCCOc1ccc2c(c1)OCO2	ZINC000875113763	DC	On-Demand	Reactive	EDNRB	80	40
COC(=O)N(C)NC(=O)NCCOc1ccc2c(c1)OCO2	ZINC000875113763	DC	On-Demand	Reactive	EDNRA	77	41
COC(=O)N(C)NC(=O)NCCOc1ccc2c(c1)OCO2	ZINC000875113763	DC	On-Demand	Reactive	BMP1	59	37
COC(=O)N(C)NC(=O)NCCOc1ccc2c(c1)OCO2	ZINC000875113763	DC	On-Demand	Reactive	MTNR1A	44	38
CCn1c(=O)c2ccccc2n(CC(=O)OCC[C@@H]2CCCCN2C)c1=O	ZINC000875113764	FD	On-Demand	Anodyne	CHRNA10	40	35
CCn1c(=O)c2ccccc2n(CC(=O)OCC[C@@H]2CCCCN2C)c1=O	ZINC000875113764	FD	On-Demand	Anodyne	Q7YY07_CRYPV	47	31
CCn1c(=O)c2ccccc2n(CC(=O)OCC[C@@H]2CCCCN2C)c1=O	ZINC000875113764	FD	On-Demand	Anodyne	ACKR3	59	35
CCn1c(=O)c2ccccc2n(CC(=O)OCC[C@H]2CCCCN2C)c1=O	ZINC000875113766	FD	On-Demand	Anodyne	CHRNA10	40	35
CCn1c(=O)c2ccccc2n(CC(=O)OCC[C@H]2CCCCN2C)c1=O	ZINC000875113766	FD	On-Demand	Anodyne	Q7YY07_CRYPV	47	31
CCn1c(=O)c2ccccc2n(CC(=O)OCC[C@H]2CCCCN2C)c1=O	ZINC000875113766	FD	On-Demand	Anodyne	ACKR3	59	35
CN(C)[C@@H]1CN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)C[C@@H]1n1ccnn1	ZINC000875113769	GC	On-Demand	Anodyne	MAPK13	66	31
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000875113787	GD	On-Demand	Anodyne	NAMPT	76	52
COCCN1CCC(NC(=O)C(=O)N2CCC[C@@H]2c2cncc(C)c2)CC1	ZINC000875113793	FD	On-Demand	Anodyne	SSTR5	43	44
O=C1CCN(C(=O)NCCOc2ccc3c(c2)OCO3)CCCCCCN1	ZINC000875113794	GD	On-Demand	Anodyne	HRH2	24	46
O=C1CCN(C(=O)NCCOc2ccc3c(c2)OCO3)CCCCCCN1	ZINC000875113794	GD	On-Demand	Anodyne	BMP1	43	33
COCCN1CCC(NC(=O)C(=O)N2CCC[C@H]2c2cncc(C)c2)CC1	ZINC000875113795	FD	On-Demand	Anodyne	SSTR5	43	44
C[C@H]1C[C@H](NC(=O)OC(C)(C)C)CN1C(=O)C(=O)N[C@H](C)Cc1ccsc1	ZINC000875113798	GE	On-Demand	Anodyne	PAPA1_CARPA	29	46
C[C@H]1C[C@H](NC(=O)OC(C)(C)C)CN1C(=O)C(=O)N[C@H](C)Cc1ccsc1	ZINC000875113798	GE	On-Demand	Anodyne	FPR1	45	34
O=C(NC1CC1)c1cccc(CNC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)c1	ZINC000875113818	FE	On-Demand	Anodyne	PLAU	15	41
O=C(NC1CC1)c1cccc(CNC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)c1	ZINC000875113818	FE	On-Demand	Anodyne	ST14	24	41
O=C(NCCC[C@H]1CCOC1=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875113821	FD	On-Demand	Anodyne	LUXR	53	35
O=C(NCCC[C@@H]1CCOC1=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875113822	FD	On-Demand	Anodyne	LUXR	53	35
CCCCCCCNC(=O)C(=O)NCc1cccnc1-n1ccnc1C	ZINC000875113825	FE	On-Demand	Mild	ASAH1	89	40
COCCN1CCC(NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)CC1	ZINC000875113827	EC	On-Demand	Anodyne	HTR4	32	40
Cc1cncc([C@@H]2CCCN2C(=O)NCc2cccc(C(=O)NC3CC3)c2)c1	ZINC000875113828	GG	On-Demand	Anodyne	DRD4	18	40
Cc1cncc([C@@H]2CCCN2C(=O)NCc2cccc(C(=O)NC3CC3)c2)c1	ZINC000875113828	GG	On-Demand	Anodyne	MAPK14	41	41
Cc1cncc([C@@H]2CCCN2C(=O)NCc2cccc(C(=O)NC3CC3)c2)c1	ZINC000875113828	GG	On-Demand	Anodyne	SSTR5	45	45
Cc1cncc([C@@H]2CCCN2C(=O)NCc2cccc(C(=O)NC3CC3)c2)c1	ZINC000875113828	GG	On-Demand	Anodyne	PREP	43	39
Cc1cncc([C@@H]2CCCN2C(=O)NCc2cccc(C(=O)NC3CC3)c2)c1	ZINC000875113828	GG	On-Demand	Anodyne	MAPK13	42	33
COCCN1CCC(NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)CC1	ZINC000875113829	EC	On-Demand	Anodyne	HTR4	32	40
Cc1cncc([C@H]2CCCN2C(=O)NCc2cccc(C(=O)NC3CC3)c2)c1	ZINC000875113830	GG	On-Demand	Anodyne	DRD4	18	40
Cc1cncc([C@H]2CCCN2C(=O)NCc2cccc(C(=O)NC3CC3)c2)c1	ZINC000875113830	GG	On-Demand	Anodyne	MAPK14	41	41
Cc1cncc([C@H]2CCCN2C(=O)NCc2cccc(C(=O)NC3CC3)c2)c1	ZINC000875113830	GG	On-Demand	Anodyne	SSTR5	45	45
Cc1cncc([C@H]2CCCN2C(=O)NCc2cccc(C(=O)NC3CC3)c2)c1	ZINC000875113830	GG	On-Demand	Anodyne	PREP	43	39
Cc1cncc([C@H]2CCCN2C(=O)NCc2cccc(C(=O)NC3CC3)c2)c1	ZINC000875113830	GG	On-Demand	Anodyne	MAPK13	42	33
CC[C@@H](NC(=O)NCc1cccc(C(=O)NC2CC2)c1)[C@@H](O)c1ccccc1	ZINC000875113834	GF	On-Demand	Anodyne	MAPK14	15	42
CC[C@@H](NC(=O)NCc1cccc(C(=O)NC2CC2)c1)[C@@H](O)c1ccccc1	ZINC000875113834	GF	On-Demand	Anodyne	BACE2	24	40
CC[C@@H](NC(=O)NCc1cccc(C(=O)NC2CC2)c1)[C@H](O)c1ccccc1	ZINC000875113838	GF	On-Demand	Anodyne	MAPK14	15	42
CC[C@@H](NC(=O)NCc1cccc(C(=O)NC2CC2)c1)[C@H](O)c1ccccc1	ZINC000875113838	GF	On-Demand	Anodyne	BACE2	24	40
COCCN(CC1CCN(C)CC1)C(=O)NCCc1ccc(Cl)s1	ZINC000875113880	FF	On-Demand	Anodyne	CACNA1I	41	32
O=C(NC1CC1)c1cccc(CNC(=O)N2CCC3(CCNC3=O)CC2)c1	ZINC000875113890	FD	On-Demand	Anodyne	MAPK14	19	41
O=CN1CCCN(C(=O)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)CC1	ZINC000875113891	GC	On-Demand	Anodyne	TGM2	76	45
O=CN1CCCN(C(=O)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)CC1	ZINC000875113891	GC	On-Demand	Anodyne	F13A1	79	45
O=CN1CCCN(C(=O)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)CC1	ZINC000875113891	GC	On-Demand	Anodyne	NAMPT	84	52
CCOC1CC2(C1)C[C@@H]2NC(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875113914	FE	On-Demand	Anodyne	MAPK14	18	44
CCOC1CC2(C1)C[C@@H]2NC(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875113914	FE	On-Demand	Anodyne	EPHX2	16	41
O=C(NC1CC1)c1cccc(CNC(=O)N2C[C@@H]3[C@@H](C[C@H]3c3ccccc3)C2)c1	ZINC000875113916	GH	On-Demand	Anodyne	DRD4	23	44
CNC(=O)Cc1ccc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)cc1	ZINC000875113918	GH	On-Demand	Anodyne	NPR1	42	34
CNC(=O)Cc1ccc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)cc1	ZINC000875113918	GH	On-Demand	Anodyne	KCNK3	72	36
O=C(NCc1cccc(C(=O)NC2CC2)c1)NC[C@@H]1C[C@H]2CCC[C@H]2O1	ZINC000875113919	FE	On-Demand	Anodyne	MAPK14	17	41
O=C(NCc1cccc(C(=O)NC2CC2)c1)NC[C@@H]1C[C@@H]2CCC[C@H]2O1	ZINC000875113920	FE	On-Demand	Anodyne	MAPK14	17	41
COCCN1CCC(NC(=O)C(=O)NCc2ncc(Cl)s2)CC1	ZINC000875113941	FC	On-Demand	Anodyne	HTR4	55	39
CCn1c(=O)c2ccccc2n(CC(=O)OCc2nc(COc3ccc(F)cc3)no2)c1=O	ZINC000875113961	JE	On-Demand	Anodyne	ADORA2B	22	44
O=C(NCc1cccc(C(=O)NC2CC2)c1)NC[C@@H]1C[C@H]2CCC[C@@H]2O1	ZINC000875113965	FE	On-Demand	Anodyne	MAPK14	17	41
O=C(NCc1cccc(C(=O)NC2CC2)c1)NC[C@@H]1C[C@@H]2CCC[C@@H]2O1	ZINC000875113967	FE	On-Demand	Anodyne	MAPK14	17	41
CN1CCN(C(=O)NCc2ccc(S(=O)(=O)N(C)C)cc2)CCC1(C)C	ZINC000875113969	GD	On-Demand	Anodyne	NAMPT	35	43
CN(C)C[C@@H]1CN(C(=O)NCCOc2ccc3c(c2)OCO3)C[C@H]1CN(C)C	ZINC000875113981	GD	On-Demand	Anodyne	EDNRB	57	38
CN(C)C[C@@H]1CN(C(=O)NCCOc2ccc3c(c2)OCO3)C[C@H]1CN(C)C	ZINC000875113981	GD	On-Demand	Anodyne	EDNRA	55	39
CN(C)C[C@@H]1CN(C(=O)NCCOc2ccc3c(c2)OCO3)C[C@H]1CN(C)C	ZINC000875113981	GD	On-Demand	Anodyne	BMP1	58	35
CN(C)C[C@@H]1CN(C(=O)NCCOc2ccc3c(c2)OCO3)C[C@H]1CN(C)C	ZINC000875113981	GD	On-Demand	Anodyne	NOS2	47	31
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@@H]3CSC[C@@H]3C2)c1	ZINC000875114007	FE	On-Demand	Anodyne	DRD4	19	44
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@@H]3CSC[C@@H]3C2)c1	ZINC000875114007	FE	On-Demand	Anodyne	MAPK14	19	41
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@H]3CSC[C@@H]3C2)c1	ZINC000875114008	FE	On-Demand	Anodyne	DRD4	19	44
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@H]3CSC[C@@H]3C2)c1	ZINC000875114008	FE	On-Demand	Anodyne	MAPK14	19	41
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@@H]3CSC[C@H]3C2)c1	ZINC000875114009	FE	On-Demand	Anodyne	DRD4	19	44
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@@H]3CSC[C@H]3C2)c1	ZINC000875114009	FE	On-Demand	Anodyne	MAPK14	19	41
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@H]3CSC[C@H]3C2)c1	ZINC000875114011	FE	On-Demand	Anodyne	DRD4	19	44
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@H]3CSC[C@H]3C2)c1	ZINC000875114011	FE	On-Demand	Anodyne	MAPK14	19	41
COC(=O)[C@@]12C[C@@H](NC(=O)NCCOc3ccc4c(c3)OCO4)C[C@@H]1C2	ZINC000875114019	FD	On-Demand	Anodyne	BMP1	41	34
COCCN(CC1CCN(C)CC1)C(=O)NCc1cc(Cl)ccc1OC	ZINC000875114044	GF	On-Demand	Anodyne	AVPR1B	41	35
COCCN(CC1CCN(C)CC1)C(=O)NCc1cc(Cl)ccc1OC	ZINC000875114044	GF	On-Demand	Anodyne	CPT1A	61	40
COCCN(CC1CCN(C)CC1)C(=O)NCc1cc(Cl)ccc1OC	ZINC000875114044	GF	On-Demand	Anodyne	CPT2	40	33
COCCN(CC1CCN(C)CC1)C(=O)NCc1cc(Cl)ccc1OC	ZINC000875114044	GF	On-Demand	Anodyne	CPT1B	57	33
COCCN(CC1CCN(C)CC1)C(=O)NCc1cc(Cl)ccc1OC	ZINC000875114044	GF	On-Demand	Anodyne	CACNA1I	55	35
COCCN(CC1CCN(C)CC1)C(=O)NCc1cc(Cl)ccc1OC	ZINC000875114044	GF	On-Demand	Anodyne	ACKR3	64	32
CN1CCN(C(=O)NCCOc2ccc3c(c2)OCO3)CCC1(C)C	ZINC000875114046	ED	On-Demand	Anodyne	BMP1	49	37
O=C(NC1CC1)c1cccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875114064	GG	On-Demand	Anodyne	DRD4	20	41
O=C(NC1CC1)c1cccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875114065	GG	On-Demand	Anodyne	DRD4	20	41
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@@H]3CS(=O)(=O)C[C@@H]3C2)c1	ZINC000875114088	GD	On-Demand	Anodyne	DRD4	26	46
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@@H]3CS(=O)(=O)C[C@@H]3C2)c1	ZINC000875114088	GD	On-Demand	Anodyne	CHRM3	15	41
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@@H]3CS(=O)(=O)C[C@@H]3C2)c1	ZINC000875114088	GD	On-Demand	Anodyne	CCR3	15	40
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@@H]3CS(=O)(=O)C[C@@H]3C2)c1	ZINC000875114088	GD	On-Demand	Anodyne	CCR2	39	40
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@@H]3CS(=O)(=O)C[C@@H]3C2)c1	ZINC000875114088	GD	On-Demand	Anodyne	ST14	65	39
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@H]3CS(=O)(=O)C[C@@H]3C2)c1	ZINC000875114090	GD	On-Demand	Anodyne	DRD4	26	46
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@H]3CS(=O)(=O)C[C@@H]3C2)c1	ZINC000875114090	GD	On-Demand	Anodyne	CHRM3	15	41
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@H]3CS(=O)(=O)C[C@@H]3C2)c1	ZINC000875114090	GD	On-Demand	Anodyne	CCR3	15	40
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@H]3CS(=O)(=O)C[C@@H]3C2)c1	ZINC000875114090	GD	On-Demand	Anodyne	CCR2	39	40
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@H]3CS(=O)(=O)C[C@@H]3C2)c1	ZINC000875114090	GD	On-Demand	Anodyne	ST14	65	39
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@@H]3CS(=O)(=O)C[C@H]3C2)c1	ZINC000875114091	GD	On-Demand	Anodyne	DRD4	26	46
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@@H]3CS(=O)(=O)C[C@H]3C2)c1	ZINC000875114091	GD	On-Demand	Anodyne	CHRM3	15	41
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@@H]3CS(=O)(=O)C[C@H]3C2)c1	ZINC000875114091	GD	On-Demand	Anodyne	CCR3	15	40
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@@H]3CS(=O)(=O)C[C@H]3C2)c1	ZINC000875114091	GD	On-Demand	Anodyne	CCR2	39	40
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@@H]3CS(=O)(=O)C[C@H]3C2)c1	ZINC000875114091	GD	On-Demand	Anodyne	ST14	65	39
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@H]3CS(=O)(=O)C[C@H]3C2)c1	ZINC000875114092	GD	On-Demand	Anodyne	DRD4	26	46
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@H]3CS(=O)(=O)C[C@H]3C2)c1	ZINC000875114092	GD	On-Demand	Anodyne	CHRM3	15	41
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@H]3CS(=O)(=O)C[C@H]3C2)c1	ZINC000875114092	GD	On-Demand	Anodyne	CCR3	15	40
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@H]3CS(=O)(=O)C[C@H]3C2)c1	ZINC000875114092	GD	On-Demand	Anodyne	CCR2	39	40
O=C(NC1CC1)c1cccc(CNC(=O)N2CC[C@H]3CS(=O)(=O)C[C@H]3C2)c1	ZINC000875114092	GD	On-Demand	Anodyne	ST14	65	39
O=CN1CCCN(C(=O)NCCOc2ccc3c(c2)OCO3)CC1	ZINC000875114097	EC	On-Demand	Anodyne	HRH2	18	42
O=CN1CCCN(C(=O)NCCOc2ccc3c(c2)OCO3)CC1	ZINC000875114097	EC	On-Demand	Anodyne	BMP1	44	35
O=CN1CCCN(C(=O)NCCOc2ccc3c(c2)OCO3)CC1	ZINC000875114097	EC	On-Demand	Anodyne	NOS2	57	34
CCC1(CC)CCCN1C(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875114098	EG	On-Demand	Anodyne	DRD4	22	42
CCC1(CC)CCCN1C(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875114098	EG	On-Demand	Anodyne	CHRM3	17	41
CCC1(CC)CCCN1C(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875114098	EG	On-Demand	Anodyne	MAPK14	29	43
CCC1(CC)CCCN1C(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875114098	EG	On-Demand	Anodyne	SSTR5	40	38
CCC1(CC)CCCN1C(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875114098	EG	On-Demand	Anodyne	MCHR1	17	40
O=C(NC1CC1)c1cccc(CNC(=O)N2CC(CNC(=O)C(F)(F)F)C2)c1	ZINC000875114107	GD	On-Demand	Anodyne	DRD4	17	40
O=C(NC1CC1)c1cccc(CNC(=O)N2CC(CNC(=O)C(F)(F)F)C2)c1	ZINC000875114107	GD	On-Demand	Anodyne	MAPK14	17	40
O=C(NC1CC1)c1cccc(CNC(=O)N2CC(CNC(=O)C(F)(F)F)C2)c1	ZINC000875114107	GD	On-Demand	Anodyne	CCR2	49	39
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)C1	ZINC000875114118	FG	On-Demand	Anodyne	EPHX2	52	44
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)C1	ZINC000875114119	FG	On-Demand	Anodyne	EPHX2	52	44
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)C1	ZINC000875114120	FG	On-Demand	Anodyne	EPHX2	52	44
CCn1c(=O)c2ccccc2n(CC(=O)O[C@H](C)C(=O)N2c3ccccc3CC[C@@H]2C)c1=O	ZINC000875114185	IE	On-Demand	Anodyne	TPP2	52	33
CCn1c(=O)c2ccccc2n(CC(=O)O[C@H](C)C(=O)N2c3ccccc3CC[C@H]2C)c1=O	ZINC000875114186	IE	On-Demand	Anodyne	TPP2	52	33
CCn1c(=O)c2ccccc2n(CC(=O)O[C@@H](C)C(=O)N2c3ccccc3CC[C@@H]2C)c1=O	ZINC000875114187	IE	On-Demand	Anodyne	TPP2	52	33
CCn1c(=O)c2ccccc2n(CC(=O)O[C@@H](C)C(=O)N2c3ccccc3CC[C@H]2C)c1=O	ZINC000875114188	IE	On-Demand	Anodyne	TPP2	52	33
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)C1	ZINC000875114221	FG	On-Demand	Anodyne	EPHX2	52	44
O=C(NCCOc1ccc2c(c1)OCO2)N1CCC[C@H](OC2CCC2)CC1	ZINC000875114228	GF	On-Demand	Anodyne	NOS2	42	35
O=C(NCCOc1ccc2c(c1)OCO2)N1CCC[C@H](OC2CCC2)CC1	ZINC000875114228	GF	On-Demand	Anodyne	EPHX2	15	40
O=C(NCCOc1ccc2c(c1)OCO2)N1CCC[C@H](OC2CCC2)CC1	ZINC000875114228	GF	On-Demand	Anodyne	MCHR1	17	42
O=C(NCCOc1ccc2c(c1)OCO2)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875114229	GF	On-Demand	Anodyne	NOS2	42	35
O=C(NCCOc1ccc2c(c1)OCO2)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875114229	GF	On-Demand	Anodyne	EPHX2	15	40
O=C(NCCOc1ccc2c(c1)OCO2)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875114229	GF	On-Demand	Anodyne	MCHR1	17	42
O=C(NCCSCCC(F)(F)F)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875114235	GG	On-Demand	Anodyne	MAPK14	18	41
C[C@@H](NC(=O)N1CC[C@@](C)(C(F)(F)F)C1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000875114239	GI	On-Demand	Anodyne	EPHX2	77	48
C[C@@H](NC(=O)N1CC[C@](C)(C(F)(F)F)C1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000875114241	GI	On-Demand	Anodyne	EPHX2	77	48
O=C(NCc1cccc(C(=O)NC2CC2)c1)NCc1ccc(O)c(Cl)c1	ZINC000875114271	FF	On-Demand	Anodyne	MAPK14	27	44
O=C(NCc1cccc(C(=O)NC2CC2)c1)NCc1ccc(O)c(Cl)c1	ZINC000875114271	FF	On-Demand	Anodyne	SSTR3	28	44
O=C(NCc1cccc(C(=O)NC2CC2)c1)NCc1ccc(O)c(Cl)c1	ZINC000875114271	FF	On-Demand	Anodyne	NCE103	16	51
O=C(NCc1cccc(C(=O)NC2CC2)c1)NCc1ccc(O)c(Cl)c1	ZINC000875114271	FF	On-Demand	Anodyne	ADCYAP1R1	56	34
CN1CCN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)CCC1(C)C	ZINC000875114273	FE	On-Demand	Anodyne	MAPK14	26	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875114288	FD	On-Demand	Anodyne	SLC6A3	42	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875114288	FD	On-Demand	Anodyne	MAPK14	24	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875114289	FD	On-Demand	Anodyne	SLC6A3	42	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875114289	FD	On-Demand	Anodyne	MAPK14	24	45
O=C(NCCCCC1CC1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875114291	EF	On-Demand	Anodyne	PLG	15	42
O=C(NCCCCC1CC1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875114291	EF	On-Demand	Anodyne	MAPK14	19	44
O=C(NCCCCC1CC1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000875114291	EF	On-Demand	Anodyne	ST14	24	42
C[C@]1(C(F)(F)F)CCN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875114296	FG	On-Demand	Anodyne	MAPK14	32	41
C[C@]1(C(F)(F)F)CCN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875114296	FG	On-Demand	Anodyne	MAPK13	43	32
C[C@]1(C(F)(F)F)CCN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875114296	FG	On-Demand	Anodyne	CCR2	64	39
C=CCc1ccc(OC(=O)c2cccc(NC(=O)CSc3nncn3C)c2)c(OC)c1	ZINC000875114298	IH	On-Demand	Mild	ACR	17	45
C=CCc1ccc(OC(=O)c2cccc(NC(=O)CSc3nncn3C)c2)c(OC)c1	ZINC000875114298	IH	On-Demand	Mild	ENPP1	78	38
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875114306	FD	On-Demand	Anodyne	DRD4	18	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875114306	FD	On-Demand	Anodyne	MAPK14	35	45
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875114306	FD	On-Demand	Anodyne	SSTR5	41	36
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000875114306	FD	On-Demand	Anodyne	MAPK13	64	33
CONC(=O)C1CCN(C(=O)N[C@@H](c2ccc(F)cc2)C2CCCC2)CC1	ZINC000875114308	GG	On-Demand	Anodyne	SLC6A3	21	45
CONC(=O)C1CCN(C(=O)N[C@H](c2ccc(F)cc2)C2CCCC2)CC1	ZINC000875114309	GG	On-Demand	Anodyne	SLC6A3	21	45
O=C(NCc1cccc(C(=O)NC2CC2)c1)NCc1noc2ccc(F)cc12	ZINC000875114314	GF	On-Demand	Anodyne	MAPK14	32	40
O=C(NCc1cccc(C(=O)NC2CC2)c1)NCc1noc2ccc(F)cc12	ZINC000875114314	GF	On-Demand	Anodyne	MCHR1	15	41
C#C[C@@H]1CC[C@@H](NC(=O)NCc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000875114320	EF	On-Demand	Mild	MAPK14	21	45
C#C[C@@H]1CC[C@@H](NC(=O)NCc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000875114320	EF	On-Demand	Mild	EPHX2	17	41
C#C[C@@H]1CC[C@@H](NC(=O)NCc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000875114320	EF	On-Demand	Mild	ST14	18	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCOc1ccc2c(c1)OCO2	ZINC000875114327	FD	On-Demand	Anodyne	SLC6A3	21	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCOc1ccc2c(c1)OCO2	ZINC000875114327	FD	On-Demand	Anodyne	EDNRB	62	36
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCOc1ccc2c(c1)OCO2	ZINC000875114327	FD	On-Demand	Anodyne	EDNRA	62	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCOc1ccc2c(c1)OCO2	ZINC000875114327	FD	On-Demand	Anodyne	BMP1	58	33
O=C(NCCOc1ccc2c(c1)OCO2)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875114331	GE	On-Demand	Anodyne	BMP1	44	34
O=C(NCCOc1ccc2c(c1)OCO2)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875114331	GE	On-Demand	Anodyne	NOS2	81	36
O=C(NCc1cccc(C(=O)NC2CC2)c1)N[C@H]1CCCC[C@H]1F	ZINC000875114338	EF	On-Demand	Anodyne	MAPK14	32	43
O=C(NCc1cccc(C(=O)NC2CC2)c1)N[C@H]1CCCC[C@H]1F	ZINC000875114338	EF	On-Demand	Anodyne	SSTR3	32	44
O=C(NCc1cccc(C(=O)NC2CC2)c1)N[C@H]1CCCC[C@H]1F	ZINC000875114338	EF	On-Demand	Anodyne	EPHX2	15	42
O=C(NCc1cccc(C(=O)NC2CC2)c1)N[C@H]1CCCC[C@H]1F	ZINC000875114338	EF	On-Demand	Anodyne	PLAU	15	42
O=C(NCc1cccc(C(=O)NC2CC2)c1)N[C@H]1CCCC[C@H]1F	ZINC000875114338	EF	On-Demand	Anodyne	ST14	21	42
O=C(NC1CC1)c1cccc(CNC(=O)N2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000875114339	GE	On-Demand	Anodyne	DRD4	16	40
O=C(NC1CC1)c1cccc(CNC(=O)N2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000875114339	GE	On-Demand	Anodyne	CCR2	46	38
O=C(NC1CC1)c1cccc(CNC(=O)N2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000875114341	GE	On-Demand	Anodyne	DRD4	16	40
O=C(NC1CC1)c1cccc(CNC(=O)N2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000875114341	GE	On-Demand	Anodyne	CCR2	46	38
COCCN1CCC(NC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875114343	GC	On-Demand	Anodyne	SLC6A3	21	42
COCCN1CCC(NC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875114343	GC	On-Demand	Anodyne	LTA4H	18	43
COCCN1CCC(NC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875114343	GC	On-Demand	Anodyne	CCR5	20	42
COCCN1CCC(NC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875114345	GC	On-Demand	Anodyne	SLC6A3	21	42
COCCN1CCC(NC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875114345	GC	On-Demand	Anodyne	LTA4H	18	43
COCCN1CCC(NC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875114345	GC	On-Demand	Anodyne	CCR5	20	42
COCCN1CCC(NC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875114347	GC	On-Demand	Anodyne	SLC6A3	21	42
COCCN1CCC(NC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875114347	GC	On-Demand	Anodyne	LTA4H	18	43
COCCN1CCC(NC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875114347	GC	On-Demand	Anodyne	CCR5	20	42
COCCN1CCC(NC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875114349	GC	On-Demand	Anodyne	SLC6A3	21	42
COCCN1CCC(NC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875114349	GC	On-Demand	Anodyne	LTA4H	18	43
COCCN1CCC(NC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875114349	GC	On-Demand	Anodyne	CCR5	20	42
O=C(NCCOc1ccc2c(c1)OCO2)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875114351	GE	On-Demand	Anodyne	MCHR1	16	40
COCCN1CCC(NC(=O)C(=O)NC2CCC(C)(N(C)C)CC2)CC1	ZINC000875114352	FC	On-Demand	Anodyne	HTR4	42	41
O=C(NCCOc1ccc2c(c1)OCO2)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875114353	GE	On-Demand	Anodyne	MCHR1	16	40
CC(=O)C1CCN(C(=O)N[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)CC1	ZINC000875114366	FG	On-Demand	Anodyne	EPHX2	52	54
CC(=O)C1CCN(C(=O)N[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)CC1	ZINC000875114368	FG	On-Demand	Anodyne	EPHX2	52	54
CCO[C@@H](C(=O)Nc1sc(C)c(-c2ccccc2)c1C(N)=O)C1CC1	ZINC000875114377	FH	On-Demand	Anodyne	TIMP3	71	32
COCCN1CCC(NC(=O)C(=O)NCc2cccc3ncccc23)CC1	ZINC000875114401	FD	On-Demand	Anodyne	HTR1A	44	37
COCCN1CCC(NC(=O)C(=O)NCc2cccc3ncccc23)CC1	ZINC000875114401	FD	On-Demand	Anodyne	HTR1D	40	36
COCCN1CCC(NC(=O)C(=O)NCc2cccc3ncccc23)CC1	ZINC000875114401	FD	On-Demand	Anodyne	HTR4	55	39
COCCN1CCC(NC(=O)C(=O)NCc2cccc3ncccc23)CC1	ZINC000875114401	FD	On-Demand	Anodyne	HTR7	41	38
COCCN1CCC(NC(=O)C(=O)NCc2cccc3ncccc23)CC1	ZINC000875114401	FD	On-Demand	Anodyne	HNMT	43	31
COCCN1CCC(NC(=O)C(=O)NCCC2CCN(C(C)C)CC2)CC1	ZINC000875114444	GC	On-Demand	Anodyne	HTR4	42	39
CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)N2CCCN(C=O)CC2)c1	ZINC000875114454	FE	On-Demand	Anodyne	P2RY14	44	35
O=C(NC[C@H]1CC=CCC1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875114476	FF	On-Demand	Anodyne	SMO	29	41
O=C(NC[C@H]1CC=CCC1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875114476	FF	On-Demand	Anodyne	ETHR	55	46
O=C(NC[C@@H]1CC=CCC1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875114477	FF	On-Demand	Anodyne	SMO	29	41
O=C(NC[C@@H]1CC=CCC1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875114477	FF	On-Demand	Anodyne	ETHR	55	46
CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)N2Cc3cccc(O)c3C2)c1	ZINC000875114479	FH	On-Demand	Clean	P2RY14	45	35
O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875114488	FD	On-Demand	Anodyne	TGM2	70	39
O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875114488	FD	On-Demand	Anodyne	F13A1	71	40
O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875114488	FD	On-Demand	Anodyne	NAMPT	93	58
C=CCc1ccc(OC(=O)c2cc(F)cc(F)c2)c(OC)c1	ZINC000875114499	DH	On-Demand	Mild	ACR	19	63
COCCN1CCC(NC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000875114525	GD	On-Demand	Anodyne	OXTR	51	36
COCCN1CCC(NC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000875114525	GD	On-Demand	Anodyne	SIGMAR1	26	41
COCCN1CCC(NC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000875114526	GD	On-Demand	Anodyne	OXTR	51	36
COCCN1CCC(NC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000875114526	GD	On-Demand	Anodyne	SIGMAR1	26	41
O=C(NCCc1ccc(OCc2ccccc2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875114528	FF	On-Demand	Anodyne	MAOB	19	40
O=C(NCCc1ccc(OCc2ccccc2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875114528	FF	On-Demand	Anodyne	GRIN2B	25	44
O=C(NCCc1ccc(OCc2ccccc2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875114528	FF	On-Demand	Anodyne	LTA4H	32	41
O=C(NCCc1ccc(OCc2ccccc2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875114528	FF	On-Demand	Anodyne	ADAM17	18	42
O=C(NCCc1ccc(OCc2ccccc2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875114528	FF	On-Demand	Anodyne	TAAR1	18	50
O=C(NCCc1ccc(OCc2ccccc2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875114528	FF	On-Demand	Anodyne	FFAR1	37	49
O=C(NCCc1ccc(OCc2ccccc2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875114528	FF	On-Demand	Anodyne	FFAR4	40	40
CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875114561	GG	On-Demand	Anodyne	ST14	49	35
CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875114563	GG	On-Demand	Anodyne	ST14	49	35
O=C(NC[C@@H]1CC=CCC1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875114567	EE	On-Demand	Anodyne	F2	15	42
O=C(NC[C@@H]1CC=CCC1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875114568	EE	On-Demand	Anodyne	F2	15	42
O=C(NC[C@@H]1CC=CCC1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875114569	EE	On-Demand	Anodyne	F2	15	42
O=C(NC[C@@H]1CC=CCC1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875114570	EE	On-Demand	Anodyne	F2	15	42
CCOC(=O)CCCCCCNC(=O)N1[C@H]2CC[C@H]1CC1(C2)CC1(F)F	ZINC000875114574	FH	On-Demand	Anodyne	EPHX2	19	48
COC(=O)C1(O)CN(C(=O)NCCOc2cccc(C(F)(F)F)c2)C1	ZINC000875114581	FD	On-Demand	Anodyne	HRH2	23	42
COC(=O)C1(O)CN(C(=O)NCCOc2cccc(C(F)(F)F)c2)C1	ZINC000875114581	FD	On-Demand	Anodyne	GALR3	67	33
COC(=O)C1(O)CN(C(=O)NCCOc2cccc(C(F)(F)F)c2)C1	ZINC000875114581	FD	On-Demand	Anodyne	PDS	47	44
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NCCc2ccc(F)cc2F)CC1	ZINC000875114583	FC	On-Demand	Anodyne	HTR2A	19	42
CN1CC[C@@H](C(=O)OCc2cnn(Cc3ccccc3)c2)[C@@H](c2cnn(C)c2)C1	ZINC000875114592	GE	On-Demand	Anodyne	SLC6A3	17	42
CN1CC[C@@H](C(=O)OCc2cnn(Cc3ccccc3)c2)[C@H](c2cnn(C)c2)C1	ZINC000875114594	GE	On-Demand	Anodyne	SLC6A3	17	42
Cc1nnc(NNC(=O)NCCOc2cccc(C(F)(F)F)c2)n1C	ZINC000875114595	FD	On-Demand	Reactive	HRH2	23	43
Cc1nnc(NNC(=O)NCCOc2cccc(C(F)(F)F)c2)n1C	ZINC000875114595	FD	On-Demand	Reactive	GALR3	45	33
Cc1nnc(NNC(=O)NCCOc2cccc(C(F)(F)F)c2)n1C	ZINC000875114595	FD	On-Demand	Reactive	PDS	45	42
CC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)c2cccc(Cl)c2)CC1	ZINC000875114609	FI	On-Demand	Anodyne	CCR5	23	41
CC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)c2cccc(Cl)c2)CC1	ZINC000875114609	FI	On-Demand	Anodyne	EPHX2	28	42
CC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)c2cccc(Cl)c2)CC1	ZINC000875114609	FI	On-Demand	Anodyne	BIRC8	55	35
CC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)c2cccc(Cl)c2)CC1	ZINC000875114612	FI	On-Demand	Anodyne	CCR5	23	41
CC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)c2cccc(Cl)c2)CC1	ZINC000875114612	FI	On-Demand	Anodyne	EPHX2	28	42
CC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)c2cccc(Cl)c2)CC1	ZINC000875114612	FI	On-Demand	Anodyne	BIRC8	55	35
CCOC(=O)CCCCCCNC(=O)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875114623	EE	On-Demand	Anodyne	EPHX2	21	49
CCOC(=O)CCCCCCNC(=O)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875114625	EE	On-Demand	Anodyne	EPHX2	21	49
COCCN1CCC(NC(=O)C(=O)NC[C@@H]2c3ccccc3CN2C)CC1	ZINC000875114652	FC	On-Demand	Anodyne	DRD2	35	41
COCCN1CCC(NC(=O)C(=O)NC[C@@H]2c3ccccc3CN2C)CC1	ZINC000875114652	FC	On-Demand	Anodyne	DRD3	48	37
COCCN1CCC(NC(=O)C(=O)NC[C@@H]2c3ccccc3CN2C)CC1	ZINC000875114652	FC	On-Demand	Anodyne	HTR4	49	37
COCCN1CCC(NC(=O)C(=O)NC[C@@H]2c3ccccc3CN2C)CC1	ZINC000875114652	FC	On-Demand	Anodyne	HTR7	27	40
COCCN1CCC(NC(=O)C(=O)NC[C@H]2c3ccccc3CN2C)CC1	ZINC000875114654	FC	On-Demand	Anodyne	DRD2	35	41
COCCN1CCC(NC(=O)C(=O)NC[C@H]2c3ccccc3CN2C)CC1	ZINC000875114654	FC	On-Demand	Anodyne	DRD3	48	37
COCCN1CCC(NC(=O)C(=O)NC[C@H]2c3ccccc3CN2C)CC1	ZINC000875114654	FC	On-Demand	Anodyne	HTR4	49	37
COCCN1CCC(NC(=O)C(=O)NC[C@H]2c3ccccc3CN2C)CC1	ZINC000875114654	FC	On-Demand	Anodyne	HTR7	27	40
CC(=O)N1CCC[C@@H]1C(=O)Nc1sc(C)c(-c2ccccc2)c1C(N)=O	ZINC000875114659	FF	On-Demand	Anodyne	F2	60	41
CC(=O)N1CCC[C@@H]1C(=O)Nc1sc(C)c(-c2ccccc2)c1C(N)=O	ZINC000875114659	FF	On-Demand	Anodyne	PRSS1	22	42
CC(=O)N1CCC[C@@H]1C(=O)Nc1sc(C)c(-c2ccccc2)c1C(N)=O	ZINC000875114659	FF	On-Demand	Anodyne	OPRM1	28	41
CC(=O)N1CCC[C@@H]1C(=O)Nc1sc(C)c(-c2ccccc2)c1C(N)=O	ZINC000875114659	FF	On-Demand	Anodyne	OPRD1	15	41
CC(=O)N1CCC[C@@H]1C(=O)Nc1sc(C)c(-c2ccccc2)c1C(N)=O	ZINC000875114659	FF	On-Demand	Anodyne	TRY1_BOVIN	86	42
CC(=O)N1CCC[C@@H]1C(=O)Nc1sc(C)c(-c2ccccc2)c1C(N)=O	ZINC000875114659	FF	On-Demand	Anodyne	LGMN	104	40
CC(=O)N1CCC[C@@H]1C(=O)Nc1sc(C)c(-c2ccccc2)c1C(N)=O	ZINC000875114659	FF	On-Demand	Anodyne	XIAP	51	43
CC(=O)N1CCC[C@@H]1C(=O)Nc1sc(C)c(-c2ccccc2)c1C(N)=O	ZINC000875114659	FF	On-Demand	Anodyne	BRCA1	52	32
CC(=O)N1CCC[C@@H]1C(=O)Nc1sc(C)c(-c2ccccc2)c1C(N)=O	ZINC000875114659	FF	On-Demand	Anodyne	TMPRSS11D	63	35
CCOC(=O)CCCCCCNC(=O)N1CC[C@H]2CC[C@@H](C1)S2	ZINC000875114660	EG	On-Demand	Anodyne	EPHX2	18	46
C=CCc1ccc(OC(=O)CCc2ccc(OC)cc2)c(OC)c1	ZINC000875114661	EH	On-Demand	Mild	AKR1C3	23	43
Cc1nnc(NNC(=O)NCCc2ccc(OCc3ccccc3)cc2)n1C	ZINC000875114663	GF	On-Demand	Reactive	MAOB	17	41
Cc1nnc(NNC(=O)NCCc2ccc(OCc3ccccc3)cc2)n1C	ZINC000875114663	GF	On-Demand	Reactive	TAAR1	16	48
Cc1nnc(NNC(=O)NCCc2ccc(OCc3ccccc3)cc2)n1C	ZINC000875114663	GF	On-Demand	Reactive	FFAR1	40	44
Cc1nnc(NNC(=O)NCCc2ccc(OCc3ccccc3)cc2)n1C	ZINC000875114663	GF	On-Demand	Reactive	FFAR4	44	37
O=C(N[C@@H](c1ccccc1)c1cccc(Cl)c1)N1CCC(CO)(CO)CC1	ZINC000875114675	GG	On-Demand	Anodyne	CACNA1H	60	41
O=C(N[C@@H](c1ccccc1)c1cccc(Cl)c1)N1CCC(CO)(CO)CC1	ZINC000875114675	GG	On-Demand	Anodyne	EPHX2	15	43
O=C(N[C@H](c1ccccc1)c1cccc(Cl)c1)N1CCC(CO)(CO)CC1	ZINC000875114676	GG	On-Demand	Anodyne	CACNA1H	60	41
O=C(N[C@H](c1ccccc1)c1cccc(Cl)c1)N1CCC(CO)(CO)CC1	ZINC000875114676	GG	On-Demand	Anodyne	EPHX2	15	43
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3ccccc3C(=O)OC)CC2)c(OC)c1	ZINC000875114704	JG	On-Demand	Mild	FKBP1A	21	40
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3ccccc3C(=O)OC)CC2)c(OC)c1	ZINC000875114704	JG	On-Demand	Mild	EPHX2	21	40
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3ccccc3C(=O)OC)CC2)c(OC)c1	ZINC000875114704	JG	On-Demand	Mild	TGM2	22	40
CCOC(=O)CCCCCCNC(=O)N1CCCC[C@@H]1[C@H]1CCCC[C@H]1O	ZINC000875114714	GH	On-Demand	Anodyne	ASAH1	67	35
CCOC(=O)CCCCCCNC(=O)N1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O	ZINC000875114715	GH	On-Demand	Anodyne	ASAH1	67	35
CCOC(=O)CCCCCCNC(=O)N1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O	ZINC000875114716	GH	On-Demand	Anodyne	ASAH1	67	35
CCOC(=O)CCCCCCNC(=O)N1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O	ZINC000875114717	GH	On-Demand	Anodyne	ASAH1	67	35
CCOC(=O)CCCCCCNC(=O)N[C@@H]1Cc2cncn2C1	ZINC000875114725	DD	On-Demand	Anodyne	EPHX2	18	45
CCOC(=O)CCCCCCNC(=O)N[C@H]1Cc2cncn2C1	ZINC000875114726	DD	On-Demand	Anodyne	EPHX2	18	45
O=C(NCCCCC1CC1)C(=O)NCCc1ccc(F)cc1F	ZINC000875114729	DE	On-Demand	Anodyne	HTR2A	15	46
CCOC(=O)CCCCCCNC(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875114734	EF	On-Demand	Anodyne	EPHX2	15	46
CCOC(=O)CCCCCCNC(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875114735	EF	On-Demand	Anodyne	EPHX2	15	46
CCOC(=O)CCCCCCNC(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875114736	EF	On-Demand	Anodyne	EPHX2	15	46
CCOC(=O)CCCCCCNC(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875114737	EF	On-Demand	Anodyne	EPHX2	15	46
CCOC(=O)CCCCCCNC(=O)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875114753	EE	On-Demand	Anodyne	EPHX2	17	47
CCOC(=O)CCCCCCNC(=O)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875114753	EE	On-Demand	Anodyne	ASAH1	71	37
CCOC(=O)CCCCCCNC(=O)N1Cc2cccc(O)c2C1	ZINC000875114755	EF	On-Demand	Clean	ASAH1	55	33
CCOC(=O)CCCCCCNC(=O)N(C)[C@@H]1CCCC[C@H]1O	ZINC000875114758	EE	On-Demand	Anodyne	EPHX2	16	48
CCOC(=O)CCCCCCNC(=O)N1CC=CC1	ZINC000875114779	CE	On-Demand	Anodyne	EPHX2	15	49
CCOC(=O)CCCCCCNC(=O)N1CC=CC1	ZINC000875114779	CE	On-Demand	Anodyne	ASAH1	80	38
CCOC(=O)CCCCCCNC(=O)N1C[C@H](O)C[C@H]1C1CC1	ZINC000875114780	EE	On-Demand	Anodyne	EPHX2	17	46
CCOC(=O)CCCCCCNC(=O)N1C[C@@H](O)C[C@H]1C1CC1	ZINC000875114781	EE	On-Demand	Anodyne	EPHX2	17	46
CCOC(=O)CCCCCCNC(=O)N1C[C@H](O)C[C@@H]1C1CC1	ZINC000875114782	EE	On-Demand	Anodyne	EPHX2	17	46
CCOC(=O)CCCCCCNC(=O)N1C[C@@H](O)C[C@@H]1C1CC1	ZINC000875114783	EE	On-Demand	Anodyne	EPHX2	17	46
CCOC(=O)CCCCCCNC(=O)N[C@@H]1CC12CCC2	ZINC000875114787	CF	On-Demand	Anodyne	EPHX2	34	58
CCOC(=O)CCCCCCNC(=O)N[C@H]1CC12CCC2	ZINC000875114788	CF	On-Demand	Anodyne	EPHX2	34	58
CN1CCN(C2CCN(C(=O)N[C@@H](c3ccc(F)cc3)C(C)(C)C)CC2)CC1	ZINC000875114804	GG	On-Demand	Anodyne	L3MBTL3	70	42
CN1CCN(C2CCN(C(=O)N[C@H](c3ccc(F)cc3)C(C)(C)C)CC2)CC1	ZINC000875114805	GG	On-Demand	Anodyne	L3MBTL3	70	42
CCOC(=O)CCCCCCNC(=O)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875114815	FE	On-Demand	Anodyne	ASAH1	57	36
CCOC(=O)CCCCCCNC(=O)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875114816	FE	On-Demand	Anodyne	ASAH1	57	36
CCOC(=O)CCCCCCNC(=O)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875114821	FG	On-Demand	Anodyne	ASAH1	66	34
CCOC(=O)CCCCCCNC(=O)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875114822	FG	On-Demand	Anodyne	ASAH1	66	34
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3ccc(C(C)C)cc3)CC2)c(OC)c1	ZINC000875114839	JJ	On-Demand	Mild	TGM2	56	48
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3ccc(C(C)C)cc3)CC2)c(OC)c1	ZINC000875114839	JJ	On-Demand	Mild	F13A1	49	33
O=C(NCc1nccs1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875114840	DE	On-Demand	Anodyne	EPHX2	15	48
O=C(NCc1nccs1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875114841	DE	On-Demand	Anodyne	EPHX2	15	48
Cn1nnnc1C1CCN(C(=O)N[C@@H](c2ccc(F)cc2)C(C)(C)C)CC1	ZINC000875114842	FG	On-Demand	Anodyne	CCR3	50	34
Cn1nnnc1C1CCN(C(=O)N[C@H](c2ccc(F)cc2)C(C)(C)C)CC1	ZINC000875114843	FG	On-Demand	Anodyne	CCR3	50	34
CN1CC[C@H]2CN(C(=O)C(=O)NCCc3ccc(F)cc3F)CC[C@@H]21	ZINC000875114855	FD	On-Demand	Anodyne	HTR2A	19	40
CN1CC[C@H]2CN(C(=O)C(=O)NCCc3ccc(F)cc3F)CC[C@H]21	ZINC000875114858	FD	On-Demand	Anodyne	HTR2A	19	40
C[C@@H](N(C)C(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1)C(C)(C)C	ZINC000875114870	EJ	On-Demand	Anodyne	HSD17B2	20	42
O=C(NCCCCC1CC1)C(=O)N[C@H]1CCN(c2ccccc2)C1	ZINC000875114875	EE	On-Demand	Anodyne	DRD2	22	50
O=C(NCCCCC1CC1)C(=O)N[C@H]1CCN(c2ccccc2)C1	ZINC000875114875	EE	On-Demand	Anodyne	HTR2A	15	40
O=C(NCCCCC1CC1)C(=O)N[C@H]1CCN(c2ccccc2)C1	ZINC000875114875	EE	On-Demand	Anodyne	DRD3	37	50
O=C(NCCCCC1CC1)C(=O)N[C@@H]1CCN(c2ccccc2)C1	ZINC000875114876	EE	On-Demand	Anodyne	DRD2	22	50
O=C(NCCCCC1CC1)C(=O)N[C@@H]1CCN(c2ccccc2)C1	ZINC000875114876	EE	On-Demand	Anodyne	HTR2A	15	40
O=C(NCCCCC1CC1)C(=O)N[C@@H]1CCN(c2ccccc2)C1	ZINC000875114876	EE	On-Demand	Anodyne	DRD3	37	50
CCOC(=O)CCCCCCNC(=O)N1CC[C@](C)(C(F)(F)F)C1	ZINC000875114892	FG	On-Demand	Anodyne	EPHX2	15	40
CCOC(=O)CCCCCCNC(=O)N1CC[C@@](C)(C(F)(F)F)C1	ZINC000875114893	FG	On-Demand	Anodyne	EPHX2	15	40
CCOC(=O)CCCCCCNC(=O)N[C@@H]1[C@H]2C[C@@H]3CO[C@@H]1[C@H]3C2	ZINC000875114906	EE	On-Demand	Anodyne	EPHX2	23	49
CCOC(=O)CCCCCCNC(=O)N[C@@H]1[C@H]2C[C@@H]3CO[C@H]1[C@H]3C2	ZINC000875114907	EE	On-Demand	Anodyne	EPHX2	23	49
CCOC(=O)CCCCCCNC(=O)N[C@@H]1[C@@H]2C[C@@H]3[C@@H]1OC[C@@H]3C2	ZINC000875114908	EE	On-Demand	Anodyne	EPHX2	23	49
CCOC(=O)CCCCCCNC(=O)N[C@@H]1[C@@H]2C[C@H]3[C@H](CO[C@H]31)C2	ZINC000875114909	EE	On-Demand	Anodyne	EPHX2	23	49
COC(=O)N(C)NC(=O)NCCOc1cccc(C(F)(F)F)c1	ZINC000875114920	ED	On-Demand	Reactive	HRH2	24	45
COC(=O)N(C)NC(=O)NCCOc1cccc(C(F)(F)F)c1	ZINC000875114920	ED	On-Demand	Reactive	MTNR1A	29	45
COC(=O)N(C)NC(=O)NCCOc1cccc(C(F)(F)F)c1	ZINC000875114920	ED	On-Demand	Reactive	MTNR1B	20	45
COC(=O)N(C)NC(=O)NCCOc1cccc(C(F)(F)F)c1	ZINC000875114920	ED	On-Demand	Reactive	GALR3	64	35
COC(=O)N(C)NC(=O)NCCOc1cccc(C(F)(F)F)c1	ZINC000875114920	ED	On-Demand	Reactive	PDS	50	47
O=C(c1cccn(C2CC2)c1=O)N1CCCc2cc(C(F)(F)F)ccc21	ZINC000875114930	FH	On-Demand	Anodyne	LIPG	49	33
CCOc1cccc([C@H](C)NC(=O)C(=O)N2C[C@H](OC)CC[C@@H]2C)c1	ZINC000875114943	EE	On-Demand	Anodyne	PDS	25	41
CCOc1cccc([C@H](C)NC(=O)C(=O)N2C[C@H](OC)CC[C@H]2C)c1	ZINC000875114944	EE	On-Demand	Anodyne	PDS	25	41
CCOc1cccc([C@H](C)NC(=O)C(=O)N2C[C@@H](OC)CC[C@H]2C)c1	ZINC000875114945	EE	On-Demand	Anodyne	PDS	25	41
CCOc1cccc([C@H](C)NC(=O)C(=O)N2C[C@@H](OC)CC[C@@H]2C)c1	ZINC000875114946	EE	On-Demand	Anodyne	PDS	25	41
C=CCc1ccc(OC(=O)CCc2ccccc2OC)c(OC)c1	ZINC000875114958	EH	On-Demand	Mild	AKR1C3	22	40
O=C(CCCOC1CCOCC1)N1CCCc2cc(C(F)(F)F)ccc21	ZINC000875114960	FH	On-Demand	Anodyne	LIPG	58	46
CC[C@@H](NC(=O)C(=O)NCC1CCN(CC)CC1)c1cccc(OC)c1OC	ZINC000875114962	GE	On-Demand	Anodyne	HTR4	49	33
CC[C@@H](NC(=O)C(=O)NCC1CCN(CC)CC1)c1cccc(OC)c1OC	ZINC000875114962	GE	On-Demand	Anodyne	CACNA1I	56	35
COc1ncccc1CNC(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875114963	FG	On-Demand	Anodyne	SCN10A	24	42
CCOc1cccc([C@H](C)NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)c1	ZINC000875114983	EF	On-Demand	Anodyne	PDS	23	41
CCOc1cccc([C@@H](C)NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)c1	ZINC000875114984	EF	On-Demand	Anodyne	PDS	23	41
COC(=O)C1(O)CN(C(=O)NCCc2csc3ccccc23)C1	ZINC000875114989	ED	On-Demand	Anodyne	MTNR1A	17	51
COC(=O)C1(O)CN(C(=O)NCCc2csc3ccccc23)C1	ZINC000875114989	ED	On-Demand	Anodyne	FFAR2	43	32
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1CCN(CCC)CC1	ZINC000875115004	EC	On-Demand	Mild	CACNA1I	47	34
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1CCN(CCC)CC1	ZINC000875115005	EC	On-Demand	Mild	CACNA1I	47	34
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)NCCC[C@H]1C=CCC1	ZINC000875115015	EE	On-Demand	Anodyne	GRIA1	51	37
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)NCCC[C@@H]1C=CCC1	ZINC000875115017	EE	On-Demand	Anodyne	GRIA1	51	37
CCOc1cccc([C@@H](C)NC(=O)C(=O)N[C@H]2CC23CCC3)c1	ZINC000875115019	DE	On-Demand	Anodyne	PDS	15	40
CCOc1cccc([C@@H](C)NC(=O)C(=O)N[C@@H]2CC23CCC3)c1	ZINC000875115020	DE	On-Demand	Anodyne	PDS	15	40
CCOc1cccc([C@H](C)NC(=O)C(=O)N[C@@H]2CC23CCC3)c1	ZINC000875115021	DE	On-Demand	Anodyne	PDS	15	40
CCOc1cccc([C@H](C)NC(=O)C(=O)N[C@H]2CC23CCC3)c1	ZINC000875115022	DE	On-Demand	Anodyne	PDS	15	40
O=C(NCc1nccs1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875115024	EE	On-Demand	Anodyne	FAAH	19	41
O=C(NCCOc1cccc(C(F)(F)F)c1)N1CCC(CO)(CO)CC1	ZINC000875115025	GD	On-Demand	Anodyne	HRH2	26	45
O=C(NCCOc1cccc(C(F)(F)F)c1)N1CCC(CO)(CO)CC1	ZINC000875115025	GD	On-Demand	Anodyne	EPHX2	27	42
O=C(NCCOc1cccc(C(F)(F)F)c1)N1CCC(CO)(CO)CC1	ZINC000875115025	GD	On-Demand	Anodyne	GALR3	41	33
O=C(NCCOc1cccc(C(F)(F)F)c1)N1CCC(CO)(CO)CC1	ZINC000875115025	GD	On-Demand	Anodyne	PDS	48	48
CC(=O)C1CCN(C(=O)C(=O)NCCc2ccc(F)cc2F)CC1	ZINC000875115051	ED	On-Demand	Anodyne	HTR2A	20	44
CCOC(=O)CCCCCCNC(=O)N[C@@H]1Cc2ccc(C#N)cc2C1	ZINC000875115053	FF	On-Demand	Mild	CA7	15	40
CCOC(=O)CCCCCCNC(=O)N[C@@H]1Cc2ccc(C#N)cc2C1	ZINC000875115053	FF	On-Demand	Mild	EPHX2	18	44
CCOC(=O)CCCCCCNC(=O)N[C@H]1Cc2ccc(C#N)cc2C1	ZINC000875115054	FF	On-Demand	Mild	CA7	15	40
CCOC(=O)CCCCCCNC(=O)N[C@H]1Cc2ccc(C#N)cc2C1	ZINC000875115054	FF	On-Demand	Mild	EPHX2	18	44
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3cccc(C(F)(F)F)c3)CC2)c(OC)c1	ZINC000875115060	JI	On-Demand	Mild	FKBP1A	34	41
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3cccc(C(F)(F)F)c3)CC2)c(OC)c1	ZINC000875115060	JI	On-Demand	Mild	CACNA1B	53	42
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3cccc(C(F)(F)F)c3)CC2)c(OC)c1	ZINC000875115060	JI	On-Demand	Mild	TGM2	25	41
Cn1nc(Cl)c(C(=O)N2CSC[C@H]2C(=O)Nc2ccccc2)c1Cl	ZINC000875115063	GF	On-Demand	Anodyne	CFTR	50	35
Cn1nc(Cl)c(C(=O)N2CSC[C@@H]2C(=O)Nc2ccccc2)c1Cl	ZINC000875115064	GF	On-Demand	Anodyne	CFTR	50	35
Cc1nnc(NNC(=O)NCCOc2ccc(C(F)(F)F)cc2)n1C	ZINC000875115084	FD	On-Demand	Reactive	PPARD	41	34
C[C@H](NC(=O)C(=O)N1CCC(CO)(CO)CC1)c1ccc(F)c(Cl)c1	ZINC000875115086	FD	On-Demand	Anodyne	CACNA1H	49	38
C[C@H](NC(=O)C(=O)N1CCC(CO)(CO)CC1)c1ccc(F)c(Cl)c1	ZINC000875115086	FD	On-Demand	Anodyne	MAPK1	45	39
CCOC(=O)CCCCCCNC(=O)N1C[C@H](C)C(F)(F)[C@@H](C)C1	ZINC000875115093	EG	On-Demand	Anodyne	EPHX2	16	49
CCOC(=O)CCCCCCNC(=O)N1C[C@H](C)C(F)(F)[C@H](C)C1	ZINC000875115094	EG	On-Demand	Anodyne	EPHX2	16	49
CCOC(=O)CCCCCCNC(=O)N1C[C@@H](C)C(F)(F)[C@H](C)C1	ZINC000875115095	EG	On-Demand	Anodyne	EPHX2	16	49
CCOC(=O)CCCCCCNC(=O)N[C@H]1CCCn2nccc21	ZINC000875115096	EF	On-Demand	Anodyne	EPHX2	18	44
CCOC(=O)CCCCCCNC(=O)N[C@@H]1CCCn2nccc21	ZINC000875115097	EF	On-Demand	Anodyne	EPHX2	18	44
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3ccc(C(=O)OCC)cc3)CC2)c(OC)c1	ZINC000875115106	JH	On-Demand	Mild	TGM2	52	48
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3ccc(C(=O)OCC)cc3)CC2)c(OC)c1	ZINC000875115106	JH	On-Demand	Mild	F13A1	42	37
O=CN1CCCN(C(=O)NCCOc2cccc(C(F)(F)F)c2)CC1	ZINC000875115107	FD	On-Demand	Anodyne	HRH2	26	46
O=CN1CCCN(C(=O)NCCOc2cccc(C(F)(F)F)c2)CC1	ZINC000875115107	FD	On-Demand	Anodyne	GALR3	51	35
O=CN1CCCN(C(=O)NCCOc2cccc(C(F)(F)F)c2)CC1	ZINC000875115107	FD	On-Demand	Anodyne	PDS	46	46
CCOC(=O)CCCCCCNC(=O)N[C@@H]1C[C@H](C)O[C@@H]1C	ZINC000875115108	DE	On-Demand	Anodyne	EPHX2	30	54
CCOC(=O)CCCCCCNC(=O)N[C@@H]1C[C@@H](C)O[C@H]1C	ZINC000875115109	DE	On-Demand	Anodyne	EPHX2	30	54
CCOC(=O)CCCCCCNC(=O)N[C@@H]1C[C@H](C)O[C@H]1C	ZINC000875115110	DE	On-Demand	Anodyne	EPHX2	30	54
CCOC(=O)CCCCCCNC(=O)N[C@@H]1C[C@@H](C)O[C@@H]1C	ZINC000875115111	DE	On-Demand	Anodyne	EPHX2	30	54
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3CCN(c4ccccc4)C3)CC2)CC1	ZINC000875115113	GC	On-Demand	Anodyne	SLC6A5	16	41
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3CCN(c4ccccc4)C3)CC2)CC1	ZINC000875115113	GC	On-Demand	Anodyne	L3MBTL3	89	40
CN1CCN(C2CCN(C(=O)C(=O)N[C@H]3CCN(c4ccccc4)C3)CC2)CC1	ZINC000875115114	GC	On-Demand	Anodyne	SLC6A5	16	41
CN1CCN(C2CCN(C(=O)C(=O)N[C@H]3CCN(c4ccccc4)C3)CC2)CC1	ZINC000875115114	GC	On-Demand	Anodyne	L3MBTL3	89	40
CCOC(=O)CCCCCCNC(=O)N[C@@H]1CCCC[C@@H]1F	ZINC000875115116	DG	On-Demand	Anodyne	EPHX2	29	53
CCOC(=O)CCCCCCNC(=O)N1CCC(F)(F)C[C@H]1C	ZINC000875115117	EG	On-Demand	Anodyne	EPHX2	17	48
CCOC(=O)CCCCCCNC(=O)N1CCC(F)(F)C[C@@H]1C	ZINC000875115118	EG	On-Demand	Anodyne	EPHX2	17	48
O=C(NCc1nccs1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875115121	GG	On-Demand	Anodyne	ETHR	40	32
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)NCc1ncc(Cl)s1	ZINC000875115131	FD	On-Demand	Anodyne	GRIA1	41	32
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)NCCCCC1CC1	ZINC000875115135	DE	On-Demand	Anodyne	OPRM1	30	47
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)NCCCCC1CC1	ZINC000875115135	DE	On-Demand	Anodyne	OPRD1	26	40
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)NCCCCC1CC1	ZINC000875115135	DE	On-Demand	Anodyne	NTSR1	76	35
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)NCCCCC1CC1	ZINC000875115135	DE	On-Demand	Anodyne	NTSR2	60	31
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)NCCCCC1CC1	ZINC000875115135	DE	On-Demand	Anodyne	GRIA1	63	42
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)NCCCCC1CC1	ZINC000875115135	DE	On-Demand	Anodyne	YARS	56	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875115137	ED	On-Demand	Anodyne	YARS	62	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2cccc(C)c2)C1	ZINC000875115176	DD	On-Demand	Anodyne	HDAC8	24	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2cccc(C)c2)C1	ZINC000875115176	DD	On-Demand	Anodyne	GPBAR1	18	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2cccc(C)c2)C1	ZINC000875115177	DD	On-Demand	Anodyne	HDAC8	24	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2cccc(C)c2)C1	ZINC000875115177	DD	On-Demand	Anodyne	GPBAR1	18	40
CCOc1cccc([C@@H](C)NC(=O)C(=O)N[C@H](C)c2ccnn2C)c1	ZINC000875115179	ED	On-Demand	Anodyne	PDS	55	44
CCOc1cccc([C@@H](C)NC(=O)C(=O)N[C@@H](C)c2ccnn2C)c1	ZINC000875115180	ED	On-Demand	Anodyne	PDS	55	44
CCOc1cccc([C@H](C)NC(=O)C(=O)N[C@H](C)c2ccnn2C)c1	ZINC000875115181	ED	On-Demand	Anodyne	PDS	55	44
CCOc1cccc([C@H](C)NC(=O)C(=O)N[C@@H](C)c2ccnn2C)c1	ZINC000875115182	ED	On-Demand	Anodyne	PDS	55	44
N#Cc1cc(C(=O)N2CCCc3cc(C(F)(F)F)ccc32)co1	ZINC000875115184	DH	On-Demand	Mild	AVPR2	22	43
CCOc1cccc([C@@H](C)NC(=O)C(=O)NCc2cnn(CC)n2)c1	ZINC000875115195	ED	On-Demand	Anodyne	ACACB	17	43
CCOc1cccc([C@@H](C)NC(=O)C(=O)NCc2cnn(CC)n2)c1	ZINC000875115195	ED	On-Demand	Anodyne	PDS	49	41
CCOc1cccc([C@H](C)NC(=O)C(=O)NCc2cnn(CC)n2)c1	ZINC000875115196	ED	On-Demand	Anodyne	ACACB	17	43
CCOc1cccc([C@H](C)NC(=O)C(=O)NCc2cnn(CC)n2)c1	ZINC000875115196	ED	On-Demand	Anodyne	PDS	49	41
CCOc1cccc([C@H](C)NC(=O)C(=O)N[C@@H](C)c2cc3cnccc3o2)c1	ZINC000875115209	GG	On-Demand	Anodyne	ACACB	15	44
CCOc1cccc([C@@H](C)NC(=O)C(=O)N[C@@H](C)c2cc3cnccc3o2)c1	ZINC000875115210	GG	On-Demand	Anodyne	ACACB	15	44
CCOc1cccc([C@H](C)NC(=O)C(=O)N[C@H](C)c2cc3cnccc3o2)c1	ZINC000875115211	GG	On-Demand	Anodyne	ACACB	15	44
CCOc1cccc([C@@H](C)NC(=O)C(=O)N[C@H](C)c2cc3cnccc3o2)c1	ZINC000875115212	GG	On-Demand	Anodyne	ACACB	15	44
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875115216	FE	On-Demand	Anodyne	NTSR1	101	35
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875115216	FE	On-Demand	Anodyne	NTSR2	68	34
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875115216	FE	On-Demand	Anodyne	SORT1	43	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875115216	FE	On-Demand	Anodyne	YARS	68	37
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875115217	FE	On-Demand	Anodyne	NTSR1	101	35
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875115217	FE	On-Demand	Anodyne	NTSR2	68	34
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875115217	FE	On-Demand	Anodyne	SORT1	43	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875115217	FE	On-Demand	Anodyne	YARS	68	37
CONC(=O)C1CCN(C(=O)N[C@@H](c2ccc(F)cc2)C(C)(C)C)CC1	ZINC000875115226	FG	On-Demand	Anodyne	SLC6A3	16	41
CONC(=O)C1CCN(C(=O)N[C@H](c2ccc(F)cc2)C(C)(C)C)CC1	ZINC000875115227	FG	On-Demand	Anodyne	SLC6A3	16	41
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000875115229	ED	On-Demand	Anodyne	EPHX2	15	40
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000875115230	ED	On-Demand	Anodyne	EPHX2	15	40
CCOC(=O)CCCCCCNC(=O)N1CC(c2ccccc2)C1	ZINC000875115231	EG	On-Demand	Anodyne	EPHX2	26	44
CCOC(=O)CCCCCCNC(=O)N1CC(c2ccccc2)C1	ZINC000875115231	EG	On-Demand	Anodyne	ASAH1	68	34
C=CCc1ccc(OC(=O)CCNC(=O)NC23CC4CC(CC(C4)C2)C3)c(OC)c1	ZINC000875115253	HH	On-Demand	Mild	EPHX2	95	49
O=C(NCCOc1ccc(C(F)(F)F)cc1)N1CCC(CO)(CO)CC1	ZINC000875115268	GD	On-Demand	Anodyne	EPHX2	35	41
O=C(NCc1ccccc1OCc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000875115276	EF	On-Demand	Anodyne	PPIA	41	39
O=C(NCc1ccccc1OCc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000875115276	EF	On-Demand	Anodyne	PTGER1	32	44
C#C[C@@H]1CC[C@@H](NC(=O)NCCCCCCC(=O)OCC)CC1	ZINC000875115282	DF	On-Demand	Mild	EPHX2	32	55
C=CC(C)(C)CCCNC(=O)C(=O)N[C@H]1CCN(c2ccccc2)C1	ZINC000875115284	EE	On-Demand	Mild	DRD3	21	41
C=CC(C)(C)CCCNC(=O)C(=O)N[C@@H]1CCN(c2ccccc2)C1	ZINC000875115285	EE	On-Demand	Mild	DRD3	21	41
O=C(NCCc1ccc(F)cc1F)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875115290	GF	On-Demand	Anodyne	HTR2A	17	42
O=C(NCCc1ccc(F)cc1F)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875115291	GF	On-Demand	Anodyne	HTR2A	17	42
CC[C@H](NC(=O)c1c(Cl)nn(C)c1Cl)c1ccccc1	ZINC000875115292	DH	On-Demand	Anodyne	TACR3	65	54
CC[C@H](NC(=O)c1c(Cl)nn(C)c1Cl)c1ccccc1	ZINC000875115292	DH	On-Demand	Anodyne	SOAT1	34	42
CC[C@H](NC(=O)c1c(Cl)nn(C)c1Cl)c1ccccc1	ZINC000875115292	DH	On-Demand	Anodyne	UTS2	43	35
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3c(Cl)cccc3Cl)CC2)c(OC)c1	ZINC000875115294	JJ	On-Demand	Mild	FKBP1A	35	40
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3c(Cl)cccc3Cl)CC2)c(OC)c1	ZINC000875115294	JJ	On-Demand	Mild	EPHX2	17	41
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3c(Cl)cccc3Cl)CC2)c(OC)c1	ZINC000875115294	JJ	On-Demand	Mild	TGM2	16	41
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(c2ccccc2)C1	ZINC000875115295	ED	On-Demand	Anodyne	DRD2	16	41
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(c2ccccc2)C1	ZINC000875115295	ED	On-Demand	Anodyne	DRD3	20	41
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(c2ccccc2)C1	ZINC000875115296	ED	On-Demand	Anodyne	DRD2	16	41
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(c2ccccc2)C1	ZINC000875115296	ED	On-Demand	Anodyne	DRD3	20	41
CCOC(=O)CCCCCCNC(=O)N1CCN(S(=O)(=O)C2CC2)CC1	ZINC000875115314	GD	On-Demand	Anodyne	EPHX2	19	47
O=C(NCc1ccccc1OCc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875115315	GF	On-Demand	Anodyne	PTGER1	49	43
O=C(NCc1ccccc1OCc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875115315	GF	On-Demand	Anodyne	EPHX2	19	45
O=C(NCc1ccccc1OCc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875115315	GF	On-Demand	Anodyne	HCN1	22	41
CCOC(=O)CCCCCCNC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875115321	EE	On-Demand	Anodyne	EPHX2	15	45
CCOC(=O)CCCCCCNC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875115322	EE	On-Demand	Anodyne	EPHX2	15	45
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)N[C@H](C)Cc2ccc(O)cc2)c1	ZINC000875115325	FF	On-Demand	Anodyne	NTSR1	91	33
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)N[C@H](C)Cc2ccc(O)cc2)c1	ZINC000875115325	FF	On-Demand	Anodyne	NTSR2	63	32
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)N[C@H](C)Cc2ccc(O)cc2)c1	ZINC000875115325	FF	On-Demand	Anodyne	HLA-A	46	34
Cc1cncc([C@H]2CCCN2C(=O)C(=O)N[C@H](C)Cc2ccc(O)cc2)c1	ZINC000875115326	FF	On-Demand	Anodyne	NTSR1	91	33
Cc1cncc([C@H]2CCCN2C(=O)C(=O)N[C@H](C)Cc2ccc(O)cc2)c1	ZINC000875115326	FF	On-Demand	Anodyne	NTSR2	63	32
Cc1cncc([C@H]2CCCN2C(=O)C(=O)N[C@H](C)Cc2ccc(O)cc2)c1	ZINC000875115326	FF	On-Demand	Anodyne	HLA-A	46	34
Cc1cncc([C@H]2CCCN2C(=O)C(=O)N[C@@H](C)Cc2ccc(O)cc2)c1	ZINC000875115327	FF	On-Demand	Anodyne	NTSR1	91	33
Cc1cncc([C@H]2CCCN2C(=O)C(=O)N[C@@H](C)Cc2ccc(O)cc2)c1	ZINC000875115327	FF	On-Demand	Anodyne	NTSR2	63	32
Cc1cncc([C@H]2CCCN2C(=O)C(=O)N[C@@H](C)Cc2ccc(O)cc2)c1	ZINC000875115327	FF	On-Demand	Anodyne	HLA-A	46	34
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)N[C@@H](C)Cc2ccc(O)cc2)c1	ZINC000875115328	FF	On-Demand	Anodyne	NTSR1	91	33
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)N[C@@H](C)Cc2ccc(O)cc2)c1	ZINC000875115328	FF	On-Demand	Anodyne	NTSR2	63	32
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)N[C@@H](C)Cc2ccc(O)cc2)c1	ZINC000875115328	FF	On-Demand	Anodyne	HLA-A	46	34
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)NCCSCCC(F)(F)F	ZINC000875115330	GE	On-Demand	Anodyne	GRIA1	46	33
CCOc1cccc([C@H](C)NC(=O)C(=O)NCCC2CCN(C(C)C)CC2)c1	ZINC000875115332	GF	On-Demand	Anodyne	SIRT3	41	33
CCOc1cccc([C@H](C)NC(=O)C(=O)NCCC2CCN(C(C)C)CC2)c1	ZINC000875115332	GF	On-Demand	Anodyne	SIRT2	45	33
CCOc1cccc([C@H](C)NC(=O)C(=O)NCCC2CCN(C(C)C)CC2)c1	ZINC000875115332	GF	On-Demand	Anodyne	SIRT1	41	33
CCOc1cccc([C@@H](C)NC(=O)C(=O)NCCC2CCN(C(C)C)CC2)c1	ZINC000875115333	GF	On-Demand	Anodyne	SIRT3	41	33
CCOc1cccc([C@@H](C)NC(=O)C(=O)NCCC2CCN(C(C)C)CC2)c1	ZINC000875115333	GF	On-Demand	Anodyne	SIRT2	45	33
CCOc1cccc([C@@H](C)NC(=O)C(=O)NCCC2CCN(C(C)C)CC2)c1	ZINC000875115333	GF	On-Demand	Anodyne	SIRT1	41	33
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875115342	EC	On-Demand	Mild	YARS	61	32
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875115343	EC	On-Demand	Mild	YARS	61	32
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875115344	EC	On-Demand	Mild	YARS	61	32
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875115345	EC	On-Demand	Mild	YARS	61	32
O=C(COCc1ccnc(O)c1)N1CCCc2cc(C(F)(F)F)ccc21	ZINC000875115349	FG	On-Demand	Anodyne	LIPG	46	35
O=C(NCCc1csc2ccccc12)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875115356	GG	On-Demand	Anodyne	ETHR	53	35
O=C(NCCc1csc2ccccc12)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875115357	GG	On-Demand	Anodyne	ETHR	53	35
C=CCc1ccc(OC(=O)COc2ccc(/C=C\C)cc2OC)c(OC)c1	ZINC000875115387	FI	On-Demand	Mild	AKR1C3	22	43
C=CCc1ccc(OC(=O)COc2ccc(/C=C/C)cc2OC)c(OC)c1	ZINC000875115388	FI	On-Demand	Mild	AKR1C3	22	43
C=CC(C)(C)CCCNC(=O)C(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875115411	EF	On-Demand	Mild	GRIA1	55	40
C=CC(C)(C)CCCNC(=O)C(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875115412	EF	On-Demand	Mild	GRIA1	55	40
CCOc1cccc([C@H](C)NC(=O)C(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875115420	FC	On-Demand	Anodyne	PDS	48	43
CCOc1cccc([C@@H](C)NC(=O)C(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875115421	FC	On-Demand	Anodyne	PDS	48	43
COC(=O)N(C)NC(=O)NCc1nccs1	ZINC000875115444	BC	On-Demand	Reactive	MAP1	51	32
CCOC(=O)CCCCCCNC(=O)N1CC[C@H](CO)C[C@H]1C	ZINC000875115446	EE	On-Demand	Anodyne	EPHX2	15	46
CCOC(=O)CCCCCCNC(=O)N1CC[C@H](CO)C[C@@H]1C	ZINC000875115447	EE	On-Demand	Anodyne	EPHX2	15	46
CCOC(=O)CCCCCCNC(=O)N1CC[C@@H](CO)C[C@H]1C	ZINC000875115448	EE	On-Demand	Anodyne	EPHX2	15	46
CCOC(=O)CCCCCCNC(=O)N1CC[C@@H](CO)C[C@@H]1C	ZINC000875115449	EE	On-Demand	Anodyne	EPHX2	15	46
CCOC(=O)CCCCCCNC(=O)NC1(C)COC1	ZINC000875115478	CD	On-Demand	Anodyne	EPHX2	34	62
CCOC(=O)CCCCCCNC(=O)N1[C@H]2CC[C@H]1CC(F)(F)C2	ZINC000875115480	EG	On-Demand	Anodyne	EPHX2	23	51
CCOC(=O)CCCCCCNC(=O)N[C@H]1CCCC12CC2	ZINC000875115488	DG	On-Demand	Anodyne	EPHX2	30	54
CCOC(=O)CCCCCCNC(=O)N[C@@H]1CCCC12CC2	ZINC000875115489	DG	On-Demand	Anodyne	EPHX2	30	54
O=CN1CCCN(C(=O)NCc2ccccc2OCc2ccccc2)CC1	ZINC000875115495	FF	On-Demand	Anodyne	PTGER1	42	41
O=CN1CCCN(C(=O)NCc2ccccc2OCc2ccccc2)CC1	ZINC000875115495	FF	On-Demand	Anodyne	DPP7	22	53
CCOC(=O)CCCCCCNC(=O)N[C@H]1CCC[C@@H]1O	ZINC000875115502	DD	On-Demand	Anodyne	EPHX2	33	53
CCOC(=O)CCCCCCNC(=O)N[C@]12CCCC[C@@H]1C2	ZINC000875115509	DG	On-Demand	Anodyne	EPHX2	38	61
CCOC(=O)CCCCCCNC(=O)N[C@@]12CCCC[C@@H]1C2	ZINC000875115510	DG	On-Demand	Anodyne	EPHX2	38	61
CCOC(=O)CCCCCCNC(=O)N[C@@]12CCCC[C@H]1C2	ZINC000875115511	DG	On-Demand	Anodyne	EPHX2	38	61
CCOC(=O)CCCCCCNC(=O)N[C@]12CCCC[C@H]1C2	ZINC000875115512	DG	On-Demand	Anodyne	EPHX2	38	61
CCOC(=O)CCCCCCNC(=O)NC1(C)CC(F)(F)C1	ZINC000875115513	DF	On-Demand	Anodyne	EPHX2	32	60
CCOC(=O)CCCCCCNC(=O)N1CCC(C(C)=O)CC1	ZINC000875115516	EF	On-Demand	Anodyne	EPHX2	17	47
CCC1(CC)CCCN1C(=O)NCc1ccc(S(=O)(=O)NCCOC)cc1	ZINC000875115524	GE	On-Demand	Anodyne	NAMPT	46	36
COC(=O)C1=NO[C@@]2(CCN(C(=O)NCCc3csc4ccccc34)C2)C1	ZINC000875115527	GF	On-Demand	Anodyne	FFAR2	48	31
COC(=O)C1=NO[C@]2(CCN(C(=O)NCCc3csc4ccccc34)C2)C1	ZINC000875115528	GF	On-Demand	Anodyne	FFAR2	48	31
CONC(=O)C1CCN(C(=O)NCCc2csc3ccccc23)CC1	ZINC000875115533	FF	On-Demand	Anodyne	MTNR1A	24	61
CCCCCCCNC(=O)C(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875115536	DF	On-Demand	Mild	OPRM1	25	53
CCCCCCCNC(=O)C(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875115536	DF	On-Demand	Mild	OPRD1	25	46
CCCCCCCNC(=O)C(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875115536	DF	On-Demand	Mild	NTSR1	41	32
CCCCCCCNC(=O)C(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875115536	DF	On-Demand	Mild	GRIA1	89	52
CCCCCCCNC(=O)C(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875115536	DF	On-Demand	Mild	YARS	48	35
CCCCCCCNC(=O)C(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875115536	DF	On-Demand	Mild	CAPN2	30	41
CCCCCCCNC(=O)C(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875115536	DF	On-Demand	Mild	ASAH1	99	38
CCCCCCCNC(=O)C(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875115537	DF	On-Demand	Mild	OPRM1	25	53
CCCCCCCNC(=O)C(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875115537	DF	On-Demand	Mild	OPRD1	25	46
CCCCCCCNC(=O)C(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875115537	DF	On-Demand	Mild	NTSR1	41	32
CCCCCCCNC(=O)C(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875115537	DF	On-Demand	Mild	GRIA1	89	52
CCCCCCCNC(=O)C(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875115537	DF	On-Demand	Mild	YARS	48	35
CCCCCCCNC(=O)C(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875115537	DF	On-Demand	Mild	CAPN2	30	41
CCCCCCCNC(=O)C(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875115537	DF	On-Demand	Mild	ASAH1	99	38
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1	ZINC000875115538	FD	On-Demand	Anodyne	YARS	54	32
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N1CCN(c2ccc(C#N)cc2)CC1	ZINC000875115542	GD	On-Demand	Mild	ITGA4	15	41
O=C(NCCc1csc2ccccc12)N1CCC2(CCNC2=O)CC1	ZINC000875115554	FF	On-Demand	Anodyne	FFAR2	61	34
CCOc1cccc([C@H](C)NC(=O)C(=O)NCCC(C)(C)COC)c1	ZINC000875115563	FE	On-Demand	Anodyne	PDS	63	42
CCOc1cccc([C@@H](C)NC(=O)C(=O)NCCC(C)(C)COC)c1	ZINC000875115564	FE	On-Demand	Anodyne	PDS	63	42
C[C@H](NC(=O)C(=O)NC[C@H]1CCCCN1Cc1ccccc1)c1ccnn1C	ZINC000875115565	GD	On-Demand	Anodyne	DRD2	15	42
C[C@H](NC(=O)C(=O)NC[C@@H]1CCCCN1Cc1ccccc1)c1ccnn1C	ZINC000875115569	GD	On-Demand	Anodyne	DRD2	15	42
C[C@H](NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1)c1ccc(F)c(Cl)c1	ZINC000875115581	GG	On-Demand	Anodyne	ENV	44	39
CCOC(=O)CCCCCCNC(=O)N1[C@H]2CC[C@H]1CC1(CC1)C2	ZINC000875115586	EH	On-Demand	Anodyne	EPHX2	25	52
C[C@H]1CC(=O)N[C@@H](C(=O)N2CCCc3cc(C(F)(F)F)ccc32)C1	ZINC000875115600	EF	On-Demand	Anodyne	LIPG	43	35
CCOC(=O)CCCCCCNC(=O)N[C@@H]1[C@H](C)O[C@H](C)[C@@H]1C	ZINC000875115602	EF	On-Demand	Anodyne	EPHX2	19	50
CCOC(=O)CCCCCCNC(=O)N[C@@H]1[C@H](C)O[C@@H](C)[C@H]1C	ZINC000875115604	EF	On-Demand	Anodyne	EPHX2	19	50
CCOC(=O)CCCCCCNC(=O)N[C@@H]1[C@H](C)O[C@H](C)[C@H]1C	ZINC000875115606	EF	On-Demand	Anodyne	EPHX2	19	50
CCOC(=O)CCCCCCNC(=O)N[C@@H]1[C@H](C)O[C@@H](C)[C@@H]1C	ZINC000875115608	EF	On-Demand	Anodyne	EPHX2	19	50
O=C(NCCc1csc2ccccc12)N1CCC(CO)(CO)CC1	ZINC000875115610	EE	On-Demand	Anodyne	FFAR2	62	36
C=CCc1ccc(OC(=O)CCNC(=O)c2ccc(Br)cc2)c(OC)c1	ZINC000875115612	HH	On-Demand	Mild	MT-ND1	19	41
CCOC(=O)CCCCCCNC(=O)N[C@]12C[C@@H]1COC2(C)C	ZINC000875115614	EE	On-Demand	Anodyne	EPHX2	34	60
CCOC(=O)CCCCCCNC(=O)N[C@@]12C[C@@H]1COC2(C)C	ZINC000875115615	EE	On-Demand	Anodyne	EPHX2	34	60
CCOC(=O)CCCCCCNC(=O)N[C@@]12C[C@H]1COC2(C)C	ZINC000875115616	EE	On-Demand	Anodyne	EPHX2	34	60
CCOC(=O)CCCCCCNC(=O)N[C@]12C[C@H]1COC2(C)C	ZINC000875115617	EE	On-Demand	Anodyne	EPHX2	34	60
O=C(NCCOc1cccc(C(F)(F)F)c1)NC[C@H]1C[C@H](O)C1	ZINC000875115620	EE	On-Demand	Anodyne	HRH2	25	46
O=C(NCCOc1cccc(C(F)(F)F)c1)NC[C@H]1C[C@H](O)C1	ZINC000875115620	EE	On-Demand	Anodyne	EPHX2	16	41
O=C(NCCOc1cccc(C(F)(F)F)c1)NC[C@H]1C[C@H](O)C1	ZINC000875115620	EE	On-Demand	Anodyne	PDS	49	47
CC[C@@H](NC(=O)c1sccc1CC#N)c1ccccc1	ZINC000875115622	CH	On-Demand	Mild	TACR3	52	42
C[S@](=N)(=O)N1CCN(C(=O)C(=O)N[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000875115633	GC	On-Demand	Anodyne	SFRP1	61	35
C[S@](=N)(=O)N1CCN(C(=O)C(=O)N[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000875115637	GC	On-Demand	Anodyne	SFRP1	61	35
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875115648	GC	On-Demand	Anodyne	YARS	46	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875115648	GC	On-Demand	Anodyne	L3MBTL3	98	44
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875115666	ED	On-Demand	Anodyne	ACE	20	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875115666	ED	On-Demand	Anodyne	MME	33	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875115666	ED	On-Demand	Anodyne	GRIA1	47	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875115666	ED	On-Demand	Anodyne	YARS	51	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875115666	ED	On-Demand	Anodyne	ACE2	39	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875115666	ED	On-Demand	Anodyne	MARS	43	30
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875115667	ED	On-Demand	Anodyne	ACE	20	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875115667	ED	On-Demand	Anodyne	MME	33	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875115667	ED	On-Demand	Anodyne	GRIA1	47	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875115667	ED	On-Demand	Anodyne	YARS	51	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875115667	ED	On-Demand	Anodyne	ACE2	39	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875115667	ED	On-Demand	Anodyne	MARS	43	30
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875115672	GF	On-Demand	Anodyne	ADRB3	19	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875115672	GF	On-Demand	Anodyne	C3AR1	41	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875115672	GF	On-Demand	Anodyne	YARS	50	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875115678	GF	On-Demand	Anodyne	ADRB3	19	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875115678	GF	On-Demand	Anodyne	C3AR1	41	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875115678	GF	On-Demand	Anodyne	YARS	50	33
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875115682	DC	On-Demand	Mild	YARS	51	33
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875115684	DC	On-Demand	Mild	YARS	51	33
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875115686	DC	On-Demand	Mild	YARS	51	33
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875115688	DC	On-Demand	Mild	YARS	51	33
O=C1N[C@H](C(=O)N2CCCc3cc(C(F)(F)F)ccc32)CO1	ZINC000875115689	DE	On-Demand	Anodyne	LIPG	48	33
C=CCc1ccc(OC(=O)c2ccc(OC)c(S(=O)(=O)NC3CCCC3)c2)c(OC)c1	ZINC000875115697	IH	On-Demand	Mild	CCR8	17	40
O=C(NCCc1ccc(F)cc1F)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875115708	FD	On-Demand	Anodyne	HTR2A	15	42
O=C(NCCc1ccc(F)cc1F)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875115709	FD	On-Demand	Anodyne	HTR2A	15	42
O=C(NCCc1ccc(F)cc1F)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875115710	FD	On-Demand	Anodyne	HTR2A	15	42
O=C(NCCc1ccc(F)cc1F)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875115711	FD	On-Demand	Anodyne	HTR2A	15	42
O=C(NCc1nccs1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875115712	EF	On-Demand	Anodyne	CPT1A	67	36
O=C(NCc1nccs1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875115713	EF	On-Demand	Anodyne	CPT1A	67	36
O=C(NCc1nccs1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875115714	EF	On-Demand	Anodyne	CPT1A	67	36
O=C(NCc1nccs1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875115715	EF	On-Demand	Anodyne	CPT1A	67	36
O=CN1CCCN(C(=O)NCCOc2ccc(C(F)(F)F)cc2)CC1	ZINC000875115717	FD	On-Demand	Anodyne	EPHX2	16	40
O=C(NCCO)C1CCN(C(=O)NCCc2csc3ccccc23)CC1	ZINC000875115740	GD	On-Demand	Anodyne	MTNR1A	22	69
CCOC(=O)CCCCCCNC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875115741	FD	On-Demand	Anodyne	ASAH1	50	33
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)c1cccc(OCC)c1	ZINC000875115746	ED	On-Demand	Mild	ACACB	15	48
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)c1cccc(OCC)c1	ZINC000875115746	ED	On-Demand	Mild	PDS	51	43
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](C)c1cccc(OCC)c1	ZINC000875115747	ED	On-Demand	Mild	ACACB	15	48
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](C)c1cccc(OCC)c1	ZINC000875115747	ED	On-Demand	Mild	PDS	51	43
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)c1cccc(OCC)c1	ZINC000875115748	ED	On-Demand	Mild	ACACB	15	48
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)c1cccc(OCC)c1	ZINC000875115748	ED	On-Demand	Mild	PDS	51	43
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](C)c1cccc(OCC)c1	ZINC000875115749	ED	On-Demand	Mild	ACACB	15	48
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](C)c1cccc(OCC)c1	ZINC000875115749	ED	On-Demand	Mild	PDS	51	43
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)NCc1ncc(Br)s1	ZINC000875115751	GD	On-Demand	Anodyne	GRIA1	41	30
C=CC(C)(C)CCCNC(=O)C(=O)NCC1CCN(CC)CC1	ZINC000875115752	DD	On-Demand	Mild	CACNA1I	56	36
COCC(C)(C)CCNC(=O)C(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875115754	ED	On-Demand	Anodyne	GRIA1	48	36
COCC(C)(C)CCNC(=O)C(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875115755	ED	On-Demand	Anodyne	GRIA1	48	36
CCOc1cccc([C@@H](C)NC(=O)C(=O)N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)c1	ZINC000875115763	FE	On-Demand	Anodyne	FKBP1A	43	38
CCOc1cccc([C@H](C)NC(=O)C(=O)N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)c1	ZINC000875115765	FE	On-Demand	Anodyne	FKBP1A	43	38
CN1CCN(C2CCN(C(=O)C(=O)NCCc3ccc(F)cc3F)CC2)CC1	ZINC000875115768	GC	On-Demand	Anodyne	HTR2A	19	42
CN1CCN(C2CCN(C(=O)C(=O)NCCc3ccc(F)cc3F)CC2)CC1	ZINC000875115768	GC	On-Demand	Anodyne	L3MBTL3	53	38
NC(=O)[C@@H]1CC[C@H](CCC(=O)N2CCCc3cc(C(F)(F)F)ccc32)O1	ZINC000875115778	FF	On-Demand	Anodyne	LIPG	49	35
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)NCc1ccc(OC(F)F)cc1F	ZINC000875115781	GE	On-Demand	Anodyne	GRIA1	41	34
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875115787	DD	On-Demand	Anodyne	GRIA1	45	34
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875115787	DD	On-Demand	Anodyne	YARS	55	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875115789	DD	On-Demand	Anodyne	GRIA1	45	34
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875115789	DD	On-Demand	Anodyne	YARS	55	33
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](C)c1cccc(OCC)c1	ZINC000875115794	ED	On-Demand	Mild	PDS	17	40
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](C)c1cccc(OCC)c1	ZINC000875115795	ED	On-Demand	Mild	PDS	17	40
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H](C)c1cccc(OCC)c1	ZINC000875115796	ED	On-Demand	Mild	PDS	17	40
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H](C)c1cccc(OCC)c1	ZINC000875115797	ED	On-Demand	Mild	PDS	17	40
O=C(NCc1nnc2n1CCCC2)NNc1ccc(OCc2ccccc2)cc1	ZINC000875115802	GG	On-Demand	Reactive	LTA4H	36	42
O=C(NCc1nnc2n1CCCC2)NNc1ccc(OCc2ccccc2)cc1	ZINC000875115802	GG	On-Demand	Reactive	ADAM17	25	40
CCOC(=O)CCCCCCNC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875115816	DC	On-Demand	Anodyne	EPHX2	29	52
CCOC(=O)CCCCCCNC(=O)N[C@@H]1CCOC[C@@H]1O	ZINC000875115818	DC	On-Demand	Anodyne	EPHX2	29	52
CCOC(=O)CCCCCCNC(=O)N[C@H]1CCOC[C@H]1O	ZINC000875115819	DC	On-Demand	Anodyne	EPHX2	29	52
CCOC(=O)CCCCCCNC(=O)N[C@H]1CCOC[C@@H]1O	ZINC000875115821	DC	On-Demand	Anodyne	EPHX2	29	52
CCOC(=O)CCCCCCNC(=O)N1CC[C@H](O)[C@H]2CCCC[C@H]21	ZINC000875115829	FF	On-Demand	Anodyne	ASAH1	68	35
CCOC(=O)CCCCCCNC(=O)N1CC[C@H](O)[C@@H]2CCCC[C@@H]21	ZINC000875115830	FF	On-Demand	Anodyne	ASAH1	68	35
CCOC(=O)CCCCCCNC(=O)N1CC[C@H](O)[C@H]2CCCC[C@@H]21	ZINC000875115831	FF	On-Demand	Anodyne	ASAH1	68	35
CCOC(=O)CCCCCCNC(=O)N1CC[C@H](O)[C@@H]2CCCC[C@H]21	ZINC000875115832	FF	On-Demand	Anodyne	ASAH1	68	35
CCOC(=O)CCCCCCNC(=O)N1Cc2cccc(OC)c2C1	ZINC000875115833	EG	On-Demand	Anodyne	HTR1A	19	41
CCOC(=O)CCCCCCNC(=O)N1Cc2cccc(OC)c2C1	ZINC000875115833	EG	On-Demand	Anodyne	DRD2	22	41
CCOC(=O)CCCCCCNC(=O)N[C@@H]1COCC[C@H]1O	ZINC000875115838	DC	On-Demand	Anodyne	EPHX2	32	53
CCOC(=O)CCCCCCNC(=O)N1CCCCCCNC(=O)CC1	ZINC000875115843	FF	On-Demand	Anodyne	ASAH1	46	32
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)Cc2ccc(O)cc2)CC1	ZINC000875115851	ED	On-Demand	Anodyne	OPRM1	45	43
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)Cc2ccc(O)cc2)CC1	ZINC000875115851	ED	On-Demand	Anodyne	YARS	77	38
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)Cc2ccc(O)cc2)CC1	ZINC000875115853	ED	On-Demand	Anodyne	OPRM1	45	43
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)Cc2ccc(O)cc2)CC1	ZINC000875115853	ED	On-Demand	Anodyne	YARS	77	38
O=C(NCCOc1ccc(C(F)(F)F)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875115854	EE	On-Demand	Anodyne	EPHX2	15	40
CCOC(=O)CCCCCCNC(=O)N[C@H]1Cc2ccccc2NC1=O	ZINC000875115862	FE	On-Demand	Anodyne	EPHX2	22	46
CCOC(=O)CCCCCCNC(=O)N[C@@H]1Cc2ccccc2NC1=O	ZINC000875115864	FE	On-Demand	Anodyne	EPHX2	22	46
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)c(OC)c1	ZINC000875115866	JG	On-Demand	Mild	PKM	42	48
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)c(OC)c1	ZINC000875115866	JG	On-Demand	Mild	TGM2	34	44
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N1CCO[C@H]([C@@H]2COC(C)(C)O2)C1	ZINC000875115882	GC	On-Demand	Anodyne	YARS	41	32
CCOC(=O)CCCCCCNC(=O)N1C[C@H]2C(=O)N(C)C(=O)[C@H]2C1	ZINC000875115887	FC	On-Demand	Anodyne	ASAH1	64	35
CCOC(=O)CCCCCCNC(=O)N[C@@H]1COC[C@@H]1O	ZINC000875115889	DC	On-Demand	Anodyne	EPHX2	28	53
CCOC(=O)CCCCCCNC(=O)N1CCN(c2ccc(C#N)nc2)CC1	ZINC000875115891	GE	On-Demand	Mild	P2RY12	23	41
CC(C)c1cc([C@@H]2CCCN(C(=O)C(=O)N[C@@H](C)Cc3ccc(O)cc3)C2)n[nH]1	ZINC000875115914	GF	On-Demand	Anodyne	NTSR1	59	32
O=C(N[C@@H](c1ccccc1)c1cccc(Cl)c1)N1CCC2(CCNC2=O)CC1	ZINC000875115915	GH	On-Demand	Anodyne	CACNA1H	57	44
CC(C)c1cc([C@@H]2CCCN(C(=O)C(=O)N[C@H](C)Cc3ccc(O)cc3)C2)n[nH]1	ZINC000875115916	GF	On-Demand	Anodyne	NTSR1	59	32
O=C(N[C@H](c1ccccc1)c1cccc(Cl)c1)N1CCC2(CCNC2=O)CC1	ZINC000875115917	GH	On-Demand	Anodyne	CACNA1H	57	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCN(c3ccccc3)C2)C1	ZINC000875115920	ED	On-Demand	Anodyne	SLC6A1	43	32
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H]2CCN(c3ccccc3)C2)C1	ZINC000875115922	ED	On-Demand	Anodyne	SLC6A1	43	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000875115923	ED	On-Demand	Anodyne	SLC6A1	43	32
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000875115924	ED	On-Demand	Anodyne	SLC6A1	43	32
CC[C@H](NC(=O)c1c(C(F)(F)F)coc1C)c1ccccc1	ZINC000875115935	DI	On-Demand	Anodyne	TACR3	62	49
CCOC(=O)CCCCCCNC(=O)N1OC2CCC1CC2	ZINC000875115937	DF	On-Demand	Anodyne	EPHX2	15	48
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875115955	FD	On-Demand	Anodyne	OPRM1	38	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875115955	FD	On-Demand	Anodyne	NTSR1	96	35
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875115955	FD	On-Demand	Anodyne	NTSR2	68	32
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875115955	FD	On-Demand	Anodyne	HLA-A	46	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875115955	FD	On-Demand	Anodyne	SORT1	43	31
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875115955	FD	On-Demand	Anodyne	YARS	55	32
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875115955	FD	On-Demand	Anodyne	XIAP	28	40
CCOc1cccc([C@H](C)NC(=O)C(=O)NCCCCC2CC2)c1	ZINC000875115964	EF	On-Demand	Anodyne	PDS	60	42
CCOc1cccc([C@@H](C)NC(=O)C(=O)NCCCCC2CC2)c1	ZINC000875115965	EF	On-Demand	Anodyne	PDS	60	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875115968	ED	On-Demand	Anodyne	OPRM1	46	47
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875115968	ED	On-Demand	Anodyne	NTSR1	88	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875115968	ED	On-Demand	Anodyne	NTSR2	47	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875115968	ED	On-Demand	Anodyne	HLA-A	45	31
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875115968	ED	On-Demand	Anodyne	YARS	62	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875115968	ED	On-Demand	Anodyne	DPP7	46	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875115969	ED	On-Demand	Anodyne	OPRM1	46	47
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875115969	ED	On-Demand	Anodyne	NTSR1	88	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875115969	ED	On-Demand	Anodyne	NTSR2	47	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875115969	ED	On-Demand	Anodyne	HLA-A	45	31
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875115969	ED	On-Demand	Anodyne	YARS	62	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875115969	ED	On-Demand	Anodyne	DPP7	46	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875115970	ED	On-Demand	Anodyne	OPRM1	46	47
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875115970	ED	On-Demand	Anodyne	NTSR1	88	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875115970	ED	On-Demand	Anodyne	NTSR2	47	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875115970	ED	On-Demand	Anodyne	HLA-A	45	31
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875115970	ED	On-Demand	Anodyne	YARS	62	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875115970	ED	On-Demand	Anodyne	DPP7	46	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875115971	ED	On-Demand	Anodyne	OPRM1	46	47
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875115971	ED	On-Demand	Anodyne	NTSR1	88	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875115971	ED	On-Demand	Anodyne	NTSR2	47	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875115971	ED	On-Demand	Anodyne	HLA-A	45	31
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875115971	ED	On-Demand	Anodyne	YARS	62	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875115971	ED	On-Demand	Anodyne	DPP7	46	33
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1CCN(CC)CC1	ZINC000875115985	DC	On-Demand	Mild	CACNA1I	45	33
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1CCN(CC)CC1	ZINC000875115986	DC	On-Demand	Mild	CACNA1I	45	33
CC(=O)C1CCN(C(=O)NCCc2csc3ccccc23)CC1	ZINC000875116012	EG	On-Demand	Anodyne	MTNR1A	24	60
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)NCc1ccc(C2(C)OCCO2)cc1	ZINC000875116014	GD	On-Demand	Anodyne	YARS	71	32
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875116062	ED	On-Demand	Anodyne	NTSR1	42	33
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875116062	ED	On-Demand	Anodyne	YARS	56	34
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875116063	ED	On-Demand	Anodyne	NTSR1	42	33
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875116063	ED	On-Demand	Anodyne	YARS	56	34
CCOc1cccc([C@H](C)NC(=O)C(=O)NCc2ncc(Cl)s2)c1	ZINC000875116068	FF	On-Demand	Anodyne	PDS	64	43
CCOc1cccc([C@@H](C)NC(=O)C(=O)NCc2ncc(Cl)s2)c1	ZINC000875116069	FF	On-Demand	Anodyne	PDS	64	43
C=CC(C)(C)CCCNC(=O)C(=O)NCC1CCN(CCC)CC1	ZINC000875116074	EE	On-Demand	Mild	CACNA1I	54	39
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1	ZINC000875116078	GC	On-Demand	Anodyne	YARS	61	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875116113	ED	On-Demand	Anodyne	OPRM1	41	39
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875116113	ED	On-Demand	Anodyne	NTSR1	59	32
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875116113	ED	On-Demand	Anodyne	YARS	46	32
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875116114	ED	On-Demand	Anodyne	OPRM1	41	39
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875116114	ED	On-Demand	Anodyne	NTSR1	59	32
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875116114	ED	On-Demand	Anodyne	YARS	46	32
CCOc1cccc([C@H](C)NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)c1	ZINC000875116125	EE	On-Demand	Anodyne	CTSK	25	40
CCOc1cccc([C@@H](C)NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)c1	ZINC000875116126	EE	On-Demand	Anodyne	CTSK	25	40
CCOc1cccc([C@@H](C)NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)c1	ZINC000875116127	EE	On-Demand	Anodyne	CTSK	25	40
CCOc1cccc([C@H](C)NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)c1	ZINC000875116128	EE	On-Demand	Anodyne	CTSK	25	40
CC(=O)[C@H]1CCCN(C(=O)NCCc2csc3ccccc23)C1	ZINC000875116133	EG	On-Demand	Anodyne	MTNR1A	21	63
CC(=O)[C@@H]1CCCN(C(=O)NCCc2csc3ccccc23)C1	ZINC000875116134	EG	On-Demand	Anodyne	MTNR1A	21	63
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)NCC[C@@H]1CCSC1	ZINC000875116141	ED	On-Demand	Anodyne	GRIA1	43	34
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(=O)NCC[C@H]1CCSC1	ZINC000875116142	ED	On-Demand	Anodyne	GRIA1	43	34
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116185	GE	On-Demand	Anodyne	DRD4	24	45
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116185	GE	On-Demand	Anodyne	ACHE	28	41
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116185	GE	On-Demand	Anodyne	SLC6A1	51	32
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116185	GE	On-Demand	Anodyne	SIGMAR1	33	43
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116185	GE	On-Demand	Anodyne	CCR3	25	45
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116187	GE	On-Demand	Anodyne	DRD4	24	45
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116187	GE	On-Demand	Anodyne	ACHE	28	41
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116187	GE	On-Demand	Anodyne	SLC6A1	51	32
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116187	GE	On-Demand	Anodyne	SIGMAR1	33	43
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116187	GE	On-Demand	Anodyne	CCR3	25	45
CCOCCCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875116207	EH	On-Demand	Anodyne	HTR1A	28	40
CCOCCCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875116207	EH	On-Demand	Anodyne	DRD2	33	45
CCOCCCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875116207	EH	On-Demand	Anodyne	DRD4	15	43
CCOCCCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875116207	EH	On-Demand	Anodyne	DRD3	37	41
CCOCCCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875116208	EH	On-Demand	Anodyne	HTR1A	28	40
CCOCCCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875116208	EH	On-Demand	Anodyne	DRD2	33	45
CCOCCCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875116208	EH	On-Demand	Anodyne	DRD4	15	43
CCOCCCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875116208	EH	On-Demand	Anodyne	DRD3	37	41
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116224	GE	On-Demand	Anodyne	DRD4	23	43
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116224	GE	On-Demand	Anodyne	ACHE	34	46
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116224	GE	On-Demand	Anodyne	SLC6A1	62	32
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116224	GE	On-Demand	Anodyne	SIGMAR1	27	48
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116224	GE	On-Demand	Anodyne	CCR3	24	49
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116226	GE	On-Demand	Anodyne	DRD4	23	43
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116226	GE	On-Demand	Anodyne	ACHE	34	46
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116226	GE	On-Demand	Anodyne	SLC6A1	62	32
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116226	GE	On-Demand	Anodyne	SIGMAR1	27	48
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116226	GE	On-Demand	Anodyne	CCR3	24	49
COc1cccc(C(C)(C)C(=O)N(C)[C@H](C)C(C)C)c1	ZINC000875116227	CG	On-Demand	Anodyne	MTNR1A	23	40
COc1cccc(C(C)(C)C(=O)N(C)[C@H](C)C(C)C)c1	ZINC000875116227	CG	On-Demand	Anodyne	MTNR1B	25	40
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116228	GE	On-Demand	Anodyne	DRD4	23	43
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116228	GE	On-Demand	Anodyne	ACHE	34	46
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116228	GE	On-Demand	Anodyne	SLC6A1	62	32
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116228	GE	On-Demand	Anodyne	SIGMAR1	27	48
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116228	GE	On-Demand	Anodyne	CCR3	24	49
COc1cccc(C(C)(C)C(=O)N(C)[C@@H](C)C(C)C)c1	ZINC000875116229	CG	On-Demand	Anodyne	MTNR1A	23	40
COc1cccc(C(C)(C)C(=O)N(C)[C@@H](C)C(C)C)c1	ZINC000875116229	CG	On-Demand	Anodyne	MTNR1B	25	40
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116230	GE	On-Demand	Anodyne	DRD4	23	43
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116230	GE	On-Demand	Anodyne	ACHE	34	46
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116230	GE	On-Demand	Anodyne	SLC6A1	62	32
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116230	GE	On-Demand	Anodyne	SIGMAR1	27	48
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116230	GE	On-Demand	Anodyne	CCR3	24	49
NC(=O)c1ccc(CC(=O)N2CCCc3cc(C(F)(F)F)ccc32)cn1	ZINC000875116235	FF	On-Demand	Anodyne	LIPG	42	34
NC(=O)c1ccc(CC(=O)N2CCCc3cc(C(F)(F)F)ccc32)cn1	ZINC000875116235	FF	On-Demand	Anodyne	EIF2AK3	70	43
CCCCCCCNC(=O)C(=O)NCC1CCN(CC)CC1	ZINC000875116245	DD	On-Demand	Mild	HTR4	45	40
CCCCCCCNC(=O)C(=O)NCC1CCN(CC)CC1	ZINC000875116245	DD	On-Demand	Mild	CACNA1I	52	34
CCCCCCCNC(=O)C(=O)NCC1CCN(CC)CC1	ZINC000875116245	DD	On-Demand	Mild	ASAH1	80	37
COC(=O)N(C)NC(=O)NCCc1csc2ccccc12	ZINC000875116259	DE	On-Demand	Reactive	MTNR1A	46	52
COC(=O)N(C)NC(=O)NCCc1csc2ccccc12	ZINC000875116259	DE	On-Demand	Reactive	MTNR1B	21	45
O=C(NCCSC(F)(F)F)N1CC(c2ccccc2)C1	ZINC000875116262	DG	On-Demand	Anodyne	RBP4	64	41
CCO[C@H](C(=O)N1CCCc2cc(C(F)(F)F)ccc21)[C@H]1CCOC1	ZINC000875116304	FG	On-Demand	Anodyne	LIPG	45	36
CCO[C@H](C(=O)N1CCCc2cc(C(F)(F)F)ccc21)[C@@H]1CCOC1	ZINC000875116305	FG	On-Demand	Anodyne	LIPG	45	36
CCO[C@@H](C(=O)N1CCCc2cc(C(F)(F)F)ccc21)[C@@H]1CCOC1	ZINC000875116306	FG	On-Demand	Anodyne	LIPG	45	36
CCO[C@@H](C(=O)N1CCCc2cc(C(F)(F)F)ccc21)[C@H]1CCOC1	ZINC000875116307	FG	On-Demand	Anodyne	LIPG	45	36
Cc1ccnn1CC(=O)N1CCCc2cc(C(F)(F)F)ccc21	ZINC000875116308	DG	On-Demand	Anodyne	LIPG	45	32
Cc1ccnn1CC(=O)N1CCCc2cc(C(F)(F)F)ccc21	ZINC000875116308	DG	On-Demand	Anodyne	EIF2AK3	32	49
CCOc1cccc([C@H](C)NC(=O)C(=O)NCC2(OC(C)C)CCC2)c1	ZINC000875116325	FF	On-Demand	Anodyne	PDS	28	40
CCOc1cccc([C@@H](C)NC(=O)C(=O)NCC2(OC(C)C)CCC2)c1	ZINC000875116326	FF	On-Demand	Anodyne	PDS	28	40
CCOCCCCNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875116345	EG	On-Demand	Anodyne	EPHX2	16	40
COC(=O)C1(O)CN(C(=O)NCCc2cccc(OC)c2OC)C1	ZINC000875116352	EC	On-Demand	Anodyne	MTNR1A	47	40
COCCN(CC1CCN(C)CC1)C(=O)NCCc1cccc(OC)c1OC	ZINC000875116358	GE	On-Demand	Anodyne	ACKR3	70	36
CCOCCCCNC(=O)N1CC([C@@H](C)C(=O)OCC)C1	ZINC000875116370	DD	On-Demand	Anodyne	EPHX2	17	41
CCOCCCCNC(=O)N1CC([C@H](C)C(=O)OCC)C1	ZINC000875116371	DD	On-Demand	Anodyne	EPHX2	17	41
CN1CCN(C2CCN(C(=O)NCCc3csc4ccccc34)CC2)CC1	ZINC000875116403	GF	On-Demand	Anodyne	MTNR1A	17	54
CN1CCN(C2CCN(C(=O)NCCc3csc4ccccc34)CC2)CC1	ZINC000875116403	GF	On-Demand	Anodyne	FFAR2	49	32
CN1CCN(C2CCN(C(=O)NCCc3csc4ccccc34)CC2)CC1	ZINC000875116403	GF	On-Demand	Anodyne	L3MBTL3	51	38
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1cccc([N+](=O)[O-])c1	ZINC000875116410	DF	On-Demand	Bother	CACNA1C	39	41
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1cccc([N+](=O)[O-])c1	ZINC000875116410	DF	On-Demand	Bother	CACNA1D	60	41
CCOCCCCNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875116417	EF	On-Demand	Mild	ITK	18	50
CCOCCCCNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875116417	EF	On-Demand	Mild	PANC	54	36
CC[C@H](C[C@H](C)O)NC(=O)NCCc1cccc(OC)c1OC	ZINC000875116428	DE	On-Demand	Anodyne	NQO2	34	43
CC[C@H](C[C@H](C)O)NC(=O)NCCc1cccc(OC)c1OC	ZINC000875116428	DE	On-Demand	Anodyne	MTNR1A	55	43
COC(=O)c1ccc(CC(=O)N2CCCc3cc(C(F)(F)F)ccc32)cn1	ZINC000875116439	GG	On-Demand	Anodyne	LIPG	48	34
COC(=O)c1ccc(CC(=O)N2CCCc3cc(C(F)(F)F)ccc32)cn1	ZINC000875116439	GG	On-Demand	Anodyne	EIF2AK3	72	41
CCOCCCCNC(=O)NC1([C@@H]2CCCCO2)CCC1	ZINC000875116440	CF	On-Demand	Anodyne	EPHX2	21	49
CCOCCCCNC(=O)NC1([C@H]2CCCCO2)CCC1	ZINC000875116442	CF	On-Demand	Anodyne	EPHX2	21	49
CCOCCCCNC(=O)NCCN1CCOC[C@@H]1CC	ZINC000875116450	DD	On-Demand	Anodyne	EPHX2	16	43
CCOCCCCNC(=O)NCCN1CCOC[C@H]1CC	ZINC000875116452	DD	On-Demand	Anodyne	EPHX2	16	43
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116462	FD	On-Demand	Mild	DRD4	21	44
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116462	FD	On-Demand	Mild	ACHE	21	41
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116462	FD	On-Demand	Mild	SLC6A1	113	35
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116462	FD	On-Demand	Mild	HTR4	31	41
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116462	FD	On-Demand	Mild	SIGMAR1	25	44
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116462	FD	On-Demand	Mild	CCR3	23	44
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116464	FD	On-Demand	Mild	DRD4	21	44
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116464	FD	On-Demand	Mild	ACHE	21	41
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116464	FD	On-Demand	Mild	SLC6A1	113	35
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116464	FD	On-Demand	Mild	HTR4	31	41
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116464	FD	On-Demand	Mild	SIGMAR1	25	44
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116464	FD	On-Demand	Mild	CCR3	23	44
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116466	FD	On-Demand	Mild	DRD4	21	44
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116466	FD	On-Demand	Mild	ACHE	21	41
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116466	FD	On-Demand	Mild	SLC6A1	113	35
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116466	FD	On-Demand	Mild	HTR4	31	41
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116466	FD	On-Demand	Mild	SIGMAR1	25	44
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116466	FD	On-Demand	Mild	CCR3	23	44
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116468	FD	On-Demand	Mild	DRD4	21	44
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116468	FD	On-Demand	Mild	ACHE	21	41
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116468	FD	On-Demand	Mild	SLC6A1	113	35
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116468	FD	On-Demand	Mild	HTR4	31	41
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116468	FD	On-Demand	Mild	SIGMAR1	25	44
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116468	FD	On-Demand	Mild	CCR3	23	44
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116480	GE	On-Demand	Anodyne	DRD2	24	46
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116480	GE	On-Demand	Anodyne	DRD4	33	49
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116480	GE	On-Demand	Anodyne	ACHE	41	42
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116480	GE	On-Demand	Anodyne	SLC6A1	92	33
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116480	GE	On-Demand	Anodyne	DRD3	24	46
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116480	GE	On-Demand	Anodyne	HTR4	39	42
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116480	GE	On-Demand	Anodyne	SIGMAR1	36	45
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116480	GE	On-Demand	Anodyne	CCR3	33	47
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116480	GE	On-Demand	Anodyne	CACNA1I	54	35
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116483	GE	On-Demand	Anodyne	DRD2	24	46
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116483	GE	On-Demand	Anodyne	DRD4	33	49
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116483	GE	On-Demand	Anodyne	ACHE	41	42
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116483	GE	On-Demand	Anodyne	SLC6A1	92	33
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116483	GE	On-Demand	Anodyne	DRD3	24	46
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116483	GE	On-Demand	Anodyne	HTR4	39	42
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116483	GE	On-Demand	Anodyne	SIGMAR1	36	45
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116483	GE	On-Demand	Anodyne	CCR3	33	47
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116483	GE	On-Demand	Anodyne	CACNA1I	54	35
O=C1CC[C@H](C(=O)N2CCCc3cc(C(F)(F)F)ccc32)O1	ZINC000875116490	DF	On-Demand	Anodyne	LIPG	49	33
C=CCc1ccc(OC(=O)c2cccc(S(=O)(=O)N3CCN(C(C)=O)CC3)c2)c(OC)c1	ZINC000875116502	JE	On-Demand	Mild	TGM2	57	35
C=CCc1ccc(OC(=O)c2cccc(S(=O)(=O)N3CCN(C(C)=O)CC3)c2)c(OC)c1	ZINC000875116502	JE	On-Demand	Mild	F13A1	66	41
C=CCc1ccc(OC(=O)c2cccc(S(=O)(=O)N3CCN(C(C)=O)CC3)c2)c(OC)c1	ZINC000875116502	JE	On-Demand	Mild	AKR1C3	57	46
CCOCCCCNC(=O)NCC[C@H](O)C1CCCC1	ZINC000875116523	CE	On-Demand	Anodyne	EPHX2	23	46
CCOCCCCNC(=O)NCC[C@@H](O)C1CCCC1	ZINC000875116524	CE	On-Demand	Anodyne	EPHX2	23	46
CCOCCCCNC(=O)N1Cc2cccc(O)c2C1	ZINC000875116553	CE	On-Demand	Clean	ASAH1	60	32
COC(=O)N(C)NC(=O)NCCc1cccc(OC)c1OC	ZINC000875116568	DD	On-Demand	Reactive	NQO2	47	47
COC(=O)N(C)NC(=O)NCCc1cccc(OC)c1OC	ZINC000875116568	DD	On-Demand	Reactive	MTNR1A	78	51
COC(=O)N(C)NC(=O)NCCc1cccc(OC)c1OC	ZINC000875116568	DD	On-Demand	Reactive	MTNR1B	48	47
C=CCc1ccc(OC(=O)c2ccc3nccnc3c2)c(OC)c1	ZINC000875116571	DH	On-Demand	Mild	ACR	18	60
C=CCc1ccc(OC(=O)c2ccc3nccnc3c2)c(OC)c1	ZINC000875116571	DH	On-Demand	Mild	DRTS_TRYCR	46	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116584	GD	On-Demand	Anodyne	DRD2	15	46
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116584	GD	On-Demand	Anodyne	DRD4	25	44
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116584	GD	On-Demand	Anodyne	ACHE	29	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116584	GD	On-Demand	Anodyne	SLC6A1	109	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116584	GD	On-Demand	Anodyne	HTR4	29	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116584	GD	On-Demand	Anodyne	SIGMAR1	35	46
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116584	GD	On-Demand	Anodyne	CCR3	33	48
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116584	GD	On-Demand	Anodyne	BIRC2	17	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116585	GD	On-Demand	Anodyne	DRD2	15	46
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116585	GD	On-Demand	Anodyne	DRD4	25	44
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116585	GD	On-Demand	Anodyne	ACHE	29	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116585	GD	On-Demand	Anodyne	SLC6A1	109	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116585	GD	On-Demand	Anodyne	HTR4	29	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116585	GD	On-Demand	Anodyne	SIGMAR1	35	46
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116585	GD	On-Demand	Anodyne	CCR3	33	48
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116585	GD	On-Demand	Anodyne	BIRC2	17	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116586	GD	On-Demand	Anodyne	DRD2	15	46
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116586	GD	On-Demand	Anodyne	DRD4	25	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116586	GD	On-Demand	Anodyne	ACHE	29	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116586	GD	On-Demand	Anodyne	SLC6A1	109	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116586	GD	On-Demand	Anodyne	HTR4	29	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116586	GD	On-Demand	Anodyne	SIGMAR1	35	46
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116586	GD	On-Demand	Anodyne	CCR3	33	48
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116586	GD	On-Demand	Anodyne	BIRC2	17	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116587	GD	On-Demand	Anodyne	DRD2	15	46
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116587	GD	On-Demand	Anodyne	DRD4	25	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116587	GD	On-Demand	Anodyne	ACHE	29	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116587	GD	On-Demand	Anodyne	SLC6A1	109	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116587	GD	On-Demand	Anodyne	HTR4	29	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116587	GD	On-Demand	Anodyne	SIGMAR1	35	46
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116587	GD	On-Demand	Anodyne	CCR3	33	48
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875116587	GD	On-Demand	Anodyne	BIRC2	17	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2cccc(OC)c2OC)C1	ZINC000875116608	FE	On-Demand	Anodyne	NQO2	24	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2cccc(OC)c2OC)C1	ZINC000875116608	FE	On-Demand	Anodyne	MTNR1A	37	40
CCOCCCCNC(=O)NNc1ccc(OC)cc1Br	ZINC000875116629	FF	On-Demand	Reactive	MTNR1A	46	43
CCOCCCCNC(=O)NNc1ccc(OC)cc1Br	ZINC000875116629	FF	On-Demand	Reactive	MTNR1B	36	43
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875116637	GE	On-Demand	Anodyne	DRD4	24	43
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875116637	GE	On-Demand	Anodyne	SIGMAR1	34	48
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875116637	GE	On-Demand	Anodyne	CCR3	29	49
COc1ccccc1[C@H]1CCCN(C(=O)NCc2nccs2)CC1	ZINC000875116690	EH	On-Demand	Anodyne	EPHX2	15	44
COc1ccccc1[C@H]1CCCN(C(=O)NCc2nccs2)CC1	ZINC000875116690	EH	On-Demand	Anodyne	RBP4	29	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2nccs2)CC1	ZINC000875116691	EH	On-Demand	Anodyne	EPHX2	15	44
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2nccs2)CC1	ZINC000875116691	EH	On-Demand	Anodyne	RBP4	29	41
CCOCCCCNC(=O)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875116724	CE	On-Demand	Anodyne	EPHX2	21	47
CCOCCCCNC(=O)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875116725	CE	On-Demand	Anodyne	EPHX2	21	47
CCOCCCCNC(=O)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875116726	CE	On-Demand	Anodyne	EPHX2	21	47
CCOCCCCNC(=O)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875116727	CE	On-Demand	Anodyne	EPHX2	21	47
CC[C@@H](NC(=O)NCc1nccs1)[C@@H](O)c1ccccc1	ZINC000875116737	DE	On-Demand	Anodyne	MAP1	44	36
CC[C@@H](NC(=O)NCc1nccs1)[C@H](O)c1ccccc1	ZINC000875116738	DE	On-Demand	Anodyne	MAP1	44	36
CCOCCCCNC(=O)N[C@@H]1C[C@H]2C[C@@]2(C(=O)OC)C1	ZINC000875116756	CD	On-Demand	Anodyne	EPHX2	28	49
CC(=O)C1CCN(C(=O)NCc2cccc(C(=O)NCc3ccco3)c2)CC1	ZINC000875116765	GF	On-Demand	Anodyne	CHRM3	15	41
CCOCCCCNC(=O)N[C@@H]1CC(C)(C)CC[C@H]1O	ZINC000875116785	CE	On-Demand	Anodyne	EPHX2	25	51
C[C@H](NC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1)c1ccnn1C	ZINC000875116790	GD	On-Demand	Anodyne	DRD4	20	41
C[C@H](NC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1)c1ccnn1C	ZINC000875116790	GD	On-Demand	Anodyne	SLC6A1	86	34
C[C@H](NC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1)c1ccnn1C	ZINC000875116790	GD	On-Demand	Anodyne	HTR4	40	42
C[C@H](NC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1)c1ccnn1C	ZINC000875116790	GD	On-Demand	Anodyne	SIGMAR1	24	43
C[C@H](NC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1)c1ccnn1C	ZINC000875116790	GD	On-Demand	Anodyne	CCR3	46	39
C[C@H](NC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1)c1ccnn1C	ZINC000875116792	GD	On-Demand	Anodyne	DRD4	20	41
C[C@H](NC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1)c1ccnn1C	ZINC000875116792	GD	On-Demand	Anodyne	SLC6A1	86	34
C[C@H](NC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1)c1ccnn1C	ZINC000875116792	GD	On-Demand	Anodyne	HTR4	40	42
C[C@H](NC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1)c1ccnn1C	ZINC000875116792	GD	On-Demand	Anodyne	SIGMAR1	24	43
C[C@H](NC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1)c1ccnn1C	ZINC000875116792	GD	On-Demand	Anodyne	CCR3	46	39
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)c1cccc([N+](=O)[O-])c1	ZINC000875116801	GH	On-Demand	Bother	CACNA1D	40	35
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)c1cccc([N+](=O)[O-])c1	ZINC000875116802	GH	On-Demand	Bother	CACNA1D	40	35
CCOCCCCNC(=O)N(CC)[C@@H](C)[C@@H](O)c1ccccc1	ZINC000875116803	DF	On-Demand	Anodyne	NPY5R	22	41
CCOCCCCNC(=O)N(CC)[C@H](C)[C@@H](O)c1ccccc1	ZINC000875116804	DF	On-Demand	Anodyne	NPY5R	22	41
CCOCCCCNC(=O)N(CC)[C@@H](C)[C@H](O)c1ccccc1	ZINC000875116805	DF	On-Demand	Anodyne	NPY5R	22	41
CCOCCCCNC(=O)N(CC)[C@H](C)[C@H](O)c1ccccc1	ZINC000875116806	DF	On-Demand	Anodyne	NPY5R	22	41
CC[C@@H]1COCCN1CCNC(=O)NCCc1cccc(OC)c1OC	ZINC000875116809	FD	On-Demand	Anodyne	MTNR1A	31	40
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875116812	FE	On-Demand	Anodyne	DRD2	15	48
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875116812	FE	On-Demand	Anodyne	DRD4	26	42
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875116812	FE	On-Demand	Anodyne	SLC6A1	55	33
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875116812	FE	On-Demand	Anodyne	SIGMAR1	41	48
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875116812	FE	On-Demand	Anodyne	CCR3	27	48
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875116813	FE	On-Demand	Anodyne	DRD2	15	48
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875116813	FE	On-Demand	Anodyne	DRD4	26	42
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875116813	FE	On-Demand	Anodyne	SLC6A1	55	33
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875116813	FE	On-Demand	Anodyne	SIGMAR1	41	48
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875116813	FE	On-Demand	Anodyne	CCR3	27	48
CCOCCCCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875116830	EG	On-Demand	Anodyne	FKBP1A	58	42
CCOCCCCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875116830	EG	On-Demand	Anodyne	AMY2	47	33
CCOCCCCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875116831	EG	On-Demand	Anodyne	FKBP1A	58	42
CCOCCCCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875116831	EG	On-Demand	Anodyne	AMY2	47	33
CCOCCCCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875116832	EG	On-Demand	Anodyne	FKBP1A	58	42
CCOCCCCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875116832	EG	On-Demand	Anodyne	AMY2	47	33
CCOCCCCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875116833	EG	On-Demand	Anodyne	FKBP1A	58	42
CCOCCCCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875116833	EG	On-Demand	Anodyne	AMY2	47	33
O=C(NCc1nccs1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875116853	DF	On-Demand	Anodyne	EPHX2	17	42
O=C(NCc1nccs1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875116854	DF	On-Demand	Anodyne	EPHX2	17	42
CCOCCCCNC(=O)NC1(C)CC(F)(F)C1	ZINC000875116856	CE	On-Demand	Anodyne	EPHX2	25	53
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1	ZINC000875116870	GF	On-Demand	Bother	CACNA1C	53	38
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1	ZINC000875116870	GF	On-Demand	Bother	CACNA1D	78	36
COCCN(CC1CCN(C)CC1)C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1	ZINC000875116871	GF	On-Demand	Bother	CACNA1C	53	38
COCCN(CC1CCN(C)CC1)C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1	ZINC000875116871	GF	On-Demand	Bother	CACNA1D	78	36
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116877	GD	On-Demand	Mild	DRD2	20	46
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116877	GD	On-Demand	Mild	DRD4	26	46
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116877	GD	On-Demand	Mild	ACHE	23	43
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116877	GD	On-Demand	Mild	SLC6A1	107	35
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116877	GD	On-Demand	Mild	DRD3	20	46
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116877	GD	On-Demand	Mild	HTR4	37	43
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116877	GD	On-Demand	Mild	SIGMAR1	27	44
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116877	GD	On-Demand	Mild	CCR3	25	44
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116878	GD	On-Demand	Mild	DRD2	20	46
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116878	GD	On-Demand	Mild	DRD4	26	46
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116878	GD	On-Demand	Mild	ACHE	23	43
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116878	GD	On-Demand	Mild	SLC6A1	107	35
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116878	GD	On-Demand	Mild	DRD3	20	46
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116878	GD	On-Demand	Mild	HTR4	37	43
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116878	GD	On-Demand	Mild	SIGMAR1	27	44
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116878	GD	On-Demand	Mild	CCR3	25	44
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116879	GD	On-Demand	Mild	DRD2	20	46
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116879	GD	On-Demand	Mild	DRD4	26	46
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116879	GD	On-Demand	Mild	ACHE	23	43
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116879	GD	On-Demand	Mild	SLC6A1	107	35
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116879	GD	On-Demand	Mild	DRD3	20	46
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116879	GD	On-Demand	Mild	HTR4	37	43
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116879	GD	On-Demand	Mild	SIGMAR1	27	44
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875116879	GD	On-Demand	Mild	CCR3	25	44
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116880	GD	On-Demand	Mild	DRD2	20	46
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116880	GD	On-Demand	Mild	DRD4	26	46
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116880	GD	On-Demand	Mild	ACHE	23	43
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116880	GD	On-Demand	Mild	SLC6A1	107	35
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116880	GD	On-Demand	Mild	DRD3	20	46
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116880	GD	On-Demand	Mild	HTR4	37	43
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116880	GD	On-Demand	Mild	SIGMAR1	27	44
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875116880	GD	On-Demand	Mild	CCR3	25	44
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875116882	GD	On-Demand	Anodyne	DRD2	15	47
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875116882	GD	On-Demand	Anodyne	DRD4	27	44
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875116882	GD	On-Demand	Anodyne	ACHE	28	41
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875116882	GD	On-Demand	Anodyne	SLC6A1	80	33
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875116882	GD	On-Demand	Anodyne	HTR4	30	41
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875116882	GD	On-Demand	Anodyne	HRH3	15	40
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875116882	GD	On-Demand	Anodyne	SIGMAR1	38	47
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875116882	GD	On-Demand	Anodyne	CCR3	38	49
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875116883	GD	On-Demand	Anodyne	DRD2	15	47
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875116883	GD	On-Demand	Anodyne	DRD4	27	44
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875116883	GD	On-Demand	Anodyne	ACHE	28	41
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875116883	GD	On-Demand	Anodyne	SLC6A1	80	33
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875116883	GD	On-Demand	Anodyne	HTR4	30	41
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875116883	GD	On-Demand	Anodyne	HRH3	15	40
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875116883	GD	On-Demand	Anodyne	SIGMAR1	38	47
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875116883	GD	On-Demand	Anodyne	CCR3	38	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nccs1	ZINC000875116884	CD	On-Demand	Anodyne	SLC6A4	23	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nccs1	ZINC000875116884	CD	On-Demand	Anodyne	SLC6A3	41	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nccs1	ZINC000875116885	CD	On-Demand	Anodyne	SLC6A4	23	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nccs1	ZINC000875116885	CD	On-Demand	Anodyne	SLC6A3	41	38
C[C@@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1cccc([N+](=O)[O-])c1	ZINC000875116895	GE	On-Demand	Bother	CACNA1D	46	36
C[C@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1cccc([N+](=O)[O-])c1	ZINC000875116896	GE	On-Demand	Bother	CACNA1D	46	36
CCOCCCCNC(=O)N[C@]12CCC[C@H]1N(C(=O)OC(C)(C)C)CC2	ZINC000875116925	FG	On-Demand	Anodyne	EPHX2	16	43
CCOCCCCNC(=O)N[C@@]12CCC[C@H]1N(C(=O)OC(C)(C)C)CC2	ZINC000875116926	FG	On-Demand	Anodyne	EPHX2	16	43
CCOCCCCNC(=O)N[C@@]12CCC[C@@H]1N(C(=O)OC(C)(C)C)CC2	ZINC000875116927	FG	On-Demand	Anodyne	EPHX2	16	43
CCOCCCCNC(=O)N[C@]12CCC[C@@H]1N(C(=O)OC(C)(C)C)CC2	ZINC000875116928	FG	On-Demand	Anodyne	EPHX2	16	43
CCOCCCCNC(=O)NC1CC(C(=O)OC)C1	ZINC000875116946	CD	On-Demand	Anodyne	EPHX2	31	50
CCOCCCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875116957	DF	On-Demand	Anodyne	ACE	34	40
CCOCCCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875116957	DF	On-Demand	Anodyne	TRY1_BOVIN	49	35
CCOCCCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875116957	DF	On-Demand	Anodyne	AMY2	45	32
CCOCCCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875116958	DF	On-Demand	Anodyne	ACE	34	40
CCOCCCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875116958	DF	On-Demand	Anodyne	TRY1_BOVIN	49	35
CCOCCCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875116958	DF	On-Demand	Anodyne	AMY2	45	32
CCOCCCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875116959	DF	On-Demand	Anodyne	ACE	34	40
CCOCCCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875116959	DF	On-Demand	Anodyne	TRY1_BOVIN	49	35
CCOCCCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875116959	DF	On-Demand	Anodyne	AMY2	45	32
CCOCCCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875116960	DF	On-Demand	Anodyne	ACE	34	40
CCOCCCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875116960	DF	On-Demand	Anodyne	TRY1_BOVIN	49	35
CCOCCCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875116960	DF	On-Demand	Anodyne	AMY2	45	32
CCOCCCCNC(=O)N1CCCC[C@@H]1CNC(=O)NC	ZINC000875116983	DD	On-Demand	Anodyne	EPHX2	15	43
CCOCCCCNC(=O)N1CCCC[C@H]1CNC(=O)NC	ZINC000875116984	DD	On-Demand	Anodyne	EPHX2	15	43
CCN(C(=O)c1ccnc(OCCN(C)C)c1)c1ccc(Cl)cc1	ZINC000875116985	EG	On-Demand	Anodyne	GPBAR1	15	40
CCN(C(=O)c1ccnc(OCCN(C)C)c1)c1ccc(Cl)cc1	ZINC000875116985	EG	On-Demand	Anodyne	UTS2	40	31
CC[C@@H](NC(=O)NCc1ccc(Cl)nc1)[C@H](O)c1ccccc1	ZINC000875117019	EG	On-Demand	Anodyne	NACHRBETA2	17	40
CC[C@@H](NC(=O)NCc1ccc(Cl)nc1)[C@H](O)c1ccccc1	ZINC000875117019	EG	On-Demand	Anodyne	PDS	54	37
CC[C@@H](NC(=O)NCc1ccc(Cl)nc1)[C@@H](O)c1ccccc1	ZINC000875117022	EG	On-Demand	Anodyne	NACHRBETA2	17	40
CC[C@@H](NC(=O)NCc1ccc(Cl)nc1)[C@@H](O)c1ccccc1	ZINC000875117022	EG	On-Demand	Anodyne	PDS	54	37
CCOCCCCNC(=O)NC1CC(Nc2ccccc2)C1	ZINC000875117034	DF	On-Demand	Anodyne	EPHX2	45	44
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NCc1ccc(Cl)nc1	ZINC000875117044	FG	On-Demand	Anodyne	NACHRBETA2	17	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc([C@H]2C[C@H]2C)o1	ZINC000875117052	EF	On-Demand	Anodyne	SLC6A3	48	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc([C@@H]2C[C@H]2C)o1	ZINC000875117053	EF	On-Demand	Anodyne	SLC6A3	48	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc([C@@H]2C[C@@H]2C)o1	ZINC000875117054	EF	On-Demand	Anodyne	SLC6A3	48	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc([C@H]2C[C@@H]2C)o1	ZINC000875117055	EF	On-Demand	Anodyne	SLC6A3	48	36
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117060	ED	On-Demand	Reactive	CHRM2	15	42
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117060	ED	On-Demand	Reactive	CHRM1	18	42
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117060	ED	On-Demand	Reactive	DRD2	22	55
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117060	ED	On-Demand	Reactive	DRD4	41	50
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117060	ED	On-Demand	Reactive	ACHE	24	44
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117060	ED	On-Demand	Reactive	SLC6A3	17	44
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117060	ED	On-Demand	Reactive	KCNH2	24	49
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117060	ED	On-Demand	Reactive	HTR4	20	42
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117060	ED	On-Demand	Reactive	CHRM3	21	42
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117060	ED	On-Demand	Reactive	LTA4H	28	42
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117060	ED	On-Demand	Reactive	SIGMAR1	52	60
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117060	ED	On-Demand	Reactive	SSTR5	72	43
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117060	ED	On-Demand	Reactive	CCR3	113	50
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117060	ED	On-Demand	Reactive	CCR5	25	40
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117060	ED	On-Demand	Reactive	UTS2R	20	41
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117060	ED	On-Demand	Reactive	SLC18A3	16	41
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117060	ED	On-Demand	Reactive	MLNR	78	43
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117060	ED	On-Demand	Reactive	SLC6A5	31	43
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117060	ED	On-Demand	Reactive	EPHX2	35	45
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117060	ED	On-Demand	Reactive	MCHR1	72	58
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117060	ED	On-Demand	Reactive	CACNA1G	53	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cl)nc1	ZINC000875117082	DD	On-Demand	Anodyne	SLC6A4	31	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cl)nc1	ZINC000875117082	DD	On-Demand	Anodyne	SLC6A3	58	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cl)nc1	ZINC000875117083	DD	On-Demand	Anodyne	SLC6A4	31	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cl)nc1	ZINC000875117083	DD	On-Demand	Anodyne	SLC6A3	58	39
C[C@@]1(C(=O)N(Cc2ccc(Cl)cc2)C2CC2)CCC(=O)N1	ZINC000875117112	DE	On-Demand	Anodyne	FFAR2	47	34
CCOCCCCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875117116	EE	On-Demand	Anodyne	HRH2	23	40
CCOCCCCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875117116	EE	On-Demand	Anodyne	PDS	51	37
CCOCCCCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875117117	EE	On-Demand	Anodyne	HRH2	23	40
CCOCCCCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875117117	EE	On-Demand	Anodyne	PDS	51	37
CCOCCCCNC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875117118	BC	On-Demand	Anodyne	EPHX2	30	51
C[C@@H](NC(=O)NC1(C)CC(F)(F)C1)c1cccc([N+](=O)[O-])c1	ZINC000875117126	DG	On-Demand	Bother	CACNA1D	57	34
C[C@H](NC(=O)NC1(C)CC(F)(F)C1)c1cccc([N+](=O)[O-])c1	ZINC000875117127	DG	On-Demand	Bother	CACNA1D	57	34
CCOCCCCNC(=O)NC(C)(C)C(O)(CC)CC	ZINC000875117182	CE	On-Demand	Anodyne	EPHX2	16	46
COC(=O)C1(O)CN(C(=O)NCc2nccs2)C1	ZINC000875117191	CB	On-Demand	Anodyne	MAP1	49	32
O=CN1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)CC1	ZINC000875117204	FD	On-Demand	Anodyne	DRD4	31	48
O=CN1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)CC1	ZINC000875117204	FD	On-Demand	Anodyne	KCNH2	17	43
O=CN1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)CC1	ZINC000875117204	FD	On-Demand	Anodyne	CHRM3	16	41
O=CN1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)CC1	ZINC000875117204	FD	On-Demand	Anodyne	SIGMAR1	44	58
O=CN1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)CC1	ZINC000875117204	FD	On-Demand	Anodyne	SSTR5	46	39
O=CN1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)CC1	ZINC000875117204	FD	On-Demand	Anodyne	CCR3	79	67
O=CN1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)CC1	ZINC000875117204	FD	On-Demand	Anodyne	MLNR	59	43
O=CN1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)CC1	ZINC000875117204	FD	On-Demand	Anodyne	MCHR1	51	49
O=CN1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)CC1	ZINC000875117204	FD	On-Demand	Anodyne	CACNA1G	48	49
O=C(NCc1ccc(Cl)nc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875117205	FH	On-Demand	Anodyne	F2	28	44
O=C(NCc1ccc(Cl)nc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875117205	FH	On-Demand	Anodyne	CPT1A	56	40
O=C(NCc1ccc(Cl)nc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875117205	FH	On-Demand	Anodyne	PREP	35	41
O=C(NCc1ccc(Cl)nc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875117205	FH	On-Demand	Anodyne	TMPRSS11D	41	31
O=C(NCc1ccc(Cl)nc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875117206	FH	On-Demand	Anodyne	F2	28	44
O=C(NCc1ccc(Cl)nc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875117206	FH	On-Demand	Anodyne	CPT1A	56	40
O=C(NCc1ccc(Cl)nc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875117206	FH	On-Demand	Anodyne	PREP	35	41
O=C(NCc1ccc(Cl)nc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875117206	FH	On-Demand	Anodyne	TMPRSS11D	41	31
O=C(NCc1ccc(Cl)nc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875117207	FH	On-Demand	Anodyne	F2	28	44
O=C(NCc1ccc(Cl)nc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875117207	FH	On-Demand	Anodyne	CPT1A	56	40
O=C(NCc1ccc(Cl)nc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875117207	FH	On-Demand	Anodyne	PREP	35	41
O=C(NCc1ccc(Cl)nc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875117207	FH	On-Demand	Anodyne	TMPRSS11D	41	31
O=C(NCc1ccc(Cl)nc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875117208	FH	On-Demand	Anodyne	F2	28	44
O=C(NCc1ccc(Cl)nc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875117208	FH	On-Demand	Anodyne	CPT1A	56	40
O=C(NCc1ccc(Cl)nc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875117208	FH	On-Demand	Anodyne	PREP	35	41
O=C(NCc1ccc(Cl)nc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875117208	FH	On-Demand	Anodyne	TMPRSS11D	41	31
C=CCc1ccc(OC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2Br)c(OC)c1	ZINC000875117211	JG	On-Demand	Mild	TGM2	15	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1ccccc1C	ZINC000875117216	EF	On-Demand	Anodyne	SLC6A4	26	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1ccccc1C	ZINC000875117216	EF	On-Demand	Anodyne	SLC6A3	56	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1ccccc1C	ZINC000875117217	EF	On-Demand	Anodyne	SLC6A4	26	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1ccccc1C	ZINC000875117217	EF	On-Demand	Anodyne	SLC6A3	56	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1ccccc1C	ZINC000875117218	EF	On-Demand	Anodyne	SLC6A4	26	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1ccccc1C	ZINC000875117218	EF	On-Demand	Anodyne	SLC6A3	56	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1ccccc1C	ZINC000875117219	EF	On-Demand	Anodyne	SLC6A4	26	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1ccccc1C	ZINC000875117219	EF	On-Demand	Anodyne	SLC6A3	56	43
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCc2ccc(Cl)nc2)C1	ZINC000875117224	GE	On-Demand	Anodyne	EPHX2	19	44
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCc2ccc(Cl)nc2)C1	ZINC000875117224	GE	On-Demand	Anodyne	NAMPT	27	41
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCc2ccc(Cl)nc2)C1	ZINC000875117225	GE	On-Demand	Anodyne	EPHX2	19	44
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCc2ccc(Cl)nc2)C1	ZINC000875117225	GE	On-Demand	Anodyne	NAMPT	27	41
O=C(N[C@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCc2ccc(Cl)nc2)C1	ZINC000875117226	GE	On-Demand	Anodyne	EPHX2	19	44
O=C(N[C@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCc2ccc(Cl)nc2)C1	ZINC000875117226	GE	On-Demand	Anodyne	NAMPT	27	41
O=C(N[C@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCc2ccc(Cl)nc2)C1	ZINC000875117227	GE	On-Demand	Anodyne	EPHX2	19	44
O=C(N[C@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCc2ccc(Cl)nc2)C1	ZINC000875117227	GE	On-Demand	Anodyne	NAMPT	27	41
CC[C@@H]1COCCN1CCNC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117256	GE	On-Demand	Anodyne	DRD4	19	40
CC[C@@H]1COCCN1CCNC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117256	GE	On-Demand	Anodyne	KCNH2	15	42
CC[C@@H]1COCCN1CCNC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117256	GE	On-Demand	Anodyne	SIGMAR1	30	48
CC[C@@H]1COCCN1CCNC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117256	GE	On-Demand	Anodyne	SSTR5	52	42
CC[C@@H]1COCCN1CCNC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117256	GE	On-Demand	Anodyne	CCR3	70	46
CC[C@@H]1COCCN1CCNC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117256	GE	On-Demand	Anodyne	CXCR3	27	41
CC[C@@H]1COCCN1CCNC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117256	GE	On-Demand	Anodyne	MCHR1	39	56
CC[C@@H]1COCCN1CCNC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117256	GE	On-Demand	Anodyne	CACNA1G	38	41
O=C(NCc1ccc(Cl)nc1)N1OC2CCC1CC2	ZINC000875117289	CF	On-Demand	Anodyne	NAMPT	20	41
O=C(NCc1ccc(Cl)nc1)N1OC2CCC1CC2	ZINC000875117289	CF	On-Demand	Anodyne	Q8WSF8_APLCA	44	35
O=C(NCc1ccc(Cl)nc1)N1OC2CCC1CC2	ZINC000875117289	CF	On-Demand	Anodyne	NACHRBETA2	56	41
CO[C@]12CCC[C@@]1(C(=O)N(Cc1ccc(Cl)cc1)C1CC1)CCO2	ZINC000875117295	EH	On-Demand	Anodyne	C5AR1	35	43
CNC(=O)NC[C@H]1COCCN1C(=O)NCc1ccc(Cl)nc1	ZINC000875117307	EC	On-Demand	Anodyne	NACHRBETA2	18	41
O=C(NCc1ccc(Cl)nc1)NC1CN(c2ccncn2)C1	ZINC000875117308	DD	On-Demand	Anodyne	NAMPT	25	42
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875117316	GG	On-Demand	Anodyne	DRD4	26	44
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875117316	GG	On-Demand	Anodyne	ACHE	17	43
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875117316	GG	On-Demand	Anodyne	SLC6A3	19	42
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875117316	GG	On-Demand	Anodyne	KCNH2	16	41
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875117316	GG	On-Demand	Anodyne	LTA4H	18	40
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875117316	GG	On-Demand	Anodyne	SIGMAR1	41	55
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875117316	GG	On-Demand	Anodyne	SSTR5	40	40
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875117316	GG	On-Demand	Anodyne	CCR3	95	48
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875117316	GG	On-Demand	Anodyne	CXCR3	18	40
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875117316	GG	On-Demand	Anodyne	MCHR1	43	48
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875117316	GG	On-Demand	Anodyne	CACNA1G	36	44
C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cl)nc1	ZINC000875117318	DE	On-Demand	Anodyne	NACHRBETA2	36	43
C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cl)nc1	ZINC000875117319	DE	On-Demand	Anodyne	NACHRBETA2	36	43
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cl)nc1	ZINC000875117320	DE	On-Demand	Anodyne	NACHRBETA2	36	43
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117397	FF	On-Demand	Anodyne	DRD4	21	45
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117397	FF	On-Demand	Anodyne	KCNH2	19	44
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117397	FF	On-Demand	Anodyne	SIGMAR1	37	56
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117397	FF	On-Demand	Anodyne	SSTR5	51	42
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117397	FF	On-Demand	Anodyne	CCR3	79	48
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117397	FF	On-Demand	Anodyne	MLNR	54	41
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117397	FF	On-Demand	Anodyne	BACE1	17	40
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117397	FF	On-Demand	Anodyne	MCHR1	51	55
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117397	FF	On-Demand	Anodyne	CACNA1G	44	43
CC(=O)C1CCN(C(=O)C(=O)NCCN(C)Cc2ccccc2)CC1	ZINC000875117417	ED	On-Demand	Anodyne	SIGMAR1	21	40
Cc1nnc(NNC(=O)NC2CCN(Cc3ccc(F)cc3)CC2)n1C	ZINC000875117438	FD	On-Demand	Reactive	DRD4	24	42
Cc1nnc(NNC(=O)NC2CCN(Cc3ccc(F)cc3)CC2)n1C	ZINC000875117438	FD	On-Demand	Reactive	KCNH2	15	41
Cc1nnc(NNC(=O)NC2CCN(Cc3ccc(F)cc3)CC2)n1C	ZINC000875117438	FD	On-Demand	Reactive	SIGMAR1	35	52
Cc1nnc(NNC(=O)NC2CCN(Cc3ccc(F)cc3)CC2)n1C	ZINC000875117438	FD	On-Demand	Reactive	SSTR5	48	41
Cc1nnc(NNC(=O)NC2CCN(Cc3ccc(F)cc3)CC2)n1C	ZINC000875117438	FD	On-Demand	Reactive	CCR3	119	38
Cc1nnc(NNC(=O)NC2CCN(Cc3ccc(F)cc3)CC2)n1C	ZINC000875117438	FD	On-Demand	Reactive	MLNR	45	38
Cc1nnc(NNC(=O)NC2CCN(Cc3ccc(F)cc3)CC2)n1C	ZINC000875117438	FD	On-Demand	Reactive	MCHR1	49	56
Cc1nnc(NNC(=O)NC2CCN(Cc3ccc(F)cc3)CC2)n1C	ZINC000875117438	FD	On-Demand	Reactive	CACNA1G	38	42
COCC(C)(C)CCNC(=O)C(=O)NCCN1CCc2sccc2C1	ZINC000875117471	FD	On-Demand	Anodyne	DRD4	40	32
O=C(NCc1ccc(Cl)nc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875117514	FF	On-Demand	Anodyne	NAMPT	15	47
O=C(NCc1ccc(Cl)nc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875117514	FF	On-Demand	Anodyne	NACHRBETA2	17	40
O=C(NCc1ccc(Cl)nc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875117514	FF	On-Demand	Anodyne	PDS	66	40
O=C(NCc1ccc(Cl)nc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875117515	FF	On-Demand	Anodyne	NAMPT	15	47
O=C(NCc1ccc(Cl)nc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875117515	FF	On-Demand	Anodyne	NACHRBETA2	17	40
O=C(NCc1ccc(Cl)nc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875117515	FF	On-Demand	Anodyne	PDS	66	40
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3C)CC2)c(OC)c1	ZINC000875117551	II	On-Demand	Mild	EPHX2	29	51
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3ccc(OCC)cc3)CC2)c(OC)c1	ZINC000875117565	JH	On-Demand	Mild	FKBP1A	42	39
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3ccc(OCC)cc3)CC2)c(OC)c1	ZINC000875117565	JH	On-Demand	Mild	TGM2	46	46
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3ccc(OCC)cc3)CC2)c(OC)c1	ZINC000875117565	JH	On-Demand	Mild	F13A1	42	35
O=C(NCCO)C1CCN(C(=O)NCc2ccc(Cl)nc2)CC1	ZINC000875117586	EC	On-Demand	Anodyne	EPHX2	22	47
O=C(NCCO)C1CCN(C(=O)NCc2ccc(Cl)nc2)CC1	ZINC000875117586	EC	On-Demand	Anodyne	NACHRBETA2	40	37
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875117590	GF	On-Demand	Anodyne	CHRM1	17	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875117590	GF	On-Demand	Anodyne	DRD2	18	48
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875117590	GF	On-Demand	Anodyne	DRD4	31	46
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875117590	GF	On-Demand	Anodyne	KCNH2	21	45
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875117590	GF	On-Demand	Anodyne	CHRM3	17	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875117590	GF	On-Demand	Anodyne	SIGMAR1	39	53
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875117590	GF	On-Demand	Anodyne	SSTR5	69	44
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875117590	GF	On-Demand	Anodyne	CCR3	83	50
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875117590	GF	On-Demand	Anodyne	MLNR	64	42
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875117590	GF	On-Demand	Anodyne	MCHR1	54	50
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875117590	GF	On-Demand	Anodyne	CACNA1G	50	46
CN1CCN(C(=O)NCc2ccc(Cl)nc2)CCC1(C)C	ZINC000875117596	DE	On-Demand	Anodyne	NAMPT	21	40
CN1CCN(C(=O)NCc2ccc(Cl)nc2)CCC1(C)C	ZINC000875117596	DE	On-Demand	Anodyne	NACHRBETA2	47	40
O=C(NCCCCOCCc1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875117643	GI	On-Demand	Anodyne	PREP	53	40
O=C(NCCCCOCCc1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875117643	GI	On-Demand	Anodyne	EPHX2	26	40
O=C(NCCCCOCCc1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875117644	GI	On-Demand	Anodyne	PREP	53	40
O=C(NCCCCOCCc1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875117644	GI	On-Demand	Anodyne	EPHX2	26	40
O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1CC(c2ccccc2)C1	ZINC000875117700	GG	On-Demand	Clean	NPY2R	47	36
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117723	GF	On-Demand	Anodyne	CHRM1	19	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117723	GF	On-Demand	Anodyne	DRD2	19	50
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117723	GF	On-Demand	Anodyne	DRD4	33	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117723	GF	On-Demand	Anodyne	ACHE	15	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117723	GF	On-Demand	Anodyne	SLC6A4	25	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117723	GF	On-Demand	Anodyne	SLC6A3	61	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117723	GF	On-Demand	Anodyne	KCNH2	19	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117723	GF	On-Demand	Anodyne	SIGMAR1	42	53
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117723	GF	On-Demand	Anodyne	SSTR5	73	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117723	GF	On-Demand	Anodyne	CCR3	76	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117723	GF	On-Demand	Anodyne	MLNR	48	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117723	GF	On-Demand	Anodyne	MCHR1	48	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117723	GF	On-Demand	Anodyne	CACNA1G	47	43
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)OCCCO4)CC2)c(OC)c1	ZINC000875117756	JH	On-Demand	Mild	PKM	41	45
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3ccc4c(c3)OCCCO4)CC2)c(OC)c1	ZINC000875117756	JH	On-Demand	Mild	TGM2	29	43
O=C(N(Cc1ccc(Cl)cc1)C1CC1)C1(F)CCOCC1	ZINC000875117776	DG	On-Demand	Anodyne	C5AR1	36	40
COC(=O)N(C)NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1	ZINC000875117783	FD	On-Demand	Reactive	NPY2R	42	35
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875117787	FC	On-Demand	Anodyne	DRD2	15	53
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875117787	FC	On-Demand	Anodyne	DRD4	33	44
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875117787	FC	On-Demand	Anodyne	KCNH2	22	46
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875117787	FC	On-Demand	Anodyne	SIGMAR1	43	55
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875117787	FC	On-Demand	Anodyne	SSTR5	62	44
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875117787	FC	On-Demand	Anodyne	CCR3	85	51
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875117787	FC	On-Demand	Anodyne	MLNR	70	41
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875117787	FC	On-Demand	Anodyne	SLC6A5	29	40
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875117787	FC	On-Demand	Anodyne	CXCR3	43	37
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875117787	FC	On-Demand	Anodyne	MCHR1	56	53
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000875117787	FC	On-Demand	Anodyne	CACNA1G	49	46
CN(CCNC(=O)NCc1ccc(N2CCOCC2)c(F)c1)CC(F)F	ZINC000875117798	FD	On-Demand	Clean	NPY2R	50	33
O=CN1CCCN(C(=O)NCc2ccc(Cl)nc2)CC1	ZINC000875117802	CD	On-Demand	Anodyne	NAMPT	21	41
O=CN1CCCN(C(=O)NCc2ccc(Cl)nc2)CC1	ZINC000875117802	CD	On-Demand	Anodyne	NACHRBETA2	42	39
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117810	ED	On-Demand	Anodyne	DRD4	27	49
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117810	ED	On-Demand	Anodyne	ACHE	19	45
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117810	ED	On-Demand	Anodyne	KCNH2	20	45
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117810	ED	On-Demand	Anodyne	SIGMAR1	44	58
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117810	ED	On-Demand	Anodyne	SSTR5	45	42
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117810	ED	On-Demand	Anodyne	CCR3	115	51
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117810	ED	On-Demand	Anodyne	SLC18A3	15	40
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117810	ED	On-Demand	Anodyne	MLNR	50	39
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117810	ED	On-Demand	Anodyne	SLC6A5	24	40
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117810	ED	On-Demand	Anodyne	EPHX2	33	46
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117810	ED	On-Demand	Anodyne	CXCR3	33	41
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117810	ED	On-Demand	Anodyne	MCHR1	55	62
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117810	ED	On-Demand	Anodyne	CACNA1G	42	46
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000875117810	ED	On-Demand	Anodyne	CACNA1I	45	40
CS(=O)(=O)NC1CN(C(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1	ZINC000875117835	GC	On-Demand	Clean	SLC6A9	24	41
C=CCc1ccc(OC(=O)c2ccc(OCC)c(OC)c2)c(OC)c1	ZINC000875117873	EI	On-Demand	Mild	ACR	23	65
O=C(NCCCCOCCc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875117901	FD	On-Demand	Anodyne	GHRHR	43	32
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3cc(Cl)ccc3Cl)CC2)c(OC)c1	ZINC000875117928	JJ	On-Demand	Mild	AVPR1B	46	33
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3cc(Cl)ccc3Cl)CC2)c(OC)c1	ZINC000875117928	JJ	On-Demand	Mild	CPT1A	59	36
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3cc(Cl)ccc3Cl)CC2)c(OC)c1	ZINC000875117928	JJ	On-Demand	Mild	CPT2	45	34
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3cc(Cl)ccc3Cl)CC2)c(OC)c1	ZINC000875117928	JJ	On-Demand	Mild	EPHX2	21	41
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3cc(Cl)ccc3Cl)CC2)c(OC)c1	ZINC000875117928	JJ	On-Demand	Mild	CPT1B	56	35
Cn1nc(Cl)c(C(=O)N(Cc2ccc(C#N)cc2)C2CC2)c1Cl	ZINC000875117936	EG	On-Demand	Mild	GPBAR1	22	42
O=C(NCc1ccc(Cl)nc1)N1CCC(CO)(CO)CC1	ZINC000875117939	DD	On-Demand	Anodyne	NAMPT	32	47
O=C(NCc1ccc(Cl)nc1)N1CCC(CO)(CO)CC1	ZINC000875117939	DD	On-Demand	Anodyne	NACHRBETA2	50	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCCOCCc1ccccc1	ZINC000875117955	FF	On-Demand	Anodyne	SLC6A4	26	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCCOCCc1ccccc1	ZINC000875117955	FF	On-Demand	Anodyne	SLC6A3	54	45
O=C(NCCN1CC[C@H](O)C1)NCc1ccc(N2CCC(O)CC2)c(F)c1	ZINC000875118006	GC	On-Demand	Clean	CCR3	41	42
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc(N2CCC(O)CC2)c(F)c1	ZINC000875118008	GC	On-Demand	Clean	CCR3	41	42
C[C@H](CNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)CN1CCCC1	ZINC000875118035	FE	On-Demand	Anodyne	OPRK1	15	44
C[C@H](CNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)CN1CCCC1	ZINC000875118035	FE	On-Demand	Anodyne	BIRC2	17	41
C[C@H](CNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)CN1CCCC1	ZINC000875118035	FE	On-Demand	Anodyne	NPFFR1	40	36
C[C@@H](CNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)CN1CCCC1	ZINC000875118037	FE	On-Demand	Anodyne	OPRK1	15	44
C[C@@H](CNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)CN1CCCC1	ZINC000875118037	FE	On-Demand	Anodyne	BIRC2	17	41
C[C@@H](CNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)CN1CCCC1	ZINC000875118037	FE	On-Demand	Anodyne	NPFFR1	40	36
CN(Cc1ccns1)C(=O)NCc1ccc(Cl)nc1	ZINC000875118038	CF	On-Demand	Anodyne	NACHRBETA2	28	41
CCC1(CC)CCCN1C(=O)NCc1ccc(Cl)nc1	ZINC000875118050	CH	On-Demand	Anodyne	NAMPT	27	40
CCC1(CC)CCCN1C(=O)NCc1ccc(Cl)nc1	ZINC000875118050	CH	On-Demand	Anodyne	NACHRBETA2	47	41
C[C@@H](CNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)CN1CCCC1	ZINC000875118059	FF	On-Demand	Anodyne	OPRL1	18	43
O=C(NCc1ccc(Cl)nc1)NC1CC(Nc2ccccc2)C1	ZINC000875118062	EG	On-Demand	Anodyne	NAMPT	27	54
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)Cc2ccccc2C)C1	ZINC000875118075	EF	On-Demand	Anodyne	ACE	26	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)Cc2ccccc2C)C1	ZINC000875118075	EF	On-Demand	Anodyne	Q6PRC7_IXORI	40	33
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)Cc2ccccc2C)C1	ZINC000875118077	EF	On-Demand	Anodyne	ACE	26	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)Cc2ccccc2C)C1	ZINC000875118077	EF	On-Demand	Anodyne	Q6PRC7_IXORI	40	33
CCOCCCCNC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875118109	DE	On-Demand	Anodyne	EPHX2	18	47
CCOCCCCNC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875118110	DE	On-Demand	Anodyne	EPHX2	18	47
CC(=O)C1CCN(C(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)CC1	ZINC000875118117	GE	On-Demand	Clean	EPHX2	17	42
CN(CCNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)CC(F)F	ZINC000875118132	GD	On-Demand	Clean	NPY2R	49	36
O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CC(c2ccccc2)C1	ZINC000875118136	FF	On-Demand	Clean	NPY2R	51	35
O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CC(c2ccccc2)C1	ZINC000875118136	FF	On-Demand	Clean	NPSR1	26	41
CCOCCCCNC(=O)NNc1cccc(C)n1	ZINC000875118181	CD	On-Demand	Reactive	GRM5	17	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(Cl)nc1	ZINC000875118184	CE	On-Demand	Anodyne	NACHRBETA2	25	42
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(Cl)nc1	ZINC000875118184	CE	On-Demand	Anodyne	PDS	40	34
O=C(NCc1ccc(Cl)nc1)N[C@H]1Cc2cncn2C1	ZINC000875118192	CD	On-Demand	Anodyne	NAMPT	15	41
O=C(NCc1ccc(Cl)nc1)N[C@@H]1Cc2cncn2C1	ZINC000875118194	CD	On-Demand	Anodyne	NAMPT	15	41
COC(=O)C1(O)CN(C(=O)NCc2ccc(Cl)nc2)C1	ZINC000875118203	CC	On-Demand	Anodyne	NAMPT	19	42
COC(=O)C1(O)CN(C(=O)NCc2ccc(Cl)nc2)C1	ZINC000875118203	CC	On-Demand	Anodyne	NACHRBETA2	47	42
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1cc(C(=O)N(C)C(C)C)ccc1Cl	ZINC000875118232	IH	On-Demand	Bother	KCNMA1	19	41
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1cc(C(=O)N(C)C(C)C)ccc1Cl	ZINC000875118232	IH	On-Demand	Bother	PTGDR	28	40
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1cc(C(=O)N(C)C(C)C)ccc1Cl	ZINC000875118232	IH	On-Demand	Bother	PTGDR2	21	40
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875118251	FG	On-Demand	Clean	DRD2	20	50
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875118251	FG	On-Demand	Clean	DRD4	40	48
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875118251	FG	On-Demand	Clean	ACHE	19	42
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875118251	FG	On-Demand	Clean	HTR2A	16	48
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875118251	FG	On-Demand	Clean	KCNH2	17	42
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875118251	FG	On-Demand	Clean	SIGMAR1	42	56
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875118251	FG	On-Demand	Clean	SSTR5	48	41
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875118251	FG	On-Demand	Clean	CCR3	79	55
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875118251	FG	On-Demand	Clean	MLNR	55	39
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875118251	FG	On-Demand	Clean	CCR2	18	47
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875118251	FG	On-Demand	Clean	MCHR1	49	50
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875118251	FG	On-Demand	Clean	CACNA1G	43	45
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCN(C)c2ccccc2)C1	ZINC000875118253	FD	On-Demand	Anodyne	SLC6A1	26	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCN(C)c2ccccc2)C1	ZINC000875118255	FD	On-Demand	Anodyne	SLC6A1	26	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1	ZINC000875118258	FE	On-Demand	Clean	NPY2R	47	35
O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1Cc2cccc(O)c2C1	ZINC000875118305	FF	On-Demand	Clean	NAMPT	23	40
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(N2CCOCC2)c(F)c1	ZINC000875118313	FE	On-Demand	Clean	NPY2R	45	33
Cc1ccccc1[C@H](C)N(C)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1	ZINC000875118343	GH	On-Demand	Clean	NPY2R	65	39
Cc1ccccc1[C@@H](C)N(C)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1	ZINC000875118344	GH	On-Demand	Clean	NPY2R	65	39
O=C(NCCCCOCCc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000875118347	DE	On-Demand	Anodyne	EPHX2	21	48
Cc1ncc(CNC(=O)C(=O)NCCCCCCc2ccccc2)s1	ZINC000875118372	FF	On-Demand	Anodyne	FAAH	86	41
Cc1ncc(CNC(=O)C(=O)NCCCCCCc2ccccc2)s1	ZINC000875118372	FF	On-Demand	Anodyne	CES1	75	40
Cc1ncc(CNC(=O)C(=O)NCCCCCCc2ccccc2)s1	ZINC000875118372	FF	On-Demand	Anodyne	AMP1_PLAFQ	27	44
Cc1ncc(CNC(=O)C(=O)NCCCCCCc2ccccc2)s1	ZINC000875118372	FF	On-Demand	Anodyne	CES1D	58	36
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3ccc4ccccc4c3)CC2)c(OC)c1	ZINC000875118397	JJ	On-Demand	Mild	F2	21	40
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3ccc4ccccc4c3)CC2)c(OC)c1	ZINC000875118397	JJ	On-Demand	Mild	FKBP1A	31	41
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3ccc4ccccc4c3)CC2)c(OC)c1	ZINC000875118397	JJ	On-Demand	Mild	TRY2_BOVIN	67	36
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3ccc4ccccc4c3)CC2)c(OC)c1	ZINC000875118397	JJ	On-Demand	Mild	TGM2	58	44
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3ccc4ccccc4c3)CC2)c(OC)c1	ZINC000875118397	JJ	On-Demand	Mild	F13A1	53	41
O=C(NCc1ccc(Cl)nc1)NC[C@H]1C[C@H](O)C1	ZINC000875118407	CD	On-Demand	Anodyne	NACHRBETA2	40	43
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)Cc1ccccc1C	ZINC000875118486	CF	On-Demand	Anodyne	ANPEP	22	42
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)Cc1ccccc1C	ZINC000875118487	CF	On-Demand	Anodyne	ANPEP	22	42
O=C(NCc1ccc(Cl)nc1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875118489	FG	On-Demand	Anodyne	OPRL1	19	41
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875118490	GD	On-Demand	Anodyne	CHRM2	18	42
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875118490	GD	On-Demand	Anodyne	DRD4	32	49
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875118490	GD	On-Demand	Anodyne	ACHE	18	45
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875118490	GD	On-Demand	Anodyne	KCNH2	20	45
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875118490	GD	On-Demand	Anodyne	CHRM3	22	42
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875118490	GD	On-Demand	Anodyne	SIGMAR1	49	61
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875118490	GD	On-Demand	Anodyne	SSTR5	44	41
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875118490	GD	On-Demand	Anodyne	CCR3	76	61
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875118490	GD	On-Demand	Anodyne	MLNR	58	42
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875118490	GD	On-Demand	Anodyne	SLC6A5	23	40
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875118490	GD	On-Demand	Anodyne	EPHX2	16	43
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875118490	GD	On-Demand	Anodyne	MCHR1	51	53
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875118490	GD	On-Demand	Anodyne	CACNA1G	41	53
O=C(NCc1ccc(Cl)nc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875118498	CF	On-Demand	Anodyne	NACHRBETA2	18	40
O=C(NCc1ccc(Cl)nc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875118499	CF	On-Demand	Anodyne	NACHRBETA2	18	40
O=C(NCc1ccc(Cl)nc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875118500	CF	On-Demand	Anodyne	NACHRBETA2	18	40
O=C(NCc1ccc(Cl)nc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875118501	CF	On-Demand	Anodyne	NACHRBETA2	18	40
O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N1Cc2cccc(O)c2C1	ZINC000875118506	GF	On-Demand	Clean	NAMPT	20	41
CCC[C@@H](CCO)NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1	ZINC000875118545	FE	On-Demand	Clean	NPY2R	40	37
CCC[C@H](CCO)NC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1	ZINC000875118546	FE	On-Demand	Clean	NPY2R	40	37
C[C@@H](CNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)CN1CCCC1	ZINC000875118566	FF	On-Demand	Mild	ITK	15	51
CCOCCCCNC(=O)N1CC[C@@H](O)[C@H]1c1ccc(Br)cc1	ZINC000875118572	GG	On-Demand	Anodyne	ASAH1	52	35
O=C(NCc1ccc(Cl)nc1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875118613	FF	On-Demand	Anodyne	NAMPT	29	42
C=CCc1ccc(OC(=O)Cc2csc(-c3ccc(OC)c(OC)c3)n2)c(OC)c1	ZINC000875118648	IJ	On-Demand	Mild	PPARD	17	41
C[C@@](CO)(Cc1ccc(F)cc1)NC(=O)NCc1ccc(Cl)nc1	ZINC000875118672	FF	On-Demand	Anodyne	NACHRBETA2	17	40
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(Cc4ccc(F)cc4)CC3)C[C@@H]1C2	ZINC000875118674	GE	On-Demand	Anodyne	DRD2	16	52
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(Cc4ccc(F)cc4)CC3)C[C@@H]1C2	ZINC000875118674	GE	On-Demand	Anodyne	DRD4	33	45
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(Cc4ccc(F)cc4)CC3)C[C@@H]1C2	ZINC000875118674	GE	On-Demand	Anodyne	ACHE	16	41
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(Cc4ccc(F)cc4)CC3)C[C@@H]1C2	ZINC000875118674	GE	On-Demand	Anodyne	KCNH2	19	44
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(Cc4ccc(F)cc4)CC3)C[C@@H]1C2	ZINC000875118674	GE	On-Demand	Anodyne	SIGMAR1	47	55
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(Cc4ccc(F)cc4)CC3)C[C@@H]1C2	ZINC000875118674	GE	On-Demand	Anodyne	SSTR5	53	43
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(Cc4ccc(F)cc4)CC3)C[C@@H]1C2	ZINC000875118674	GE	On-Demand	Anodyne	CCR3	78	47
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(Cc4ccc(F)cc4)CC3)C[C@@H]1C2	ZINC000875118674	GE	On-Demand	Anodyne	MLNR	52	38
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(Cc4ccc(F)cc4)CC3)C[C@@H]1C2	ZINC000875118674	GE	On-Demand	Anodyne	SLC6A5	30	43
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(Cc4ccc(F)cc4)CC3)C[C@@H]1C2	ZINC000875118674	GE	On-Demand	Anodyne	EPHX2	38	49
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(Cc4ccc(F)cc4)CC3)C[C@@H]1C2	ZINC000875118674	GE	On-Demand	Anodyne	CXCR3	38	42
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(Cc4ccc(F)cc4)CC3)C[C@@H]1C2	ZINC000875118674	GE	On-Demand	Anodyne	MCHR1	50	57
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(Cc4ccc(F)cc4)CC3)C[C@@H]1C2	ZINC000875118674	GE	On-Demand	Anodyne	CACNA1G	47	47
O=C(NCc1ccc(N2CCOCC2)c(F)c1)N(C1CC1)C1CC1	ZINC000875118745	EE	On-Demand	Clean	NPY2R	43	36
C[C@@H](CN(C)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)C(C)(C)C	ZINC000875118771	GH	On-Demand	Clean	NPY2R	48	35
O=C(NCc1ccc(Cl)nc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875118805	EG	On-Demand	Anodyne	EPHX2	24	45
O=C(NCc1ccc(Cl)nc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875118805	EG	On-Demand	Anodyne	NACHRBETA2	45	37
O=C(NCc1ccc(Cl)nc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875118806	EG	On-Demand	Anodyne	EPHX2	24	45
O=C(NCc1ccc(Cl)nc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875118806	EG	On-Demand	Anodyne	NACHRBETA2	45	37
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCN(C)Cc2ccccc2)C1	ZINC000875118821	ED	On-Demand	Anodyne	SLC6A1	49	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCN(C)Cc2ccccc2)C1	ZINC000875118821	ED	On-Demand	Anodyne	DPP7	49	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCN(C)Cc2ccccc2)C1	ZINC000875118822	ED	On-Demand	Anodyne	SLC6A1	49	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCN(C)Cc2ccccc2)C1	ZINC000875118822	ED	On-Demand	Anodyne	DPP7	49	41
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3cccc(C(C)=O)c3)CC2)c(OC)c1	ZINC000875118831	JH	On-Demand	Mild	FKBP1A	27	40
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3cccc(C(C)=O)c3)CC2)c(OC)c1	ZINC000875118831	JH	On-Demand	Mild	TGM2	27	44
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3cccc(C(C)=O)c3)CC2)c(OC)c1	ZINC000875118831	JH	On-Demand	Mild	AKR1C3	51	40
O=C(NCc1ccc(N2CCOCC2)c(F)c1)NC1CN(c2ccncn2)C1	ZINC000875118916	GD	On-Demand	Clean	NOS2	65	33
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)N[C@@H]1CCc2c(F)cccc21	ZINC000875118943	FE	On-Demand	Anodyne	HTR1A	15	41
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)N[C@H]1CCc2c(F)cccc21	ZINC000875118944	FE	On-Demand	Anodyne	HTR1A	15	41
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)N[C@H]1CCc2c(F)cccc21	ZINC000875118945	FE	On-Demand	Anodyne	HTR1A	15	41
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)N[C@@H]1CCc2c(F)cccc21	ZINC000875118946	FE	On-Demand	Anodyne	HTR1A	15	41
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCc2c(F)cccc21	ZINC000875118968	EE	On-Demand	Anodyne	DRD4	41	32
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCc2c(F)cccc21	ZINC000875118969	EE	On-Demand	Anodyne	DRD4	41	32
O=C(NCc1ccc(N2CCOCC2)c(F)c1)N1CC=CC1	ZINC000875118991	DD	On-Demand	Clean	STAT6	40	33
CN(CCNC(=O)NCc1ccc(Cl)nc1)CC(F)F	ZINC000875118994	DD	On-Demand	Anodyne	NACHRBETA2	23	41
CS(=O)(=O)NC1CN(C(=O)NCc2ccc(Cl)nc2)C1	ZINC000875119000	DC	On-Demand	Anodyne	NAMPT	35	43
CS(=O)(=O)NC1CN(C(=O)NCc2ccc(Cl)nc2)C1	ZINC000875119000	DC	On-Demand	Anodyne	NACHRBETA2	35	41
CC[C@@H](NC(=O)C(=O)N[C@@H]1CCCN(CC)C1)c1cccc(OC)c1OC	ZINC000875119009	GD	On-Demand	Anodyne	BIRC2	34	42
CC[C@@H](NC(=O)C(=O)N[C@H]1CCCN(CC)C1)c1cccc(OC)c1OC	ZINC000875119011	GD	On-Demand	Anodyne	BIRC2	34	42
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(Cl)c(C(=O)N(C)C(C)C)c1	ZINC000875119015	IH	On-Demand	Bother	KCNMA1	20	44
O=C(NCc1ccc(Cl)nc1)N1C[C@H](O)C[C@H]1C1CC1	ZINC000875119018	CD	On-Demand	Anodyne	VHL	50	35
O=C(NCc1ccc(Cl)nc1)N1C[C@@H](O)C[C@@H]1C1CC1	ZINC000875119020	CD	On-Demand	Anodyne	VHL	50	35
O=C(NCc1ccc(Cl)nc1)N1C[C@@H](O)C[C@H]1C1CC1	ZINC000875119022	CD	On-Demand	Anodyne	VHL	50	35
O=C(NCc1ccc(Cl)nc1)N1C[C@H](O)C[C@@H]1C1CC1	ZINC000875119023	CD	On-Demand	Anodyne	VHL	50	35
Cn1nc(Cl)c(C(=O)N(CCc2ccccc2)C2CC2)c1Cl	ZINC000875119033	EH	On-Demand	Anodyne	C5AR1	28	44
Cn1nc(Cl)c(C(=O)N(CCc2ccccc2)C2CC2)c1Cl	ZINC000875119033	EH	On-Demand	Anodyne	MBTPS1	67	36
O=CN1CCCN(C(=O)NCCCCOCCc2ccccc2)CC1	ZINC000875119040	ED	On-Demand	Anodyne	PREP	36	40
CN1CCN(C2CCN(C(=O)C(=O)N[C@H]3CCc4c(F)cccc43)CC2)CC1	ZINC000875119055	GD	On-Demand	Anodyne	L3MBTL3	67	41
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3CCc4c(F)cccc43)CC2)CC1	ZINC000875119057	GD	On-Demand	Anodyne	L3MBTL3	67	41
O=C(NCc1ccc(Cl)nc1)N1CC2(CCCO2)C1	ZINC000875119067	CD	On-Demand	Anodyne	NAMPT	22	40
O=C(NC1CCN(CC2CC2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875119075	EF	On-Demand	Anodyne	CHRM1	18	47
O=C(NC1CCN(CC2CC2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875119075	EF	On-Demand	Anodyne	DRD2	18	55
O=C(NC1CCN(CC2CC2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875119075	EF	On-Demand	Anodyne	DRD4	22	55
O=C(NC1CCN(CC2CC2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875119075	EF	On-Demand	Anodyne	DRD3	17	45
O=C(NC1CCN(CC2CC2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875119075	EF	On-Demand	Anodyne	CHRM3	15	47
O=C(NC1CCN(CC2CC2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875119075	EF	On-Demand	Anodyne	LTA4H	21	43
O=C(NC1CCN(CC2CC2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875119075	EF	On-Demand	Anodyne	SIGMAR1	40	47
O=C(NC1CCN(CC2CC2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875119075	EF	On-Demand	Anodyne	CCR3	46	40
O=C(NC1CCN(CC2CC2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875119075	EF	On-Demand	Anodyne	EPHX2	46	46
O=C(NC1CCN(CC2CC2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875119075	EF	On-Demand	Anodyne	CXCR3	17	45
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(F)c(C(=O)N(C)C(C)C)c1	ZINC000875119081	IG	On-Demand	Bother	KCNMA1	20	44
CCCCCCCNC(=O)C(=O)NCc1cnc(C)s1	ZINC000875119101	CE	On-Demand	Mild	ASAH1	81	34
O=C(NNc1cccc(F)c1Cl)NC1CCN(CC2CC2)CC1	ZINC000875119152	EF	On-Demand	Reactive	SIGMAR1	23	44
CCC[C@H](CCO)NC(=O)NCc1ccc(Cl)nc1	ZINC000875119163	CE	On-Demand	Anodyne	NACHRBETA2	18	45
CCC[C@@H](CCO)NC(=O)NCc1ccc(Cl)nc1	ZINC000875119165	CE	On-Demand	Anodyne	NACHRBETA2	18	45
O=C(NCc1ccc(Cl)nc1)N1CC(c2ccccc2)C1	ZINC000875119167	DG	On-Demand	Anodyne	EPHX2	18	43
O=C(NCc1ccc(Cl)nc1)N1CC(c2ccccc2)C1	ZINC000875119167	DG	On-Demand	Anodyne	NAMPT	36	47
O=C(NCc1ccc(Cl)nc1)N1CC(c2ccccc2)C1	ZINC000875119167	DG	On-Demand	Anodyne	Q8WSF8_APLCA	42	32
O=C(NCc1ccc(Cl)nc1)N1CC(c2ccccc2)C1	ZINC000875119167	DG	On-Demand	Anodyne	NACHRBETA2	53	40
O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)N(C1CC1)C1CC1	ZINC000875119174	EF	On-Demand	Clean	NPY2R	41	36
CCN1CCC[C@@H](NC(=O)C(=O)NCc2cc(C(F)(F)F)cc(Cl)n2)C1	ZINC000875119220	GD	On-Demand	Anodyne	CCR2	59	41
CCN1CCC[C@H](NC(=O)C(=O)NCc2cc(C(F)(F)F)cc(Cl)n2)C1	ZINC000875119221	GD	On-Demand	Anodyne	CCR2	59	41
O=C(NCc1ccc(Cl)nc1)N(C1CC1)C1CC1	ZINC000875119232	CF	On-Demand	Anodyne	Q8WSF8_APLCA	44	35
O=C(NCc1ccc(Cl)nc1)N(C1CC1)C1CC1	ZINC000875119232	CF	On-Demand	Anodyne	NACHRBETA2	56	44
O=C(NCC[C@@H](O)C(F)F)NCc1ccc(Cl)nc1	ZINC000875119233	CD	On-Demand	Anodyne	NACHRBETA2	27	44
O=C(NCC[C@H](O)C(F)F)NCc1ccc(Cl)nc1	ZINC000875119234	CD	On-Demand	Anodyne	NACHRBETA2	27	44
O=C(NCc1ccc(Cl)nc1)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875119268	ED	On-Demand	Anodyne	NACHRBETA2	39	40
O=C(NCc1ccc(Cl)nc1)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875119269	ED	On-Demand	Anodyne	NACHRBETA2	39	40
CC[C@@H](NC(=O)NC1CCN(CC2CC2)CC1)[C@@H](O)c1ccccc1	ZINC000875119283	EF	On-Demand	Anodyne	CHRM1	20	45
CC[C@@H](NC(=O)NC1CCN(CC2CC2)CC1)[C@@H](O)c1ccccc1	ZINC000875119283	EF	On-Demand	Anodyne	DRD4	15	41
CC[C@@H](NC(=O)NC1CCN(CC2CC2)CC1)[C@@H](O)c1ccccc1	ZINC000875119283	EF	On-Demand	Anodyne	CHRM3	17	46
CC[C@@H](NC(=O)NC1CCN(CC2CC2)CC1)[C@@H](O)c1ccccc1	ZINC000875119283	EF	On-Demand	Anodyne	CCR5	41	41
CC[C@@H](NC(=O)NC1CCN(CC2CC2)CC1)[C@@H](O)c1ccccc1	ZINC000875119283	EF	On-Demand	Anodyne	EPHX2	25	40
CC[C@@H](NC(=O)NC1CCN(CC2CC2)CC1)[C@H](O)c1ccccc1	ZINC000875119286	EF	On-Demand	Anodyne	CHRM1	20	45
CC[C@@H](NC(=O)NC1CCN(CC2CC2)CC1)[C@H](O)c1ccccc1	ZINC000875119286	EF	On-Demand	Anodyne	DRD4	15	41
CC[C@@H](NC(=O)NC1CCN(CC2CC2)CC1)[C@H](O)c1ccccc1	ZINC000875119286	EF	On-Demand	Anodyne	CHRM3	17	46
CC[C@@H](NC(=O)NC1CCN(CC2CC2)CC1)[C@H](O)c1ccccc1	ZINC000875119286	EF	On-Demand	Anodyne	CCR5	41	41
CC[C@@H](NC(=O)NC1CCN(CC2CC2)CC1)[C@H](O)c1ccccc1	ZINC000875119286	EF	On-Demand	Anodyne	EPHX2	25	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccc(CN3CCOCC3)c2)C1	ZINC000875119302	GD	On-Demand	Anodyne	CHRM3	18	41
COc1cc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)ccc1C	ZINC000875119328	GE	On-Demand	Anodyne	ACHE	18	41
COc1cc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)ccc1C	ZINC000875119328	GE	On-Demand	Anodyne	TRPV1	24	40
COc1cc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)ccc1C	ZINC000875119328	GE	On-Demand	Anodyne	SIRT2	43	30
COc1cc(CNC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)ccc1C	ZINC000875119329	GF	On-Demand	Anodyne	PDE4A	20	42
COc1cc(CNC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)ccc1C	ZINC000875119330	GF	On-Demand	Anodyne	PDE4A	20	42
C=CCc1ccc(OC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccc(C(C)=O)cc2)c(OC)c1	ZINC000875119333	JH	On-Demand	Mild	FKBP1A	65	53
C=CCc1ccc(OC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccc(C(C)=O)cc2)c(OC)c1	ZINC000875119333	JH	On-Demand	Mild	MMP13	31	44
C=CCc1ccc(OC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccc(C(C)=O)cc2)c(OC)c1	ZINC000875119333	JH	On-Demand	Mild	MMP3	34	44
C=CCc1ccc(OC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccc(C(C)=O)cc2)c(OC)c1	ZINC000875119333	JH	On-Demand	Mild	MMP7	36	44
C=CCc1ccc(OC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccc(C(C)=O)cc2)c(OC)c1	ZINC000875119333	JH	On-Demand	Mild	MMP1	36	44
C=CCc1ccc(OC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccc(C(C)=O)cc2)c(OC)c1	ZINC000875119341	JH	On-Demand	Mild	FKBP1A	65	53
C=CCc1ccc(OC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccc(C(C)=O)cc2)c(OC)c1	ZINC000875119341	JH	On-Demand	Mild	MMP13	31	44
C=CCc1ccc(OC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccc(C(C)=O)cc2)c(OC)c1	ZINC000875119341	JH	On-Demand	Mild	MMP3	34	44
C=CCc1ccc(OC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccc(C(C)=O)cc2)c(OC)c1	ZINC000875119341	JH	On-Demand	Mild	MMP7	36	44
C=CCc1ccc(OC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccc(C(C)=O)cc2)c(OC)c1	ZINC000875119341	JH	On-Demand	Mild	MMP1	36	44
CCN1CCC[C@@H](NC(=O)C(=O)N2CCO[C@H](c3ccc(OC)cc3)C2)C1	ZINC000875119350	GD	On-Demand	Anodyne	BIRC2	22	41
CCN1CCC[C@H](NC(=O)C(=O)N2CCO[C@@H](c3ccc(OC)cc3)C2)C1	ZINC000875119352	GD	On-Demand	Anodyne	BIRC2	22	41
CCN1CCC[C@@H](NC(=O)C(=O)N2CCO[C@@H](c3ccc(OC)cc3)C2)C1	ZINC000875119354	GD	On-Demand	Anodyne	BIRC2	22	41
CCN1CCC[C@H](NC(=O)C(=O)N2CCO[C@H](c3ccc(OC)cc3)C2)C1	ZINC000875119356	GD	On-Demand	Anodyne	BIRC2	22	41
COC(=O)C1(O)CN(C(=O)NCc2cccc(CN3CCOCC3)c2)C1	ZINC000875119359	FB	On-Demand	Anodyne	CHRM3	17	40
CCC[C@@H](CCO)NC(=O)NCc1cccc(OC(C)C)c1	ZINC000875119367	DF	On-Demand	Anodyne	ANPEP	18	48
CCC[C@@H](CCO)NC(=O)NCc1cccc(OC(C)C)c1	ZINC000875119367	DF	On-Demand	Anodyne	PDS	50	35
CCC[C@H](CCO)NC(=O)NCc1cccc(OC(C)C)c1	ZINC000875119369	DF	On-Demand	Anodyne	ANPEP	18	48
CCC[C@H](CCO)NC(=O)NCc1cccc(OC(C)C)c1	ZINC000875119369	DF	On-Demand	Anodyne	PDS	50	35
O=C(NCc1ccc(Cl)nc1)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875119458	EG	On-Demand	Anodyne	Q8WSF8_APLCA	42	32
O=C(NCc1ccc(Cl)nc1)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875119458	EG	On-Demand	Anodyne	NACHRBETA2	46	38
O=C(NCc1ccc(Cl)nc1)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875119460	EG	On-Demand	Anodyne	Q8WSF8_APLCA	42	32
O=C(NCc1ccc(Cl)nc1)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875119460	EG	On-Demand	Anodyne	NACHRBETA2	46	38
CN(C[C@@H]1C[C@H](O)C1)C(=O)NCc1ccc(Cl)nc1	ZINC000875119465	CD	On-Demand	Anodyne	NACHRBETA2	34	42
O=C(NCc1ccc(Cl)nc1)N[C@@H]1C[C@H](CO)C1	ZINC000875119479	CD	On-Demand	Anodyne	NACHRBETA2	36	42
O=C(NCc1ccc(Cl)nc1)N1CC[C@H]2CC[C@@H](C1)S2(=O)=O	ZINC000875119516	ED	On-Demand	Anodyne	Q8WSF8_APLCA	41	32
O=C(NCc1ccc(Cl)nc1)N1CC[C@H]2CC[C@@H](C1)S2(=O)=O	ZINC000875119516	ED	On-Demand	Anodyne	NACHRBETA2	41	38
N#Cc1ccc(Cn2cc(NC(=O)NC3CCN(CC4CC4)CC3)cn2)cc1	ZINC000875119526	GF	On-Demand	Mild	SIGMAR1	20	44
N#Cc1ccc(Cn2cc(NC(=O)NC3CCN(CC4CC4)CC3)cn2)cc1	ZINC000875119526	GF	On-Demand	Mild	CCR3	40	44
N#Cc1ccc(Cn2cc(NC(=O)NC3CCN(CC4CC4)CC3)cn2)cc1	ZINC000875119526	GF	On-Demand	Mild	ITK	15	48
N#Cc1ccc(Cn2cc(NC(=O)NC3CCN(CC4CC4)CC3)cn2)cc1	ZINC000875119526	GF	On-Demand	Mild	CXCR3	20	40
N#Cc1ccc(Cn2cc(NC(=O)NC3CCN(CC4CC4)CC3)cn2)cc1	ZINC000875119526	GF	On-Demand	Mild	MCHR1	27	46
N#Cc1ccc(Cn2cc(NC(=O)NC3CCN(CC4CC4)CC3)cn2)cc1	ZINC000875119526	GF	On-Demand	Mild	PANC	41	36
N#CCc1ccsc1C(=O)N(CCc1ccccc1)C1CC1	ZINC000875119528	DH	On-Demand	Mild	C5AR1	25	41
N#CCc1ccsc1C(=O)N(CCc1ccccc1)C1CC1	ZINC000875119528	DH	On-Demand	Mild	MBTPS1	40	33
O=C(NCc1ccc(OCCOc2ccccc2)nc1)NC[C@H]1C[C@H](O)C1	ZINC000875119529	FE	On-Demand	Anodyne	GRIN2B	19	40
CCN1CCC[C@H](NC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)C1	ZINC000875119549	GD	On-Demand	Anodyne	ETHR	55	46
CCN1CCC[C@@H](NC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)C1	ZINC000875119551	GD	On-Demand	Anodyne	ETHR	55	46
O=C(NCc1ccc(Cl)nc1)N1CCC(CCO)(CCO)CC1	ZINC000875119556	ED	On-Demand	Anodyne	NAMPT	21	41
O=C(NCc1ccc(Cl)nc1)N1CCC(CCO)(CCO)CC1	ZINC000875119556	ED	On-Demand	Anodyne	NACHRBETA2	47	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(OC(C)C)c1	ZINC000875119575	EF	On-Demand	Anodyne	SLC6A4	33	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(OC(C)C)c1	ZINC000875119575	EF	On-Demand	Anodyne	SLC6A3	61	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(OC(C)C)c1	ZINC000875119577	EF	On-Demand	Anodyne	SLC6A4	33	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(OC(C)C)c1	ZINC000875119577	EF	On-Demand	Anodyne	SLC6A3	61	42
CC[C@@H](NC(=O)NCc1cccc(CN2CCOCC2)c1)[C@H](O)c1ccccc1	ZINC000875119583	GF	On-Demand	Anodyne	HRH2	21	40
CC[C@@H](NC(=O)NCc1cccc(CN2CCOCC2)c1)[C@H](O)c1ccccc1	ZINC000875119583	GF	On-Demand	Anodyne	CHRM3	21	40
CC[C@@H](NC(=O)NCc1cccc(CN2CCOCC2)c1)[C@H](O)c1ccccc1	ZINC000875119583	GF	On-Demand	Anodyne	CASR	44	37
CC[C@@H](NC(=O)NCc1cccc(CN2CCOCC2)c1)[C@@H](O)c1ccccc1	ZINC000875119586	GF	On-Demand	Anodyne	HRH2	21	40
CC[C@@H](NC(=O)NCc1cccc(CN2CCOCC2)c1)[C@@H](O)c1ccccc1	ZINC000875119586	GF	On-Demand	Anodyne	CHRM3	21	40
CC[C@@H](NC(=O)NCc1cccc(CN2CCOCC2)c1)[C@@H](O)c1ccccc1	ZINC000875119586	GF	On-Demand	Anodyne	CASR	44	37
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(CC2CC2)CC1	ZINC000875119591	FE	On-Demand	Anodyne	DRD4	23	45
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(CC2CC2)CC1	ZINC000875119591	FE	On-Demand	Anodyne	SIGMAR1	23	51
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(CC2CC2)CC1	ZINC000875119591	FE	On-Demand	Anodyne	CCR3	44	39
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(CC2CC2)CC1	ZINC000875119591	FE	On-Demand	Anodyne	EPHX2	22	43
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(CC2CC2)CC1	ZINC000875119591	FE	On-Demand	Anodyne	MCHR1	25	43
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(CC2CC2)CC1	ZINC000875119593	FE	On-Demand	Anodyne	DRD4	23	45
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(CC2CC2)CC1	ZINC000875119593	FE	On-Demand	Anodyne	SIGMAR1	23	51
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(CC2CC2)CC1	ZINC000875119593	FE	On-Demand	Anodyne	CCR3	44	39
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(CC2CC2)CC1	ZINC000875119593	FE	On-Demand	Anodyne	EPHX2	22	43
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(CC2CC2)CC1	ZINC000875119593	FE	On-Demand	Anodyne	MCHR1	25	43
COC(=O)N(C)NC(=O)NCc1cccc(CN2CCOCC2)c1	ZINC000875119594	EC	On-Demand	Reactive	HRH2	26	40
COC(=O)N(C)NC(=O)NCc1cccc(CN2CCOCC2)c1	ZINC000875119594	EC	On-Demand	Reactive	CHRM3	19	41
O=C(NCc1ccc(Cl)nc1)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875119599	CD	On-Demand	Anodyne	NAMPT	26	41
O=C(NCc1ccc(Cl)nc1)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875119599	CD	On-Demand	Anodyne	NACHRBETA2	41	39
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(OCC(=O)N(C)C)c1	ZINC000875119600	FD	On-Demand	Anodyne	ROCK2	25	42
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(OCC(=O)N(C)C)c1	ZINC000875119600	FD	On-Demand	Anodyne	PDS	89	40
CCN1CCC[C@H](NC(=O)C(=O)N[C@@H](C)c2ccc(C(F)(F)F)nc2)C1	ZINC000875119606	FD	On-Demand	Anodyne	BIRC2	36	40
CCN1CCC[C@@H](NC(=O)C(=O)N[C@H](C)c2ccc(C(F)(F)F)nc2)C1	ZINC000875119608	FD	On-Demand	Anodyne	BIRC2	36	40
CCN1CCC[C@@H](NC(=O)C(=O)N[C@@H](C)c2ccc(C(F)(F)F)nc2)C1	ZINC000875119610	FD	On-Demand	Anodyne	BIRC2	36	40
O=C(NCc1ccccc1OC1CCCC1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875119611	GF	On-Demand	Anodyne	EPHX2	16	49
CCN1CCC[C@H](NC(=O)C(=O)N[C@H](C)c2ccc(C(F)(F)F)nc2)C1	ZINC000875119612	FD	On-Demand	Anodyne	BIRC2	36	40
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(C)cc1C	ZINC000875119649	CF	On-Demand	Anodyne	ANPEP	15	43
CCOc1cc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)ccc1OC(F)F	ZINC000875119653	GG	On-Demand	Anodyne	SSTR5	65	36
CCOc1cc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)ccc1OC(F)F	ZINC000875119654	GG	On-Demand	Anodyne	SSTR5	65	36
CCOc1cc(CNC(=O)NC2CC(C(=O)OC)C2)ccc1OC(F)F	ZINC000875119667	FE	On-Demand	Anodyne	SSTR5	42	34
COC(=O)C1(O)CN(C(=O)NCc2ccccc2OC2CCCC2)C1	ZINC000875119670	ED	On-Demand	Anodyne	EPHX2	17	45
O=C(NCc1cccc(CN2CCOCC2)c1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875119687	GG	On-Demand	Anodyne	CHRM3	17	40
CCOc1cc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)ccc1OC(F)F	ZINC000875119692	FF	On-Demand	Anodyne	SSTR5	66	35
CCOc1cc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)ccc1OC(F)F	ZINC000875119693	FF	On-Demand	Anodyne	SSTR5	66	35
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCNC(=O)c1ccc(OC)cc1	ZINC000875119749	GD	On-Demand	Anodyne	DRD4	40	31
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCNC(=O)c1ccc(OC)cc1	ZINC000875119749	GD	On-Demand	Anodyne	SLC6A4	22	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCNC(=O)c1ccc(OC)cc1	ZINC000875119749	GD	On-Demand	Anodyne	SLC6A3	41	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCNC(=O)c1ccc(OC)cc1	ZINC000875119749	GD	On-Demand	Anodyne	PLD1	15	42
CCOc1cc(CNC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)ccc1OC(F)F	ZINC000875119756	GF	On-Demand	Anodyne	SLC6A4	28	43
CCOc1cc(CNC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)ccc1OC(F)F	ZINC000875119756	GF	On-Demand	Anodyne	SLC6A3	65	43
CCOc1cc(CNC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)ccc1OC(F)F	ZINC000875119756	GF	On-Demand	Anodyne	SSTR5	49	33
CCOc1cc(CNC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)ccc1OC(F)F	ZINC000875119757	GF	On-Demand	Anodyne	SLC6A4	28	43
CCOc1cc(CNC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)ccc1OC(F)F	ZINC000875119757	GF	On-Demand	Anodyne	SLC6A3	65	43
CCOc1cc(CNC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)ccc1OC(F)F	ZINC000875119757	GF	On-Demand	Anodyne	SSTR5	49	33
Cn1nc(Cl)c(C(=O)N(Cc2cccc(F)c2)C2CC2)c1Cl	ZINC000875119780	EH	On-Demand	Anodyne	SLC6A9	37	49
O=C(NCc1cccc(CN2CCOCC2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875119790	ED	On-Demand	Anodyne	HRH2	24	41
O=C(NCc1cccc(CN2CCOCC2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875119790	ED	On-Demand	Anodyne	CHRM3	17	41
O=C(NCc1cccc(CN2CCOCC2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875119790	ED	On-Demand	Anodyne	EPHX2	21	43
O=C(NCc1ccc(Cl)nc1)N1CC=CC1	ZINC000875119804	BD	On-Demand	Anodyne	NAMPT	29	44
O=C(NCc1ccc(Cl)nc1)N1CC=CC1	ZINC000875119804	BD	On-Demand	Anodyne	Q8WSF8_APLCA	40	36
O=C(NCc1ccc(Cl)nc1)N1CC=CC1	ZINC000875119804	BD	On-Demand	Anodyne	NACHRBETA2	54	45
CN1CCN(C(=O)NCc2cccc(CN3CCOCC3)c2)CCC1(C)C	ZINC000875119806	FE	On-Demand	Anodyne	CHRM3	18	43
C#CC[C@@H](COC)NC(=O)C(=O)NCCc1ccc(OC)cc1OC	ZINC000875119815	EC	On-Demand	Mild	MTNR1A	77	39
C#CC[C@@H](COC)NC(=O)C(=O)NCCc1ccc(OC)cc1OC	ZINC000875119815	EC	On-Demand	Mild	MTNR1B	59	38
C#CC[C@H](COC)NC(=O)C(=O)NCCc1ccc(OC)cc1OC	ZINC000875119817	EC	On-Demand	Mild	MTNR1A	77	39
C#CC[C@H](COC)NC(=O)C(=O)NCCc1ccc(OC)cc1OC	ZINC000875119817	EC	On-Demand	Mild	MTNR1B	59	38
COc1cc(CNC(=O)C(=O)NCc2ccc(OC(F)F)cc2F)ccc1C	ZINC000875119825	GF	On-Demand	Anodyne	LEF	61	39
CCN1CCC[C@@H](NC(=O)C(=O)NC(c2ccnn2C)c2ccnn2C)C1	ZINC000875119834	FB	On-Demand	Anodyne	BIRC2	37	40
CCN1CCC[C@H](NC(=O)C(=O)NC(c2ccnn2C)c2ccnn2C)C1	ZINC000875119838	FB	On-Demand	Anodyne	BIRC2	37	40
CC[C@H](C[C@H](C)O)NC(=O)NCCNC(=O)c1ccc(OC)cc1	ZINC000875119839	ED	On-Demand	Anodyne	CTSL	19	46
COc1cc(CNC(=O)C(=O)NC[C@@H]2c3ccccc3CN2C)ccc1C	ZINC000875119857	FD	On-Demand	Anodyne	DRD4	40	31
COc1cc(CNC(=O)C(=O)NC[C@@H]2c3ccccc3CN2C)ccc1C	ZINC000875119857	FD	On-Demand	Anodyne	DRD3	45	41
COc1cc(CNC(=O)C(=O)NC[C@@H]2c3ccccc3CN2C)ccc1C	ZINC000875119857	FD	On-Demand	Anodyne	HCRTR1	17	41
COc1cc(CNC(=O)C(=O)NC[C@H]2c3ccccc3CN2C)ccc1C	ZINC000875119858	FD	On-Demand	Anodyne	DRD4	40	31
COc1cc(CNC(=O)C(=O)NC[C@H]2c3ccccc3CN2C)ccc1C	ZINC000875119858	FD	On-Demand	Anodyne	DRD3	45	41
COc1cc(CNC(=O)C(=O)NC[C@H]2c3ccccc3CN2C)ccc1C	ZINC000875119858	FD	On-Demand	Anodyne	HCRTR1	17	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)c(OC)c1OC	ZINC000875119860	GD	On-Demand	Anodyne	SLC6A4	23	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)c(OC)c1OC	ZINC000875119860	GD	On-Demand	Anodyne	SLC6A3	43	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)c(OC)c1OC	ZINC000875119860	GD	On-Demand	Anodyne	SLC9A1	43	29
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)c(OC)c1OC	ZINC000875119861	GD	On-Demand	Anodyne	SLC6A4	23	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)c(OC)c1OC	ZINC000875119861	GD	On-Demand	Anodyne	SLC6A3	43	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)c(OC)c1OC	ZINC000875119861	GD	On-Demand	Anodyne	SLC9A1	43	29
CCN1CCC[C@H](NC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)C1	ZINC000875119866	FD	On-Demand	Anodyne	BIRC2	41	43
CCN1CCC[C@H](NC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)C1	ZINC000875119869	FD	On-Demand	Anodyne	BIRC2	41	43
CCN1CCC[C@H](NC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)C1	ZINC000875119872	FD	On-Demand	Anodyne	BIRC2	41	43
CCN1CCC[C@H](NC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)C1	ZINC000875119875	FD	On-Demand	Anodyne	BIRC2	41	43
C=CCc1ccc(OC(=O)[C@H]2CCCN2C(=O)C23CC4CC(CC(C4)C2)C3)c(OC)c1	ZINC000875119876	HJ	On-Demand	Mild	FKBP1A	61	47
C=CCc1ccc(OC(=O)c2ccc(NC(=O)C3CC3)cc2)c(OC)c1	ZINC000875119880	FH	On-Demand	Mild	PRSS1	15	59
C=CCc1ccc(OC(=O)c2ccc(NC(=O)C3CC3)cc2)c(OC)c1	ZINC000875119880	FH	On-Demand	Mild	MTNR1B	18	42
C=CCc1ccc(OC(=O)c2ccc(NC(=O)C3CC3)cc2)c(OC)c1	ZINC000875119880	FH	On-Demand	Mild	ACR	70	59
C=CCc1ccc(OC(=O)[C@@H]2CCCN2C(=O)C23CC4CC(CC(C4)C2)C3)c(OC)c1	ZINC000875119881	HJ	On-Demand	Mild	FKBP1A	61	47
O=C(NCc1ccc(Cl)nc1)N(CCO)CCOCCO	ZINC000875119898	DC	On-Demand	Anodyne	NACHRBETA2	23	41
CCOc1ccccc1Oc1ccc(CNC(=O)NC2(C)CC(F)(F)C2)cn1	ZINC000875119899	GI	On-Demand	Anodyne	HCN1	48	31
CCOc1ccccc1Oc1ccc(CNC(=O)NC2(C)CC(F)(F)C2)cn1	ZINC000875119899	GI	On-Demand	Anodyne	HCN4	40	31
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2OC2CCCC2)CC1	ZINC000875119915	GE	On-Demand	Anodyne	EPHX2	37	50
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2OC2CCCC2)CC1	ZINC000875119915	GE	On-Demand	Anodyne	SCD1	17	41
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2OC2CCCC2)CC1	ZINC000875119915	GE	On-Demand	Anodyne	SCD	16	42
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cl)nc1	ZINC000875119919	DE	On-Demand	Anodyne	NACHRBETA2	18	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCn2ccnc2C)CC1	ZINC000875119921	FH	On-Demand	Anodyne	HTR1A	25	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCn2ccnc2C)CC1	ZINC000875119921	FH	On-Demand	Anodyne	DRD2	26	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCn2ccnc2C)CC1	ZINC000875119921	FH	On-Demand	Anodyne	ACKR3	62	32
COc1ccccc1[C@H]1CCCN(C(=O)NCCCn2ccnc2C)CC1	ZINC000875119922	FH	On-Demand	Anodyne	HTR1A	25	42
COc1ccccc1[C@H]1CCCN(C(=O)NCCCn2ccnc2C)CC1	ZINC000875119922	FH	On-Demand	Anodyne	DRD2	26	42
COc1ccccc1[C@H]1CCCN(C(=O)NCCCn2ccnc2C)CC1	ZINC000875119922	FH	On-Demand	Anodyne	ACKR3	62	32
COCC(C)(C)CCNC(=O)C(=O)NCC1(c2ccccc2OC)CCCC1	ZINC000875119923	GF	On-Demand	Anodyne	KCNA3	43	37
COCC(C)(C)CCNC(=O)C(=O)NCC1(c2ccccc2OC)CCCC1	ZINC000875119923	GF	On-Demand	Anodyne	NMBR	17	40
CCN1CCC[C@@H](NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875119926	FD	On-Demand	Anodyne	CHRNA7	42	35
CCN1CCC[C@@H](NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875119926	FD	On-Demand	Anodyne	C3AR1	43	42
CCN1CCC[C@@H](NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875119926	FD	On-Demand	Anodyne	BIRC2	39	41
CCN1CCC[C@H](NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875119927	FD	On-Demand	Anodyne	CHRNA7	42	35
CCN1CCC[C@H](NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875119927	FD	On-Demand	Anodyne	C3AR1	43	42
CCN1CCC[C@H](NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875119927	FD	On-Demand	Anodyne	BIRC2	39	41
CCN1CCC[C@H](NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875119928	FD	On-Demand	Anodyne	CHRNA7	42	35
CCN1CCC[C@H](NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875119928	FD	On-Demand	Anodyne	C3AR1	43	42
CCN1CCC[C@H](NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875119928	FD	On-Demand	Anodyne	BIRC2	39	41
CCN1CCC[C@@H](NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875119929	FD	On-Demand	Anodyne	CHRNA7	42	35
CCN1CCC[C@@H](NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875119929	FD	On-Demand	Anodyne	C3AR1	43	42
CCN1CCC[C@@H](NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875119929	FD	On-Demand	Anodyne	BIRC2	39	41
CCCCCCCNC(=O)C(=O)N[C@H]1CCCN(CC)C1	ZINC000875119930	CD	On-Demand	Mild	TPP2	17	40
CCCCCCCNC(=O)C(=O)N[C@H]1CCCN(CC)C1	ZINC000875119930	CD	On-Demand	Mild	ASAH1	79	34
CCCCCCCNC(=O)C(=O)N[C@@H]1CCCN(CC)C1	ZINC000875119931	CD	On-Demand	Mild	TPP2	17	40
CCCCCCCNC(=O)C(=O)N[C@@H]1CCCN(CC)C1	ZINC000875119931	CD	On-Demand	Mild	ASAH1	79	34
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C)cc1C	ZINC000875119951	DF	On-Demand	Anodyne	SLC6A4	28	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C)cc1C	ZINC000875119951	DF	On-Demand	Anodyne	SLC6A3	57	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C)cc1C	ZINC000875119953	DF	On-Demand	Anodyne	SLC6A4	28	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C)cc1C	ZINC000875119953	DF	On-Demand	Anodyne	SLC6A3	57	41
O=C(NCc1ccc(Cl)nc1)N1CCc2nc(C3CC3)ncc2C1	ZINC000875119973	EF	On-Demand	Anodyne	MAPK1	42	46
CCOc1ccccc1Oc1ccc(CNC(=O)NC[C@H]2C[C@H](O)C2)cn1	ZINC000875119988	FF	On-Demand	Anodyne	HCN1	47	31
CCOc1ccccc1Oc1ccc(CNC(=O)NC[C@H]2C[C@H](O)C2)cn1	ZINC000875119988	FF	On-Demand	Anodyne	HCN4	40	31
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3ccc(F)c(F)c3)CC2)c(OC)c1	ZINC000875119990	JH	On-Demand	Mild	TGM2	37	45
C=CC(C)(C)CCCNC(=O)C(=O)NCc1ccc(C)c(OC)c1	ZINC000875120007	EF	On-Demand	Mild	TRPV1	23	42
O=C(NC1CCN(CC2CC2)CC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875120011	FF	On-Demand	Anodyne	SIGMAR1	25	40
O=C(NC1CCN(CC2CC2)CC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875120013	FF	On-Demand	Anodyne	SIGMAR1	25	40
O=C(NC1CCN(CC2CC2)CC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875120015	FF	On-Demand	Anodyne	SIGMAR1	25	40
O=C(NC1CCN(CC2CC2)CC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875120016	FF	On-Demand	Anodyne	SIGMAR1	25	40
O=C(NCc1ccc(Cl)nc1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875120017	EF	On-Demand	Anodyne	EPHX2	17	52
O=C(NCc1ccc(Cl)nc1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875120017	EF	On-Demand	Anodyne	NAMPT	19	44
O=C(NCc1ccc(Cl)nc1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875120018	EF	On-Demand	Anodyne	EPHX2	17	52
O=C(NCc1ccc(Cl)nc1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875120018	EF	On-Demand	Anodyne	NAMPT	19	44
CCN1CCC[C@H](NC(=O)C(=O)NCc2nc(-c3ccncc3)cs2)C1	ZINC000875120019	FD	On-Demand	Anodyne	PRKD1	46	33
CCN1CCC[C@@H](NC(=O)C(=O)NCc2nc(-c3ccncc3)cs2)C1	ZINC000875120020	FD	On-Demand	Anodyne	PRKD1	46	33
CCN1CCC[C@H](NC(=O)C(=O)N2CCC[C@@H]2c2cncc(C)c2)C1	ZINC000875120031	ED	On-Demand	Anodyne	SSTR5	30	42
CCN1CCC[C@@H](NC(=O)C(=O)N2CCC[C@@H]2c2cncc(C)c2)C1	ZINC000875120033	ED	On-Demand	Anodyne	SSTR5	30	42
CCN1CCC[C@H](NC(=O)C(=O)N2CCC[C@H]2c2cncc(C)c2)C1	ZINC000875120035	ED	On-Demand	Anodyne	SSTR5	30	42
COCCN(CC1CCN(C)CC1)C(=O)NCc1cccc(OC(C)C)c1	ZINC000875120036	GF	On-Demand	Anodyne	MMP13	18	41
O=C(NCc1cccc(CN2CCOCC2)c1)N1CCC(CO)(CO)CC1	ZINC000875120037	GC	On-Demand	Anodyne	CHRM3	20	41
O=C(NCc1cccc(CN2CCOCC2)c1)N1CCC(CO)(CO)CC1	ZINC000875120037	GC	On-Demand	Anodyne	FAAH	21	41
O=C(NCc1cccc(CN2CCOCC2)c1)N1CCC(CO)(CO)CC1	ZINC000875120037	GC	On-Demand	Anodyne	NPFFR1	40	36
CCN1CCC[C@@H](NC(=O)C(=O)N2CCC[C@H]2c2cncc(C)c2)C1	ZINC000875120040	ED	On-Demand	Anodyne	SSTR5	30	42
C=CCc1ccc(OC(=O)c2ccc(OC)c(S(=O)(=O)NC(C)(C)C)c2)c(OC)c1	ZINC000875120042	IH	On-Demand	Mild	ACR	18	56
C=CCc1ccc(OC(=O)c2ccc(C3SCCS3)cc2)c(OC)c1	ZINC000875120047	FK	On-Demand	Mild	ACR	19	64
COC(=O)N(C)NC(=O)NCc1ccc(Cl)nc1	ZINC000875120050	CD	On-Demand	Reactive	NACHRBETA2	29	44
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NC1CCN(CC2CC2)CC1	ZINC000875120066	GF	On-Demand	Anodyne	DRD4	15	41
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NC1CCN(CC2CC2)CC1	ZINC000875120066	GF	On-Demand	Anodyne	SIGMAR1	22	45
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NC1CCN(CC2CC2)CC1	ZINC000875120066	GF	On-Demand	Anodyne	EPHX2	22	41
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NC1CCN(CC2CC2)CC1	ZINC000875120066	GF	On-Demand	Anodyne	MCHR1	22	44
CCN1CCC[C@@H](NC(=O)C(=O)N2CCO[C@@H](c3ccccc3OC)C2)C1	ZINC000875120073	GD	On-Demand	Anodyne	BIRC2	28	41
CCN1CCC[C@H](NC(=O)C(=O)N2CCO[C@@H](c3ccccc3OC)C2)C1	ZINC000875120075	GD	On-Demand	Anodyne	BIRC2	28	41
CCN1CCC[C@@H](NC(=O)C(=O)N2CCO[C@H](c3ccccc3OC)C2)C1	ZINC000875120076	GD	On-Demand	Anodyne	BIRC2	28	41
CCN1CCC[C@H](NC(=O)C(=O)N2CCO[C@H](c3ccccc3OC)C2)C1	ZINC000875120077	GD	On-Demand	Anodyne	BIRC2	28	41
CC[C@@H](NC(=O)NCCNC(=O)c1ccc(OC)cc1)[C@@H](O)c1ccccc1	ZINC000875120082	GE	On-Demand	Anodyne	CTSL	19	44
CC[C@@H](NC(=O)NCCNC(=O)c1ccc(OC)cc1)[C@@H](O)c1ccccc1	ZINC000875120082	GE	On-Demand	Anodyne	CYP27B1	22	41
CC[C@@H](NC(=O)NCCNC(=O)c1ccc(OC)cc1)[C@H](O)c1ccccc1	ZINC000875120088	GE	On-Demand	Anodyne	CTSL	19	44
CC[C@@H](NC(=O)NCCNC(=O)c1ccc(OC)cc1)[C@H](O)c1ccccc1	ZINC000875120088	GE	On-Demand	Anodyne	CYP27B1	22	41
O=C(NCc1ccc(Cl)nc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875120089	EG	On-Demand	Anodyne	F2	38	43
O=C(NCc1ccc(Cl)nc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875120089	EG	On-Demand	Anodyne	PREP	51	44
O=C(NCc1ccc(Cl)nc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875120089	EG	On-Demand	Anodyne	TMPRSS11D	57	33
O=C(NCc1ccc(Cl)nc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875120091	EG	On-Demand	Anodyne	F2	38	43
O=C(NCc1ccc(Cl)nc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875120091	EG	On-Demand	Anodyne	PREP	51	44
O=C(NCc1ccc(Cl)nc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875120091	EG	On-Demand	Anodyne	TMPRSS11D	57	33
CC[C@@H]1COCCN1CCNC(=O)NCc1ccc(OC)c(OC)c1OC	ZINC000875120092	GD	On-Demand	Anodyne	SLC9A1	44	30
O=C(NCc1ccc(Cl)nc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875120093	EG	On-Demand	Anodyne	F2	38	43
O=C(NCc1ccc(Cl)nc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875120093	EG	On-Demand	Anodyne	PREP	51	44
O=C(NCc1ccc(Cl)nc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875120093	EG	On-Demand	Anodyne	TMPRSS11D	57	33
O=C(NCc1ccc(Cl)nc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875120095	EG	On-Demand	Anodyne	F2	38	43
O=C(NCc1ccc(Cl)nc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875120095	EG	On-Demand	Anodyne	PREP	51	44
O=C(NCc1ccc(Cl)nc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875120095	EG	On-Demand	Anodyne	TMPRSS11D	57	33
C=CCc1ccc(OC(=O)CCc2c[nH]c3ccccc23)c(OC)c1	ZINC000875120100	EI	On-Demand	Mild	TACR1	22	43
C=CCc1ccc(OC(=O)CCc2c[nH]c3ccccc23)c(OC)c1	ZINC000875120100	EI	On-Demand	Mild	MC5R	49	35
C=CCc1ccc(OC(=O)CCc2c[nH]c3ccccc23)c(OC)c1	ZINC000875120100	EI	On-Demand	Mild	ECE1	44	38
C=CCc1ccc(OC(=O)CCc2c[nH]c3ccccc23)c(OC)c1	ZINC000875120100	EI	On-Demand	Mild	MMP11	43	31
C=CCc1ccc(OC(=O)CCc2c[nH]c3ccccc23)c(OC)c1	ZINC000875120100	EI	On-Demand	Mild	GHSR	58	38
C=CCc1ccc(OC(=O)CCc2c[nH]c3ccccc23)c(OC)c1	ZINC000875120100	EI	On-Demand	Mild	MC1R	42	35
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(OC(C)C)c1	ZINC000875120108	DF	On-Demand	Anodyne	ANPEP	19	52
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(OC(C)C)c1	ZINC000875120108	DF	On-Demand	Anodyne	AMP1_PLAFQ	19	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(OC(C)C)c1	ZINC000875120108	DF	On-Demand	Anodyne	PDS	88	40
O=C(NCc1cccc(CN2CCOCC2)c1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875120131	GF	On-Demand	Anodyne	CHRM3	18	41
O=C(NCc1cccc(CN2CCOCC2)c1)NC1([C@H]2CCCCO2)CCC1	ZINC000875120132	GF	On-Demand	Anodyne	CHRM3	18	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCCNC(=O)c2ccc(OC)cc2)C1	ZINC000875120141	GD	On-Demand	Anodyne	DRD4	41	32
CCOC(=O)[C@H](C)C1CN(C(=O)NCCNC(=O)c2ccc(OC)cc2)C1	ZINC000875120141	GD	On-Demand	Anodyne	CTSL	15	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCNC(=O)c2ccc(OC)cc2)C1	ZINC000875120141	GD	On-Demand	Anodyne	MMP1	15	40
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1(c2ccccc2OC)CCCC1	ZINC000875120143	GE	On-Demand	Mild	KCNA3	43	37
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1(c2ccccc2OC)CCCC1	ZINC000875120143	GE	On-Demand	Mild	HCN1	43	35
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1(c2ccccc2OC)CCCC1	ZINC000875120143	GE	On-Demand	Mild	HCN4	40	35
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1(c2ccccc2OC)CCCC1	ZINC000875120144	GE	On-Demand	Mild	KCNA3	43	37
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1(c2ccccc2OC)CCCC1	ZINC000875120144	GE	On-Demand	Mild	HCN1	43	35
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1(c2ccccc2OC)CCCC1	ZINC000875120144	GE	On-Demand	Mild	HCN4	40	35
CN(C)C[C@@H]1CN(C(=O)NCc2ccc(Cl)nc2)C[C@H]1CN(C)C	ZINC000875120148	FD	On-Demand	Anodyne	NACHRBETA2	37	41
O=C(NCc1ccc(Cl)nc1)NC[C@@H]1C[C@H](O)C1	ZINC000875120159	CD	On-Demand	Anodyne	NACHRBETA2	40	43
O=C(NCc1ccc(Cl)nc1)NCC1CC(O)C1	ZINC000875120160	CD	On-Demand	Anodyne	NACHRBETA2	40	43
CCN1CCC[C@@H](NC(=O)C(=O)N[C@@H](C)c2cc3cnccc3o2)C1	ZINC000875120167	ED	On-Demand	Anodyne	BIRC2	34	43
CCN1CCC[C@H](NC(=O)C(=O)N[C@@H](C)c2cc3cnccc3o2)C1	ZINC000875120168	ED	On-Demand	Anodyne	BIRC2	34	43
CCN1CCC[C@H](NC(=O)C(=O)N[C@H](C)c2cc3cnccc3o2)C1	ZINC000875120169	ED	On-Demand	Anodyne	BIRC2	34	43
CCN1CCC[C@@H](NC(=O)C(=O)N[C@H](C)c2cc3cnccc3o2)C1	ZINC000875120170	ED	On-Demand	Anodyne	BIRC2	34	43
C[C@@]1(CO)CN(C(=O)NCc2ccc(Cl)nc2)C[C@]1(C)CO	ZINC000875120182	ED	On-Demand	Anodyne	NAMPT	28	46
C[C@@]1(CO)CN(C(=O)NCc2ccc(Cl)nc2)C[C@]1(C)CO	ZINC000875120182	ED	On-Demand	Anodyne	NACHRBETA2	52	44
O=C(NCc1ccc(Cl)nc1)N1Cc2cccnc2N2C[C@H](O)C[C@H]2C1	ZINC000875120194	FD	On-Demand	Anodyne	NAMPT	24	41
O=C(NC1CCN(CC2CC2)CC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875120202	GG	On-Demand	Anodyne	CHRM1	15	44
O=C(NC1CCN(CC2CC2)CC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875120202	GG	On-Demand	Anodyne	DRD4	19	40
O=C(NC1CCN(CC2CC2)CC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875120202	GG	On-Demand	Anodyne	OPRL1	20	43
O=C(NC1CCN(CC2CC2)CC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875120202	GG	On-Demand	Anodyne	SIGMAR1	29	41
CCN1CCC[C@H](NC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875120247	DC	On-Demand	Anodyne	BIRC2	41	41
CCN1CCC[C@@H](NC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875120249	DC	On-Demand	Anodyne	BIRC2	41	41
CCN1CCC[C@H](NC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875120251	DC	On-Demand	Anodyne	BIRC2	41	41
CCN1CCC[C@@H](NC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875120252	DC	On-Demand	Anodyne	BIRC2	41	41
CCn1c(=O)c2ccccc2n(CC(=O)N(C)C(C)C)c1=O	ZINC000875120259	DD	On-Demand	Anodyne	TSPO	29	40
O=C(NCC[C@@H](O)COCc1ccccc1)NCc1ccc(Cl)nc1	ZINC000875120260	FF	On-Demand	Anodyne	PDS	43	35
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3cccc(CN4CCOCC4)c3)C[C@@H]1C2	ZINC000875120266	GD	On-Demand	Anodyne	HRH2	23	40
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3cccc(CN4CCOCC4)c3)C[C@@H]1C2	ZINC000875120266	GD	On-Demand	Anodyne	EPHX2	17	43
O=CN1CCCN(C(=O)NCc2ccccc2OC2CCCC2)CC1	ZINC000875120277	EE	On-Demand	Anodyne	EPHX2	23	50
COc1cc(CNC(=O)C(=O)N[C@H](C)c2ccc(C(F)(F)F)nc2)ccc1C	ZINC000875120279	GF	On-Demand	Anodyne	TRPV1	61	34
COc1cc(CNC(=O)C(=O)N[C@@H](C)c2ccc(C(F)(F)F)nc2)ccc1C	ZINC000875120280	GF	On-Demand	Anodyne	TRPV1	61	34
CCOc1ccccc1Oc1ccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)cn1	ZINC000875120281	GH	On-Demand	Anodyne	HCN1	49	33
CCOc1ccccc1Oc1ccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)cn1	ZINC000875120281	GH	On-Demand	Anodyne	HCN4	42	33
CCOc1ccccc1Oc1ccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)cn1	ZINC000875120282	GH	On-Demand	Anodyne	HCN1	49	33
CCOc1ccccc1Oc1ccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)cn1	ZINC000875120282	GH	On-Demand	Anodyne	HCN4	42	33
O=CN1CCCN(C(=O)NCc2cccc(CN3CCOCC3)c2)CC1	ZINC000875120287	FC	On-Demand	Anodyne	CHRM3	16	41
O=CN1CCCN(C(=O)NCc2cccc(CN3CCOCC3)c2)CC1	ZINC000875120287	FC	On-Demand	Anodyne	FAAH	21	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccc(OC(C)C)c2)C1	ZINC000875120296	EF	On-Demand	Anodyne	PDS	50	36
COc1cc(CNC(=O)C(=O)NCCCCC2CC2)ccc1C	ZINC000875120309	DE	On-Demand	Anodyne	TRPV1	24	43
C#CC[C@@H](COC)NC(=O)C(=O)NCc1ccc(C)c(OC)c1	ZINC000875120312	DC	On-Demand	Mild	TRPV1	18	41
C#CC[C@H](COC)NC(=O)C(=O)NCc1ccc(C)c(OC)c1	ZINC000875120313	DC	On-Demand	Mild	TRPV1	18	41
C=CCc1ccc(OC(=O)c2cccc(NC(=O)C3CC3)c2)c(OC)c1	ZINC000875120322	FH	On-Demand	Mild	MTNR1B	23	42
C=CCc1ccc(OC(=O)c2cccc(NC(=O)C3CC3)c2)c(OC)c1	ZINC000875120322	FH	On-Demand	Mild	ACR	22	51
CCOc1ccccc1Oc1ccc(CNC(=O)N2CCCN(C=O)CC2)cn1	ZINC000875120326	GF	On-Demand	Anodyne	HCN1	50	35
CCOc1ccccc1Oc1ccc(CNC(=O)N2CCCN(C=O)CC2)cn1	ZINC000875120326	GF	On-Demand	Anodyne	HCN4	42	32
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(CN2CCOCC2)c1	ZINC000875120328	GD	On-Demand	Anodyne	SLC6A3	41	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(CN2CCOCC2)c1	ZINC000875120329	GD	On-Demand	Anodyne	SLC6A3	41	37
Cc1nnc(NNC(=O)NCc2ccc(Cl)nc2)n1C	ZINC000875120348	CC	On-Demand	Reactive	NACHRBETA2	26	41
O=C(NCc1ccc(Cl)nc1)N1CCCC(F)(F)CC1	ZINC000875120359	DG	On-Demand	Anodyne	NAMPT	25	40
O=C(NC1CCN(CC2CC2)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875120364	FF	On-Demand	Anodyne	CHRM1	15	45
O=C(NC1CCN(CC2CC2)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875120364	FF	On-Demand	Anodyne	OPRL1	17	40
O=C(NC1CCN(CC2CC2)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875120364	FF	On-Demand	Anodyne	SIGMAR1	32	40
O=C(NC1CCN(CC2CC2)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875120364	FF	On-Demand	Anodyne	EPHX2	22	44
O=C(NC1CCN(CC2CC2)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875120365	FF	On-Demand	Anodyne	CHRM1	15	45
O=C(NC1CCN(CC2CC2)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875120365	FF	On-Demand	Anodyne	OPRL1	17	40
O=C(NC1CCN(CC2CC2)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875120365	FF	On-Demand	Anodyne	SIGMAR1	32	40
O=C(NC1CCN(CC2CC2)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875120365	FF	On-Demand	Anodyne	EPHX2	22	44
CC[C@@H]1COCCN1CCNC(=O)NCCNC(=O)c1ccc(OC)cc1	ZINC000875120396	GC	On-Demand	Anodyne	DRD4	46	37
CC[C@@H]1COCCN1CCNC(=O)NCCNC(=O)c1ccc(OC)cc1	ZINC000875120396	GC	On-Demand	Anodyne	MTOR	24	41
N#Cc1cccc([C@H](NC(=O)NC2CCN(CC3CC3)CC2)C(F)(F)F)c1	ZINC000875120397	GG	On-Demand	Mild	SIGMAR1	18	42
N#Cc1cccc([C@H](NC(=O)NC2CCN(CC3CC3)CC2)C(F)(F)F)c1	ZINC000875120397	GG	On-Demand	Mild	CCR3	29	41
N#Cc1cccc([C@H](NC(=O)NC2CCN(CC3CC3)CC2)C(F)(F)F)c1	ZINC000875120397	GG	On-Demand	Mild	CXCR3	15	42
N#Cc1cccc([C@H](NC(=O)NC2CCN(CC3CC3)CC2)C(F)(F)F)c1	ZINC000875120397	GG	On-Demand	Mild	MCHR1	52	48
N#Cc1cccc([C@@H](NC(=O)NC2CCN(CC3CC3)CC2)C(F)(F)F)c1	ZINC000875120398	GG	On-Demand	Mild	SIGMAR1	18	42
N#Cc1cccc([C@@H](NC(=O)NC2CCN(CC3CC3)CC2)C(F)(F)F)c1	ZINC000875120398	GG	On-Demand	Mild	CCR3	29	41
N#Cc1cccc([C@@H](NC(=O)NC2CCN(CC3CC3)CC2)C(F)(F)F)c1	ZINC000875120398	GG	On-Demand	Mild	CXCR3	15	42
N#Cc1cccc([C@@H](NC(=O)NC2CCN(CC3CC3)CC2)C(F)(F)F)c1	ZINC000875120398	GG	On-Demand	Mild	MCHR1	52	48
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3ccc(C(C)=O)cc3)CC2)c(OC)c1	ZINC000875120406	JH	On-Demand	Mild	TGM2	60	51
C=CCc1ccc(OC(=O)C2CCN(S(=O)(=O)c3ccc(C(C)=O)cc3)CC2)c(OC)c1	ZINC000875120406	JH	On-Demand	Mild	F13A1	52	33
C=CCc1ccc(OC(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2Cl)c(OC)c1	ZINC000875120423	II	On-Demand	Mild	TGM2	39	42
C=CCc1ccc(OC(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2Cl)c(OC)c1	ZINC000875120423	II	On-Demand	Mild	F13A1	44	37
O=C(NC1CCN(CC2CC2)CC1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875120437	FG	On-Demand	Anodyne	SIGMAR1	27	40
O=C(NC1CCN(CC2CC2)CC1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875120440	FG	On-Demand	Anodyne	SIGMAR1	27	40
O=C(NC1CCN(CC2CC2)CC1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875120442	FG	On-Demand	Anodyne	SIGMAR1	27	40
O=C(NC1CCN(CC2CC2)CC1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875120444	FG	On-Demand	Anodyne	SIGMAR1	27	40
CC[C@@H](NC(=O)N1CCC[C@H](C(C)=O)C1)c1ccccc1OCC(=O)N(C)C	ZINC000875120457	GF	On-Demand	Anodyne	HCN1	41	33
CC[C@@H](NC(=O)N1CCC[C@H](C(C)=O)C1)c1ccccc1OCC(=O)N(C)C	ZINC000875120457	GF	On-Demand	Anodyne	HCN4	41	33
CC[C@@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)c1ccccc1OCC(=O)N(C)C	ZINC000875120458	GF	On-Demand	Anodyne	HCN1	41	33
CC[C@@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)c1ccccc1OCC(=O)N(C)C	ZINC000875120458	GF	On-Demand	Anodyne	HCN4	41	33
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(CN2CCOCC2)c1	ZINC000875120464	ED	On-Demand	Anodyne	HRH2	23	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(CN2CCOCC2)c1	ZINC000875120464	ED	On-Demand	Anodyne	CHRM3	17	41
CC(=O)NC[C@@H]1CCCCN1C(=O)NCc1cccc(OC(C)C)c1	ZINC000875120484	EF	On-Demand	Anodyne	F2	20	43
CC(=O)NC[C@@H]1CCCCN1C(=O)NCc1cccc(OC(C)C)c1	ZINC000875120484	EF	On-Demand	Anodyne	FKBP1A	38	44
CC(=O)NC[C@@H]1CCCCN1C(=O)NCc1cccc(OC(C)C)c1	ZINC000875120484	EF	On-Demand	Anodyne	CPT1A	23	43
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(OC)c(OC)c2OC)C1	ZINC000875120489	GE	On-Demand	Anodyne	SLC9A1	57	32
O=C(NCc1ccc(Cl)nc1)N[C@H]1COC[C@H]1O	ZINC000875120493	CC	On-Demand	Anodyne	NACHRBETA2	39	41
C=CCc1ccc(OC(=O)c2cc(C(=O)OCC)cc([N+](=O)[O-])c2)c(OC)c1	ZINC000875120526	GH	On-Demand	Mild	CACNA1D	51	39
C=CCc1ccc(OC(=O)c2cc(C(=O)OCC)cc([N+](=O)[O-])c2)c(OC)c1	ZINC000875120526	GH	On-Demand	Mild	ACR	17	55
O=C(NCc1ccc(Cl)nc1)N1CCCC2(CC1)CC2	ZINC000875120527	CG	On-Demand	Anodyne	NAMPT	27	41
O=C(NCc1ccc(Cl)nc1)N1CCCC2(CC1)CC2	ZINC000875120527	CG	On-Demand	Anodyne	NACHRBETA2	41	41
COC(=O)N(C)NC(=O)NCc1cccc(OC(C)C)c1	ZINC000875120531	CD	On-Demand	Reactive	ROCK1	28	43
COC(=O)N(C)NC(=O)NCc1cccc(OC(C)C)c1	ZINC000875120531	CD	On-Demand	Reactive	ROCK2	35	43
COC(=O)N(C)NC(=O)NCc1cccc(OC(C)C)c1	ZINC000875120531	CD	On-Demand	Reactive	AMP1_PLAFQ	25	42
COC(=O)N(C)NC(=O)NCc1cccc(OC(C)C)c1	ZINC000875120531	CD	On-Demand	Reactive	PDS	58	35
C=CCc1ccc(OC(=O)[C@H]2Cc3ccccc3CN2S(=O)(=O)c2cccs2)c(OC)c1	ZINC000875120536	JI	On-Demand	Mild	MMP3	23	42
C=CCc1ccc(OC(=O)[C@H]2Cc3ccccc3CN2S(=O)(=O)c2cccs2)c(OC)c1	ZINC000875120536	JI	On-Demand	Mild	MMP8	29	43
C=CCc1ccc(OC(=O)[C@H]2Cc3ccccc3CN2S(=O)(=O)c2cccs2)c(OC)c1	ZINC000875120536	JI	On-Demand	Mild	ADAM9	41	35
O=C(c1scnc1C(F)F)N(Cc1cccc(F)c1)C1CC1	ZINC000875120537	EI	On-Demand	Anodyne	SLC6A9	25	40
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc(Cl)nc1	ZINC000875120548	CC	On-Demand	Anodyne	NAMPT	15	41
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc(Cl)nc1	ZINC000875120548	CC	On-Demand	Anodyne	Q8WSF8_APLCA	40	33
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc(Cl)nc1	ZINC000875120548	CC	On-Demand	Anodyne	NACHRBETA2	40	37
O=C(NCCN1CC[C@H](O)C1)NCc1ccc(Cl)nc1	ZINC000875120557	CC	On-Demand	Anodyne	NAMPT	15	41
O=C(NCCN1CC[C@H](O)C1)NCc1ccc(Cl)nc1	ZINC000875120557	CC	On-Demand	Anodyne	Q8WSF8_APLCA	40	33
O=C(NCCN1CC[C@H](O)C1)NCc1ccc(Cl)nc1	ZINC000875120557	CC	On-Demand	Anodyne	NACHRBETA2	40	37
O=C(NCC[C@H](O)C1CCCC1)NCc1cccc(CN2CCOCC2)c1	ZINC000875120562	GE	On-Demand	Anodyne	HRH2	27	44
O=C(NCC[C@H](O)C1CCCC1)NCc1cccc(CN2CCOCC2)c1	ZINC000875120562	GE	On-Demand	Anodyne	CHRM3	19	40
O=C(NCC[C@H](O)C1CCCC1)NCc1cccc(CN2CCOCC2)c1	ZINC000875120562	GE	On-Demand	Anodyne	MCHR1	16	41
O=C(NCC[C@@H](O)C1CCCC1)NCc1cccc(CN2CCOCC2)c1	ZINC000875120564	GE	On-Demand	Anodyne	HRH2	27	44
O=C(NCC[C@@H](O)C1CCCC1)NCc1cccc(CN2CCOCC2)c1	ZINC000875120564	GE	On-Demand	Anodyne	CHRM3	19	40
O=C(NCC[C@@H](O)C1CCCC1)NCc1cccc(CN2CCOCC2)c1	ZINC000875120564	GE	On-Demand	Anodyne	MCHR1	16	41
O=C(NCc1ccccc1OC1CCCC1)N1CCC(CO)(CO)CC1	ZINC000875120568	FE	On-Demand	Anodyne	EPHX2	28	50
CC[C@@H](NC(=O)NCc1cccc(OCC(=O)N(C)C)c1)[C@@H](O)c1ccccc1	ZINC000875120570	GE	On-Demand	Anodyne	ROCK2	19	41
CC[C@@H](NC(=O)NCc1cccc(OCC(=O)N(C)C)c1)[C@@H](O)c1ccccc1	ZINC000875120570	GE	On-Demand	Anodyne	PDS	94	43
CC[C@@H](NC(=O)NCc1cccc(OCC(=O)N(C)C)c1)[C@H](O)c1ccccc1	ZINC000875120575	GE	On-Demand	Anodyne	ROCK2	19	41
CC[C@@H](NC(=O)NCc1cccc(OCC(=O)N(C)C)c1)[C@H](O)c1ccccc1	ZINC000875120575	GE	On-Demand	Anodyne	PDS	94	43
CC[C@@H]1COCCN1CCNC(=O)NCc1cccc(CN2CCOCC2)c1	ZINC000875120604	GD	On-Demand	Anodyne	HRH2	26	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccc(OCC(=O)N(C)C)c2)C1	ZINC000875120615	GD	On-Demand	Anodyne	PDS	50	36
O=C(NCc1cccc(CN2CCOCC2)c1)N1Cc2cccc(O)c2C1	ZINC000875120628	FE	On-Demand	Clean	CHRM3	17	43
O=C(NCc1cccc(CN2CCOCC2)c1)N1Cc2cccc(O)c2C1	ZINC000875120628	FE	On-Demand	Clean	NAMPT	26	42
COC(=O)C1(O)CN(C(=O)NCc2cccc(OC(C)C)c2)C1	ZINC000875120630	DC	On-Demand	Anodyne	PDS	40	33
COc1cc(CNC(=O)C(=O)N2CCC[C@@H]2c2cncc(C)c2)ccc1C	ZINC000875120645	FF	On-Demand	Anodyne	SSTR5	30	45
COc1cc(CNC(=O)C(=O)N2CCC[C@H]2c2cncc(C)c2)ccc1C	ZINC000875120646	FF	On-Demand	Anodyne	SSTR5	30	45
COc1cc(CNC(=O)C(=O)N(C)C[C@H](C)NC(=O)OC(C)(C)C)ccc1C	ZINC000875120649	GD	On-Demand	Anodyne	TRPV1	23	40
COc1cc(CNC(=O)C(=O)N(C)C[C@@H](C)NC(=O)OC(C)(C)C)ccc1C	ZINC000875120650	GD	On-Demand	Anodyne	TRPV1	23	40
CC[C@H](NC(=O)c1c(Cl)nn(C)c1Cl)c1cccc(Cl)c1	ZINC000875120659	EI	On-Demand	Anodyne	TACR3	52	43
CC[C@H](NC(=O)c1c(Cl)nn(C)c1Cl)c1cccc(Cl)c1	ZINC000875120659	EI	On-Demand	Anodyne	PDS	24	40
COCC(C)(C)CCNC(=O)C(=O)NCc1ccc(C)c(OC)c1	ZINC000875120663	ED	On-Demand	Anodyne	TRPV1	26	43
COCC(C)(C)CCNC(=O)C(=O)NCc1ccc(C)c(OC)c1	ZINC000875120663	ED	On-Demand	Anodyne	MT-ND1	23	41
COc1cc(CNC(=O)C(=O)N2CCC(N3CCN(C)CC3)CC2)ccc1C	ZINC000875120683	GC	On-Demand	Anodyne	L3MBTL3	50	38
O=C(NCCC[C@H]1C=CCC1)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875120701	FF	On-Demand	Anodyne	DRD3	16	43
O=C(NCCC[C@@H]1C=CCC1)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875120702	FF	On-Demand	Anodyne	DRD3	16	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875120705	FD	On-Demand	Anodyne	DRD4	29	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875120705	FD	On-Demand	Anodyne	ACHE	15	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875120705	FD	On-Demand	Anodyne	SIGMAR1	29	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875120705	FD	On-Demand	Anodyne	SSTR5	64	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875120705	FD	On-Demand	Anodyne	PDK1	33	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875120705	FD	On-Demand	Anodyne	MCHR1	33	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(N(CC)CC)cc1	ZINC000875120708	DF	On-Demand	Clean	ANPEP	15	42
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCN1Cc2ccccc2C1	ZINC000875120713	GD	On-Demand	Anodyne	DRD2	17	40
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCN1Cc2ccccc2C1	ZINC000875120713	GD	On-Demand	Anodyne	DRD4	41	33
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCN1Cc2ccccc2C1	ZINC000875120713	GD	On-Demand	Anodyne	DRD3	28	43
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCN1Cc2ccccc2C1	ZINC000875120714	GD	On-Demand	Anodyne	DRD2	17	40
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCN1Cc2ccccc2C1	ZINC000875120714	GD	On-Demand	Anodyne	DRD4	41	33
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCN1Cc2ccccc2C1	ZINC000875120714	GD	On-Demand	Anodyne	DRD3	28	43
COc1cc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)ccc1OCCO	ZINC000875120722	FD	On-Demand	Anodyne	PDE6A	40	31
COc1cc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)ccc1OCCO	ZINC000875120722	FD	On-Demand	Anodyne	MT-ND1	23	40
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000875120751	FD	On-Demand	Anodyne	DRD4	27	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000875120751	FD	On-Demand	Anodyne	SIGMAR1	25	43
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000875120751	FD	On-Demand	Anodyne	SSTR5	73	43
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000875120751	FD	On-Demand	Anodyne	CCR3	19	40
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000875120751	FD	On-Demand	Anodyne	MCHR1	42	40
COCCN(CC1CCN(C)CC1)C(=O)NCCc1c(F)cccc1F	ZINC000875120753	FF	On-Demand	Anodyne	ACKR3	63	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1c(F)cccc1F	ZINC000875120756	EE	On-Demand	Anodyne	SLC6A3	50	38
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000875120773	EB	On-Demand	Anodyne	DRD4	25	42
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000875120773	EB	On-Demand	Anodyne	SIGMAR1	28	44
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000875120773	EB	On-Demand	Anodyne	SSTR5	64	41
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000875120773	EB	On-Demand	Anodyne	CCR3	22	40
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000875120773	EB	On-Demand	Anodyne	SLC6A5	28	41
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000875120773	EB	On-Demand	Anodyne	PDK1	42	43
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000875120773	EB	On-Demand	Anodyne	MCHR1	43	43
O=C(NC1CCN(Cc2ccncc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875120775	EE	On-Demand	Anodyne	DRD4	21	49
O=C(NC1CCN(Cc2ccncc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875120775	EE	On-Demand	Anodyne	SIGMAR1	27	47
O=C(NC1CCN(Cc2ccncc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875120775	EE	On-Demand	Anodyne	SSTR5	46	36
O=C(NC1CCN(Cc2ccncc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875120775	EE	On-Demand	Anodyne	EPHX2	17	47
O=C(NC1CCN(Cc2ccncc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875120775	EE	On-Demand	Anodyne	MCHR1	32	40
O=C(NC1CCN(Cc2ccncc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875120776	EE	On-Demand	Anodyne	DRD4	21	49
O=C(NC1CCN(Cc2ccncc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875120776	EE	On-Demand	Anodyne	SIGMAR1	27	47
O=C(NC1CCN(Cc2ccncc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875120776	EE	On-Demand	Anodyne	SSTR5	46	36
O=C(NC1CCN(Cc2ccncc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875120776	EE	On-Demand	Anodyne	EPHX2	17	47
O=C(NC1CCN(Cc2ccncc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875120776	EE	On-Demand	Anodyne	MCHR1	32	40
O=C(NC1CCN(Cc2ccncc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875120777	EE	On-Demand	Anodyne	DRD4	21	49
O=C(NC1CCN(Cc2ccncc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875120777	EE	On-Demand	Anodyne	SIGMAR1	27	47
O=C(NC1CCN(Cc2ccncc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875120777	EE	On-Demand	Anodyne	SSTR5	46	36
O=C(NC1CCN(Cc2ccncc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875120777	EE	On-Demand	Anodyne	EPHX2	17	47
O=C(NC1CCN(Cc2ccncc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875120777	EE	On-Demand	Anodyne	MCHR1	32	40
O=C(NC1CCN(Cc2ccncc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875120778	EE	On-Demand	Anodyne	DRD4	21	49
O=C(NC1CCN(Cc2ccncc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875120778	EE	On-Demand	Anodyne	SIGMAR1	27	47
O=C(NC1CCN(Cc2ccncc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875120778	EE	On-Demand	Anodyne	SSTR5	46	36
O=C(NC1CCN(Cc2ccncc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875120778	EE	On-Demand	Anodyne	EPHX2	17	47
O=C(NC1CCN(Cc2ccncc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875120778	EE	On-Demand	Anodyne	MCHR1	32	40
CCC1(CC)CCCN1C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875120786	EG	On-Demand	Anodyne	DRD4	30	41
CCC1(CC)CCCN1C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875120786	EG	On-Demand	Anodyne	SIGMAR1	26	45
CCC1(CC)CCCN1C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875120786	EG	On-Demand	Anodyne	SSTR5	60	41
CCC1(CC)CCCN1C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875120786	EG	On-Demand	Anodyne	MCHR1	44	41
CCC1(CC)CCCN1C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875120786	EG	On-Demand	Anodyne	CACNA1G	16	41
COc1ccc(OCCCNC(=O)C(=O)NCc2ncc(Cl)s2)cc1	ZINC000875120804	GE	On-Demand	Anodyne	SCNN1A	30	44
C=CCc1ccc(OC(=O)c2cccnc2SCC(=O)Nc2ccc3c(c2)OCO3)c(OC)c1	ZINC000875120812	JI	On-Demand	Mild	ENPP1	78	41
C=CCc1ccc(OC(=O)c2cc(Cl)nc(Cl)c2)c(OC)c1	ZINC000875120825	EI	On-Demand	Mild	ACR	15	60
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NC2CCN(c3ccccc3)CC2)c1	ZINC000875120834	GF	On-Demand	Anodyne	SSTR5	28	40
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NC2CCN(c3ccccc3)CC2)c1	ZINC000875120835	GF	On-Demand	Anodyne	SSTR5	28	40
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN(c2ccc(F)cc2)C1	ZINC000875120843	GD	On-Demand	Anodyne	CACNA1I	55	39
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN(c2ccc(F)cc2)C1	ZINC000875120844	GD	On-Demand	Anodyne	CACNA1I	55	39
O=C(NCCCCC1CC1)C(=O)NCCN1Cc2ccccc2C1	ZINC000875120855	ED	On-Demand	Anodyne	HTR1A	36	42
O=C(NCCCCC1CC1)C(=O)NCCN1Cc2ccccc2C1	ZINC000875120855	ED	On-Demand	Anodyne	DRD2	44	45
O=C(NCCCCC1CC1)C(=O)NCCN1Cc2ccccc2C1	ZINC000875120855	ED	On-Demand	Anodyne	HTR2A	18	42
O=C(NCCCCC1CC1)C(=O)NCCN1Cc2ccccc2C1	ZINC000875120855	ED	On-Demand	Anodyne	DRD3	74	44
O=C(NCCCCC1CC1)C(=O)NCCN1Cc2ccccc2C1	ZINC000875120855	ED	On-Demand	Anodyne	HTR7	31	40
CN(Cc1cccc(C#N)c1)C(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875120890	GI	On-Demand	Mild	HSD17B2	24	42
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NC2CCN(c3ccccc3)CC2)CC1	ZINC000875120901	GC	On-Demand	Anodyne	EPHX2	22	47
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NC2CCN(c3ccccc3)CC2)CC1	ZINC000875120901	GC	On-Demand	Anodyne	SFRP1	86	38
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NC2CCN(c3ccccc3)CC2)CC1	ZINC000875120901	GC	On-Demand	Anodyne	WNT3	48	32
COC(=O)N(C)NC(=O)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000875120903	GD	On-Demand	Reactive	HTR1A	64	45
COC(=O)N(C)NC(=O)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000875120903	GD	On-Demand	Reactive	DRD2	76	45
COC(=O)N(C)NC(=O)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000875120903	GD	On-Demand	Reactive	DRD4	72	44
COC(=O)N(C)NC(=O)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000875120903	GD	On-Demand	Reactive	ACHE	43	48
COC(=O)N(C)NC(=O)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000875120903	GD	On-Demand	Reactive	HRH2	32	42
COC(=O)N(C)NC(=O)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000875120903	GD	On-Demand	Reactive	ADRA1D	45	43
COC(=O)N(C)NC(=O)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000875120903	GD	On-Demand	Reactive	HTR2A	46	47
COC(=O)N(C)NC(=O)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000875120903	GD	On-Demand	Reactive	HTR2C	32	41
COC(=O)N(C)NC(=O)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000875120903	GD	On-Demand	Reactive	SLC6A4	22	40
COC(=O)N(C)NC(=O)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000875120903	GD	On-Demand	Reactive	ADRA1A	61	43
COC(=O)N(C)NC(=O)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000875120903	GD	On-Demand	Reactive	ADRA1B	37	43
COC(=O)N(C)NC(=O)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000875120903	GD	On-Demand	Reactive	DRD3	103	53
COC(=O)N(C)NC(=O)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000875120903	GD	On-Demand	Reactive	SLC6A3	17	40
COC(=O)N(C)NC(=O)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000875120903	GD	On-Demand	Reactive	HTR7	57	45
COC(=O)N(C)NC(=O)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000875120903	GD	On-Demand	Reactive	TACR2	17	41
COC(=O)N(C)NC(=O)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000875120903	GD	On-Demand	Reactive	SIGMAR1	71	45
COC(=O)N(C)NC(=O)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000875120903	GD	On-Demand	Reactive	BCHE	26	48
COC(=O)N(C)NC(=O)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000875120903	GD	On-Demand	Reactive	CCR3	34	46
COC(=O)N(C)NC(=O)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000875120903	GD	On-Demand	Reactive	SCN2A	19	56
COC(=O)N(C)NC(=O)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000875120903	GD	On-Demand	Reactive	MCHR1	19	45
COC(=O)N(C)NC(=O)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000875120903	GD	On-Demand	Reactive	CACNA1G	45	41
COC(=O)N(C)NC(=O)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000875120903	GD	On-Demand	Reactive	NPFFR1	42	37
CN1CC[C@H]2CN(C(=O)C(=O)NCCN3Cc4ccccc4C3)CC[C@@H]21	ZINC000875120912	FC	On-Demand	Anodyne	PLD1	70	36
CN1CC[C@H]2CN(C(=O)C(=O)NCCN3Cc4ccccc4C3)CC[C@@H]21	ZINC000875120912	FC	On-Demand	Anodyne	PLD2	55	36
CN1CC[C@H]2CN(C(=O)C(=O)NCCN3Cc4ccccc4C3)CC[C@H]21	ZINC000875120913	FC	On-Demand	Anodyne	PLD1	70	36
CN1CC[C@H]2CN(C(=O)C(=O)NCCN3Cc4ccccc4C3)CC[C@H]21	ZINC000875120913	FC	On-Demand	Anodyne	PLD2	55	36
O=C1CCN(C(=O)NC2CCN(Cc3ccncc3)CC2)CCCCCCN1	ZINC000875120933	GE	On-Demand	Anodyne	DRD4	19	40
O=C1CCN(C(=O)NC2CCN(Cc3ccncc3)CC2)CCCCCCN1	ZINC000875120933	GE	On-Demand	Anodyne	SIGMAR1	21	47
O=C1CCN(C(=O)NC2CCN(Cc3ccncc3)CC2)CCCCCCN1	ZINC000875120933	GE	On-Demand	Anodyne	SSTR5	42	35
O=C1CCN(C(=O)NC2CCN(Cc3ccncc3)CC2)CCCCCCN1	ZINC000875120933	GE	On-Demand	Anodyne	CCR3	23	45
O=C1CCN(C(=O)NC2CCN(Cc3ccncc3)CC2)CCCCCCN1	ZINC000875120933	GE	On-Demand	Anodyne	MCHR1	36	43
CN1CCN(C2CCN(C(=O)C(=O)NCCN3Cc4ccccc4C3)CC2)CC1	ZINC000875120948	GC	On-Demand	Anodyne	PLD1	47	35
CN1CCN(C2CCN(C(=O)C(=O)NCCN3Cc4ccccc4C3)CC2)CC1	ZINC000875120948	GC	On-Demand	Anodyne	PLD2	44	35
CN1CCN(C2CCN(C(=O)C(=O)NCCN3Cc4ccccc4C3)CC2)CC1	ZINC000875120948	GC	On-Demand	Anodyne	L3MBTL3	79	43
C[C@@H](NC(=O)N1C[C@@](C)(CO)[C@@](C)(CO)C1)c1ccc(C(C)(C)C)cc1	ZINC000875120951	FG	On-Demand	Anodyne	PTGER4	19	41
C[C@H](NC(=O)N1C[C@@](C)(CO)[C@@](C)(CO)C1)c1ccc(C(C)(C)C)cc1	ZINC000875120952	FG	On-Demand	Anodyne	PTGER4	19	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCCO)c(OC)c1	ZINC000875120953	GD	On-Demand	Anodyne	SLC6A4	21	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCCO)c(OC)c1	ZINC000875120954	GD	On-Demand	Anodyne	SLC6A4	21	41
O=C(NC1CCN(Cc2ccncc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875120955	FE	On-Demand	Clean	DRD4	28	46
O=C(NC1CCN(Cc2ccncc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875120955	FE	On-Demand	Clean	ACHE	19	42
O=C(NC1CCN(Cc2ccncc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875120955	FE	On-Demand	Clean	SIGMAR1	27	47
O=C(NC1CCN(Cc2ccncc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875120955	FE	On-Demand	Clean	SSTR5	53	37
O=C(NC1CCN(Cc2ccncc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875120955	FE	On-Demand	Clean	CCR3	25	43
O=C(NC1CCN(Cc2ccncc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875120955	FE	On-Demand	Clean	MCHR1	36	43
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(C(C)(C)C)cc1	ZINC000875120966	EF	On-Demand	Anodyne	GHRHR	49	34
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(C(C)(C)C)cc1	ZINC000875120966	EF	On-Demand	Anodyne	PTGER4	23	41
CC[C@@H](NC(=O)NC1CCN(Cc2ccncc2)CC1)[C@H](O)c1ccccc1	ZINC000875120982	GF	On-Demand	Anodyne	CHRM2	15	42
CC[C@@H](NC(=O)NC1CCN(Cc2ccncc2)CC1)[C@H](O)c1ccccc1	ZINC000875120982	GF	On-Demand	Anodyne	CHRM1	17	52
CC[C@@H](NC(=O)NC1CCN(Cc2ccncc2)CC1)[C@H](O)c1ccccc1	ZINC000875120982	GF	On-Demand	Anodyne	DRD4	36	48
CC[C@@H](NC(=O)NC1CCN(Cc2ccncc2)CC1)[C@H](O)c1ccccc1	ZINC000875120982	GF	On-Demand	Anodyne	ACHE	29	42
CC[C@@H](NC(=O)NC1CCN(Cc2ccncc2)CC1)[C@H](O)c1ccccc1	ZINC000875120982	GF	On-Demand	Anodyne	CHRM3	21	42
CC[C@@H](NC(=O)NC1CCN(Cc2ccncc2)CC1)[C@H](O)c1ccccc1	ZINC000875120982	GF	On-Demand	Anodyne	SIGMAR1	34	48
CC[C@@H](NC(=O)NC1CCN(Cc2ccncc2)CC1)[C@H](O)c1ccccc1	ZINC000875120982	GF	On-Demand	Anodyne	SSTR5	56	40
CC[C@@H](NC(=O)NC1CCN(Cc2ccncc2)CC1)[C@H](O)c1ccccc1	ZINC000875120982	GF	On-Demand	Anodyne	CCR3	24	43
CC[C@@H](NC(=O)NC1CCN(Cc2ccncc2)CC1)[C@H](O)c1ccccc1	ZINC000875120982	GF	On-Demand	Anodyne	SLC6A5	19	40
CC[C@@H](NC(=O)NC1CCN(Cc2ccncc2)CC1)[C@H](O)c1ccccc1	ZINC000875120982	GF	On-Demand	Anodyne	EPHX2	21	45
CC[C@@H](NC(=O)NC1CCN(Cc2ccncc2)CC1)[C@H](O)c1ccccc1	ZINC000875120982	GF	On-Demand	Anodyne	MCHR1	37	47
CC[C@@H](NC(=O)NC1CCN(Cc2ccncc2)CC1)[C@@H](O)c1ccccc1	ZINC000875120983	GF	On-Demand	Anodyne	CHRM2	15	42
CC[C@@H](NC(=O)NC1CCN(Cc2ccncc2)CC1)[C@@H](O)c1ccccc1	ZINC000875120983	GF	On-Demand	Anodyne	CHRM1	17	52
CC[C@@H](NC(=O)NC1CCN(Cc2ccncc2)CC1)[C@@H](O)c1ccccc1	ZINC000875120983	GF	On-Demand	Anodyne	DRD4	36	48
CC[C@@H](NC(=O)NC1CCN(Cc2ccncc2)CC1)[C@@H](O)c1ccccc1	ZINC000875120983	GF	On-Demand	Anodyne	ACHE	29	42
CC[C@@H](NC(=O)NC1CCN(Cc2ccncc2)CC1)[C@@H](O)c1ccccc1	ZINC000875120983	GF	On-Demand	Anodyne	CHRM3	21	42
CC[C@@H](NC(=O)NC1CCN(Cc2ccncc2)CC1)[C@@H](O)c1ccccc1	ZINC000875120983	GF	On-Demand	Anodyne	SIGMAR1	34	48
CC[C@@H](NC(=O)NC1CCN(Cc2ccncc2)CC1)[C@@H](O)c1ccccc1	ZINC000875120983	GF	On-Demand	Anodyne	SSTR5	56	40
CC[C@@H](NC(=O)NC1CCN(Cc2ccncc2)CC1)[C@@H](O)c1ccccc1	ZINC000875120983	GF	On-Demand	Anodyne	CCR3	24	43
CC[C@@H](NC(=O)NC1CCN(Cc2ccncc2)CC1)[C@@H](O)c1ccccc1	ZINC000875120983	GF	On-Demand	Anodyne	SLC6A5	19	40
CC[C@@H](NC(=O)NC1CCN(Cc2ccncc2)CC1)[C@@H](O)c1ccccc1	ZINC000875120983	GF	On-Demand	Anodyne	EPHX2	21	45
CC[C@@H](NC(=O)NC1CCN(Cc2ccncc2)CC1)[C@@H](O)c1ccccc1	ZINC000875120983	GF	On-Demand	Anodyne	MCHR1	37	47
O=C(NCc1cccc2ncccc12)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875120985	GF	On-Demand	Anodyne	HTR1A	18	45
O=C(NCc1cccc2ncccc12)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875120985	GF	On-Demand	Anodyne	DRD3	16	41
O=C(NCc1cccc2ncccc12)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875120985	GF	On-Demand	Anodyne	METAP1	40	35
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCN1Cc2ccccc2C1	ZINC000875121009	EC	On-Demand	Mild	DRD4	43	36
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCN1Cc2ccccc2C1	ZINC000875121009	EC	On-Demand	Mild	DRD3	42	38
C#CC[C@H](CCOC)NC(=O)C(=O)NCCN1Cc2ccccc2C1	ZINC000875121010	EC	On-Demand	Mild	DRD4	43	36
C#CC[C@H](CCOC)NC(=O)C(=O)NCCN1Cc2ccccc2C1	ZINC000875121010	EC	On-Demand	Mild	DRD3	42	38
O=C(NC1CCN(Cc2ccncc2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875121011	GF	On-Demand	Anodyne	CHRM2	17	47
O=C(NC1CCN(Cc2ccncc2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875121011	GF	On-Demand	Anodyne	CHRM1	16	55
O=C(NC1CCN(Cc2ccncc2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875121011	GF	On-Demand	Anodyne	DRD2	28	65
O=C(NC1CCN(Cc2ccncc2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875121011	GF	On-Demand	Anodyne	DRD4	60	65
O=C(NC1CCN(Cc2ccncc2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875121011	GF	On-Demand	Anodyne	ACHE	48	49
O=C(NC1CCN(Cc2ccncc2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875121011	GF	On-Demand	Anodyne	DRD3	22	65
O=C(NC1CCN(Cc2ccncc2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875121011	GF	On-Demand	Anodyne	KCNH2	16	42
O=C(NC1CCN(Cc2ccncc2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875121011	GF	On-Demand	Anodyne	CHRM3	22	55
O=C(NC1CCN(Cc2ccncc2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875121011	GF	On-Demand	Anodyne	GRIN2B	15	40
O=C(NC1CCN(Cc2ccncc2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875121011	GF	On-Demand	Anodyne	LTA4H	36	49
O=C(NC1CCN(Cc2ccncc2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875121011	GF	On-Demand	Anodyne	SIGMAR1	60	57
O=C(NC1CCN(Cc2ccncc2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875121011	GF	On-Demand	Anodyne	SSTR5	63	40
O=C(NC1CCN(Cc2ccncc2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875121011	GF	On-Demand	Anodyne	CCR3	54	45
O=C(NC1CCN(Cc2ccncc2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875121011	GF	On-Demand	Anodyne	FAAH	24	43
O=C(NC1CCN(Cc2ccncc2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875121011	GF	On-Demand	Anodyne	SLC6A5	25	45
O=C(NC1CCN(Cc2ccncc2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875121011	GF	On-Demand	Anodyne	EPHX2	31	55
O=C(NC1CCN(Cc2ccncc2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875121011	GF	On-Demand	Anodyne	CXCR3	35	43
O=C(NC1CCN(Cc2ccncc2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875121011	GF	On-Demand	Anodyne	MCHR1	60	48
O=C(NC1CCN(Cc2ccncc2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875121011	GF	On-Demand	Anodyne	CACNA1G	17	43
O=C(NC1CCN(Cc2ccncc2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875121011	GF	On-Demand	Anodyne	CCR8	15	40
O=C(NC1CCN(Cc2ccncc2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875121011	GF	On-Demand	Anodyne	NPFFR1	42	37
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875121014	FD	On-Demand	Anodyne	HTR1A	15	40
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875121014	FD	On-Demand	Anodyne	DRD2	21	45
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875121014	FD	On-Demand	Anodyne	DRD3	28	45
C=CC(C)(C)CCCNC(=O)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875121015	FF	On-Demand	Mild	HTR1A	15	45
C=CC(C)(C)CCCNC(=O)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875121015	FF	On-Demand	Mild	DRD2	17	45
C=CC(C)(C)CCCNC(=O)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875121015	FF	On-Demand	Mild	DRD3	30	45
C=CCc1ccc(OC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccccc2)c(OC)c1	ZINC000875121046	HH	On-Demand	Mild	FKBP1A	102	65
C=CCc1ccc(OC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccccc2)c(OC)c1	ZINC000875121046	HH	On-Demand	Mild	MMP13	32	44
C=CCc1ccc(OC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccccc2)c(OC)c1	ZINC000875121046	HH	On-Demand	Mild	ITGA4	30	41
C=CCc1ccc(OC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccccc2)c(OC)c1	ZINC000875121046	HH	On-Demand	Mild	CAPNS1	20	41
C=CCc1ccc(OC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccccc2)c(OC)c1	ZINC000875121046	HH	On-Demand	Mild	MMP2	17	40
C=CCc1ccc(OC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccccc2)c(OC)c1	ZINC000875121046	HH	On-Demand	Mild	MMP3	40	44
C=CCc1ccc(OC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccccc2)c(OC)c1	ZINC000875121046	HH	On-Demand	Mild	MMP8	24	40
C=CCc1ccc(OC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccccc2)c(OC)c1	ZINC000875121046	HH	On-Demand	Mild	MMP9	25	40
C=CCc1ccc(OC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccccc2)c(OC)c1	ZINC000875121046	HH	On-Demand	Mild	MMP7	37	44
C=CCc1ccc(OC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccccc2)c(OC)c1	ZINC000875121046	HH	On-Demand	Mild	MMP1	37	44
C=CCc1ccc(OC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccccc2)c(OC)c1	ZINC000875121046	HH	On-Demand	Mild	FKBP5	23	40
C=CCc1ccc(OC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccccc2)c(OC)c1	ZINC000875121047	HH	On-Demand	Mild	FKBP1A	102	65
C=CCc1ccc(OC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccccc2)c(OC)c1	ZINC000875121047	HH	On-Demand	Mild	MMP13	32	44
C=CCc1ccc(OC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccccc2)c(OC)c1	ZINC000875121047	HH	On-Demand	Mild	ITGA4	30	41
C=CCc1ccc(OC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccccc2)c(OC)c1	ZINC000875121047	HH	On-Demand	Mild	CAPNS1	20	41
C=CCc1ccc(OC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccccc2)c(OC)c1	ZINC000875121047	HH	On-Demand	Mild	MMP2	17	40
C=CCc1ccc(OC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccccc2)c(OC)c1	ZINC000875121047	HH	On-Demand	Mild	MMP3	40	44
C=CCc1ccc(OC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccccc2)c(OC)c1	ZINC000875121047	HH	On-Demand	Mild	MMP8	24	40
C=CCc1ccc(OC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccccc2)c(OC)c1	ZINC000875121047	HH	On-Demand	Mild	MMP9	25	40
C=CCc1ccc(OC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccccc2)c(OC)c1	ZINC000875121047	HH	On-Demand	Mild	MMP7	37	44
C=CCc1ccc(OC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccccc2)c(OC)c1	ZINC000875121047	HH	On-Demand	Mild	MMP1	37	44
C=CCc1ccc(OC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccccc2)c(OC)c1	ZINC000875121047	HH	On-Demand	Mild	FKBP5	23	40
C#CC[C@@H](COC)NC(=O)C(=O)NCCN1Cc2ccccc2C1	ZINC000875121048	EC	On-Demand	Mild	DRD2	16	40
C#CC[C@@H](COC)NC(=O)C(=O)NCCN1Cc2ccccc2C1	ZINC000875121048	EC	On-Demand	Mild	DRD4	41	34
C#CC[C@H](COC)NC(=O)C(=O)NCCN1Cc2ccccc2C1	ZINC000875121049	EC	On-Demand	Mild	DRD2	16	40
C#CC[C@H](COC)NC(=O)C(=O)NCCN1Cc2ccccc2C1	ZINC000875121049	EC	On-Demand	Mild	DRD4	41	34
COc1ccc(OCCCNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875121050	FD	On-Demand	Anodyne	HRH2	34	43
COc1ccc(OCCCNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875121050	FD	On-Demand	Anodyne	HRH3	46	38
COc1ccc(OCCCNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875121050	FD	On-Demand	Anodyne	DPP7	15	40
COc1ccc(OCCCNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875121051	FD	On-Demand	Anodyne	HRH2	34	43
COc1ccc(OCCCNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875121051	FD	On-Demand	Anodyne	HRH3	46	38
COc1ccc(OCCCNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875121051	FD	On-Demand	Anodyne	DPP7	15	40
C[C@H](NC(=O)C(=O)NCCN1Cc2ccccc2C1)c1cc2cnccc2o1	ZINC000875121054	GE	On-Demand	Anodyne	DRD4	40	32
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875121058	GF	On-Demand	Anodyne	CHRM2	18	42
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875121058	GF	On-Demand	Anodyne	DRD4	33	45
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875121058	GF	On-Demand	Anodyne	ACHE	22	42
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875121058	GF	On-Demand	Anodyne	CHRM3	22	52
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875121058	GF	On-Demand	Anodyne	SIGMAR1	39	47
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875121058	GF	On-Demand	Anodyne	SSTR5	42	36
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875121058	GF	On-Demand	Anodyne	CCR3	24	47
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875121058	GF	On-Demand	Anodyne	EPHX2	20	45
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875121058	GF	On-Demand	Anodyne	CXCR3	22	47
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875121058	GF	On-Demand	Anodyne	MCHR1	29	45
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875121059	GF	On-Demand	Anodyne	CHRM2	18	42
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875121059	GF	On-Demand	Anodyne	DRD4	33	45
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875121059	GF	On-Demand	Anodyne	ACHE	22	42
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875121059	GF	On-Demand	Anodyne	CHRM3	22	52
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875121059	GF	On-Demand	Anodyne	SIGMAR1	39	47
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875121059	GF	On-Demand	Anodyne	SSTR5	42	36
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875121059	GF	On-Demand	Anodyne	CCR3	24	47
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875121059	GF	On-Demand	Anodyne	EPHX2	20	45
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875121059	GF	On-Demand	Anodyne	CXCR3	22	47
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875121059	GF	On-Demand	Anodyne	MCHR1	29	45
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875121125	DC	On-Demand	Reactive	DRD4	34	50
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875121125	DC	On-Demand	Reactive	ACHE	25	44
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875121125	DC	On-Demand	Reactive	HTR4	17	42
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875121125	DC	On-Demand	Reactive	LTA4H	22	41
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875121125	DC	On-Demand	Reactive	SIGMAR1	35	48
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875121125	DC	On-Demand	Reactive	SSTR5	72	41
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875121125	DC	On-Demand	Reactive	UTS2R	15	41
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875121125	DC	On-Demand	Reactive	SLC6A5	30	41
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875121125	DC	On-Demand	Reactive	EPHX2	28	45
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875121125	DC	On-Demand	Reactive	PDK1	50	42
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875121125	DC	On-Demand	Reactive	MCHR1	56	47
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875121125	DC	On-Demand	Reactive	CCR8	17	40
O=C(NC1CCN(Cc2ccncc2)CC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875121148	GF	On-Demand	Anodyne	DRD4	36	45
O=C(NC1CCN(Cc2ccncc2)CC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875121148	GF	On-Demand	Anodyne	ACHE	26	42
O=C(NC1CCN(Cc2ccncc2)CC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875121148	GF	On-Demand	Anodyne	CHRM3	16	40
O=C(NC1CCN(Cc2ccncc2)CC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875121148	GF	On-Demand	Anodyne	SIGMAR1	33	48
O=C(NC1CCN(Cc2ccncc2)CC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875121148	GF	On-Demand	Anodyne	SSTR5	48	38
O=C(NC1CCN(Cc2ccncc2)CC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875121148	GF	On-Demand	Anodyne	CCR3	27	40
O=C(NC1CCN(Cc2ccncc2)CC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875121148	GF	On-Demand	Anodyne	SLC6A5	16	40
O=C(NC1CCN(Cc2ccncc2)CC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875121148	GF	On-Demand	Anodyne	MCHR1	32	42
O=C(NCC[C@H](O)C1CCCC1)NC1CCN(Cc2ccncc2)CC1	ZINC000875121156	FE	On-Demand	Anodyne	DRD4	22	46
O=C(NCC[C@H](O)C1CCCC1)NC1CCN(Cc2ccncc2)CC1	ZINC000875121156	FE	On-Demand	Anodyne	HRH2	15	44
O=C(NCC[C@H](O)C1CCCC1)NC1CCN(Cc2ccncc2)CC1	ZINC000875121156	FE	On-Demand	Anodyne	SIGMAR1	24	44
O=C(NCC[C@H](O)C1CCCC1)NC1CCN(Cc2ccncc2)CC1	ZINC000875121156	FE	On-Demand	Anodyne	SSTR5	52	39
O=C(NCC[C@H](O)C1CCCC1)NC1CCN(Cc2ccncc2)CC1	ZINC000875121156	FE	On-Demand	Anodyne	CCR3	21	42
O=C(NCC[C@H](O)C1CCCC1)NC1CCN(Cc2ccncc2)CC1	ZINC000875121156	FE	On-Demand	Anodyne	EPHX2	22	41
O=C(NCC[C@H](O)C1CCCC1)NC1CCN(Cc2ccncc2)CC1	ZINC000875121156	FE	On-Demand	Anodyne	MCHR1	39	44
O=C(NCC[C@@H](O)C1CCCC1)NC1CCN(Cc2ccncc2)CC1	ZINC000875121157	FE	On-Demand	Anodyne	DRD4	22	46
O=C(NCC[C@@H](O)C1CCCC1)NC1CCN(Cc2ccncc2)CC1	ZINC000875121157	FE	On-Demand	Anodyne	HRH2	15	44
O=C(NCC[C@@H](O)C1CCCC1)NC1CCN(Cc2ccncc2)CC1	ZINC000875121157	FE	On-Demand	Anodyne	SIGMAR1	24	44
O=C(NCC[C@@H](O)C1CCCC1)NC1CCN(Cc2ccncc2)CC1	ZINC000875121157	FE	On-Demand	Anodyne	SSTR5	52	39
O=C(NCC[C@@H](O)C1CCCC1)NC1CCN(Cc2ccncc2)CC1	ZINC000875121157	FE	On-Demand	Anodyne	CCR3	21	42
O=C(NCC[C@@H](O)C1CCCC1)NC1CCN(Cc2ccncc2)CC1	ZINC000875121157	FE	On-Demand	Anodyne	EPHX2	22	41
O=C(NCC[C@@H](O)C1CCCC1)NC1CCN(Cc2ccncc2)CC1	ZINC000875121157	FE	On-Demand	Anodyne	MCHR1	39	44
C[C@@H](NC(=O)NCCN1CC[C@H](O)C1)c1ccc(C(C)(C)C)cc1	ZINC000875121162	EE	On-Demand	Anodyne	CACNA1H	22	41
C[C@@H](NC(=O)NCCN1CC[C@@H](O)C1)c1ccc(C(C)(C)C)cc1	ZINC000875121163	EE	On-Demand	Anodyne	CACNA1H	22	41
C[C@H](NC(=O)NCCN1CC[C@@H](O)C1)c1ccc(C(C)(C)C)cc1	ZINC000875121164	EE	On-Demand	Anodyne	CACNA1H	22	41
C[C@H](NC(=O)NCCN1CC[C@H](O)C1)c1ccc(C(C)(C)C)cc1	ZINC000875121165	EE	On-Demand	Anodyne	CACNA1H	22	41
O=C(NCc1ncc(Cl)s1)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875121166	GE	On-Demand	Anodyne	DRD3	15	40
C=CC(C)(C)CCCNC(=O)C(=O)NCCN1Cc2ccccc2C1	ZINC000875121169	EE	On-Demand	Mild	DRD3	40	43
COc1cc(CNC(=O)N2CCC[C@@H](C(C)=O)C2)ccc1OCCO	ZINC000875121173	FD	On-Demand	Anodyne	FKBP1A	30	40
C[C@H](NC(=O)C(=O)NC[C@@H]1CCN(c2ccc(F)cc2)C1)c1ccnn1C	ZINC000875121180	FD	On-Demand	Anodyne	CCR3	54	34
C[C@H](NC(=O)C(=O)NC[C@H]1CCN(c2ccc(F)cc2)C1)c1ccnn1C	ZINC000875121182	FD	On-Demand	Anodyne	CCR3	54	34
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(Cc4ccncc4)CC3)C[C@@H]1C2	ZINC000875121193	FD	On-Demand	Anodyne	DRD4	29	45
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(Cc4ccncc4)CC3)C[C@@H]1C2	ZINC000875121193	FD	On-Demand	Anodyne	ACHE	15	41
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(Cc4ccncc4)CC3)C[C@@H]1C2	ZINC000875121193	FD	On-Demand	Anodyne	SIGMAR1	32	45
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(Cc4ccncc4)CC3)C[C@@H]1C2	ZINC000875121193	FD	On-Demand	Anodyne	SSTR5	57	38
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(Cc4ccncc4)CC3)C[C@@H]1C2	ZINC000875121193	FD	On-Demand	Anodyne	SLC6A5	29	41
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(Cc4ccncc4)CC3)C[C@@H]1C2	ZINC000875121193	FD	On-Demand	Anodyne	EPHX2	28	49
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(Cc4ccncc4)CC3)C[C@@H]1C2	ZINC000875121193	FD	On-Demand	Anodyne	PDK1	34	40
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(Cc4ccncc4)CC3)C[C@@H]1C2	ZINC000875121193	FD	On-Demand	Anodyne	CXCR3	25	42
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(Cc4ccncc4)CC3)C[C@@H]1C2	ZINC000875121193	FD	On-Demand	Anodyne	MCHR1	36	44
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875121225	FD	On-Demand	Anodyne	HTR1A	42	49
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875121225	FD	On-Demand	Anodyne	DRD2	62	41
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875121225	FD	On-Demand	Anodyne	DRD4	64	41
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875121225	FD	On-Demand	Anodyne	ACHE	48	48
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875121225	FD	On-Demand	Anodyne	HRH2	28	42
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875121225	FD	On-Demand	Anodyne	HTR2A	39	48
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875121225	FD	On-Demand	Anodyne	DRD3	83	43
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875121225	FD	On-Demand	Anodyne	HTR4	31	40
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875121225	FD	On-Demand	Anodyne	HTR7	21	46
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875121225	FD	On-Demand	Anodyne	SIGMAR1	72	49
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875121225	FD	On-Demand	Anodyne	BCHE	20	45
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875121225	FD	On-Demand	Anodyne	CCR3	48	49
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875121225	FD	On-Demand	Anodyne	NPFFR1	41	38
COc1ccc(OCCCNC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875121243	FD	On-Demand	Anodyne	CHRM2	40	38
COc1ccc(OCCCNC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875121243	FD	On-Demand	Anodyne	HRH2	32	41
COc1ccc(OCCCNC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875121243	FD	On-Demand	Anodyne	SCNN1A	24	40
COc1ccc(OCCCNC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875121243	FD	On-Demand	Anodyne	MTNR1A	49	38
COc1ccc(OCCCNC(=O)C(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875121243	FD	On-Demand	Anodyne	MTNR1B	45	38
C=CCc1ccc(OC(=O)CCCOc2ccccc2)c(OC)c1	ZINC000875121257	EI	On-Demand	Mild	PPARG	22	49
C=CCc1ccc(OC(=O)CCCOc2ccccc2)c(OC)c1	ZINC000875121257	EI	On-Demand	Mild	LTA4H	19	43
C=CCc1ccc(OC(=O)CCCOc2ccccc2)c(OC)c1	ZINC000875121257	EI	On-Demand	Mild	AKR1C3	21	41
CCCCCCCNC(=O)C(=O)NCCN1Cc2ccccc2C1	ZINC000875121269	EE	On-Demand	Mild	HTR1A	48	47
CCCCCCCNC(=O)C(=O)NCCN1Cc2ccccc2C1	ZINC000875121269	EE	On-Demand	Mild	DRD2	51	42
CCCCCCCNC(=O)C(=O)NCCN1Cc2ccccc2C1	ZINC000875121269	EE	On-Demand	Mild	DRD4	42	34
CCCCCCCNC(=O)C(=O)NCCN1Cc2ccccc2C1	ZINC000875121269	EE	On-Demand	Mild	DRD3	81	45
CCCCCCCNC(=O)C(=O)NCCN1Cc2ccccc2C1	ZINC000875121269	EE	On-Demand	Mild	HTR4	16	41
CCCCCCCNC(=O)C(=O)NCCN1Cc2ccccc2C1	ZINC000875121269	EE	On-Demand	Mild	HTR7	39	41
CCCCCCCNC(=O)C(=O)NCCN1Cc2ccccc2C1	ZINC000875121269	EE	On-Demand	Mild	CFTR	49	34
CCCCCCCNC(=O)C(=O)NCCN1Cc2ccccc2C1	ZINC000875121269	EE	On-Demand	Mild	TPP2	21	40
CCCCCCCNC(=O)C(=O)NCCN1Cc2ccccc2C1	ZINC000875121269	EE	On-Demand	Mild	ASAH1	105	43
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(c3ccccc3)CC2)CC1	ZINC000875121276	FD	On-Demand	Anodyne	EPHX2	31	47
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(c3ccccc3)CC2)CC1	ZINC000875121276	FD	On-Demand	Anodyne	SFRP1	49	36
CC[C@@H]1COCCN1CCNC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875121287	GD	On-Demand	Anodyne	DRD4	15	41
CC[C@@H]1COCCN1CCNC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875121287	GD	On-Demand	Anodyne	SSTR5	59	41
CC[C@@H]1COCCN1CCNC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875121287	GD	On-Demand	Anodyne	MCHR1	30	43
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875121294	GG	On-Demand	Anodyne	DRD4	21	42
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875121294	GG	On-Demand	Anodyne	SIGMAR1	22	44
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875121294	GG	On-Demand	Anodyne	SSTR5	58	40
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875121294	GG	On-Demand	Anodyne	CCR3	23	46
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875121294	GG	On-Demand	Anodyne	EPHX2	28	42
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875121294	GG	On-Demand	Anodyne	MCHR1	38	42
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875121295	GG	On-Demand	Anodyne	DRD4	21	42
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875121295	GG	On-Demand	Anodyne	SIGMAR1	22	44
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875121295	GG	On-Demand	Anodyne	SSTR5	58	40
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875121295	GG	On-Demand	Anodyne	CCR3	23	46
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875121295	GG	On-Demand	Anodyne	EPHX2	28	42
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875121295	GG	On-Demand	Anodyne	MCHR1	38	42
CN1CCN(C(=O)NC2CCN(Cc3ccncc3)CC2)CCC1(C)C	ZINC000875121296	FE	On-Demand	Anodyne	DRD4	23	41
CN1CCN(C(=O)NC2CCN(Cc3ccncc3)CC2)CCC1(C)C	ZINC000875121296	FE	On-Demand	Anodyne	SIGMAR1	22	43
CN1CCN(C(=O)NC2CCN(Cc3ccncc3)CC2)CCC1(C)C	ZINC000875121296	FE	On-Demand	Anodyne	SSTR5	55	37
CN1CCN(C(=O)NC2CCN(Cc3ccncc3)CC2)CCC1(C)C	ZINC000875121296	FE	On-Demand	Anodyne	CCR3	16	46
CN1CCN(C(=O)NC2CCN(Cc3ccncc3)CC2)CCC1(C)C	ZINC000875121296	FE	On-Demand	Anodyne	MCHR1	38	42
O=C(NC1CCN(Cc2ccncc2)CC1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875121300	FF	On-Demand	Anodyne	DRD4	17	43
O=C(NC1CCN(Cc2ccncc2)CC1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875121300	FF	On-Demand	Anodyne	SIGMAR1	19	40
O=C(NC1CCN(Cc2ccncc2)CC1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875121300	FF	On-Demand	Anodyne	SSTR5	49	37
O=C(NC1CCN(Cc2ccncc2)CC1)NC1([C@H]2CCCCO2)CCC1	ZINC000875121301	FF	On-Demand	Anodyne	DRD4	17	43
O=C(NC1CCN(Cc2ccncc2)CC1)NC1([C@H]2CCCCO2)CCC1	ZINC000875121301	FF	On-Demand	Anodyne	SIGMAR1	19	40
O=C(NC1CCN(Cc2ccncc2)CC1)NC1([C@H]2CCCCO2)CCC1	ZINC000875121301	FF	On-Demand	Anodyne	SSTR5	49	37
O=C(NCCO)C1CCN(C(=O)NCCc2c(F)cccc2F)CC1	ZINC000875121346	FD	On-Demand	Anodyne	EPHX2	16	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(c3ccccc3)CC2)C1	ZINC000875121349	FD	On-Demand	Anodyne	SLC6A1	55	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(c3ccccc3)CC2)C1	ZINC000875121349	FD	On-Demand	Anodyne	EPHX2	16	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(c3ccccc3)CC2)C1	ZINC000875121350	FD	On-Demand	Anodyne	SLC6A1	55	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(c3ccccc3)CC2)C1	ZINC000875121350	FD	On-Demand	Anodyne	EPHX2	16	44
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875121363	GF	On-Demand	Anodyne	DRD4	30	45
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875121363	GF	On-Demand	Anodyne	ACHE	26	42
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875121363	GF	On-Demand	Anodyne	SIGMAR1	32	48
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875121363	GF	On-Demand	Anodyne	SSTR5	46	37
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875121363	GF	On-Demand	Anodyne	CCR3	25	43
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875121363	GF	On-Demand	Anodyne	SLC6A5	16	40
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875121363	GF	On-Demand	Anodyne	MCHR1	33	43
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875121364	GF	On-Demand	Anodyne	DRD4	30	45
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875121364	GF	On-Demand	Anodyne	ACHE	26	42
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875121364	GF	On-Demand	Anodyne	SIGMAR1	32	48
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875121364	GF	On-Demand	Anodyne	SSTR5	46	37
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875121364	GF	On-Demand	Anodyne	CCR3	25	43
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875121364	GF	On-Demand	Anodyne	SLC6A5	16	40
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875121364	GF	On-Demand	Anodyne	MCHR1	33	43
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875121365	GF	On-Demand	Anodyne	DRD4	30	45
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875121365	GF	On-Demand	Anodyne	ACHE	26	42
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875121365	GF	On-Demand	Anodyne	SIGMAR1	32	48
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875121365	GF	On-Demand	Anodyne	SSTR5	46	37
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875121365	GF	On-Demand	Anodyne	CCR3	25	43
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875121365	GF	On-Demand	Anodyne	SLC6A5	16	40
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875121365	GF	On-Demand	Anodyne	MCHR1	33	43
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875121366	GF	On-Demand	Anodyne	DRD4	30	45
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875121366	GF	On-Demand	Anodyne	ACHE	26	42
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875121366	GF	On-Demand	Anodyne	SIGMAR1	32	48
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875121366	GF	On-Demand	Anodyne	SSTR5	46	37
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875121366	GF	On-Demand	Anodyne	CCR3	25	43
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875121366	GF	On-Demand	Anodyne	SLC6A5	16	40
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875121366	GF	On-Demand	Anodyne	MCHR1	33	43
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875121371	ED	On-Demand	Anodyne	DRD4	16	43
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875121371	ED	On-Demand	Anodyne	SIGMAR1	24	45
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875121371	ED	On-Demand	Anodyne	SSTR5	58	39
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875121371	ED	On-Demand	Anodyne	EPHX2	22	41
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000875121371	ED	On-Demand	Anodyne	MCHR1	37	44
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(OCCO)c(OC)c2)C1	ZINC000875121377	GD	On-Demand	Anodyne	PDE6A	40	33
O=C(NC1CCN(Cc2ccncc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875121393	FE	On-Demand	Anodyne	DRD4	22	41
O=C(NC1CCN(Cc2ccncc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875121393	FE	On-Demand	Anodyne	ACHE	19	43
O=C(NC1CCN(Cc2ccncc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875121393	FE	On-Demand	Anodyne	LTA4H	17	43
O=C(NC1CCN(Cc2ccncc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875121393	FE	On-Demand	Anodyne	SIGMAR1	24	44
O=C(NC1CCN(Cc2ccncc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875121393	FE	On-Demand	Anodyne	SSTR5	45	36
COc1ccc(OCCCNC(=O)C(=O)N[C@H](C)c2ccnn2C)cc1	ZINC000875121394	FD	On-Demand	Anodyne	SCNN1A	31	42
COc1ccc(OCCCNC(=O)C(=O)N[C@@H](C)c2ccnn2C)cc1	ZINC000875121395	FD	On-Demand	Anodyne	SCNN1A	31	42
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875121399	GE	On-Demand	Anodyne	DRD4	22	43
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875121399	GE	On-Demand	Anodyne	SIGMAR1	20	44
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875121399	GE	On-Demand	Anodyne	SSTR5	50	38
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875121399	GE	On-Demand	Anodyne	CCR3	18	42
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875121399	GE	On-Demand	Anodyne	SLC6A5	29	41
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875121399	GE	On-Demand	Anodyne	MCHR1	46	46
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875121400	GE	On-Demand	Anodyne	DRD4	22	43
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875121400	GE	On-Demand	Anodyne	SIGMAR1	20	44
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875121400	GE	On-Demand	Anodyne	SSTR5	50	38
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875121400	GE	On-Demand	Anodyne	CCR3	18	42
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875121400	GE	On-Demand	Anodyne	SLC6A5	29	41
O=C(NC1CCN(Cc2ccncc2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875121400	GE	On-Demand	Anodyne	MCHR1	46	46
O=C(NC1CCN(c2ccccc2)CC1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875121404	GC	On-Demand	Anodyne	SIGMAR1	15	41
O=C(NC1CCN(c2ccccc2)CC1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875121404	GC	On-Demand	Anodyne	EPHX2	19	47
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccncc2)CC1	ZINC000875121406	DD	On-Demand	Anodyne	DRD4	22	49
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccncc2)CC1	ZINC000875121406	DD	On-Demand	Anodyne	ACHE	20	45
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccncc2)CC1	ZINC000875121406	DD	On-Demand	Anodyne	SIGMAR1	28	46
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccncc2)CC1	ZINC000875121406	DD	On-Demand	Anodyne	SSTR5	51	37
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccncc2)CC1	ZINC000875121406	DD	On-Demand	Anodyne	EPHX2	24	46
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccncc2)CC1	ZINC000875121406	DD	On-Demand	Anodyne	MCHR1	41	46
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)NC1CCN(Cc2ccncc2)CC1	ZINC000875121420	GE	On-Demand	Anodyne	SIGMAR1	18	46
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)NC1CCN(Cc2ccncc2)CC1	ZINC000875121420	GE	On-Demand	Anodyne	SSTR5	44	36
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)NC1CCN(Cc2ccncc2)CC1	ZINC000875121420	GE	On-Demand	Anodyne	SLC6A5	30	43
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)NC1CCN(Cc2ccncc2)CC1	ZINC000875121420	GE	On-Demand	Anodyne	MCHR1	36	45
O=C(NC[C@H]1CC(C(F)(F)F)=NO1)NC1CCN(Cc2ccncc2)CC1	ZINC000875121421	GE	On-Demand	Anodyne	SIGMAR1	18	46
O=C(NC[C@H]1CC(C(F)(F)F)=NO1)NC1CCN(Cc2ccncc2)CC1	ZINC000875121421	GE	On-Demand	Anodyne	SSTR5	44	36
O=C(NC[C@H]1CC(C(F)(F)F)=NO1)NC1CCN(Cc2ccncc2)CC1	ZINC000875121421	GE	On-Demand	Anodyne	SLC6A5	30	43
O=C(NC[C@H]1CC(C(F)(F)F)=NO1)NC1CCN(Cc2ccncc2)CC1	ZINC000875121421	GE	On-Demand	Anodyne	MCHR1	36	45
COCC(C)(C)CCNC(=O)C(=O)NCCN1Cc2ccccc2C1	ZINC000875121426	ED	On-Demand	Anodyne	HTR1A	21	41
COCC(C)(C)CCNC(=O)C(=O)NCCN1Cc2ccccc2C1	ZINC000875121426	ED	On-Demand	Anodyne	DRD2	22	44
COCC(C)(C)CCNC(=O)C(=O)NCCN1Cc2ccccc2C1	ZINC000875121426	ED	On-Demand	Anodyne	DRD4	46	38
COCC(C)(C)CCNC(=O)C(=O)NCCN1Cc2ccccc2C1	ZINC000875121426	ED	On-Demand	Anodyne	DRD3	40	43
O=C(NC1CCN(c2ccccc2)CC1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875121432	FD	On-Demand	Anodyne	EPHX2	16	44
O=C(NC1CCN(c2ccccc2)CC1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875121433	FD	On-Demand	Anodyne	EPHX2	16	44
O=C(NC1CCN(c2ccccc2)CC1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875121434	FD	On-Demand	Anodyne	EPHX2	16	44
O=C(NC1CCN(c2ccccc2)CC1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875121435	FD	On-Demand	Anodyne	EPHX2	16	44
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000875121466	EC	On-Demand	Anodyne	HTR1A	16	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000875121466	EC	On-Demand	Anodyne	SLC6A1	109	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000875121467	EC	On-Demand	Anodyne	HTR1A	16	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000875121467	EC	On-Demand	Anodyne	SLC6A1	109	35
O=C(NNc1cccc(F)c1Cl)NC1CCN(Cc2ccncc2)CC1	ZINC000875121468	GG	On-Demand	Reactive	DRD4	26	45
O=C(NNc1cccc(F)c1Cl)NC1CCN(Cc2ccncc2)CC1	ZINC000875121468	GG	On-Demand	Reactive	SIGMAR1	28	51
O=C(NNc1cccc(F)c1Cl)NC1CCN(Cc2ccncc2)CC1	ZINC000875121468	GG	On-Demand	Reactive	SSTR5	47	38
O=C(NNc1cccc(F)c1Cl)NC1CCN(Cc2ccncc2)CC1	ZINC000875121468	GG	On-Demand	Reactive	CCR3	38	40
O=C(NNc1cccc(F)c1Cl)NC1CCN(Cc2ccncc2)CC1	ZINC000875121468	GG	On-Demand	Reactive	SLC6A5	25	41
O=C(NNc1cccc(F)c1Cl)NC1CCN(Cc2ccncc2)CC1	ZINC000875121468	GG	On-Demand	Reactive	EPHX2	17	42
O=C(NNc1cccc(F)c1Cl)NC1CCN(Cc2ccncc2)CC1	ZINC000875121468	GG	On-Demand	Reactive	MCHR1	50	42
O=C(NC1CCN(Cc2ccncc2)CC1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875121504	GD	On-Demand	Anodyne	DRD4	21	41
O=C(NC1CCN(Cc2ccncc2)CC1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875121504	GD	On-Demand	Anodyne	ACHE	18	43
O=C(NC1CCN(Cc2ccncc2)CC1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875121504	GD	On-Demand	Anodyne	SIGMAR1	22	44
O=C(NC1CCN(Cc2ccncc2)CC1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875121504	GD	On-Demand	Anodyne	SSTR5	43	35
O=C(NC1CCN(Cc2ccncc2)CC1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875121504	GD	On-Demand	Anodyne	CCR3	26	40
O=C(NC1CCN(Cc2ccncc2)CC1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875121504	GD	On-Demand	Anodyne	PDK1	33	40
O=C(NC1CCN(Cc2ccncc2)CC1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875121504	GD	On-Demand	Anodyne	MCHR1	41	47
O=C(NC1CCN(Cc2ccncc2)CC1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875121504	GD	On-Demand	Anodyne	CACNA1I	47	39
O=C(NC1CCN(Cc2ccncc2)CC1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875121513	GG	On-Demand	Anodyne	DRD4	23	47
O=C(NC1CCN(Cc2ccncc2)CC1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875121513	GG	On-Demand	Anodyne	ACHE	20	43
O=C(NC1CCN(Cc2ccncc2)CC1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875121513	GG	On-Demand	Anodyne	SIGMAR1	27	49
O=C(NC1CCN(Cc2ccncc2)CC1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875121513	GG	On-Demand	Anodyne	SSTR5	49	38
O=C(NC1CCN(Cc2ccncc2)CC1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875121513	GG	On-Demand	Anodyne	SLC6A5	31	44
O=C(NC1CCN(Cc2ccncc2)CC1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875121513	GG	On-Demand	Anodyne	EPHX2	27	44
O=C(NC1CCN(Cc2ccncc2)CC1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875121513	GG	On-Demand	Anodyne	MCHR1	38	42
O=C(NC1CCN(Cc2ccncc2)CC1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875121513	GG	On-Demand	Anodyne	CACNA1G	17	40
COc1ccc(OCCCNC(=O)C(=O)N[C@H]2CC23CCC3)cc1	ZINC000875121522	ED	On-Demand	Anodyne	IKBKE	43	35
COc1ccc(OCCCNC(=O)C(=O)N[C@@H]2CC23CCC3)cc1	ZINC000875121523	ED	On-Demand	Anodyne	IKBKE	43	35
O=CN1CCCN(C(=O)NC2CCN(Cc3ccncc3)CC2)CC1	ZINC000875121530	EC	On-Demand	Anodyne	DRD4	25	45
O=CN1CCCN(C(=O)NC2CCN(Cc3ccncc3)CC2)CC1	ZINC000875121530	EC	On-Demand	Anodyne	SIGMAR1	28	47
O=CN1CCCN(C(=O)NC2CCN(Cc3ccncc3)CC2)CC1	ZINC000875121530	EC	On-Demand	Anodyne	SSTR5	53	36
O=CN1CCCN(C(=O)NC2CCN(Cc3ccncc3)CC2)CC1	ZINC000875121530	EC	On-Demand	Anodyne	CCR3	28	54
O=CN1CCCN(C(=O)NC2CCN(Cc3ccncc3)CC2)CC1	ZINC000875121530	EC	On-Demand	Anodyne	PDK1	26	40
O=CN1CCCN(C(=O)NC2CCN(Cc3ccncc3)CC2)CC1	ZINC000875121530	EC	On-Demand	Anodyne	MCHR1	37	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCc2ccccn2)cc1	ZINC000875121547	GF	On-Demand	Anodyne	SLC6A3	40	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCc2ccccn2)cc1	ZINC000875121548	GF	On-Demand	Anodyne	SLC6A3	40	39
CNC(=O)CCNC(=O)N[C@H](c1nc2ccccc2[nH]1)C1CCCCC1	ZINC000875121581	FF	On-Demand	Anodyne	MMP7	15	41
CNC(=O)CCNC(=O)N[C@@H](c1nc2ccccc2[nH]1)C1CCCCC1	ZINC000875121582	FF	On-Demand	Anodyne	MMP7	15	41
O=C(NCCCCC1CC1)C(=O)NCc1ccc(-n2ccnc2)c(F)c1	ZINC000875121607	FE	On-Demand	Anodyne	NOS2	94	34
Cc1ccc([C@H](C)NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875121620	DE	On-Demand	Anodyne	BIRC2	40	42
Cc1ccc([C@@H](C)NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875121621	DE	On-Demand	Anodyne	BIRC2	40	42
Cc1ccc([C@H](C)NC(=O)NNc2cccc(C)n2)cc1	ZINC000875121627	CG	On-Demand	Reactive	GRM5	16	43
Cc1ccc([C@H](C)NC(=O)NNc2cccc(C)n2)cc1	ZINC000875121627	CG	On-Demand	Reactive	SORT1	15	40
COCC(C)(C)CCNC(=O)C(=O)NCc1ccc(-n2ccnc2)c(F)c1	ZINC000875121655	GD	On-Demand	Anodyne	NOS2	79	34
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OCc2ccccn2)cc1	ZINC000875121665	FG	On-Demand	Anodyne	ANPEP	15	40
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OCc2ccccn2)cc1	ZINC000875121665	FG	On-Demand	Anodyne	LPAR1	24	44
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OCc2ccccn2)cc1	ZINC000875121665	FG	On-Demand	Anodyne	CAPN2	22	40
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OCc2ccccn2)cc1	ZINC000875121665	FG	On-Demand	Anodyne	LPAR3	30	44
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OCc2ccccn2)cc1	ZINC000875121665	FG	On-Demand	Anodyne	PDS	51	39
CNC(=O)CCNC(=O)NCc1cccc(OC(C)(C)C)c1	ZINC000875121670	DD	On-Demand	Anodyne	HRH2	22	40
CNC(=O)CCNC(=O)NCc1cccc(OC(C)(C)C)c1	ZINC000875121670	DD	On-Demand	Anodyne	ROCK2	21	40
CNC(=O)CCNC(=O)NCc1cccc(OC(C)(C)C)c1	ZINC000875121670	DD	On-Demand	Anodyne	PDS	50	32
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(-n3ccnc3)c(F)c2)C1	ZINC000875121698	FD	On-Demand	Anodyne	NOS2	101	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(-n3ccnc3)c(F)c2)C1	ZINC000875121699	FD	On-Demand	Anodyne	NOS2	101	37
O=CN1CCCN(C(=O)NCc2ccc(OCc3ccccn3)cc2)CC1	ZINC000875121711	FE	On-Demand	Anodyne	DPP7	18	40
CNC(=O)CCNC(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875121715	DD	On-Demand	Anodyne	TBXAS1	20	40
CNC(=O)CCNC(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875121715	DD	On-Demand	Anodyne	C3AR1	41	41
CNC(=O)CCNC(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875121716	DD	On-Demand	Anodyne	TBXAS1	20	40
CNC(=O)CCNC(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875121716	DD	On-Demand	Anodyne	C3AR1	41	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(OC)c1OC	ZINC000875121729	ED	On-Demand	Anodyne	SLC6A3	47	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(OC)c1OC	ZINC000875121730	ED	On-Demand	Anodyne	SLC6A3	47	39
O=C(NCCC[C@H]1C=CCC1)C(=O)NCc1ccc(-n2ccnc2)c(F)c1	ZINC000875121735	FE	On-Demand	Anodyne	NOS2	87	32
O=C(NCCC[C@@H]1C=CCC1)C(=O)NCc1ccc(-n2ccnc2)c(F)c1	ZINC000875121736	FE	On-Demand	Anodyne	NOS2	87	32
Cc1cccc(CNC(=O)N2CCC[C@@H](C(=O)N[C@@H]3CCC[C@@H](O)C3)C2)n1	ZINC000875121745	FD	On-Demand	Anodyne	PDE8B	46	37
Cc1cccc(CNC(=O)N2CCC[C@@H](C(=O)N[C@@H]3CCC[C@H](O)C3)C2)n1	ZINC000875121746	FD	On-Demand	Anodyne	PDE8B	46	37
Cc1cccc(CNC(=O)N2CCC[C@@H](C(=O)N[C@H]3CCC[C@H](O)C3)C2)n1	ZINC000875121747	FD	On-Demand	Anodyne	PDE8B	46	37
Cc1cccc(CNC(=O)N2CCC[C@@H](C(=O)N[C@H]3CCC[C@@H](O)C3)C2)n1	ZINC000875121748	FD	On-Demand	Anodyne	PDE8B	46	37
CCC(CC)C(=O)N1CCC(NC(=O)NN(C)C(=O)OC)CC1	ZINC000875121749	ED	On-Demand	Reactive	EPHX2	27	48
Cc1cccc(CNC(=O)N[C@H](C)C2CN(C(=O)OC(C)(C)C)C2)n1	ZINC000875121752	EE	On-Demand	Anodyne	PDE8B	45	36
Cc1cccc(CNC(=O)N[C@@H](C)C2CN(C(=O)OC(C)(C)C)C2)n1	ZINC000875121753	EE	On-Demand	Anodyne	PDE8B	45	36
CCC(CC)C(=O)N1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@@]3(C(=O)OC)C2)CC1	ZINC000875121757	GE	On-Demand	Anodyne	EPHX2	30	47
O=C(NC1CCOCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875121762	DD	On-Demand	Anodyne	DRD4	27	45
O=C(NC1CCOCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875121762	DD	On-Demand	Anodyne	ACHE	19	41
O=C(NC1CCOCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875121762	DD	On-Demand	Anodyne	SIGMAR1	43	48
O=C(NC1CCOCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875121762	DD	On-Demand	Anodyne	CCR3	19	45
O=C(NC1CCOCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875121762	DD	On-Demand	Anodyne	MCHR1	15	42
COc1ccccc1[C@H]1CCCN(C(=O)NCc2nc(C3CC3)no2)CC1	ZINC000875121763	FG	On-Demand	Anodyne	SMO	33	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2nc(C3CC3)no2)CC1	ZINC000875121764	FG	On-Demand	Anodyne	SMO	33	40
Cc1cccc(CNC(=O)NC(C)(C)[C@@H]2CCCCO2)n1	ZINC000875121769	CF	On-Demand	Anodyne	PDE8B	41	36
Cc1cccc(CNC(=O)NC(C)(C)[C@H]2CCCCO2)n1	ZINC000875121770	CF	On-Demand	Anodyne	PDE8B	41	36
Cc1cccc(CNC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)n1	ZINC000875121774	DE	On-Demand	Anodyne	PDE8B	50	40
CCC(CC)C(=O)N1CCC(NC(=O)N2CCC[C@H](OC3CCC3)CC2)CC1	ZINC000875121775	GH	On-Demand	Anodyne	EPHX2	19	44
CCC(CC)C(=O)N1CCC(NC(=O)N2CCC[C@@H](OC3CCC3)CC2)CC1	ZINC000875121776	GH	On-Demand	Anodyne	EPHX2	19	44
CCC(CC)C(=O)N1CCC(NC(=O)N2CCCN(C=O)CC2)CC1	ZINC000875121777	FD	On-Demand	Anodyne	EPHX2	17	44
CCC(CC)C(=O)N1CCC(NC(=O)NC[C@@H]2CCO[C@@H]2C(=O)OC)CC1	ZINC000875121785	GD	On-Demand	Anodyne	EPHX2	18	44
Cc1cccc(CNC(=O)N2CCC3(CCN(C)CC3)CC2)n1	ZINC000875121788	DE	On-Demand	Anodyne	PDE8B	44	36
Cc1cccc(CNC(=O)N2CCCN(C=O)CC2)n1	ZINC000875121794	CC	On-Demand	Anodyne	PDE8B	45	36
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCOCC1	ZINC000875121795	DD	On-Demand	Anodyne	EPHX2	15	47
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCOCC1	ZINC000875121796	DD	On-Demand	Anodyne	EPHX2	15	47
CCC1(CC)CCCN1C(=O)NCc1cccc(C)n1	ZINC000875121804	CG	On-Demand	Anodyne	PDE8B	43	35
CCC(CC)C(=O)N1CCC(NC(=O)N2CCCC2(CC)CC)CC1	ZINC000875121805	FH	On-Demand	Anodyne	EPHX2	17	45
Cc1cccc(CNC(=O)N2C[C@@H]3C[C@H]2CN3c2ccccc2)n1	ZINC000875121811	DF	On-Demand	Anodyne	PDE8B	52	42
C=CCc1ccc(OC(=O)Cc2cccc(OC)c2)c(OC)c1	ZINC000875121826	DH	On-Demand	Mild	MTNR1B	38	44
Cc1cccc(CNC(=O)N2CCC(CO)(CO)CC2)n1	ZINC000875121832	CC	On-Demand	Anodyne	PDE8B	46	37
CCC(CC)C(=O)N1CCC(NC(=O)N[C@H](CC)C[C@H](C)O)CC1	ZINC000875121844	EE	On-Demand	Anodyne	EPHX2	24	51
CCCCCCCNC(=O)C(=O)NCc1ccoc1C	ZINC000875121856	CE	On-Demand	Mild	ASAH1	97	38
O=C(NCc1ccc(OCc2ccccn2)cc1)N1CCC(CO)(CO)CC1	ZINC000875121893	GD	On-Demand	Anodyne	ADAM17	36	40
O=C(NCc1ccc(OCc2ccccn2)cc1)N1CCC(CO)(CO)CC1	ZINC000875121893	GD	On-Demand	Anodyne	NAMPT	27	42
CCC1CCC(NC(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875121898	CF	On-Demand	Anodyne	EPHX2	17	47
CCC1CCC(NC(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875121899	CF	On-Demand	Anodyne	EPHX2	17	47
CNC(=O)CCNC(=O)NCc1noc2cc(F)ccc12	ZINC000875121921	CC	On-Demand	Anodyne	P2RX7	23	41
CCC(CC)C(=O)N1CCC(NC(=O)N[C@@H](CC)C[C@@H](C)O)CC1	ZINC000875121945	EE	On-Demand	Anodyne	EPHX2	24	51
CCC(CC)C(=O)N1CCC(NC(=O)N[C@H](CC)C[C@@H](C)O)CC1	ZINC000875121946	EE	On-Demand	Anodyne	EPHX2	24	51
CCC(CC)C(=O)N1CCC(NC(=O)N[C@@H](CC)C[C@H](C)O)CC1	ZINC000875121947	EE	On-Demand	Anodyne	EPHX2	24	51
Cc1cccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)n1	ZINC000875121950	DG	On-Demand	Anodyne	EPHX2	24	40
Cc1cccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)n1	ZINC000875121950	DG	On-Demand	Anodyne	PDE8B	44	36
Cc1cccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)n1	ZINC000875121951	DG	On-Demand	Anodyne	EPHX2	24	40
Cc1cccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)n1	ZINC000875121951	DG	On-Demand	Anodyne	PDE8B	44	36
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3cccc(C)n3)C[C@@H]1C2	ZINC000875121952	DD	On-Demand	Anodyne	PDE8B	42	37
CCN(C(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1)C1CCCC1	ZINC000875121955	EI	On-Demand	Anodyne	ACE	39	42
CCN(C(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1)C1CCCC1	ZINC000875121955	EI	On-Demand	Anodyne	AMY2	45	32
C=CCc1ccc(OC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c(OC)c1	ZINC000875121966	IF	On-Demand	Mild	TGM2	39	44
Cc1cccc(CNC(=O)N2CC[C@@H](C(F)(F)F)O[C@@H](C)C2)n1	ZINC000875121969	EF	On-Demand	Anodyne	PDE8B	45	36
Cc1cccc(CNC(=O)N2CC[C@H](C(F)(F)F)O[C@H](C)C2)n1	ZINC000875121970	EF	On-Demand	Anodyne	PDE8B	45	36
Cc1cccc(CNC(=O)N2CC[C@H](C(F)(F)F)O[C@@H](C)C2)n1	ZINC000875121971	EF	On-Demand	Anodyne	PDE8B	45	36
Cc1cccc(CNC(=O)N2CC[C@@H](C(F)(F)F)O[C@H](C)C2)n1	ZINC000875121972	EF	On-Demand	Anodyne	PDE8B	45	36
Cc1cccc(CNC(=O)N2CCC(c3nccc(-c4cccnc4)n3)CC2)n1	ZINC000875121977	GG	On-Demand	Anodyne	PDE8B	43	36
CC[C@@H]1COCCN1CCNC(=O)NCc1cccc(C)n1	ZINC000875121981	DD	On-Demand	Anodyne	PDE8B	41	37
O=C(NC1CCOCC1)NC1CC(Nc2ccccc2)C1	ZINC000875121991	CE	On-Demand	Anodyne	EPHX2	29	48
CCC(CC)C(=O)N1CCC(NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CC1	ZINC000875122000	GD	On-Demand	Anodyne	EPHX2	26	49
CCC(CC)C(=O)N1CCC(NC(=O)NC2CC(C(=O)OC)C2)CC1	ZINC000875122003	FD	On-Demand	Anodyne	EPHX2	37	55
CCC(CC)C(=O)N1CCC(NC(=O)N2CC(O)(C(=O)OC)C2)CC1	ZINC000875122006	FC	On-Demand	Anodyne	EPHX2	17	42
CCC(CC)C(=O)N1CCC(NC(=O)NC2([C@H]3CCCCO3)CCC2)CC1	ZINC000875122007	GG	On-Demand	Anodyne	EPHX2	22	46
CCC(CC)C(=O)N1CCC(NC(=O)NC2([C@@H]3CCCCO3)CCC2)CC1	ZINC000875122008	GG	On-Demand	Anodyne	EPHX2	22	46
Cc1cccc(CNC(=O)NC2CC(Nc3ccccc3)C2)n1	ZINC000875122012	DF	On-Demand	Anodyne	PDE8B	49	40
Cc1cccc(CNC(=O)N2CCO[C@@H](C(F)(F)F)CC2)n1	ZINC000875122024	DE	On-Demand	Anodyne	PDE8B	44	35
Cc1cccc(CNC(=O)N2CCO[C@H](C(F)(F)F)CC2)n1	ZINC000875122025	DE	On-Demand	Anodyne	PDE8B	44	35
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(C(=O)C(CC)CC)CC2)C1	ZINC000875122029	GE	On-Demand	Anodyne	EPHX2	15	45
O=C(NC1CCOCC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875122034	DD	On-Demand	Anodyne	EPHX2	28	46
O=C(NC1CCOCC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875122035	DD	On-Demand	Anodyne	EPHX2	28	46
O=C(NCc1ccc(-n2ccnc2)c(F)c1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875122057	FE	On-Demand	Anodyne	NOS2	97	36
CNC(=O)CCNC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875122093	DD	On-Demand	Anodyne	ROCK1	27	47
CNC(=O)CCNC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875122093	DD	On-Demand	Anodyne	ROCK2	19	47
CNC(=O)CCNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875122094	ED	On-Demand	Mild	CTSF	66	34
CNC(=O)CCNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875122095	ED	On-Demand	Mild	CTSF	66	34
CNC(=O)CCNC(=O)NC[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C	ZINC000875122100	GD	On-Demand	Anodyne	OPRD1	20	44
CNC(=O)CCNC(=O)NC[C@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C	ZINC000875122101	GD	On-Demand	Anodyne	OPRD1	20	44
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccc(-n3ccnc3)c(F)c2)C1	ZINC000875122108	FD	On-Demand	Anodyne	NOS2	87	35
O=C(NCC[C@@H]1CCSC1)C(=O)NCc1ccc(-n2ccnc2)c(F)c1	ZINC000875122110	GD	On-Demand	Anodyne	NOS2	92	33
O=C(NCC[C@H]1CCSC1)C(=O)NCc1ccc(-n2ccnc2)c(F)c1	ZINC000875122111	GD	On-Demand	Anodyne	NOS2	92	33
C=CCc1ccc(OC(=O)c2cccc(N(C)C)c2)c(OC)c1	ZINC000875122127	DH	On-Demand	Mild	ACR	19	57
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(-n4ccnc4)c(F)c3)CC[C@H]21	ZINC000875122132	GD	On-Demand	Anodyne	NOS2	98	36
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(-n4ccnc4)c(F)c3)CC[C@@H]21	ZINC000875122134	GD	On-Demand	Anodyne	NOS2	98	36
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)c1cccc(OCc2ccccn2)c1	ZINC000875122144	FH	On-Demand	Anodyne	PDS	42	41
CCC(CC)C(=O)N1CCC(NC(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875122149	FE	On-Demand	Anodyne	EPHX2	23	44
CCC(CC)C(=O)N1CCC(NC(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875122150	FE	On-Demand	Anodyne	EPHX2	23	44
Cc1cccc(CNC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)n1	ZINC000875122153	ED	On-Demand	Anodyne	PDE8B	48	39
C=CCc1ccc(OC(=O)c2ccc3c(c2)OCCO3)c(OC)c1	ZINC000875122154	EG	On-Demand	Mild	ACR	15	63
CCC(CC)C(=O)N1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)CC1	ZINC000875122155	EF	On-Demand	Anodyne	EPHX2	25	49
CCC(CC)C(=O)N1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)CC1	ZINC000875122156	EF	On-Demand	Anodyne	EPHX2	25	49
CCC(CC)C(=O)N1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)CC1	ZINC000875122157	EF	On-Demand	Anodyne	EPHX2	25	49
CCC(CC)C(=O)N1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)CC1	ZINC000875122158	EF	On-Demand	Anodyne	EPHX2	25	49
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCOCC2)CC1	ZINC000875122177	EG	On-Demand	Anodyne	EPHX2	28	42
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCOCC2)CC1	ZINC000875122177	EG	On-Demand	Anodyne	RBP4	35	41
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCOCC2)CC1	ZINC000875122178	EG	On-Demand	Anodyne	EPHX2	28	42
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCOCC2)CC1	ZINC000875122178	EG	On-Demand	Anodyne	RBP4	35	41
C=CCc1ccc(OC(=O)c2ccc(C)c(S(=O)(=O)N3CCOCC3)c2)c(OC)c1	ZINC000875122179	IF	On-Demand	Mild	CNR2	15	49
C#Cc1cccc(NC(=O)CNC(=O)Nc2cnn(C3CCN(C)CC3)c2)c1	ZINC000875122184	GD	On-Demand	Mild	CCR3	34	42
C#Cc1cccc(NC(=O)CNC(=O)Nc2cnn(C3CCN(C)CC3)c2)c1	ZINC000875122184	GD	On-Demand	Mild	CCKBR	18	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccc(C)n2)C1	ZINC000875122189	DD	On-Demand	Anodyne	PDE8B	49	40
Cc1cccc(CNC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)n1	ZINC000875122196	FG	On-Demand	Anodyne	PDE8B	49	39
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)c1cccc(OCc2ccccn2)c1	ZINC000875122198	FH	On-Demand	Anodyne	PDS	42	41
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCC2(c3ccc(F)cc3)CCOCC2)C1	ZINC000875122199	GE	On-Demand	Anodyne	KCNA3	45	36
COCCN(CC1CCN(C)CC1)C(=O)NCc1cccc(OC)c1OC	ZINC000875122209	GE	On-Demand	Anodyne	ACKR3	66	35
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NCc1nc(C2CC2)no1	ZINC000875122210	GG	On-Demand	Anodyne	CPT1A	57	38
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1cccc(OCc2ccccn2)c1	ZINC000875122217	GH	On-Demand	Anodyne	GRIN2B	20	40
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1cccc(OCc2ccccn2)c1	ZINC000875122221	GH	On-Demand	Anodyne	GRIN2B	20	40
COC(=O)C1(O)CN(C(=O)NCc2cccc(C)n2)C1	ZINC000875122227	CB	On-Demand	Anodyne	PDE8B	45	36
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(C)cc1	ZINC000875122249	DF	On-Demand	Anodyne	SLC6A4	32	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(C)cc1	ZINC000875122249	DF	On-Demand	Anodyne	SLC6A3	67	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(C)cc1	ZINC000875122251	DF	On-Demand	Anodyne	SLC6A4	32	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(C)cc1	ZINC000875122251	DF	On-Demand	Anodyne	SLC6A3	67	47
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(C)cc1	ZINC000875122254	DF	On-Demand	Anodyne	SLC6A4	32	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(C)cc1	ZINC000875122254	DF	On-Demand	Anodyne	SLC6A3	67	47
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(C)cc1	ZINC000875122255	DF	On-Demand	Anodyne	SLC6A4	32	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(C)cc1	ZINC000875122255	DF	On-Demand	Anodyne	SLC6A3	67	47
COCCN(CC1CCN(C)CC1)C(=O)NCc1cccc(C)n1	ZINC000875122256	ED	On-Demand	Anodyne	PDE8B	46	40
CCC(CC)C(=O)N1CCC(NC(=O)NNc2cccc(C)n2)CC1	ZINC000875122269	EE	On-Demand	Reactive	EPHX2	33	44
CCC1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@@]3(C(=O)OC)C2)CC1	ZINC000875122276	DF	On-Demand	Anodyne	EPHX2	19	45
C=CCc1ccc(OC(=O)/C=C/c2ccc3c(c2)OCO3)c(OC)c1	ZINC000875122291	EH	On-Demand	Mild	EDNRB	30	40
C=CCc1ccc(OC(=O)/C=C/c2ccc3c(c2)OCO3)c(OC)c1	ZINC000875122291	EH	On-Demand	Mild	F3	17	49
C=CCc1ccc(OC(=O)/C=C/c2ccc3c(c2)OCO3)c(OC)c1	ZINC000875122291	EH	On-Demand	Mild	NR1H4	37	44
C=CCc1ccc(OC(=O)/C=C\c2ccc3c(c2)OCO3)c(OC)c1	ZINC000875122293	EH	On-Demand	Mild	EDNRB	30	40
C=CCc1ccc(OC(=O)/C=C\c2ccc3c(c2)OCO3)c(OC)c1	ZINC000875122293	EH	On-Demand	Mild	F3	17	49
C=CCc1ccc(OC(=O)/C=C\c2ccc3c(c2)OCO3)c(OC)c1	ZINC000875122293	EH	On-Demand	Mild	NR1H4	37	44
CCC(CC)C(=O)N1CCC(NC(=O)N[C@@H]2CC(C)(C)CC[C@H]2O)CC1	ZINC000875122353	FF	On-Demand	Anodyne	EPHX2	29	51
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000875122390	GC	On-Demand	Anodyne	DRD4	29	44
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000875122390	GC	On-Demand	Anodyne	KCNH2	19	44
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000875122390	GC	On-Demand	Anodyne	SIGMAR1	27	57
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000875122390	GC	On-Demand	Anodyne	SSTR5	76	43
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000875122390	GC	On-Demand	Anodyne	CCR3	51	46
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000875122390	GC	On-Demand	Anodyne	CXCR3	50	42
COC(=O)C1(O)CN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000875122390	GC	On-Demand	Anodyne	MCHR1	58	49
CC[C@H](C)NC(=O)CCNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875122394	FF	On-Demand	Anodyne	OPRL1	17	43
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(OC)cc2OC)C1	ZINC000875122420	FE	On-Demand	Anodyne	MTNR1A	42	36
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875122445	FD	On-Demand	Mild	DRD3	15	40
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875122445	FD	On-Demand	Mild	P2RY12	57	33
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875122446	FD	On-Demand	Mild	DRD3	15	40
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875122446	FD	On-Demand	Mild	P2RY12	57	33
CC(=O)C1CCN(C(=O)N[C@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875122464	FI	On-Demand	Anodyne	ACE	63	39
CC(=O)C1CCN(C(=O)N[C@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875122464	FI	On-Demand	Anodyne	FKBP1A	37	41
CC(=O)C1CCN(C(=O)N[C@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875122464	FI	On-Demand	Anodyne	SLC6A3	15	41
CC(=O)C1CCN(C(=O)N[C@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875122464	FI	On-Demand	Anodyne	GHRHR	41	34
CC(=O)C1CCN(C(=O)N[C@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875122464	FI	On-Demand	Anodyne	CYSP_TRYCR	16	41
CC(=O)C1CCN(C(=O)N[C@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875122464	FI	On-Demand	Anodyne	CCR5	57	46
CC(=O)C1CCN(C(=O)N[C@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875122464	FI	On-Demand	Anodyne	BIRC2	49	40
CC(=O)C1CCN(C(=O)N[C@@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875122465	FI	On-Demand	Anodyne	ACE	63	39
CC(=O)C1CCN(C(=O)N[C@@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875122465	FI	On-Demand	Anodyne	FKBP1A	37	41
CC(=O)C1CCN(C(=O)N[C@@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875122465	FI	On-Demand	Anodyne	SLC6A3	15	41
CC(=O)C1CCN(C(=O)N[C@@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875122465	FI	On-Demand	Anodyne	GHRHR	41	34
CC(=O)C1CCN(C(=O)N[C@@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875122465	FI	On-Demand	Anodyne	CYSP_TRYCR	16	41
CC(=O)C1CCN(C(=O)N[C@@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875122465	FI	On-Demand	Anodyne	CCR5	57	46
CC(=O)C1CCN(C(=O)N[C@@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875122465	FI	On-Demand	Anodyne	BIRC2	49	40
CNC(=O)CCNC(=O)NC1CCN(c2ccccc2C#N)CC1	ZINC000875122475	EC	On-Demand	Mild	HTR1A	16	42
CNC(=O)CCNC(=O)NC1CCN(c2ccccc2C#N)CC1	ZINC000875122475	EC	On-Demand	Mild	DRD2	19	44
CNC(=O)CCNC(=O)NC1CCN(c2ccccc2C#N)CC1	ZINC000875122475	EC	On-Demand	Mild	DRD4	21	45
CNC(=O)CCNC(=O)NC1CCN(c2ccccc2C#N)CC1	ZINC000875122475	EC	On-Demand	Mild	HTR7	15	42
CNC(=O)CCNC(=O)NC1CCN(c2ccccc2C#N)CC1	ZINC000875122475	EC	On-Demand	Mild	NPY1R	17	42
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	ACE	41	42
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	TYR	33	42
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	OPRM1	35	40
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	OPRD1	33	40
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	CELA1	18	43
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	ELANE	20	42
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	MME	86	42
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	ANPEP	48	38
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	TACR1	21	58
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	CTRA_BOVIN	52	33
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	HRAS	47	46
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	FCER2	50	32
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	CASP3	16	48
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	BMP1	21	46
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	KLK3	92	41
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	CTSB	91	59
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	PAPA1_CARPA	108	59
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	CYSP_TRYCR	72	50
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	CTSG	42	33
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	CTSK	55	59
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	CTSL	63	59
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	TIMP3	72	33
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	CAPNS1	87	52
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	HLA-DRB1	84	39
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	CELA2A	58	33
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	REN	23	43
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	MMP11	67	34
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	CTSS	26	59
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	CAPN1	123	52
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	CASP1	25	42
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	CTRC	16	44
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	CAPN2	162	55
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	ACE2	61	38
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	CASP9	30	40
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	FPR1	56	35
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	CTRB_BOVIN	45	35
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	NPR	86	42
C=C(C)CN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875122487	GH	On-Demand	Mild	PSMB5	47	44
O=C(N[C@H](c1ccccc1)C1CCCC1)N1CCC(CO)(CO)CC1	ZINC000875122488	EF	On-Demand	Anodyne	CTSS	20	42
O=C(N[C@@H](c1ccccc1)C1CCCC1)N1CCC(CO)(CO)CC1	ZINC000875122489	EF	On-Demand	Anodyne	CTSS	20	42
CNC(=O)CCNC(=O)NC[C@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000875122490	EC	On-Demand	Anodyne	DRD4	19	43
CNC(=O)CCNC(=O)NC[C@@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000875122491	EC	On-Demand	Anodyne	DRD4	19	43
C=CCc1ccc(OC(=O)c2ccc3c(c2)OCO3)c(OC)c1	ZINC000875122507	DG	On-Demand	Mild	EDNRB	43	48
C=CCc1ccc(OC(=O)c2ccc3c(c2)OCO3)c(OC)c1	ZINC000875122507	DG	On-Demand	Mild	EDNRA	49	51
C=CCc1ccc(OC(=O)c2ccc3c(c2)OCO3)c(OC)c1	ZINC000875122507	DG	On-Demand	Mild	F3	21	41
C=CCc1ccc(OC(=O)c2ccc3c(c2)OCO3)c(OC)c1	ZINC000875122507	DG	On-Demand	Mild	ACR	15	63
CNC(=O)CCNC(=O)N[C@H](C)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875122511	FD	On-Demand	Anodyne	GPR119	28	44
CNC(=O)CCNC(=O)N[C@@H](C)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875122512	FD	On-Demand	Anodyne	GPR119	28	44
O=C(NCCCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875122534	GG	On-Demand	Clean	HTR1A	106	60
O=C(NCCCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875122534	GG	On-Demand	Clean	DRD2	85	53
O=C(NCCCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875122534	GG	On-Demand	Clean	DRD1	19	41
O=C(NCCCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875122534	GG	On-Demand	Clean	DRD4	52	53
O=C(NCCCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875122534	GG	On-Demand	Clean	ADRA1D	34	48
O=C(NCCCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875122534	GG	On-Demand	Clean	HTR2A	73	56
O=C(NCCCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875122534	GG	On-Demand	Clean	HTR2C	40	48
O=C(NCCCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875122534	GG	On-Demand	Clean	SLC6A4	20	43
O=C(NCCCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875122534	GG	On-Demand	Clean	ADRA1A	53	48
O=C(NCCCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875122534	GG	On-Demand	Clean	ADRA1B	34	48
O=C(NCCCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875122534	GG	On-Demand	Clean	DRD3	114	56
O=C(NCCCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875122534	GG	On-Demand	Clean	DRD5	22	49
O=C(NCCCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875122534	GG	On-Demand	Clean	HTR7	115	48
O=C(NCCCCN1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875122534	GG	On-Demand	Clean	SIGMAR1	15	43
C=CCc1ccc(OC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c(OC)c1	ZINC000875122536	GI	On-Demand	Mild	TAAR1	15	48
O=C(NCCOC1CCCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875122542	EF	On-Demand	Anodyne	ADRB1	15	40
O=C(NCCOC1CCCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875122543	EF	On-Demand	Anodyne	ADRB1	15	40
O=C(NCCOC1CCCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875122544	EF	On-Demand	Anodyne	ADRB1	15	40
Cc1cccc(CNC(=O)N2CC([C@@H]3CCC[C@H](C)C3)C2)n1	ZINC000875122546	DG	On-Demand	Anodyne	PDE8B	47	38
Cc1cccc(CNC(=O)N2CC([C@H]3CCC[C@@H](C)C3)C2)n1	ZINC000875122548	DG	On-Demand	Anodyne	PDE8B	47	38
Cc1cccc(CNC(=O)N2CC([C@@H]3CCC[C@@H](C)C3)C2)n1	ZINC000875122550	DG	On-Demand	Anodyne	PDE8B	47	38
Cc1cccc(CNC(=O)N2CC([C@H]3CCC[C@H](C)C3)C2)n1	ZINC000875122552	DG	On-Demand	Anodyne	PDE8B	47	38
Cc1ccc([C@H](C)NC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875122580	CG	On-Demand	Clean	PTGER4	15	42
C=CCc1ccc(OC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2C)c(OC)c1	ZINC000875122585	IF	On-Demand	Mild	TGM2	22	42
CCC(CC)C(=O)N1CCC(NC(=O)NCCN2CCOC[C@H]2CC)CC1	ZINC000875122610	GD	On-Demand	Anodyne	EPHX2	16	42
CCC(CC)C(=O)N1CCC(NC(=O)NCCN2CCOC[C@@H]2CC)CC1	ZINC000875122612	GD	On-Demand	Anodyne	EPHX2	16	42
CCC(CC)C(=O)N1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875122614	GG	On-Demand	Anodyne	EPHX2	51	48
Cc1cccc(CNC(=O)NC2([C@@H]3CCCCO3)CCC2)n1	ZINC000875122638	DF	On-Demand	Anodyne	PDE8B	40	35
Cc1cccc(CNC(=O)NC2([C@H]3CCCCO3)CCC2)n1	ZINC000875122640	DF	On-Demand	Anodyne	PDE8B	40	35
CCC(CC)C(=O)N1CCC(NC(=O)N2CCCC[C@H]2CNC(=O)NC)CC1	ZINC000875122642	GD	On-Demand	Anodyne	EPHX2	15	45
CCC(CC)C(=O)N1CCC(NC(=O)N2CCCC[C@@H]2CNC(=O)NC)CC1	ZINC000875122644	GD	On-Demand	Anodyne	EPHX2	15	45
C=CCc1ccc(OC(=O)c2ccc3nc[nH]c3c2)c(OC)c1	ZINC000875122661	DH	On-Demand	Mild	ACR	18	59
C=CCc1ccc(OC(=O)c2ccc3nc[nH]c3c2)c(OC)c1	ZINC000875122661	DH	On-Demand	Mild	QPCT	22	44
CCC(CC)C(=O)N1CCC(NC(=O)N2CCC(CO)(CO)CC2)CC1	ZINC000875122687	FD	On-Demand	Anodyne	EPHX2	18	43
O=C(NCc1nc(C2CC2)no1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875122689	ED	On-Demand	Anodyne	ETHR	42	40
O=C(NCc1nc(C2CC2)no1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875122692	ED	On-Demand	Anodyne	ETHR	42	40
CNC(=O)CCNC(=O)NCc1cccc2ncccc12	ZINC000875122696	CD	On-Demand	Anodyne	P2RX7	15	41
CNC(=O)CCNC(=O)NCc1cccc2ncccc12	ZINC000875122696	CD	On-Demand	Anodyne	MTNR1A	24	42
Cc1nnc(NNC(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)n1C	ZINC000875122720	GD	On-Demand	Reactive	DRD4	17	41
Cc1nnc(NNC(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)n1C	ZINC000875122720	GD	On-Demand	Reactive	SIGMAR1	21	54
Cc1nnc(NNC(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)n1C	ZINC000875122720	GD	On-Demand	Reactive	SSTR5	68	38
Cc1nnc(NNC(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)n1C	ZINC000875122720	GD	On-Demand	Reactive	CCR3	38	42
Cc1nnc(NNC(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)n1C	ZINC000875122720	GD	On-Demand	Reactive	MCHR1	50	47
CCC(CC)C(=O)N1CCC(NC(=O)NC(C)(C)C(O)(CC)CC)CC1	ZINC000875122744	FG	On-Demand	Anodyne	EPHX2	30	49
Cc1cccc(CNC(=O)N2CCCCCCNC(=O)CC2)n1	ZINC000875122758	DD	On-Demand	Anodyne	PDE8B	42	35
O=C(NC1CCOCC1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875122787	FF	On-Demand	Anodyne	MAPK1	63	34
O=C(NC1CCOCC1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875122787	FF	On-Demand	Anodyne	SMO	15	40
CCC(CC)C(=O)N1CCC(NC(=O)NC2(C)CC(F)(F)C2)CC1	ZINC000875122789	EF	On-Demand	Anodyne	EPHX2	33	50
CCOC(=O)[C@@H]1CN(C(=O)NCc2cccc(C)n2)CCC1(F)F	ZINC000875122795	EE	On-Demand	Anodyne	PDE8B	45	37
Cc1cccc(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)n1	ZINC000875122796	CE	On-Demand	Anodyne	PDE8B	41	36
Cc1cccc(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)n1	ZINC000875122797	CE	On-Demand	Anodyne	PDE8B	41	36
Cc1cccc(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)n1	ZINC000875122799	CE	On-Demand	Anodyne	PDE8B	41	36
Cc1cccc(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)n1	ZINC000875122801	CE	On-Demand	Anodyne	PDE8B	41	36
Cc1cccc(CNC(=O)NC[C@H]2CN(Cc3ccccc3C)CCO2)n1	ZINC000875122804	FE	On-Demand	Anodyne	PDE8B	71	41
Cc1cccc(CNC(=O)NC[C@@H]2CN(Cc3ccccc3C)CCO2)n1	ZINC000875122806	FE	On-Demand	Anodyne	PDE8B	71	41
Cn1cc(CNC(=O)C(=O)N2C[C@@H]3CC[C@H](C2)N3C(=O)OC(C)(C)C)cn1	ZINC000875122813	GC	On-Demand	Anodyne	GPR119	18	40
O=C(NCCOC1CCCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875122845	EF	On-Demand	Anodyne	ADRB1	15	40
CONC(=O)C1CCN(C(=O)N[C@@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875122848	GG	On-Demand	Anodyne	ACE	49	37
CONC(=O)C1CCN(C(=O)N[C@@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875122848	GG	On-Demand	Anodyne	FKBP1A	53	42
CONC(=O)C1CCN(C(=O)N[C@@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875122848	GG	On-Demand	Anodyne	SLC6A3	20	44
CONC(=O)C1CCN(C(=O)N[C@@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875122848	GG	On-Demand	Anodyne	GHRHR	45	34
CONC(=O)C1CCN(C(=O)N[C@@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875122848	GG	On-Demand	Anodyne	CCR5	44	45
CONC(=O)C1CCN(C(=O)N[C@@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875122848	GG	On-Demand	Anodyne	CAPN1	20	42
CONC(=O)C1CCN(C(=O)N[C@@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875122848	GG	On-Demand	Anodyne	XIAP	49	35
CONC(=O)C1CCN(C(=O)N[C@@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875122848	GG	On-Demand	Anodyne	Q6PRC7_IXORI	45	35
CONC(=O)C1CCN(C(=O)N[C@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875122849	GG	On-Demand	Anodyne	ACE	49	37
CONC(=O)C1CCN(C(=O)N[C@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875122849	GG	On-Demand	Anodyne	FKBP1A	53	42
CONC(=O)C1CCN(C(=O)N[C@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875122849	GG	On-Demand	Anodyne	SLC6A3	20	44
CONC(=O)C1CCN(C(=O)N[C@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875122849	GG	On-Demand	Anodyne	GHRHR	45	34
CONC(=O)C1CCN(C(=O)N[C@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875122849	GG	On-Demand	Anodyne	CCR5	44	45
CONC(=O)C1CCN(C(=O)N[C@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875122849	GG	On-Demand	Anodyne	CAPN1	20	42
CONC(=O)C1CCN(C(=O)N[C@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875122849	GG	On-Demand	Anodyne	XIAP	49	35
CONC(=O)C1CCN(C(=O)N[C@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875122849	GG	On-Demand	Anodyne	Q6PRC7_IXORI	45	35
C=CCc1ccc(OC(=O)c2ccc(N)c([N+](=O)[O-])c2)c(OC)c1	ZINC000875122850	EG	On-Demand	Mild	ACR	22	60
O=C(NCCOC1CCCC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875122851	EF	On-Demand	Anodyne	EPHX2	16	44
O=C(NCCOC1CCCC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875122852	EF	On-Demand	Anodyne	EPHX2	16	44
C=CCc1ccc(OC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2Cl)c(OC)c1	ZINC000875122854	JG	On-Demand	Mild	TGM2	23	41
CCCCCCCNC(=O)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875122855	EF	On-Demand	Mild	HTR1A	39	52
CCCCCCCNC(=O)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875122855	EF	On-Demand	Mild	DRD2	37	46
CCCCCCCNC(=O)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875122855	EF	On-Demand	Mild	CNR1	17	40
CCCCCCCNC(=O)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875122855	EF	On-Demand	Mild	HTR2A	30	44
CCCCCCCNC(=O)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875122855	EF	On-Demand	Mild	HTR2C	15	41
CCCCCCCNC(=O)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875122855	EF	On-Demand	Mild	DRD3	61	46
CCCCCCCNC(=O)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875122855	EF	On-Demand	Mild	P2RY12	43	34
CCCCCCCNC(=O)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875122855	EF	On-Demand	Mild	CNR2	26	40
CCCCCCCNC(=O)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875122855	EF	On-Demand	Mild	SIGMAR1	18	40
CCCCCCCNC(=O)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875122855	EF	On-Demand	Mild	SOAT1	22	40
CCCCCCCNC(=O)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875122855	EF	On-Demand	Mild	EPHX2	31	48
CCCCCCCNC(=O)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875122855	EF	On-Demand	Mild	ASAH1	92	38
C=CCc1ccc(OC(=O)c2cccc(OC(F)F)c2)c(OC)c1	ZINC000875122866	EI	On-Demand	Mild	ACR	19	55
COC(=O)C1(O)CN(C(=O)NCc2cc(OC)ccc2Br)C1	ZINC000875122872	FC	On-Demand	Anodyne	MTNR1A	48	36
CN1CCN(C2CCN(C(=O)N[C@H](c3ccccc3)C3CCCC3)CC2)CC1	ZINC000875122875	GG	On-Demand	Anodyne	CCR5	20	42
CN1CCN(C2CCN(C(=O)N[C@H](c3ccccc3)C3CCCC3)CC2)CC1	ZINC000875122875	GG	On-Demand	Anodyne	L3MBTL3	89	47
CN1CCN(C2CCN(C(=O)N[C@@H](c3ccccc3)C3CCCC3)CC2)CC1	ZINC000875122876	GG	On-Demand	Anodyne	CCR5	20	42
CN1CCN(C2CCN(C(=O)N[C@@H](c3ccccc3)C3CCCC3)CC2)CC1	ZINC000875122876	GG	On-Demand	Anodyne	L3MBTL3	89	47
O=C(N[C@@H](CCc1ccccc1)c1ccccc1)N1CCC2(CCNC2=O)CC1	ZINC000875122883	GH	On-Demand	Anodyne	CACNA1H	20	41
O=C(N[C@@H](CCc1ccccc1)c1ccccc1)N1CCC2(CCNC2=O)CC1	ZINC000875122883	GH	On-Demand	Anodyne	GHRHR	68	41
O=C(N[C@H](CCc1ccccc1)c1ccccc1)N1CCC2(CCNC2=O)CC1	ZINC000875122884	GH	On-Demand	Anodyne	CACNA1H	20	41
O=C(N[C@H](CCc1ccccc1)c1ccccc1)N1CCC2(CCNC2=O)CC1	ZINC000875122884	GH	On-Demand	Anodyne	GHRHR	68	41
O=C(NCCO)C1CCN(C(=O)N[C@@H](c2ccccc2)C2CCCC2)CC1	ZINC000875122898	FE	On-Demand	Anodyne	EPHX2	18	44
O=C(NCCO)C1CCN(C(=O)N[C@H](c2ccccc2)C2CCCC2)CC1	ZINC000875122899	FE	On-Demand	Anodyne	EPHX2	18	44
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(c4ccccc4)CC3)CC[C@@H]21	ZINC000875122906	FD	On-Demand	Anodyne	EPHX2	19	42
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(c4ccccc4)CC3)CC[C@H]21	ZINC000875122909	FD	On-Demand	Anodyne	EPHX2	19	42
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1cccc(OCc2ccccn2)c1	ZINC000875122912	GH	On-Demand	Anodyne	BIRC2	18	40
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1cccc(OCc2ccccn2)c1	ZINC000875122914	GH	On-Demand	Anodyne	BIRC2	18	40
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875122918	GE	On-Demand	Anodyne	HTR1A	17	41
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875122918	GE	On-Demand	Anodyne	DRD2	17	44
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875122918	GE	On-Demand	Anodyne	DRD3	21	44
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875122918	GE	On-Demand	Anodyne	HTR7	22	41
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875122919	GE	On-Demand	Anodyne	HTR1A	17	41
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875122919	GE	On-Demand	Anodyne	DRD2	17	44
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875122919	GE	On-Demand	Anodyne	DRD3	21	44
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875122919	GE	On-Demand	Anodyne	HTR7	22	41
COC(=O)C1(O)CN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000875122925	GC	On-Demand	Anodyne	HTR1A	130	61
COC(=O)C1(O)CN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000875122925	GC	On-Demand	Anodyne	ADRA2A	15	41
COC(=O)C1(O)CN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000875122925	GC	On-Demand	Anodyne	DRD2	98	48
COC(=O)C1(O)CN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000875122925	GC	On-Demand	Anodyne	DRD1	20	44
COC(=O)C1(O)CN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000875122925	GC	On-Demand	Anodyne	DRD4	61	47
COC(=O)C1(O)CN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000875122925	GC	On-Demand	Anodyne	ADRA1D	67	50
COC(=O)C1(O)CN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000875122925	GC	On-Demand	Anodyne	HTR2A	84	52
COC(=O)C1(O)CN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000875122925	GC	On-Demand	Anodyne	HTR2C	42	48
COC(=O)C1(O)CN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000875122925	GC	On-Demand	Anodyne	SLC6A4	20	44
COC(=O)C1(O)CN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000875122925	GC	On-Demand	Anodyne	ADRA1A	92	50
COC(=O)C1(O)CN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000875122925	GC	On-Demand	Anodyne	ADRA1B	64	50
COC(=O)C1(O)CN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000875122925	GC	On-Demand	Anodyne	DRD3	121	52
COC(=O)C1(O)CN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000875122925	GC	On-Demand	Anodyne	HTR4	21	41
COC(=O)C1(O)CN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000875122925	GC	On-Demand	Anodyne	DRD5	19	42
COC(=O)C1(O)CN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000875122925	GC	On-Demand	Anodyne	HTR7	140	48
COC(=O)C1(O)CN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000875122925	GC	On-Demand	Anodyne	SIGMAR1	26	45
COC(=O)N(C)NC(=O)N[C@@H](C)c1ccc(C)cc1	ZINC000875122954	CD	On-Demand	Reactive	ACACA	24	40
COC(=O)N(C)NC(=O)N[C@@H](C)c1ccc(C)cc1	ZINC000875122954	CD	On-Demand	Reactive	ACACB	24	40
COC(=O)N(C)NC(=O)N[C@H](C)c1ccc(C)cc1	ZINC000875122956	CD	On-Demand	Reactive	ACACA	24	40
COC(=O)N(C)NC(=O)N[C@H](C)c1ccc(C)cc1	ZINC000875122956	CD	On-Demand	Reactive	ACACB	24	40
Cc1cccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)n1	ZINC000875122971	EG	On-Demand	Anodyne	CPT1A	73	36
Cc1cccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)n1	ZINC000875122971	EG	On-Demand	Anodyne	PDE8B	48	39
Cc1cccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)n1	ZINC000875122975	EG	On-Demand	Anodyne	CPT1A	73	36
Cc1cccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)n1	ZINC000875122975	EG	On-Demand	Anodyne	PDE8B	48	39
Cc1cccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)n1	ZINC000875122979	EG	On-Demand	Anodyne	CPT1A	73	36
Cc1cccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)n1	ZINC000875122979	EG	On-Demand	Anodyne	PDE8B	48	39
Cc1cccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)n1	ZINC000875122982	EG	On-Demand	Anodyne	CPT1A	73	36
Cc1cccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)n1	ZINC000875122982	EG	On-Demand	Anodyne	PDE8B	48	39
Cc1ccc([C@H](C)NC(=O)N2CCC[C@@H](C(=O)N[C@@H]3CCC[C@@H](O)C3)C2)cc1	ZINC000875122995	GF	On-Demand	Anodyne	EPHX2	19	44
Cc1ccc([C@H](C)NC(=O)N2CCC[C@@H](C(=O)N[C@@H]3CCC[C@H](O)C3)C2)cc1	ZINC000875122997	GF	On-Demand	Anodyne	EPHX2	19	44
Cc1ccc([C@H](C)NC(=O)N2CCC[C@@H](C(=O)N[C@H]3CCC[C@@H](O)C3)C2)cc1	ZINC000875122999	GF	On-Demand	Anodyne	EPHX2	19	44
Cc1ccc([C@H](C)NC(=O)N2CCC[C@@H](C(=O)N[C@H]3CCC[C@H](O)C3)C2)cc1	ZINC000875123000	GF	On-Demand	Anodyne	EPHX2	19	44
CCC(CC)C(=O)N1CCC(NC(=O)NNc2cccc(F)c2Cl)CC1	ZINC000875123021	GH	On-Demand	Reactive	EPHX2	34	43
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cccc(C)n2)CC1	ZINC000875123029	FH	On-Demand	Anodyne	PDE8B	40	36
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cccc(C)n2)CC1	ZINC000875123030	FH	On-Demand	Anodyne	PDE8B	40	36
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(OC)c1OC	ZINC000875123041	DE	On-Demand	Anodyne	ANPEP	19	52
N#Cc1ccc(Cn2cc(NC(=O)NC3CCOCC3)cn2)cc1	ZINC000875123048	EE	On-Demand	Mild	CCR3	17	40
N#Cc1ccc(Cn2cc(NC(=O)NC3CCOCC3)cn2)cc1	ZINC000875123048	EE	On-Demand	Mild	ITK	18	51
N#Cc1ccc(Cn2cc(NC(=O)NC3CCOCC3)cn2)cc1	ZINC000875123048	EE	On-Demand	Mild	PANC	57	40
C#CC[C@@H](COC)NC(=O)C(=O)NCc1ccc(-n2ccnc2)c(F)c1	ZINC000875123090	FC	On-Demand	Mild	NOS2	60	33
C#CC[C@H](COC)NC(=O)C(=O)NCc1ccc(-n2ccnc2)c(F)c1	ZINC000875123093	FC	On-Demand	Mild	NOS2	60	33
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875123133	FD	On-Demand	Reactive	DRD4	33	45
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875123133	FD	On-Demand	Reactive	KCNH2	21	47
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875123133	FD	On-Demand	Reactive	CHRM3	18	40
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875123133	FD	On-Demand	Reactive	LTA4H	21	40
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875123133	FD	On-Demand	Reactive	SIGMAR1	34	62
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875123133	FD	On-Demand	Reactive	SSTR5	75	41
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875123133	FD	On-Demand	Reactive	CCR3	66	47
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875123133	FD	On-Demand	Reactive	UTS2R	16	40
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875123133	FD	On-Demand	Reactive	EPHX2	22	41
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875123133	FD	On-Demand	Reactive	CXCR3	43	38
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875123133	FD	On-Demand	Reactive	MCHR1	72	53
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875123133	FD	On-Demand	Reactive	CCR8	16	43
O=C(NCc1nc(C2CC2)no1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875123135	EE	On-Demand	Anodyne	EPHX2	17	41
O=C(NCc1nc(C2CC2)no1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875123135	EE	On-Demand	Anodyne	SMO	34	42
O=C(NCc1nc(C2CC2)no1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875123138	EE	On-Demand	Anodyne	EPHX2	17	41
O=C(NCc1nc(C2CC2)no1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875123138	EE	On-Demand	Anodyne	SMO	34	42
Cc1cccc(CNC(=O)N[C@]23CCC[C@@H]2N(C(=O)OC(C)(C)C)CC3)n1	ZINC000875123146	FG	On-Demand	Anodyne	PDE8B	40	36
Cc1cccc(CNC(=O)N[C@@]23CCC[C@@H]2N(C(=O)OC(C)(C)C)CC3)n1	ZINC000875123148	FG	On-Demand	Anodyne	PDE8B	40	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)cc1OC	ZINC000875123149	ED	On-Demand	Anodyne	SLC6A4	26	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)cc1OC	ZINC000875123149	ED	On-Demand	Anodyne	SLC6A3	47	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)cc1OC	ZINC000875123150	ED	On-Demand	Anodyne	SLC6A4	26	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)cc1OC	ZINC000875123150	ED	On-Demand	Anodyne	SLC6A3	47	41
Cc1cccc(CNC(=O)N[C@@]23CCC[C@H]2N(C(=O)OC(C)(C)C)CC3)n1	ZINC000875123151	FG	On-Demand	Anodyne	PDE8B	40	36
Cc1cccc(CNC(=O)N[C@]23CCC[C@H]2N(C(=O)OC(C)(C)C)CC3)n1	ZINC000875123153	FG	On-Demand	Anodyne	PDE8B	40	36
Cc1cccc(CNC(=O)NCC[C@H](O)C2CCCC2)n1	ZINC000875123156	CE	On-Demand	Anodyne	PDE8B	40	36
Cc1cccc(CNC(=O)NCC[C@@H](O)C2CCCC2)n1	ZINC000875123158	CE	On-Demand	Anodyne	PDE8B	40	36
Cn1cc(CNC(=O)C(=O)N2CCN(c3ccc(F)cc3F)CC2)cn1	ZINC000875123182	FC	On-Demand	Anodyne	NPY2R	46	38
C[C@@H](NC(=O)N1CCC(CCF)CC1)c1cccc(NS(C)(=O)=O)c1	ZINC000875123186	FF	On-Demand	Anodyne	TRPV1	40	34
C[C@@H](NC(=O)N1CCC(CCF)CC1)c1cccc(NS(C)(=O)=O)c1	ZINC000875123186	FF	On-Demand	Anodyne	ST14	72	36
CC[C@H](C)NC(=O)CCNC(=O)N(CC)[C@H](C)[C@H](O)c1ccccc1	ZINC000875123232	EE	On-Demand	Anodyne	NPY5R	22	41
CC[C@H](C)NC(=O)CCNC(=O)N(CC)[C@H](C)[C@@H](O)c1ccccc1	ZINC000875123233	EE	On-Demand	Anodyne	NPY5R	22	41
CC[C@H](C)NC(=O)CCNC(=O)N(CC)[C@@H](C)[C@H](O)c1ccccc1	ZINC000875123234	EE	On-Demand	Anodyne	NPY5R	22	41
CC[C@H](C)NC(=O)CCNC(=O)N(CC)[C@@H](C)[C@@H](O)c1ccccc1	ZINC000875123235	EE	On-Demand	Anodyne	NPY5R	22	41
Cn1cc(CNC(=O)C(=O)NCCCCCCc2ccccc2)cn1	ZINC000875123244	ED	On-Demand	Anodyne	HTR1A	15	43
Cn1cc(CNC(=O)C(=O)NCCCCCCc2ccccc2)cn1	ZINC000875123244	ED	On-Demand	Anodyne	DRD2	17	43
Cn1cc(CNC(=O)C(=O)NCCCCCCc2ccccc2)cn1	ZINC000875123244	ED	On-Demand	Anodyne	SIGMAR1	22	40
Cn1cc(CNC(=O)C(=O)NCCCCCCc2ccccc2)cn1	ZINC000875123244	ED	On-Demand	Anodyne	FAAH	76	40
Cn1cc(CNC(=O)C(=O)NCCCCCCc2ccccc2)cn1	ZINC000875123244	ED	On-Demand	Anodyne	CES1	68	37
Cn1cc(CNC(=O)C(=O)NCCCCCCc2ccccc2)cn1	ZINC000875123244	ED	On-Demand	Anodyne	AMP1_PLAFQ	30	45
Cn1cc(CNC(=O)C(=O)NCCCCCCc2ccccc2)cn1	ZINC000875123244	ED	On-Demand	Anodyne	CES1D	55	35
C=CCc1ccc(OC(=O)c2cccc(S(=O)(=O)N3C[C@H](C)O[C@H](C)C3)c2)c(OC)c1	ZINC000875123280	IG	On-Demand	Mild	AKR1C3	52	41
C=CCc1ccc(OC(=O)c2cccc(S(=O)(=O)N3C[C@@H](C)O[C@H](C)C3)c2)c(OC)c1	ZINC000875123282	IG	On-Demand	Mild	AKR1C3	52	41
C=CCc1ccc(OC(=O)c2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)c(OC)c1	ZINC000875123284	IF	On-Demand	Mild	CPT1B	44	35
C=CCc1ccc(OC(=O)c2cccc(S(=O)(=O)N3C[C@H](C)O[C@@H](C)C3)c2)c(OC)c1	ZINC000875123285	IG	On-Demand	Mild	AKR1C3	52	41
CC[C@H](C[C@H](C)O)NC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000875123343	GE	On-Demand	Anodyne	HTR1A	94	60
CC[C@H](C[C@H](C)O)NC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000875123343	GE	On-Demand	Anodyne	DRD2	76	48
CC[C@H](C[C@H](C)O)NC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000875123343	GE	On-Demand	Anodyne	DRD1	15	41
CC[C@H](C[C@H](C)O)NC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000875123343	GE	On-Demand	Anodyne	DRD4	43	45
CC[C@H](C[C@H](C)O)NC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000875123343	GE	On-Demand	Anodyne	ADRA1D	30	52
CC[C@H](C[C@H](C)O)NC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000875123343	GE	On-Demand	Anodyne	HTR2A	69	50
CC[C@H](C[C@H](C)O)NC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000875123343	GE	On-Demand	Anodyne	HTR2C	40	48
CC[C@H](C[C@H](C)O)NC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000875123343	GE	On-Demand	Anodyne	SLC6A4	19	43
CC[C@H](C[C@H](C)O)NC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000875123343	GE	On-Demand	Anodyne	ADRA1A	45	52
CC[C@H](C[C@H](C)O)NC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000875123343	GE	On-Demand	Anodyne	ADRA1B	25	52
CC[C@H](C[C@H](C)O)NC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000875123343	GE	On-Demand	Anodyne	DRD3	100	50
CC[C@H](C[C@H](C)O)NC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000875123343	GE	On-Demand	Anodyne	HTR7	102	42
CC[C@H](C[C@H](C)O)NC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000875123343	GE	On-Demand	Anodyne	CAPN2	24	41
CNC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875123364	ED	On-Demand	Anodyne	CHRM2	19	41
CNC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875123364	ED	On-Demand	Anodyne	DRD2	30	49
CNC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875123364	ED	On-Demand	Anodyne	DRD4	65	46
CNC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875123364	ED	On-Demand	Anodyne	ACHE	74	67
CNC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875123364	ED	On-Demand	Anodyne	HRH2	30	40
CNC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875123364	ED	On-Demand	Anodyne	HRH1	15	42
CNC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875123364	ED	On-Demand	Anodyne	DRD3	22	46
CNC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875123364	ED	On-Demand	Anodyne	SLC6A3	22	52
CNC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875123364	ED	On-Demand	Anodyne	HTR4	34	43
CNC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875123364	ED	On-Demand	Anodyne	CHRM3	24	41
CNC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875123364	ED	On-Demand	Anodyne	SIGMAR1	77	50
CNC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875123364	ED	On-Demand	Anodyne	BCHE	21	52
CNC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875123364	ED	On-Demand	Anodyne	CCR3	60	45
CNC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875123364	ED	On-Demand	Anodyne	NPFFR2	38	40
CNC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875123364	ED	On-Demand	Anodyne	MCHR1	36	43
CNC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875123364	ED	On-Demand	Anodyne	CACNA1G	36	44
CNC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875123364	ED	On-Demand	Anodyne	CACNA1I	63	39
CNC(=O)CCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875123364	ED	On-Demand	Anodyne	NPFFR1	49	45
O=C(NCCCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875123395	FD	On-Demand	Anodyne	HTR1A	110	61
O=C(NCCCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875123395	FD	On-Demand	Anodyne	DRD2	87	54
O=C(NCCCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875123395	FD	On-Demand	Anodyne	DRD1	17	43
O=C(NCCCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875123395	FD	On-Demand	Anodyne	DRD4	58	48
O=C(NCCCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875123395	FD	On-Demand	Anodyne	ADRA1D	32	50
O=C(NCCCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875123395	FD	On-Demand	Anodyne	HTR2A	79	54
O=C(NCCCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875123395	FD	On-Demand	Anodyne	HTR2C	42	51
O=C(NCCCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875123395	FD	On-Demand	Anodyne	SLC6A4	21	43
O=C(NCCCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875123395	FD	On-Demand	Anodyne	ADRA1A	49	50
O=C(NCCCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875123395	FD	On-Demand	Anodyne	ADRA1B	28	50
O=C(NCCCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875123395	FD	On-Demand	Anodyne	DRD3	111	54
O=C(NCCCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875123395	FD	On-Demand	Anodyne	DRD5	17	41
O=C(NCCCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875123395	FD	On-Demand	Anodyne	HTR7	118	45
O=C(NCCCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875123395	FD	On-Demand	Anodyne	SIGMAR1	18	46
O=C(NCCCCN1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875123395	FD	On-Demand	Anodyne	CCR3	29	44
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H](CCc1ccccc1)c1ccccc1	ZINC000875123409	EG	On-Demand	Anodyne	MME	50	37
O=C(NC[C@H]1C[C@H](O)C1)N[C@H](CCc1ccccc1)c1ccccc1	ZINC000875123412	EG	On-Demand	Anodyne	MME	50	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(OC)ccc1Br	ZINC000875123421	GF	On-Demand	Anodyne	SLC6A4	26	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(OC)ccc1Br	ZINC000875123421	GF	On-Demand	Anodyne	SLC6A3	46	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(OC)ccc1Br	ZINC000875123424	GF	On-Demand	Anodyne	SLC6A4	26	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(OC)ccc1Br	ZINC000875123424	GF	On-Demand	Anodyne	SLC6A3	46	41
CCC1CCC(NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CC1	ZINC000875123428	DE	On-Demand	Anodyne	EPHX2	17	51
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875123436	FF	On-Demand	Anodyne	DRD4	16	42
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875123436	FF	On-Demand	Anodyne	KCNH2	17	43
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875123436	FF	On-Demand	Anodyne	SIGMAR1	22	59
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875123436	FF	On-Demand	Anodyne	SSTR5	62	40
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875123436	FF	On-Demand	Anodyne	CCR3	34	45
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875123436	FF	On-Demand	Anodyne	MCHR1	53	48
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(-n3ccnc3)c(F)c2)CC1	ZINC000875123446	FD	On-Demand	Anodyne	NOS2	100	37
CO[C@@H]1C[C@@H]2CN(C(=O)NCc3cccc(C)n3)Cc3cccnc3N2C1	ZINC000875123474	FE	On-Demand	Anodyne	PDE8B	40	36
CO[C@H]1C[C@H]2CN(C(=O)NCc3cccc(C)n3)Cc3cccnc3N2C1	ZINC000875123476	FE	On-Demand	Anodyne	PDE8B	40	36
Cc1nnc(NNC(=O)N[C@H](C)CCc2ccc(OC(C)C)cc2)n1C	ZINC000875123493	FF	On-Demand	Reactive	ACACB	22	45
Cc1nnc(NNC(=O)N[C@@H](C)CCc2ccc(OC(C)C)cc2)n1C	ZINC000875123503	FF	On-Demand	Reactive	ACACB	22	45
COc1ccc(N2CCN(C(=O)C(=O)NCc3cnn(C)c3)CC2)c(OC)c1	ZINC000875123529	GC	On-Demand	Clean	HTR1A	42	39
COc1ccc(N2CCN(C(=O)C(=O)NCc3cnn(C)c3)CC2)c(OC)c1	ZINC000875123529	GC	On-Demand	Clean	DRD2	38	43
COc1ccc(N2CCN(C(=O)C(=O)NCc3cnn(C)c3)CC2)c(OC)c1	ZINC000875123529	GC	On-Demand	Clean	DRD4	42	33
COc1ccc(N2CCN(C(=O)C(=O)NCc3cnn(C)c3)CC2)c(OC)c1	ZINC000875123529	GC	On-Demand	Clean	DRD3	58	38
COc1ccc(N2CCN(C(=O)C(=O)NCc3cnn(C)c3)CC2)c(OC)c1	ZINC000875123529	GC	On-Demand	Clean	PDGFRB	43	38
Cc1cccc(CNC(=O)N2Cc3cccc(O)c3C2)n1	ZINC000875123540	CE	On-Demand	Clean	PDE8B	48	42
CC[C@H](C)NC(=O)CCNC(=O)NNc1ccc(OC)cc1Br	ZINC000875123547	GE	On-Demand	Reactive	MTNR1A	56	38
CC[C@H](C)NC(=O)CCNC(=O)NNc1ccc(OC)cc1Br	ZINC000875123547	GE	On-Demand	Reactive	MTNR1B	47	38
C=CCc1ccc(OC(=O)COc2cccc(C(F)(F)F)c2)c(OC)c1	ZINC000875123553	FI	On-Demand	Mild	PDS	45	39
Cc1cccc(CNC(=O)N2CC(CNC(=O)C(F)(F)F)C2)n1	ZINC000875123592	ED	On-Demand	Anodyne	PDE8B	49	40
Cc1cccc(CNC(=O)N2Cc3cccnc3N3C[C@H](O)C[C@H]3C2)n1	ZINC000875123595	FD	On-Demand	Anodyne	PDE8B	44	37
Cc1cccc(CNC(=O)N(CC(C)C)CC2CCN(C)CC2)n1	ZINC000875123596	EF	On-Demand	Anodyne	PDE8B	41	35
Cc1cccc(CNC(=O)N2CC[C@@H](O)[C@H]2c2ccc(Br)cc2)n1	ZINC000875123598	GG	On-Demand	Anodyne	PDE8B	43	35
O=C(NCc1nc(C2CC2)no1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875123599	FF	On-Demand	Anodyne	CPT1A	80	40
O=C(NCc1nc(C2CC2)no1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875123600	FF	On-Demand	Anodyne	CPT1A	80	40
O=C(NCc1nc(C2CC2)no1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875123601	FF	On-Demand	Anodyne	CPT1A	80	40
O=C(NCc1nc(C2CC2)no1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875123602	FF	On-Demand	Anodyne	CPT1A	80	40
Cc1cccc(CNC(=O)NC[C@@H]2CC(C(F)(F)F)=NO2)n1	ZINC000875123605	DD	On-Demand	Anodyne	PDE8B	41	37
Cc1cccc(CNC(=O)NC[C@H]2CC(C(F)(F)F)=NO2)n1	ZINC000875123606	DD	On-Demand	Anodyne	PDE8B	41	37
Cc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)n1	ZINC000875123625	EF	On-Demand	Anodyne	TRY1_BOVIN	44	36
Cc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)n1	ZINC000875123625	EF	On-Demand	Anodyne	PDE8B	47	38
Cc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)n1	ZINC000875123626	EF	On-Demand	Anodyne	TRY1_BOVIN	44	36
Cc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)n1	ZINC000875123626	EF	On-Demand	Anodyne	PDE8B	47	38
Cc1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)n1	ZINC000875123627	EF	On-Demand	Anodyne	TRY1_BOVIN	44	36
Cc1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)n1	ZINC000875123627	EF	On-Demand	Anodyne	PDE8B	47	38
Cc1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)n1	ZINC000875123628	EF	On-Demand	Anodyne	TRY1_BOVIN	44	36
Cc1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)n1	ZINC000875123628	EF	On-Demand	Anodyne	PDE8B	47	38
Cc1cccc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)n1	ZINC000875123638	CE	On-Demand	Anodyne	PDE8B	48	39
Cc1cccc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)n1	ZINC000875123639	CE	On-Demand	Anodyne	PDE8B	48	39
CCC(CC)C(=O)N1CCC(NC(=O)N(C)OCC(F)(F)F)CC1	ZINC000875123641	FF	On-Demand	Anodyne	EPHX2	28	42
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1ccc(-n2ccnc2)c(F)c1	ZINC000875123653	FD	On-Demand	Mild	NOS2	84	34
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1ccc(-n2ccnc2)c(F)c1	ZINC000875123654	FD	On-Demand	Mild	NOS2	84	34
CCC1CCC(NC(=O)NC2(C)CC(F)(F)C2)CC1	ZINC000875123662	CG	On-Demand	Anodyne	EPHX2	15	46
O=C(NCc1ccc(-n2ccnc2)c(F)c1)C(=O)N[C@H]1CC12CCC2	ZINC000875123667	ED	On-Demand	Anodyne	NOS2	93	35
O=C(NCc1ccc(-n2ccnc2)c(F)c1)C(=O)N[C@@H]1CC12CCC2	ZINC000875123668	ED	On-Demand	Anodyne	NOS2	93	35
C=CCc1ccc(OC(=O)c2ccccc2OC)c(OC)c1	ZINC000875123748	CH	On-Demand	Mild	ACR	15	58
CNC(=O)CCNC(=O)NCc1ccc(O)c(Cl)c1	ZINC000875123788	CC	On-Demand	Anodyne	NCE103	19	52
O=CN1CCCN(C(=O)N[C@@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875123789	FG	On-Demand	Anodyne	DPP7	36	41
O=CN1CCCN(C(=O)N[C@@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875123789	FG	On-Demand	Anodyne	Q6PRC7_IXORI	42	37
O=CN1CCCN(C(=O)N[C@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875123792	FG	On-Demand	Anodyne	DPP7	36	41
O=CN1CCCN(C(=O)N[C@H](CCc2ccccc2)c2ccccc2)CC1	ZINC000875123792	FG	On-Demand	Anodyne	Q6PRC7_IXORI	42	37
O=C(NCc1cc2c(s1)CCCC2)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875123819	GG	On-Demand	Anodyne	ETHR	45	35
O=C(NCc1cc2c(s1)CCCC2)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875123822	GG	On-Demand	Anodyne	ETHR	45	35
O=C(NNc1ccc(OCc2ccccc2)cc1)NC1CCOCC1	ZINC000875123850	EG	On-Demand	Reactive	ALOX5	25	41
O=C(NNc1ccc(OCc2ccccc2)cc1)NC1CCOCC1	ZINC000875123850	EG	On-Demand	Reactive	MAOB	22	41
O=C(NNc1ccc(OCc2ccccc2)cc1)NC1CCOCC1	ZINC000875123850	EG	On-Demand	Reactive	LTA4H	42	48
O=C(NNc1ccc(OCc2ccccc2)cc1)NC1CCOCC1	ZINC000875123850	EG	On-Demand	Reactive	ADAM17	25	48
O=C(NNc1ccc(OCc2ccccc2)cc1)NC1CCOCC1	ZINC000875123850	EG	On-Demand	Reactive	SLC6A5	33	43
O=C(NNc1ccc(OCc2ccccc2)cc1)NC1CCOCC1	ZINC000875123850	EG	On-Demand	Reactive	EPHX2	39	46
O=C(NNc1ccc(OCc2ccccc2)cc1)NC1CCOCC1	ZINC000875123850	EG	On-Demand	Reactive	NAAA	19	46
O=C(NNc1ccc(OCc2ccccc2)cc1)NC1CCOCC1	ZINC000875123850	EG	On-Demand	Reactive	FFAR1	33	42
Cc1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)n1	ZINC000875123853	DD	On-Demand	Anodyne	PDE8B	46	37
CCC(CC)C(=O)N1CCC(NC(=O)NC[C@H]2C[C@H](O)C2)CC1	ZINC000875123859	ED	On-Demand	Anodyne	EPHX2	32	52
C=CCc1ccc(OC(=O)CCCc2c[nH]c3ccccc23)c(OC)c1	ZINC000875123868	EJ	On-Demand	Mild	TACR1	20	41
C=CCc1ccc(OC(=O)CCCc2c[nH]c3ccccc23)c(OC)c1	ZINC000875123868	EJ	On-Demand	Mild	MC3R	42	36
C=CCc1ccc(OC(=O)CCCc2c[nH]c3ccccc23)c(OC)c1	ZINC000875123868	EJ	On-Demand	Mild	MC5R	53	32
C=CCc1ccc(OC(=O)CCCc2c[nH]c3ccccc23)c(OC)c1	ZINC000875123868	EJ	On-Demand	Mild	ECE1	40	37
C=CCc1ccc(OC(=O)CCCc2c[nH]c3ccccc23)c(OC)c1	ZINC000875123868	EJ	On-Demand	Mild	MMP11	62	30
C=CCc1ccc(OC(=O)CCCc2c[nH]c3ccccc23)c(OC)c1	ZINC000875123868	EJ	On-Demand	Mild	GHSR	57	38
C=CCc1ccc(OC(=O)CCCc2c[nH]c3ccccc23)c(OC)c1	ZINC000875123868	EJ	On-Demand	Mild	MC1R	54	37
CCC(CC)C(=O)N1CCC(NC(=O)N2CCC[C@@H](CCC(=O)OC)C2)CC1	ZINC000875123903	GF	On-Demand	Anodyne	EPHX2	15	40
CCC(CC)C(=O)N1CCC(NC(=O)N2CCC[C@H](CCC(=O)OC)C2)CC1	ZINC000875123904	GF	On-Demand	Anodyne	EPHX2	15	40
CC(=O)C1CCN(C(=O)C(=O)NCC2(c3cccc(F)c3)CCCCC2)CC1	ZINC000875123930	GF	On-Demand	Anodyne	HCN1	40	31
CC(=O)C1CCN(C(=O)C(=O)NCC2(c3cccc(F)c3)CCCCC2)CC1	ZINC000875123930	GF	On-Demand	Anodyne	HCN4	40	31
CC(=O)C1CCN(C(=O)C(=O)NCC2(c3ccc(F)cc3)CCCCC2)CC1	ZINC000875123933	GF	On-Demand	Anodyne	CACNA1G	34	55
CC(=O)C1CCN(C(=O)C(=O)NCC2(c3ccc(F)cc3)CCCCC2)CC1	ZINC000875123933	GF	On-Demand	Anodyne	HCN1	40	31
CC(=O)C1CCN(C(=O)C(=O)NCC2(c3ccc(F)cc3)CCCCC2)CC1	ZINC000875123933	GF	On-Demand	Anodyne	HCN4	40	31
CCC(CC)C(=O)N1CCC(NC(=O)N2CCC[C@H](C(C)(C)O)C2)CC1	ZINC000875123936	FF	On-Demand	Anodyne	EPHX2	23	43
CCC(CC)C(=O)N1CCC(NC(=O)N2CCC[C@@H](C(C)(C)O)C2)CC1	ZINC000875123939	FF	On-Demand	Anodyne	EPHX2	23	43
Cc1cccc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)n1	ZINC000875123955	EE	On-Demand	Anodyne	FAAH	18	41
Cc1cccc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)n1	ZINC000875123955	EE	On-Demand	Anodyne	PDE8B	50	40
COC(=O)C1(O)CN(C(=O)N[C@@H](C)CCc2ccc(OC(C)C)cc2)C1	ZINC000875123960	FD	On-Demand	Anodyne	ACACB	26	47
COC(=O)C1(O)CN(C(=O)N[C@H](C)CCc2ccc(OC(C)C)cc2)C1	ZINC000875123966	FD	On-Demand	Anodyne	ACACB	26	47
C=CCc1ccc(OC(=O)c2cc[n+]([O-])cc2)c(OC)c1	ZINC000875123967	CE	On-Demand	Mild	ACR	19	63
Cc1cccc(CNC(=O)N2CCC[C@H]3[C@H]2CCN3C(=O)OC(C)(C)C)n1	ZINC000875123971	FG	On-Demand	Anodyne	PDE8B	44	35
Cc1cccc(CNC(=O)N2CCC[C@@H]3[C@H]2CCN3C(=O)OC(C)(C)C)n1	ZINC000875123973	FG	On-Demand	Anodyne	PDE8B	44	35
Cc1cccc(CNC(=O)N2CCC[C@H]3[C@@H]2CCN3C(=O)OC(C)(C)C)n1	ZINC000875123975	FG	On-Demand	Anodyne	PDE8B	44	35
Cc1cccc(CNC(=O)N2CCC[C@@H]3[C@@H]2CCN3C(=O)OC(C)(C)C)n1	ZINC000875123977	FG	On-Demand	Anodyne	PDE8B	44	35
Cc1cccc(CNC(=O)NC[C@H]2C[C@H](O)C2)n1	ZINC000875123979	BC	On-Demand	Anodyne	PDE8B	50	41
CCC(CC)C(=O)N1CCC(NC(=O)NC[C@H]2CC(C(F)(F)F)=NO2)CC1	ZINC000875123980	GE	On-Demand	Anodyne	EPHX2	28	43
CCC(CC)C(=O)N1CCC(NC(=O)NC[C@@H]2CC(C(F)(F)F)=NO2)CC1	ZINC000875123982	GE	On-Demand	Anodyne	EPHX2	28	43
CNC(=O)CCNC(=O)NCCc1c[nH]c2cc(F)c(C)cc12	ZINC000875123983	DD	On-Demand	Anodyne	MPO	72	51
CNC(=O)CCNC(=O)NCCc1c[nH]c2cc(F)c(C)cc12	ZINC000875123983	DD	On-Demand	Anodyne	MTNR1A	15	57
COC(=O)N(C)NC(=O)N[C@H](C)CCc1ccc(OC(C)C)cc1	ZINC000875123994	EF	On-Demand	Reactive	ACACA	17	47
COC(=O)N(C)NC(=O)N[C@H](C)CCc1ccc(OC(C)C)cc1	ZINC000875123994	EF	On-Demand	Reactive	ACACB	30	50
COC(=O)N(C)NC(=O)N[C@@H](C)CCc1ccc(OC(C)C)cc1	ZINC000875123995	EF	On-Demand	Reactive	ACACA	17	47
COC(=O)N(C)NC(=O)N[C@@H](C)CCc1ccc(OC(C)C)cc1	ZINC000875123995	EF	On-Demand	Reactive	ACACB	30	50
Cc1cccc(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)n1	ZINC000875123999	EE	On-Demand	Anodyne	CTSV	28	40
CNC(=O)CCNC(=O)NCC1(c2ccccc2)CCN(C)CC1	ZINC000875124000	ED	On-Demand	Anodyne	KCNA3	49	41
CNC(=O)CCNC(=O)NCC1(c2ccccc2)CCN(C)CC1	ZINC000875124000	ED	On-Demand	Anodyne	SOAT1	17	45
CNC(=O)CCNC(=O)NCC1(c2ccccc2)CCN(C)CC1	ZINC000875124000	ED	On-Demand	Anodyne	NPFFR1	35	47
Cc1cccc(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)n1	ZINC000875124001	EE	On-Demand	Anodyne	CTSV	28	40
CCC(CC)C(=O)N1CCC(NC(=O)NC(C)(C)[C@@H]2CCCCO2)CC1	ZINC000875124002	FG	On-Demand	Anodyne	EPHX2	23	48
CCC(CC)C(=O)N1CCC(NC(=O)NC(C)(C)[C@H]2CCCCO2)CC1	ZINC000875124004	FG	On-Demand	Anodyne	EPHX2	23	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(C)n1	ZINC000875124006	DD	On-Demand	Anodyne	SLC6A3	57	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(C)n1	ZINC000875124006	DD	On-Demand	Anodyne	PDE8B	48	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(C)n1	ZINC000875124008	DD	On-Demand	Anodyne	SLC6A3	57	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(C)n1	ZINC000875124008	DD	On-Demand	Anodyne	PDE8B	48	39
Cc1cccc(CNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)n1	ZINC000875124014	EF	On-Demand	Anodyne	PDE8B	44	35
Cc1cccc(CNC(=O)N2CCC[C@](O)(c3ccccc3)C2)n1	ZINC000875124015	EF	On-Demand	Anodyne	PDE8B	44	35
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)NC1CCOCC1	ZINC000875124022	EH	On-Demand	Anodyne	MDM2	62	35
C=CCc1ccc(OC(=O)c2ccc(F)c(S(=O)(=O)N3CCCCC3)c2)c(OC)c1	ZINC000875124023	IH	On-Demand	Mild	CPT1B	41	34
CCC(CC)C(=O)N1CCC(NC(=O)N[C@@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000875124027	GG	On-Demand	Anodyne	EPHX2	38	46
CCC(CC)C(=O)N1CCC(NC(=O)N[C@@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000875124027	GG	On-Demand	Anodyne	XIAP	49	36
CCC(CC)C(=O)N1CCC(NC(=O)N[C@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000875124028	GG	On-Demand	Anodyne	EPHX2	38	46
CCC(CC)C(=O)N1CCC(NC(=O)N[C@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000875124028	GG	On-Demand	Anodyne	XIAP	49	36
CCC(CC)C(=O)N1CCC(NC(=O)N[C@@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000875124029	GG	On-Demand	Anodyne	EPHX2	38	46
CCC(CC)C(=O)N1CCC(NC(=O)N[C@@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000875124029	GG	On-Demand	Anodyne	XIAP	49	36
CCC(CC)C(=O)N1CCC(NC(=O)N[C@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000875124030	GG	On-Demand	Anodyne	EPHX2	38	46
CCC(CC)C(=O)N1CCC(NC(=O)N[C@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000875124030	GG	On-Demand	Anodyne	XIAP	49	36
CCC(CC)C(=O)N1CCC(NC(=O)N2CCC3(CCN(C)CC3)CC2)CC1	ZINC000875124031	GF	On-Demand	Anodyne	EPHX2	17	42
CCC(CC)C(=O)N1CCC(NC(=O)NN=c2cc[nH]cc2C)CC1	ZINC000875124033	ED	On-Demand	Reactive	EPHX2	29	42
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NC1CCOCC1	ZINC000875124041	EF	On-Demand	Anodyne	LTA4H	16	44
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NC1CCOCC1	ZINC000875124041	EF	On-Demand	Anodyne	SIGMAR1	30	48
CCC(CC)C(=O)N1CCC(NC(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)CC1	ZINC000875124042	GH	On-Demand	Anodyne	EPHX2	34	48
CCC(CC)C(=O)N1CCC(NC(=O)NN=c2cc[nH]c(C)c2)CC1	ZINC000875124043	ED	On-Demand	Reactive	EPHX2	32	44
C=CCc1ccc(OC(=O)CCc2ccc(S(=O)(=O)N3CCCCC3)cc2)c(OC)c1	ZINC000875124044	II	On-Demand	Mild	TGM2	45	45
C=CCc1ccc(OC(=O)CCc2ccc(S(=O)(=O)N3CCCCC3)cc2)c(OC)c1	ZINC000875124044	II	On-Demand	Mild	F13A1	49	38
Cc1cccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)n1	ZINC000875124045	CD	On-Demand	Anodyne	PDE8B	50	40
Cc1cccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)n1	ZINC000875124046	CD	On-Demand	Anodyne	PDE8B	50	40
Cc1cccc(CNC(=O)N2C[C@@H]3CN(C(=O)OC(C)(C)C)C[C@]3(C)C2)n1	ZINC000875124053	FF	On-Demand	Anodyne	PDE8B	45	35
CCC(CC)C(=O)N1CCC(NC(=O)NCC[C@@H](O)C2CCCC2)CC1	ZINC000875124056	FF	On-Demand	Anodyne	EPHX2	25	55
CCC(CC)C(=O)N1CCC(NC(=O)NCC[C@H](O)C2CCCC2)CC1	ZINC000875124057	FF	On-Demand	Anodyne	EPHX2	25	55
CC(=O)C1CCN(C(=O)C(=O)NCC2(c3ccc(F)cc3)CCOCC2)CC1	ZINC000875124062	GD	On-Demand	Anodyne	CACNA1G	22	45
O=C(NCc1ccc(-n2ccnc2)c(F)c1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875124088	GD	On-Demand	Anodyne	NOS2	93	34
O=C(NCc1ccc(-n2ccnc2)c(F)c1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875124089	GD	On-Demand	Anodyne	NOS2	93	34
O=C(NCc1ccc(-n2ccnc2)c(F)c1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875124090	GD	On-Demand	Anodyne	NOS2	93	34
O=C(NCc1ccc(-n2ccnc2)c(F)c1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875124091	GD	On-Demand	Anodyne	NOS2	93	34
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3ccc(OCc4ccccn4)cc3)C[C@@H]1C2	ZINC000875124094	GF	On-Demand	Anodyne	ADAM17	17	40
Cc1ccc([C@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)cc1	ZINC000875124126	ED	On-Demand	Anodyne	EPHX2	19	42
CNC(=O)CCNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875124135	EC	On-Demand	Anodyne	CAPN2	43	32
CNC(=O)CCNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875124135	EC	On-Demand	Anodyne	EPHX2	17	47
CNC(=O)CCNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875124135	EC	On-Demand	Anodyne	NPR	40	34
CNC(=O)CCNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875124135	EC	On-Demand	Anodyne	SLC12A5	57	34
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccoc3C)CC2)c(OC)c1	ZINC000875124137	GD	On-Demand	Clean	DRD4	40	32
C=CCc1ccc(OC(=O)c2ccc(N(C)C)cc2)c(OC)c1	ZINC000875124147	DH	On-Demand	Mild	ACR	24	67
Cn1cc(CNC(=O)C(=O)N2CCC(Cc3ccccc3Cl)CC2)cn1	ZINC000875124165	FE	On-Demand	Anodyne	EPHX2	17	41
O=CN1CCCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)CC1	ZINC000875124177	GD	On-Demand	Anodyne	DRD4	26	45
O=CN1CCCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)CC1	ZINC000875124177	GD	On-Demand	Anodyne	KCNH2	16	41
O=CN1CCCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)CC1	ZINC000875124177	GD	On-Demand	Anodyne	SIGMAR1	26	61
O=CN1CCCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)CC1	ZINC000875124177	GD	On-Demand	Anodyne	SSTR5	60	38
O=CN1CCCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)CC1	ZINC000875124177	GD	On-Demand	Anodyne	CCR3	47	61
O=CN1CCCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)CC1	ZINC000875124177	GD	On-Demand	Anodyne	MLNR	37	43
O=CN1CCCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)CC1	ZINC000875124177	GD	On-Demand	Anodyne	MCHR1	52	52
CC[C@H](C)NC(=O)CCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875124182	FF	On-Demand	Anodyne	ACE	28	41
CC[C@H](C)NC(=O)CCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875124182	FF	On-Demand	Anodyne	FKBP1A	25	40
CC[C@H](C)NC(=O)CCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875124182	FF	On-Demand	Anodyne	CCR5	18	41
CC[C@H](C)NC(=O)CCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875124182	FF	On-Demand	Anodyne	XIAP	42	38
CC[C@H](C)NC(=O)CCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875124183	FF	On-Demand	Anodyne	ACE	28	41
CC[C@H](C)NC(=O)CCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875124183	FF	On-Demand	Anodyne	FKBP1A	25	40
CC[C@H](C)NC(=O)CCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875124183	FF	On-Demand	Anodyne	CCR5	18	41
CC[C@H](C)NC(=O)CCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875124183	FF	On-Demand	Anodyne	XIAP	42	38
CC[C@H](C)NC(=O)CCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875124184	FF	On-Demand	Anodyne	ACE	28	41
CC[C@H](C)NC(=O)CCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875124184	FF	On-Demand	Anodyne	FKBP1A	25	40
CC[C@H](C)NC(=O)CCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875124184	FF	On-Demand	Anodyne	CCR5	18	41
CC[C@H](C)NC(=O)CCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875124184	FF	On-Demand	Anodyne	XIAP	42	38
CC[C@H](C)NC(=O)CCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875124185	FF	On-Demand	Anodyne	ACE	28	41
CC[C@H](C)NC(=O)CCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875124185	FF	On-Demand	Anodyne	FKBP1A	25	40
CC[C@H](C)NC(=O)CCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875124185	FF	On-Demand	Anodyne	CCR5	18	41
CC[C@H](C)NC(=O)CCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875124185	FF	On-Demand	Anodyne	XIAP	42	38
CC[C@H](C)NC(=O)CCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875124205	EE	On-Demand	Anodyne	ACE	36	43
CC[C@H](C)NC(=O)CCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875124205	EE	On-Demand	Anodyne	PREP	24	41
CC[C@H](C)NC(=O)CCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875124205	EE	On-Demand	Anodyne	XIAP	48	39
CC[C@H](C)NC(=O)CCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875124206	EE	On-Demand	Anodyne	ACE	36	43
CC[C@H](C)NC(=O)CCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875124206	EE	On-Demand	Anodyne	PREP	24	41
CC[C@H](C)NC(=O)CCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875124206	EE	On-Demand	Anodyne	XIAP	48	39
CC[C@H](C)NC(=O)CCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875124207	EE	On-Demand	Anodyne	ACE	36	43
CC[C@H](C)NC(=O)CCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875124207	EE	On-Demand	Anodyne	PREP	24	41
CC[C@H](C)NC(=O)CCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875124207	EE	On-Demand	Anodyne	XIAP	48	39
CC[C@H](C)NC(=O)CCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875124208	EE	On-Demand	Anodyne	ACE	36	43
CC[C@H](C)NC(=O)CCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875124208	EE	On-Demand	Anodyne	PREP	24	41
CC[C@H](C)NC(=O)CCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875124208	EE	On-Demand	Anodyne	XIAP	48	39
CC[C@H](C)NC(=O)CCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875124211	FD	On-Demand	Anodyne	PDS	42	36
CC[C@H](C)NC(=O)CCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875124212	FD	On-Demand	Anodyne	PDS	42	36
Cn1cc(CNC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cn1	ZINC000875124229	EC	On-Demand	Anodyne	PREP	46	37
Cn1cc(CNC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cn1	ZINC000875124230	EC	On-Demand	Anodyne	PREP	46	37
Cn1cc(CNC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cn1	ZINC000875124231	EC	On-Demand	Anodyne	PREP	46	37
Cn1cc(CNC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cn1	ZINC000875124232	EC	On-Demand	Anodyne	PREP	46	37
CN1CCN(C2CCN(C(=O)NCc3cc4c(s3)CCCC4)CC2)CC1	ZINC000875124262	GF	On-Demand	Anodyne	L3MBTL3	68	40
O=CN1CCCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875124292	GD	On-Demand	Anodyne	HTR1A	103	60
O=CN1CCCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875124292	GD	On-Demand	Anodyne	DRD2	81	50
O=CN1CCCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875124292	GD	On-Demand	Anodyne	DRD1	17	41
O=CN1CCCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875124292	GD	On-Demand	Anodyne	DRD4	48	45
O=CN1CCCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875124292	GD	On-Demand	Anodyne	ADRA1D	36	49
O=CN1CCCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875124292	GD	On-Demand	Anodyne	HTR2A	71	53
O=CN1CCCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875124292	GD	On-Demand	Anodyne	HTR2C	36	50
O=CN1CCCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875124292	GD	On-Demand	Anodyne	SLC6A4	17	42
O=CN1CCCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875124292	GD	On-Demand	Anodyne	ADRA1A	52	49
O=CN1CCCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875124292	GD	On-Demand	Anodyne	ADRA1B	33	49
O=CN1CCCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875124292	GD	On-Demand	Anodyne	DRD3	102	53
O=CN1CCCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875124292	GD	On-Demand	Anodyne	DRD5	18	43
O=CN1CCCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875124292	GD	On-Demand	Anodyne	HTR7	114	45
O=CN1CCCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)CC1	ZINC000875124292	GD	On-Demand	Anodyne	SIGMAR1	16	45
O=C(NCC[C@H]1CCSC1)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875124301	FE	On-Demand	Anodyne	SIRT3	40	31
O=C(NCC[C@H]1CCSC1)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875124301	FE	On-Demand	Anodyne	SIRT2	44	32
O=C(NCC[C@H]1CCSC1)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875124301	FE	On-Demand	Anodyne	SIRT1	40	32
O=C(NCC[C@@H]1CCSC1)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875124302	FE	On-Demand	Anodyne	SIRT3	40	31
O=C(NCC[C@@H]1CCSC1)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875124302	FE	On-Demand	Anodyne	SIRT2	44	32
O=C(NCC[C@@H]1CCSC1)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875124302	FE	On-Demand	Anodyne	SIRT1	40	32
CNC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875124306	DE	On-Demand	Anodyne	HRH2	20	40
CNC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875124306	DE	On-Demand	Anodyne	SCNN1A	43	40
CNC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875124306	DE	On-Demand	Anodyne	MME	28	42
CNC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875124306	DE	On-Demand	Anodyne	SIGMAR1	17	49
CNC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875124306	DE	On-Demand	Anodyne	SCN2A	23	43
CNC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875124306	DE	On-Demand	Anodyne	HDAC8	18	48
CNC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875124306	DE	On-Demand	Anodyne	HDAC10	15	44
CNC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875124306	DE	On-Demand	Anodyne	S1PR3	19	48
CNC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875124306	DE	On-Demand	Anodyne	MTNR1A	39	44
CNC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875124306	DE	On-Demand	Anodyne	MTNR1B	39	44
CNC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875124306	DE	On-Demand	Anodyne	MMP3	34	43
CNC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875124306	DE	On-Demand	Anodyne	MMP8	17	48
CNC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875124306	DE	On-Demand	Anodyne	GRIA1	43	47
CNC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875124306	DE	On-Demand	Anodyne	HDAC1	18	48
CNC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875124306	DE	On-Demand	Anodyne	FAAH	81	46
CNC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875124306	DE	On-Demand	Anodyne	S1PR2	32	48
CNC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875124306	DE	On-Demand	Anodyne	SLC6A5	22	41
CNC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875124306	DE	On-Demand	Anodyne	CES1	75	44
CNC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875124306	DE	On-Demand	Anodyne	EPHX2	19	45
CNC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875124306	DE	On-Demand	Anodyne	HDAC11	15	44
CNC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875124306	DE	On-Demand	Anodyne	AMP1_PLAFQ	28	50
CNC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875124306	DE	On-Demand	Anodyne	NAAA	28	43
CNC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875124306	DE	On-Demand	Anodyne	CRTM	43	41
CNC(=O)CCNC(=O)NCCCCCCc1ccccc1	ZINC000875124306	DE	On-Demand	Anodyne	CES1D	54	33
Cc1nnc(NNC(=O)NCCCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875124311	GD	On-Demand	Reactive	HTR1A	113	58
Cc1nnc(NNC(=O)NCCCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875124311	GD	On-Demand	Reactive	DRD2	88	47
Cc1nnc(NNC(=O)NCCCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875124311	GD	On-Demand	Reactive	DRD1	16	42
Cc1nnc(NNC(=O)NCCCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875124311	GD	On-Demand	Reactive	DRD4	53	43
Cc1nnc(NNC(=O)NCCCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875124311	GD	On-Demand	Reactive	ADRA1D	51	51
Cc1nnc(NNC(=O)NCCCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875124311	GD	On-Demand	Reactive	HTR2A	79	52
Cc1nnc(NNC(=O)NCCCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875124311	GD	On-Demand	Reactive	HTR2C	44	52
Cc1nnc(NNC(=O)NCCCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875124311	GD	On-Demand	Reactive	SLC6A4	21	46
Cc1nnc(NNC(=O)NCCCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875124311	GD	On-Demand	Reactive	ADRA1A	71	51
Cc1nnc(NNC(=O)NCCCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875124311	GD	On-Demand	Reactive	ADRA1B	45	51
Cc1nnc(NNC(=O)NCCCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875124311	GD	On-Demand	Reactive	DRD3	112	52
Cc1nnc(NNC(=O)NCCCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875124311	GD	On-Demand	Reactive	HTR7	120	44
Cc1nnc(NNC(=O)NCCCCN2CCN(c3ccccc3)CC2)n1C	ZINC000875124311	GD	On-Demand	Reactive	NPY1R	17	46
O=C1OC[C@H]2CN(C(=O)N[C@@H](CCc3ccccc3)c3ccccc3)C[C@@H]12	ZINC000875124330	FG	On-Demand	Anodyne	NAAA	41	40
O=C1OC[C@H]2CN(C(=O)N[C@H](CCc3ccccc3)c3ccccc3)C[C@@H]12	ZINC000875124331	FG	On-Demand	Anodyne	NAAA	41	40
O=C(N[C@@H](CCc1ccccc1)c1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875124337	GG	On-Demand	Anodyne	GHRHR	61	40
O=C(N[C@H](CCc1ccccc1)c1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875124338	GG	On-Demand	Anodyne	GHRHR	61	40
CCCCCCCNC(=O)C(=O)NCc1cnn(C)c1	ZINC000875124391	CD	On-Demand	Mild	ASAH1	100	39
Cn1cc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)cn1	ZINC000875124413	GD	On-Demand	Anodyne	DRD2	32	46
Cn1cc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)cn1	ZINC000875124413	GD	On-Demand	Anodyne	DRD4	54	45
Cn1cc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)cn1	ZINC000875124413	GD	On-Demand	Anodyne	ACHE	67	59
Cn1cc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)cn1	ZINC000875124413	GD	On-Demand	Anodyne	HRH1	19	41
Cn1cc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)cn1	ZINC000875124413	GD	On-Demand	Anodyne	DRD3	29	45
Cn1cc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)cn1	ZINC000875124413	GD	On-Demand	Anodyne	SLC6A3	18	47
Cn1cc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)cn1	ZINC000875124413	GD	On-Demand	Anodyne	HTR4	39	44
Cn1cc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)cn1	ZINC000875124413	GD	On-Demand	Anodyne	SIGMAR1	61	44
Cn1cc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)cn1	ZINC000875124413	GD	On-Demand	Anodyne	BCHE	20	48
Cn1cc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)cn1	ZINC000875124413	GD	On-Demand	Anodyne	CCR3	51	42
Cn1cc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)cn1	ZINC000875124413	GD	On-Demand	Anodyne	MCHR1	36	40
Cn1cc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)cn1	ZINC000875124413	GD	On-Demand	Anodyne	CACNA1G	33	41
Cn1cc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)cn1	ZINC000875124413	GD	On-Demand	Anodyne	PANC	48	38
Cn1cc(CNC(=O)C(=O)NCc2ccc(OC(F)F)cc2F)cn1	ZINC000875124426	FD	On-Demand	Anodyne	P2RX7	44	37
C[C@H](NC(=O)C(=O)NCC1(c2ccc(Cl)cc2)CCCC1)c1ccnn1C	ZINC000875124427	GF	On-Demand	Anodyne	CCR1	44	33
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OC)cc1OC	ZINC000875124431	DE	On-Demand	Anodyne	MTNR1A	49	36
O=C(NCc1nc(C2CC2)no1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875124434	EE	On-Demand	Anodyne	CPT1A	42	36
O=C(NCc1nc(C2CC2)no1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875124435	EE	On-Demand	Anodyne	CPT1A	42	36
O=C(NCc1nc(C2CC2)no1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875124436	EE	On-Demand	Anodyne	CPT1A	42	36
O=C(NCc1nc(C2CC2)no1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875124437	EE	On-Demand	Anodyne	CPT1A	42	36
C[C@@H](NC(=O)N1CCC(C)(F)CC1)c1cccc(NS(C)(=O)=O)c1	ZINC000875124438	FF	On-Demand	Anodyne	CACNA1H	34	41
Cn1cc(CNC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)cn1	ZINC000875124448	FD	On-Demand	Anodyne	NAMPT	50	44
Cn1cc(CNC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)cn1	ZINC000875124449	FD	On-Demand	Anodyne	NAMPT	50	44
COC(=O)N(C)NC(=O)NCc1cc(OC)ccc1Br	ZINC000875124461	ED	On-Demand	Reactive	MTNR1A	73	39
COC(=O)N(C)NC(=O)NCc1cc(OC)ccc1Br	ZINC000875124461	ED	On-Demand	Reactive	MTNR1B	57	38
O=C(NCCOC1CCCC1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875124470	EF	On-Demand	Anodyne	ADRB1	34	56
O=C(NCCOC1CCCC1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875124471	EF	On-Demand	Anodyne	ADRB1	34	56
C=CCc1ccc(OC(=O)/C=C/c2ccc(OC)c(OC)c2)c(OC)c1	ZINC000875124478	FI	On-Demand	Mild	CYP1A1	15	43
C=CCc1ccc(OC(=O)/C=C/c2ccc(OC)c(OC)c2)c(OC)c1	ZINC000875124478	FI	On-Demand	Mild	ABCG2	16	48
C=CCc1ccc(OC(=O)/C=C\c2ccc(OC)c(OC)c2)c(OC)c1	ZINC000875124479	FI	On-Demand	Mild	CYP1A1	15	43
C=CCc1ccc(OC(=O)/C=C\c2ccc(OC)c(OC)c2)c(OC)c1	ZINC000875124479	FI	On-Demand	Mild	ABCG2	16	48
N#Cc1ccc(Cn2cc(NC(=O)NCCOC3CCCC3)cn2)cc1	ZINC000875124496	FF	On-Demand	Mild	CCR3	15	42
N#Cc1ccc(Cn2cc(NC(=O)NCCOC3CCCC3)cn2)cc1	ZINC000875124496	FF	On-Demand	Mild	ITK	21	51
N#Cc1ccc(Cn2cc(NC(=O)NCCOC3CCCC3)cn2)cc1	ZINC000875124496	FF	On-Demand	Mild	PANC	55	37
C=CCc1ccc(OC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c(OC)c1	ZINC000875124498	HH	On-Demand	Mild	TGM2	38	42
C=CCc1ccc(OC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c(OC)c1	ZINC000875124498	HH	On-Demand	Mild	F13A1	40	36
C=CCc1ccc(OC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c(OC)c1	ZINC000875124498	HH	On-Demand	Mild	AKR1C3	61	45
COC(=O)N(C)NC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000875124512	FD	On-Demand	Reactive	HTR1A	142	63
COC(=O)N(C)NC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000875124512	FD	On-Demand	Reactive	ADRA2A	15	45
COC(=O)N(C)NC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000875124512	FD	On-Demand	Reactive	DRD2	101	50
COC(=O)N(C)NC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000875124512	FD	On-Demand	Reactive	DRD1	20	45
COC(=O)N(C)NC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000875124512	FD	On-Demand	Reactive	DRD4	69	48
COC(=O)N(C)NC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000875124512	FD	On-Demand	Reactive	ADRA1D	64	52
COC(=O)N(C)NC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000875124512	FD	On-Demand	Reactive	HTR2A	88	53
COC(=O)N(C)NC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000875124512	FD	On-Demand	Reactive	HTR2C	47	53
COC(=O)N(C)NC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000875124512	FD	On-Demand	Reactive	SLC6A4	23	44
COC(=O)N(C)NC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000875124512	FD	On-Demand	Reactive	ADRA1A	87	52
COC(=O)N(C)NC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000875124512	FD	On-Demand	Reactive	ADRA1B	55	52
COC(=O)N(C)NC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000875124512	FD	On-Demand	Reactive	DRD3	133	53
COC(=O)N(C)NC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000875124512	FD	On-Demand	Reactive	HTR4	16	42
COC(=O)N(C)NC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000875124512	FD	On-Demand	Reactive	DRD5	19	45
COC(=O)N(C)NC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000875124512	FD	On-Demand	Reactive	HTR7	146	49
COC(=O)N(C)NC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000875124512	FD	On-Demand	Reactive	SIGMAR1	22	45
COC(=O)N(C)NC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000875124512	FD	On-Demand	Reactive	NPY1R	15	43
COC(=O)N(C)NC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000875124512	FD	On-Demand	Reactive	CCR3	25	42
CONC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)C2CCCC2)CC1	ZINC000875124521	FG	On-Demand	Anodyne	AMY2	47	33
CONC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)C2CCCC2)CC1	ZINC000875124521	FG	On-Demand	Anodyne	EPHX2	22	45
CONC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)C2CCCC2)CC1	ZINC000875124522	FG	On-Demand	Anodyne	AMY2	47	33
CONC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)C2CCCC2)CC1	ZINC000875124522	FG	On-Demand	Anodyne	EPHX2	22	45
CC[C@@H](NC(=O)NCCOC1CCCC1)[C@H](O)c1ccccc1	ZINC000875124540	DF	On-Demand	Anodyne	ADRB1	15	43
CC[C@@H](NC(=O)NCCOC1CCCC1)[C@@H](O)c1ccccc1	ZINC000875124542	DF	On-Demand	Anodyne	ADRB1	15	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1c(OC)cc(OC)cc1OC	ZINC000875124543	GD	On-Demand	Anodyne	SLC6A3	42	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1c(OC)cc(OC)cc1OC	ZINC000875124544	GD	On-Demand	Anodyne	SLC6A3	42	39
O=C(NC1CCN(c2ccccc2)CC1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875124546	GF	On-Demand	Anodyne	EPHX2	22	44
O=C(NC1CCN(c2ccccc2)CC1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875124547	GF	On-Demand	Anodyne	EPHX2	22	44
CNC(=O)CCNC(=O)NCc1cc(Cl)cc(Cl)c1F	ZINC000875124550	DE	On-Demand	Anodyne	P2RX7	46	38
CC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)C2CCCC2)CC1	ZINC000875124551	EH	On-Demand	Anodyne	EPHX2	21	43
CC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)C2CCCC2)CC1	ZINC000875124551	EH	On-Demand	Anodyne	L3MBTL3	42	33
CC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)C2CCCC2)CC1	ZINC000875124552	EH	On-Demand	Anodyne	EPHX2	21	43
CC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)C2CCCC2)CC1	ZINC000875124552	EH	On-Demand	Anodyne	L3MBTL3	42	33
C=CCc1ccc(OC(=O)CCOc2ccc(OC)cc2)c(OC)c1	ZINC000875124606	EH	On-Demand	Mild	LTB4R	22	40
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1cnn(C)c1)CC2	ZINC000875124612	FD	On-Demand	Anodyne	SLC18A2	46	34
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1cnn(C)c1)CC2	ZINC000875124612	FD	On-Demand	Anodyne	HCRTR1	15	43
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1cnn(C)c1)CC2	ZINC000875124613	FD	On-Demand	Anodyne	SLC18A2	46	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1cnn(C)c1)CC2	ZINC000875124613	FD	On-Demand	Anodyne	HCRTR1	15	43
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(OC)cc1OC	ZINC000875124635	GE	On-Demand	Anodyne	ACKR3	62	32
C=CCc1ccc(OC(=O)/C=C\c2ccc(OC)cc2)c(OC)c1	ZINC000875124663	DI	On-Demand	Mild	ABCG2	17	46
C=CCc1ccc(OC(=O)/C=C/c2ccc(OC)cc2)c(OC)c1	ZINC000875124664	DI	On-Demand	Mild	ABCG2	17	46
O=C(NCCCCC1CC1)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875124669	EE	On-Demand	Anodyne	HTR1A	28	51
O=C(NCCCCC1CC1)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875124669	EE	On-Demand	Anodyne	DRD2	30	55
O=C(NCCCCC1CC1)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875124669	EE	On-Demand	Anodyne	HTR2A	24	44
O=C(NCCCCC1CC1)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875124669	EE	On-Demand	Anodyne	DRD3	45	55
C=CCc1ccc(OC(=O)CCc2ccccc2)c(OC)c1	ZINC000875124671	CH	On-Demand	Mild	MTNR1B	15	41
C=CCc1ccc(OC(=O)CCc2ccccc2)c(OC)c1	ZINC000875124671	CH	On-Demand	Mild	ABCB1	27	41
C=CCc1ccc(OC(=O)CCc2ccccc2)c(OC)c1	ZINC000875124671	CH	On-Demand	Mild	FFAR1	41	40
C=CCc1ccc(OC(=O)CCc2ccccc2)c(OC)c1	ZINC000875124671	CH	On-Demand	Mild	AKR1C3	27	49
O=C(N[C@@H](c1ccccc1)C1CCCC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875124705	GH	On-Demand	Anodyne	SMO	42	44
O=C(N[C@@H](c1ccccc1)C1CCCC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875124705	GH	On-Demand	Anodyne	ETHR	59	37
O=C(N[C@@H](c1ccccc1)C1CCCC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875124706	GH	On-Demand	Anodyne	SMO	42	44
O=C(N[C@@H](c1ccccc1)C1CCCC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875124706	GH	On-Demand	Anodyne	ETHR	59	37
O=C(N[C@H](c1ccccc1)C1CCCC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875124707	GH	On-Demand	Anodyne	SMO	42	44
O=C(N[C@H](c1ccccc1)C1CCCC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875124707	GH	On-Demand	Anodyne	ETHR	59	37
O=C(N[C@H](c1ccccc1)C1CCCC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875124708	GH	On-Demand	Anodyne	SMO	42	44
O=C(N[C@H](c1ccccc1)C1CCCC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875124708	GH	On-Demand	Anodyne	ETHR	59	37
COC(=O)N(C)NC(=O)N[C@@H](c1ccccc1)C1CCCC1	ZINC000875124722	DF	On-Demand	Reactive	AMY2	44	30
COC(=O)N(C)NC(=O)N[C@H](c1ccccc1)C1CCCC1	ZINC000875124723	DF	On-Demand	Reactive	AMY2	44	30
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)N1Cc2cccc(O)c2C1	ZINC000875124758	GG	On-Demand	Clean	DRD4	33	50
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)N1Cc2cccc(O)c2C1	ZINC000875124758	GG	On-Demand	Clean	KCNH2	16	40
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)N1Cc2cccc(O)c2C1	ZINC000875124758	GG	On-Demand	Clean	SIGMAR1	26	59
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)N1Cc2cccc(O)c2C1	ZINC000875124758	GG	On-Demand	Clean	SSTR5	54	38
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)N1Cc2cccc(O)c2C1	ZINC000875124758	GG	On-Demand	Clean	CCR3	54	50
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)N1Cc2cccc(O)c2C1	ZINC000875124758	GG	On-Demand	Clean	CCR2	20	41
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)N1Cc2cccc(O)c2C1	ZINC000875124758	GG	On-Demand	Clean	MCHR1	53	56
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875124763	FD	On-Demand	Anodyne	DRD4	23	44
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875124763	FD	On-Demand	Anodyne	KCNH2	19	44
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875124763	FD	On-Demand	Anodyne	SIGMAR1	27	60
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875124763	FD	On-Demand	Anodyne	SSTR5	58	38
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875124763	FD	On-Demand	Anodyne	CCR3	69	46
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875124763	FD	On-Demand	Anodyne	EPHX2	18	41
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875124763	FD	On-Demand	Anodyne	CXCR3	42	41
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875124763	FD	On-Demand	Anodyne	MCHR1	57	52
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000875124763	FD	On-Demand	Anodyne	CACNA1I	58	41
O=C(NCc1nc(C2CC2)no1)N1CCCC(F)(F)CC1	ZINC000875124764	DE	On-Demand	Anodyne	SMO	21	40
CC(=O)C1CCN(C(=O)C(=O)NCC2(c3ccc(Cl)cc3)CCCC2)CC1	ZINC000875124768	GG	On-Demand	Anodyne	CCR1	54	36
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)N1CCC(CO)(CO)CC1	ZINC000875124803	GD	On-Demand	Anodyne	CHRM1	15	45
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)N1CCC(CO)(CO)CC1	ZINC000875124803	GD	On-Demand	Anodyne	DRD4	26	46
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)N1CCC(CO)(CO)CC1	ZINC000875124803	GD	On-Demand	Anodyne	KCNH2	19	42
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)N1CCC(CO)(CO)CC1	ZINC000875124803	GD	On-Demand	Anodyne	CHRM3	20	45
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)N1CCC(CO)(CO)CC1	ZINC000875124803	GD	On-Demand	Anodyne	SIGMAR1	27	63
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)N1CCC(CO)(CO)CC1	ZINC000875124803	GD	On-Demand	Anodyne	SSTR5	48	38
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)N1CCC(CO)(CO)CC1	ZINC000875124803	GD	On-Demand	Anodyne	CCR3	46	56
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)N1CCC(CO)(CO)CC1	ZINC000875124803	GD	On-Demand	Anodyne	MLNR	35	40
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)N1CCC(CO)(CO)CC1	ZINC000875124803	GD	On-Demand	Anodyne	MCHR1	56	52
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)N1CCC(CO)(CO)CC1	ZINC000875124803	GD	On-Demand	Anodyne	MCHR2	46	34
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)N1CCC(CO)(CO)CC1	ZINC000875124803	GD	On-Demand	Anodyne	CACNA1G	23	42
COC(=O)N(C)NC(=O)NCc1ccc(OC)cc1OC	ZINC000875124816	CD	On-Demand	Reactive	MTNR1A	79	40
COC(=O)N(C)NC(=O)NCc1ccc(OC)cc1OC	ZINC000875124816	CD	On-Demand	Reactive	MTNR1B	63	40
COC(=O)N(C)NC(=O)NCc1ccc(OC)cc1OC	ZINC000875124816	CD	On-Demand	Reactive	MT-ND1	19	43
COC(=O)N(C)NC(=O)NCC(=O)N(C)Cc1ccccc1	ZINC000875124817	DC	On-Demand	Reactive	TSPO	15	42
COC(=O)N(C)NC(=O)NCC(=O)N(C)Cc1ccccc1	ZINC000875124817	DC	On-Demand	Reactive	CTSB	19	43
COC(=O)N(C)NC(=O)NCC(=O)N(C)Cc1ccccc1	ZINC000875124817	DC	On-Demand	Reactive	HSD17B2	21	41
COC(=O)N(C)NC(=O)NCC(=O)N(C)Cc1ccccc1	ZINC000875124817	DC	On-Demand	Reactive	LIMK2	24	41
COC(=O)C1(O)CN(C(=O)NCc2ccc(OC)cc2OC)C1	ZINC000875124822	DC	On-Demand	Anodyne	MTNR1A	52	37
COC(=O)C1(O)CN(C(=O)NCc2ccc(OC)cc2OC)C1	ZINC000875124822	DC	On-Demand	Anodyne	MTNR1B	41	37
C=CCc1ccc(OC(=O)c2ccc(OC)c(S(=O)(=O)N3CCOCC3)c2)c(OC)c1	ZINC000875124825	IF	On-Demand	Mild	CPT1A	44	36
C=CCc1ccc(OC(=O)c2ccc(OC)c(S(=O)(=O)N3CCOCC3)c2)c(OC)c1	ZINC000875124825	IF	On-Demand	Mild	CPT1B	41	34
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H](C)COc2ccccc2)cc1	ZINC000875124875	FF	On-Demand	Anodyne	ANPEP	17	41
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H](C)COc2ccccc2)cc1	ZINC000875124875	FF	On-Demand	Anodyne	PDS	79	45
CC(=O)N(C)c1ccc(CNC(=O)N[C@H](C)COc2ccccc2)cc1	ZINC000875124876	FF	On-Demand	Anodyne	ANPEP	17	41
CC(=O)N(C)c1ccc(CNC(=O)N[C@H](C)COc2ccccc2)cc1	ZINC000875124876	FF	On-Demand	Anodyne	PDS	79	45
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)COc2ccccc2)C1	ZINC000875124889	DE	On-Demand	Anodyne	SLC6A1	62	34
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)COc2ccccc2)C1	ZINC000875124889	DE	On-Demand	Anodyne	CPT1A	83	36
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)COc2ccccc2)C1	ZINC000875124889	DE	On-Demand	Anodyne	CPT2	44	34
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)COc2ccccc2)C1	ZINC000875124889	DE	On-Demand	Anodyne	REN	17	42
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)COc2ccccc2)C1	ZINC000875124889	DE	On-Demand	Anodyne	DPP7	60	41
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)COc2ccccc2)C1	ZINC000875124889	DE	On-Demand	Anodyne	BIRC2	43	39
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)COc2ccccc2)C1	ZINC000875124889	DE	On-Demand	Anodyne	Q9N6S8_PLAFA	20	42
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)COc2ccccc2)C1	ZINC000875124890	DE	On-Demand	Anodyne	SLC6A1	62	34
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)COc2ccccc2)C1	ZINC000875124890	DE	On-Demand	Anodyne	CPT1A	83	36
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)COc2ccccc2)C1	ZINC000875124890	DE	On-Demand	Anodyne	CPT2	44	34
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)COc2ccccc2)C1	ZINC000875124890	DE	On-Demand	Anodyne	REN	17	42
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)COc2ccccc2)C1	ZINC000875124890	DE	On-Demand	Anodyne	DPP7	60	41
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)COc2ccccc2)C1	ZINC000875124890	DE	On-Demand	Anodyne	BIRC2	43	39
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)COc2ccccc2)C1	ZINC000875124890	DE	On-Demand	Anodyne	Q9N6S8_PLAFA	20	42
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)COc2ccccc2)C1	ZINC000875124891	DE	On-Demand	Anodyne	SLC6A1	62	34
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)COc2ccccc2)C1	ZINC000875124891	DE	On-Demand	Anodyne	CPT1A	83	36
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)COc2ccccc2)C1	ZINC000875124891	DE	On-Demand	Anodyne	CPT2	44	34
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)COc2ccccc2)C1	ZINC000875124891	DE	On-Demand	Anodyne	REN	17	42
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)COc2ccccc2)C1	ZINC000875124891	DE	On-Demand	Anodyne	DPP7	60	41
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)COc2ccccc2)C1	ZINC000875124891	DE	On-Demand	Anodyne	BIRC2	43	39
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)COc2ccccc2)C1	ZINC000875124891	DE	On-Demand	Anodyne	Q9N6S8_PLAFA	20	42
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)COc2ccccc2)C1	ZINC000875124892	DE	On-Demand	Anodyne	SLC6A1	62	34
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)COc2ccccc2)C1	ZINC000875124892	DE	On-Demand	Anodyne	CPT1A	83	36
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)COc2ccccc2)C1	ZINC000875124892	DE	On-Demand	Anodyne	CPT2	44	34
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)COc2ccccc2)C1	ZINC000875124892	DE	On-Demand	Anodyne	REN	17	42
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)COc2ccccc2)C1	ZINC000875124892	DE	On-Demand	Anodyne	DPP7	60	41
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)COc2ccccc2)C1	ZINC000875124892	DE	On-Demand	Anodyne	BIRC2	43	39
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)COc2ccccc2)C1	ZINC000875124892	DE	On-Demand	Anodyne	Q9N6S8_PLAFA	20	42
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)COc1ccccc1	ZINC000875124898	CE	On-Demand	Anodyne	ADRB1	15	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)COc1ccccc1	ZINC000875124898	CE	On-Demand	Anodyne	MME	22	44
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)COc1ccccc1	ZINC000875124898	CE	On-Demand	Anodyne	ACE2	41	35
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)COc1ccccc1	ZINC000875124898	CE	On-Demand	Anodyne	PDS	77	42
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)COc1ccccc1	ZINC000875124899	CE	On-Demand	Anodyne	ADRB1	15	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)COc1ccccc1	ZINC000875124899	CE	On-Demand	Anodyne	MME	22	44
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)COc1ccccc1	ZINC000875124899	CE	On-Demand	Anodyne	ACE2	41	35
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)COc1ccccc1	ZINC000875124899	CE	On-Demand	Anodyne	PDS	77	42
CC(=O)NC[C@@H]1CCCCN1C(=O)N[C@@H](C)COc1ccccc1	ZINC000875124924	EE	On-Demand	Anodyne	HCRTR1	23	45
CC(=O)NC[C@@H]1CCCCN1C(=O)N[C@@H](C)COc1ccccc1	ZINC000875124924	EE	On-Demand	Anodyne	CPT1A	121	42
CC(=O)NC[C@@H]1CCCCN1C(=O)N[C@@H](C)COc1ccccc1	ZINC000875124924	EE	On-Demand	Anodyne	CPT2	47	37
CC(=O)NC[C@@H]1CCCCN1C(=O)N[C@@H](C)COc1ccccc1	ZINC000875124924	EE	On-Demand	Anodyne	MTNR1B	18	41
CC(=O)NC[C@@H]1CCCCN1C(=O)N[C@H](C)COc1ccccc1	ZINC000875124925	EE	On-Demand	Anodyne	HCRTR1	23	45
CC(=O)NC[C@@H]1CCCCN1C(=O)N[C@H](C)COc1ccccc1	ZINC000875124925	EE	On-Demand	Anodyne	CPT1A	121	42
CC(=O)NC[C@@H]1CCCCN1C(=O)N[C@H](C)COc1ccccc1	ZINC000875124925	EE	On-Demand	Anodyne	CPT2	47	37
CC(=O)NC[C@@H]1CCCCN1C(=O)N[C@H](C)COc1ccccc1	ZINC000875124925	EE	On-Demand	Anodyne	MTNR1B	18	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)COc1ccccc1	ZINC000875124952	EE	On-Demand	Anodyne	SLC6A4	28	51
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)COc1ccccc1	ZINC000875124952	EE	On-Demand	Anodyne	SLC6A3	62	51
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)COc1ccccc1	ZINC000875124952	EE	On-Demand	Anodyne	LTA4H	15	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)COc1ccccc1	ZINC000875124953	EE	On-Demand	Anodyne	SLC6A4	28	51
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)COc1ccccc1	ZINC000875124953	EE	On-Demand	Anodyne	SLC6A3	62	51
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)COc1ccccc1	ZINC000875124953	EE	On-Demand	Anodyne	LTA4H	15	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)COc1ccccc1	ZINC000875124954	EE	On-Demand	Anodyne	SLC6A4	28	51
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)COc1ccccc1	ZINC000875124954	EE	On-Demand	Anodyne	SLC6A3	62	51
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)COc1ccccc1	ZINC000875124954	EE	On-Demand	Anodyne	LTA4H	15	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)COc1ccccc1	ZINC000875124955	EE	On-Demand	Anodyne	SLC6A4	28	51
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)COc1ccccc1	ZINC000875124955	EE	On-Demand	Anodyne	SLC6A3	62	51
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)COc1ccccc1	ZINC000875124955	EE	On-Demand	Anodyne	LTA4H	15	42
Cc1cncc([C@@H]2CCCN2C(=O)N[C@H](C)COc2ccccc2)c1	ZINC000875124965	EH	On-Demand	Anodyne	CPT1A	125	40
Cc1cncc([C@@H]2CCCN2C(=O)N[C@H](C)COc2ccccc2)c1	ZINC000875124965	EH	On-Demand	Anodyne	CPT2	45	37
Cc1cncc([C@@H]2CCCN2C(=O)N[C@H](C)COc2ccccc2)c1	ZINC000875124965	EH	On-Demand	Anodyne	PREP	46	37
Cc1cncc([C@@H]2CCCN2C(=O)N[C@H](C)COc2ccccc2)c1	ZINC000875124965	EH	On-Demand	Anodyne	CHRNA10	40	37
Cc1cncc([C@@H]2CCCN2C(=O)N[C@H](C)COc2ccccc2)c1	ZINC000875124965	EH	On-Demand	Anodyne	BRCA1	59	31
Cc1cncc([C@@H]2CCCN2C(=O)N[C@@H](C)COc2ccccc2)c1	ZINC000875124966	EH	On-Demand	Anodyne	CPT1A	125	40
Cc1cncc([C@@H]2CCCN2C(=O)N[C@@H](C)COc2ccccc2)c1	ZINC000875124966	EH	On-Demand	Anodyne	CPT2	45	37
Cc1cncc([C@@H]2CCCN2C(=O)N[C@@H](C)COc2ccccc2)c1	ZINC000875124966	EH	On-Demand	Anodyne	PREP	46	37
Cc1cncc([C@@H]2CCCN2C(=O)N[C@@H](C)COc2ccccc2)c1	ZINC000875124966	EH	On-Demand	Anodyne	CHRNA10	40	37
Cc1cncc([C@@H]2CCCN2C(=O)N[C@@H](C)COc2ccccc2)c1	ZINC000875124966	EH	On-Demand	Anodyne	BRCA1	59	31
Cc1cncc([C@H]2CCCN2C(=O)N[C@@H](C)COc2ccccc2)c1	ZINC000875124967	EH	On-Demand	Anodyne	CPT1A	125	40
Cc1cncc([C@H]2CCCN2C(=O)N[C@@H](C)COc2ccccc2)c1	ZINC000875124967	EH	On-Demand	Anodyne	CPT2	45	37
Cc1cncc([C@H]2CCCN2C(=O)N[C@@H](C)COc2ccccc2)c1	ZINC000875124967	EH	On-Demand	Anodyne	PREP	46	37
Cc1cncc([C@H]2CCCN2C(=O)N[C@@H](C)COc2ccccc2)c1	ZINC000875124967	EH	On-Demand	Anodyne	CHRNA10	40	37
Cc1cncc([C@H]2CCCN2C(=O)N[C@@H](C)COc2ccccc2)c1	ZINC000875124967	EH	On-Demand	Anodyne	BRCA1	59	31
Cc1cncc([C@H]2CCCN2C(=O)N[C@H](C)COc2ccccc2)c1	ZINC000875124968	EH	On-Demand	Anodyne	CPT1A	125	40
Cc1cncc([C@H]2CCCN2C(=O)N[C@H](C)COc2ccccc2)c1	ZINC000875124968	EH	On-Demand	Anodyne	CPT2	45	37
Cc1cncc([C@H]2CCCN2C(=O)N[C@H](C)COc2ccccc2)c1	ZINC000875124968	EH	On-Demand	Anodyne	PREP	46	37
Cc1cncc([C@H]2CCCN2C(=O)N[C@H](C)COc2ccccc2)c1	ZINC000875124968	EH	On-Demand	Anodyne	CHRNA10	40	37
Cc1cncc([C@H]2CCCN2C(=O)N[C@H](C)COc2ccccc2)c1	ZINC000875124968	EH	On-Demand	Anodyne	BRCA1	59	31
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H](C)COc1ccccc1	ZINC000875125004	FE	On-Demand	Anodyne	CPT1A	43	34
COCCN(CC1CCN(C)CC1)C(=O)N[C@H](C)COc1ccccc1	ZINC000875125005	FE	On-Demand	Anodyne	CPT1A	43	34
CCC1(N2CCOCC2)CCN(C(=O)N[C@H](C)COc2ccccc2)CC1	ZINC000875125021	GF	On-Demand	Anodyne	HCN1	58	38
CCC1(N2CCOCC2)CCN(C(=O)N[C@@H](C)COc2ccccc2)CC1	ZINC000875125022	GF	On-Demand	Anodyne	HCN1	58	38
CN(CCNC(=O)C(=O)NCc1ccc(OC(F)F)cc1F)C1CC1	ZINC000875125117	FD	On-Demand	Anodyne	TRPV1	51	33
COC(=O)N(C)NC(=O)NC[C@@H](c1ccccc1OC)N1CCCCC1	ZINC000875125139	FE	On-Demand	Reactive	HCN1	51	36
COC(=O)N(C)NC(=O)NC[C@@H](c1ccccc1OC)N1CCCCC1	ZINC000875125139	FE	On-Demand	Reactive	HCN4	49	36
COC(=O)N(C)NC(=O)NC[C@H](c1ccccc1OC)N1CCCCC1	ZINC000875125140	FE	On-Demand	Reactive	HCN1	51	36
COC(=O)N(C)NC(=O)NC[C@H](c1ccccc1OC)N1CCCCC1	ZINC000875125140	FE	On-Demand	Reactive	HCN4	49	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)COc2ccccc2)C1	ZINC000875125152	EE	On-Demand	Anodyne	ACE	26	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)COc2ccccc2)C1	ZINC000875125152	EE	On-Demand	Anodyne	PDS	57	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)COc2ccccc2)C1	ZINC000875125153	EE	On-Demand	Anodyne	ACE	26	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)COc2ccccc2)C1	ZINC000875125153	EE	On-Demand	Anodyne	PDS	57	37
C=CCc1ccc(OC(=O)c2ccc(C)c(NC(=O)c3ccco3)c2)c(OC)c1	ZINC000875125158	GJ	On-Demand	Mild	ACR	17	51
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC(=O)N(C)Cc1ccccc1	ZINC000875125198	FD	On-Demand	Anodyne	SLC6A4	22	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC(=O)N(C)Cc1ccccc1	ZINC000875125198	FD	On-Demand	Anodyne	SLC6A3	47	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCC(=O)N(C)Cc2ccccc2)C1	ZINC000875125245	FD	On-Demand	Anodyne	ACE	32	41
CC[C@H](C[C@H](C)O)NC(=O)NCC(=O)N(C)Cc1ccccc1	ZINC000875125332	DD	On-Demand	Anodyne	NPR	40	32
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H](C)c2ccc(F)cc2)C1	ZINC000875125357	ED	On-Demand	Anodyne	CCR3	40	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H](C)c2ccc(F)cc2)C1	ZINC000875125358	ED	On-Demand	Anodyne	CCR3	40	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H](C)c2ccc(F)cc2)C1	ZINC000875125359	ED	On-Demand	Anodyne	CCR3	40	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H](C)c2ccc(F)cc2)C1	ZINC000875125360	ED	On-Demand	Anodyne	CCR3	40	33
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1ccc(F)cc1)N(C)C	ZINC000875125379	FE	On-Demand	Anodyne	SLC6A4	25	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1ccc(F)cc1)N(C)C	ZINC000875125379	FE	On-Demand	Anodyne	SLC6A3	63	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1ccc(F)cc1)N(C)C	ZINC000875125380	FE	On-Demand	Anodyne	SLC6A4	25	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1ccc(F)cc1)N(C)C	ZINC000875125380	FE	On-Demand	Anodyne	SLC6A3	63	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1ccc(F)cc1)N(C)C	ZINC000875125381	FE	On-Demand	Anodyne	SLC6A4	25	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1ccc(F)cc1)N(C)C	ZINC000875125381	FE	On-Demand	Anodyne	SLC6A3	63	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1ccc(F)cc1)N(C)C	ZINC000875125382	FE	On-Demand	Anodyne	SLC6A4	25	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1ccc(F)cc1)N(C)C	ZINC000875125382	FE	On-Demand	Anodyne	SLC6A3	63	48
COc1ccc(N2CCN(C(=O)C(=O)NCCN(C)C3CC3)CC2)c(OC)c1	ZINC000875125384	GC	On-Demand	Clean	DRD2	31	41
COc1ccc(N2CCN(C(=O)C(=O)NCCN(C)C3CC3)CC2)c(OC)c1	ZINC000875125384	GC	On-Demand	Clean	DRD4	43	34
COc1ccc(N2CCN(C(=O)C(=O)NCCN(C)C3CC3)CC2)c(OC)c1	ZINC000875125384	GC	On-Demand	Clean	DRD3	49	38
COc1ccc(N2CCN(C(=O)C(=O)NCCN(C)C3CC3)CC2)c(OC)c1	ZINC000875125384	GC	On-Demand	Clean	MTNR1B	23	42
CC(=O)C1CCN(C(=O)N[C@H](C)COc2ccccc2)CC1	ZINC000875125402	DE	On-Demand	Anodyne	HRH3	17	43
CC(=O)C1CCN(C(=O)N[C@H](C)COc2ccccc2)CC1	ZINC000875125402	DE	On-Demand	Anodyne	CPT1A	72	36
CC(=O)C1CCN(C(=O)N[C@H](C)COc2ccccc2)CC1	ZINC000875125402	DE	On-Demand	Anodyne	CPT2	43	34
CC(=O)C1CCN(C(=O)N[C@@H](C)COc2ccccc2)CC1	ZINC000875125403	DE	On-Demand	Anodyne	HRH3	17	43
CC(=O)C1CCN(C(=O)N[C@@H](C)COc2ccccc2)CC1	ZINC000875125403	DE	On-Demand	Anodyne	CPT1A	72	36
CC(=O)C1CCN(C(=O)N[C@@H](C)COc2ccccc2)CC1	ZINC000875125403	DE	On-Demand	Anodyne	CPT2	43	34
C[C@H](NC(=O)C(=O)NCCN(C)C1CC1)c1ccc(C(F)(F)F)nc1	ZINC000875125436	FD	On-Demand	Anodyne	TRPV1	56	33
C[C@@H](CN(C)C(=O)C(=O)NC[C@H](C)c1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000875125450	GE	On-Demand	Anodyne	PAPA1_CARPA	28	41
C[C@@H](CN(C)C(=O)C(=O)NC[C@@H](C)c1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000875125451	GE	On-Demand	Anodyne	PAPA1_CARPA	28	41
CN(CCNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1)C1CC1	ZINC000875125584	GD	On-Demand	Anodyne	SMO	39	43
CN(CCNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1)C1CC1	ZINC000875125584	GD	On-Demand	Anodyne	ETHR	61	47
CN1CCN(C2CCN(C(=O)C(=O)NCCN(C)C3CC3)CC2)CC1	ZINC000875125631	FB	On-Demand	Anodyne	L3MBTL3	42	39
Cc1csc([C@H]2CCN(C(=O)N[C@H](C)COc3ccccc3)C2)n1	ZINC000875125649	EG	On-Demand	Anodyne	CPT1A	67	41
C[C@@H]1CCCC[C@H]1CNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875125701	GF	On-Demand	Anodyne	SMO	37	41
C[C@@H]1CCCC[C@H]1CNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875125701	GF	On-Demand	Anodyne	ETHR	55	50
C[C@@H]1CCCC[C@@H]1CNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875125702	GF	On-Demand	Anodyne	SMO	37	41
C[C@@H]1CCCC[C@@H]1CNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875125702	GF	On-Demand	Anodyne	ETHR	55	50
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCN(C)C1CC1)CC2	ZINC000875125719	GD	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCN(C)C1CC1)CC2	ZINC000875125719	GD	On-Demand	Anodyne	MTNR1B	18	43
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCN(C)C1CC1)CC2	ZINC000875125720	GD	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCN(C)C1CC1)CC2	ZINC000875125720	GD	On-Demand	Anodyne	MTNR1B	18	43
C[C@@H]1[C@@H](O)C[C@@H]2CC[C@@H]1N2C(=O)N[C@H](C)COc1ccccc1	ZINC000875125729	DE	On-Demand	Anodyne	SLC6A3	31	43
C[C@@H]1[C@@H](O)C[C@@H]2CC[C@@H]1N2C(=O)N[C@H](C)COc1ccccc1	ZINC000875125729	DE	On-Demand	Anodyne	GLRA1	41	33
C[C@H]1[C@@H]2CC[C@@H](C[C@H]1O)N2C(=O)N[C@H](C)COc1ccccc1	ZINC000875125730	DE	On-Demand	Anodyne	SLC6A3	31	43
C[C@H]1[C@@H]2CC[C@@H](C[C@H]1O)N2C(=O)N[C@H](C)COc1ccccc1	ZINC000875125730	DE	On-Demand	Anodyne	GLRA1	41	33
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NCCN(C)C3CC3)C2)c1	ZINC000875125741	GC	On-Demand	Anodyne	DRD4	26	42
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NCCN(C)C3CC3)C2)c1	ZINC000875125742	GC	On-Demand	Anodyne	DRD4	26	42
CONC(=O)C1CCN(C(=O)N[C@H](C)COc2ccccc2)CC1	ZINC000875125756	ED	On-Demand	Anodyne	CPT1A	59	34
CONC(=O)C1CCN(C(=O)N[C@@H](C)COc2ccccc2)CC1	ZINC000875125757	ED	On-Demand	Anodyne	CPT1A	59	34
C=C(C)CN(CC)C(=O)[C@H]1CC(=O)N(Cc2ccccc2Cl)C1	ZINC000875125766	EG	On-Demand	Mild	P2RX7	23	42
C=C(C)CN(CC)C(=O)[C@@H]1CC(=O)N(Cc2ccccc2Cl)C1	ZINC000875125767	EG	On-Demand	Mild	P2RX7	23	42
CN(CCNC(=O)C(=O)NCc1nc(-c2ccncc2)cs1)C1CC1	ZINC000875125769	FD	On-Demand	Anodyne	ROCK1	23	41
CN(CCNC(=O)C(=O)NCc1nc(-c2ccncc2)cs1)C1CC1	ZINC000875125769	FD	On-Demand	Anodyne	ROCK2	16	41
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@H](C)COc2ccccc2)C1	ZINC000875125776	DF	On-Demand	Anodyne	CPT1A	48	40
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@@H](C)COc2ccccc2)C1	ZINC000875125779	DF	On-Demand	Anodyne	CPT1A	48	40
C=CCc1ccc(OC(=O)COc2ccc(C(=O)CC)cc2)c(OC)c1	ZINC000875125818	FI	On-Demand	Mild	PLA2G4B	35	40
C[C@H]1CCC[C@@H](CNC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)C1	ZINC000875125859	GF	On-Demand	Anodyne	SMO	29	42
C[C@H]1CCC[C@@H](CNC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)C1	ZINC000875125859	GF	On-Demand	Anodyne	ETHR	59	47
COC(=O)N(C)NC(=O)N[C@@H](C)COc1ccccc1	ZINC000875125888	CD	On-Demand	Reactive	PDS	57	37
COC(=O)N(C)NC(=O)N[C@H](C)COc1ccccc1	ZINC000875125889	CD	On-Demand	Reactive	PDS	57	37
CN(CCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875125898	GD	On-Demand	Anodyne	CHRM2	18	44
CN(CCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875125898	GD	On-Demand	Anodyne	DRD2	31	46
CN(CCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875125898	GD	On-Demand	Anodyne	DRD4	55	46
CN(CCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875125898	GD	On-Demand	Anodyne	ACHE	71	63
CN(CCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875125898	GD	On-Demand	Anodyne	HRH1	18	41
CN(CCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875125898	GD	On-Demand	Anodyne	DRD3	25	45
CN(CCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875125898	GD	On-Demand	Anodyne	SLC6A3	18	50
CN(CCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875125898	GD	On-Demand	Anodyne	HTR4	26	42
CN(CCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875125898	GD	On-Demand	Anodyne	CHRM3	22	40
CN(CCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875125898	GD	On-Demand	Anodyne	LTA4H	18	44
CN(CCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875125898	GD	On-Demand	Anodyne	SIGMAR1	71	48
CN(CCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875125898	GD	On-Demand	Anodyne	BCHE	20	53
CN(CCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875125898	GD	On-Demand	Anodyne	CCR3	36	41
CN(CCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875125898	GD	On-Demand	Anodyne	MCHR1	41	45
CN(CCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875125898	GD	On-Demand	Anodyne	CACNA1G	32	43
CN(CCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875125898	GD	On-Demand	Anodyne	CACNA1I	51	40
CN(CCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875125898	GD	On-Demand	Anodyne	SIRT3	41	33
CN(CCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875125898	GD	On-Demand	Anodyne	SIRT2	46	33
CN(CCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875125898	GD	On-Demand	Anodyne	SIRT1	42	34
CCC[C@@H](CCO)NC(=O)N[C@@H](C)COc1ccccc1	ZINC000875125942	CE	On-Demand	Anodyne	PDS	57	38
CCC[C@@H](CCO)NC(=O)N[C@H](C)COc1ccccc1	ZINC000875125943	CE	On-Demand	Anodyne	PDS	57	38
CCC[C@H](CCO)NC(=O)N[C@@H](C)COc1ccccc1	ZINC000875125944	CE	On-Demand	Anodyne	PDS	57	38
CCC[C@H](CCO)NC(=O)N[C@H](C)COc1ccccc1	ZINC000875125945	CE	On-Demand	Anodyne	PDS	57	38
COC(=O)C1(O)CN(C(=O)NC[C@@H](c2ccccc2OC)N2CCCCC2)C1	ZINC000875125953	GD	On-Demand	Anodyne	HCN1	53	37
COC(=O)C1(O)CN(C(=O)NC[C@H](c2ccccc2OC)N2CCCCC2)C1	ZINC000875125954	GD	On-Demand	Anodyne	HCN1	53	37
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@@H](C)COc1ccccc1)CC2	ZINC000875125963	FG	On-Demand	Anodyne	MAPK1	44	36
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@H](C)COc1ccccc1)CC2	ZINC000875125964	FG	On-Demand	Anodyne	MAPK1	44	36
CCC1(N(C)C)CCN(C(=O)N[C@@H](C)COc2ccccc2)CC1	ZINC000875125981	EF	On-Demand	Anodyne	GHRHR	45	35
CCC1(N(C)C)CCN(C(=O)N[C@@H](C)COc2ccccc2)CC1	ZINC000875125981	EF	On-Demand	Anodyne	PDS	41	35
CCC1(N(C)C)CCN(C(=O)N[C@H](C)COc2ccccc2)CC1	ZINC000875125982	EF	On-Demand	Anodyne	GHRHR	45	35
CCC1(N(C)C)CCN(C(=O)N[C@H](C)COc2ccccc2)CC1	ZINC000875125982	EF	On-Demand	Anodyne	PDS	41	35
C[C@H]1CCC[C@@H](CNC(=O)C(=O)NC2CCN(CC(=O)OC(C)(C)C)CC2)C1	ZINC000875125996	GD	On-Demand	Anodyne	CACNA1I	42	34
CN(CCNC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)C1CC1	ZINC000875125997	ED	On-Demand	Anodyne	OXTR	54	37
CN(CCNC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)C1CC1	ZINC000875125998	ED	On-Demand	Anodyne	OXTR	54	37
NC(=O)CCOC(=O)c1cccc(Oc2cccc(C(F)(F)F)c2)c1	ZINC000875126003	FH	On-Demand	Anodyne	TRY1_BOVIN	16	40
NC(=O)CCOC(=O)c1cccc(Oc2cccc(C(F)(F)F)c2)c1	ZINC000875126003	FH	On-Demand	Anodyne	ACR	21	48
NC(=O)CCOC(=O)c1cccc(Oc2cccc(C(F)(F)F)c2)c1	ZINC000875126003	FH	On-Demand	Anodyne	PDS	42	42
C[C@@H]1CCCC[C@@H]1CNC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875126015	FD	On-Demand	Anodyne	L3MBTL3	42	39
C[C@@H]1CCCC[C@H]1CNC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875126017	FD	On-Demand	Anodyne	L3MBTL3	42	39
COC(=O)c1oc(CNC(=O)N[C@H](C)COc2ccccc2)cc1C	ZINC000875126041	EF	On-Demand	Anodyne	PDS	50	35
COC(=O)c1oc(CNC(=O)N[C@@H](C)COc2ccccc2)cc1C	ZINC000875126042	EF	On-Demand	Anodyne	PDS	50	35
CC(C)(C)N1CCC(NC(=O)NCC[C@@H](O)COCc2ccccc2)CC1	ZINC000875126078	GF	On-Demand	Anodyne	CASR	17	43
CC(C)(C)N1CCC(NC(=O)NCC[C@@H](O)COCc2ccccc2)CC1	ZINC000875126078	GF	On-Demand	Anodyne	GHSR	40	40
CC(C)(C)N1CCC(NC(=O)NCC[C@@H](O)COCc2ccccc2)CC1	ZINC000875126078	GF	On-Demand	Anodyne	EPHX2	27	43
O=C(CCCNC(=O)N1CCC2(CCNC2=O)CC1)Nc1ccc(Cl)cc1	ZINC000875126132	GE	On-Demand	Anodyne	CACNA1H	55	37
CNC(=O)COc1cccc(CNC(=O)NCC[C@H](O)C2CCCC2)c1	ZINC000875126133	FD	On-Demand	Anodyne	HRH2	28	41
CNC(=O)COc1cccc(CNC(=O)NCC[C@H](O)C2CCCC2)c1	ZINC000875126133	FD	On-Demand	Anodyne	PDS	42	34
CNC(=O)COc1cccc(CNC(=O)NCC[C@@H](O)C2CCCC2)c1	ZINC000875126134	FD	On-Demand	Anodyne	HRH2	28	41
CNC(=O)COc1cccc(CNC(=O)NCC[C@@H](O)C2CCCC2)c1	ZINC000875126134	FD	On-Demand	Anodyne	PDS	42	34
CNC(=O)COc1cccc(CNC(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)c1	ZINC000875126144	GF	On-Demand	Anodyne	PDS	50	35
CC(=O)C1CCN(C(=O)C(=O)NC[C@H](C)COCc2ccccc2)CC1	ZINC000875126148	FD	On-Demand	Anodyne	CAPNS1	41	30
CC(=O)C1CCN(C(=O)C(=O)NC[C@H](C)COCc2ccccc2)CC1	ZINC000875126148	FD	On-Demand	Anodyne	CAPN1	49	35
CC(=O)C1CCN(C(=O)C(=O)NC[C@H](C)COCc2ccccc2)CC1	ZINC000875126148	FD	On-Demand	Anodyne	CAPN2	74	34
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H](C)COCc2ccccc2)CC1	ZINC000875126149	FD	On-Demand	Anodyne	CAPNS1	41	30
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H](C)COCc2ccccc2)CC1	ZINC000875126149	FD	On-Demand	Anodyne	CAPN1	49	35
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H](C)COCc2ccccc2)CC1	ZINC000875126149	FD	On-Demand	Anodyne	CAPN2	74	34
O=CN1CCCN(C(=O)NCCCC(=O)Nc2ccc(Cl)cc2)CC1	ZINC000875126172	FD	On-Demand	Anodyne	EPHX2	19	44
O=CN1CCCN(C(=O)NCCCC(=O)Nc2ccc(Cl)cc2)CC1	ZINC000875126172	FD	On-Demand	Anodyne	CACNA1G	15	46
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCOCCc3ccccc3)C[C@@H]1C2	ZINC000875126175	FE	On-Demand	Anodyne	EPHX2	26	45
CNC(=O)COc1cccc(CNC(=O)N2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000875126177	GD	On-Demand	Anodyne	PDS	40	32
CNC(=O)COc1cccc(CNC(=O)N2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000875126178	GD	On-Demand	Anodyne	PDS	40	32
CC(C)(C)N1CCC(NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)CC1	ZINC000875126197	GG	On-Demand	Anodyne	OPRL1	16	43
C=CCc1ccc(OC(=O)CCCNC(=O)c2ccc(Cl)cc2)c(OC)c1	ZINC000875126202	GI	On-Demand	Mild	DRD3	19	43
C=CCc1ccc(OC(=O)CCCNC(=O)c2ccc(Cl)cc2)c(OC)c1	ZINC000875126202	GI	On-Demand	Mild	PTGDR	21	44
C=CCc1ccc(OC(=O)CCCNC(=O)c2ccc(Cl)cc2)c(OC)c1	ZINC000875126202	GI	On-Demand	Mild	PTGDR2	16	44
CONC(=O)C1CCN(C(=O)NCCCC(=O)Nc2ccc(Cl)cc2)CC1	ZINC000875126205	GE	On-Demand	Anodyne	EPHX2	37	46
CN(C)[C@@H](CNC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1ccc(F)cc1	ZINC000875126210	FF	On-Demand	Anodyne	SLC6A3	17	41
COCC(C)(C)CCNC(=O)C(=O)NCc1nc2cc(Cl)ccc2s1	ZINC000875126212	GF	On-Demand	Anodyne	AGPAT2	17	43
CC(C)(C)N1CCC(NC(=O)N[C@H]2Cc3ccccc3NC2=O)CC1	ZINC000875126213	EE	On-Demand	Anodyne	PYGM	15	42
CC(C)(C)N1CCC(NC(=O)N[C@@H]2Cc3ccccc3NC2=O)CC1	ZINC000875126214	EE	On-Demand	Anodyne	PYGM	15	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCC(C)(C)c2ccccc2)C1	ZINC000875126216	EE	On-Demand	Anodyne	AMY2	42	29
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCC(C)(C)c2ccccc2)C1	ZINC000875126217	EE	On-Demand	Anodyne	AMY2	42	29
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(OCC(=O)NC)c1	ZINC000875126218	ED	On-Demand	Anodyne	ANPEP	19	47
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(OCC(=O)NC)c1	ZINC000875126218	ED	On-Demand	Anodyne	ROCK2	23	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(OCC(=O)NC)c1	ZINC000875126218	ED	On-Demand	Anodyne	PDS	92	40
CC(C)(C)N1CCC(NC(=O)N2CC[C@H](c3ccc(O)cc3)C2)CC1	ZINC000875126233	EG	On-Demand	Anodyne	EPHX2	28	41
CC(C)(C)N1CCC(NC(=O)N2CC[C@@H](c3ccc(O)cc3)C2)CC1	ZINC000875126234	EG	On-Demand	Anodyne	EPHX2	28	41
O=CN1CCCN(C(=O)NCCOc2cccc3ccccc23)CC1	ZINC000875126238	EE	On-Demand	Anodyne	MCL1	42	39
CNC(=O)COc1cccc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875126241	FD	On-Demand	Anodyne	BIRC2	25	40
CNC(=O)COc1cccc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875126242	FD	On-Demand	Anodyne	BIRC2	25	40
CNC(=O)COc1cccc(CNC(=O)NC2(C)CC(F)(F)C2)c1	ZINC000875126252	ED	On-Demand	Anodyne	PDS	50	35
O=CN1CCCN(C(=O)NCCCOCCc2ccccc2)CC1	ZINC000875126255	ED	On-Demand	Anodyne	PREP	37	40
CNC(=O)COc1cccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875126272	ED	On-Demand	Anodyne	PDS	41	31
CNC(=O)COc1cccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875126273	ED	On-Demand	Anodyne	PDS	41	31
O=C(NCCCOCCc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875126283	FD	On-Demand	Anodyne	GHRHR	44	32
CN1CC[C@H]2CN(C(=O)NCCCC(=O)Nc3ccc(Cl)cc3)CC[C@H]21	ZINC000875126289	GF	On-Demand	Anodyne	EPHX2	25	40
CN1CC[C@H]2CN(C(=O)NCCCC(=O)Nc3ccc(Cl)cc3)CC[C@@H]21	ZINC000875126290	GF	On-Demand	Anodyne	EPHX2	25	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCC(=O)Nc1ccc(Cl)cc1	ZINC000875126294	GF	On-Demand	Anodyne	SLC6A4	25	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCC(=O)Nc1ccc(Cl)cc1	ZINC000875126294	GF	On-Demand	Anodyne	SLC6A3	47	43
CC(=O)[C@H]1CCCN(C(=O)NCCCC(=O)Nc2ccc(Cl)cc2)C1	ZINC000875126327	FG	On-Demand	Anodyne	EPHX2	24	40
CC(=O)[C@@H]1CCCN(C(=O)NCCCC(=O)Nc2ccc(Cl)cc2)C1	ZINC000875126328	FG	On-Demand	Anodyne	EPHX2	24	40
O=C(NCCO)C1CCN(C(=O)NCCOc2cccc3ccccc23)CC1	ZINC000875126356	GD	On-Demand	Anodyne	MTNR1A	17	40
O=C(NCCO)C1CCN(C(=O)NCCOc2cccc3ccccc23)CC1	ZINC000875126356	GD	On-Demand	Anodyne	MTNR1B	15	40
CC(C)(C)N1CCC(NC(=O)N[C@@H]2C[C@H](CO)C2)CC1	ZINC000875126358	CD	On-Demand	Anodyne	EPHX2	28	44
CNC(=O)COc1cccc(CNC(=O)N2CCC[C@](O)(c3ccccc3)C2)c1	ZINC000875126365	GE	On-Demand	Anodyne	PDS	42	32
CNC(=O)COc1cccc(CNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)c1	ZINC000875126366	GE	On-Demand	Anodyne	PDS	42	32
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCOCCc1ccccc1	ZINC000875126367	FE	On-Demand	Anodyne	SLC6A4	28	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCOCCc1ccccc1	ZINC000875126367	FE	On-Demand	Anodyne	SLC6A3	57	46
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(-c2ccccc2)o1	ZINC000875126375	DG	On-Demand	Anodyne	ANPEP	21	40
CNC(=O)COc1cccc(CNC(=O)N(C)OCC(F)(F)F)c1	ZINC000875126381	ED	On-Demand	Anodyne	PDS	65	38
CNC(=O)COc1cccc(CNC(=O)N2CCCCCCNC(=O)CC2)c1	ZINC000875126426	GD	On-Demand	Anodyne	HRH2	34	42
CNC(=O)COc1cccc(CNC(=O)N2CCCCCCNC(=O)CC2)c1	ZINC000875126426	GD	On-Demand	Anodyne	UPP1	48	32
CC(=O)C1CCN(C(=O)NCCCC(=O)Nc2ccc(Cl)cc2)CC1	ZINC000875126443	FG	On-Demand	Anodyne	EPHX2	39	42
CC(=O)C1CCN(C(=O)NCCCC(=O)Nc2ccc(Cl)cc2)CC1	ZINC000875126443	FG	On-Demand	Anodyne	CACNA1G	15	46
CC(C)(C)N1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875126460	GG	On-Demand	Mild	ITK	17	48
CC(C)(C)N1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875126460	GG	On-Demand	Mild	PANC	59	41
CNC(=O)COc1cccc(CNC(=O)NC2CC(Nc3ccccc3)C2)c1	ZINC000875126493	GE	On-Demand	Anodyne	PDS	51	36
C=C(C)CN(CC)C(=O)c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12	ZINC000875126507	GJ	On-Demand	Mild	TSPO	25	40
C=C(C)CN(CC)C(=O)c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12	ZINC000875126507	GJ	On-Demand	Mild	PRS	25	40
C=C(C)CN(CC)C(=O)c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12	ZINC000875126507	GJ	On-Demand	Mild	TACR3	15	40
C=C(C)CN(CC)C(=O)c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12	ZINC000875126507	GJ	On-Demand	Mild	MT-CO2	39	40
C[C@H](NC(=O)C(=O)NCCSCc1cccc2ccccc12)c1ccnn1C	ZINC000875126511	GF	On-Demand	Anodyne	Q6PRC7_IXORI	46	33
CNC(=O)COc1cccc(CNC(=O)N[C@@H]2CC(C)(C)CC[C@H]2O)c1	ZINC000875126514	FD	On-Demand	Anodyne	ADORA3	41	31
CNC(=O)COc1cccc(CNC(=O)N[C@@H]2CC(C)(C)CC[C@H]2O)c1	ZINC000875126514	FD	On-Demand	Anodyne	PDS	44	32
O=C(NCCCOCCc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000875126525	DD	On-Demand	Anodyne	EPHX2	18	44
O=C(NCCO)C1CCN(C(=O)NCc2ccc(-c3ccccc3)o2)CC1	ZINC000875126532	FD	On-Demand	Anodyne	EPHX2	16	43
CC(C)(C)N1CCC(NC(=O)NCC[C@H](O)C2CCCC2)CC1	ZINC000875126539	EE	On-Demand	Anodyne	EPHX2	15	41
CC(C)(C)N1CCC(NC(=O)NCC[C@@H](O)C2CCCC2)CC1	ZINC000875126540	EE	On-Demand	Anodyne	EPHX2	15	41
CC(C)(C)N1CCC(NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)CC1	ZINC000875126560	FF	On-Demand	Anodyne	EPHX2	27	46
CC(C)(C)N1CCC(NC(=O)N2CCC[C@](O)(c3ccccc3)C2)CC1	ZINC000875126561	FF	On-Demand	Anodyne	EPHX2	27	46
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H](C)COCc2ccccc2)C1	ZINC000875126581	FD	On-Demand	Anodyne	CAPN2	40	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H](C)COCc2ccccc2)C1	ZINC000875126581	FD	On-Demand	Anodyne	BIRC2	21	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H](C)COCc2ccccc2)C1	ZINC000875126582	FD	On-Demand	Anodyne	CAPN2	40	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H](C)COCc2ccccc2)C1	ZINC000875126582	FD	On-Demand	Anodyne	BIRC2	21	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H](C)COCc2ccccc2)C1	ZINC000875126583	FD	On-Demand	Anodyne	CAPN2	40	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H](C)COCc2ccccc2)C1	ZINC000875126583	FD	On-Demand	Anodyne	BIRC2	21	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H](C)COCc2ccccc2)C1	ZINC000875126584	FD	On-Demand	Anodyne	CAPN2	40	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H](C)COCc2ccccc2)C1	ZINC000875126584	FD	On-Demand	Anodyne	BIRC2	21	43
CNC(=O)COc1cccc(CNC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875126585	GD	On-Demand	Anodyne	HRH2	28	40
CNC(=O)COc1cccc(CNC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875126585	GD	On-Demand	Anodyne	UPP1	40	31
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(C(C)(C)C)CC1	ZINC000875126594	CE	On-Demand	Anodyne	EPHX2	18	40
CC(C)(C)N1CCC(NC(=O)NCCN2CC[C@H](O)C2)CC1	ZINC000875126602	DC	On-Demand	Anodyne	CACNA1H	18	45
CC(C)(C)N1CCC(NC(=O)NCCN2CC[C@@H](O)C2)CC1	ZINC000875126603	DC	On-Demand	Anodyne	CACNA1H	18	45
C#CC[C@H](COC)NC(=O)C(=O)NCc1nc2cc(Cl)ccc2s1	ZINC000875126617	FD	On-Demand	Mild	AGPAT2	27	41
C#CC[C@@H](COC)NC(=O)C(=O)NCc1nc2cc(Cl)ccc2s1	ZINC000875126618	FD	On-Demand	Mild	AGPAT2	27	41
CC(C)(C)N1CCC(NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875126620	FG	On-Demand	Anodyne	WNT3	41	31
CC(C)(C)N1CCC(NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875126621	FG	On-Demand	Anodyne	WNT3	41	31
CC(C)(C)N1CCC(NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875126622	FG	On-Demand	Anodyne	WNT3	41	31
CC(C)(C)N1CCC(NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875126623	FG	On-Demand	Anodyne	WNT3	41	31
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccc(OCC(=O)NC)c2)C1	ZINC000875126625	GD	On-Demand	Anodyne	PDS	50	36
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1c(F)cccc1F	ZINC000875126647	EG	On-Demand	Anodyne	REN	15	42
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1c(F)cccc1F	ZINC000875126653	EG	On-Demand	Anodyne	REN	15	42
CC(C)(C)N1CCC(NC(=O)N2CC(c3ccccc3)C2)CC1	ZINC000875126656	DG	On-Demand	Anodyne	EPHX2	48	44
CC(C)(C)N1CCC(NC(=O)N2CC(c3ccccc3)C2)CC1	ZINC000875126656	DG	On-Demand	Anodyne	RBP4	56	35
CC[C@@H](NC(=O)NC1CCN(C(C)(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000875126680	EG	On-Demand	Anodyne	EPHX2	31	40
CC[C@@H](NC(=O)NC1CCN(C(C)(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000875126680	EG	On-Demand	Anodyne	XIAP	40	37
CC(C)(C)N1CCC(NC(=O)N[C@@H](CCO)c2ccc(Cl)c(F)c2)CC1	ZINC000875126683	GG	On-Demand	Anodyne	MAPK1	54	37
CC[C@@H](NC(=O)NC1CCN(C(C)(C)C)CC1)[C@H](O)c1ccccc1	ZINC000875126684	EG	On-Demand	Anodyne	EPHX2	31	40
CC[C@@H](NC(=O)NC1CCN(C(C)(C)C)CC1)[C@H](O)c1ccccc1	ZINC000875126684	EG	On-Demand	Anodyne	XIAP	40	37
CC(C)(C)N1CCC(NC(=O)N[C@H](CCO)c2ccc(Cl)c(F)c2)CC1	ZINC000875126689	GG	On-Demand	Anodyne	MAPK1	54	37
CNC(=O)COc1cccc(CNC(=O)N2C[C@@H]3C[C@H]2CN3c2ccccc2)c1	ZINC000875126691	GD	On-Demand	Anodyne	PDS	53	34
C[C@@H](NC(=O)N1CCc2nc(C3CC3)ncc2C1)c1c(F)cccc1F	ZINC000875126719	FG	On-Demand	Anodyne	MAPK1	56	41
C[C@@H](NC(=O)N1CCN(C)C(C)(C)CC1)c1c(F)cccc1F	ZINC000875126721	EG	On-Demand	Anodyne	CACNA1H	49	38
C[C@@H](NC(=O)N1CCN(C)C(C)(C)CC1)c1c(F)cccc1F	ZINC000875126721	EG	On-Demand	Anodyne	CCR1	46	38
C#CC[C@@H](COC)NC(=O)C(=O)NCc1cccc(OCC(C)C)c1	ZINC000875126751	ED	On-Demand	Mild	PDS	77	39
C#CC[C@H](COC)NC(=O)C(=O)NCc1cccc(OCC(C)C)c1	ZINC000875126752	ED	On-Demand	Mild	PDS	77	39
CNC(=O)COc1cccc(CNC(=O)N2CCCN(C=O)CC2)c1	ZINC000875126791	EC	On-Demand	Anodyne	PDS	48	32
O=C(NCCO)C1CCN(C(=O)NCCCOCCc2ccccc2)CC1	ZINC000875126803	GD	On-Demand	Anodyne	FKBP1A	33	42
O=C(NCCO)C1CCN(C(=O)NCCCOCCc2ccccc2)CC1	ZINC000875126803	GD	On-Demand	Anodyne	EPHX2	15	42
Cc1nnc(NNC(=O)N[C@@H](C)c2c(Cl)ccc(F)c2Cl)n1C	ZINC000875126811	FF	On-Demand	Reactive	MET	15	42
Cc1nnc(NNC(=O)N[C@H](C)c2c(Cl)ccc(F)c2Cl)n1C	ZINC000875126817	FF	On-Demand	Reactive	MET	15	42
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(OCC(C)C)c2)CC1	ZINC000875126818	FE	On-Demand	Anodyne	PDS	76	38
CC(=O)C1CCN(C(=O)C(=O)NCCC(C)(C)c2ccccc2)CC1	ZINC000875126903	EE	On-Demand	Anodyne	SFRP1	40	32
CNC(=O)COc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875126950	GE	On-Demand	Anodyne	F2	29	47
CNC(=O)COc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875126950	GE	On-Demand	Anodyne	FKBP1A	46	39
CNC(=O)COc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875126950	GE	On-Demand	Anodyne	CPT1A	110	42
CNC(=O)COc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875126950	GE	On-Demand	Anodyne	CPT2	43	34
CNC(=O)COc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875126950	GE	On-Demand	Anodyne	PREP	32	41
CNC(=O)COc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875126950	GE	On-Demand	Anodyne	PDS	50	36
COC(=O)N(C)NC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000875126951	GF	On-Demand	Reactive	CHRM2	15	49
COC(=O)N(C)NC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000875126951	GF	On-Demand	Reactive	CHRM1	16	49
COC(=O)N(C)NC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000875126951	GF	On-Demand	Reactive	DRD2	20	54
COC(=O)N(C)NC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000875126951	GF	On-Demand	Reactive	DRD4	38	60
COC(=O)N(C)NC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000875126951	GF	On-Demand	Reactive	ACHE	34	45
COC(=O)N(C)NC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000875126951	GF	On-Demand	Reactive	HRH2	22	41
COC(=O)N(C)NC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000875126951	GF	On-Demand	Reactive	DRD3	16	54
COC(=O)N(C)NC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000875126951	GF	On-Demand	Reactive	KCNH2	16	50
COC(=O)N(C)NC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000875126951	GF	On-Demand	Reactive	CHRM3	27	49
COC(=O)N(C)NC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000875126951	GF	On-Demand	Reactive	LTA4H	15	40
COC(=O)N(C)NC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000875126951	GF	On-Demand	Reactive	TACR1	43	42
COC(=O)N(C)NC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000875126951	GF	On-Demand	Reactive	SIGMAR1	36	64
COC(=O)N(C)NC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000875126951	GF	On-Demand	Reactive	SSTR5	61	40
COC(=O)N(C)NC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000875126951	GF	On-Demand	Reactive	CACNA1B	43	43
COC(=O)N(C)NC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000875126951	GF	On-Demand	Reactive	CCR3	49	44
COC(=O)N(C)NC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000875126951	GF	On-Demand	Reactive	CCR2	87	48
COC(=O)N(C)NC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000875126951	GF	On-Demand	Reactive	SLC6A5	35	49
COC(=O)N(C)NC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000875126951	GF	On-Demand	Reactive	EPHX2	37	47
COC(=O)N(C)NC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000875126951	GF	On-Demand	Reactive	CXCR3	26	47
COC(=O)N(C)NC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000875126951	GF	On-Demand	Reactive	MCHR1	73	46
COC(=O)N(C)NC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000875126951	GF	On-Demand	Reactive	CACNA1G	42	47
COC(=O)N(C)NC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000875126951	GF	On-Demand	Reactive	CCR8	19	46
CNC(=O)COc1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875126952	GE	On-Demand	Anodyne	F2	29	47
CNC(=O)COc1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875126952	GE	On-Demand	Anodyne	FKBP1A	46	39
CNC(=O)COc1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875126952	GE	On-Demand	Anodyne	CPT1A	110	42
CNC(=O)COc1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875126952	GE	On-Demand	Anodyne	CPT2	43	34
CNC(=O)COc1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875126952	GE	On-Demand	Anodyne	PREP	32	41
CNC(=O)COc1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875126952	GE	On-Demand	Anodyne	PDS	50	36
C[C@@H](NC(=O)N1CC(c2ccccc2)C1)c1c(F)cccc1F	ZINC000875126960	DH	On-Demand	Anodyne	RBP4	48	40
CNC(=O)COc1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875126972	GE	On-Demand	Anodyne	F2	29	47
CNC(=O)COc1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875126972	GE	On-Demand	Anodyne	FKBP1A	46	39
CNC(=O)COc1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875126972	GE	On-Demand	Anodyne	CPT1A	110	42
CNC(=O)COc1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875126972	GE	On-Demand	Anodyne	CPT2	43	34
CNC(=O)COc1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875126972	GE	On-Demand	Anodyne	PREP	32	41
CNC(=O)COc1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875126972	GE	On-Demand	Anodyne	PDS	50	36
CNC(=O)COc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875126973	GE	On-Demand	Anodyne	F2	29	47
CNC(=O)COc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875126973	GE	On-Demand	Anodyne	FKBP1A	46	39
CNC(=O)COc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875126973	GE	On-Demand	Anodyne	CPT1A	110	42
CNC(=O)COc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875126973	GE	On-Demand	Anodyne	CPT2	43	34
CNC(=O)COc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875126973	GE	On-Demand	Anodyne	PREP	32	41
CNC(=O)COc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875126973	GE	On-Demand	Anodyne	PDS	50	36
CC(C)(C)N1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875126992	FF	On-Demand	Anodyne	EPHX2	37	46
CC(C)(C)N1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875126993	FF	On-Demand	Anodyne	EPHX2	37	46
C[C@@H](CNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)CN1CCCCC1	ZINC000875126995	GG	On-Demand	Anodyne	OPRL1	15	42
CCC1(CC)CCCN1C(=O)NCc1cccc(OCC(=O)NC)c1	ZINC000875127017	EF	On-Demand	Anodyne	HRH2	30	42
CCC1(CC)CCCN1C(=O)NCc1cccc(OCC(=O)NC)c1	ZINC000875127017	EF	On-Demand	Anodyne	PDS	48	33
COC(=O)[C@@]1(OC)CCN(C(=O)N[C@@H](C)c2c(F)cccc2F)C1	ZINC000875127045	ED	On-Demand	Anodyne	CACNA1H	41	36
COC(=O)[C@@]1(OC)CCN(C(=O)N[C@H](C)c2c(F)cccc2F)C1	ZINC000875127049	ED	On-Demand	Anodyne	CACNA1H	41	36
CNC(=O)COc1cccc(CNC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875127057	DC	On-Demand	Anodyne	PDS	53	34
CNC(=O)COc1cccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875127128	GE	On-Demand	Anodyne	EPHX2	20	41
CNC(=O)COc1cccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875127129	GE	On-Demand	Anodyne	EPHX2	20	41
CC[C@@H](NC(=O)NCc1cccc(OCC(=O)NC)c1)[C@@H](O)c1ccccc1	ZINC000875127149	GE	On-Demand	Anodyne	UPP1	40	30
CC[C@@H](NC(=O)NCc1cccc(OCC(=O)NC)c1)[C@@H](O)c1ccccc1	ZINC000875127149	GE	On-Demand	Anodyne	ROCK2	17	40
CC[C@@H](NC(=O)NCc1cccc(OCC(=O)NC)c1)[C@@H](O)c1ccccc1	ZINC000875127149	GE	On-Demand	Anodyne	PDS	94	43
CC[C@@H](NC(=O)NCc1cccc(OCC(=O)NC)c1)[C@H](O)c1ccccc1	ZINC000875127150	GE	On-Demand	Anodyne	UPP1	40	30
CC[C@@H](NC(=O)NCc1cccc(OCC(=O)NC)c1)[C@H](O)c1ccccc1	ZINC000875127150	GE	On-Demand	Anodyne	ROCK2	17	40
CC[C@@H](NC(=O)NCc1cccc(OCC(=O)NC)c1)[C@H](O)c1ccccc1	ZINC000875127150	GE	On-Demand	Anodyne	PDS	94	43
CN(C)C[C@@H]1CN(C(=O)NCCOc2cccc3ccccc23)C[C@H]1CN(C)C	ZINC000875127157	GF	On-Demand	Anodyne	MCL1	40	40
O=C(NCc1ccc(-c2ccccc2)o1)NC[C@H]1C[C@H](O)C1	ZINC000875127165	DF	On-Demand	Anodyne	CYP2E1	17	40
O=C(NCCOc1cccc2ccccc12)N1CCC(CO)(CO)CC1	ZINC000875127166	FD	On-Demand	Anodyne	ALB	23	40
O=C(NCCOc1cccc2ccccc12)N1CCC(CO)(CO)CC1	ZINC000875127166	FD	On-Demand	Anodyne	MCL1	48	42
C[C@H](NC(=O)C(=O)NC[C@@H](C)COCc1ccccc1)c1ccnn1C	ZINC000875127167	FD	On-Demand	Anodyne	CTSB	40	33
C[C@H](NC(=O)C(=O)NC[C@@H](C)COCc1ccccc1)c1ccnn1C	ZINC000875127167	FD	On-Demand	Anodyne	CAPNS1	48	32
C[C@H](NC(=O)C(=O)NC[C@@H](C)COCc1ccccc1)c1ccnn1C	ZINC000875127167	FD	On-Demand	Anodyne	CAPN1	62	37
C[C@H](NC(=O)C(=O)NC[C@@H](C)COCc1ccccc1)c1ccnn1C	ZINC000875127167	FD	On-Demand	Anodyne	CAPN2	95	36
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1c(Cl)ccc(F)c1Cl	ZINC000875127223	EG	On-Demand	Anodyne	MET	17	40
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1c(Cl)ccc(F)c1Cl	ZINC000875127230	EG	On-Demand	Anodyne	MET	17	40
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1c(Cl)ccc(F)c1Cl	ZINC000875127249	FG	On-Demand	Anodyne	MET	19	42
COc1cccc([C@H](C)NC(=O)N[C@H](C)[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000875127306	GG	On-Demand	Anodyne	MTNR1A	37	42
COc1cccc([C@H](C)NC(=O)N[C@H](C)[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000875127306	GG	On-Demand	Anodyne	MTNR1B	38	42
COc1cccc([C@H](C)NC(=O)N[C@H](C)[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000875127308	GG	On-Demand	Anodyne	MTNR1A	37	42
COc1cccc([C@H](C)NC(=O)N[C@H](C)[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000875127308	GG	On-Demand	Anodyne	MTNR1B	38	42
COc1cccc([C@H](C)NC(=O)N[C@@H](C)[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000875127310	GG	On-Demand	Anodyne	MTNR1A	37	42
COc1cccc([C@H](C)NC(=O)N[C@@H](C)[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000875127310	GG	On-Demand	Anodyne	MTNR1B	38	42
COc1cccc([C@H](C)NC(=O)N[C@@H](C)[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000875127312	GG	On-Demand	Anodyne	MTNR1A	37	42
COc1cccc([C@H](C)NC(=O)N[C@@H](C)[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000875127312	GG	On-Demand	Anodyne	MTNR1B	38	42
Cc1ccc([C@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)c(C)c1	ZINC000875127332	ED	On-Demand	Anodyne	EPHX2	27	45
COc1cccc([C@@H](C)NC(=O)N[C@@H]2CCOC[C@H]2O)c1	ZINC000875127372	CD	On-Demand	Anodyne	MTNR1A	17	40
COc1cccc([C@@H](C)NC(=O)N[C@@H]2CCOC[C@H]2O)c1	ZINC000875127372	CD	On-Demand	Anodyne	MTNR1B	20	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)c1cccc(OC)c1	ZINC000875127396	CF	On-Demand	Anodyne	MTNR1A	36	46
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)c1cccc(OC)c1	ZINC000875127396	CF	On-Demand	Anodyne	MTNR1B	36	46
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)c1cccc(OC)c1	ZINC000875127396	CF	On-Demand	Anodyne	ROCK2	16	43
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)c1cccc(OC)c1	ZINC000875127396	CF	On-Demand	Anodyne	PDS	23	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)c1cccc(OC)c1	ZINC000875127397	CF	On-Demand	Anodyne	MTNR1A	36	46
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)c1cccc(OC)c1	ZINC000875127397	CF	On-Demand	Anodyne	MTNR1B	36	46
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)c1cccc(OC)c1	ZINC000875127397	CF	On-Demand	Anodyne	ROCK2	16	43
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)c1cccc(OC)c1	ZINC000875127397	CF	On-Demand	Anodyne	PDS	23	40
O=C(NCc1cccc(NC(=O)c2cccc(F)c2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875127408	FF	On-Demand	Anodyne	ROCK2	18	43
O=C(NCc1cccc(NC(=O)c2cccc(F)c2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875127408	FF	On-Demand	Anodyne	KCNK3	94	49
O=C(NCc1cccc(NC(=O)c2cccc(F)c2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875127408	FF	On-Demand	Anodyne	KCNK9	47	46
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)C(=O)NCC2CC=CC2)C1	ZINC000875127427	FD	On-Demand	Anodyne	CACNA1I	47	34
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)C(=O)NCC2CC=CC2)C1	ZINC000875127428	FD	On-Demand	Anodyne	CACNA1I	47	34
COC(=O)N(C)NC(=O)N[C@H](C)c1cccc(OC)c1	ZINC000875127459	CD	On-Demand	Reactive	MTNR1A	35	43
COC(=O)N(C)NC(=O)N[C@H](C)c1cccc(OC)c1	ZINC000875127459	CD	On-Demand	Reactive	MTNR1B	33	43
COC(=O)N(C)NC(=O)N[C@@H](C)c1cccc(OC)c1	ZINC000875127460	CD	On-Demand	Reactive	MTNR1A	35	43
COC(=O)N(C)NC(=O)N[C@@H](C)c1cccc(OC)c1	ZINC000875127460	CD	On-Demand	Reactive	MTNR1B	33	43
O=C(NCC[C@H]1CCSC1)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875127473	GE	On-Demand	Anodyne	DRD2	20	47
O=C(NCC[C@H]1CCSC1)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875127473	GE	On-Demand	Anodyne	DRD4	43	47
O=C(NCC[C@H]1CCSC1)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875127473	GE	On-Demand	Anodyne	ACHE	61	57
O=C(NCC[C@H]1CCSC1)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875127473	GE	On-Demand	Anodyne	DRD3	15	44
O=C(NCC[C@H]1CCSC1)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875127473	GE	On-Demand	Anodyne	HTR4	41	45
O=C(NCC[C@H]1CCSC1)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875127473	GE	On-Demand	Anodyne	SIGMAR1	59	44
O=C(NCC[C@H]1CCSC1)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875127473	GE	On-Demand	Anodyne	BCHE	18	49
O=C(NCC[C@H]1CCSC1)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875127473	GE	On-Demand	Anodyne	MCHR1	15	41
O=C(NCC[C@H]1CCSC1)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875127473	GE	On-Demand	Anodyne	CACNA1I	57	41
O=C(NCC[C@@H]1CCSC1)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875127474	GE	On-Demand	Anodyne	DRD2	20	47
O=C(NCC[C@@H]1CCSC1)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875127474	GE	On-Demand	Anodyne	DRD4	43	47
O=C(NCC[C@@H]1CCSC1)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875127474	GE	On-Demand	Anodyne	ACHE	61	57
O=C(NCC[C@@H]1CCSC1)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875127474	GE	On-Demand	Anodyne	DRD3	15	44
O=C(NCC[C@@H]1CCSC1)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875127474	GE	On-Demand	Anodyne	HTR4	41	45
O=C(NCC[C@@H]1CCSC1)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875127474	GE	On-Demand	Anodyne	SIGMAR1	59	44
O=C(NCC[C@@H]1CCSC1)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875127474	GE	On-Demand	Anodyne	BCHE	18	49
O=C(NCC[C@@H]1CCSC1)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875127474	GE	On-Demand	Anodyne	MCHR1	15	41
O=C(NCC[C@@H]1CCSC1)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875127474	GE	On-Demand	Anodyne	CACNA1I	57	41
C[C@@H](NC(=O)NCCN1CC[C@@H](O)C1)c1c(F)cccc1F	ZINC000875127493	DD	On-Demand	Anodyne	PLD1	54	35
C[C@@H](NC(=O)NCCN1CC[C@@H](O)C1)c1c(F)cccc1F	ZINC000875127493	DD	On-Demand	Anodyne	PLD2	55	33
C[C@@H](NC(=O)NCCN1CC[C@H](O)C1)c1c(F)cccc1F	ZINC000875127495	DD	On-Demand	Anodyne	PLD1	54	35
C[C@@H](NC(=O)NCCN1CC[C@H](O)C1)c1c(F)cccc1F	ZINC000875127495	DD	On-Demand	Anodyne	PLD2	55	33
C[C@H](NC(=O)NCCN1CC[C@H](O)C1)c1c(F)cccc1F	ZINC000875127496	DD	On-Demand	Anodyne	PLD1	54	35
C[C@H](NC(=O)NCCN1CC[C@H](O)C1)c1c(F)cccc1F	ZINC000875127496	DD	On-Demand	Anodyne	PLD2	55	33
C[C@H](NC(=O)NCCN1CC[C@@H](O)C1)c1c(F)cccc1F	ZINC000875127498	DD	On-Demand	Anodyne	PLD1	54	35
C[C@H](NC(=O)NCCN1CC[C@@H](O)C1)c1c(F)cccc1F	ZINC000875127498	DD	On-Demand	Anodyne	PLD2	55	33
NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CC(c4ccccc4)C3)cc2)C1	ZINC000875127531	GF	On-Demand	Clean	SLC6A1	62	34
NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CC(c4ccccc4)C3)cc2)C1	ZINC000875127531	GF	On-Demand	Clean	DPP7	40	34
NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CC(c4ccccc4)C3)cc2)C1	ZINC000875127531	GF	On-Demand	Clean	TMPRSS11D	59	33
NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CC(c4ccccc4)C3)cc2)C1	ZINC000875127533	GF	On-Demand	Clean	SLC6A1	62	34
NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CC(c4ccccc4)C3)cc2)C1	ZINC000875127533	GF	On-Demand	Clean	DPP7	40	34
NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CC(c4ccccc4)C3)cc2)C1	ZINC000875127533	GF	On-Demand	Clean	TMPRSS11D	59	33
C[C@@H](NC(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1)c1c(F)cccc1F	ZINC000875127538	FF	On-Demand	Anodyne	CACNA1H	44	38
C[C@@H](NC(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1)c1c(F)cccc1F	ZINC000875127539	FF	On-Demand	Anodyne	CACNA1H	44	38
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1c(F)cccc1F	ZINC000875127566	ED	On-Demand	Anodyne	CACNA1H	55	41
NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3Cc4cccc(O)c4C3)cc2)C1	ZINC000875127610	GE	On-Demand	Clean	NAMPT	23	42
NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3Cc4cccc(O)c4C3)cc2)C1	ZINC000875127610	GE	On-Demand	Clean	TMPRSS11D	42	31
NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3Cc4cccc(O)c4C3)cc2)C1	ZINC000875127613	GE	On-Demand	Clean	NAMPT	23	42
NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3Cc4cccc(O)c4C3)cc2)C1	ZINC000875127613	GE	On-Demand	Clean	TMPRSS11D	42	31
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875127689	GE	On-Demand	Anodyne	CACNA1I	41	33
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875127690	GE	On-Demand	Anodyne	CACNA1I	41	33
Cc1nccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)n1	ZINC000875127692	DE	On-Demand	Anodyne	EPHX2	19	42
Cc1nccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)n1	ZINC000875127693	DE	On-Demand	Anodyne	EPHX2	19	42
CN1CC[C@H]2CN(C(=O)C(=O)NCC3CCN(Cc4ccccc4)CC3)CC[C@H]21	ZINC000875127755	GD	On-Demand	Anodyne	CHRM2	18	40
CN1CC[C@H]2CN(C(=O)C(=O)NCC3CCN(Cc4ccccc4)CC3)CC[C@H]21	ZINC000875127755	GD	On-Demand	Anodyne	DRD2	25	48
CN1CC[C@H]2CN(C(=O)C(=O)NCC3CCN(Cc4ccccc4)CC3)CC[C@H]21	ZINC000875127755	GD	On-Demand	Anodyne	DRD4	47	48
CN1CC[C@H]2CN(C(=O)C(=O)NCC3CCN(Cc4ccccc4)CC3)CC[C@H]21	ZINC000875127755	GD	On-Demand	Anodyne	ACHE	56	50
CN1CC[C@H]2CN(C(=O)C(=O)NCC3CCN(Cc4ccccc4)CC3)CC[C@H]21	ZINC000875127755	GD	On-Demand	Anodyne	DRD3	18	45
CN1CC[C@H]2CN(C(=O)C(=O)NCC3CCN(Cc4ccccc4)CC3)CC[C@H]21	ZINC000875127755	GD	On-Demand	Anodyne	HTR4	65	46
CN1CC[C@H]2CN(C(=O)C(=O)NCC3CCN(Cc4ccccc4)CC3)CC[C@H]21	ZINC000875127755	GD	On-Demand	Anodyne	GRIN2B	43	36
CN1CC[C@H]2CN(C(=O)C(=O)NCC3CCN(Cc4ccccc4)CC3)CC[C@H]21	ZINC000875127755	GD	On-Demand	Anodyne	SIGMAR1	53	44
CN1CC[C@H]2CN(C(=O)C(=O)NCC3CCN(Cc4ccccc4)CC3)CC[C@H]21	ZINC000875127755	GD	On-Demand	Anodyne	BCHE	18	42
CN1CC[C@H]2CN(C(=O)C(=O)NCC3CCN(Cc4ccccc4)CC3)CC[C@H]21	ZINC000875127755	GD	On-Demand	Anodyne	MCHR1	21	40
CN1CC[C@H]2CN(C(=O)C(=O)NCC3CCN(Cc4ccccc4)CC3)CC[C@H]21	ZINC000875127755	GD	On-Demand	Anodyne	CACNA1I	76	42
CN1CC[C@H]2CN(C(=O)C(=O)NCC3CCN(Cc4ccccc4)CC3)CC[C@@H]21	ZINC000875127758	GD	On-Demand	Anodyne	CHRM2	18	40
CN1CC[C@H]2CN(C(=O)C(=O)NCC3CCN(Cc4ccccc4)CC3)CC[C@@H]21	ZINC000875127758	GD	On-Demand	Anodyne	DRD2	25	48
CN1CC[C@H]2CN(C(=O)C(=O)NCC3CCN(Cc4ccccc4)CC3)CC[C@@H]21	ZINC000875127758	GD	On-Demand	Anodyne	DRD4	47	48
CN1CC[C@H]2CN(C(=O)C(=O)NCC3CCN(Cc4ccccc4)CC3)CC[C@@H]21	ZINC000875127758	GD	On-Demand	Anodyne	ACHE	56	50
CN1CC[C@H]2CN(C(=O)C(=O)NCC3CCN(Cc4ccccc4)CC3)CC[C@@H]21	ZINC000875127758	GD	On-Demand	Anodyne	DRD3	18	45
CN1CC[C@H]2CN(C(=O)C(=O)NCC3CCN(Cc4ccccc4)CC3)CC[C@@H]21	ZINC000875127758	GD	On-Demand	Anodyne	HTR4	65	46
CN1CC[C@H]2CN(C(=O)C(=O)NCC3CCN(Cc4ccccc4)CC3)CC[C@@H]21	ZINC000875127758	GD	On-Demand	Anodyne	GRIN2B	43	36
CN1CC[C@H]2CN(C(=O)C(=O)NCC3CCN(Cc4ccccc4)CC3)CC[C@@H]21	ZINC000875127758	GD	On-Demand	Anodyne	SIGMAR1	53	44
CN1CC[C@H]2CN(C(=O)C(=O)NCC3CCN(Cc4ccccc4)CC3)CC[C@@H]21	ZINC000875127758	GD	On-Demand	Anodyne	BCHE	18	42
CN1CC[C@H]2CN(C(=O)C(=O)NCC3CCN(Cc4ccccc4)CC3)CC[C@@H]21	ZINC000875127758	GD	On-Demand	Anodyne	MCHR1	21	40
CN1CC[C@H]2CN(C(=O)C(=O)NCC3CCN(Cc4ccccc4)CC3)CC[C@@H]21	ZINC000875127758	GD	On-Demand	Anodyne	CACNA1I	76	42
COc1cccc([C@H](C)NC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875127826	CD	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@H](C)NC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875127826	CD	On-Demand	Anodyne	MTNR1A	41	42
COc1cccc([C@H](C)NC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875127826	CD	On-Demand	Anodyne	MTNR1B	39	42
COc1cccc([C@@H](C)NC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875127828	CD	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@@H](C)NC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875127828	CD	On-Demand	Anodyne	MTNR1A	41	42
COc1cccc([C@@H](C)NC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875127828	CD	On-Demand	Anodyne	MTNR1B	39	42
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1c(Cl)ccc(F)c1Cl	ZINC000875127889	GF	On-Demand	Anodyne	CACNA1H	65	41
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1c(Cl)ccc(F)c1Cl	ZINC000875127889	GF	On-Demand	Anodyne	CCR1	47	38
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1c(Cl)ccc(F)c1Cl	ZINC000875127889	GF	On-Demand	Anodyne	MET	21	43
C[C@@H](NC(=O)N1CC[C@H](c2ccc(O)cc2)C1)c1c(F)cccc1F	ZINC000875127892	EH	On-Demand	Anodyne	CACNA1H	41	36
C[C@@H](NC(=O)N1CC[C@H](c2ccc(O)cc2)C1)c1c(F)cccc1F	ZINC000875127892	EH	On-Demand	Anodyne	CCR1	34	43
C[C@@H](NC(=O)N1CC[C@@H](c2ccc(O)cc2)C1)c1c(F)cccc1F	ZINC000875127893	EH	On-Demand	Anodyne	CACNA1H	41	36
C[C@@H](NC(=O)N1CC[C@@H](c2ccc(O)cc2)C1)c1c(F)cccc1F	ZINC000875127893	EH	On-Demand	Anodyne	CCR1	34	43
CCC1(CC)CCCN1C(=O)NCc1ccc(CS(C)(=O)=O)cc1	ZINC000875127894	FG	On-Demand	Anodyne	SLC12A5	53	36
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H](C)CN2CCCC2=O)CC1	ZINC000875127923	FF	On-Demand	Anodyne	RBP4	37	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H](C)CN2CCCC2=O)CC1	ZINC000875127924	FF	On-Demand	Anodyne	RBP4	37	41
COc1ccccc1[C@H]1CCCN(C(=O)N[C@@H](C)CN2CCCC2=O)CC1	ZINC000875127926	FF	On-Demand	Anodyne	RBP4	37	41
COc1ccccc1[C@H]1CCCN(C(=O)N[C@H](C)CN2CCCC2=O)CC1	ZINC000875127927	FF	On-Demand	Anodyne	RBP4	37	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(CS(C)(=O)=O)cc1	ZINC000875127930	ED	On-Demand	Anodyne	ANPEP	15	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1c(F)cccc1F	ZINC000875128047	EF	On-Demand	Anodyne	SLC6A4	27	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1c(F)cccc1F	ZINC000875128047	EF	On-Demand	Anodyne	SLC6A3	55	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1c(F)cccc1F	ZINC000875128048	EF	On-Demand	Anodyne	SLC6A4	27	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1c(F)cccc1F	ZINC000875128048	EF	On-Demand	Anodyne	SLC6A3	55	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1c(F)cccc1F	ZINC000875128049	EF	On-Demand	Anodyne	SLC6A4	27	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1c(F)cccc1F	ZINC000875128049	EF	On-Demand	Anodyne	SLC6A3	55	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1c(F)cccc1F	ZINC000875128050	EF	On-Demand	Anodyne	SLC6A4	27	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1c(F)cccc1F	ZINC000875128050	EF	On-Demand	Anodyne	SLC6A3	55	41
C[C@@H](NC(=O)N1CCC(CCO)(CCO)CC1)c1c(F)cccc1F	ZINC000875128051	FF	On-Demand	Anodyne	CACNA1H	50	38
CCCCCCCNC(=O)C(=O)N[C@H](C)CN1CCCC1=O	ZINC000875128065	DD	On-Demand	Mild	ASAH1	85	35
CCCCCCCNC(=O)C(=O)N[C@@H](C)CN1CCCC1=O	ZINC000875128067	DD	On-Demand	Mild	ASAH1	85	35
CCCOc1ncccc1CNC(=O)C(=O)NCc1ncc(Cl)s1	ZINC000875128088	FD	On-Demand	Anodyne	SCN10A	20	43
O=C(NCc1cccc(F)c1F)C(=O)NC1CCN(CC2CCCCC2)CC1	ZINC000875128130	GF	On-Demand	Anodyne	SIGMAR1	23	45
O=C(NCc1cccc(F)c1F)C(=O)NC1CCN(CC2CCCCC2)CC1	ZINC000875128130	GF	On-Demand	Anodyne	CCR3	25	40
COc1cccc([C@@H](C)NC(=O)NCC[C@@H](O)C2CCCC2)c1	ZINC000875128155	DF	On-Demand	Anodyne	DRD4	40	30
COc1cccc([C@@H](C)NC(=O)NCC[C@@H](O)C2CCCC2)c1	ZINC000875128155	DF	On-Demand	Anodyne	MTNR1A	42	45
COc1cccc([C@@H](C)NC(=O)NCC[C@@H](O)C2CCCC2)c1	ZINC000875128155	DF	On-Demand	Anodyne	MTNR1B	38	45
COc1cccc([C@@H](C)NC(=O)NCC[C@H](O)C2CCCC2)c1	ZINC000875128156	DF	On-Demand	Anodyne	DRD4	40	30
COc1cccc([C@@H](C)NC(=O)NCC[C@H](O)C2CCCC2)c1	ZINC000875128156	DF	On-Demand	Anodyne	MTNR1A	42	45
COc1cccc([C@@H](C)NC(=O)NCC[C@H](O)C2CCCC2)c1	ZINC000875128156	DF	On-Demand	Anodyne	MTNR1B	38	45
COc1cccc([C@H](C)NC(=O)NCC[C@H](O)C2CCCC2)c1	ZINC000875128157	DF	On-Demand	Anodyne	DRD4	40	30
COc1cccc([C@H](C)NC(=O)NCC[C@H](O)C2CCCC2)c1	ZINC000875128157	DF	On-Demand	Anodyne	MTNR1A	42	45
COc1cccc([C@H](C)NC(=O)NCC[C@H](O)C2CCCC2)c1	ZINC000875128157	DF	On-Demand	Anodyne	MTNR1B	38	45
COc1cccc([C@H](C)NC(=O)NCC[C@@H](O)C2CCCC2)c1	ZINC000875128158	DF	On-Demand	Anodyne	DRD4	40	30
COc1cccc([C@H](C)NC(=O)NCC[C@@H](O)C2CCCC2)c1	ZINC000875128158	DF	On-Demand	Anodyne	MTNR1A	42	45
COc1cccc([C@H](C)NC(=O)NCC[C@@H](O)C2CCCC2)c1	ZINC000875128158	DF	On-Demand	Anodyne	MTNR1B	38	45
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875128159	GE	On-Demand	Anodyne	DRD2	20	48
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875128159	GE	On-Demand	Anodyne	DRD4	46	48
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875128159	GE	On-Demand	Anodyne	ACHE	55	48
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875128159	GE	On-Demand	Anodyne	DRD3	16	45
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875128159	GE	On-Demand	Anodyne	HTR4	48	46
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875128159	GE	On-Demand	Anodyne	GRIN2B	58	36
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875128159	GE	On-Demand	Anodyne	SIGMAR1	65	48
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875128159	GE	On-Demand	Anodyne	BCHE	15	44
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875128159	GE	On-Demand	Anodyne	MCHR1	18	40
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875128159	GE	On-Demand	Anodyne	CACNA1G	20	41
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875128159	GE	On-Demand	Anodyne	CACNA1I	63	42
Cc1nccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)n1	ZINC000875128216	EF	On-Demand	Anodyne	CPT1A	82	35
O=C(NCCS(=O)(=O)Cc1ccccc1)C(=O)N1CCC(CCF)CC1	ZINC000875128243	GD	On-Demand	Anodyne	ACHE	29	45
O=C(NCCS(=O)(=O)Cc1ccccc1)C(=O)N1CCC(CCF)CC1	ZINC000875128243	GD	On-Demand	Anodyne	GRIN2B	40	34
O=C(NCCS(=O)(=O)Cc1ccccc1)C(=O)N1CCC(CCF)CC1	ZINC000875128243	GD	On-Demand	Anodyne	ST14	52	34
O=C(NCCS(=O)(=O)Cc1ccccc1)C(=O)N1CCC(CCF)CC1	ZINC000875128243	GD	On-Demand	Anodyne	SFRP1	83	33
O=C(NCCS(=O)(=O)Cc1ccccc1)C(=O)N1CCC(CCF)CC1	ZINC000875128243	GD	On-Demand	Anodyne	WNT3	51	33
Cc1nccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)n1	ZINC000875128315	EF	On-Demand	Anodyne	CPT1A	82	35
Cc1nccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)n1	ZINC000875128316	EF	On-Demand	Anodyne	CPT1A	82	35
Cc1nccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)n1	ZINC000875128317	EF	On-Demand	Anodyne	CPT1A	82	35
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(S(=O)(=O)N(C)C)cc1	ZINC000875128320	GD	On-Demand	Anodyne	NPY2R	17	45
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(S(=O)(=O)N(C)C)cc1	ZINC000875128322	GD	On-Demand	Anodyne	NPY2R	17	45
Cc1nccc(CNC(=O)N2C[C@@H]3C[C@H]2CN3c2ccccc2)n1	ZINC000875128366	DD	On-Demand	Anodyne	PDE8B	40	32
C[C@@H](NC(=O)N1CCCC(F)(F)CC1)c1c(F)cccc1F	ZINC000875128405	DH	On-Demand	Anodyne	CACNA1H	53	39
CC(=O)C1CCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875128423	GD	On-Demand	Anodyne	CHRM2	20	41
CC(=O)C1CCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875128423	GD	On-Demand	Anodyne	DRD2	27	51
CC(=O)C1CCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875128423	GD	On-Demand	Anodyne	DRD4	54	51
CC(=O)C1CCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875128423	GD	On-Demand	Anodyne	ACHE	60	51
CC(=O)C1CCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875128423	GD	On-Demand	Anodyne	HRH1	16	41
CC(=O)C1CCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875128423	GD	On-Demand	Anodyne	DRD3	18	45
CC(=O)C1CCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875128423	GD	On-Demand	Anodyne	SLC6A3	15	42
CC(=O)C1CCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875128423	GD	On-Demand	Anodyne	HTR4	63	51
CC(=O)C1CCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875128423	GD	On-Demand	Anodyne	GRIN2B	61	38
CC(=O)C1CCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875128423	GD	On-Demand	Anodyne	LTA4H	22	41
CC(=O)C1CCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875128423	GD	On-Demand	Anodyne	HRH3	19	49
CC(=O)C1CCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875128423	GD	On-Demand	Anodyne	SIGMAR1	71	48
CC(=O)C1CCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875128423	GD	On-Demand	Anodyne	BCHE	17	44
CC(=O)C1CCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875128423	GD	On-Demand	Anodyne	CCR3	48	39
CC(=O)C1CCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875128423	GD	On-Demand	Anodyne	CCR5	20	44
CC(=O)C1CCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875128423	GD	On-Demand	Anodyne	MCHR1	29	42
CC(=O)C1CCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875128423	GD	On-Demand	Anodyne	CACNA1G	38	45
CC(=O)C1CCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875128423	GD	On-Demand	Anodyne	CACNA1I	69	44
O=CN1CCCN(C(=O)NCc2cccc(NC(=O)c3cccc(F)c3)c2)CC1	ZINC000875128425	GE	On-Demand	Anodyne	TAAR1	36	41
O=CN1CCCN(C(=O)NCc2cccc(NC(=O)c3cccc(F)c3)c2)CC1	ZINC000875128425	GE	On-Demand	Anodyne	KCNK3	88	48
O=CN1CCCN(C(=O)NCc2cccc(NC(=O)c3cccc(F)c3)c2)CC1	ZINC000875128425	GE	On-Demand	Anodyne	KCNK9	46	43
CCCOc1ncccc1CNC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875128431	GE	On-Demand	Anodyne	SIRT3	43	34
CCCOc1ncccc1CNC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875128431	GE	On-Demand	Anodyne	SIRT2	47	34
CCCOc1ncccc1CNC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875128431	GE	On-Demand	Anodyne	SIRT1	43	34
COc1cccc([C@@H](C)NC(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875128460	DD	On-Demand	Anodyne	CACNA1H	35	42
COc1cccc([C@@H](C)NC(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875128460	DD	On-Demand	Anodyne	DRD4	41	31
COc1cccc([C@@H](C)NC(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875128460	DD	On-Demand	Anodyne	MTNR1A	36	41
COc1cccc([C@@H](C)NC(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875128460	DD	On-Demand	Anodyne	MTNR1B	44	41
COc1cccc([C@H](C)NC(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875128463	DD	On-Demand	Anodyne	CACNA1H	35	42
COc1cccc([C@H](C)NC(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875128463	DD	On-Demand	Anodyne	DRD4	41	31
COc1cccc([C@H](C)NC(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875128463	DD	On-Demand	Anodyne	MTNR1A	36	41
COc1cccc([C@H](C)NC(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875128463	DD	On-Demand	Anodyne	MTNR1B	44	41
COc1cccc([C@@H](C)NC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875128491	EH	On-Demand	Anodyne	EPHX2	15	45
COc1cccc([C@H](C)NC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875128494	EH	On-Demand	Anodyne	EPHX2	15	45
COc1cccc([C@@H](C)NC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875128495	EH	On-Demand	Anodyne	EPHX2	15	45
COc1cccc([C@H](C)NC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875128498	EH	On-Demand	Anodyne	EPHX2	15	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(CS(C)(=O)=O)cc1	ZINC000875128502	GD	On-Demand	Anodyne	PLG	50	31
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(CS(C)(=O)=O)cc1	ZINC000875128502	GD	On-Demand	Anodyne	SLC6A3	49	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(CS(C)(=O)=O)cc1	ZINC000875128505	GD	On-Demand	Anodyne	PLG	50	31
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(CS(C)(=O)=O)cc1	ZINC000875128505	GD	On-Demand	Anodyne	SLC6A3	49	39
COc1cccc([C@@H](C)NC(=O)N(C)OCC(F)(F)F)c1	ZINC000875128516	DF	On-Demand	Anodyne	MTNR1A	27	42
COc1cccc([C@@H](C)NC(=O)N(C)OCC(F)(F)F)c1	ZINC000875128516	DF	On-Demand	Anodyne	MTNR1B	30	42
COc1cccc([C@H](C)NC(=O)N(C)OCC(F)(F)F)c1	ZINC000875128518	DF	On-Demand	Anodyne	MTNR1A	27	42
COc1cccc([C@H](C)NC(=O)N(C)OCC(F)(F)F)c1	ZINC000875128518	DF	On-Demand	Anodyne	MTNR1B	30	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cccc(OC)c1	ZINC000875128543	EE	On-Demand	Anodyne	SLC6A4	24	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cccc(OC)c1	ZINC000875128543	EE	On-Demand	Anodyne	SLC6A3	47	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cccc(OC)c1	ZINC000875128545	EE	On-Demand	Anodyne	SLC6A4	24	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cccc(OC)c1	ZINC000875128545	EE	On-Demand	Anodyne	SLC6A3	47	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cccc(OC)c1	ZINC000875128546	EE	On-Demand	Anodyne	SLC6A4	24	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cccc(OC)c1	ZINC000875128546	EE	On-Demand	Anodyne	SLC6A3	47	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cccc(OC)c1	ZINC000875128548	EE	On-Demand	Anodyne	SLC6A4	24	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cccc(OC)c1	ZINC000875128548	EE	On-Demand	Anodyne	SLC6A3	47	44
CCCCCCCNC(=O)C(=O)NC1CCC(C(=O)NC)CC1	ZINC000875128576	ED	On-Demand	Mild	LASR	42	30
COCCN(CC1CCN(C)CC1)C(=O)NCc1cc([N+](=O)[O-])ccc1OC	ZINC000875128584	GE	On-Demand	Bother	ACKR3	44	31
CC(C)(C)N1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875128676	EG	On-Demand	Anodyne	EPHX2	50	43
COc1cccc([C@H](C)NC(=O)NC2(C)CC(F)(F)C2)c1	ZINC000875128687	CG	On-Demand	Anodyne	MTNR1A	24	41
COc1cccc([C@H](C)NC(=O)NC2(C)CC(F)(F)C2)c1	ZINC000875128687	CG	On-Demand	Anodyne	MTNR1B	28	41
COc1cccc([C@@H](C)NC(=O)NC2(C)CC(F)(F)C2)c1	ZINC000875128689	CG	On-Demand	Anodyne	MTNR1A	24	41
COc1cccc([C@@H](C)NC(=O)NC2(C)CC(F)(F)C2)c1	ZINC000875128689	CG	On-Demand	Anodyne	MTNR1B	28	41
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)N2CCCc3cc(C)ccc32)cc1	ZINC000875128703	HF	On-Demand	Anodyne	AVPR2	17	40
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)N2CCCc3cc(C)ccc32)cc1	ZINC000875128703	HF	On-Demand	Anodyne	IDO1	31	41
CC(C)(C)N1CCC(NC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875128710	GH	On-Demand	Mild	MCHR1	24	43
CC(C)(C)N1CCC(NC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875128716	GH	On-Demand	Mild	MCHR1	24	43
C[C@@H](NC(=O)NC(C)(C)C(C)(C)O)c1c(F)cccc1F	ZINC000875128785	DF	On-Demand	Anodyne	DAC	22	40
C[C@H](NC(=O)NC(C)(C)C(C)(C)O)c1c(F)cccc1F	ZINC000875128786	DF	On-Demand	Anodyne	DAC	22	40
CC[C@@H](NC(=O)NCc1ccc(CS(C)(=O)=O)cc1)[C@@H](O)c1ccccc1	ZINC000875128787	GF	On-Demand	Anodyne	ANPEP	15	43
CC[C@@H](NC(=O)NCc1ccc(CS(C)(=O)=O)cc1)[C@@H](O)c1ccccc1	ZINC000875128787	GF	On-Demand	Anodyne	TACR3	23	40
CC[C@@H](NC(=O)NCc1ccc(CS(C)(=O)=O)cc1)[C@@H](O)c1ccccc1	ZINC000875128787	GF	On-Demand	Anodyne	PDS	42	34
NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N(C3CC3)C3CC3)cc2)C1	ZINC000875128804	FE	On-Demand	Clean	TMPRSS11D	48	33
NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N(C3CC3)C3CC3)cc2)C1	ZINC000875128805	FE	On-Demand	Clean	TMPRSS11D	48	33
O=CN1CCCN(C(=O)NCc2cccc(NC(=O)c3ccc(F)cc3)c2)CC1	ZINC000875128820	GE	On-Demand	Anodyne	TAAR1	40	39
O=CN1CCCN(C(=O)NCc2cccc(NC(=O)c3ccc(F)cc3)c2)CC1	ZINC000875128820	GE	On-Demand	Anodyne	KCNK3	68	47
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H](C)c1cccc(OC)c1	ZINC000875128834	FF	On-Demand	Anodyne	DRD4	41	31
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H](C)c1cccc(OC)c1	ZINC000875128834	FF	On-Demand	Anodyne	CASR	22	40
COCCN(CC1CCN(C)CC1)C(=O)N[C@H](C)c1cccc(OC)c1	ZINC000875128838	FF	On-Demand	Anodyne	DRD4	41	31
COCCN(CC1CCN(C)CC1)C(=O)N[C@H](C)c1cccc(OC)c1	ZINC000875128838	FF	On-Demand	Anodyne	CASR	22	40
Cc1nccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)n1	ZINC000875128841	EE	On-Demand	Anodyne	TRY1_BOVIN	40	35
Cc1nccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)n1	ZINC000875128844	EE	On-Demand	Anodyne	TRY1_BOVIN	40	35
Cc1nccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)n1	ZINC000875128846	EE	On-Demand	Anodyne	TRY1_BOVIN	40	35
Cc1nccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)n1	ZINC000875128847	EE	On-Demand	Anodyne	TRY1_BOVIN	40	35
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CCCC[C@H]1c1ccccc1	ZINC000875128850	ED	On-Demand	Mild	GRIA4	15	40
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CCCC[C@@H]1c1ccccc1	ZINC000875128851	ED	On-Demand	Mild	GRIA4	15	40
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000875128852	ED	On-Demand	Mild	GRIA4	15	40
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CCCC[C@H]1c1ccccc1	ZINC000875128853	ED	On-Demand	Mild	GRIA4	15	40
Cc1nccc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)n1	ZINC000875128862	ED	On-Demand	Anodyne	FAAH	18	40
CC[C@@H](NC(=O)NCc1ccc(CS(C)(=O)=O)cc1)[C@H](O)c1ccccc1	ZINC000875128883	GF	On-Demand	Anodyne	ANPEP	15	43
CC[C@@H](NC(=O)NCc1ccc(CS(C)(=O)=O)cc1)[C@H](O)c1ccccc1	ZINC000875128883	GF	On-Demand	Anodyne	TACR3	23	40
CC[C@@H](NC(=O)NCc1ccc(CS(C)(=O)=O)cc1)[C@H](O)c1ccccc1	ZINC000875128883	GF	On-Demand	Anodyne	PDS	42	34
O=C(NCCc1ccc(F)c(Br)c1)N1CCC2(CCNC2=O)CC1	ZINC000875128962	GE	On-Demand	Anodyne	CACNA1H	43	33
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(Oc3cccnc3)c(F)c2)CC1	ZINC000875128964	GE	On-Demand	Anodyne	NAMPT	58	35
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(CS(C)(=O)=O)cc2)C1	ZINC000875128985	GD	On-Demand	Anodyne	TMPRSS11D	62	34
COc1cccc([C@H](C)NC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)c1	ZINC000875129046	FE	On-Demand	Anodyne	ROCK1	15	40
COc1cccc([C@H](C)NC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)c1	ZINC000875129046	FE	On-Demand	Anodyne	MTNR1A	29	41
COc1cccc([C@H](C)NC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)c1	ZINC000875129046	FE	On-Demand	Anodyne	MTNR1B	35	41
COc1cccc([C@@H](C)NC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)c1	ZINC000875129050	FE	On-Demand	Anodyne	ROCK1	15	40
COc1cccc([C@@H](C)NC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)c1	ZINC000875129050	FE	On-Demand	Anodyne	MTNR1A	29	41
COc1cccc([C@@H](C)NC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)c1	ZINC000875129050	FE	On-Demand	Anodyne	MTNR1B	35	41
COc1cccc([C@@H](C)NC(=O)NNc2cccc(C)n2)c1	ZINC000875129059	DF	On-Demand	Reactive	MTNR1A	25	40
COc1cccc([C@@H](C)NC(=O)NNc2cccc(C)n2)c1	ZINC000875129059	DF	On-Demand	Reactive	MTNR1B	25	40
COc1cccc([C@@H](C)NC(=O)NNc2cccc(C)n2)c1	ZINC000875129059	DF	On-Demand	Reactive	GRM5	19	40
COc1cccc([C@H](C)NC(=O)NNc2cccc(C)n2)c1	ZINC000875129061	DF	On-Demand	Reactive	MTNR1A	25	40
COc1cccc([C@H](C)NC(=O)NNc2cccc(C)n2)c1	ZINC000875129061	DF	On-Demand	Reactive	MTNR1B	25	40
COc1cccc([C@H](C)NC(=O)NNc2cccc(C)n2)c1	ZINC000875129061	DF	On-Demand	Reactive	GRM5	19	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(C)cc1C	ZINC000875129139	EG	On-Demand	Anodyne	SLC6A4	21	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(C)cc1C	ZINC000875129139	EG	On-Demand	Anodyne	SLC6A3	46	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(C)cc1C	ZINC000875129141	EG	On-Demand	Anodyne	SLC6A4	21	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(C)cc1C	ZINC000875129141	EG	On-Demand	Anodyne	SLC6A3	46	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(C)cc1C	ZINC000875129143	EG	On-Demand	Anodyne	SLC6A4	21	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(C)cc1C	ZINC000875129143	EG	On-Demand	Anodyne	SLC6A3	46	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(C)cc1C	ZINC000875129144	EG	On-Demand	Anodyne	SLC6A4	21	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(C)cc1C	ZINC000875129144	EG	On-Demand	Anodyne	SLC6A3	46	40
CCCOc1ncccc1CNC(=O)C(=O)N1CCC[C@@H]1c1cncc(C)c1	ZINC000875129154	GF	On-Demand	Anodyne	SCN10A	19	40
CCCOc1ncccc1CNC(=O)C(=O)N1CCC[C@H]1c1cncc(C)c1	ZINC000875129156	GF	On-Demand	Anodyne	SCN10A	19	40
COC(=O)C1(O)CN(C(=O)N[C@@H](C)c2cccc(OC)c2)C1	ZINC000875129168	DC	On-Demand	Anodyne	MTNR1A	28	41
COC(=O)C1(O)CN(C(=O)N[C@@H](C)c2cccc(OC)c2)C1	ZINC000875129168	DC	On-Demand	Anodyne	MTNR1B	33	41
COC(=O)C1(O)CN(C(=O)N[C@H](C)c2cccc(OC)c2)C1	ZINC000875129169	DC	On-Demand	Anodyne	MTNR1A	28	41
COC(=O)C1(O)CN(C(=O)N[C@H](C)c2cccc(OC)c2)C1	ZINC000875129169	DC	On-Demand	Anodyne	MTNR1B	33	41
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1c(F)cccc1F	ZINC000875129205	FH	On-Demand	Anodyne	CACNA1H	54	39
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3cccc(NC(=O)C4CCCC4)c3)C[C@@H]1C2	ZINC000875129328	GF	On-Demand	Anodyne	EPHX2	25	40
O=C(NCc1cccc2[nH]ccc12)C(=O)NC1CCN(CC2CCCCC2)CC1	ZINC000875129344	GF	On-Demand	Anodyne	NMBR	17	40
COCC(C)(C)CCNC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129390	GE	On-Demand	Anodyne	CHRM2	17	44
COCC(C)(C)CCNC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129390	GE	On-Demand	Anodyne	DRD2	32	52
COCC(C)(C)CCNC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129390	GE	On-Demand	Anodyne	DRD4	59	52
COCC(C)(C)CCNC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129390	GE	On-Demand	Anodyne	ACHE	64	52
COCC(C)(C)CCNC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129390	GE	On-Demand	Anodyne	HRH1	16	40
COCC(C)(C)CCNC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129390	GE	On-Demand	Anodyne	DRD3	26	46
COCC(C)(C)CCNC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129390	GE	On-Demand	Anodyne	SLC6A3	17	44
COCC(C)(C)CCNC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129390	GE	On-Demand	Anodyne	HTR4	57	49
COCC(C)(C)CCNC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129390	GE	On-Demand	Anodyne	SIGMAR1	68	47
COCC(C)(C)CCNC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129390	GE	On-Demand	Anodyne	BCHE	19	46
COCC(C)(C)CCNC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129390	GE	On-Demand	Anodyne	MCHR1	30	45
COCC(C)(C)CCNC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129390	GE	On-Demand	Anodyne	CACNA1G	42	44
COCC(C)(C)CCNC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129390	GE	On-Demand	Anodyne	CACNA1I	80	43
COc1cccc([C@H](C)NC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875129412	DF	On-Demand	Anodyne	DRD4	41	31
COc1cccc([C@H](C)NC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875129414	DF	On-Demand	Anodyne	DRD4	41	31
COc1cccc([C@@H](C)NC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875129416	DF	On-Demand	Anodyne	DRD4	41	31
COc1cccc([C@@H](C)NC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875129418	DF	On-Demand	Anodyne	DRD4	41	31
COc1cccc([C@@H](C)NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875129477	ED	On-Demand	Anodyne	MTNR1A	18	43
COc1cccc([C@@H](C)NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875129477	ED	On-Demand	Anodyne	MTNR1B	24	43
COc1cccc([C@@H](C)NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875129477	ED	On-Demand	Anodyne	MCHR1	20	44
COc1cccc([C@@H](C)NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875129477	ED	On-Demand	Anodyne	BIRC2	32	45
COc1cccc([C@@H](C)NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875129477	ED	On-Demand	Anodyne	HPGDS	22	42
COc1cccc([C@H](C)NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875129478	ED	On-Demand	Anodyne	MTNR1A	18	43
COc1cccc([C@H](C)NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875129478	ED	On-Demand	Anodyne	MTNR1B	24	43
COc1cccc([C@H](C)NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875129478	ED	On-Demand	Anodyne	MCHR1	20	44
COc1cccc([C@H](C)NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875129478	ED	On-Demand	Anodyne	BIRC2	32	45
COc1cccc([C@H](C)NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875129478	ED	On-Demand	Anodyne	HPGDS	22	42
C[C@@H](NC(=O)NC[C@H]1COCCO1)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000875129497	FF	On-Demand	Anodyne	PRCP	29	47
C[C@H](NC(=O)NC[C@@H]1COCCO1)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000875129498	FF	On-Demand	Anodyne	PRCP	29	47
C[C@H](NC(=O)NC[C@H]1COCCO1)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000875129499	FF	On-Demand	Anodyne	PRCP	29	47
C[C@@H](NC(=O)NC[C@@H]1COCCO1)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000875129500	FF	On-Demand	Anodyne	PRCP	29	47
O=CN1CCCN(C(=O)NCc2cccc(NC(=O)c3ccccn3)c2)CC1	ZINC000875129505	GD	On-Demand	Anodyne	GRM4	67	46
Cc1nccc(CNC(=O)N(C)C[C@H]2CCCCN2Cc2ccccc2)n1	ZINC000875129526	FF	On-Demand	Anodyne	CPT1A	60	35
COc1cccc([C@@H](C)NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)c1	ZINC000875129534	GH	On-Demand	Anodyne	OPRL1	22	46
COc1cccc([C@@H](C)NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)c1	ZINC000875129534	GH	On-Demand	Anodyne	NPY1R	15	46
COc1cccc([C@H](C)NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)c1	ZINC000875129535	GH	On-Demand	Anodyne	OPRL1	22	46
COc1cccc([C@H](C)NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)c1	ZINC000875129535	GH	On-Demand	Anodyne	NPY1R	15	46
Cc1nccc(CNC(=O)NC[C@H]2CN(Cc3ccccc3C)CCO2)n1	ZINC000875129548	FD	On-Demand	Anodyne	PDE8B	63	34
Cc1nccc(CNC(=O)NC[C@@H]2CN(Cc3ccccc3C)CCO2)n1	ZINC000875129549	FD	On-Demand	Anodyne	PDE8B	63	34
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)C(=O)N2CCC(CCF)CC2)C1	ZINC000875129595	GE	On-Demand	Anodyne	CACNA1I	46	33
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)C(=O)N2CCC(CCF)CC2)C1	ZINC000875129596	GE	On-Demand	Anodyne	CACNA1I	46	33
O=C(Nc1cccc(CNC(=O)N2Cc3cccc(O)c3C2)c1)C1CCCC1	ZINC000875129601	GH	On-Demand	Clean	NAMPT	26	41
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875129608	FE	On-Demand	Anodyne	CHRM2	17	41
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875129608	FE	On-Demand	Anodyne	DRD2	26	47
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875129608	FE	On-Demand	Anodyne	DRD4	50	47
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875129608	FE	On-Demand	Anodyne	ACHE	57	47
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875129608	FE	On-Demand	Anodyne	DRD3	18	43
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875129608	FE	On-Demand	Anodyne	SLC6A3	16	43
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875129608	FE	On-Demand	Anodyne	HTR4	50	45
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875129608	FE	On-Demand	Anodyne	CHRM3	20	41
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875129608	FE	On-Demand	Anodyne	SIGMAR1	80	46
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875129608	FE	On-Demand	Anodyne	BCHE	19	41
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875129608	FE	On-Demand	Anodyne	MCHR1	18	41
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875129608	FE	On-Demand	Anodyne	CACNA1G	25	46
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875129608	FE	On-Demand	Anodyne	CACNA1I	60	41
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875129608	FE	On-Demand	Anodyne	NPFFR1	41	36
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875129609	FE	On-Demand	Anodyne	CHRM2	17	41
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875129609	FE	On-Demand	Anodyne	DRD2	26	47
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875129609	FE	On-Demand	Anodyne	DRD4	50	47
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875129609	FE	On-Demand	Anodyne	ACHE	57	47
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875129609	FE	On-Demand	Anodyne	DRD3	18	43
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875129609	FE	On-Demand	Anodyne	SLC6A3	16	43
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875129609	FE	On-Demand	Anodyne	HTR4	50	45
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875129609	FE	On-Demand	Anodyne	CHRM3	20	41
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875129609	FE	On-Demand	Anodyne	SIGMAR1	80	46
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875129609	FE	On-Demand	Anodyne	BCHE	19	41
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875129609	FE	On-Demand	Anodyne	MCHR1	18	41
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875129609	FE	On-Demand	Anodyne	CACNA1G	25	46
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875129609	FE	On-Demand	Anodyne	CACNA1I	60	41
O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875129609	FE	On-Demand	Anodyne	NPFFR1	41	36
C#CC[C@@H](COC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129651	FD	On-Demand	Mild	DRD2	22	51
C#CC[C@@H](COC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129651	FD	On-Demand	Mild	DRD4	42	51
C#CC[C@@H](COC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129651	FD	On-Demand	Mild	ACHE	53	49
C#CC[C@@H](COC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129651	FD	On-Demand	Mild	DRD3	17	43
C#CC[C@@H](COC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129651	FD	On-Demand	Mild	SLC6A3	22	46
C#CC[C@@H](COC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129651	FD	On-Demand	Mild	HTR4	46	49
C#CC[C@@H](COC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129651	FD	On-Demand	Mild	SIGMAR1	50	46
C#CC[C@@H](COC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129651	FD	On-Demand	Mild	BCHE	15	42
C#CC[C@@H](COC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129651	FD	On-Demand	Mild	MCHR1	15	40
C#CC[C@@H](COC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129651	FD	On-Demand	Mild	CACNA1I	60	40
C#CC[C@H](COC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129652	FD	On-Demand	Mild	DRD2	22	51
C#CC[C@H](COC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129652	FD	On-Demand	Mild	DRD4	42	51
C#CC[C@H](COC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129652	FD	On-Demand	Mild	ACHE	53	49
C#CC[C@H](COC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129652	FD	On-Demand	Mild	DRD3	17	43
C#CC[C@H](COC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129652	FD	On-Demand	Mild	SLC6A3	22	46
C#CC[C@H](COC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129652	FD	On-Demand	Mild	HTR4	46	49
C#CC[C@H](COC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129652	FD	On-Demand	Mild	SIGMAR1	50	46
C#CC[C@H](COC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129652	FD	On-Demand	Mild	BCHE	15	42
C#CC[C@H](COC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129652	FD	On-Demand	Mild	MCHR1	15	40
C#CC[C@H](COC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129652	FD	On-Demand	Mild	CACNA1I	60	40
COc1cccc([C@@H](C)NC(=O)N2Cc3cccc(O)c3C2)c1	ZINC000875129653	DG	On-Demand	Clean	DRD4	41	31
COc1cccc([C@H](C)NC(=O)N2Cc3cccc(O)c3C2)c1	ZINC000875129654	DG	On-Demand	Clean	DRD4	41	31
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccnc(C)n1	ZINC000875129657	DD	On-Demand	Anodyne	SLC6A3	49	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccnc(C)n1	ZINC000875129658	DD	On-Demand	Anodyne	SLC6A3	49	39
COc1cccc([C@H](C)NC(=O)N(C)CCN2CC3(CCOCC3)C2)c1	ZINC000875129663	FF	On-Demand	Anodyne	DRD4	40	31
COc1cccc([C@H](C)NC(=O)N(C)CCN2CC3(CCOCC3)C2)c1	ZINC000875129663	FF	On-Demand	Anodyne	CASR	48	46
COc1cccc([C@@H](C)NC(=O)N(C)CCN2CC3(CCOCC3)C2)c1	ZINC000875129664	FF	On-Demand	Anodyne	DRD4	40	31
COc1cccc([C@@H](C)NC(=O)N(C)CCN2CC3(CCOCC3)C2)c1	ZINC000875129664	FF	On-Demand	Anodyne	CASR	48	46
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129667	GD	On-Demand	Anodyne	DRD2	25	48
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129667	GD	On-Demand	Anodyne	DRD4	44	48
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129667	GD	On-Demand	Anodyne	ACHE	57	47
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129667	GD	On-Demand	Anodyne	SLC6A1	73	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129667	GD	On-Demand	Anodyne	DRD3	17	45
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129667	GD	On-Demand	Anodyne	HTR4	50	48
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129667	GD	On-Demand	Anodyne	HRH3	23	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129667	GD	On-Demand	Anodyne	SIGMAR1	56	46
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129667	GD	On-Demand	Anodyne	BCHE	15	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129667	GD	On-Demand	Anodyne	CCR3	40	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129667	GD	On-Demand	Anodyne	CACNA1G	34	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129667	GD	On-Demand	Anodyne	CACNA1I	66	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129668	GD	On-Demand	Anodyne	DRD2	25	48
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129668	GD	On-Demand	Anodyne	DRD4	44	48
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129668	GD	On-Demand	Anodyne	ACHE	57	47
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129668	GD	On-Demand	Anodyne	SLC6A1	73	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129668	GD	On-Demand	Anodyne	DRD3	17	45
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129668	GD	On-Demand	Anodyne	HTR4	50	48
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129668	GD	On-Demand	Anodyne	HRH3	23	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129668	GD	On-Demand	Anodyne	SIGMAR1	56	46
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129668	GD	On-Demand	Anodyne	BCHE	15	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129668	GD	On-Demand	Anodyne	CCR3	40	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129668	GD	On-Demand	Anodyne	CACNA1G	34	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129668	GD	On-Demand	Anodyne	CACNA1I	66	42
COc1cccc([C@@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)c1	ZINC000875129680	ED	On-Demand	Anodyne	DRD4	44	34
COc1cccc([C@@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)c1	ZINC000875129680	ED	On-Demand	Anodyne	NQO2	18	41
COc1cccc([C@@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)c1	ZINC000875129680	ED	On-Demand	Anodyne	MTNR1A	51	48
COc1cccc([C@@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)c1	ZINC000875129680	ED	On-Demand	Anodyne	MTNR1B	53	48
COc1cccc([C@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)c1	ZINC000875129681	ED	On-Demand	Anodyne	DRD4	44	34
COc1cccc([C@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)c1	ZINC000875129681	ED	On-Demand	Anodyne	NQO2	18	41
COc1cccc([C@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)c1	ZINC000875129681	ED	On-Demand	Anodyne	MTNR1A	51	48
COc1cccc([C@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)c1	ZINC000875129681	ED	On-Demand	Anodyne	MTNR1B	53	48
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129710	GD	On-Demand	Mild	CHRM2	15	41
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129710	GD	On-Demand	Mild	DRD2	24	50
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129710	GD	On-Demand	Mild	DRD4	47	50
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129710	GD	On-Demand	Mild	ACHE	53	50
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129710	GD	On-Demand	Mild	DRD3	22	46
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129710	GD	On-Demand	Mild	SLC6A3	21	43
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129710	GD	On-Demand	Mild	HTR4	59	50
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129710	GD	On-Demand	Mild	SIGMAR1	48	45
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129710	GD	On-Demand	Mild	BCHE	15	43
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129710	GD	On-Demand	Mild	MCHR1	18	42
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129710	GD	On-Demand	Mild	CACNA1I	62	42
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129711	GD	On-Demand	Mild	CHRM2	15	41
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129711	GD	On-Demand	Mild	DRD2	24	50
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129711	GD	On-Demand	Mild	DRD4	47	50
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129711	GD	On-Demand	Mild	ACHE	53	50
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129711	GD	On-Demand	Mild	DRD3	22	46
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129711	GD	On-Demand	Mild	SLC6A3	21	43
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129711	GD	On-Demand	Mild	HTR4	59	50
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129711	GD	On-Demand	Mild	SIGMAR1	48	45
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129711	GD	On-Demand	Mild	BCHE	15	43
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129711	GD	On-Demand	Mild	MCHR1	18	42
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875129711	GD	On-Demand	Mild	CACNA1I	62	42
COc1cccc([C@H](C)NC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875129726	EG	On-Demand	Anodyne	CACNA1H	34	41
COc1cccc([C@H](C)NC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875129726	EG	On-Demand	Anodyne	DRD4	41	31
COc1cccc([C@@H](C)NC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875129727	EG	On-Demand	Anodyne	CACNA1H	34	41
COc1cccc([C@@H](C)NC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875129727	EG	On-Demand	Anodyne	DRD4	41	31
COc1cccc([C@H](C)NC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875129753	DF	On-Demand	Anodyne	REN	17	47
COc1cccc([C@@H](C)NC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875129754	DF	On-Demand	Anodyne	REN	17	47
COc1cccc([C@@H](C)NC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875129755	DF	On-Demand	Anodyne	REN	17	47
COc1cccc([C@H](C)NC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875129756	DF	On-Demand	Anodyne	REN	17	47
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccnc(C)n2)CC1	ZINC000875129763	FG	On-Demand	Anodyne	EPHX2	15	42
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccnc(C)n2)CC1	ZINC000875129763	FG	On-Demand	Anodyne	MAP3K12	30	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccnc(C)n2)CC1	ZINC000875129764	FG	On-Demand	Anodyne	EPHX2	15	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccnc(C)n2)CC1	ZINC000875129764	FG	On-Demand	Anodyne	MAP3K12	30	40
O=C(NCc1cccc(NC(=O)c2ccc(F)cc2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875129767	FF	On-Demand	Anodyne	CCR3	53	38
O=C(NCc1cccc(NC(=O)c2ccc(F)cc2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875129767	FF	On-Demand	Anodyne	ROCK2	20	43
O=C(NCc1cccc(NC(=O)c2ccc(F)cc2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875129767	FF	On-Demand	Anodyne	KCNK3	71	48
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129772	GE	On-Demand	Anodyne	DRD2	21	49
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129772	GE	On-Demand	Anodyne	DRD4	49	49
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129772	GE	On-Demand	Anodyne	ACHE	55	47
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129772	GE	On-Demand	Anodyne	DRD3	15	46
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129772	GE	On-Demand	Anodyne	HTR4	60	45
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129772	GE	On-Demand	Anodyne	SIGMAR1	59	45
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129772	GE	On-Demand	Anodyne	BCHE	15	43
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129772	GE	On-Demand	Anodyne	MCHR1	18	41
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129772	GE	On-Demand	Anodyne	CACNA1G	28	40
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875129772	GE	On-Demand	Anodyne	CACNA1I	66	41
COc1cccc([C@H](C)NC(=O)N2CCN(C)C(C)(C)CC2)c1	ZINC000875129801	DF	On-Demand	Anodyne	DRD4	40	31
COc1cccc([C@@H](C)NC(=O)N2CCN(C)C(C)(C)CC2)c1	ZINC000875129802	DF	On-Demand	Anodyne	DRD4	40	31
CN1CCN(C(=O)NCc2cccc(NC(=O)c3ccccn3)c2)CCC1(C)C	ZINC000875129847	GF	On-Demand	Anodyne	GRM4	63	43
C[C@@H](CNC(=O)N1CCc2nc(C3CC3)ncc2C1)N1CCCCC1	ZINC000875129875	EE	On-Demand	Anodyne	MAPK1	40	39
O=C(NC[C@H]1CCCOC1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875129919	GF	On-Demand	Anodyne	SMO	22	41
C[C@H](NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1)c1ccnn1C	ZINC000875129953	GD	On-Demand	Anodyne	DRD2	23	46
C[C@H](NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1)c1ccnn1C	ZINC000875129953	GD	On-Demand	Anodyne	DRD4	44	46
C[C@H](NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1)c1ccnn1C	ZINC000875129953	GD	On-Demand	Anodyne	ACHE	56	47
C[C@H](NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1)c1ccnn1C	ZINC000875129953	GD	On-Demand	Anodyne	DRD3	16	41
C[C@H](NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1)c1ccnn1C	ZINC000875129953	GD	On-Demand	Anodyne	SLC6A3	16	40
C[C@H](NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1)c1ccnn1C	ZINC000875129953	GD	On-Demand	Anodyne	HTR4	73	51
C[C@H](NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1)c1ccnn1C	ZINC000875129953	GD	On-Demand	Anodyne	SIGMAR1	57	42
C[C@H](NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1)c1ccnn1C	ZINC000875129953	GD	On-Demand	Anodyne	BCHE	18	41
C[C@H](NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1)c1ccnn1C	ZINC000875129953	GD	On-Demand	Anodyne	CCR3	43	42
C[C@H](NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1)c1ccnn1C	ZINC000875129953	GD	On-Demand	Anodyne	FAAH	15	41
C[C@H](NC(=O)C(=O)NCC1CCN(Cc2ccccc2)CC1)c1ccnn1C	ZINC000875129953	GD	On-Demand	Anodyne	CACNA1I	66	40
COC[C@H](C)CNC(=O)C(=O)NC[C@H]1CN(Cc2cccc(C)c2)CCO1	ZINC000875130029	GC	On-Demand	Anodyne	DRD4	21	40
COC[C@@H](C)CNC(=O)C(=O)NC[C@@H]1CN(Cc2cccc(C)c2)CCO1	ZINC000875130030	GC	On-Demand	Anodyne	DRD4	21	40
COC[C@H](C)CNC(=O)C(=O)NC[C@@H]1CN(Cc2cccc(C)c2)CCO1	ZINC000875130031	GC	On-Demand	Anodyne	DRD4	21	40
COC[C@@H](C)CNC(=O)C(=O)NC[C@H]1CN(Cc2cccc(C)c2)CCO1	ZINC000875130032	GC	On-Demand	Anodyne	DRD4	21	40
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1	ZINC000875130054	GD	On-Demand	Clean	DPP7	49	35
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1	ZINC000875130055	GD	On-Demand	Clean	DPP7	49	35
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)C1	ZINC000875130056	GD	On-Demand	Clean	DPP7	49	35
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)C1	ZINC000875130057	GD	On-Demand	Clean	DPP7	49	35
COC[C@H](C)CNC(=O)C(=O)NC[C@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000875130121	GC	On-Demand	Anodyne	DRD4	17	43
COC[C@@H](C)CNC(=O)C(=O)NC[C@@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000875130122	GC	On-Demand	Anodyne	DRD4	17	43
COC[C@H](C)CNC(=O)C(=O)NC[C@@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000875130123	GC	On-Demand	Anodyne	DRD4	17	43
COC[C@@H](C)CNC(=O)C(=O)NC[C@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000875130124	GC	On-Demand	Anodyne	DRD4	17	43
O=C(NC[C@H]1CCCOC1)NNc1ccc(OCc2ccccc2)cc1	ZINC000875130146	FG	On-Demand	Reactive	LTA4H	24	42
O=C1CCCN1Cc1ccc(CNC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875130188	FF	On-Demand	Clean	NAMPT	25	44
O=C(NC[C@H]1CCCOC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875130197	DE	On-Demand	Anodyne	EPHX2	16	40
O=C(NC[C@H]1CCCOC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875130199	DE	On-Demand	Anodyne	EPHX2	16	40
CC[C@@H](NC(=O)NCCC(=O)NC1CCCCC1)[C@H](O)c1ccccc1	ZINC000875130208	FF	On-Demand	Anodyne	EPHX2	21	48
CC[C@@H](NC(=O)NCCC(=O)NC1CCCCC1)[C@@H](O)c1ccccc1	ZINC000875130209	FF	On-Demand	Anodyne	EPHX2	21	48
COC[C@H](C)CNC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875130217	FD	On-Demand	Anodyne	NPY2R	73	38
COC[C@@H](C)CNC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875130218	FD	On-Demand	Anodyne	NPY2R	73	38
O=C(NCc1ccc(CN2CCCC2=O)cc1)NC1CC(Nc2ccccc2)C1	ZINC000875130293	GG	On-Demand	Anodyne	LTA4H	23	42
C[C@@H](CNC(=O)N1CC(Cc2cccs2)C1)N1CCCCC1	ZINC000875130384	DF	On-Demand	Anodyne	DPP7	18	43
C[C@H](CNC(=O)N1CC(Cc2cccs2)C1)N1CCCCC1	ZINC000875130385	DF	On-Demand	Anodyne	DPP7	18	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(CN2CCCC2=O)cc1	ZINC000875130406	GE	On-Demand	Anodyne	SLC6A3	40	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(CN2CCCC2=O)cc1	ZINC000875130407	GE	On-Demand	Anodyne	SLC6A3	40	36
N#Cc1ccc(Cn2cc(NC(=O)NC[C@@H]3CCCOC3)cn2)cc1	ZINC000875130476	EE	On-Demand	Mild	CCR3	22	40
N#Cc1ccc(Cn2cc(NC(=O)NC[C@@H]3CCCOC3)cn2)cc1	ZINC000875130476	EE	On-Demand	Mild	ITK	17	48
N#Cc1ccc(Cn2cc(NC(=O)NC[C@@H]3CCCOC3)cn2)cc1	ZINC000875130476	EE	On-Demand	Mild	PANC	54	36
N#Cc1ccc(Cn2cc(NC(=O)NC[C@H]3CCCOC3)cn2)cc1	ZINC000875130477	EE	On-Demand	Mild	CCR3	22	40
N#Cc1ccc(Cn2cc(NC(=O)NC[C@H]3CCCOC3)cn2)cc1	ZINC000875130477	EE	On-Demand	Mild	ITK	17	48
N#Cc1ccc(Cn2cc(NC(=O)NC[C@H]3CCCOC3)cn2)cc1	ZINC000875130477	EE	On-Demand	Mild	PANC	54	36
NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CCCN(C=O)CC3)cc2)C1	ZINC000875130486	GC	On-Demand	Clean	DPP7	43	32
NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CCCN(C=O)CC3)cc2)C1	ZINC000875130487	GC	On-Demand	Clean	DPP7	43	32
COC[C@H](C)CNC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875130494	ED	On-Demand	Anodyne	ROCK1	25	46
COC[C@H](C)CNC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875130494	ED	On-Demand	Anodyne	ROCK2	17	46
COC[C@@H](C)CNC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875130495	ED	On-Demand	Anodyne	ROCK1	25	46
COC[C@@H](C)CNC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875130495	ED	On-Demand	Anodyne	ROCK2	17	46
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@@H]2CCCOC2)CC1	ZINC000875130613	EG	On-Demand	Anodyne	DRD2	21	43
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@@H]2CCCOC2)CC1	ZINC000875130613	EG	On-Demand	Anodyne	SMO	20	41
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@H]2CCCOC2)CC1	ZINC000875130614	EG	On-Demand	Anodyne	DRD2	21	43
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@H]2CCCOC2)CC1	ZINC000875130614	EG	On-Demand	Anodyne	SMO	20	41
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@@H]2CCCOC2)CC1	ZINC000875130615	EG	On-Demand	Anodyne	DRD2	21	43
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@@H]2CCCOC2)CC1	ZINC000875130615	EG	On-Demand	Anodyne	SMO	20	41
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@H]2CCCOC2)CC1	ZINC000875130616	EG	On-Demand	Anodyne	DRD2	21	43
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@H]2CCCOC2)CC1	ZINC000875130616	EG	On-Demand	Anodyne	SMO	20	41
C[C@@H](CNC(=O)N1CC(c2ccccc2)C1)N1CCCCC1	ZINC000875130619	DF	On-Demand	Anodyne	CCR5	41	38
C[C@@H](CNC(=O)N1CC(c2ccccc2)C1)N1CCCCC1	ZINC000875130619	DF	On-Demand	Anodyne	DPP7	49	38
C[C@H](CNC(=O)N1CC(c2ccccc2)C1)N1CCCCC1	ZINC000875130620	DF	On-Demand	Anodyne	CCR5	41	38
C[C@H](CNC(=O)N1CC(c2ccccc2)C1)N1CCCCC1	ZINC000875130620	DF	On-Demand	Anodyne	DPP7	49	38
C[C@@H](CNC(=O)N(Cc1cccc(O)c1)[C@@H]1CC[C@@H](O)CC1)N1CCCCC1	ZINC000875130635	GG	On-Demand	Anodyne	CCR5	20	41
C[C@H](CNC(=O)N(Cc1cccc(O)c1)[C@@H]1CC[C@@H](O)CC1)N1CCCCC1	ZINC000875130636	GG	On-Demand	Anodyne	CCR5	20	41
COC[C@H](C)CNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875130762	FD	On-Demand	Anodyne	SMO	36	41
COC[C@H](C)CNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875130762	FD	On-Demand	Anodyne	ETHR	59	46
COC[C@@H](C)CNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875130763	FD	On-Demand	Anodyne	SMO	36	41
COC[C@@H](C)CNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875130763	FD	On-Demand	Anodyne	ETHR	59	46
COC[C@H](C)CNC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875130836	ED	On-Demand	Anodyne	OXTR	40	35
COC[C@H](C)CNC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875130836	ED	On-Demand	Anodyne	GHRHR	20	41
COC[C@@H](C)CNC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875130837	ED	On-Demand	Anodyne	OXTR	40	35
COC[C@@H](C)CNC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875130837	ED	On-Demand	Anodyne	GHRHR	20	41
COC[C@H](C)CNC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875130838	ED	On-Demand	Anodyne	OXTR	40	35
COC[C@H](C)CNC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875130838	ED	On-Demand	Anodyne	GHRHR	20	41
COC[C@@H](C)CNC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875130839	ED	On-Demand	Anodyne	OXTR	40	35
COC[C@@H](C)CNC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875130839	ED	On-Demand	Anodyne	GHRHR	20	41
C[C@@H](CNC(=O)Nc1cnn(C2CCN(C)CC2)c1)N1CCCCC1	ZINC000875130842	EE	On-Demand	Anodyne	TBK1	29	43
C[C@@H](CNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)N1CCCCC1	ZINC000875130863	FF	On-Demand	Mild	ITK	17	49
COC[C@@H](C)CNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875130897	GC	On-Demand	Clean	DRD2	32	41
COC[C@@H](C)CNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875130897	GC	On-Demand	Clean	DRD4	41	33
COC[C@@H](C)CNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875130897	GC	On-Demand	Clean	DRD3	47	38
COC[C@H](C)CNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875130898	GC	On-Demand	Clean	DRD2	32	41
COC[C@H](C)CNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875130898	GC	On-Demand	Clean	DRD4	41	33
COC[C@H](C)CNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875130898	GC	On-Demand	Clean	DRD3	47	38
COC[C@H](C)CNC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1C	ZINC000875130922	FD	On-Demand	Anodyne	SLC18A2	52	37
COC[C@H](C)CNC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1C	ZINC000875130923	FD	On-Demand	Anodyne	SLC18A2	52	37
COC[C@@H](C)CNC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1C	ZINC000875130924	FD	On-Demand	Anodyne	SLC18A2	52	37
COC[C@@H](C)CNC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1C	ZINC000875130925	FD	On-Demand	Anodyne	SLC18A2	52	37
C[C@@H](CNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)N1CCCCC1	ZINC000875130935	FG	On-Demand	Anodyne	OPRL1	24	43
COC[C@@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875130946	GD	On-Demand	Anodyne	CHRM2	15	41
COC[C@@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875130946	GD	On-Demand	Anodyne	DRD2	31	48
COC[C@@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875130946	GD	On-Demand	Anodyne	DRD4	50	48
COC[C@@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875130946	GD	On-Demand	Anodyne	ACHE	66	58
COC[C@@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875130946	GD	On-Demand	Anodyne	DRD3	23	46
COC[C@@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875130946	GD	On-Demand	Anodyne	SLC6A3	32	54
COC[C@@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875130946	GD	On-Demand	Anodyne	HTR4	37	48
COC[C@@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875130946	GD	On-Demand	Anodyne	SIGMAR1	60	48
COC[C@@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875130946	GD	On-Demand	Anodyne	BCHE	20	49
COC[C@@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875130946	GD	On-Demand	Anodyne	MCHR1	29	44
COC[C@@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875130946	GD	On-Demand	Anodyne	CACNA1G	38	40
COC[C@@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875130946	GD	On-Demand	Anodyne	CACNA1I	55	38
COC[C@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875130947	GD	On-Demand	Anodyne	CHRM2	15	41
COC[C@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875130947	GD	On-Demand	Anodyne	DRD2	31	48
COC[C@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875130947	GD	On-Demand	Anodyne	DRD4	50	48
COC[C@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875130947	GD	On-Demand	Anodyne	ACHE	66	58
COC[C@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875130947	GD	On-Demand	Anodyne	DRD3	23	46
COC[C@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875130947	GD	On-Demand	Anodyne	SLC6A3	32	54
COC[C@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875130947	GD	On-Demand	Anodyne	HTR4	37	48
COC[C@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875130947	GD	On-Demand	Anodyne	SIGMAR1	60	48
COC[C@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875130947	GD	On-Demand	Anodyne	BCHE	20	49
COC[C@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875130947	GD	On-Demand	Anodyne	MCHR1	29	44
COC[C@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875130947	GD	On-Demand	Anodyne	CACNA1G	38	40
COC[C@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875130947	GD	On-Demand	Anodyne	CACNA1I	55	38
O=C(NCCCCC1CC1)C(=O)NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1	ZINC000875131126	GF	On-Demand	Anodyne	CACNA1I	41	37
O=C(NCCCCC1CC1)C(=O)NC[C@H]1CCN(c2ccc(F)c(F)c2)C1	ZINC000875131127	GF	On-Demand	Anodyne	CACNA1I	41	37
CCC(CC)[C@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1cccs1	ZINC000875131129	FH	On-Demand	Anodyne	GHRHR	45	32
CCC(CC)[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1cccs1	ZINC000875131130	FH	On-Demand	Anodyne	GHRHR	45	32
O=C(NC[C@@H]1CCN(c2ccc(Cl)cc2)C1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875131147	GF	On-Demand	Anodyne	CACNA1I	45	35
O=C(NC[C@H]1CCN(c2ccc(Cl)cc2)C1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875131148	GF	On-Demand	Anodyne	CACNA1I	45	35
CC(=O)C1CCN(C(=O)C(=O)NCC2CCN(Cc3cccs3)CC2)CC1	ZINC000875131155	GD	On-Demand	Anodyne	CACNA1I	61	36
COC(=O)[C@@]12C[C@@H](NC(=O)NCCNC(=O)c3cccc(C)c3)C[C@@H]1C2	ZINC000875131156	FD	On-Demand	Anodyne	DRD4	45	37
COC(=O)[C@@]12C[C@@H](NC(=O)NCCNC(=O)c3cccc(C)c3)C[C@@H]1C2	ZINC000875131156	FD	On-Demand	Anodyne	KCNK3	51	35
COC(=O)[C@@]12C[C@@H](NC(=O)NCCNC(=O)c3cccc(C)c3)C[C@@H]1C2	ZINC000875131156	FD	On-Demand	Anodyne	KCNK9	41	35
N#Cc1ccc(N2CCN(C(=O)NCCOC3CCCCC3)CC2)cn1	ZINC000875131160	FE	On-Demand	Mild	CTSK	21	43
O=CN1CCCN(C(=O)NCc2cccc(Cn3cccn3)c2)CC1	ZINC000875131165	ED	On-Demand	Anodyne	FAAH	18	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(Cn2cccn2)c1	ZINC000875131174	FE	On-Demand	Anodyne	SLC6A3	43	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(Cn2cccn2)c1	ZINC000875131175	FE	On-Demand	Anodyne	SLC6A3	43	37
COC(=O)N(C)NC(=O)NCCOc1cccc(Br)c1	ZINC000875131184	ED	On-Demand	Reactive	MTNR1A	39	49
COC(=O)N(C)NC(=O)NCCOc1cccc(Br)c1	ZINC000875131184	ED	On-Demand	Reactive	MTNR1B	27	49
COC(=O)N(C)NC(=O)NCCOc1cccc(Br)c1	ZINC000875131184	ED	On-Demand	Reactive	PDS	25	40
C[C@H](NC(=O)C(=O)NCC1CCN(Cc2cccs2)CC1)c1ccnn1C	ZINC000875131215	GD	On-Demand	Anodyne	HTR4	43	38
C[C@H](NC(=O)C(=O)NCC1CCN(Cc2cccs2)CC1)c1ccnn1C	ZINC000875131215	GD	On-Demand	Anodyne	CACNA1I	55	32
C=CCSCCNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875131223	GE	On-Demand	Mild	ETHR	53	46
O=C(NCCOC1CCCCC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875131234	FE	On-Demand	Anodyne	ETHR	52	39
O=C(NCCOC1CCCCC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875131236	FE	On-Demand	Anodyne	ETHR	52	39
O=C(NCc1cccc(OCCN2CCOCC2)c1)C(=O)N[C@@H]1CC12CCC2	ZINC000875131264	GD	On-Demand	Anodyne	HRH2	34	41
O=C(NCc1cccc(OCCN2CCOCC2)c1)C(=O)N[C@@H]1CC12CCC2	ZINC000875131264	GD	On-Demand	Anodyne	LTA4H	22	40
O=C(NCc1cccc(OCCN2CCOCC2)c1)C(=O)N[C@@H]1CC12CCC2	ZINC000875131264	GD	On-Demand	Anodyne	EPHX2	28	46
O=C(NCc1cccc(OCCN2CCOCC2)c1)C(=O)N[C@H]1CC12CCC2	ZINC000875131267	GD	On-Demand	Anodyne	HRH2	34	41
O=C(NCc1cccc(OCCN2CCOCC2)c1)C(=O)N[C@H]1CC12CCC2	ZINC000875131267	GD	On-Demand	Anodyne	LTA4H	22	40
O=C(NCc1cccc(OCCN2CCOCC2)c1)C(=O)N[C@H]1CC12CCC2	ZINC000875131267	GD	On-Demand	Anodyne	EPHX2	28	46
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCC2CCN(Cc3cccs3)CC2)C1	ZINC000875131274	GE	On-Demand	Anodyne	CACNA1I	48	33
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCN(C)c2ccccc2F)C1	ZINC000875131277	FE	On-Demand	Anodyne	ASAH1	51	34
C=CCOc1ccc(C(=O)OCCC(N)=O)cc1OC	ZINC000875131280	CD	On-Demand	Mild	ACR	16	43
O=CN1CCCN(C(=O)NCc2cccc(NC(=O)c3ccncc3)c2)CC1	ZINC000875131282	GD	On-Demand	Anodyne	P2RY14	44	34
O=CN1CCCN(C(=O)NCc2cccc(NC(=O)c3ccncc3)c2)CC1	ZINC000875131282	GD	On-Demand	Anodyne	KCNK3	60	46
O=C(NCc1cccc(COc2ccccc2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875131283	EF	On-Demand	Anodyne	ADAM17	25	40
O=C(NCc1cccc(COc2ccccc2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875131283	EF	On-Demand	Anodyne	GYS1	44	32
O=C(NCc1cccc(COc2ccccc2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875131283	EF	On-Demand	Anodyne	FFAR1	34	41
O=C(NCc1cccc(COc2ccccc2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875131283	EF	On-Demand	Anodyne	PDS	65	38
CC(=O)C1CCN(C(=O)NCCNC(=O)c2ccc(Br)cc2)CC1	ZINC000875131341	GE	On-Demand	Anodyne	L3MBTL3	32	41
COCC(C)(C)CCNC(=O)C(=O)NCC1CCN(Cc2cccs2)CC1	ZINC000875131346	GE	On-Demand	Anodyne	CACNA1I	66	38
C[C@H](NC(=O)C(=O)NC[C@@H]1CCCN(Cc2cccs2)C1)c1ccnn1C	ZINC000875131350	GD	On-Demand	Anodyne	SLC6A1	44	31
C[C@H](NC(=O)C(=O)NC[C@H]1CCCN(Cc2cccs2)C1)c1ccnn1C	ZINC000875131354	GD	On-Demand	Anodyne	SLC6A1	44	31
Cc1noc(C)c1CNC(=O)C(=O)NCc1ccc(OC(F)F)cc1F	ZINC000875131359	FD	On-Demand	Anodyne	P2RX7	33	59
CONC(=O)C1CCN(C(=O)NCc2cn3cc(C)ccc3n2)CC1	ZINC000875131375	ED	On-Demand	Anodyne	EPHX2	25	41
O=C(NCc1ccccc1OCC(F)(F)F)N1CCC(CO)(CO)CC1	ZINC000875131398	GD	On-Demand	Anodyne	EPHX2	18	48
O=C(NCCCCC1CC1)C(=O)NCC1CCN(Cc2cccs2)CC1	ZINC000875131408	GF	On-Demand	Anodyne	CACNA1I	62	37
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1OCC(F)(F)F	ZINC000875131434	EF	On-Demand	Anodyne	ANPEP	17	46
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1OCC(F)(F)F	ZINC000875131434	EF	On-Demand	Anodyne	PDS	44	36
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000875131438	GE	On-Demand	Anodyne	CACNA1I	73	38
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000875131439	GE	On-Demand	Anodyne	CACNA1I	73	38
C=CCSCCNC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875131475	FE	On-Demand	Mild	C3AR1	39	40
C=CCSCCNC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875131477	FE	On-Demand	Mild	C3AR1	39	40
CC(=O)N(C)c1ccc(CNC(=O)NCCNC(=O)c2cccc(C)c2)cc1	ZINC000875131505	GE	On-Demand	Anodyne	KCNK3	57	42
CC(=O)N(C)c1ccc(CNC(=O)NCCNC(=O)c2cccc(C)c2)cc1	ZINC000875131505	GE	On-Demand	Anodyne	KCNK9	43	38
O=C(NCCOc1cccc(Br)c1)NC[C@H]1C[C@H](O)C1	ZINC000875131511	ED	On-Demand	Anodyne	HRH2	26	41
CN1CCN(C2CCN(C(=O)NCCOC3CCCCC3)CC2)CC1	ZINC000875131514	FD	On-Demand	Anodyne	L3MBTL3	46	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3cccs3)CC2)C1	ZINC000875131521	GD	On-Demand	Anodyne	CACNA1I	46	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3cccs3)CC2)C1	ZINC000875131522	GD	On-Demand	Anodyne	CACNA1I	46	33
C[C@H](NC(=O)C(=O)NC[C@@H]1CCN(c2ccc(Cl)cc2)C1)c1ccnn1C	ZINC000875131523	GD	On-Demand	Anodyne	CACNA1I	42	32
C[C@H](NC(=O)C(=O)NC[C@H]1CCN(c2ccc(Cl)cc2)C1)c1ccnn1C	ZINC000875131525	GD	On-Demand	Anodyne	CACNA1I	42	32
C[C@@H](CCN(C)C)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875131576	FD	On-Demand	Anodyne	ROCK1	26	45
C[C@@H](CCN(C)C)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875131576	FD	On-Demand	Anodyne	ROCK2	17	45
C[C@@H](CCN(C)C)NC(=O)C(=O)N[C@@H]1CC[C@@H](NC(=O)OC(C)(C)C)CC1	ZINC000875131580	GD	On-Demand	Anodyne	CTSK	15	41
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1CCN(Cc2cccs2)CC1	ZINC000875131613	GD	On-Demand	Mild	CACNA1I	55	34
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1CCN(Cc2cccs2)CC1	ZINC000875131614	GD	On-Demand	Mild	CACNA1I	55	34
O=C(NCC1CCN(Cc2cccs2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875131632	GF	On-Demand	Anodyne	CACNA1I	46	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(c3ccc(Cl)cc3)C2)C1	ZINC000875131636	GE	On-Demand	Anodyne	CACNA1I	48	32
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(c3ccc(Cl)cc3)C2)C1	ZINC000875131637	GE	On-Demand	Anodyne	CACNA1I	48	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(c3ccc(Cl)cc3)C2)C1	ZINC000875131638	GE	On-Demand	Anodyne	CACNA1I	48	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(c3ccc(Cl)cc3)C2)C1	ZINC000875131639	GE	On-Demand	Anodyne	CACNA1I	48	32
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCN(c3ccc(Cl)cc3)C2)CC1	ZINC000875131641	GE	On-Demand	Anodyne	CACNA1I	47	34
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCN(c3ccc(Cl)cc3)C2)CC1	ZINC000875131642	GE	On-Demand	Anodyne	CACNA1I	47	34
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1	ZINC000875131653	GE	On-Demand	Anodyne	CACNA1I	68	36
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN(c2ccc(F)c(F)c2)C1	ZINC000875131654	GE	On-Demand	Anodyne	CACNA1I	68	36
CC[C@@H](NC(=O)NCCCCn1ccnc1)[C@H](O)c1ccccc1	ZINC000875131670	EE	On-Demand	Anodyne	TBXAS1	62	49
CC[C@@H](NC(=O)NCCCCn1ccnc1)[C@H](O)c1ccccc1	ZINC000875131670	EE	On-Demand	Anodyne	HMOX2	48	39
CC[C@@H](NC(=O)NCCCCn1ccnc1)[C@H](O)c1ccccc1	ZINC000875131670	EE	On-Demand	Anodyne	CYP24A1	46	34
CC[C@@H](NC(=O)NCCCCn1ccnc1)[C@H](O)c1ccccc1	ZINC000875131670	EE	On-Demand	Anodyne	QPCT	39	45
CC[C@@H](NC(=O)NCCCCn1ccnc1)[C@H](O)c1ccccc1	ZINC000875131670	EE	On-Demand	Anodyne	CYP27B1	61	34
CC[C@@H](NC(=O)NCCCCn1ccnc1)[C@@H](O)c1ccccc1	ZINC000875131672	EE	On-Demand	Anodyne	TBXAS1	62	49
CC[C@@H](NC(=O)NCCCCn1ccnc1)[C@@H](O)c1ccccc1	ZINC000875131672	EE	On-Demand	Anodyne	HMOX2	48	39
CC[C@@H](NC(=O)NCCCCn1ccnc1)[C@@H](O)c1ccccc1	ZINC000875131672	EE	On-Demand	Anodyne	CYP24A1	46	34
CC[C@@H](NC(=O)NCCCCn1ccnc1)[C@@H](O)c1ccccc1	ZINC000875131672	EE	On-Demand	Anodyne	QPCT	39	45
CC[C@@H](NC(=O)NCCCCn1ccnc1)[C@@H](O)c1ccccc1	ZINC000875131672	EE	On-Demand	Anodyne	CYP27B1	61	34
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1OCC(F)(F)F	ZINC000875131673	GF	On-Demand	Anodyne	SLC6A3	42	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1OCC(F)(F)F	ZINC000875131674	GF	On-Demand	Anodyne	SLC6A3	42	37
O=C(NCCOC1CCCCC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875131693	GH	On-Demand	Anodyne	SMO	38	44
O=C(NCCOC1CCCCC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875131693	GH	On-Demand	Anodyne	ETHR	61	52
O=C(NCc1cccc(COc2ccccc2)c1)N1CCC(CO)(CO)CC1	ZINC000875131696	GF	On-Demand	Anodyne	GYS1	47	36
O=C(NCc1cccc(COc2ccccc2)c1)N1CCC(CO)(CO)CC1	ZINC000875131696	GF	On-Demand	Anodyne	EPHX2	17	42
O=C(NCc1cccc(COc2ccccc2)c1)N1CCC(CO)(CO)CC1	ZINC000875131696	GF	On-Demand	Anodyne	FFAR1	35	40
O=C(NCc1cccc(COc2ccccc2)c1)N1CCC(CO)(CO)CC1	ZINC000875131696	GF	On-Demand	Anodyne	PDS	50	35
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1OC(C)C	ZINC000875131707	DF	On-Demand	Anodyne	ANPEP	23	50
C[C@@H](CCN(C)C)NC(=O)C(=O)NC[C@H]1c2ccccc2CN1C	ZINC000875131723	EC	On-Demand	Anodyne	UTS2	46	32
C[C@@H](CCN(C)C)NC(=O)C(=O)NC[C@@H]1c2ccccc2CN1C	ZINC000875131726	EC	On-Demand	Anodyne	UTS2	46	32
C[C@@H](CCN(C)C)NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875131763	GD	On-Demand	Anodyne	ETHR	61	48
Cc1noc(C)c1CNC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875131782	FF	On-Demand	Anodyne	FAAH	70	42
Cc1noc(C)c1CNC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875131782	FF	On-Demand	Anodyne	CES1	69	40
Cc1noc(C)c1CNC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875131782	FF	On-Demand	Anodyne	AMP1_PLAFQ	28	45
Cc1noc(C)c1CNC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875131782	FF	On-Demand	Anodyne	CES1D	54	33
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@H]2CCN(c3ccc(Cl)cc3)C2)C1	ZINC000875131798	GE	On-Demand	Anodyne	CACNA1I	47	34
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@@H]2CCN(c3ccc(Cl)cc3)C2)C1	ZINC000875131800	GE	On-Demand	Anodyne	CACNA1I	47	34
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@H]2CCN(c3ccc(F)c(F)c3)C2)C1	ZINC000875131802	GD	On-Demand	Anodyne	CACNA1I	43	31
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@@H]2CCN(c3ccc(F)c(F)c3)C2)C1	ZINC000875131803	GD	On-Demand	Anodyne	CACNA1I	43	31
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000875131820	GD	On-Demand	Mild	CACNA1I	55	35
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000875131821	GD	On-Demand	Mild	CACNA1I	55	35
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000875131822	GD	On-Demand	Mild	CACNA1I	55	35
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000875131823	GD	On-Demand	Mild	CACNA1I	55	35
O=C(NCCOc1cccc(Br)c1)N1CCC(CO)(CO)CC1	ZINC000875131832	GD	On-Demand	Anodyne	HRH2	29	40
CCC(CC)[C@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1cccs1	ZINC000875131840	GH	On-Demand	Anodyne	L3MBTL3	63	42
CCC(CC)[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1cccs1	ZINC000875131841	GH	On-Demand	Anodyne	L3MBTL3	63	42
O=CN1CCCN(C(=O)NCc2cccc(COc3ccccc3)c2)CC1	ZINC000875131844	FF	On-Demand	Anodyne	DPP7	23	42
O=CN1CCCN(C(=O)NCc2cccc(COc3ccccc3)c2)CC1	ZINC000875131844	FF	On-Demand	Anodyne	PDS	49	34
C[C@@H](NC(=O)NCCOC1CCCCC1)c1ccccc1O	ZINC000875131850	DG	On-Demand	Clean	AMY2	45	31
CCCCCCCNC(=O)C(=O)NCc1c(C)noc1C	ZINC000875131936	CD	On-Demand	Mild	ASAH1	72	33
Cc1noc(C)c1CNC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875131940	GD	On-Demand	Anodyne	P2RX7	27	52
Cc1noc(C)c1CNC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875131940	GD	On-Demand	Anodyne	NPY2R	64	44
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H](C)CCN(C)C)CC2	ZINC000875131979	GD	On-Demand	Anodyne	SLC18A2	55	40
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H](C)CCN(C)C)CC2	ZINC000875131980	GD	On-Demand	Anodyne	SLC18A2	55	40
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@@H](C)CCN(C)C)CC2	ZINC000875131981	GD	On-Demand	Anodyne	SLC18A2	55	40
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@H](C)CCN(C)C)CC2	ZINC000875131982	GD	On-Demand	Anodyne	SLC18A2	55	40
CC[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc2c(c1)OCCO2	ZINC000875131988	FD	On-Demand	Anodyne	CACNA1H	25	42
C[C@@H](CCN(C)C)NC(=O)C(=O)NCc1ccc(OC(F)F)cc1F	ZINC000875131991	FD	On-Demand	Anodyne	UTS2	48	32
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000875132016	GD	On-Demand	Mild	CACNA1I	48	33
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000875132017	GD	On-Demand	Mild	CACNA1I	48	33
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000875132018	GD	On-Demand	Mild	CACNA1I	48	33
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000875132019	GD	On-Demand	Mild	CACNA1I	48	33
CC(=O)[C@H]1CCCN(C(=O)NCCNC(=O)c2ccc(Br)cc2)C1	ZINC000875132067	GE	On-Demand	Anodyne	DPP7	35	43
CC(=O)[C@@H]1CCCN(C(=O)NCCNC(=O)c2ccc(Br)cc2)C1	ZINC000875132068	GE	On-Demand	Anodyne	DPP7	35	43
O=C(NCc1cccc(Cn2cccn2)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875132084	GH	On-Demand	Anodyne	EPHX2	19	41
O=C(NCc1cccc(Cn2cccn2)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875132085	GH	On-Demand	Anodyne	EPHX2	19	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCOc1ccccc1C	ZINC000875132094	EE	On-Demand	Anodyne	SLC6A3	45	39
C[C@@H](CN(C)C(=O)C(=O)N[C@H](C)CCN(C)C)NC(=O)OC(C)(C)C	ZINC000875132097	FC	On-Demand	Anodyne	CTSK	15	42
C[C@@H](CCN(C)C)NC(=O)C(=O)N(C)C[C@@H](C)NC(=O)OC(C)(C)C	ZINC000875132098	FC	On-Demand	Anodyne	CTSK	15	42
C[C@@H](CN(C)C(=O)C(=O)N[C@@H](C)CCN(C)C)NC(=O)OC(C)(C)C	ZINC000875132099	FC	On-Demand	Anodyne	CTSK	15	42
CN1CCN(C(=O)NCc2cccc(NC(=O)c3ccncc3)c2)CCC1(C)C	ZINC000875132120	GF	On-Demand	Anodyne	KCNK3	64	42
O=C(NCCOC1CCCCC1)NCc1ccc(O)c(Cl)c1	ZINC000875132162	EG	On-Demand	Anodyne	NCE103	15	47
COC(=O)C1(O)CN(C(=O)NCCOc2cccc(Br)c2)C1	ZINC000875132182	FC	On-Demand	Anodyne	MTNR1A	17	45
C[C@@H](CCN(C)C)NC(=O)C(=O)N[C@@H](C)c1ccc(C(F)(F)F)nc1	ZINC000875132216	FD	On-Demand	Anodyne	UTS2	66	33
C[C@@H](CCN(C)C)NC(=O)C(=O)N[C@H](C)c1ccc(C(F)(F)F)nc1	ZINC000875132217	FD	On-Demand	Anodyne	UTS2	66	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cn2cc(C)ccc2n1	ZINC000875132218	ED	On-Demand	Anodyne	SLC6A3	49	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cn2cc(C)ccc2n1	ZINC000875132220	ED	On-Demand	Anodyne	SLC6A3	49	39
O=C(NCCCCn1ccnc1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875132260	FE	On-Demand	Anodyne	CYP19A1	16	43
O=C(NCCCCn1ccnc1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875132260	FE	On-Demand	Anodyne	CYP11B1	30	43
O=C(NCCCCn1ccnc1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875132260	FE	On-Demand	Anodyne	TBXAS1	64	47
O=C(NCCCCn1ccnc1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875132260	FE	On-Demand	Anodyne	CYP11B2	16	43
O=C(NCCCCn1ccnc1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875132260	FE	On-Demand	Anodyne	FAAH	18	43
O=C(NCCCCn1ccnc1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875132260	FE	On-Demand	Anodyne	QPCT	43	43
CCC1(CC)CCCN1C(=O)NCCNC(=O)c1ccccc1F	ZINC000875132266	EF	On-Demand	Anodyne	SLC6A9	21	41
CCC1(CC)CCCN1C(=O)NCCNC(=O)c1ccccc1F	ZINC000875132266	EF	On-Demand	Anodyne	SLC12A5	48	33
CCC1(CC)CCCN1C(=O)NCCNC(=O)c1ccccc1F	ZINC000875132266	EF	On-Demand	Anodyne	HCN1	73	35
CCC1(CC)CCCN1C(=O)NCCNC(=O)c1ccccc1F	ZINC000875132266	EF	On-Demand	Anodyne	HCN4	52	34
CNC(=O)CCCNC(=O)N[C@@H]1C[C@H]2C[C@@]2(C(=O)OC)C1	ZINC000875132272	CC	On-Demand	Anodyne	EPHX2	20	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCCn2ccnc2)CC1	ZINC000875132279	FH	On-Demand	Anodyne	HTR1A	27	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCCn2ccnc2)CC1	ZINC000875132279	FH	On-Demand	Anodyne	DRD2	27	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCCn2ccnc2)CC1	ZINC000875132279	FH	On-Demand	Anodyne	DRD3	35	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCCn2ccnc2)CC1	ZINC000875132279	FH	On-Demand	Anodyne	TBXAS1	35	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCCn2ccnc2)CC1	ZINC000875132279	FH	On-Demand	Anodyne	RBP4	32	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCCn2ccnc2)CC1	ZINC000875132279	FH	On-Demand	Anodyne	QPCT	46	48
COc1ccccc1[C@H]1CCCN(C(=O)NCCCCn2ccnc2)CC1	ZINC000875132280	FH	On-Demand	Anodyne	HTR1A	27	41
COc1ccccc1[C@H]1CCCN(C(=O)NCCCCn2ccnc2)CC1	ZINC000875132280	FH	On-Demand	Anodyne	DRD2	27	41
COc1ccccc1[C@H]1CCCN(C(=O)NCCCCn2ccnc2)CC1	ZINC000875132280	FH	On-Demand	Anodyne	DRD3	35	41
COc1ccccc1[C@H]1CCCN(C(=O)NCCCCn2ccnc2)CC1	ZINC000875132280	FH	On-Demand	Anodyne	TBXAS1	35	40
COc1ccccc1[C@H]1CCCN(C(=O)NCCCCn2ccnc2)CC1	ZINC000875132280	FH	On-Demand	Anodyne	RBP4	32	40
COc1ccccc1[C@H]1CCCN(C(=O)NCCCCn2ccnc2)CC1	ZINC000875132280	FH	On-Demand	Anodyne	QPCT	46	48
COC(=O)N(C)NC(=O)NCCCCn1ccnc1	ZINC000875132281	CC	On-Demand	Reactive	TBXAS1	44	47
COC(=O)N(C)NC(=O)NCCCCn1ccnc1	ZINC000875132281	CC	On-Demand	Reactive	QPCT	42	52
CNC(=O)CCCNC(=O)NC1CC(C(=O)OC)C1	ZINC000875132287	CB	On-Demand	Anodyne	EPHX2	21	49
CNC(=O)CCCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875132318	ED	On-Demand	Anodyne	FKBP1A	34	40
CNC(=O)CCCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875132318	ED	On-Demand	Anodyne	TRY1_BOVIN	41	35
CNC(=O)CCCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875132319	ED	On-Demand	Anodyne	FKBP1A	34	40
CNC(=O)CCCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875132319	ED	On-Demand	Anodyne	TRY1_BOVIN	41	35
CNC(=O)CCCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875132320	ED	On-Demand	Anodyne	FKBP1A	34	40
CNC(=O)CCCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875132320	ED	On-Demand	Anodyne	TRY1_BOVIN	41	35
CNC(=O)CCCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875132321	ED	On-Demand	Anodyne	FKBP1A	34	40
CNC(=O)CCCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875132321	ED	On-Demand	Anodyne	TRY1_BOVIN	41	35
CCN(CC)S(=O)(=O)c1ccc(Br)c(C(=O)N2CCCc3cc(C)ccc32)c1	ZINC000875132326	JI	On-Demand	Anodyne	AVPR2	24	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCNC(=O)c2ccccc2F)C1	ZINC000875132337	FD	On-Demand	Anodyne	HCN1	55	31
CCOC(=O)[C@H](C)C1CN(C(=O)NCCNC(=O)c2ccccc2F)C1	ZINC000875132337	FD	On-Demand	Anodyne	HCN4	47	31
CC(=O)C1CCN(C(=O)C(=O)NCCCc2cccc(C(F)(F)F)c2)CC1	ZINC000875132361	GF	On-Demand	Anodyne	CACNA1B	41	33
CC(=O)C1CCN(C(=O)C(=O)NCCCc2cccc(C(F)(F)F)c2)CC1	ZINC000875132361	GF	On-Demand	Anodyne	CCR2	82	38
CC(=O)C1CCN(C(=O)C(=O)NCCCc2cccc(C(F)(F)F)c2)CC1	ZINC000875132361	GF	On-Demand	Anodyne	PDS	34	40
C[C@@H](CCN(C)C)NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875132367	FD	On-Demand	Anodyne	C3AR1	43	41
C[C@@H](CCN(C)C)NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875132369	FD	On-Demand	Anodyne	C3AR1	43	41
O=C(NCCCCC1CC1)C(=O)NC1CCN(c2nccs2)CC1	ZINC000875132386	FD	On-Demand	Anodyne	SIRT3	45	36
O=C(NCCCCC1CC1)C(=O)NC1CCN(c2nccs2)CC1	ZINC000875132386	FD	On-Demand	Anodyne	SIRT2	44	32
O=C(NCCCCC1CC1)C(=O)NC1CCN(c2nccs2)CC1	ZINC000875132386	FD	On-Demand	Anodyne	SIRT1	46	36
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000875132387	GG	On-Demand	Anodyne	PRNP	40	35
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000875132387	GG	On-Demand	Anodyne	F7	26	45
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000875132388	GG	On-Demand	Anodyne	PRNP	40	35
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000875132388	GG	On-Demand	Anodyne	F7	26	45
Cc1csc([C@H]2CCN(C(=O)N[C@H](Cc3ccccc3)CN(C)C)C2)n1	ZINC000875132432	FG	On-Demand	Anodyne	TACR2	51	33
C[C@@H](CCN(C)C)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875132500	CC	On-Demand	Anodyne	UTS2	67	34
C[C@@H](CCN(C)C)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875132502	CC	On-Demand	Anodyne	UTS2	67	34
CC[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1ccc2c(c1)OCCO2	ZINC000875132509	FE	On-Demand	Anodyne	CACNA1H	25	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1OC(C)C	ZINC000875132515	EF	On-Demand	Anodyne	SLC6A4	36	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1OC(C)C	ZINC000875132515	EF	On-Demand	Anodyne	SLC6A3	74	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1OC(C)C	ZINC000875132516	EF	On-Demand	Anodyne	SLC6A4	36	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1OC(C)C	ZINC000875132516	EF	On-Demand	Anodyne	SLC6A3	74	42
O=C(N[C@H]1CCN(C2CC2)C1)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875132534	GC	On-Demand	Anodyne	ADRA1D	16	44
O=C(N[C@@H]1CCN(C2CC2)C1)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875132535	GC	On-Demand	Anodyne	ADRA1D	16	44
COC(=O)[C@@]12C[C@@H](NC(=O)NCCC(=O)NC3CCCCC3)C[C@@H]1C2	ZINC000875132536	FD	On-Demand	Anodyne	EPHX2	19	50
O=C1CCN(C(=O)NCCCCn2ccnc2)CCCCCCN1	ZINC000875132566	ED	On-Demand	Anodyne	TBXAS1	39	44
O=C(NCCCCn1ccnc1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875132567	EE	On-Demand	Anodyne	TBXAS1	51	44
O=C(NCCCCn1ccnc1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875132567	EE	On-Demand	Anodyne	QPCT	33	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCC(=O)NC)C1	ZINC000875132583	CC	On-Demand	Anodyne	NOD1	42	32
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCNC(=O)c1ccccc1F	ZINC000875132592	FD	On-Demand	Anodyne	SLC6A3	48	39
O=C(NCCCCn1ccnc1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875132603	FF	On-Demand	Anodyne	TBXAS1	51	45
O=C(NCCCCn1ccnc1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875132603	FF	On-Demand	Anodyne	QPCT	41	39
C[C@H](NC(=O)C(=O)N(C)Cc1ncc[nH]1)c1ccc(N2CCOCC2)cc1	ZINC000875132607	FD	On-Demand	Clean	EPHB4	47	32
CNC(=O)CCCNC(=O)N(C)C[C@H]1CCCCN1Cc1ccccc1	ZINC000875132631	FE	On-Demand	Anodyne	SIGMAR1	20	45
CC(C)(C)OC(=O)N[C@@H]1CCCCCN(C(=O)NCCCCn2ccnc2)C1	ZINC000875132634	GG	On-Demand	Anodyne	QPCT	25	46
Cc1noc(C)c1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875132680	GE	On-Demand	Anodyne	DRD2	21	42
Cc1noc(C)c1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875132680	GE	On-Demand	Anodyne	DRD4	44	41
Cc1noc(C)c1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875132680	GE	On-Demand	Anodyne	ACHE	63	57
Cc1noc(C)c1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875132680	GE	On-Demand	Anodyne	DRD3	17	41
Cc1noc(C)c1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875132680	GE	On-Demand	Anodyne	HTR4	24	40
Cc1noc(C)c1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875132680	GE	On-Demand	Anodyne	SIGMAR1	55	42
Cc1noc(C)c1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875132680	GE	On-Demand	Anodyne	BCHE	17	49
Cc1noc(C)c1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875132680	GE	On-Demand	Anodyne	SIRT2	43	30
CC[C@@H](NC(=O)C(=O)N[C@@H](C)CCN(C)C)c1cccc(OC)c1OC	ZINC000875132700	FD	On-Demand	Anodyne	UTS2	64	34
CC[C@@H](NC(=O)C(=O)N[C@H](C)CCN(C)C)c1cccc(OC)c1OC	ZINC000875132703	FD	On-Demand	Anodyne	UTS2	64	34
CN1CC[C@H]2CN(C(=O)C(=O)NCCCc3cccc(C(F)(F)F)c3)CC[C@H]21	ZINC000875132704	GE	On-Demand	Anodyne	CACNA1B	40	34
CN1CC[C@H]2CN(C(=O)C(=O)NCCCc3cccc(C(F)(F)F)c3)CC[C@H]21	ZINC000875132704	GE	On-Demand	Anodyne	CCR2	78	38
CN1CC[C@H]2CN(C(=O)C(=O)NCCCc3cccc(C(F)(F)F)c3)CC[C@@H]21	ZINC000875132708	GE	On-Demand	Anodyne	CACNA1B	40	34
CN1CC[C@H]2CN(C(=O)C(=O)NCCCc3cccc(C(F)(F)F)c3)CC[C@@H]21	ZINC000875132708	GE	On-Demand	Anodyne	CCR2	78	38
C[C@@H](CCN(C)C)NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875132719	ED	On-Demand	Anodyne	OXTR	55	37
C[C@@H](CCN(C)C)NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875132719	ED	On-Demand	Anodyne	GHRHR	54	45
C[C@@H](CCN(C)C)NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875132723	ED	On-Demand	Anodyne	OXTR	55	37
C[C@@H](CCN(C)C)NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875132723	ED	On-Demand	Anodyne	GHRHR	54	45
C[C@@H](CCN(C)C)NC(=O)C(=O)N[C@H](C)c1cc2cnccc2o1	ZINC000875132734	ED	On-Demand	Anodyne	UTS2	61	35
C[C@@H](CCN(C)C)NC(=O)C(=O)N[C@@H](C)c1cc2cnccc2o1	ZINC000875132736	ED	On-Demand	Anodyne	UTS2	61	35
CC(=O)C1CCN(C(=O)NCCC(=O)Nc2ccc(Br)cc2)CC1	ZINC000875132737	GF	On-Demand	Anodyne	EPHX2	15	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000875132768	FD	On-Demand	Anodyne	SLC6A4	26	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000875132768	FD	On-Demand	Anodyne	SLC6A3	57	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000875132768	FD	On-Demand	Anodyne	TIMP3	68	33
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000875132771	FD	On-Demand	Anodyne	SLC6A4	26	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000875132771	FD	On-Demand	Anodyne	SLC6A3	57	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000875132771	FD	On-Demand	Anodyne	TIMP3	68	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000875132773	FD	On-Demand	Anodyne	SLC6A4	26	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000875132773	FD	On-Demand	Anodyne	SLC6A3	57	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000875132773	FD	On-Demand	Anodyne	TIMP3	68	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000875132775	FD	On-Demand	Anodyne	SLC6A4	26	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000875132775	FD	On-Demand	Anodyne	SLC6A3	57	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000875132775	FD	On-Demand	Anodyne	TIMP3	68	33
O=C(N[C@H]1CCN(C2CC2)C1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875132796	GD	On-Demand	Anodyne	ETHR	55	46
O=C(N[C@@H]1CCN(C2CC2)C1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875132799	GD	On-Demand	Anodyne	ETHR	55	46
Cc1nccnc1[C@H](C)NC(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000875132817	EE	On-Demand	Anodyne	MME	54	38
Cc1nccnc1[C@@H](C)NC(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000875132818	EE	On-Demand	Anodyne	MME	54	38
Cc1nccnc1[C@H](C)NC(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000875132819	EE	On-Demand	Anodyne	MME	54	38
Cc1nccnc1[C@@H](C)NC(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000875132820	EE	On-Demand	Anodyne	MME	54	38
N#Cc1cccc([C@H](NC(=O)NCCC(=O)NC2CCCCC2)C(F)(F)F)c1	ZINC000875132829	GG	On-Demand	Mild	MCHR1	18	41
N#Cc1cccc([C@@H](NC(=O)NCCC(=O)NC2CCCCC2)C(F)(F)F)c1	ZINC000875132830	GG	On-Demand	Mild	MCHR1	18	41
CS[C@@H]1C[C@@H](NC(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875132835	DE	On-Demand	Anodyne	ACE	34	46
CS[C@@H]1C[C@@H](NC(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875132835	DE	On-Demand	Anodyne	MME	65	46
CS[C@@H]1C[C@@H](NC(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875132835	DE	On-Demand	Anodyne	CTSC	16	43
CS[C@@H]1C[C@@H](NC(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875132836	DE	On-Demand	Anodyne	ACE	34	46
CS[C@@H]1C[C@@H](NC(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875132836	DE	On-Demand	Anodyne	MME	65	46
CS[C@@H]1C[C@@H](NC(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875132836	DE	On-Demand	Anodyne	CTSC	16	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCN(C2CC2)C1	ZINC000875132837	GD	On-Demand	Anodyne	CHRM2	21	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCN(C2CC2)C1	ZINC000875132837	GD	On-Demand	Anodyne	CHRM1	17	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCN(C2CC2)C1	ZINC000875132837	GD	On-Demand	Anodyne	DRD2	28	48
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCN(C2CC2)C1	ZINC000875132837	GD	On-Demand	Anodyne	DRD4	51	48
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCN(C2CC2)C1	ZINC000875132837	GD	On-Demand	Anodyne	ACHE	61	58
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCN(C2CC2)C1	ZINC000875132837	GD	On-Demand	Anodyne	DRD3	26	47
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCN(C2CC2)C1	ZINC000875132837	GD	On-Demand	Anodyne	SLC6A3	16	47
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCN(C2CC2)C1	ZINC000875132837	GD	On-Demand	Anodyne	HTR4	17	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCN(C2CC2)C1	ZINC000875132837	GD	On-Demand	Anodyne	CHRM3	23	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCN(C2CC2)C1	ZINC000875132837	GD	On-Demand	Anodyne	LTA4H	23	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCN(C2CC2)C1	ZINC000875132837	GD	On-Demand	Anodyne	SIGMAR1	58	50
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCN(C2CC2)C1	ZINC000875132837	GD	On-Demand	Anodyne	BCHE	15	48
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCN(C2CC2)C1	ZINC000875132837	GD	On-Demand	Anodyne	CCR3	44	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCN(C2CC2)C1	ZINC000875132837	GD	On-Demand	Anodyne	CCR2	32	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCN(C2CC2)C1	ZINC000875132837	GD	On-Demand	Anodyne	SLC6A5	22	53
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCN(C2CC2)C1	ZINC000875132837	GD	On-Demand	Anodyne	MCHR1	36	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCN(C2CC2)C1	ZINC000875132837	GD	On-Demand	Anodyne	CACNA1G	20	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000875132838	GD	On-Demand	Anodyne	CHRM2	21	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000875132838	GD	On-Demand	Anodyne	CHRM1	17	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000875132838	GD	On-Demand	Anodyne	DRD2	28	48
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000875132838	GD	On-Demand	Anodyne	DRD4	51	48
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000875132838	GD	On-Demand	Anodyne	ACHE	61	58
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000875132838	GD	On-Demand	Anodyne	DRD3	26	47
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000875132838	GD	On-Demand	Anodyne	SLC6A3	16	47
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000875132838	GD	On-Demand	Anodyne	HTR4	17	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000875132838	GD	On-Demand	Anodyne	CHRM3	23	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000875132838	GD	On-Demand	Anodyne	LTA4H	23	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000875132838	GD	On-Demand	Anodyne	SIGMAR1	58	50
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000875132838	GD	On-Demand	Anodyne	BCHE	15	48
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000875132838	GD	On-Demand	Anodyne	CCR3	44	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000875132838	GD	On-Demand	Anodyne	CCR2	32	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000875132838	GD	On-Demand	Anodyne	SLC6A5	22	53
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000875132838	GD	On-Demand	Anodyne	MCHR1	36	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000875132838	GD	On-Demand	Anodyne	CACNA1G	20	41
Cc1noc(C)c1CNC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875132851	FD	On-Demand	Anodyne	F2	24	41
Cc1noc(C)c1CNC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875132861	FD	On-Demand	Anodyne	F2	24	41
Cc1noc(C)c1CNC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875132864	FD	On-Demand	Anodyne	F2	24	41
Cc1noc(C)c1CNC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875132865	FD	On-Demand	Anodyne	F2	24	41
O=C(CCNC(=O)N1Cc2cccc(O)c2C1)NC1CCCCC1	ZINC000875132870	EE	On-Demand	Clean	EPHX2	17	42
O=C(N[C@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCCCCn2ccnc2)C1	ZINC000875132911	GD	On-Demand	Anodyne	QPCT	19	44
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCCCCn2ccnc2)C1	ZINC000875132913	GD	On-Demand	Anodyne	QPCT	19	44
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCCCCn2ccnc2)C1	ZINC000875132917	GD	On-Demand	Anodyne	QPCT	19	44
O=C(N[C@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCCCCn2ccnc2)C1	ZINC000875132920	GD	On-Demand	Anodyne	QPCT	19	44
COC(=O)C1(O)CN(C(=O)NCCCCn2ccnc2)C1	ZINC000875132938	CB	On-Demand	Anodyne	TBXAS1	37	44
COC(=O)C1(O)CN(C(=O)NCCCCn2ccnc2)C1	ZINC000875132938	CB	On-Demand	Anodyne	QPCT	43	44
CNC(=O)CCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875132960	DD	On-Demand	Anodyne	TRY1_BOVIN	52	38
CNC(=O)CCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875132960	DD	On-Demand	Anodyne	PREP	38	40
CNC(=O)CCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875132962	DD	On-Demand	Anodyne	TRY1_BOVIN	52	38
CNC(=O)CCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875132962	DD	On-Demand	Anodyne	PREP	38	40
CNC(=O)CCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875132964	DD	On-Demand	Anodyne	TRY1_BOVIN	52	38
CNC(=O)CCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875132964	DD	On-Demand	Anodyne	PREP	38	40
CNC(=O)CCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875132967	DD	On-Demand	Anodyne	TRY1_BOVIN	52	38
CNC(=O)CCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875132967	DD	On-Demand	Anodyne	PREP	38	40
CSCC[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)N1CCCc2cc(C)ccc21	ZINC000875133040	JJ	On-Demand	Anodyne	F2	36	44
CSCC[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)N1CCCc2cc(C)ccc21	ZINC000875133040	JJ	On-Demand	Anodyne	TRY2_BOVIN	79	42
C[C@H]1CCC[C@@H](C2CN(C(=O)NCCCCn3ccnc3)C2)C1	ZINC000875133054	DG	On-Demand	Anodyne	TBXAS1	20	40
C[C@H]1CCC[C@@H](C2CN(C(=O)NCCCCn3ccnc3)C2)C1	ZINC000875133054	DG	On-Demand	Anodyne	QPCT	29	40
COc1ccccc1[C@@H]1CSCCCN1C(=O)NCCCCn1ccnc1	ZINC000875133061	GH	On-Demand	Anodyne	DRD2	19	41
COc1ccccc1[C@@H]1CSCCCN1C(=O)NCCCCn1ccnc1	ZINC000875133061	GH	On-Demand	Anodyne	DRD3	32	41
COc1ccccc1[C@@H]1CSCCCN1C(=O)NCCCCn1ccnc1	ZINC000875133061	GH	On-Demand	Anodyne	QPCT	43	46
CSCC[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)N1CCCc2cc(C)ccc21	ZINC000875133069	JJ	On-Demand	Anodyne	F2	36	44
CSCC[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)N1CCCc2cc(C)ccc21	ZINC000875133069	JJ	On-Demand	Anodyne	TRY2_BOVIN	79	42
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1	ZINC000875133092	GF	On-Demand	Mild	ASAH1	91	45
CCCCCCCNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1	ZINC000875133094	GF	On-Demand	Mild	ASAH1	91	45
O=C(NCCCCn1ccnc1)NCC[C@H](O)C1CCCC1	ZINC000875133095	DD	On-Demand	Anodyne	TBXAS1	31	45
O=C(NCCCCn1ccnc1)NCC[C@H](O)C1CCCC1	ZINC000875133095	DD	On-Demand	Anodyne	QPCT	30	48
O=C(NCCCCn1ccnc1)NCC[C@@H](O)C1CCCC1	ZINC000875133097	DD	On-Demand	Anodyne	TBXAS1	31	45
O=C(NCCCCn1ccnc1)NCC[C@@H](O)C1CCCC1	ZINC000875133097	DD	On-Demand	Anodyne	QPCT	30	48
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H](C)CCN(C)C)CC2)c(OC)c1	ZINC000875133104	GC	On-Demand	Clean	PDGFRB	25	40
COc1ccc(N2CCN(C(=O)C(=O)N[C@H](C)CCN(C)C)CC2)c(OC)c1	ZINC000875133107	GC	On-Demand	Clean	PDGFRB	25	40
C[C@@H](CCN(C)C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875133110	GD	On-Demand	Anodyne	DRD2	25	43
C[C@@H](CCN(C)C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875133110	GD	On-Demand	Anodyne	DRD4	46	44
C[C@@H](CCN(C)C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875133110	GD	On-Demand	Anodyne	ACHE	64	59
C[C@@H](CCN(C)C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875133110	GD	On-Demand	Anodyne	DRD3	18	44
C[C@@H](CCN(C)C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875133110	GD	On-Demand	Anodyne	SLC6A3	18	49
C[C@@H](CCN(C)C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875133110	GD	On-Demand	Anodyne	HTR4	35	46
C[C@@H](CCN(C)C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875133110	GD	On-Demand	Anodyne	TACR2	17	42
C[C@@H](CCN(C)C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875133110	GD	On-Demand	Anodyne	SIGMAR1	55	48
C[C@@H](CCN(C)C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875133110	GD	On-Demand	Anodyne	BCHE	18	49
C[C@@H](CCN(C)C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875133110	GD	On-Demand	Anodyne	MCHR1	35	49
C[C@@H](CCN(C)C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875133110	GD	On-Demand	Anodyne	CACNA1G	39	40
C[C@@H](CCN(C)C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875133110	GD	On-Demand	Anodyne	CACNA1I	54	38
Cc1noc(C)c1CNC(=O)C(=O)NCc1cn(C(F)F)c2ccccc12	ZINC000875133139	GF	On-Demand	Anodyne	P2RX7	24	49
CNC(=O)CCCNC(=O)NC1CC(Nc2ccccc2)C1	ZINC000875133195	DD	On-Demand	Anodyne	EPHX2	18	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCCn1ccnc1	ZINC000875133216	DD	On-Demand	Anodyne	TBXAS1	29	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCCn1ccnc1	ZINC000875133216	DD	On-Demand	Anodyne	QPCT	36	41
COCC1CC(NC(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133265	DD	On-Demand	Anodyne	ACE	15	44
COCC1CC(NC(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133265	DD	On-Demand	Anodyne	MME	43	44
COCC1CC(NC(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133265	DD	On-Demand	Anodyne	PAPA1_CARPA	41	34
COCC1CC(NC(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133266	DD	On-Demand	Anodyne	ACE	15	44
COCC1CC(NC(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133266	DD	On-Demand	Anodyne	MME	43	44
COCC1CC(NC(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133266	DD	On-Demand	Anodyne	PAPA1_CARPA	41	34
O=C(NCCNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1F	ZINC000875133303	GF	On-Demand	Anodyne	EPHX2	27	40
O=C(NCCNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1F	ZINC000875133303	GF	On-Demand	Anodyne	SCD1	17	42
O=C(NCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1F	ZINC000875133304	GF	On-Demand	Anodyne	EPHX2	27	40
O=C(NCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1F	ZINC000875133304	GF	On-Demand	Anodyne	SCD1	17	42
CNC(=O)CCCNC(=O)NC1(C)CCC(C)(C)CC1	ZINC000875133307	CE	On-Demand	Anodyne	EPHX2	19	41
CCOC(=O)[C@@H]1CN(C(=O)NCCCCn2ccnc2)CCC1(F)F	ZINC000875133323	FD	On-Demand	Anodyne	TBXAS1	22	41
COC(=O)N(C)NC(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000875133324	DD	On-Demand	Reactive	MME	76	40
COC(=O)N(C)NC(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000875133324	DD	On-Demand	Reactive	ANPEP	47	34
COC(=O)N(C)NC(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000875133324	DD	On-Demand	Reactive	PAPA1_CARPA	47	35
COC(=O)N(C)NC(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000875133325	DD	On-Demand	Reactive	MME	76	40
COC(=O)N(C)NC(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000875133325	DD	On-Demand	Reactive	ANPEP	47	34
COC(=O)N(C)NC(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000875133325	DD	On-Demand	Reactive	PAPA1_CARPA	47	35
O=C(NCc1cccc(O)c1)N1Cc2cccnc2N2C[C@H](O)C[C@H]2C1	ZINC000875133355	FD	On-Demand	Anodyne	NAMPT	20	40
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NCCCCn1ccnc1	ZINC000875133367	FF	On-Demand	Anodyne	TBXAS1	55	56
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NCCCCn1ccnc1	ZINC000875133367	FF	On-Demand	Anodyne	HMOX2	46	34
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NCCCCn1ccnc1	ZINC000875133367	FF	On-Demand	Anodyne	QPCT	36	45
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133394	FD	On-Demand	Anodyne	ACE	45	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133394	FD	On-Demand	Anodyne	MME	55	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133394	FD	On-Demand	Anodyne	TIMP3	43	32
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133394	FD	On-Demand	Anodyne	CAPNS1	60	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133394	FD	On-Demand	Anodyne	REN	46	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133394	FD	On-Demand	Anodyne	CAPN1	44	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133394	FD	On-Demand	Anodyne	Q6PRC7_IXORI	45	35
COC(=O)N(C)NC(=O)NCc1ccccc1OCC(C)C	ZINC000875133395	DE	On-Demand	Reactive	ANPEP	17	47
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133397	FD	On-Demand	Anodyne	ACE	45	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133397	FD	On-Demand	Anodyne	MME	55	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133397	FD	On-Demand	Anodyne	TIMP3	43	32
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133397	FD	On-Demand	Anodyne	CAPNS1	60	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133397	FD	On-Demand	Anodyne	REN	46	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133397	FD	On-Demand	Anodyne	CAPN1	44	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133397	FD	On-Demand	Anodyne	Q6PRC7_IXORI	45	35
O=C(NCc1cccc(O)c1)NC1CC(Nc2ccccc2)C1	ZINC000875133416	DF	On-Demand	Anodyne	EPHX2	20	45
O=C(NCCCCn1ccnc1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875133429	EC	On-Demand	Anodyne	TBXAS1	24	47
O=C(NCCCCn1ccnc1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875133430	DD	On-Demand	Anodyne	TBXAS1	26	42
O=C(NCCCCn1ccnc1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875133472	EF	On-Demand	Anodyne	TBXAS1	26	48
O=C(NCCCCn1ccnc1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875133472	EF	On-Demand	Anodyne	QPCT	30	41
O=C(NCCCCn1ccnc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875133474	FF	On-Demand	Anodyne	TBXAS1	55	45
O=C(NCCCCn1ccnc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875133474	FF	On-Demand	Anodyne	CYP24A1	40	35
O=C(NCCCCn1ccnc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875133474	FF	On-Demand	Anodyne	CYP27B1	52	35
O=C(NCCCCn1ccnc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875133475	FF	On-Demand	Anodyne	TBXAS1	55	45
O=C(NCCCCn1ccnc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875133475	FF	On-Demand	Anodyne	CYP24A1	40	35
O=C(NCCCCn1ccnc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875133475	FF	On-Demand	Anodyne	CYP27B1	52	35
O=C(NCCCCn1ccnc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875133478	FF	On-Demand	Anodyne	TBXAS1	55	45
O=C(NCCCCn1ccnc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875133478	FF	On-Demand	Anodyne	CYP24A1	40	35
O=C(NCCCCn1ccnc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875133478	FF	On-Demand	Anodyne	CYP27B1	52	35
O=C(NCCCCn1ccnc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875133480	FF	On-Demand	Anodyne	TBXAS1	55	45
O=C(NCCCCn1ccnc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875133480	FF	On-Demand	Anodyne	CYP24A1	40	35
O=C(NCCCCn1ccnc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875133480	FF	On-Demand	Anodyne	CYP27B1	52	35
C[C@H](NC(=O)NCCCCn1ccnc1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875133481	FE	On-Demand	Anodyne	TBXAS1	21	40
C[C@H](NC(=O)NCCCCn1ccnc1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875133481	FE	On-Demand	Anodyne	QPCT	28	41
C[C@@H](NC(=O)NCCCCn1ccnc1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875133483	FE	On-Demand	Anodyne	TBXAS1	21	40
C[C@@H](NC(=O)NCCCCn1ccnc1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875133483	FE	On-Demand	Anodyne	QPCT	28	41
O=C(NCCCCn1ccnc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875133487	EF	On-Demand	Anodyne	TBXAS1	57	46
O=C(NCCCCn1ccnc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875133487	EF	On-Demand	Anodyne	CYP24A1	41	36
O=C(NCCCCn1ccnc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875133487	EF	On-Demand	Anodyne	CYP27B1	53	36
O=C(NCCCCn1ccnc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875133489	EF	On-Demand	Anodyne	TBXAS1	57	46
O=C(NCCCCn1ccnc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875133489	EF	On-Demand	Anodyne	CYP24A1	41	36
O=C(NCCCCn1ccnc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875133489	EF	On-Demand	Anodyne	CYP27B1	53	36
O=C(NCCCCn1ccnc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875133490	EF	On-Demand	Anodyne	TBXAS1	57	46
O=C(NCCCCn1ccnc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875133490	EF	On-Demand	Anodyne	CYP24A1	41	36
O=C(NCCCCn1ccnc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875133490	EF	On-Demand	Anodyne	CYP27B1	53	36
O=C(NCCCCn1ccnc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875133491	EF	On-Demand	Anodyne	TBXAS1	57	46
O=C(NCCCCn1ccnc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875133491	EF	On-Demand	Anodyne	CYP24A1	41	36
O=C(NCCCCn1ccnc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875133491	EF	On-Demand	Anodyne	CYP27B1	53	36
CNC(=O)CCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875133503	EF	On-Demand	Anodyne	DRD2	30	43
CNC(=O)CCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875133503	EF	On-Demand	Anodyne	DRD4	16	44
CNC(=O)CCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875133504	EF	On-Demand	Anodyne	DRD2	30	43
CNC(=O)CCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875133504	EF	On-Demand	Anodyne	DRD4	16	44
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133521	EE	On-Demand	Anodyne	TIMP3	75	39
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133523	EE	On-Demand	Anodyne	TIMP3	75	39
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H](Cc2ccccc2)CN(C)C)cc1	ZINC000875133536	GF	On-Demand	Anodyne	MME	51	37
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H](Cc2ccccc2)CN(C)C)cc1	ZINC000875133536	GF	On-Demand	Anodyne	ANPEP	31	42
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H](Cc2ccccc2)CN(C)C)cc1	ZINC000875133536	GF	On-Demand	Anodyne	CTSB	18	40
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H](Cc2ccccc2)CN(C)C)cc1	ZINC000875133536	GF	On-Demand	Anodyne	PAPA1_CARPA	32	40
CC(=O)N(C)c1ccc(CNC(=O)N[C@H](Cc2ccccc2)CN(C)C)cc1	ZINC000875133537	GF	On-Demand	Anodyne	MME	51	37
CC(=O)N(C)c1ccc(CNC(=O)N[C@H](Cc2ccccc2)CN(C)C)cc1	ZINC000875133537	GF	On-Demand	Anodyne	ANPEP	31	42
CC(=O)N(C)c1ccc(CNC(=O)N[C@H](Cc2ccccc2)CN(C)C)cc1	ZINC000875133537	GF	On-Demand	Anodyne	CTSB	18	40
CC(=O)N(C)c1ccc(CNC(=O)N[C@H](Cc2ccccc2)CN(C)C)cc1	ZINC000875133537	GF	On-Demand	Anodyne	PAPA1_CARPA	32	40
CCCCCCCNC(=O)C(=O)NC1CCN(c2nccs2)CC1	ZINC000875133539	FE	On-Demand	Mild	ASAH1	54	33
CN1CC[C@H]2CN(C(=O)C(=O)NCCc3cc(Cl)cc(Cl)c3)CC[C@@H]21	ZINC000875133540	GE	On-Demand	Anodyne	CACNA1I	48	37
CN1CC[C@H]2CN(C(=O)C(=O)NCCc3cc(Cl)cc(Cl)c3)CC[C@H]21	ZINC000875133544	GE	On-Demand	Anodyne	CACNA1I	48	37
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCc2cccc(C(F)(F)F)c2)C1	ZINC000875133591	GF	On-Demand	Anodyne	HRH2	19	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCc2cccc(C(F)(F)F)c2)C1	ZINC000875133591	GF	On-Demand	Anodyne	CACNA1B	40	36
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCc2cccc(C(F)(F)F)c2)C1	ZINC000875133591	GF	On-Demand	Anodyne	CCR2	73	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCc2cccc(C(F)(F)F)c2)C1	ZINC000875133596	GF	On-Demand	Anodyne	HRH2	19	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCc2cccc(C(F)(F)F)c2)C1	ZINC000875133596	GF	On-Demand	Anodyne	CACNA1B	40	36
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCc2cccc(C(F)(F)F)c2)C1	ZINC000875133596	GF	On-Demand	Anodyne	CCR2	73	37
C=C(C)CN(CC)C(=O)c1ccc(-n2cccn2)nc1	ZINC000875133628	CE	On-Demand	Mild	OPRD1	15	41
O=C(NCCCCn1ccnc1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875133652	ED	On-Demand	Anodyne	TBXAS1	30	49
O=C(NCCCCn1ccnc1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875133652	ED	On-Demand	Anodyne	QPCT	28	40
O=C(NCCCCn1ccnc1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875133654	ED	On-Demand	Anodyne	TBXAS1	30	49
O=C(NCCCCn1ccnc1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875133654	ED	On-Demand	Anodyne	QPCT	28	40
CCC1(CC)CCCN1C(=O)NCCCCn1ccnc1	ZINC000875133684	CG	On-Demand	Anodyne	TBXAS1	40	43
CCC1(CC)CCCN1C(=O)NCCCCn1ccnc1	ZINC000875133684	CG	On-Demand	Anodyne	QPCT	40	39
CCCCCCCNC(=O)C(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000875133701	CD	On-Demand	Mild	ASAH1	53	33
CCCCCCCNC(=O)C(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000875133701	CD	On-Demand	Mild	LASR	46	33
CCCCCCCNC(=O)C(=O)N[C@H]1CCN(C2CC2)C1	ZINC000875133702	CD	On-Demand	Mild	ASAH1	53	33
CCCCCCCNC(=O)C(=O)N[C@H]1CCN(C2CC2)C1	ZINC000875133702	CD	On-Demand	Mild	LASR	46	33
CCC1(CC)CCCN1C(=O)NCc1cccc(O)c1	ZINC000875133708	CG	On-Demand	Anodyne	SLC12A5	67	37
O=C(NCc1cccc2c1OCO2)N1CCC[C@H](OC2CCC2)CC1	ZINC000875133712	EG	On-Demand	Anodyne	EPHX2	20	43
O=C(NCc1cccc2c1OCO2)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875133714	EG	On-Demand	Anodyne	EPHX2	20	43
CN1CCN(C(=O)NCCCCn2ccnc2)CCC1(C)C	ZINC000875133716	DD	On-Demand	Anodyne	TBXAS1	35	45
CN1CCN(C(=O)NCCCCn2ccnc2)CCC1(C)C	ZINC000875133716	DD	On-Demand	Anodyne	QPCT	36	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133718	EE	On-Demand	Anodyne	ACE	52	37
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133718	EE	On-Demand	Anodyne	SLC6A1	55	33
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133718	EE	On-Demand	Anodyne	OPRM1	29	42
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133718	EE	On-Demand	Anodyne	MME	48	42
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133718	EE	On-Demand	Anodyne	CACNA1B	34	42
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133718	EE	On-Demand	Anodyne	PREP	34	41
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133718	EE	On-Demand	Anodyne	REN	55	39
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133718	EE	On-Demand	Anodyne	DPP7	52	38
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133718	EE	On-Demand	Anodyne	Q9N6S8_PLAFA	15	41
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133719	EE	On-Demand	Anodyne	ACE	52	37
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133719	EE	On-Demand	Anodyne	SLC6A1	55	33
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133719	EE	On-Demand	Anodyne	OPRM1	29	42
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133719	EE	On-Demand	Anodyne	MME	48	42
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133719	EE	On-Demand	Anodyne	CACNA1B	34	42
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133719	EE	On-Demand	Anodyne	PREP	34	41
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133719	EE	On-Demand	Anodyne	REN	55	39
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133719	EE	On-Demand	Anodyne	DPP7	52	38
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133719	EE	On-Demand	Anodyne	Q9N6S8_PLAFA	15	41
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133720	EE	On-Demand	Anodyne	ACE	52	37
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133720	EE	On-Demand	Anodyne	SLC6A1	55	33
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133720	EE	On-Demand	Anodyne	OPRM1	29	42
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133720	EE	On-Demand	Anodyne	MME	48	42
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133720	EE	On-Demand	Anodyne	CACNA1B	34	42
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133720	EE	On-Demand	Anodyne	PREP	34	41
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133720	EE	On-Demand	Anodyne	REN	55	39
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133720	EE	On-Demand	Anodyne	DPP7	52	38
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133720	EE	On-Demand	Anodyne	Q9N6S8_PLAFA	15	41
CC(=O)[C@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133722	EE	On-Demand	Anodyne	ACE	52	37
CC(=O)[C@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133722	EE	On-Demand	Anodyne	SLC6A1	55	33
CC(=O)[C@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133722	EE	On-Demand	Anodyne	OPRM1	29	42
CC(=O)[C@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133722	EE	On-Demand	Anodyne	MME	48	42
CC(=O)[C@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133722	EE	On-Demand	Anodyne	CACNA1B	34	42
CC(=O)[C@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133722	EE	On-Demand	Anodyne	PREP	34	41
CC(=O)[C@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133722	EE	On-Demand	Anodyne	REN	55	39
CC(=O)[C@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133722	EE	On-Demand	Anodyne	DPP7	52	38
CC(=O)[C@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)C1	ZINC000875133722	EE	On-Demand	Anodyne	Q9N6S8_PLAFA	15	41
O=C(NCCCCn1ccnc1)NNc1cccc(F)c1Br	ZINC000875133749	FF	On-Demand	Reactive	TBXAS1	47	50
O=C(NCCCCn1ccnc1)NNc1cccc(F)c1Br	ZINC000875133749	FF	On-Demand	Reactive	QPCT	34	45
CNC(=O)CCCNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875133773	ED	On-Demand	Anodyne	NPFFR1	41	38
O=C(NCCCCn1ccnc1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875133776	EE	On-Demand	Anodyne	TBXAS1	52	44
O=C(NCCCCn1ccnc1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875133776	EE	On-Demand	Anodyne	QPCT	40	39
O=C(NCCCCn1ccnc1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875133777	EE	On-Demand	Anodyne	TBXAS1	52	44
O=C(NCCCCn1ccnc1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875133777	EE	On-Demand	Anodyne	QPCT	40	39
COC(=O)c1ccc(OC)c2c1CCN(C(=O)NCCCCn1ccnc1)C2	ZINC000875133781	GE	On-Demand	Anodyne	TBXAS1	35	42
COC(=O)c1ccc(OC)c2c1CCN(C(=O)NCCCCn1ccnc1)C2	ZINC000875133781	GE	On-Demand	Anodyne	QPCT	46	50
CNC(=O)CCCNC(=O)NNc1ccc(OC)cc1Br	ZINC000875133783	FD	On-Demand	Reactive	MTNR1A	56	40
CNC(=O)CCCNC(=O)NNc1ccc(OC)cc1Br	ZINC000875133783	FD	On-Demand	Reactive	MTNR1B	48	39
COCCN(CC1CCN(C)CC1)C(=O)NCCCCn1ccnc1	ZINC000875133789	FD	On-Demand	Anodyne	TBXAS1	22	40
O=C(NCc1cccc(O)c1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875133804	EG	On-Demand	Anodyne	FKBP1A	38	41
O=C(NCc1cccc(O)c1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875133804	EG	On-Demand	Anodyne	PREP	44	43
O=C(NCc1cccc(O)c1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875133804	EG	On-Demand	Anodyne	TMPRSS11D	51	32
O=C(NCc1cccc(O)c1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875133806	EG	On-Demand	Anodyne	FKBP1A	38	41
O=C(NCc1cccc(O)c1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875133806	EG	On-Demand	Anodyne	PREP	44	43
O=C(NCc1cccc(O)c1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875133806	EG	On-Demand	Anodyne	TMPRSS11D	51	32
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCCn3ccnc3)C[C@@H]1C2	ZINC000875133807	DD	On-Demand	Anodyne	QPCT	35	44
O=C(NCc1cccc(O)c1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875133808	EG	On-Demand	Anodyne	FKBP1A	38	41
O=C(NCc1cccc(O)c1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875133808	EG	On-Demand	Anodyne	PREP	44	43
O=C(NCc1cccc(O)c1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875133808	EG	On-Demand	Anodyne	TMPRSS11D	51	32
O=C(NCc1cccc(O)c1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875133810	EG	On-Demand	Anodyne	FKBP1A	38	41
O=C(NCc1cccc(O)c1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875133810	EG	On-Demand	Anodyne	PREP	44	43
O=C(NCc1cccc(O)c1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875133810	EG	On-Demand	Anodyne	TMPRSS11D	51	32
O=C(NCc1cccc(O)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875133815	DG	On-Demand	Anodyne	EPHX2	24	43
O=C(NCc1cccc(O)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875133815	DG	On-Demand	Anodyne	TPSAB1	15	43
O=C(NCc1cccc(O)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875133816	DG	On-Demand	Anodyne	EPHX2	24	43
O=C(NCc1cccc(O)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875133816	DG	On-Demand	Anodyne	TPSAB1	15	43
O=C(NCCCCn1ccnc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875133828	EF	On-Demand	Anodyne	TBXAS1	35	45
O=C(NCCCCn1ccnc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875133828	EF	On-Demand	Anodyne	QPCT	33	42
O=C(NCCCCn1ccnc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875133829	EF	On-Demand	Anodyne	TBXAS1	35	45
O=C(NCCCCn1ccnc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875133829	EF	On-Demand	Anodyne	QPCT	33	42
O=C(NCCCCn1ccnc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875133830	FE	On-Demand	Anodyne	CYP11B1	18	48
O=C(NCCCCn1ccnc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875133830	FE	On-Demand	Anodyne	TBXAS1	61	51
O=C(NCCCCn1ccnc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875133830	FE	On-Demand	Anodyne	HMOX2	50	38
O=C(NCCCCn1ccnc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875133830	FE	On-Demand	Anodyne	QPCT	40	46
O=C(NCCCCn1ccnc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875133831	FE	On-Demand	Anodyne	CYP11B1	18	48
O=C(NCCCCn1ccnc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875133831	FE	On-Demand	Anodyne	TBXAS1	61	51
O=C(NCCCCn1ccnc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875133831	FE	On-Demand	Anodyne	HMOX2	50	38
O=C(NCCCCn1ccnc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875133831	FE	On-Demand	Anodyne	QPCT	40	46
O=CN1CCCN(C(=O)N[C@@H](Cc2ccc(Cl)cc2)c2ccccc2)CC1	ZINC000875133832	GG	On-Demand	Anodyne	MC4R	67	38
O=CN1CCCN(C(=O)N[C@@H](Cc2ccc(Cl)cc2)c2ccccc2)CC1	ZINC000875133832	GG	On-Demand	Anodyne	DPP7	47	41
O=CN1CCCN(C(=O)N[C@H](Cc2ccc(Cl)cc2)c2ccccc2)CC1	ZINC000875133833	GG	On-Demand	Anodyne	MC4R	67	38
O=CN1CCCN(C(=O)N[C@H](Cc2ccc(Cl)cc2)c2ccccc2)CC1	ZINC000875133833	GG	On-Demand	Anodyne	DPP7	47	41
CNC(=O)CCCNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875133834	ED	On-Demand	Anodyne	OPRL1	19	43
COC(=O)N(C)NC(=O)NCCNC(=O)c1ccccc1F	ZINC000875133839	DC	On-Demand	Reactive	ECR	37	43
COC(=O)N(C)NC(=O)NCCNC(=O)c1ccccc1F	ZINC000875133839	DC	On-Demand	Reactive	E3UJZ5_SPOLI	20	43
O=C(NCCCCn1ccnc1)NC[C@H]1C[C@H](O)C1	ZINC000875133841	CC	On-Demand	Anodyne	TBXAS1	38	46
O=C(NCCCCn1ccnc1)NC[C@H]1C[C@H](O)C1	ZINC000875133841	CC	On-Demand	Anodyne	QPCT	35	44
O=C(NCCCCn1ccnc1)NNc1cccc(F)c1Cl	ZINC000875133845	EF	On-Demand	Reactive	TBXAS1	52	55
O=C(NCCCCn1ccnc1)NNc1cccc(F)c1Cl	ZINC000875133845	EF	On-Demand	Reactive	HMOX2	50	35
O=C(NCCCCn1ccnc1)NNc1cccc(F)c1Cl	ZINC000875133845	EF	On-Demand	Reactive	QPCT	35	45
O=C(NCCNC(=O)c1ccccc1F)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875133851	GE	On-Demand	Anodyne	ADRB1	24	40
O=C(NCCNC(=O)c1ccccc1F)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875133851	GE	On-Demand	Anodyne	ADRB3	19	40
O=C(NCCNC(=O)c1ccccc1F)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875133851	GE	On-Demand	Anodyne	SLC6A5	20	42
O=C(NCCNC(=O)c1ccccc1F)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875133852	GE	On-Demand	Anodyne	ADRB1	24	40
O=C(NCCNC(=O)c1ccccc1F)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875133852	GE	On-Demand	Anodyne	ADRB3	19	40
O=C(NCCNC(=O)c1ccccc1F)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875133852	GE	On-Demand	Anodyne	SLC6A5	20	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cn2ccc(C)cc2n1	ZINC000875133855	ED	On-Demand	Anodyne	SLC6A3	41	35
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cn2ccc(C)cc2n1	ZINC000875133856	ED	On-Demand	Anodyne	SLC6A3	41	35
CNC(=O)CCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875133858	FE	On-Demand	Reactive	TSHR	40	31
CNC(=O)CCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875133858	FE	On-Demand	Reactive	MAOB	25	44
CNC(=O)CCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875133858	FE	On-Demand	Reactive	LTA4H	50	53
CNC(=O)CCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875133858	FE	On-Demand	Reactive	SCN2A	19	44
CNC(=O)CCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875133858	FE	On-Demand	Reactive	MTNR1B	20	42
CNC(=O)CCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875133858	FE	On-Demand	Reactive	FFAR1	38	43
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H]1CCN(C3CC3)C1)CC2	ZINC000875133877	GD	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@H]1CCN(C3CC3)C1)CC2	ZINC000875133879	GD	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@@H]1CCN(C3CC3)C1)CC2	ZINC000875133881	GD	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H]1CCN(C3CC3)C1)CC2	ZINC000875133883	GD	On-Demand	Anodyne	SLC18A2	49	36
CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H]1CCCN2C(=O)NCCCCn1ccnc1	ZINC000875133888	GF	On-Demand	Anodyne	TBXAS1	31	41
CC(C)(C)OC(=O)N1CC[C@@H]2[C@H]1CCCN2C(=O)NCCCCn1ccnc1	ZINC000875133891	GF	On-Demand	Anodyne	TBXAS1	31	41
CC(C)(C)OC(=O)N1CC[C@H]2[C@@H]1CCCN2C(=O)NCCCCn1ccnc1	ZINC000875133893	GF	On-Demand	Anodyne	TBXAS1	31	41
CC(C)(C)OC(=O)N1CC[C@H]2[C@H]1CCCN2C(=O)NCCCCn1ccnc1	ZINC000875133895	GF	On-Demand	Anodyne	TBXAS1	31	41
CN1CCN(C(=O)NCCNC(=O)c2ccccc2F)CCC1(C)C	ZINC000875133925	FD	On-Demand	Anodyne	HCN1	49	35
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000875133933	DE	On-Demand	Anodyne	MME	98	44
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000875133933	DE	On-Demand	Anodyne	ANPEP	68	38
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000875133933	DE	On-Demand	Anodyne	CTSB	40	39
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000875133933	DE	On-Demand	Anodyne	PAPA1_CARPA	56	36
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000875133933	DE	On-Demand	Anodyne	NAALAD2	18	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000875133933	DE	On-Demand	Anodyne	CAPNS1	58	34
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000875133933	DE	On-Demand	Anodyne	CAPN1	53	35
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000875133933	DE	On-Demand	Anodyne	CAPN2	54	33
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000875133933	DE	On-Demand	Anodyne	ACE2	52	38
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000875133933	DE	On-Demand	Anodyne	FPR1	57	39
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000875133935	DE	On-Demand	Anodyne	MME	98	44
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000875133935	DE	On-Demand	Anodyne	ANPEP	68	38
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000875133935	DE	On-Demand	Anodyne	CTSB	40	39
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000875133935	DE	On-Demand	Anodyne	PAPA1_CARPA	56	36
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000875133935	DE	On-Demand	Anodyne	NAALAD2	18	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000875133935	DE	On-Demand	Anodyne	CAPNS1	58	34
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000875133935	DE	On-Demand	Anodyne	CAPN1	53	35
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000875133935	DE	On-Demand	Anodyne	CAPN2	54	33
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000875133935	DE	On-Demand	Anodyne	ACE2	52	38
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000875133935	DE	On-Demand	Anodyne	FPR1	57	39
O=C(NCc1cccc(O)c1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875133937	EF	On-Demand	Anodyne	OPRM1	31	44
O=C(NCc1cccc(O)c1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875133937	EF	On-Demand	Anodyne	OPRD1	25	44
O=C(NCc1cccc(O)c1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875133937	EF	On-Demand	Anodyne	OPRK1	33	44
O=C(NCc1cccc(O)c1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875133937	EF	On-Demand	Anodyne	EPHX2	15	51
O=C(NCc1cccc(O)c1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875133937	EF	On-Demand	Anodyne	NPSR1	25	40
O=C(NCc1cccc(O)c1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875133937	EF	On-Demand	Anodyne	SLC12A5	57	34
O=C(NCCCCn1ccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875133938	CE	On-Demand	Anodyne	TBXAS1	25	43
O=C(NCCCCn1ccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875133938	CE	On-Demand	Anodyne	QPCT	28	41
O=C(NCc1cccc(O)c1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875133939	EF	On-Demand	Anodyne	OPRM1	31	44
O=C(NCc1cccc(O)c1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875133939	EF	On-Demand	Anodyne	OPRD1	25	44
O=C(NCc1cccc(O)c1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875133939	EF	On-Demand	Anodyne	OPRK1	33	44
O=C(NCc1cccc(O)c1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875133939	EF	On-Demand	Anodyne	EPHX2	15	51
O=C(NCc1cccc(O)c1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875133939	EF	On-Demand	Anodyne	NPSR1	25	40
O=C(NCc1cccc(O)c1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875133939	EF	On-Demand	Anodyne	SLC12A5	57	34
O=C(NCCCCn1ccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875133941	CE	On-Demand	Anodyne	TBXAS1	25	43
O=C(NCCCCn1ccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875133941	CE	On-Demand	Anodyne	QPCT	28	41
O=C(NCCCCn1ccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875133943	CE	On-Demand	Anodyne	TBXAS1	25	43
O=C(NCCCCn1ccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875133943	CE	On-Demand	Anodyne	QPCT	28	41
O=C(NCCCCn1ccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875133944	CE	On-Demand	Anodyne	TBXAS1	25	43
O=C(NCCCCn1ccnc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875133944	CE	On-Demand	Anodyne	QPCT	28	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCn2ccnc2)C1	ZINC000875133950	DD	On-Demand	Anodyne	TBXAS1	32	44
CC[C@@H]1COCCN1CCNC(=O)NCCCCn1ccnc1	ZINC000875133956	DD	On-Demand	Anodyne	TBXAS1	21	41
CC[C@@H]1COCCN1CCNC(=O)NCCCCn1ccnc1	ZINC000875133956	DD	On-Demand	Anodyne	QPCT	29	40
COC(=O)N(C)NC(=O)NCCCc1ccc(OC)cc1	ZINC000875133963	CD	On-Demand	Reactive	SCNN1A	34	43
COC(=O)N(C)NC(=O)NCCCc1ccc(OC)cc1	ZINC000875133963	CD	On-Demand	Reactive	MTNR1A	83	48
COC(=O)N(C)NC(=O)NCCCc1ccc(OC)cc1	ZINC000875133963	CD	On-Demand	Reactive	MTNR1B	66	44
COC(=O)N(C)NC(=O)NCCCc1ccc(OC)cc1	ZINC000875133963	CD	On-Demand	Reactive	CA9	15	41
O=C(NCc1cccc(O)c1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875133985	GG	On-Demand	Anodyne	NAMPT	54	34
CCn1ncc(CNC(=O)N[C@@H](Cc2ccccc2)CN(C)C)n1	ZINC000875134017	ED	On-Demand	Anodyne	MME	45	33
CCn1ncc(CNC(=O)N[C@@H](Cc2ccccc2)CN(C)C)n1	ZINC000875134017	ED	On-Demand	Anodyne	PAPA1_CARPA	41	35
CCn1ncc(CNC(=O)N[C@H](Cc2ccccc2)CN(C)C)n1	ZINC000875134018	ED	On-Demand	Anodyne	MME	45	33
CCn1ncc(CNC(=O)N[C@H](Cc2ccccc2)CN(C)C)n1	ZINC000875134018	ED	On-Demand	Anodyne	PAPA1_CARPA	41	35
CNC(=O)CCCNC(=O)N1CCC[C@@]1(C)Cc1ccc(C)cc1	ZINC000875134026	EF	On-Demand	Anodyne	SLC12A5	45	39
CNC(=O)CCCNC(=O)N1CCC[C@]1(C)Cc1ccc(C)cc1	ZINC000875134027	EF	On-Demand	Anodyne	SLC12A5	45	39
N#Cc1cccc([C@H](NC(=O)NCCCCn2ccnc2)C(F)(F)F)c1	ZINC000875134045	FG	On-Demand	Mild	TBXAS1	44	48
N#Cc1cccc([C@H](NC(=O)NCCCCn2ccnc2)C(F)(F)F)c1	ZINC000875134045	FG	On-Demand	Mild	HMOX2	40	36
N#Cc1cccc([C@H](NC(=O)NCCCCn2ccnc2)C(F)(F)F)c1	ZINC000875134045	FG	On-Demand	Mild	QPCT	37	43
N#Cc1cccc([C@@H](NC(=O)NCCCCn2ccnc2)C(F)(F)F)c1	ZINC000875134046	FG	On-Demand	Mild	TBXAS1	44	48
N#Cc1cccc([C@@H](NC(=O)NCCCCn2ccnc2)C(F)(F)F)c1	ZINC000875134046	FG	On-Demand	Mild	HMOX2	40	36
N#Cc1cccc([C@@H](NC(=O)NCCCCn2ccnc2)C(F)(F)F)c1	ZINC000875134046	FG	On-Demand	Mild	QPCT	37	43
CNC(=O)CCCNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875134049	ED	On-Demand	Mild	CTSF	60	33
CNC(=O)CCCNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875134050	ED	On-Demand	Mild	CTSF	60	33
CC[C@H](C[C@H](C)O)NC(=O)NCCNC(=O)c1ccccc1F	ZINC000875134057	ED	On-Demand	Anodyne	DAC	32	40
CN(C)C[C@@H]1CN(C(=O)NCCCCn2ccnc2)C[C@H]1CN(C)C	ZINC000875134062	FD	On-Demand	Anodyne	TBXAS1	31	44
CN(C)C[C@@H]1CN(C(=O)NCCCCn2ccnc2)C[C@H]1CN(C)C	ZINC000875134062	FD	On-Demand	Anodyne	QPCT	32	40
O=C(NCCCCn1ccnc1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875134072	DE	On-Demand	Anodyne	TBXAS1	29	41
O=C(NCCCCn1ccnc1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875134072	DE	On-Demand	Anodyne	QPCT	32	41
O=C(NCCCCn1ccnc1)NC1([C@H]2CCCCO2)CCC1	ZINC000875134073	DE	On-Demand	Anodyne	TBXAS1	29	41
O=C(NCCCCn1ccnc1)NC1([C@H]2CCCCO2)CCC1	ZINC000875134073	DE	On-Demand	Anodyne	QPCT	32	41
CC(=O)C1CCN(C(=O)C(=O)NCCc2cc(Cl)cc(Cl)c2)CC1	ZINC000875134075	FE	On-Demand	Anodyne	CACNA1I	54	35
CC[C@H](C[C@H](C)O)NC(=O)NCCCCn1ccnc1	ZINC000875134080	CD	On-Demand	Anodyne	TBXAS1	33	44
CC[C@H](C[C@H](C)O)NC(=O)NCCCCn1ccnc1	ZINC000875134080	CD	On-Demand	Anodyne	QPCT	33	44
O=C(NCCCCn1ccnc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875134083	EE	On-Demand	Anodyne	TBXAS1	24	46
O=C(NCCCCn1ccnc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875134085	EE	On-Demand	Anodyne	TBXAS1	24	46
O=C(NCc1cccc(O)c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875134087	EF	On-Demand	Anodyne	F2	42	45
O=C(NCc1cccc(O)c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875134087	EF	On-Demand	Anodyne	OPRM1	36	40
O=C(NCc1cccc(O)c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875134087	EF	On-Demand	Anodyne	OPRK1	19	40
O=C(NCc1cccc(O)c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875134087	EF	On-Demand	Anodyne	PREP	53	46
O=C(NCc1cccc(O)c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875134087	EF	On-Demand	Anodyne	TMPRSS11D	61	34
O=C(NCc1cccc(O)c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875134088	EF	On-Demand	Anodyne	F2	42	45
O=C(NCc1cccc(O)c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875134088	EF	On-Demand	Anodyne	OPRM1	36	40
O=C(NCc1cccc(O)c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875134088	EF	On-Demand	Anodyne	OPRK1	19	40
O=C(NCc1cccc(O)c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875134088	EF	On-Demand	Anodyne	PREP	53	46
O=C(NCc1cccc(O)c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875134088	EF	On-Demand	Anodyne	TMPRSS11D	61	34
O=C(NCc1cccc(O)c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875134089	EF	On-Demand	Anodyne	F2	42	45
O=C(NCc1cccc(O)c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875134089	EF	On-Demand	Anodyne	OPRM1	36	40
O=C(NCc1cccc(O)c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875134089	EF	On-Demand	Anodyne	OPRK1	19	40
O=C(NCc1cccc(O)c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875134089	EF	On-Demand	Anodyne	PREP	53	46
O=C(NCc1cccc(O)c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875134089	EF	On-Demand	Anodyne	TMPRSS11D	61	34
O=C(NCc1cccc(O)c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875134090	EF	On-Demand	Anodyne	F2	42	45
O=C(NCc1cccc(O)c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875134090	EF	On-Demand	Anodyne	OPRM1	36	40
O=C(NCc1cccc(O)c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875134090	EF	On-Demand	Anodyne	OPRK1	19	40
O=C(NCc1cccc(O)c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875134090	EF	On-Demand	Anodyne	PREP	53	46
O=C(NCc1cccc(O)c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875134090	EF	On-Demand	Anodyne	TMPRSS11D	61	34
CC(=O)C1CCN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)CC1	ZINC000875134098	EE	On-Demand	Anodyne	ACE	44	40
CC(=O)C1CCN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)CC1	ZINC000875134098	EE	On-Demand	Anodyne	MME	69	40
CC(=O)C1CCN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)CC1	ZINC000875134098	EE	On-Demand	Anodyne	CAPN1	33	43
CC(=O)C1CCN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)CC1	ZINC000875134098	EE	On-Demand	Anodyne	AMP1_PLAFQ	22	41
CC(=O)C1CCN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)CC1	ZINC000875134099	EE	On-Demand	Anodyne	ACE	44	40
CC(=O)C1CCN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)CC1	ZINC000875134099	EE	On-Demand	Anodyne	MME	69	40
CC(=O)C1CCN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)CC1	ZINC000875134099	EE	On-Demand	Anodyne	CAPN1	33	43
CC(=O)C1CCN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)CC1	ZINC000875134099	EE	On-Demand	Anodyne	AMP1_PLAFQ	22	41
O=C(NCCCCn1ccnc1)NC1CC(Nc2ccccc2)C1	ZINC000875134145	EF	On-Demand	Anodyne	TBXAS1	59	46
O=C(NCCCCn1ccnc1)NC1CC(Nc2ccccc2)C1	ZINC000875134145	EF	On-Demand	Anodyne	QPCT	36	46
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000875134157	EE	On-Demand	Anodyne	TIMP3	90	40
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000875134162	EE	On-Demand	Anodyne	TIMP3	90	40
CC[C@@H](NC(=O)C(=O)N[C@@H]1CCN(C2CC2)C1)c1cccc(OC)c1OC	ZINC000875134202	GD	On-Demand	Anodyne	DRD2	15	42
CC[C@@H](NC(=O)C(=O)N[C@H]1CCN(C2CC2)C1)c1cccc(OC)c1OC	ZINC000875134203	GD	On-Demand	Anodyne	DRD2	15	42
COCC(C)(C)CCNC(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000875134208	EF	On-Demand	Anodyne	PAPA1_CARPA	46	37
COCC(C)(C)CCNC(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000875134209	EF	On-Demand	Anodyne	PAPA1_CARPA	46	37
O=C(N[C@H]1CCN(C2CC2)C1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875134216	FD	On-Demand	Anodyne	CHRNA7	48	38
O=C(N[C@H]1CCN(C2CC2)C1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875134216	FD	On-Demand	Anodyne	C3AR1	46	45
O=C(N[C@@H]1CCN(C2CC2)C1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875134217	FD	On-Demand	Anodyne	CHRNA7	48	38
O=C(N[C@@H]1CCN(C2CC2)C1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875134217	FD	On-Demand	Anodyne	C3AR1	46	45
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000875134218	FD	On-Demand	Anodyne	CHRNA7	48	38
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000875134218	FD	On-Demand	Anodyne	C3AR1	46	45
O=C(NCCCCn1ccnc1)N1Cc2cccc(O)c2C1	ZINC000875134229	DE	On-Demand	Clean	TBXAS1	51	49
O=C(NCCCCn1ccnc1)N1Cc2cccc(O)c2C1	ZINC000875134229	DE	On-Demand	Clean	QPCT	43	40
O=C(N[C@H]1CCN(C2CC2)C1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875134252	FD	On-Demand	Anodyne	CHRNA7	48	38
O=C(N[C@H]1CCN(C2CC2)C1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875134252	FD	On-Demand	Anodyne	C3AR1	46	45
CCC1(N(C)C)CCN(C(=O)C(=O)NCc2ccc(-n3ccnc3)cc2)CC1	ZINC000875134280	GD	On-Demand	Anodyne	NOS2	84	34
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccc(-n3ccnc3)cc2)C1	ZINC000875134288	FD	On-Demand	Anodyne	NOS2	64	38
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000875134289	EC	On-Demand	Anodyne	SLC6A5	17	43
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000875134291	EC	On-Demand	Anodyne	SLC6A5	17	43
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)N[C@H]1CCN(C2CC2)C1	ZINC000875134293	EC	On-Demand	Anodyne	SLC6A5	17	43
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)N[C@H]1CCN(C2CC2)C1	ZINC000875134295	EC	On-Demand	Anodyne	SLC6A5	17	43
CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H]1CCCN2C(=O)NCc1cccc(O)c1	ZINC000875134302	GG	On-Demand	Anodyne	FKBP1A	25	40
CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H]1CCCN2C(=O)NCc1cccc(O)c1	ZINC000875134302	GG	On-Demand	Anodyne	PREP	40	39
CC(C)(C)OC(=O)N1CC[C@@H]2[C@H]1CCCN2C(=O)NCc1cccc(O)c1	ZINC000875134304	GG	On-Demand	Anodyne	FKBP1A	25	40
CC(C)(C)OC(=O)N1CC[C@@H]2[C@H]1CCCN2C(=O)NCc1cccc(O)c1	ZINC000875134304	GG	On-Demand	Anodyne	PREP	40	39
CC(C)(C)OC(=O)N1CC[C@H]2[C@@H]1CCCN2C(=O)NCc1cccc(O)c1	ZINC000875134307	GG	On-Demand	Anodyne	FKBP1A	25	40
CC(C)(C)OC(=O)N1CC[C@H]2[C@@H]1CCCN2C(=O)NCc1cccc(O)c1	ZINC000875134307	GG	On-Demand	Anodyne	PREP	40	39
CC(C)(C)OC(=O)N1CC[C@H]2[C@H]1CCCN2C(=O)NCc1cccc(O)c1	ZINC000875134309	GG	On-Demand	Anodyne	FKBP1A	25	40
CC(C)(C)OC(=O)N1CC[C@H]2[C@H]1CCCN2C(=O)NCc1cccc(O)c1	ZINC000875134309	GG	On-Demand	Anodyne	PREP	40	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccc(F)cc1)[C@H]1CCCO1	ZINC000875134315	GF	On-Demand	Anodyne	SLC6A4	18	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccc(F)cc1)[C@H]1CCCO1	ZINC000875134315	GF	On-Demand	Anodyne	SLC6A3	41	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccc(F)cc1)[C@@H]1CCCO1	ZINC000875134318	GF	On-Demand	Anodyne	SLC6A4	18	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccc(F)cc1)[C@@H]1CCCO1	ZINC000875134318	GF	On-Demand	Anodyne	SLC6A3	41	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccc(F)cc1)[C@@H]1CCCO1	ZINC000875134320	GF	On-Demand	Anodyne	SLC6A4	18	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccc(F)cc1)[C@@H]1CCCO1	ZINC000875134320	GF	On-Demand	Anodyne	SLC6A3	41	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccc(F)cc1)[C@H]1CCCO1	ZINC000875134322	GF	On-Demand	Anodyne	SLC6A4	18	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccc(F)cc1)[C@H]1CCCO1	ZINC000875134322	GF	On-Demand	Anodyne	SLC6A3	41	45
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCc2ccc(-n3ccnc3)cc2)c1	ZINC000875134323	GF	On-Demand	Anodyne	NOS2	79	38
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCc2ccc(-n3ccnc3)cc2)c1	ZINC000875134325	GF	On-Demand	Anodyne	NOS2	79	38
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N[C@@H](C1CCC1)[C@H]1CCCO1	ZINC000875134383	GD	On-Demand	Anodyne	NOS2	55	34
O=C(NCC[C@@H]1CCSC1)C(=O)NC1CCN(c2nccs2)CC1	ZINC000875134385	FD	On-Demand	Anodyne	SIRT3	40	33
O=C(NCC[C@@H]1CCSC1)C(=O)NC1CCN(c2nccs2)CC1	ZINC000875134385	FD	On-Demand	Anodyne	SIRT2	45	33
O=C(NCC[C@@H]1CCSC1)C(=O)NC1CCN(c2nccs2)CC1	ZINC000875134385	FD	On-Demand	Anodyne	SIRT1	41	33
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N[C@@H](C1CCC1)[C@@H]1CCCO1	ZINC000875134386	GD	On-Demand	Anodyne	NOS2	55	34
O=C(NCC[C@H]1CCSC1)C(=O)NC1CCN(c2nccs2)CC1	ZINC000875134387	FD	On-Demand	Anodyne	SIRT3	40	33
O=C(NCC[C@H]1CCSC1)C(=O)NC1CCN(c2nccs2)CC1	ZINC000875134387	FD	On-Demand	Anodyne	SIRT2	45	33
O=C(NCC[C@H]1CCSC1)C(=O)NC1CCN(c2nccs2)CC1	ZINC000875134387	FD	On-Demand	Anodyne	SIRT1	41	33
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N[C@H](C1CCC1)[C@@H]1CCCO1	ZINC000875134388	GD	On-Demand	Anodyne	NOS2	55	34
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(O)c1	ZINC000875134389	DD	On-Demand	Anodyne	SLC6A4	34	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(O)c1	ZINC000875134389	DD	On-Demand	Anodyne	SLC6A3	60	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(O)c1	ZINC000875134389	DD	On-Demand	Anodyne	Q8WSF8_APLCA	17	40
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N[C@H](C1CCC1)[C@H]1CCCO1	ZINC000875134390	GD	On-Demand	Anodyne	NOS2	55	34
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(O)c1	ZINC000875134391	DD	On-Demand	Anodyne	SLC6A4	34	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(O)c1	ZINC000875134391	DD	On-Demand	Anodyne	SLC6A3	60	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(O)c1	ZINC000875134391	DD	On-Demand	Anodyne	Q8WSF8_APLCA	17	40
CC[C@@H](NC(=O)NCc1cccc(O)c1)[C@H](O)c1ccccc1	ZINC000875134435	DF	On-Demand	Anodyne	ANPEP	17	44
CC[C@@H](NC(=O)NCc1cccc(O)c1)[C@H](O)c1ccccc1	ZINC000875134435	DF	On-Demand	Anodyne	PDS	55	38
CC[C@@H](NC(=O)NCc1cccc(O)c1)[C@@H](O)c1ccccc1	ZINC000875134438	DF	On-Demand	Anodyne	ANPEP	17	44
CC[C@@H](NC(=O)NCc1cccc(O)c1)[C@@H](O)c1ccccc1	ZINC000875134438	DF	On-Demand	Anodyne	PDS	55	38
O=C(CCNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)NC1CCCCC1	ZINC000875134446	GG	On-Demand	Anodyne	EPHX2	16	46
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875134463	GD	On-Demand	Anodyne	NOS2	53	35
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875134464	GD	On-Demand	Anodyne	NOS2	53	35
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875134465	GD	On-Demand	Anodyne	NOS2	53	35
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875134466	GD	On-Demand	Anodyne	NOS2	53	35
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)NC[C@@H]1CCN1C1CCCCC1	ZINC000875134472	GE	On-Demand	Anodyne	NOS2	92	41
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)NC[C@H]1CCN1C1CCCCC1	ZINC000875134473	GE	On-Demand	Anodyne	NOS2	92	41
CN1CCC[C@H](NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C1	ZINC000875134485	EE	On-Demand	Mild	CCR3	52	41
CN1CCC[C@H](NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C1	ZINC000875134485	EE	On-Demand	Mild	ITK	19	47
CN1CCC[C@H](NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C1	ZINC000875134485	EE	On-Demand	Mild	PANC	53	37
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875134497	FD	On-Demand	Anodyne	NOS2	92	35
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875134499	FD	On-Demand	Anodyne	NOS2	92	35
C[C@H](NC(=O)C(=O)NCCCc1cccc(C(F)(F)F)c1)c1ccnn1C	ZINC000875134500	GE	On-Demand	Anodyne	PDS	36	42
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875134501	FD	On-Demand	Anodyne	NOS2	92	35
COCC1CC(NC(=O)N[C@@H](C)c2ccc(NC(=O)c3ccc(F)cc3)cc2)C1	ZINC000875134502	GH	On-Demand	Anodyne	F7	23	41
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875134503	FD	On-Demand	Anodyne	NOS2	92	35
COCC1CC(NC(=O)N[C@H](C)c2ccc(NC(=O)c3ccc(F)cc3)cc2)C1	ZINC000875134504	GH	On-Demand	Anodyne	F7	23	41
O=C(NCc1cccc(O)c1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875134548	FG	On-Demand	Anodyne	OPRM1	31	42
O=C(NCc1cccc(O)c1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875134548	FG	On-Demand	Anodyne	OPRK1	29	40
COCCN(CC1CCN(C)CC1)C(=O)NCCOc1ccccc1C	ZINC000875134549	FE	On-Demand	Anodyne	ACKR3	62	32
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(OC)c([N+](=O)[O-])c1	ZINC000875134559	GE	On-Demand	Bother	ACKR3	44	31
COC(=O)N(C)NC(=O)NCc1cccc(O)c1	ZINC000875134567	CC	On-Demand	Reactive	ROCK2	27	41
COC(=O)N(C)NC(=O)NCc1cccc(O)c1	ZINC000875134567	CC	On-Demand	Reactive	HSD17B2	34	44
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1cc(C)no1)CC2	ZINC000875134571	FD	On-Demand	Anodyne	SLC18A2	45	33
O=C(CCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)NC1CCCCC1	ZINC000875134572	FF	On-Demand	Anodyne	EPHX2	16	45
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1cc(C)no1)CC2	ZINC000875134573	FD	On-Demand	Anodyne	SLC18A2	45	33
O=C(CCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)NC1CCCCC1	ZINC000875134575	FF	On-Demand	Anodyne	EPHX2	16	45
O=C(CCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)NC1CCCCC1	ZINC000875134577	FF	On-Demand	Anodyne	EPHX2	16	45
O=C(CCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)NC1CCCCC1	ZINC000875134579	FF	On-Demand	Anodyne	EPHX2	16	45
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(-n3ccnc3)cc2)C1	ZINC000875134585	FD	On-Demand	Anodyne	NOS2	97	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(-n3ccnc3)cc2)C1	ZINC000875134586	FD	On-Demand	Anodyne	NOS2	97	40
C[C@@H](Cc1ccsc1)NC(=O)NC1(CNC(=O)OC(C)(C)C)CCOCC1	ZINC000875134587	GG	On-Demand	Anodyne	PAPA1_CARPA	26	46
COCCN(CC1CCN(C)CC1)C(=O)NCCNC(=O)c1ccccc1F	ZINC000875134635	GD	On-Demand	Anodyne	ACKR3	62	33
CCC[C@@H](CNC(=O)C(=O)NCc1ccc(-n2ccnc2)cc1)OCC	ZINC000875134643	FD	On-Demand	Anodyne	CYP2C19	15	40
CCC[C@H](CNC(=O)C(=O)NCc1ccc(-n2ccnc2)cc1)OCC	ZINC000875134644	FD	On-Demand	Anodyne	CYP2C19	15	40
O=C(NCC[C@H]1CCSC1)C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000875134650	FD	On-Demand	Anodyne	NOS2	60	35
O=C(NCC[C@@H]1CCSC1)C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000875134651	FD	On-Demand	Anodyne	NOS2	60	35
C#CC[C@@H](COC)NC(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000875134659	DD	On-Demand	Mild	PAPA1_CARPA	46	34
C#CC[C@H](COC)NC(=O)N[C@H](Cc1ccccc1)CN(C)C	ZINC000875134660	DD	On-Demand	Mild	PAPA1_CARPA	46	34
C#CC[C@@H](COC)NC(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000875134661	DD	On-Demand	Mild	PAPA1_CARPA	46	34
C#CC[C@H](COC)NC(=O)N[C@@H](Cc1ccccc1)CN(C)C	ZINC000875134662	DD	On-Demand	Mild	PAPA1_CARPA	46	34
C#CC[C@@H](COC)NC(=O)C(=O)NCCCc1cccc(C(F)(F)F)c1	ZINC000875134666	FD	On-Demand	Mild	PDS	42	44
C#CC[C@H](COC)NC(=O)C(=O)NCCCc1cccc(C(F)(F)F)c1	ZINC000875134667	FD	On-Demand	Mild	PDS	42	44
CONC(=O)C1CCN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)CC1	ZINC000875134674	FD	On-Demand	Anodyne	AMY2	45	30
CONC(=O)C1CCN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)CC1	ZINC000875134674	FD	On-Demand	Anodyne	CAPNS1	47	33
CONC(=O)C1CCN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)CC1	ZINC000875134674	FD	On-Demand	Anodyne	F11	44	38
CONC(=O)C1CCN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)CC1	ZINC000875134674	FD	On-Demand	Anodyne	CAPN1	44	46
CONC(=O)C1CCN(C(=O)N[C@@H](Cc2ccccc2)CN(C)C)CC1	ZINC000875134674	FD	On-Demand	Anodyne	Q6PRC7_IXORI	42	33
CONC(=O)C1CCN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)CC1	ZINC000875134675	FD	On-Demand	Anodyne	AMY2	45	30
CONC(=O)C1CCN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)CC1	ZINC000875134675	FD	On-Demand	Anodyne	CAPNS1	47	33
CONC(=O)C1CCN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)CC1	ZINC000875134675	FD	On-Demand	Anodyne	F11	44	38
CONC(=O)C1CCN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)CC1	ZINC000875134675	FD	On-Demand	Anodyne	CAPN1	44	46
CONC(=O)C1CCN(C(=O)N[C@H](Cc2ccccc2)CN(C)C)CC1	ZINC000875134675	FD	On-Demand	Anodyne	Q6PRC7_IXORI	42	33
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(O)c1	ZINC000875134678	CD	On-Demand	Anodyne	ANPEP	23	46
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(O)c1	ZINC000875134678	CD	On-Demand	Anodyne	CAPN2	42	34
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(O)c1	ZINC000875134678	CD	On-Demand	Anodyne	PDS	54	35
O=C(NCc1cccc(O)c1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875134698	EE	On-Demand	Anodyne	SIGMAR1	23	41
O=C(NCc1cccc(O)c1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875134698	EE	On-Demand	Anodyne	FAAH	21	43
COC(=O)N(C)NC(=O)N[C@H](C)COc1cccc(F)c1	ZINC000875134705	CD	On-Demand	Reactive	PDS	57	42
COC(=O)N(C)NC(=O)N[C@@H](C)COc1cccc(F)c1	ZINC000875134706	CD	On-Demand	Reactive	PDS	57	42
CN1CCC[C@H](NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000875134718	ED	On-Demand	Anodyne	PTGER4	19	41
CN1CCC[C@H](NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000875134718	ED	On-Demand	Anodyne	EPHX2	23	45
CN1CCC[C@H](NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000875134720	ED	On-Demand	Anodyne	PTGER4	19	41
CN1CCC[C@H](NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000875134720	ED	On-Demand	Anodyne	EPHX2	23	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)COc1cccc(F)c1	ZINC000875134767	FE	On-Demand	Anodyne	SLC6A4	21	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)COc1cccc(F)c1	ZINC000875134767	FE	On-Demand	Anodyne	SLC6A3	44	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)COc1cccc(F)c1	ZINC000875134768	FE	On-Demand	Anodyne	SLC6A4	21	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)COc1cccc(F)c1	ZINC000875134768	FE	On-Demand	Anodyne	SLC6A3	44	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)COc1cccc(F)c1	ZINC000875134769	FE	On-Demand	Anodyne	SLC6A4	21	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)COc1cccc(F)c1	ZINC000875134769	FE	On-Demand	Anodyne	SLC6A3	44	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)COc1cccc(F)c1	ZINC000875134770	FE	On-Demand	Anodyne	SLC6A4	21	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)COc1cccc(F)c1	ZINC000875134770	FE	On-Demand	Anodyne	SLC6A3	44	45
CC[C@@H]1COCCN1CCNC(=O)NCc1ccccc1OCCOC	ZINC000875134772	FD	On-Demand	Anodyne	HCN1	51	32
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N[C@H]1CCCn2nccc21	ZINC000875134777	FD	On-Demand	Anodyne	NOS2	93	37
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N[C@@H]1CCCn2nccc21	ZINC000875134778	FD	On-Demand	Anodyne	NOS2	93	37
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)NC[C@@H]1CCCN1CC(F)F	ZINC000875134782	GD	On-Demand	Anodyne	NOS2	91	39
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)NC[C@H]1CCCN1CC(F)F	ZINC000875134783	GD	On-Demand	Anodyne	NOS2	91	39
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N1C[C@@H]2CCC[C@]2(CO)C1	ZINC000875134812	FD	On-Demand	Anodyne	NOS2	99	38
C[C@@H](Cc1ccsc1)NC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875134856	EG	On-Demand	Anodyne	SLC12A5	15	40
C[C@@H](Cc1ccsc1)NC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875134857	EG	On-Demand	Anodyne	SLC12A5	15	40
COc1ccc(N2CCN(C(=O)C(=O)NCc3cc(C)no3)CC2)c(OC)c1	ZINC000875134861	GC	On-Demand	Clean	DRD2	28	41
COc1ccc(N2CCN(C(=O)C(=O)NCc3cc(C)no3)CC2)c(OC)c1	ZINC000875134861	GC	On-Demand	Clean	DRD4	43	33
COc1ccc(N2CCN(C(=O)C(=O)NCc3cc(C)no3)CC2)c(OC)c1	ZINC000875134861	GC	On-Demand	Clean	DRD3	49	41
O=C(NCC[C@H]1CC=CCC1)C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000875134886	FE	On-Demand	Anodyne	NOS2	48	34
O=C(NCC[C@@H]1CC=CCC1)C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000875134887	FE	On-Demand	Anodyne	NOS2	48	34
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)NCC1CC=CC1	ZINC000875134913	DD	On-Demand	Anodyne	NOS2	90	37
O=C1CCN(C(=O)C(=O)NCc2ccc(-n3ccnc3)cc2)CCCCCCN1	ZINC000875134914	GD	On-Demand	Anodyne	NOS2	76	35
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N1CCCC2(CC1)CC2	ZINC000875134921	FE	On-Demand	Anodyne	NOS2	89	35
CN1CCC[C@H](NC(=O)NC2CC(Nc3ccccc3)C2)C1	ZINC000875134938	DE	On-Demand	Anodyne	EPHX2	31	45
CN1CCC[C@H](NC(=O)NC2CC(Nc3ccccc3)C2)C1	ZINC000875134938	DE	On-Demand	Anodyne	BIRC2	40	37
CN1CCC[C@H](NC(=O)N[C@@](C)(CO)Cc2ccc(Cl)cc2)C1	ZINC000875134960	EE	On-Demand	Anodyne	SLC6A5	22	41
CN1CCC[C@H](NC(=O)N[C@@](C)(CO)Cc2ccc(Cl)cc2)C1	ZINC000875134960	EE	On-Demand	Anodyne	BIRC2	26	44
CN1CCC[C@H](NC(=O)N[C@](C)(CO)Cc2ccc(Cl)cc2)C1	ZINC000875134962	EE	On-Demand	Anodyne	SLC6A5	22	41
CN1CCC[C@H](NC(=O)N[C@](C)(CO)Cc2ccc(Cl)cc2)C1	ZINC000875134962	EE	On-Demand	Anodyne	BIRC2	26	44
CCCCCCCNC(=O)C(=O)NCCC1CCN(C)CC1	ZINC000875134978	DD	On-Demand	Mild	ASAH1	81	38
CCCCCCCNC(=O)C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000875134979	EF	On-Demand	Mild	TBXAS1	20	49
CCCCCCCNC(=O)C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000875134979	EF	On-Demand	Mild	NOS2	61	34
CCCCCCCNC(=O)C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000875134979	EF	On-Demand	Mild	CYP2C19	17	48
CCCCCCCNC(=O)C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000875134979	EF	On-Demand	Mild	ASAH1	85	37
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875134986	GE	On-Demand	Anodyne	NOS2	84	38
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875134987	GE	On-Demand	Anodyne	NOS2	84	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1ccsc1	ZINC000875134990	DE	On-Demand	Anodyne	SLC6A4	21	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1ccsc1	ZINC000875134990	DE	On-Demand	Anodyne	SLC6A3	45	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1ccsc1	ZINC000875134991	DE	On-Demand	Anodyne	SLC6A4	21	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1ccsc1	ZINC000875134991	DE	On-Demand	Anodyne	SLC6A3	45	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1ccsc1	ZINC000875134992	DE	On-Demand	Anodyne	SLC6A4	21	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1ccsc1	ZINC000875134992	DE	On-Demand	Anodyne	SLC6A3	45	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1ccsc1	ZINC000875134993	DE	On-Demand	Anodyne	SLC6A4	21	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1ccsc1	ZINC000875134993	DE	On-Demand	Anodyne	SLC6A3	45	41
CN1CCC[C@H](NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)C1	ZINC000875134994	DD	On-Demand	Anodyne	BIRC2	40	40
CN1CCC[C@H](NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)C1	ZINC000875134995	DD	On-Demand	Anodyne	BIRC2	40	40
CN1CCC[C@H](NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)C1	ZINC000875134996	DD	On-Demand	Anodyne	BIRC2	40	40
CN1CCC[C@H](NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)C1	ZINC000875134997	DD	On-Demand	Anodyne	BIRC2	40	40
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875135003	FC	On-Demand	Anodyne	NOS2	68	33
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875135004	FC	On-Demand	Anodyne	NOS2	68	33
COC(=O)[C@@]1(C)CN(C(=O)C(=O)NCc2ccc(-n3ccnc3)cc2)C[C@@H]1C	ZINC000875135006	GD	On-Demand	Anodyne	NOS2	60	35
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)NCC1([C@@H]2CCCCO2)CCC1	ZINC000875135008	GE	On-Demand	Anodyne	NOS2	84	37
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)NCC1([C@H]2CCCCO2)CCC1	ZINC000875135009	GE	On-Demand	Anodyne	NOS2	84	37
C[C@H]1C[C@H](CO)CCN1C(=O)C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000875135021	FD	On-Demand	Anodyne	NOS2	70	36
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N[C@H](c1ccccn1)C1CCC1	ZINC000875135028	GF	On-Demand	Anodyne	NOS2	66	35
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N[C@@H](c1ccccn1)C1CCC1	ZINC000875135029	GF	On-Demand	Anodyne	NOS2	66	35
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(-n4ccnc4)cc3)CC[C@H]21	ZINC000875135044	FD	On-Demand	Anodyne	NOS2	90	36
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(-n4ccnc4)cc3)CC[C@@H]21	ZINC000875135046	FD	On-Demand	Anodyne	NOS2	90	36
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)NC[C@@H]1CC[C@@H]2C[C@H]2C1	ZINC000875135047	FE	On-Demand	Anodyne	NOS2	97	35
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)NC[C@@H]1CC[C@H]2C[C@@H]2C1	ZINC000875135048	FE	On-Demand	Anodyne	NOS2	97	35
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)NC[C@@H]1CC[C@H]2C[C@H]2C1	ZINC000875135049	FE	On-Demand	Anodyne	NOS2	97	35
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)NC[C@@H]1CC[C@@H]2C[C@@H]2C1	ZINC000875135050	FE	On-Demand	Anodyne	NOS2	97	35
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N[C@@H]1CO[C@@H](C2CC2)C1	ZINC000875135060	FD	On-Demand	Anodyne	NOS2	81	33
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N[C@H]1CO[C@@H](C2CC2)C1	ZINC000875135061	FD	On-Demand	Anodyne	NOS2	81	33
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N[C@@H]1CO[C@H](C2CC2)C1	ZINC000875135062	FD	On-Demand	Anodyne	NOS2	81	33
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N[C@H]1CO[C@H](C2CC2)C1	ZINC000875135063	FD	On-Demand	Anodyne	NOS2	81	33
CN1CCC(CCNC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875135072	FD	On-Demand	Anodyne	FKBP1A	19	43
CN1CCC(CCNC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875135073	FD	On-Demand	Anodyne	FKBP1A	19	43
CN1CCC(CCNC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875135074	FD	On-Demand	Anodyne	FKBP1A	19	43
CN1CCC(CCNC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875135075	FD	On-Demand	Anodyne	FKBP1A	19	43
O=C(NCCNC(=O)N1CCC[C@@](O)(c2ccccc2)C1)c1ccccc1F	ZINC000875135083	GE	On-Demand	Anodyne	EPHX2	20	48
O=C(NCCNC(=O)N1CCC[C@@](O)(c2ccccc2)C1)c1ccccc1F	ZINC000875135083	GE	On-Demand	Anodyne	HCN1	42	32
O=C(NCCNC(=O)N1CCC[C@](O)(c2ccccc2)C1)c1ccccc1F	ZINC000875135084	GE	On-Demand	Anodyne	EPHX2	20	48
O=C(NCCNC(=O)N1CCC[C@](O)(c2ccccc2)C1)c1ccccc1F	ZINC000875135084	GE	On-Demand	Anodyne	HCN1	42	32
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N1CCC(CCF)CC1	ZINC000875135085	FE	On-Demand	Anodyne	NOS2	90	36
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000875135096	FD	On-Demand	Mild	NOS2	55	37
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000875135097	FD	On-Demand	Mild	NOS2	55	37
COC[C@]1(C)CN(C(=O)C(=O)NCc2ccc(-n3ccnc3)cc2)CCO1	ZINC000875135132	FC	On-Demand	Anodyne	NOS2	98	38
COC[C@@]1(C)CN(C(=O)C(=O)NCc2ccc(-n3ccnc3)cc2)CCO1	ZINC000875135133	FC	On-Demand	Anodyne	NOS2	98	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)COc2cccc(F)c2)C1	ZINC000875135145	FE	On-Demand	Anodyne	PDS	51	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)COc2cccc(F)c2)C1	ZINC000875135147	FE	On-Demand	Anodyne	PDS	51	42
O=C(NCCCCC1CC1)C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000875135150	EE	On-Demand	Anodyne	NOS2	76	36
C[C@@H](Cc1ccsc1)NC(=O)N(C)C[C@@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000875135153	GF	On-Demand	Anodyne	PAPA1_CARPA	22	46
C[C@@H](Cc1ccsc1)NC(=O)N(C)C[C@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000875135156	GF	On-Demand	Anodyne	PAPA1_CARPA	22	46
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)COc1cccc(F)c1	ZINC000875135191	DE	On-Demand	Anodyne	PDS	76	47
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)COc1cccc(F)c1	ZINC000875135193	DE	On-Demand	Anodyne	PDS	76	47
O=C(N[C@@H]1CCN(CC(F)(F)F)C1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875135195	GD	On-Demand	Anodyne	SFRP1	46	32
O=C(N[C@@H]1CCN(CC(F)(F)F)C1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875135195	GD	On-Demand	Anodyne	WNT3	48	31
O=C(N[C@@H]1CCN(CC(F)(F)F)C1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875135195	GD	On-Demand	Anodyne	HPGDS	35	41
O=C(N[C@@H]1CCN(CC(F)(F)F)C1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875135196	GD	On-Demand	Anodyne	SFRP1	46	32
O=C(N[C@@H]1CCN(CC(F)(F)F)C1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875135196	GD	On-Demand	Anodyne	WNT3	48	31
O=C(N[C@@H]1CCN(CC(F)(F)F)C1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875135196	GD	On-Demand	Anodyne	HPGDS	35	41
O=C(N[C@@H]1CCN(CC(F)(F)F)C1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875135197	GD	On-Demand	Anodyne	SFRP1	46	32
O=C(N[C@@H]1CCN(CC(F)(F)F)C1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875135197	GD	On-Demand	Anodyne	WNT3	48	31
O=C(N[C@@H]1CCN(CC(F)(F)F)C1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875135197	GD	On-Demand	Anodyne	HPGDS	35	41
O=C(N[C@@H]1CCN(CC(F)(F)F)C1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875135198	GD	On-Demand	Anodyne	SFRP1	46	32
O=C(N[C@@H]1CCN(CC(F)(F)F)C1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875135198	GD	On-Demand	Anodyne	WNT3	48	31
O=C(N[C@@H]1CCN(CC(F)(F)F)C1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875135198	GD	On-Demand	Anodyne	HPGDS	35	41
C[C@@H](Cc1ccsc1)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875135201	DD	On-Demand	Anodyne	GHRHR	40	38
C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000875135222	FD	On-Demand	Anodyne	NOS2	60	35
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000875135223	FD	On-Demand	Anodyne	NOS2	60	35
C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000875135225	FD	On-Demand	Anodyne	NOS2	60	35
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1OCCOC	ZINC000875135236	DE	On-Demand	Anodyne	ANPEP	19	50
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875135240	FD	On-Demand	Anodyne	NOS2	93	34
CCCCCCCNC(=O)C(=O)NCc1cc(C)no1	ZINC000875135241	CD	On-Demand	Mild	ASAH1	86	35
O=C(NCCC[C@H]1C=CCC1)C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000875135242	FE	On-Demand	Anodyne	NOS2	48	34
O=C(NCCC[C@@H]1C=CCC1)C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000875135243	FE	On-Demand	Anodyne	NOS2	48	34
CCOC[C@H]1CN(C(=O)C(=O)NCc2ccc(-n3ccnc3)cc2)CCO1	ZINC000875135253	FC	On-Demand	Anodyne	NOS2	99	36
CN(C[C@@H]1C[C@H](O)C1)C(=O)C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000875135260	EC	On-Demand	Anodyne	NOS2	89	35
CN1CCC[C@H](NC(=O)N2CCC[C@](O)(c3ccccc3)C2)C1	ZINC000875135272	DD	On-Demand	Anodyne	EPHX2	21	46
CN1CCC[C@H](NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)C1	ZINC000875135274	DD	On-Demand	Anodyne	EPHX2	21	46
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N[C@H]1CC12CCC2	ZINC000875135288	DD	On-Demand	Anodyne	NOS2	90	37
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875135289	DD	On-Demand	Anodyne	NOS2	90	37
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H](C)COc1cccc(F)c1	ZINC000875135293	GF	On-Demand	Anodyne	CHRNA10	56	44
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H](C)COc1cccc(F)c1	ZINC000875135293	GF	On-Demand	Anodyne	ACKR3	64	35
COCCN(CC1CCN(C)CC1)C(=O)N[C@H](C)COc1cccc(F)c1	ZINC000875135294	GF	On-Demand	Anodyne	CHRNA10	56	44
COCCN(CC1CCN(C)CC1)C(=O)N[C@H](C)COc1cccc(F)c1	ZINC000875135294	GF	On-Demand	Anodyne	ACKR3	64	35
COCC(C)(C)CCNC(=O)C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000875135301	FD	On-Demand	Anodyne	NOS2	56	37
N#CCCN1CCN(C(=O)C(=O)NCc2ccc(-n3ccnc3)cc2)CC1	ZINC000875135306	FC	On-Demand	Mild	NOS2	72	33
N#CCCN1CCN(C(=O)C(=O)NCc2ccc(-n3ccnc3)cc2)CC1	ZINC000875135306	FC	On-Demand	Mild	KCNJ1	45	39
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N1CCO[C@@H](CCF)C1	ZINC000875135310	FD	On-Demand	Anodyne	NOS2	100	36
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N1CCO[C@H](CCF)C1	ZINC000875135311	FD	On-Demand	Anodyne	NOS2	100	36
COc1ccccc1[C@H]1CCCN(C(=O)N[C@@H]2CCCN(C)C2)CC1	ZINC000875135317	EG	On-Demand	Anodyne	EPHX2	21	41
COc1ccccc1[C@H]1CCCN(C(=O)N[C@@H]2CCCN(C)C2)CC1	ZINC000875135317	EG	On-Demand	Anodyne	RBP4	40	41
COc1ccccc1[C@H]1CCCN(C(=O)N[C@@H]2CCCN(C)C2)CC1	ZINC000875135317	EG	On-Demand	Anodyne	BIRC2	24	40
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(C)C2)CC1	ZINC000875135318	EG	On-Demand	Anodyne	EPHX2	21	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(C)C2)CC1	ZINC000875135318	EG	On-Demand	Anodyne	RBP4	40	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(C)C2)CC1	ZINC000875135318	EG	On-Demand	Anodyne	BIRC2	24	40
COc1ccccc1[C@H]1CCCN(C(=O)N[C@H]2CCCN(C)C2)CC1	ZINC000875135319	EG	On-Demand	Anodyne	EPHX2	21	41
COc1ccccc1[C@H]1CCCN(C(=O)N[C@H]2CCCN(C)C2)CC1	ZINC000875135319	EG	On-Demand	Anodyne	RBP4	40	41
COc1ccccc1[C@H]1CCCN(C(=O)N[C@H]2CCCN(C)C2)CC1	ZINC000875135319	EG	On-Demand	Anodyne	BIRC2	24	40
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2CCCN(C)C2)CC1	ZINC000875135320	EG	On-Demand	Anodyne	EPHX2	21	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2CCCN(C)C2)CC1	ZINC000875135320	EG	On-Demand	Anodyne	RBP4	40	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2CCCN(C)C2)CC1	ZINC000875135320	EG	On-Demand	Anodyne	BIRC2	24	40
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N1C[C@@H](CO)[C@H](C(F)(F)F)C1	ZINC000875135326	GD	On-Demand	Anodyne	NOS2	74	33
O=C(NCC[C@@H]1CCCOC1)C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000875135339	FD	On-Demand	Anodyne	NOS2	72	36
O=C(NCC[C@H]1CCCOC1)C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000875135340	FD	On-Demand	Anodyne	NOS2	72	36
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)NC[C@@H]1CCN1C1CCCC1	ZINC000875135341	GD	On-Demand	Anodyne	NOS2	96	41
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)NC[C@H]1CCN1C1CCCC1	ZINC000875135342	GD	On-Demand	Anodyne	NOS2	96	41
CCCCCCCNC(=O)C(=O)N[C@@H]1CCN(CC(F)(F)F)C1	ZINC000875135355	ED	On-Demand	Mild	ASAH1	83	35
CCCCCCCNC(=O)C(=O)N[C@H]1CCN(CC(F)(F)F)C1	ZINC000875135356	ED	On-Demand	Mild	ASAH1	83	35
O=C(NCc1ccc(-n2ccnc2)cc1)C(=O)N1CCC[C@@H]1Cn1ccnc1	ZINC000875135364	GD	On-Demand	Anodyne	NOS2	93	40
CN1CCC[C@H](NC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875135400	EF	On-Demand	Mild	LGMN	47	33
CN1CCC[C@H](NC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875135400	EF	On-Demand	Mild	CHRNA10	18	40
CN1CCC[C@H](NC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875135402	EF	On-Demand	Mild	LGMN	47	33
CN1CCC[C@H](NC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875135402	EF	On-Demand	Mild	CHRNA10	18	40
C[C@@H](Cc1ccsc1)NC(=O)NCC1(NC(=O)OC(C)(C)C)CCOCC1	ZINC000875135452	GG	On-Demand	Anodyne	PAPA1_CARPA	27	46
CN1CCC[C@H](NC(=O)N2CCC(c3nccc(-c4cccnc4)n3)CC2)C1	ZINC000875135473	GF	On-Demand	Anodyne	PIM1	16	40
CN1CCC[C@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875135477	ED	On-Demand	Anodyne	DRD2	19	45
CN1CCC[C@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875135477	ED	On-Demand	Anodyne	DRD4	39	47
CN1CCC[C@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875135477	ED	On-Demand	Anodyne	SLC6A1	41	31
CN1CCC[C@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875135477	ED	On-Demand	Anodyne	LTA4H	18	41
CN1CCC[C@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875135477	ED	On-Demand	Anodyne	SIGMAR1	49	45
CN1CCC[C@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875135477	ED	On-Demand	Anodyne	CCR3	39	42
CN1CCC[C@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875135477	ED	On-Demand	Anodyne	EPHX2	16	41
CN1CCC[C@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875135477	ED	On-Demand	Anodyne	MCHR1	15	43
CN1CCC[C@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875135477	ED	On-Demand	Anodyne	BIRC2	42	44
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(-n3ccnc3)cc2)CC1	ZINC000875135481	FD	On-Demand	Anodyne	NOS2	96	40
COc1ccccc1N1CCC(NC(=O)C(=O)NCCC[C@H]2C=CCC2)CC1	ZINC000875135527	GF	On-Demand	Anodyne	HTR1A	95	49
COc1ccccc1N1CCC(NC(=O)C(=O)NCCC[C@H]2C=CCC2)CC1	ZINC000875135527	GF	On-Demand	Anodyne	DRD2	81	48
COc1ccccc1N1CCC(NC(=O)C(=O)NCCC[C@H]2C=CCC2)CC1	ZINC000875135527	GF	On-Demand	Anodyne	DRD1	17	44
COc1ccccc1N1CCC(NC(=O)C(=O)NCCC[C@H]2C=CCC2)CC1	ZINC000875135527	GF	On-Demand	Anodyne	DRD4	47	47
COc1ccccc1N1CCC(NC(=O)C(=O)NCCC[C@H]2C=CCC2)CC1	ZINC000875135527	GF	On-Demand	Anodyne	ADRA1D	85	43
COc1ccccc1N1CCC(NC(=O)C(=O)NCCC[C@H]2C=CCC2)CC1	ZINC000875135527	GF	On-Demand	Anodyne	HTR2A	26	43
COc1ccccc1N1CCC(NC(=O)C(=O)NCCC[C@H]2C=CCC2)CC1	ZINC000875135527	GF	On-Demand	Anodyne	ADRA1A	76	44
COc1ccccc1N1CCC(NC(=O)C(=O)NCCC[C@H]2C=CCC2)CC1	ZINC000875135527	GF	On-Demand	Anodyne	ADRA1B	64	43
COc1ccccc1N1CCC(NC(=O)C(=O)NCCC[C@H]2C=CCC2)CC1	ZINC000875135527	GF	On-Demand	Anodyne	DRD3	94	48
COc1ccccc1N1CCC(NC(=O)C(=O)NCCC[C@H]2C=CCC2)CC1	ZINC000875135527	GF	On-Demand	Anodyne	HTR7	57	42
COc1ccccc1N1CCC(NC(=O)C(=O)NCCC[C@H]2C=CCC2)CC1	ZINC000875135527	GF	On-Demand	Anodyne	NPY1R	19	40
COc1ccccc1N1CCC(NC(=O)C(=O)NCCC[C@@H]2C=CCC2)CC1	ZINC000875135528	GF	On-Demand	Anodyne	HTR1A	95	49
COc1ccccc1N1CCC(NC(=O)C(=O)NCCC[C@@H]2C=CCC2)CC1	ZINC000875135528	GF	On-Demand	Anodyne	DRD2	81	48
COc1ccccc1N1CCC(NC(=O)C(=O)NCCC[C@@H]2C=CCC2)CC1	ZINC000875135528	GF	On-Demand	Anodyne	DRD1	17	44
COc1ccccc1N1CCC(NC(=O)C(=O)NCCC[C@@H]2C=CCC2)CC1	ZINC000875135528	GF	On-Demand	Anodyne	DRD4	47	47
COc1ccccc1N1CCC(NC(=O)C(=O)NCCC[C@@H]2C=CCC2)CC1	ZINC000875135528	GF	On-Demand	Anodyne	ADRA1D	85	43
COc1ccccc1N1CCC(NC(=O)C(=O)NCCC[C@@H]2C=CCC2)CC1	ZINC000875135528	GF	On-Demand	Anodyne	HTR2A	26	43
COc1ccccc1N1CCC(NC(=O)C(=O)NCCC[C@@H]2C=CCC2)CC1	ZINC000875135528	GF	On-Demand	Anodyne	ADRA1A	76	44
COc1ccccc1N1CCC(NC(=O)C(=O)NCCC[C@@H]2C=CCC2)CC1	ZINC000875135528	GF	On-Demand	Anodyne	ADRA1B	64	43
COc1ccccc1N1CCC(NC(=O)C(=O)NCCC[C@@H]2C=CCC2)CC1	ZINC000875135528	GF	On-Demand	Anodyne	DRD3	94	48
COc1ccccc1N1CCC(NC(=O)C(=O)NCCC[C@@H]2C=CCC2)CC1	ZINC000875135528	GF	On-Demand	Anodyne	HTR7	57	42
COc1ccccc1N1CCC(NC(=O)C(=O)NCCC[C@@H]2C=CCC2)CC1	ZINC000875135528	GF	On-Demand	Anodyne	NPY1R	19	40
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135562	FC	On-Demand	Mild	HTR1A	92	45
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135562	FC	On-Demand	Mild	DRD2	81	45
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135562	FC	On-Demand	Mild	DRD4	44	45
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135562	FC	On-Demand	Mild	ADRA1D	85	42
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135562	FC	On-Demand	Mild	HTR2A	21	40
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135562	FC	On-Demand	Mild	ADRA1A	76	42
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135562	FC	On-Demand	Mild	ADRA1B	65	42
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135562	FC	On-Demand	Mild	DRD3	77	43
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135562	FC	On-Demand	Mild	HTR7	55	39
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135563	FC	On-Demand	Mild	HTR1A	92	45
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135563	FC	On-Demand	Mild	DRD2	81	45
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135563	FC	On-Demand	Mild	DRD4	44	45
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135563	FC	On-Demand	Mild	ADRA1D	85	42
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135563	FC	On-Demand	Mild	HTR2A	21	40
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135563	FC	On-Demand	Mild	ADRA1A	76	42
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135563	FC	On-Demand	Mild	ADRA1B	65	42
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135563	FC	On-Demand	Mild	DRD3	77	43
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135563	FC	On-Demand	Mild	HTR7	55	39
CCN1CCC[C@H](NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C1	ZINC000875135585	FE	On-Demand	Mild	CCR3	53	41
CCN1CCC[C@H](NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C1	ZINC000875135585	FE	On-Demand	Mild	ITK	18	49
CCN1CCC[C@H](NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C1	ZINC000875135585	FE	On-Demand	Mild	PANC	53	37
CCN1CCC[C@@H](NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C1	ZINC000875135586	FE	On-Demand	Mild	CCR3	53	41
CCN1CCC[C@@H](NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C1	ZINC000875135586	FE	On-Demand	Mild	ITK	18	49
CCN1CCC[C@@H](NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C1	ZINC000875135586	FE	On-Demand	Mild	PANC	53	37
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccccc1OCc1ccccc1	ZINC000875135601	GG	On-Demand	Anodyne	GHRHR	49	34
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccccc1OCc1ccccc1	ZINC000875135601	GG	On-Demand	Anodyne	PTGER1	40	37
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccccc1OCc1ccccc1	ZINC000875135601	GG	On-Demand	Anodyne	CAPN2	56	33
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccccc1OCc1ccccc1	ZINC000875135601	GG	On-Demand	Anodyne	ACE2	15	40
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccccc1OCc1ccccc1	ZINC000875135601	GG	On-Demand	Anodyne	SLC12A5	42	34
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccccc1OCc1ccccc1	ZINC000875135601	GG	On-Demand	Anodyne	HCN1	49	38
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)CC1	ZINC000875135611	GE	On-Demand	Anodyne	HTR1A	76	42
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)CC1	ZINC000875135611	GE	On-Demand	Anodyne	DRD2	64	44
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)CC1	ZINC000875135611	GE	On-Demand	Anodyne	DRD4	35	44
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)CC1	ZINC000875135611	GE	On-Demand	Anodyne	ADRA1D	72	43
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)CC1	ZINC000875135611	GE	On-Demand	Anodyne	ADRA1A	62	43
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)CC1	ZINC000875135611	GE	On-Demand	Anodyne	ADRA1B	57	43
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)CC1	ZINC000875135611	GE	On-Demand	Anodyne	DRD3	66	44
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)CC1	ZINC000875135611	GE	On-Demand	Anodyne	HTR7	49	40
COc1ccccc1N1CCC(NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)CC1	ZINC000875135617	GD	On-Demand	Anodyne	HTR1A	72	48
COc1ccccc1N1CCC(NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)CC1	ZINC000875135617	GD	On-Demand	Anodyne	DRD2	60	48
COc1ccccc1N1CCC(NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)CC1	ZINC000875135617	GD	On-Demand	Anodyne	DRD4	29	42
COc1ccccc1N1CCC(NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)CC1	ZINC000875135617	GD	On-Demand	Anodyne	ADRA1D	66	44
COc1ccccc1N1CCC(NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)CC1	ZINC000875135617	GD	On-Demand	Anodyne	HTR2A	16	45
COc1ccccc1N1CCC(NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)CC1	ZINC000875135617	GD	On-Demand	Anodyne	ADRA1A	57	44
COc1ccccc1N1CCC(NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)CC1	ZINC000875135617	GD	On-Demand	Anodyne	ADRA1B	52	44
COc1ccccc1N1CCC(NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)CC1	ZINC000875135617	GD	On-Demand	Anodyne	DRD3	62	42
COc1ccccc1N1CCC(NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)CC1	ZINC000875135617	GD	On-Demand	Anodyne	HTR7	45	40
COc1ccccc1N1CCC(NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)CC1	ZINC000875135618	GD	On-Demand	Anodyne	HTR1A	72	48
COc1ccccc1N1CCC(NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)CC1	ZINC000875135618	GD	On-Demand	Anodyne	DRD2	60	48
COc1ccccc1N1CCC(NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)CC1	ZINC000875135618	GD	On-Demand	Anodyne	DRD4	29	42
COc1ccccc1N1CCC(NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)CC1	ZINC000875135618	GD	On-Demand	Anodyne	ADRA1D	66	44
COc1ccccc1N1CCC(NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)CC1	ZINC000875135618	GD	On-Demand	Anodyne	HTR2A	16	45
COc1ccccc1N1CCC(NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)CC1	ZINC000875135618	GD	On-Demand	Anodyne	ADRA1A	57	44
COc1ccccc1N1CCC(NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)CC1	ZINC000875135618	GD	On-Demand	Anodyne	ADRA1B	52	44
COc1ccccc1N1CCC(NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)CC1	ZINC000875135618	GD	On-Demand	Anodyne	DRD3	62	42
COc1ccccc1N1CCC(NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)CC1	ZINC000875135618	GD	On-Demand	Anodyne	HTR7	45	40
O=C(NCCc1c[nH]c2cc(Cl)ccc12)C(=O)N[C@H]1CC12CCC2	ZINC000875135621	EF	On-Demand	Anodyne	ACHE	30	40
O=C(NCCc1c[nH]c2cc(Cl)ccc12)C(=O)N[C@@H]1CC12CCC2	ZINC000875135622	EF	On-Demand	Anodyne	ACHE	30	40
CCN1CCC[C@H](NC(=O)N2CCC(c3nccc(-c4cccnc4)n3)CC2)C1	ZINC000875135631	GF	On-Demand	Anodyne	PRKD1	42	33
CCN1CCC[C@@H](NC(=O)N2CCC(c3nccc(-c4cccnc4)n3)CC2)C1	ZINC000875135632	GF	On-Demand	Anodyne	PRKD1	42	33
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccccc1OCc1ccccc1	ZINC000875135634	GG	On-Demand	Anodyne	CAPN1	44	34
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccccc1OCc1ccccc1	ZINC000875135634	GG	On-Demand	Anodyne	CAPN2	45	32
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccccc1OCc1ccccc1	ZINC000875135634	GG	On-Demand	Anodyne	DPP7	20	43
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccccc1OCc1ccccc1	ZINC000875135634	GG	On-Demand	Anodyne	Q6PRC7_IXORI	44	35
O=C(NCc1cccc(N2CCOC2=O)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875135643	GG	On-Demand	Anodyne	EPHX2	15	41
O=C(NCc1cccc(N2CCOC2=O)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875135644	GG	On-Demand	Anodyne	EPHX2	15	41
CCN1CCC[C@H](NC(=O)N(CC)[C@H](C)[C@@H](O)c2ccccc2)C1	ZINC000875135664	EF	On-Demand	Anodyne	XIAP	41	37
CCN1CCC[C@H](NC(=O)N(CC)[C@H](C)[C@@H](O)c2ccccc2)C1	ZINC000875135664	EF	On-Demand	Anodyne	BIRC2	55	45
CCN1CCC[C@H](NC(=O)N(CC)[C@H](C)[C@H](O)c2ccccc2)C1	ZINC000875135665	EF	On-Demand	Anodyne	XIAP	41	37
CCN1CCC[C@H](NC(=O)N(CC)[C@H](C)[C@H](O)c2ccccc2)C1	ZINC000875135665	EF	On-Demand	Anodyne	BIRC2	55	45
CCN1CCC[C@H](NC(=O)N(CC)[C@@H](C)[C@@H](O)c2ccccc2)C1	ZINC000875135666	EF	On-Demand	Anodyne	XIAP	41	37
CCN1CCC[C@H](NC(=O)N(CC)[C@@H](C)[C@@H](O)c2ccccc2)C1	ZINC000875135666	EF	On-Demand	Anodyne	BIRC2	55	45
CCN1CCC[C@H](NC(=O)N(CC)[C@@H](C)[C@H](O)c2ccccc2)C1	ZINC000875135667	EF	On-Demand	Anodyne	XIAP	41	37
CCN1CCC[C@H](NC(=O)N(CC)[C@@H](C)[C@H](O)c2ccccc2)C1	ZINC000875135667	EF	On-Demand	Anodyne	BIRC2	55	45
C[C@H](NC(=O)C(=O)NCCCc1cccc(Cl)c1)c1cc2cnccc2o1	ZINC000875135724	GG	On-Demand	Anodyne	PTAFR	19	40
C[C@H](NC(=O)C(=O)NCCCc1cccc(Cl)c1)c1cc2cnccc2o1	ZINC000875135724	GG	On-Demand	Anodyne	MTNR1A	16	41
C[C@H](NC(=O)C(=O)NCCCc1cccc(Cl)c1)c1cc2cnccc2o1	ZINC000875135724	GG	On-Demand	Anodyne	MTNR1B	18	41
CCN1CCC[C@@H](NC(=O)N2CCOC[C@H]2c2ccc(OC)cc2)C1	ZINC000875135727	EE	On-Demand	Anodyne	BIRC2	22	40
CCN1CCC[C@H](NC(=O)N2CCOC[C@@H]2c2ccc(OC)cc2)C1	ZINC000875135728	EE	On-Demand	Anodyne	BIRC2	22	40
CCN1CCC[C@@H](NC(=O)N2CCOC[C@@H]2c2ccc(OC)cc2)C1	ZINC000875135729	EE	On-Demand	Anodyne	BIRC2	22	40
CCN1CCC[C@H](NC(=O)N2CCOC[C@H]2c2ccc(OC)cc2)C1	ZINC000875135730	EE	On-Demand	Anodyne	BIRC2	22	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCc2cccc(Cl)c2)C1	ZINC000875135747	FE	On-Demand	Anodyne	DPP7	44	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCc2cccc(Cl)c2)C1	ZINC000875135748	FE	On-Demand	Anodyne	DPP7	44	44
CCN1CCC[C@@H](NC(=O)N[C@](C)(CO)Cc2ccc(OC)cc2)C1	ZINC000875135758	ED	On-Demand	Anodyne	BIRC2	30	48
CCN1CCC[C@H](NC(=O)N[C@](C)(CO)Cc2ccc(OC)cc2)C1	ZINC000875135759	ED	On-Demand	Anodyne	BIRC2	30	48
CCN1CCC[C@H](NC(=O)N[C@@](C)(CO)Cc2ccc(OC)cc2)C1	ZINC000875135760	ED	On-Demand	Anodyne	BIRC2	30	48
CCN1CCC[C@@H](NC(=O)N[C@@](C)(CO)Cc2ccc(OC)cc2)C1	ZINC000875135761	ED	On-Demand	Anodyne	BIRC2	30	48
O=C1OCCN1c1cccc(CNC(=O)N2CCC[C@@H]2Cn2ccnc2)c1	ZINC000875135766	FE	On-Demand	Anodyne	NOS2	73	37
O=C(NCc1cccc(N2CCOC2=O)c1)N1CCC2(CCNC2=O)CC1	ZINC000875135767	FD	On-Demand	Anodyne	CACNA1H	41	32
O=C(NCc1ncc(Cl)s1)C(=O)N[C@@H]1CCN(CC(F)(F)F)C1	ZINC000875135777	FD	On-Demand	Anodyne	HPGDS	37	42
O=C(NCc1ncc(Cl)s1)C(=O)N[C@H]1CCN(CC(F)(F)F)C1	ZINC000875135778	FD	On-Demand	Anodyne	HPGDS	37	42
O=C(NCc1cccc(N2CCOC2=O)c1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875135782	GG	On-Demand	Anodyne	EPHX2	20	47
CCN1CCC[C@H](NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)C1	ZINC000875135787	FF	On-Demand	Anodyne	BIRC2	37	40
CCN1CCC[C@@H](NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)C1	ZINC000875135788	FF	On-Demand	Anodyne	BIRC2	37	40
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@H](OC)CC[C@@H]2C)CC1	ZINC000875135827	GD	On-Demand	Anodyne	HTR1A	68	44
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@H](OC)CC[C@@H]2C)CC1	ZINC000875135827	GD	On-Demand	Anodyne	DRD2	57	46
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@H](OC)CC[C@@H]2C)CC1	ZINC000875135827	GD	On-Demand	Anodyne	DRD4	31	46
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@H](OC)CC[C@@H]2C)CC1	ZINC000875135827	GD	On-Demand	Anodyne	ADRA1D	64	41
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@H](OC)CC[C@@H]2C)CC1	ZINC000875135827	GD	On-Demand	Anodyne	ADRA1A	55	41
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@H](OC)CC[C@@H]2C)CC1	ZINC000875135827	GD	On-Demand	Anodyne	ADRA1B	49	41
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@H](OC)CC[C@@H]2C)CC1	ZINC000875135827	GD	On-Demand	Anodyne	DRD3	60	41
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@H](OC)CC[C@@H]2C)CC1	ZINC000875135827	GD	On-Demand	Anodyne	HTR7	45	39
O=C(NC[C@H]1Cc2ccccc21)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875135828	CF	On-Demand	Anodyne	RBP4	42	39
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@H](OC)CC[C@H]2C)CC1	ZINC000875135829	GD	On-Demand	Anodyne	HTR1A	68	44
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@H](OC)CC[C@H]2C)CC1	ZINC000875135829	GD	On-Demand	Anodyne	DRD2	57	46
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@H](OC)CC[C@H]2C)CC1	ZINC000875135829	GD	On-Demand	Anodyne	DRD4	31	46
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@H](OC)CC[C@H]2C)CC1	ZINC000875135829	GD	On-Demand	Anodyne	ADRA1D	64	41
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@H](OC)CC[C@H]2C)CC1	ZINC000875135829	GD	On-Demand	Anodyne	ADRA1A	55	41
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@H](OC)CC[C@H]2C)CC1	ZINC000875135829	GD	On-Demand	Anodyne	ADRA1B	49	41
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@H](OC)CC[C@H]2C)CC1	ZINC000875135829	GD	On-Demand	Anodyne	DRD3	60	41
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@H](OC)CC[C@H]2C)CC1	ZINC000875135829	GD	On-Demand	Anodyne	HTR7	45	39
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@@H](OC)CC[C@@H]2C)CC1	ZINC000875135830	GD	On-Demand	Anodyne	HTR1A	68	44
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@@H](OC)CC[C@@H]2C)CC1	ZINC000875135830	GD	On-Demand	Anodyne	DRD2	57	46
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@@H](OC)CC[C@@H]2C)CC1	ZINC000875135830	GD	On-Demand	Anodyne	DRD4	31	46
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@@H](OC)CC[C@@H]2C)CC1	ZINC000875135830	GD	On-Demand	Anodyne	ADRA1D	64	41
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@@H](OC)CC[C@@H]2C)CC1	ZINC000875135830	GD	On-Demand	Anodyne	ADRA1A	55	41
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@@H](OC)CC[C@@H]2C)CC1	ZINC000875135830	GD	On-Demand	Anodyne	ADRA1B	49	41
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@@H](OC)CC[C@@H]2C)CC1	ZINC000875135830	GD	On-Demand	Anodyne	DRD3	60	41
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@@H](OC)CC[C@@H]2C)CC1	ZINC000875135830	GD	On-Demand	Anodyne	HTR7	45	39
O=C(NC[C@@H]1Cc2ccccc21)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875135831	CF	On-Demand	Anodyne	RBP4	42	39
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@@H](OC)CC[C@H]2C)CC1	ZINC000875135832	GD	On-Demand	Anodyne	HTR1A	68	44
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@@H](OC)CC[C@H]2C)CC1	ZINC000875135832	GD	On-Demand	Anodyne	DRD2	57	46
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@@H](OC)CC[C@H]2C)CC1	ZINC000875135832	GD	On-Demand	Anodyne	DRD4	31	46
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@@H](OC)CC[C@H]2C)CC1	ZINC000875135832	GD	On-Demand	Anodyne	ADRA1D	64	41
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@@H](OC)CC[C@H]2C)CC1	ZINC000875135832	GD	On-Demand	Anodyne	ADRA1A	55	41
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@@H](OC)CC[C@H]2C)CC1	ZINC000875135832	GD	On-Demand	Anodyne	ADRA1B	49	41
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@@H](OC)CC[C@H]2C)CC1	ZINC000875135832	GD	On-Demand	Anodyne	DRD3	60	41
COc1ccccc1N1CCC(NC(=O)C(=O)N2C[C@@H](OC)CC[C@H]2C)CC1	ZINC000875135832	GD	On-Demand	Anodyne	HTR7	45	39
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135845	GD	On-Demand	Mild	HTR1A	91	44
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135845	GD	On-Demand	Mild	DRD2	86	45
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135845	GD	On-Demand	Mild	DRD4	52	45
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135845	GD	On-Demand	Mild	ADRA1D	85	42
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135845	GD	On-Demand	Mild	HTR2A	22	40
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135845	GD	On-Demand	Mild	ADRA1A	76	42
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135845	GD	On-Demand	Mild	ADRA1B	64	42
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135845	GD	On-Demand	Mild	DRD3	85	45
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135845	GD	On-Demand	Mild	HTR7	56	39
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135846	GD	On-Demand	Mild	HTR1A	91	44
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135846	GD	On-Demand	Mild	DRD2	86	45
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135846	GD	On-Demand	Mild	DRD4	52	45
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135846	GD	On-Demand	Mild	ADRA1D	85	42
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135846	GD	On-Demand	Mild	HTR2A	22	40
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135846	GD	On-Demand	Mild	ADRA1A	76	42
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135846	GD	On-Demand	Mild	ADRA1B	64	42
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135846	GD	On-Demand	Mild	DRD3	85	45
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135846	GD	On-Demand	Mild	HTR7	56	39
CN1CCN(c2ncccc2CNC(=O)C(=O)NCC[C@H]2CCSC2)CC1	ZINC000875135863	GC	On-Demand	Anodyne	SIRT3	52	33
CN1CCN(c2ncccc2CNC(=O)C(=O)NCC[C@H]2CCSC2)CC1	ZINC000875135863	GC	On-Demand	Anodyne	SIRT2	52	33
CN1CCN(c2ncccc2CNC(=O)C(=O)NCC[C@H]2CCSC2)CC1	ZINC000875135863	GC	On-Demand	Anodyne	SIRT1	52	33
CN1CCN(c2ncccc2CNC(=O)C(=O)NCC[C@@H]2CCSC2)CC1	ZINC000875135864	GC	On-Demand	Anodyne	SIRT3	52	33
CN1CCN(c2ncccc2CNC(=O)C(=O)NCC[C@@H]2CCSC2)CC1	ZINC000875135864	GC	On-Demand	Anodyne	SIRT2	52	33
CN1CCN(c2ncccc2CNC(=O)C(=O)NCC[C@@H]2CCSC2)CC1	ZINC000875135864	GC	On-Demand	Anodyne	SIRT1	52	33
COc1ccccc1N1CCC(NC(=O)C(=O)NCCCCC2CC2)CC1	ZINC000875135874	FE	On-Demand	Anodyne	HTR1A	117	59
COc1ccccc1N1CCC(NC(=O)C(=O)NCCCCC2CC2)CC1	ZINC000875135874	FE	On-Demand	Anodyne	ADRA2A	15	49
COc1ccccc1N1CCC(NC(=O)C(=O)NCCCCC2CC2)CC1	ZINC000875135874	FE	On-Demand	Anodyne	DRD2	112	57
COc1ccccc1N1CCC(NC(=O)C(=O)NCCCCC2CC2)CC1	ZINC000875135874	FE	On-Demand	Anodyne	DRD1	23	50
COc1ccccc1N1CCC(NC(=O)C(=O)NCCCCC2CC2)CC1	ZINC000875135874	FE	On-Demand	Anodyne	DRD4	66	53
COc1ccccc1N1CCC(NC(=O)C(=O)NCCCCC2CC2)CC1	ZINC000875135874	FE	On-Demand	Anodyne	ADRA1D	110	45
COc1ccccc1N1CCC(NC(=O)C(=O)NCCCCC2CC2)CC1	ZINC000875135874	FE	On-Demand	Anodyne	HTR1B	15	51
COc1ccccc1N1CCC(NC(=O)C(=O)NCCCCC2CC2)CC1	ZINC000875135874	FE	On-Demand	Anodyne	HTR2A	41	48
COc1ccccc1N1CCC(NC(=O)C(=O)NCCCCC2CC2)CC1	ZINC000875135874	FE	On-Demand	Anodyne	HTR2C	21	51
COc1ccccc1N1CCC(NC(=O)C(=O)NCCCCC2CC2)CC1	ZINC000875135874	FE	On-Demand	Anodyne	ADRA1A	101	49
COc1ccccc1N1CCC(NC(=O)C(=O)NCCCCC2CC2)CC1	ZINC000875135874	FE	On-Demand	Anodyne	ADRA1B	84	45
COc1ccccc1N1CCC(NC(=O)C(=O)NCCCCC2CC2)CC1	ZINC000875135874	FE	On-Demand	Anodyne	DRD3	127	57
COc1ccccc1N1CCC(NC(=O)C(=O)NCCCCC2CC2)CC1	ZINC000875135874	FE	On-Demand	Anodyne	HTR7	72	44
COc1ccccc1N1CCC(NC(=O)C(=O)NCCCCC2CC2)CC1	ZINC000875135874	FE	On-Demand	Anodyne	SIGMAR1	16	41
COc1ccccc1N1CCC(NC(=O)C(=O)NCCCCC2CC2)CC1	ZINC000875135874	FE	On-Demand	Anodyne	NPY1R	21	40
C=CC(C)(C)CCCNC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135910	GF	On-Demand	Mild	HTR1A	97	52
C=CC(C)(C)CCCNC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135910	GF	On-Demand	Mild	DRD2	86	52
C=CC(C)(C)CCCNC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135910	GF	On-Demand	Mild	DRD1	18	44
C=CC(C)(C)CCCNC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135910	GF	On-Demand	Mild	DRD4	48	47
C=CC(C)(C)CCCNC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135910	GF	On-Demand	Mild	ADRA1D	93	45
C=CC(C)(C)CCCNC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135910	GF	On-Demand	Mild	HTR2A	27	46
C=CC(C)(C)CCCNC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135910	GF	On-Demand	Mild	ADRA1A	84	45
C=CC(C)(C)CCCNC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135910	GF	On-Demand	Mild	ADRA1B	69	42
C=CC(C)(C)CCCNC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135910	GF	On-Demand	Mild	DRD3	97	49
C=CC(C)(C)CCCNC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875135910	GF	On-Demand	Mild	HTR7	64	43
Cc1cncc([C@@H]2CCCN2C(=O)NCc2ccn(-c3ccccc3)n2)c1	ZINC000875135913	FH	On-Demand	Anodyne	PREP	34	40
Cc1cncc([C@H]2CCCN2C(=O)NCc2ccn(-c3ccccc3)n2)c1	ZINC000875135920	FH	On-Demand	Anodyne	PREP	34	40
CN1CCN(C2CCN(C(=O)NCc3ccn(-c4ccccc4)n3)CC2)CC1	ZINC000875135928	GD	On-Demand	Anodyne	EPHX2	17	40
CN1CCN(C2CCN(C(=O)NCc3ccn(-c4ccccc4)n3)CC2)CC1	ZINC000875135928	GD	On-Demand	Anodyne	L3MBTL3	61	39
CCN1CCC[C@H](NC(=O)N[C@](C)(CO)Cc2ccc(OC)c(OC)c2)C1	ZINC000875135933	GD	On-Demand	Anodyne	FKBP1A	36	41
CCN1CCC[C@H](NC(=O)N[C@](C)(CO)Cc2ccc(OC)c(OC)c2)C1	ZINC000875135933	GD	On-Demand	Anodyne	SSTR5	42	34
CCN1CCC[C@H](NC(=O)N[C@@](C)(CO)Cc2ccc(OC)c(OC)c2)C1	ZINC000875135935	GD	On-Demand	Anodyne	FKBP1A	36	41
CCN1CCC[C@H](NC(=O)N[C@@](C)(CO)Cc2ccc(OC)c(OC)c2)C1	ZINC000875135935	GD	On-Demand	Anodyne	SSTR5	42	34
CCN1CCC[C@@H](NC(=O)N[C@@](C)(CO)Cc2ccc(OC)c(OC)c2)C1	ZINC000875135937	GD	On-Demand	Anodyne	FKBP1A	36	41
CCN1CCC[C@@H](NC(=O)N[C@@](C)(CO)Cc2ccc(OC)c(OC)c2)C1	ZINC000875135937	GD	On-Demand	Anodyne	SSTR5	42	34
CCN1CCC[C@@H](NC(=O)N[C@](C)(CO)Cc2ccc(OC)c(OC)c2)C1	ZINC000875135938	GD	On-Demand	Anodyne	FKBP1A	36	41
CCN1CCC[C@@H](NC(=O)N[C@](C)(CO)Cc2ccc(OC)c(OC)c2)C1	ZINC000875135938	GD	On-Demand	Anodyne	SSTR5	42	34
CN1CCN(c2ncccc2CNC(=O)C(=O)NCCCCC2CC2)CC1	ZINC000875135941	FD	On-Demand	Anodyne	SIRT3	47	35
CN1CCN(c2ncccc2CNC(=O)C(=O)NCCCCC2CC2)CC1	ZINC000875135941	FD	On-Demand	Anodyne	SIRT2	47	35
CN1CCN(c2ncccc2CNC(=O)C(=O)NCCCCC2CC2)CC1	ZINC000875135941	FD	On-Demand	Anodyne	SIRT1	45	35
CCN1CCC[C@H](NC(=O)N[C@@H](C)[C@H](O)c2cc(OC)ccc2OC)C1	ZINC000875135948	FD	On-Demand	Anodyne	BIRC2	40	44
CCN1CCC[C@H](NC(=O)N[C@H](C)[C@H](O)c2cc(OC)ccc2OC)C1	ZINC000875135949	FD	On-Demand	Anodyne	BIRC2	40	44
CCOc1ccccc1CNC(=O)NC1CC(C(=O)OC)C1	ZINC000875135950	DD	On-Demand	Anodyne	EPHX2	19	44
CCOc1ccccc1CNC(=O)NC1CC(C(=O)OC)C1	ZINC000875135950	DD	On-Demand	Anodyne	HCN1	55	33
CCOc1ccccc1CNC(=O)NC1CC(C(=O)OC)C1	ZINC000875135950	DD	On-Demand	Anodyne	HCN4	43	33
CCN1CCC[C@H](NC(=O)N[C@H](C)[C@@H](O)c2cc(OC)ccc2OC)C1	ZINC000875135951	FD	On-Demand	Anodyne	BIRC2	40	44
CCN1CCC[C@H](NC(=O)N[C@@H](C)[C@@H](O)c2cc(OC)ccc2OC)C1	ZINC000875135953	FD	On-Demand	Anodyne	BIRC2	40	44
O=C(NCCO)C1CCN(C(=O)NC[C@@H]2Cc3ccccc32)CC1	ZINC000875135964	EC	On-Demand	Anodyne	MTNR1A	20	50
O=C(NCCO)C1CCN(C(=O)NC[C@@H]2Cc3ccccc32)CC1	ZINC000875135964	EC	On-Demand	Anodyne	MTNR1B	22	50
O=C(NCCO)C1CCN(C(=O)NC[C@H]2Cc3ccccc32)CC1	ZINC000875135967	EC	On-Demand	Anodyne	MTNR1A	20	50
O=C(NCCO)C1CCN(C(=O)NC[C@H]2Cc3ccccc32)CC1	ZINC000875135967	EC	On-Demand	Anodyne	MTNR1B	22	50
CCC1(N2CCCC2)CCN(C(=O)NCc2ccn(-c3ccccc3)n2)CC1	ZINC000875136037	GG	On-Demand	Anodyne	HCN1	61	33
CCC1(N2CCCC2)CCN(C(=O)NCc2ccn(-c3ccccc3)n2)CC1	ZINC000875136037	GG	On-Demand	Anodyne	HCN4	47	31
CCOc1ccccc1CNC(=O)N(C)CCN1CC2(CCOCC2)C1	ZINC000875136042	FE	On-Demand	Anodyne	HCN1	50	38
CCOc1ccccc1CNC(=O)N(C)CCN1CC2(CCOCC2)C1	ZINC000875136042	FE	On-Demand	Anodyne	HCN4	41	33
O=C(NC[C@H]1Cc2ccccc21)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875136047	FE	On-Demand	Anodyne	SMO	36	46
O=C(NC[C@H]1Cc2ccccc21)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875136047	FE	On-Demand	Anodyne	ETHR	52	34
O=C(NC[C@@H]1Cc2ccccc21)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875136048	FE	On-Demand	Anodyne	SMO	36	46
O=C(NC[C@@H]1Cc2ccccc21)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875136048	FE	On-Demand	Anodyne	ETHR	52	34
O=C(NC[C@@H]1Cc2ccccc21)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875136049	FE	On-Demand	Anodyne	SMO	36	46
O=C(NC[C@@H]1Cc2ccccc21)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875136049	FE	On-Demand	Anodyne	ETHR	52	34
O=C(NC[C@H]1Cc2ccccc21)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875136050	FE	On-Demand	Anodyne	SMO	36	46
O=C(NC[C@H]1Cc2ccccc21)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875136050	FE	On-Demand	Anodyne	ETHR	52	34
CCOc1ccccc1CNC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1	ZINC000875136059	FD	On-Demand	Anodyne	HCN1	50	34
CCOc1ccccc1CNC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1	ZINC000875136059	FD	On-Demand	Anodyne	HCN4	42	32
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)N[C@@H]2CCN(CC(F)(F)F)C2)c1	ZINC000875136090	GD	On-Demand	Anodyne	SSTR5	28	40
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)N[C@H]2CCN(CC(F)(F)F)C2)c1	ZINC000875136093	GD	On-Demand	Anodyne	SSTR5	28	40
Cc1cncc([C@H]2CCCN2C(=O)C(=O)N[C@@H]2CCN(CC(F)(F)F)C2)c1	ZINC000875136095	GD	On-Demand	Anodyne	SSTR5	28	40
Cc1cncc([C@H]2CCCN2C(=O)C(=O)N[C@H]2CCN(CC(F)(F)F)C2)c1	ZINC000875136098	GD	On-Demand	Anodyne	SSTR5	28	40
CCN(CCNC(=O)OC(C)(C)C)C(=O)NC[C@@H]1Cc2ccccc21	ZINC000875136148	EF	On-Demand	Anodyne	MTNR1A	15	44
CCN(CCNC(=O)OC(C)(C)C)C(=O)NC[C@@H]1Cc2ccccc21	ZINC000875136148	EF	On-Demand	Anodyne	MTNR1B	18	44
CCN(CCNC(=O)OC(C)(C)C)C(=O)NC[C@H]1Cc2ccccc21	ZINC000875136150	EF	On-Demand	Anodyne	MTNR1A	15	44
CCN(CCNC(=O)OC(C)(C)C)C(=O)NC[C@H]1Cc2ccccc21	ZINC000875136150	EF	On-Demand	Anodyne	MTNR1B	18	44
O=C(NCc1cccc(N2CCOC2=O)c1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875136153	GF	On-Demand	Anodyne	NPSR1	25	40
O=C(NCc1cccc(N2CCOC2=O)c1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875136155	GF	On-Demand	Anodyne	NPSR1	25	40
CCOc1ccccc1CNC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875136156	EG	On-Demand	Anodyne	EPHX2	17	43
CCOc1ccccc1CNC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875136156	EG	On-Demand	Anodyne	CCR8	37	43
CCOc1ccccc1CNC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875136156	EG	On-Demand	Anodyne	HCN1	75	46
CCOc1ccccc1CNC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875136156	EG	On-Demand	Anodyne	HCN4	56	38
O=C(NC[C@@H]1Cc2ccccc21)N1Cc2cccc(O)c2C1	ZINC000875136158	CF	On-Demand	Clean	MTNR1A	15	46
O=C(NC[C@@H]1Cc2ccccc21)N1Cc2cccc(O)c2C1	ZINC000875136158	CF	On-Demand	Clean	MTNR1B	17	46
O=C(NC[C@H]1Cc2ccccc21)N1Cc2cccc(O)c2C1	ZINC000875136160	CF	On-Demand	Clean	MTNR1A	15	46
O=C(NC[C@H]1Cc2ccccc21)N1Cc2cccc(O)c2C1	ZINC000875136160	CF	On-Demand	Clean	MTNR1B	17	46
CCOc1ccccc1CNC(=O)N1CCCN(C=O)CC1	ZINC000875136162	DD	On-Demand	Anodyne	HCN1	59	38
CCOc1ccccc1CNC(=O)N1CCCN(C=O)CC1	ZINC000875136162	DD	On-Demand	Anodyne	HCN4	45	35
C[C@H](NC(=O)C(=O)NCCCc1cccc(Cl)c1)c1ccnn1C	ZINC000875136189	ED	On-Demand	Anodyne	SCNN1A	55	36
C[C@H](NC(=O)C(=O)NCCCc1cccc(Cl)c1)c1ccnn1C	ZINC000875136189	ED	On-Demand	Anodyne	CTSL	19	42
C[C@H](NC(=O)C(=O)NCCCc1cccc(Cl)c1)c1ccnn1C	ZINC000875136189	ED	On-Demand	Anodyne	MTNR1A	17	42
C[C@H](NC(=O)C(=O)NCCCc1cccc(Cl)c1)c1ccnn1C	ZINC000875136189	ED	On-Demand	Anodyne	MTNR1B	19	42
C[C@H](NC(=O)C(=O)NCCCc1cccc(Cl)c1)c1ccnn1C	ZINC000875136189	ED	On-Demand	Anodyne	CTSV	52	42
O=C1OCCN1c1cccc(CNC(=O)N(C2CC2)C2CC2)c1	ZINC000875136191	DE	On-Demand	Anodyne	CARM1	45	36
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@@H](C)c2ccnn2C)CC1	ZINC000875136205	GD	On-Demand	Anodyne	HTR1A	96	43
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@@H](C)c2ccnn2C)CC1	ZINC000875136205	GD	On-Demand	Anodyne	DRD2	77	43
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@@H](C)c2ccnn2C)CC1	ZINC000875136205	GD	On-Demand	Anodyne	DRD4	39	42
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@@H](C)c2ccnn2C)CC1	ZINC000875136205	GD	On-Demand	Anodyne	ADRA1D	96	43
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@@H](C)c2ccnn2C)CC1	ZINC000875136205	GD	On-Demand	Anodyne	HTR2A	22	42
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@@H](C)c2ccnn2C)CC1	ZINC000875136205	GD	On-Demand	Anodyne	ADRA1A	86	43
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@@H](C)c2ccnn2C)CC1	ZINC000875136205	GD	On-Demand	Anodyne	ADRA1B	73	43
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@@H](C)c2ccnn2C)CC1	ZINC000875136205	GD	On-Demand	Anodyne	DRD3	73	43
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@@H](C)c2ccnn2C)CC1	ZINC000875136205	GD	On-Demand	Anodyne	HTR7	58	40
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@H](C)c2ccnn2C)CC1	ZINC000875136206	GD	On-Demand	Anodyne	HTR1A	96	43
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@H](C)c2ccnn2C)CC1	ZINC000875136206	GD	On-Demand	Anodyne	DRD2	77	43
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@H](C)c2ccnn2C)CC1	ZINC000875136206	GD	On-Demand	Anodyne	DRD4	39	42
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@H](C)c2ccnn2C)CC1	ZINC000875136206	GD	On-Demand	Anodyne	ADRA1D	96	43
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@H](C)c2ccnn2C)CC1	ZINC000875136206	GD	On-Demand	Anodyne	HTR2A	22	42
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@H](C)c2ccnn2C)CC1	ZINC000875136206	GD	On-Demand	Anodyne	ADRA1A	86	43
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@H](C)c2ccnn2C)CC1	ZINC000875136206	GD	On-Demand	Anodyne	ADRA1B	73	43
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@H](C)c2ccnn2C)CC1	ZINC000875136206	GD	On-Demand	Anodyne	DRD3	73	43
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@H](C)c2ccnn2C)CC1	ZINC000875136206	GD	On-Demand	Anodyne	HTR7	58	40
CO[C@@H]1CC[C@@H](C)N(C(=O)NC[C@H]2Cc3ccccc32)C1	ZINC000875136227	CF	On-Demand	Anodyne	MTNR1A	23	48
CO[C@@H]1CC[C@@H](C)N(C(=O)NC[C@H]2Cc3ccccc32)C1	ZINC000875136227	CF	On-Demand	Anodyne	MTNR1B	28	48
CO[C@@H]1CC[C@@H](C)N(C(=O)NC[C@@H]2Cc3ccccc32)C1	ZINC000875136229	CF	On-Demand	Anodyne	MTNR1A	23	48
CO[C@@H]1CC[C@@H](C)N(C(=O)NC[C@@H]2Cc3ccccc32)C1	ZINC000875136229	CF	On-Demand	Anodyne	MTNR1B	28	48
COC(=O)N(C)NC(=O)NC[C@@H]1Cc2ccccc21	ZINC000875136248	CD	On-Demand	Reactive	MTNR1A	23	50
COC(=O)N(C)NC(=O)NC[C@@H]1Cc2ccccc21	ZINC000875136248	CD	On-Demand	Reactive	MTNR1B	28	50
COC(=O)N(C)NC(=O)NC[C@H]1Cc2ccccc21	ZINC000875136249	CD	On-Demand	Reactive	MTNR1A	23	50
COC(=O)N(C)NC(=O)NC[C@H]1Cc2ccccc21	ZINC000875136249	CD	On-Demand	Reactive	MTNR1B	28	50
CCOc1ccccc1CNC(=O)N1Cc2cccc(O)c2C1	ZINC000875136261	DG	On-Demand	Clean	HCN1	55	38
CCOc1ccccc1CNC(=O)N1Cc2cccc(O)c2C1	ZINC000875136261	DG	On-Demand	Clean	HCN4	40	31
CONC(=O)C1CCN(C(=O)NC[C@@H]2Cc3ccccc32)CC1	ZINC000875136267	DD	On-Demand	Anodyne	MTNR1A	24	46
CONC(=O)C1CCN(C(=O)NC[C@@H]2Cc3ccccc32)CC1	ZINC000875136267	DD	On-Demand	Anodyne	MTNR1B	28	46
CONC(=O)C1CCN(C(=O)NC[C@H]2Cc3ccccc32)CC1	ZINC000875136268	DD	On-Demand	Anodyne	MTNR1A	24	46
CONC(=O)C1CCN(C(=O)NC[C@H]2Cc3ccccc32)CC1	ZINC000875136268	DD	On-Demand	Anodyne	MTNR1B	28	46
C[C@@H](CNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)Cn1cccn1	ZINC000875136272	FE	On-Demand	Anodyne	FAAH	16	40
C[C@H](CNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)Cn1cccn1	ZINC000875136273	FE	On-Demand	Anodyne	FAAH	16	40
O=C(NCc1ccn(-c2ccccc2)n1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875136278	GE	On-Demand	Anodyne	ETHR	53	34
O=C(NCc1ccn(-c2ccccc2)n1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875136279	GE	On-Demand	Anodyne	ETHR	53	34
N#CCc1ccsc1C(=O)N(CCc1ccccc1)C1CCCC1	ZINC000875136281	EI	On-Demand	Mild	ACE	40	36
N#CCc1ccsc1C(=O)N(CCc1ccccc1)C1CCCC1	ZINC000875136281	EI	On-Demand	Mild	C5AR1	24	44
N#CCc1ccsc1C(=O)N(CCc1ccccc1)C1CCCC1	ZINC000875136281	EI	On-Demand	Mild	MBTPS1	44	32
O=C(NC[C@@H]1Cc2ccccc21)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875136302	EF	On-Demand	Anodyne	RBP4	41	36
O=C(NC[C@@H]1Cc2ccccc21)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875136306	EF	On-Demand	Anodyne	RBP4	41	36
O=C(NC[C@H]1Cc2ccccc21)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875136309	EF	On-Demand	Anodyne	RBP4	41	36
O=C(NC[C@H]1Cc2ccccc21)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875136312	EF	On-Demand	Anodyne	RBP4	41	36
O=C1OCCN1c1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875136329	GG	On-Demand	Anodyne	PREP	18	40
O=C1OCCN1c1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875136329	GG	On-Demand	Anodyne	TMPRSS11D	60	34
O=C1OCCN1c1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875136330	GG	On-Demand	Anodyne	PREP	18	40
O=C1OCCN1c1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875136330	GG	On-Demand	Anodyne	TMPRSS11D	60	34
O=C1OCCN1c1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875136331	GG	On-Demand	Anodyne	PREP	18	40
O=C1OCCN1c1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875136331	GG	On-Demand	Anodyne	TMPRSS11D	60	34
O=C1OCCN1c1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875136333	GG	On-Demand	Anodyne	PREP	18	40
O=C1OCCN1c1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875136333	GG	On-Demand	Anodyne	TMPRSS11D	60	34
CCN1CCC[C@H](NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)C1	ZINC000875136350	EE	On-Demand	Anodyne	SLC6A1	42	38
CCN1CCC[C@H](NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)C1	ZINC000875136350	EE	On-Demand	Anodyne	BIRC2	41	45
CCN1CCC[C@H](NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)C1	ZINC000875136351	EE	On-Demand	Anodyne	SLC6A1	42	38
CCN1CCC[C@H](NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)C1	ZINC000875136351	EE	On-Demand	Anodyne	BIRC2	41	45
CCN1CCC[C@H](NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)C1	ZINC000875136353	EE	On-Demand	Anodyne	SLC6A1	42	38
CCN1CCC[C@H](NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)C1	ZINC000875136353	EE	On-Demand	Anodyne	BIRC2	41	45
CCN1CCC[C@H](NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)C1	ZINC000875136355	EE	On-Demand	Anodyne	SLC6A1	42	38
CCN1CCC[C@H](NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)C1	ZINC000875136355	EE	On-Demand	Anodyne	BIRC2	41	45
CCOc1ccccc1CNC(=O)N1CCCCCCNC(=O)CC1	ZINC000875136381	EF	On-Demand	Anodyne	HCN1	57	39
CCOc1ccccc1CNC(=O)N1CCCCCCNC(=O)CC1	ZINC000875136381	EF	On-Demand	Anodyne	HCN4	45	35
CCN1CCC[C@H](NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)C1	ZINC000875136416	EE	On-Demand	Anodyne	EPHX2	19	44
CCN1CCC[C@@H](NC(=O)N2CCC[C@](O)(c3ccccc3)C2)C1	ZINC000875136417	EE	On-Demand	Anodyne	EPHX2	19	44
CCN1CCC[C@@H](NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)C1	ZINC000875136418	EE	On-Demand	Anodyne	EPHX2	19	44
CCN1CCC[C@H](NC(=O)N2CCC[C@](O)(c3ccccc3)C2)C1	ZINC000875136419	EE	On-Demand	Anodyne	EPHX2	19	44
CCN1CCC[C@@H](NC(=O)N2C[C@@H]3C[C@H]2CN3c2ccccc2)C1	ZINC000875136440	EE	On-Demand	Anodyne	BIRC2	42	38
CCN1CCC[C@H](NC(=O)N2C[C@@H]3C[C@H]2CN3c2ccccc2)C1	ZINC000875136441	EE	On-Demand	Anodyne	BIRC2	42	38
O=C(NCc1cccc(N2CCOC2=O)c1)N1CCC(CCF)CC1	ZINC000875136475	EF	On-Demand	Anodyne	ST14	40	31
CCOc1ccccc1CNC(=O)N(CC)OCC	ZINC000875136489	CF	On-Demand	Anodyne	TSPO	18	41
CCOc1ccccc1CNC(=O)N(CC)OCC	ZINC000875136489	CF	On-Demand	Anodyne	HCN1	48	32
CCOc1ccccc1CNC(=O)N(CC)OCC	ZINC000875136489	CF	On-Demand	Anodyne	HCN4	40	31
CCOc1ccccc1CNC(=O)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875136490	FG	On-Demand	Anodyne	HCN1	52	36
CCOc1ccccc1CNC(=O)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875136490	FG	On-Demand	Anodyne	HCN4	45	36
O=C(NCCO)C1CCN(C(=O)NCc2ccn(-c3ccccc3)n2)CC1	ZINC000875136513	FC	On-Demand	Anodyne	EPHX2	18	41
COC(=O)[C@@]12C[C@@H](NC(=O)NC[C@@H]3Cc4ccccc43)C[C@@H]1C2	ZINC000875136524	DD	On-Demand	Anodyne	MTNR1B	16	41
COC(=O)[C@@]12C[C@@H](NC(=O)NC[C@H]3Cc4ccccc43)C[C@@H]1C2	ZINC000875136525	DD	On-Demand	Anodyne	MTNR1B	16	41
COc1ccccc1N1CCC(NC(=O)C(=O)NCC[C@H]2CCSC2)CC1	ZINC000875136526	GE	On-Demand	Anodyne	HTR1A	91	47
COc1ccccc1N1CCC(NC(=O)C(=O)NCC[C@H]2CCSC2)CC1	ZINC000875136526	GE	On-Demand	Anodyne	DRD2	81	51
COc1ccccc1N1CCC(NC(=O)C(=O)NCC[C@H]2CCSC2)CC1	ZINC000875136526	GE	On-Demand	Anodyne	DRD4	45	45
COc1ccccc1N1CCC(NC(=O)C(=O)NCC[C@H]2CCSC2)CC1	ZINC000875136526	GE	On-Demand	Anodyne	ADRA1D	88	41
COc1ccccc1N1CCC(NC(=O)C(=O)NCC[C@H]2CCSC2)CC1	ZINC000875136526	GE	On-Demand	Anodyne	HTR2A	22	41
COc1ccccc1N1CCC(NC(=O)C(=O)NCC[C@H]2CCSC2)CC1	ZINC000875136526	GE	On-Demand	Anodyne	ADRA1A	77	41
COc1ccccc1N1CCC(NC(=O)C(=O)NCC[C@H]2CCSC2)CC1	ZINC000875136526	GE	On-Demand	Anodyne	ADRA1B	67	41
COc1ccccc1N1CCC(NC(=O)C(=O)NCC[C@H]2CCSC2)CC1	ZINC000875136526	GE	On-Demand	Anodyne	DRD3	88	51
COc1ccccc1N1CCC(NC(=O)C(=O)NCC[C@H]2CCSC2)CC1	ZINC000875136526	GE	On-Demand	Anodyne	HTR7	54	40
COc1ccccc1N1CCC(NC(=O)C(=O)NCC[C@H]2CCSC2)CC1	ZINC000875136526	GE	On-Demand	Anodyne	SIRT3	40	33
COc1ccccc1N1CCC(NC(=O)C(=O)NCC[C@H]2CCSC2)CC1	ZINC000875136526	GE	On-Demand	Anodyne	SIRT2	44	33
COc1ccccc1N1CCC(NC(=O)C(=O)NCC[C@H]2CCSC2)CC1	ZINC000875136526	GE	On-Demand	Anodyne	SIRT1	40	33
COc1ccccc1N1CCC(NC(=O)C(=O)NCC[C@@H]2CCSC2)CC1	ZINC000875136531	GE	On-Demand	Anodyne	HTR1A	91	47
COc1ccccc1N1CCC(NC(=O)C(=O)NCC[C@@H]2CCSC2)CC1	ZINC000875136531	GE	On-Demand	Anodyne	DRD2	81	51
COc1ccccc1N1CCC(NC(=O)C(=O)NCC[C@@H]2CCSC2)CC1	ZINC000875136531	GE	On-Demand	Anodyne	DRD4	45	45
COc1ccccc1N1CCC(NC(=O)C(=O)NCC[C@@H]2CCSC2)CC1	ZINC000875136531	GE	On-Demand	Anodyne	ADRA1D	88	41
COc1ccccc1N1CCC(NC(=O)C(=O)NCC[C@@H]2CCSC2)CC1	ZINC000875136531	GE	On-Demand	Anodyne	HTR2A	22	41
COc1ccccc1N1CCC(NC(=O)C(=O)NCC[C@@H]2CCSC2)CC1	ZINC000875136531	GE	On-Demand	Anodyne	ADRA1A	77	41
COc1ccccc1N1CCC(NC(=O)C(=O)NCC[C@@H]2CCSC2)CC1	ZINC000875136531	GE	On-Demand	Anodyne	ADRA1B	67	41
COc1ccccc1N1CCC(NC(=O)C(=O)NCC[C@@H]2CCSC2)CC1	ZINC000875136531	GE	On-Demand	Anodyne	DRD3	88	51
COc1ccccc1N1CCC(NC(=O)C(=O)NCC[C@@H]2CCSC2)CC1	ZINC000875136531	GE	On-Demand	Anodyne	HTR7	54	40
COc1ccccc1N1CCC(NC(=O)C(=O)NCC[C@@H]2CCSC2)CC1	ZINC000875136531	GE	On-Demand	Anodyne	SIRT3	40	33
COc1ccccc1N1CCC(NC(=O)C(=O)NCC[C@@H]2CCSC2)CC1	ZINC000875136531	GE	On-Demand	Anodyne	SIRT2	44	33
COc1ccccc1N1CCC(NC(=O)C(=O)NCC[C@@H]2CCSC2)CC1	ZINC000875136531	GE	On-Demand	Anodyne	SIRT1	40	33
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2Cc3ccccc32)C1	ZINC000875136544	DE	On-Demand	Anodyne	MTNR1B	18	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2Cc3ccccc32)C1	ZINC000875136546	DE	On-Demand	Anodyne	MTNR1B	18	41
CCOc1ccccc1CNC(=O)N[C@@H]1C[C@H]2C[C@@]2(C(=O)OC)C1	ZINC000875136549	EE	On-Demand	Anodyne	HCN1	49	32
CCOc1ccccc1CNC(=O)N[C@@H]1C[C@H]2C[C@@]2(C(=O)OC)C1	ZINC000875136549	EE	On-Demand	Anodyne	HCN4	42	32
CC(=O)Nc1ccc2c(c1)CN(C(=O)NC[C@@H]1Cc3ccccc31)CC2	ZINC000875136559	EG	On-Demand	Anodyne	MTNR1B	15	44
CC(=O)Nc1ccc2c(c1)CN(C(=O)NC[C@H]1Cc3ccccc31)CC2	ZINC000875136560	EG	On-Demand	Anodyne	MTNR1B	15	44
CCOc1ccccc1CNC(=O)NC(C)(C)[C@@H]1CCCCO1	ZINC000875136561	DG	On-Demand	Anodyne	HCN1	52	36
CCOc1ccccc1CNC(=O)NC(C)(C)[C@@H]1CCCCO1	ZINC000875136561	DG	On-Demand	Anodyne	HCN4	46	36
CCOc1ccccc1CNC(=O)NC(C)(C)[C@H]1CCCCO1	ZINC000875136563	DG	On-Demand	Anodyne	HCN1	52	36
CCOc1ccccc1CNC(=O)NC(C)(C)[C@H]1CCCCO1	ZINC000875136563	DG	On-Demand	Anodyne	HCN4	46	36
COc1ccccc1N1CCC(NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875136577	GD	On-Demand	Anodyne	HTR1A	71	42
COc1ccccc1N1CCC(NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875136577	GD	On-Demand	Anodyne	DRD2	62	44
COc1ccccc1N1CCC(NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875136577	GD	On-Demand	Anodyne	DRD4	32	43
COc1ccccc1N1CCC(NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875136577	GD	On-Demand	Anodyne	ADRA1D	69	42
COc1ccccc1N1CCC(NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875136577	GD	On-Demand	Anodyne	ADRA1A	60	42
COc1ccccc1N1CCC(NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875136577	GD	On-Demand	Anodyne	ADRA1B	56	42
COc1ccccc1N1CCC(NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875136577	GD	On-Demand	Anodyne	DRD3	64	43
COc1ccccc1N1CCC(NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875136577	GD	On-Demand	Anodyne	HTR7	47	39
COc1ccccc1N1CCC(NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875136581	GD	On-Demand	Anodyne	HTR1A	71	42
COc1ccccc1N1CCC(NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875136581	GD	On-Demand	Anodyne	DRD2	62	44
COc1ccccc1N1CCC(NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875136581	GD	On-Demand	Anodyne	DRD4	32	43
COc1ccccc1N1CCC(NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875136581	GD	On-Demand	Anodyne	ADRA1D	69	42
COc1ccccc1N1CCC(NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875136581	GD	On-Demand	Anodyne	ADRA1A	60	42
COc1ccccc1N1CCC(NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875136581	GD	On-Demand	Anodyne	ADRA1B	56	42
COc1ccccc1N1CCC(NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875136581	GD	On-Demand	Anodyne	DRD3	64	43
COc1ccccc1N1CCC(NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875136581	GD	On-Demand	Anodyne	HTR7	47	39
C[C@H](NC(=O)NC[C@H]1Cc2ccccc21)c1ccccc1O	ZINC000875136596	CG	On-Demand	Clean	MTNR1A	15	46
C[C@H](NC(=O)NC[C@H]1Cc2ccccc21)c1ccccc1O	ZINC000875136596	CG	On-Demand	Clean	MTNR1B	17	46
C[C@H](NC(=O)NC[C@@H]1Cc2ccccc21)c1ccccc1O	ZINC000875136598	CG	On-Demand	Clean	MTNR1A	15	46
C[C@H](NC(=O)NC[C@@H]1Cc2ccccc21)c1ccccc1O	ZINC000875136598	CG	On-Demand	Clean	MTNR1B	17	46
C[C@@H](NC(=O)NC[C@@H]1Cc2ccccc21)c1ccccc1O	ZINC000875136599	CG	On-Demand	Clean	MTNR1A	15	46
C[C@@H](NC(=O)NC[C@@H]1Cc2ccccc21)c1ccccc1O	ZINC000875136599	CG	On-Demand	Clean	MTNR1B	17	46
C[C@@H](NC(=O)NC[C@H]1Cc2ccccc21)c1ccccc1O	ZINC000875136600	CG	On-Demand	Clean	MTNR1A	15	46
C[C@@H](NC(=O)NC[C@H]1Cc2ccccc21)c1ccccc1O	ZINC000875136600	CG	On-Demand	Clean	MTNR1B	17	46
CC(=O)[C@H]1CCCN(C(=O)NCc2ccn(-c3ccccc3)n2)C1	ZINC000875136603	EE	On-Demand	Anodyne	SLC6A1	43	31
CC(=O)[C@H]1CCCN(C(=O)NCc2ccn(-c3ccccc3)n2)C1	ZINC000875136603	EE	On-Demand	Anodyne	DPP7	41	35
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccn(-c3ccccc3)n2)C1	ZINC000875136605	EE	On-Demand	Anodyne	SLC6A1	43	31
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccn(-c3ccccc3)n2)C1	ZINC000875136605	EE	On-Demand	Anodyne	DPP7	41	35
CC(=O)[C@@H]1CCCN(C(=O)NC[C@@H]2Cc3ccccc32)C1	ZINC000875136606	CE	On-Demand	Anodyne	MTNR1A	20	46
CC(=O)[C@@H]1CCCN(C(=O)NC[C@@H]2Cc3ccccc32)C1	ZINC000875136606	CE	On-Demand	Anodyne	MTNR1B	23	46
Cc1nnc(NNC(=O)N[C@H](C)c2ccccc2OCc2ccccc2)n1C	ZINC000875136619	GG	On-Demand	Reactive	PPIA	42	40
C[C@@H]1CN(C(=O)NCc2cccc(N3CCOC3=O)c2)Cc2ccccc21	ZINC000875136623	FG	On-Demand	Anodyne	NPSR1	25	40
CC(=O)[C@H]1CCCN(C(=O)NC[C@@H]2Cc3ccccc32)C1	ZINC000875136624	CE	On-Demand	Anodyne	MTNR1A	20	46
CC(=O)[C@H]1CCCN(C(=O)NC[C@@H]2Cc3ccccc32)C1	ZINC000875136624	CE	On-Demand	Anodyne	MTNR1B	23	46
CC(=O)[C@@H]1CCCN(C(=O)NC[C@H]2Cc3ccccc32)C1	ZINC000875136625	CE	On-Demand	Anodyne	MTNR1A	20	46
CC(=O)[C@@H]1CCCN(C(=O)NC[C@H]2Cc3ccccc32)C1	ZINC000875136625	CE	On-Demand	Anodyne	MTNR1B	23	46
CC(=O)[C@H]1CCCN(C(=O)NC[C@H]2Cc3ccccc32)C1	ZINC000875136626	CE	On-Demand	Anodyne	MTNR1A	20	46
CC(=O)[C@H]1CCCN(C(=O)NC[C@H]2Cc3ccccc32)C1	ZINC000875136626	CE	On-Demand	Anodyne	MTNR1B	23	46
CCOc1ccccc1CNC(=O)NN(C)C(=O)OC	ZINC000875136653	CD	On-Demand	Reactive	HCN1	50	33
CCOc1ccccc1CNC(=O)NN(C)C(=O)OC	ZINC000875136653	CD	On-Demand	Reactive	HCN4	42	32
CCOc1ccccc1CNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875136654	ED	On-Demand	Anodyne	SSTR5	50	35
CCOc1ccccc1CNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875136654	ED	On-Demand	Anodyne	CCR3	19	41
CCOc1ccccc1CNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875136654	ED	On-Demand	Anodyne	EPHX2	25	43
CCOc1ccccc1CNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875136654	ED	On-Demand	Anodyne	HCN1	66	38
CCOc1ccccc1CNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875136654	ED	On-Demand	Anodyne	HCN4	50	38
CCOc1ccccc1CNC(=O)NC[C@@H]1CCO[C@@H]1C(=O)OC	ZINC000875136656	ED	On-Demand	Anodyne	HCN1	48	32
CCOc1ccccc1CNC(=O)NC[C@@H]1CCO[C@@H]1C(=O)OC	ZINC000875136656	ED	On-Demand	Anodyne	HCN4	41	32
CCOc1ccccc1CNC(=O)N1CCCC[C@H]1CNC(=O)NC	ZINC000875136669	EE	On-Demand	Anodyne	HCRTR1	19	40
CCOc1ccccc1CNC(=O)N1CCCC[C@H]1CNC(=O)NC	ZINC000875136669	EE	On-Demand	Anodyne	HCN1	51	36
CCOc1ccccc1CNC(=O)N1CCCC[C@H]1CNC(=O)NC	ZINC000875136669	EE	On-Demand	Anodyne	HCN4	45	36
CCOc1ccccc1CNC(=O)N1CCCC[C@@H]1CNC(=O)NC	ZINC000875136670	EE	On-Demand	Anodyne	HCRTR1	19	40
CCOc1ccccc1CNC(=O)N1CCCC[C@@H]1CNC(=O)NC	ZINC000875136670	EE	On-Demand	Anodyne	HCN1	51	36
CCOc1ccccc1CNC(=O)N1CCCC[C@@H]1CNC(=O)NC	ZINC000875136670	EE	On-Demand	Anodyne	HCN4	45	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccn(-c2ccccc2)n1	ZINC000875136704	FE	On-Demand	Anodyne	SLC6A3	47	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccn(-c2ccccc2)n1	ZINC000875136705	FE	On-Demand	Anodyne	SLC6A3	47	41
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccccc1OCc1ccccc1	ZINC000875136736	FG	On-Demand	Anodyne	CAPN2	66	37
COc1ccccc1N1CCC(NC(=O)C(=O)N2CCC(C(C)=O)CC2)CC1	ZINC000875136737	GD	On-Demand	Anodyne	HTR1A	80	48
COc1ccccc1N1CCC(NC(=O)C(=O)N2CCC(C(C)=O)CC2)CC1	ZINC000875136737	GD	On-Demand	Anodyne	DRD2	67	45
COc1ccccc1N1CCC(NC(=O)C(=O)N2CCC(C(C)=O)CC2)CC1	ZINC000875136737	GD	On-Demand	Anodyne	DRD4	34	45
COc1ccccc1N1CCC(NC(=O)C(=O)N2CCC(C(C)=O)CC2)CC1	ZINC000875136737	GD	On-Demand	Anodyne	ADRA1D	77	43
COc1ccccc1N1CCC(NC(=O)C(=O)N2CCC(C(C)=O)CC2)CC1	ZINC000875136737	GD	On-Demand	Anodyne	HTR2A	20	40
COc1ccccc1N1CCC(NC(=O)C(=O)N2CCC(C(C)=O)CC2)CC1	ZINC000875136737	GD	On-Demand	Anodyne	ADRA1A	68	43
COc1ccccc1N1CCC(NC(=O)C(=O)N2CCC(C(C)=O)CC2)CC1	ZINC000875136737	GD	On-Demand	Anodyne	ADRA1B	61	43
COc1ccccc1N1CCC(NC(=O)C(=O)N2CCC(C(C)=O)CC2)CC1	ZINC000875136737	GD	On-Demand	Anodyne	DRD3	66	45
COc1ccccc1N1CCC(NC(=O)C(=O)N2CCC(C(C)=O)CC2)CC1	ZINC000875136737	GD	On-Demand	Anodyne	HTR7	50	40
COCC(C)(C)CCNC(=O)C(=O)NCCc1c[nH]c2cc(Cl)ccc12	ZINC000875136748	GF	On-Demand	Anodyne	NQO2	15	43
COCC(C)(C)CCNC(=O)C(=O)NCCc1c[nH]c2cc(Cl)ccc12	ZINC000875136748	GF	On-Demand	Anodyne	MTNR1A	16	47
CC(=O)C1CCN(C(=O)C(=O)NCCCc2cccc(Cl)c2)CC1	ZINC000875136755	FE	On-Demand	Anodyne	MTNR1A	21	40
CC(=O)C1CCN(C(=O)C(=O)NCCCc2cccc(Cl)c2)CC1	ZINC000875136755	FE	On-Demand	Anodyne	MTNR1B	22	40
CC(=O)C1CCN(C(=O)C(=O)NCCCc2cccc(Cl)c2)CC1	ZINC000875136755	FE	On-Demand	Anodyne	EPHX2	15	46
O=C(NCc1cccc(N2CCOC2=O)c1)N1CCc2nc(C3CC3)ncc2C1	ZINC000875136763	GF	On-Demand	Anodyne	MAPK1	15	42
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875136766	GD	On-Demand	Anodyne	HTR1A	96	49
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875136766	GD	On-Demand	Anodyne	DRD2	91	51
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875136766	GD	On-Demand	Anodyne	DRD1	15	42
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875136766	GD	On-Demand	Anodyne	DRD4	58	46
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875136766	GD	On-Demand	Anodyne	ADRA1D	98	43
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875136766	GD	On-Demand	Anodyne	HTR2A	25	42
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875136766	GD	On-Demand	Anodyne	ADRA1A	87	43
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875136766	GD	On-Demand	Anodyne	ADRA1B	71	41
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875136766	GD	On-Demand	Anodyne	DRD3	97	49
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875136766	GD	On-Demand	Anodyne	HTR7	56	41
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000875136766	GD	On-Demand	Anodyne	NPY1R	17	40
CCOc1ccccc1CNC(=O)N[C@H](CC)C[C@H](C)O	ZINC000875136807	CE	On-Demand	Anodyne	ANPEP	23	50
CCOc1ccccc1CNC(=O)N[C@H](CC)C[C@H](C)O	ZINC000875136807	CE	On-Demand	Anodyne	HCN1	49	35
CCOc1ccccc1CNC(=O)N[C@H](CC)C[C@H](C)O	ZINC000875136807	CE	On-Demand	Anodyne	HCN4	40	33
CCOc1ccccc1CNC(=O)N[C@H](CC)C[C@H](C)O	ZINC000875136807	CE	On-Demand	Anodyne	PDS	41	34
CCOc1ccccc1CNC(=O)N[C@@H](CC)C[C@H](C)O	ZINC000875136809	CE	On-Demand	Anodyne	ANPEP	23	50
CCOc1ccccc1CNC(=O)N[C@@H](CC)C[C@H](C)O	ZINC000875136809	CE	On-Demand	Anodyne	HCN1	49	35
CCOc1ccccc1CNC(=O)N[C@@H](CC)C[C@H](C)O	ZINC000875136809	CE	On-Demand	Anodyne	HCN4	40	33
CCOc1ccccc1CNC(=O)N[C@@H](CC)C[C@H](C)O	ZINC000875136809	CE	On-Demand	Anodyne	PDS	41	34
CCOc1ccccc1CNC(=O)N[C@@H](CC)C[C@@H](C)O	ZINC000875136810	CE	On-Demand	Anodyne	ANPEP	23	50
CCOc1ccccc1CNC(=O)N[C@@H](CC)C[C@@H](C)O	ZINC000875136810	CE	On-Demand	Anodyne	HCN1	49	35
CCOc1ccccc1CNC(=O)N[C@@H](CC)C[C@@H](C)O	ZINC000875136810	CE	On-Demand	Anodyne	HCN4	40	33
CCOc1ccccc1CNC(=O)N[C@@H](CC)C[C@@H](C)O	ZINC000875136810	CE	On-Demand	Anodyne	PDS	41	34
CCOc1ccccc1CNC(=O)N[C@H](CC)C[C@@H](C)O	ZINC000875136812	CE	On-Demand	Anodyne	ANPEP	23	50
CCOc1ccccc1CNC(=O)N[C@H](CC)C[C@@H](C)O	ZINC000875136812	CE	On-Demand	Anodyne	HCN1	49	35
CCOc1ccccc1CNC(=O)N[C@H](CC)C[C@@H](C)O	ZINC000875136812	CE	On-Demand	Anodyne	HCN4	40	33
CCOc1ccccc1CNC(=O)N[C@H](CC)C[C@@H](C)O	ZINC000875136812	CE	On-Demand	Anodyne	PDS	41	34
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@H]2CC23CCC3)CC1	ZINC000875136831	FD	On-Demand	Anodyne	HTR1A	93	46
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@H]2CC23CCC3)CC1	ZINC000875136831	FD	On-Demand	Anodyne	DRD2	77	46
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@H]2CC23CCC3)CC1	ZINC000875136831	FD	On-Demand	Anodyne	DRD4	38	44
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@H]2CC23CCC3)CC1	ZINC000875136831	FD	On-Demand	Anodyne	ADRA1D	88	43
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@H]2CC23CCC3)CC1	ZINC000875136831	FD	On-Demand	Anodyne	HTR2A	21	43
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@H]2CC23CCC3)CC1	ZINC000875136831	FD	On-Demand	Anodyne	ADRA1A	76	43
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@H]2CC23CCC3)CC1	ZINC000875136831	FD	On-Demand	Anodyne	ADRA1B	69	43
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@H]2CC23CCC3)CC1	ZINC000875136831	FD	On-Demand	Anodyne	DRD3	74	44
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@H]2CC23CCC3)CC1	ZINC000875136831	FD	On-Demand	Anodyne	HTR7	54	42
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@@H]2CC23CCC3)CC1	ZINC000875136833	FD	On-Demand	Anodyne	HTR1A	93	46
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@@H]2CC23CCC3)CC1	ZINC000875136833	FD	On-Demand	Anodyne	DRD2	77	46
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@@H]2CC23CCC3)CC1	ZINC000875136833	FD	On-Demand	Anodyne	DRD4	38	44
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@@H]2CC23CCC3)CC1	ZINC000875136833	FD	On-Demand	Anodyne	ADRA1D	88	43
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@@H]2CC23CCC3)CC1	ZINC000875136833	FD	On-Demand	Anodyne	HTR2A	21	43
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@@H]2CC23CCC3)CC1	ZINC000875136833	FD	On-Demand	Anodyne	ADRA1A	76	43
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@@H]2CC23CCC3)CC1	ZINC000875136833	FD	On-Demand	Anodyne	ADRA1B	69	43
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@@H]2CC23CCC3)CC1	ZINC000875136833	FD	On-Demand	Anodyne	DRD3	74	44
COc1ccccc1N1CCC(NC(=O)C(=O)N[C@@H]2CC23CCC3)CC1	ZINC000875136833	FD	On-Demand	Anodyne	HTR7	54	42
COCC(C)(C)CCNC(=O)C(=O)NCCCc1cccc(Cl)c1	ZINC000875136843	FF	On-Demand	Anodyne	MTNR1A	16	45
COCC(C)(C)CCNC(=O)C(=O)NCCCc1cccc(Cl)c1	ZINC000875136843	FF	On-Demand	Anodyne	MTNR1B	19	45
COCC(C)(C)CCNC(=O)C(=O)NCCCc1cccc(Cl)c1	ZINC000875136843	FF	On-Demand	Anodyne	CRTM	36	40
CCOc1ccccc1CNC(=O)N(C)OCC(F)(F)F	ZINC000875136848	DF	On-Demand	Anodyne	CARM1	18	42
CCOc1ccccc1CNC(=O)N(C)OCC(F)(F)F	ZINC000875136848	DF	On-Demand	Anodyne	KCNK3	19	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1Cc2ccccc21	ZINC000875136857	DE	On-Demand	Anodyne	SLC6A3	42	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1Cc2ccccc21	ZINC000875136857	DE	On-Demand	Anodyne	MTNR1A	17	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1Cc2ccccc21	ZINC000875136857	DE	On-Demand	Anodyne	MTNR1B	20	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1Cc2ccccc21	ZINC000875136858	DE	On-Demand	Anodyne	SLC6A3	42	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1Cc2ccccc21	ZINC000875136858	DE	On-Demand	Anodyne	MTNR1A	17	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1Cc2ccccc21	ZINC000875136858	DE	On-Demand	Anodyne	MTNR1B	20	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1Cc2ccccc21	ZINC000875136859	DE	On-Demand	Anodyne	SLC6A3	42	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1Cc2ccccc21	ZINC000875136859	DE	On-Demand	Anodyne	MTNR1A	17	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1Cc2ccccc21	ZINC000875136859	DE	On-Demand	Anodyne	MTNR1B	20	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1Cc2ccccc21	ZINC000875136860	DE	On-Demand	Anodyne	SLC6A3	42	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1Cc2ccccc21	ZINC000875136860	DE	On-Demand	Anodyne	MTNR1A	17	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1Cc2ccccc21	ZINC000875136860	DE	On-Demand	Anodyne	MTNR1B	20	41
CN(Cc1ccc2cc[nH]c2c1)C(=O)NC[C@@H]1Cc2ccccc21	ZINC000875136861	DH	On-Demand	Anodyne	MTNR1B	15	44
CN(Cc1ccc2cc[nH]c2c1)C(=O)NC[C@H]1Cc2ccccc21	ZINC000875136862	DH	On-Demand	Anodyne	MTNR1B	15	44
CCOc1ccccc1CNC(=O)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875136863	EH	On-Demand	Anodyne	HCN1	49	33
CCOc1ccccc1CNC(=O)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875136863	EH	On-Demand	Anodyne	HCN4	41	31
O=C(NCC[C@@H](O)C1CCCC1)NC[C@@H]1Cc2ccccc21	ZINC000875136864	DF	On-Demand	Anodyne	MTNR1B	15	43
O=C(NCC[C@@H](O)C1CCCC1)NC[C@H]1Cc2ccccc21	ZINC000875136865	DF	On-Demand	Anodyne	MTNR1B	15	43
O=C(NCC[C@H](O)C1CCCC1)NC[C@@H]1Cc2ccccc21	ZINC000875136866	DF	On-Demand	Anodyne	MTNR1B	15	43
O=C(NCC[C@H](O)C1CCCC1)NC[C@H]1Cc2ccccc21	ZINC000875136867	DF	On-Demand	Anodyne	MTNR1B	15	43
CCOc1ccccc1CNC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875136887	ED	On-Demand	Anodyne	MTNR1A	16	40
CCOc1ccccc1CNC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875136887	ED	On-Demand	Anodyne	EPHX2	33	49
CCOc1ccccc1CNC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875136887	ED	On-Demand	Anodyne	CACNA1G	36	42
CCOc1ccccc1CNC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875136887	ED	On-Demand	Anodyne	HCN1	51	34
CCOc1ccccc1CNC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875136887	ED	On-Demand	Anodyne	HCN4	43	34
CCOc1ccccc1CNC(=O)NN=c1cc[nH]cc1C	ZINC000875136896	DE	On-Demand	Reactive	HCN1	48	33
O=C(NCc1cccc(N2CCOC2=O)c1)N1CC(c2ccccc2)C1	ZINC000875136929	FF	On-Demand	Anodyne	NPSR1	27	42
CCN1CCC[C@@H](NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000875136932	EE	On-Demand	Anodyne	HRH2	24	40
CCN1CCC[C@@H](NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000875136932	EE	On-Demand	Anodyne	CCR3	27	40
CCN1CCC[C@@H](NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000875136932	EE	On-Demand	Anodyne	EPHX2	21	43
CCN1CCC[C@H](NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000875136933	EE	On-Demand	Anodyne	HRH2	24	40
CCN1CCC[C@H](NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000875136933	EE	On-Demand	Anodyne	CCR3	27	40
CCN1CCC[C@H](NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000875136933	EE	On-Demand	Anodyne	EPHX2	21	43
CCN1CCC[C@@H](NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000875136934	EE	On-Demand	Anodyne	HRH2	24	40
CCN1CCC[C@@H](NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000875136934	EE	On-Demand	Anodyne	CCR3	27	40
CCN1CCC[C@@H](NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000875136934	EE	On-Demand	Anodyne	EPHX2	21	43
CCN1CCC[C@H](NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000875136935	EE	On-Demand	Anodyne	HRH2	24	40
CCN1CCC[C@H](NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000875136935	EE	On-Demand	Anodyne	CCR3	27	40
CCN1CCC[C@H](NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000875136935	EE	On-Demand	Anodyne	EPHX2	21	43
CCN1CCC[C@@H](NC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875136955	FF	On-Demand	Mild	MCHR1	34	40
CCN1CCC[C@H](NC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875136956	FF	On-Demand	Mild	MCHR1	34	40
CCN1CCC[C@@H](NC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875136957	FF	On-Demand	Mild	MCHR1	34	40
CCN1CCC[C@H](NC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875136958	FF	On-Demand	Mild	MCHR1	34	40
CCOC(=O)N1CCC(C(=O)N2CCCc3cc(C)ccc32)CC1	ZINC000875136973	EG	On-Demand	Anodyne	GPR119	21	40
CN(C)C[C@@H]1CN(C(=O)NC[C@H]2Cc3ccccc32)C[C@H]1CN(C)C	ZINC000875137007	ED	On-Demand	Anodyne	MTNR1B	16	45
CN(C)C[C@@H]1CN(C(=O)NC[C@@H]2Cc3ccccc32)C[C@H]1CN(C)C	ZINC000875137008	ED	On-Demand	Anodyne	MTNR1B	16	45
CCOc1ccccc1CNC(=O)NNc1nnc(C)n1C	ZINC000875137020	DD	On-Demand	Reactive	HCN1	50	34
CCOc1ccccc1CNC(=O)NNc1nnc(C)n1C	ZINC000875137020	DD	On-Demand	Reactive	HCN4	40	32
CCOc1ccccc1CNC(=O)NCC[C@H](O)C1CCCC1	ZINC000875137021	DF	On-Demand	Anodyne	HCN1	53	37
CCOc1ccccc1CNC(=O)NCC[C@H](O)C1CCCC1	ZINC000875137021	DF	On-Demand	Anodyne	HCN4	46	37
CCOc1ccccc1CNC(=O)NCC[C@@H](O)C1CCCC1	ZINC000875137022	DF	On-Demand	Anodyne	HCN1	53	37
CCOc1ccccc1CNC(=O)NCC[C@@H](O)C1CCCC1	ZINC000875137022	DF	On-Demand	Anodyne	HCN4	46	37
CCOc1ccccc1CNC(=O)N1CC[C@@]2(CC(C(=O)OC)=NO2)C1	ZINC000875137023	FD	On-Demand	Anodyne	HCN1	50	34
CCOc1ccccc1CNC(=O)N1CC[C@@]2(CC(C(=O)OC)=NO2)C1	ZINC000875137023	FD	On-Demand	Anodyne	HCN4	41	32
CCOc1ccccc1CNC(=O)N1CC[C@]2(CC(C(=O)OC)=NO2)C1	ZINC000875137024	FD	On-Demand	Anodyne	HCN1	50	34
CCOc1ccccc1CNC(=O)N1CC[C@]2(CC(C(=O)OC)=NO2)C1	ZINC000875137024	FD	On-Demand	Anodyne	HCN4	41	32
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NC[C@@H]2Cc3ccccc32)[C@H](O)C1	ZINC000875137036	GD	On-Demand	Anodyne	GPR119	32	40
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NC[C@H]2Cc3ccccc32)[C@H](O)C1	ZINC000875137037	GD	On-Demand	Anodyne	GPR119	32	40
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NC[C@H]2Cc3ccccc32)[C@@H](O)C1	ZINC000875137038	GD	On-Demand	Anodyne	GPR119	32	40
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NC[C@@H]2Cc3ccccc32)[C@@H](O)C1	ZINC000875137039	GD	On-Demand	Anodyne	GPR119	32	40
CCOc1ccccc1CNC(=O)NNc1cccc(C)n1	ZINC000875137067	DF	On-Demand	Reactive	GRM5	17	48
CCOc1ccccc1CNC(=O)NNc1cccc(C)n1	ZINC000875137067	DF	On-Demand	Reactive	HCN1	46	31
CCOc1ccccc1CNC(=O)N(CCOC)C1CCOCC1	ZINC000875137081	EE	On-Demand	Anodyne	MBTPS1	40	33
CCOc1ccccc1CNC(=O)N(CCOC)C1CCOCC1	ZINC000875137081	EE	On-Demand	Anodyne	HCN1	48	35
CCOc1ccccc1CNC(=O)N(CCOC)C1CCOCC1	ZINC000875137081	EE	On-Demand	Anodyne	HCN4	41	32
CCCCCCCNC(=O)C(=O)NCc1cccnc1N1CCN(C)CC1	ZINC000875137088	GD	On-Demand	Mild	ASAH1	80	36
CC(=O)Nc1cccc2c1CN(C(=O)NC[C@@H]1Cc3ccccc31)CC2	ZINC000875137101	EG	On-Demand	Anodyne	MTNR1A	18	50
CC(=O)Nc1cccc2c1CN(C(=O)NC[C@@H]1Cc3ccccc31)CC2	ZINC000875137101	EG	On-Demand	Anodyne	MTNR1B	21	50
CC(=O)Nc1cccc2c1CN(C(=O)NC[C@H]1Cc3ccccc31)CC2	ZINC000875137102	EG	On-Demand	Anodyne	MTNR1A	18	50
CC(=O)Nc1cccc2c1CN(C(=O)NC[C@H]1Cc3ccccc31)CC2	ZINC000875137102	EG	On-Demand	Anodyne	MTNR1B	21	50
Cc1nnc(NNC(=O)NC[C@H]2Cc3ccccc32)n1C	ZINC000875137103	CD	On-Demand	Reactive	MTNR1B	15	42
Cc1nnc(NNC(=O)NC[C@@H]2Cc3ccccc32)n1C	ZINC000875137104	CD	On-Demand	Reactive	MTNR1B	15	42
O=C(NCc1ccn(-c2ccccc2)n1)N1CCC(Cc2nccs2)CC1	ZINC000875137132	GG	On-Demand	Anodyne	GRIN2B	22	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2cccnc2N2CCN(C)CC2)C1	ZINC000875137168	GC	On-Demand	Anodyne	SCN10A	15	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2cccnc2N2CCN(C)CC2)C1	ZINC000875137169	GC	On-Demand	Anodyne	SCN10A	15	40
CCOc1ccccc1CNC(=O)N1CC(O)(C(=O)OC)C1	ZINC000875137192	DC	On-Demand	Anodyne	HCN1	57	37
CCOc1ccccc1CNC(=O)N1CC(O)(C(=O)OC)C1	ZINC000875137192	DC	On-Demand	Anodyne	HCN4	44	34
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H]1Cc2ccccc21	ZINC000875137195	CE	On-Demand	Anodyne	MTNR1A	19	45
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H]1Cc2ccccc21	ZINC000875137195	CE	On-Demand	Anodyne	MTNR1B	20	45
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H]1Cc2ccccc21	ZINC000875137196	CE	On-Demand	Anodyne	MTNR1A	19	45
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H]1Cc2ccccc21	ZINC000875137196	CE	On-Demand	Anodyne	MTNR1B	20	45
CCOc1ccccc1CNC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875137199	EH	On-Demand	Anodyne	EPHX2	29	54
CCOc1ccccc1CNC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875137199	EH	On-Demand	Anodyne	SCD1	18	41
CCOc1ccccc1CNC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875137199	EH	On-Demand	Anodyne	HCN1	54	38
CCOc1ccccc1CNC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875137199	EH	On-Demand	Anodyne	HCN4	47	38
CCOc1ccccc1CNC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875137200	EH	On-Demand	Anodyne	EPHX2	29	54
CCOc1ccccc1CNC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875137200	EH	On-Demand	Anodyne	SCD1	18	41
CCOc1ccccc1CNC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875137200	EH	On-Demand	Anodyne	HCN1	54	38
CCOc1ccccc1CNC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875137200	EH	On-Demand	Anodyne	HCN4	47	38
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1Cc2ccccc21	ZINC000875137210	CD	On-Demand	Anodyne	MTNR1A	16	48
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1Cc2ccccc21	ZINC000875137210	CD	On-Demand	Anodyne	MTNR1B	17	48
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1Cc2ccccc21	ZINC000875137211	CD	On-Demand	Anodyne	MTNR1A	16	48
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1Cc2ccccc21	ZINC000875137211	CD	On-Demand	Anodyne	MTNR1B	17	48
CC(=O)C1CCN(C(=O)NC[C@@H]2Cc3ccccc32)CC1	ZINC000875137240	CE	On-Demand	Anodyne	MTNR1A	20	50
CC(=O)C1CCN(C(=O)NC[C@@H]2Cc3ccccc32)CC1	ZINC000875137240	CE	On-Demand	Anodyne	MTNR1B	23	50
CC(=O)C1CCN(C(=O)NC[C@H]2Cc3ccccc32)CC1	ZINC000875137241	CE	On-Demand	Anodyne	MTNR1A	20	50
CC(=O)C1CCN(C(=O)NC[C@H]2Cc3ccccc32)CC1	ZINC000875137241	CE	On-Demand	Anodyne	MTNR1B	23	50
CN1CCN(C2CCN(C(=O)NC[C@@H]3Cc4ccccc43)CC2)CC1	ZINC000875137253	ED	On-Demand	Anodyne	MTNR1B	15	44
CN1CCN(C2CCN(C(=O)NC[C@@H]3Cc4ccccc43)CC2)CC1	ZINC000875137253	ED	On-Demand	Anodyne	L3MBTL3	76	43
CN1CCN(C2CCN(C(=O)NC[C@H]3Cc4ccccc43)CC2)CC1	ZINC000875137254	ED	On-Demand	Anodyne	MTNR1B	15	44
CN1CCN(C2CCN(C(=O)NC[C@H]3Cc4ccccc43)CC2)CC1	ZINC000875137254	ED	On-Demand	Anodyne	L3MBTL3	76	43
CC(=O)C1CCN(C(=O)C(=O)NCc2cccnc2N2CCN(C)CC2)CC1	ZINC000875137255	GC	On-Demand	Anodyne	SCN10A	16	40
O=C(NCc1ccn(-c2ccccc2)n1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875137274	FH	On-Demand	Anodyne	EPHX2	23	42
O=C(NCc1ccn(-c2ccccc2)n1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875137275	FH	On-Demand	Anodyne	EPHX2	23	42
COC(=O)C1(O)CN(C(=O)NC[C@H]2Cc3ccccc32)C1	ZINC000875137283	CC	On-Demand	Anodyne	MTNR1A	18	44
COC(=O)C1(O)CN(C(=O)NC[C@H]2Cc3ccccc32)C1	ZINC000875137283	CC	On-Demand	Anodyne	MTNR1B	23	44
COC(=O)C1(O)CN(C(=O)NC[C@@H]2Cc3ccccc32)C1	ZINC000875137284	CC	On-Demand	Anodyne	MTNR1A	18	44
COC(=O)C1(O)CN(C(=O)NC[C@@H]2Cc3ccccc32)C1	ZINC000875137284	CC	On-Demand	Anodyne	MTNR1B	23	44
CCOc1ccccc1CNC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875137308	EF	On-Demand	Anodyne	HCN1	49	36
CCOc1ccccc1CNC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875137308	EF	On-Demand	Anodyne	HCN4	44	36
C[C@@H](Cc1ccccc1F)NC(=O)N1CCCCCCNC(=O)CC1	ZINC000875137321	EF	On-Demand	Anodyne	Q9N6S8_PLAFA	17	40
C[C@H](Cc1ccccc1F)NC(=O)N1CCCCCCNC(=O)CC1	ZINC000875137322	EF	On-Demand	Anodyne	Q9N6S8_PLAFA	17	40
C[C@@H](Cc1ccccc1F)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875137331	DF	On-Demand	Anodyne	SSTR2	42	34
C[C@@H](Cc1ccccc1F)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875137331	DF	On-Demand	Anodyne	CCR1	22	42
C[C@@H](Cc1ccccc1F)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875137331	DF	On-Demand	Anodyne	DPP4	20	45
C[C@@H](Cc1ccccc1F)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875137331	DF	On-Demand	Anodyne	REN	16	44
C[C@@H](Cc1ccccc1F)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875137331	DF	On-Demand	Anodyne	BIRC2	48	42
C[C@H](Cc1ccccc1F)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875137332	DF	On-Demand	Anodyne	SSTR2	42	34
C[C@H](Cc1ccccc1F)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875137332	DF	On-Demand	Anodyne	CCR1	22	42
C[C@H](Cc1ccccc1F)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875137332	DF	On-Demand	Anodyne	DPP4	20	45
C[C@H](Cc1ccccc1F)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875137332	DF	On-Demand	Anodyne	REN	16	44
C[C@H](Cc1ccccc1F)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875137332	DF	On-Demand	Anodyne	BIRC2	48	42
C[C@H](Cc1ccccc1F)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875137333	DF	On-Demand	Anodyne	SSTR2	42	34
C[C@H](Cc1ccccc1F)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875137333	DF	On-Demand	Anodyne	CCR1	22	42
C[C@H](Cc1ccccc1F)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875137333	DF	On-Demand	Anodyne	DPP4	20	45
C[C@H](Cc1ccccc1F)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875137333	DF	On-Demand	Anodyne	REN	16	44
C[C@H](Cc1ccccc1F)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875137333	DF	On-Demand	Anodyne	BIRC2	48	42
C[C@@H](Cc1ccccc1F)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875137334	DF	On-Demand	Anodyne	SSTR2	42	34
C[C@@H](Cc1ccccc1F)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875137334	DF	On-Demand	Anodyne	CCR1	22	42
C[C@@H](Cc1ccccc1F)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875137334	DF	On-Demand	Anodyne	DPP4	20	45
C[C@@H](Cc1ccccc1F)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875137334	DF	On-Demand	Anodyne	REN	16	44
C[C@@H](Cc1ccccc1F)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875137334	DF	On-Demand	Anodyne	BIRC2	48	42
CC(=O)Nc1ccc(CCNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875137346	FC	On-Demand	Anodyne	NPY2R	23	43
CC(=O)Nc1ccc(CCNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875137347	FC	On-Demand	Anodyne	NPY2R	23	43
CCOc1ccccc1CNC(=O)N1CCC(CO)(CO)CC1	ZINC000875137350	DD	On-Demand	Anodyne	EPHX2	17	43
CCOc1ccccc1CNC(=O)N1CCC(CO)(CO)CC1	ZINC000875137350	DD	On-Demand	Anodyne	HCN1	76	41
CCOc1ccccc1CNC(=O)N1CCC(CO)(CO)CC1	ZINC000875137350	DD	On-Demand	Anodyne	HCN4	56	38
CN1CCN(C2CCN(C(=O)C(=O)NCCc3ccc(F)c(F)c3)CC2)CC1	ZINC000875137376	GC	On-Demand	Anodyne	L3MBTL3	73	39
CCOc1ccccc1CNC(=O)N1CC[C@@H](C(F)(F)F)O[C@H](C)C1	ZINC000875137378	FG	On-Demand	Anodyne	EPHX2	17	49
CCOc1ccccc1CNC(=O)N1CC[C@@H](C(F)(F)F)O[C@H](C)C1	ZINC000875137378	FG	On-Demand	Anodyne	HCN1	51	34
CCOc1ccccc1CNC(=O)N1CC[C@@H](C(F)(F)F)O[C@H](C)C1	ZINC000875137378	FG	On-Demand	Anodyne	HCN4	44	34
CCOc1ccccc1CNC(=O)N1CC[C@H](C(F)(F)F)O[C@H](C)C1	ZINC000875137379	FG	On-Demand	Anodyne	EPHX2	17	49
CCOc1ccccc1CNC(=O)N1CC[C@H](C(F)(F)F)O[C@H](C)C1	ZINC000875137379	FG	On-Demand	Anodyne	HCN1	51	34
CCOc1ccccc1CNC(=O)N1CC[C@H](C(F)(F)F)O[C@H](C)C1	ZINC000875137379	FG	On-Demand	Anodyne	HCN4	44	34
CCOc1ccccc1CNC(=O)N1CC[C@H](C(F)(F)F)O[C@@H](C)C1	ZINC000875137380	FG	On-Demand	Anodyne	EPHX2	17	49
CCOc1ccccc1CNC(=O)N1CC[C@H](C(F)(F)F)O[C@@H](C)C1	ZINC000875137380	FG	On-Demand	Anodyne	HCN1	51	34
CCOc1ccccc1CNC(=O)N1CC[C@H](C(F)(F)F)O[C@@H](C)C1	ZINC000875137380	FG	On-Demand	Anodyne	HCN4	44	34
CCOc1ccccc1CNC(=O)N1CC[C@@H](C(F)(F)F)O[C@@H](C)C1	ZINC000875137381	FG	On-Demand	Anodyne	EPHX2	17	49
CCOc1ccccc1CNC(=O)N1CC[C@@H](C(F)(F)F)O[C@@H](C)C1	ZINC000875137381	FG	On-Demand	Anodyne	HCN1	51	34
CCOc1ccccc1CNC(=O)N1CC[C@@H](C(F)(F)F)O[C@@H](C)C1	ZINC000875137381	FG	On-Demand	Anodyne	HCN4	44	34
O=C(NC[C@@H]1Cc2ccccc21)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875137406	FH	On-Demand	Anodyne	SMO	44	52
O=C(NC[C@@H]1Cc2ccccc21)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875137406	FH	On-Demand	Anodyne	ETHR	63	45
O=C(NC[C@H]1Cc2ccccc21)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875137407	FH	On-Demand	Anodyne	SMO	44	52
O=C(NC[C@H]1Cc2ccccc21)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875137407	FH	On-Demand	Anodyne	ETHR	63	45
C[C@@H](CN(C)C(=O)NC[C@H]1Cc2ccccc21)NC(=O)OC(C)(C)C	ZINC000875137450	EF	On-Demand	Anodyne	MTNR1B	15	40
C[C@@H](CN(C)C(=O)NC[C@@H]1Cc2ccccc21)NC(=O)OC(C)(C)C	ZINC000875137453	EF	On-Demand	Anodyne	MTNR1B	15	40
CC(=O)N(C)c1ccc(CNC(=O)NC[C@@H]2Cc3ccccc32)cc1	ZINC000875137462	EF	On-Demand	Anodyne	MTNR1A	18	48
CC(=O)N(C)c1ccc(CNC(=O)NC[C@@H]2Cc3ccccc32)cc1	ZINC000875137462	EF	On-Demand	Anodyne	MTNR1B	21	48
CC(=O)N(C)c1ccc(CNC(=O)NC[C@H]2Cc3ccccc32)cc1	ZINC000875137463	EF	On-Demand	Anodyne	MTNR1A	18	48
CC(=O)N(C)c1ccc(CNC(=O)NC[C@H]2Cc3ccccc32)cc1	ZINC000875137463	EF	On-Demand	Anodyne	MTNR1B	21	48
COc1cccc([C@H](O)C2CCN(C(=O)NC[C@H]3Cc4ccccc43)CC2)c1	ZINC000875137491	GG	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@H](O)C2CCN(C(=O)NC[C@H]3Cc4ccccc43)CC2)c1	ZINC000875137491	GG	On-Demand	Anodyne	MTNR1A	43	46
COc1cccc([C@H](O)C2CCN(C(=O)NC[C@H]3Cc4ccccc43)CC2)c1	ZINC000875137491	GG	On-Demand	Anodyne	MTNR1B	53	46
COc1cccc([C@H](O)C2CCN(C(=O)NC[C@@H]3Cc4ccccc43)CC2)c1	ZINC000875137493	GG	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@H](O)C2CCN(C(=O)NC[C@@H]3Cc4ccccc43)CC2)c1	ZINC000875137493	GG	On-Demand	Anodyne	MTNR1A	43	46
COc1cccc([C@H](O)C2CCN(C(=O)NC[C@@H]3Cc4ccccc43)CC2)c1	ZINC000875137493	GG	On-Demand	Anodyne	MTNR1B	53	46
CCOc1ccccc1CNC(=O)N1CCN(C)C(C)(C)CC1	ZINC000875137495	DF	On-Demand	Anodyne	HCN1	66	42
CCOc1ccccc1CNC(=O)N1CCN(C)C(C)(C)CC1	ZINC000875137495	DF	On-Demand	Anodyne	HCN4	47	36
CCOc1ccccc1CNC(=O)N(CCOC)CC1CCN(C)CC1	ZINC000875137515	FF	On-Demand	Anodyne	HCN1	61	38
CCOc1ccccc1CNC(=O)N(CCOC)CC1CCN(C)CC1	ZINC000875137515	FF	On-Demand	Anodyne	HCN4	43	33
CCOc1ccccc1CNC(=O)N(CCOC)CC1CCN(C)CC1	ZINC000875137515	FF	On-Demand	Anodyne	ACKR3	62	32
C[C@H](NC(=O)C(=O)NCCc1ccc(F)c(F)c1)c1ccnn1C	ZINC000875137565	ED	On-Demand	Anodyne	ABCC1	46	33
CCOc1ccccc1CNC(=O)N1CC[C@]2(C(=O)OC)CCC[C@H]12	ZINC000875137574	EF	On-Demand	Anodyne	HCN1	63	37
CCOc1ccccc1CNC(=O)N1CC[C@]2(C(=O)OC)CCC[C@H]12	ZINC000875137574	EF	On-Demand	Anodyne	HCN4	56	37
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H](C)Cc1ccccc1F	ZINC000875137591	FF	On-Demand	Anodyne	ACKR3	49	32
COCCN(CC1CCN(C)CC1)C(=O)N[C@H](C)Cc1ccccc1F	ZINC000875137592	FF	On-Demand	Anodyne	ACKR3	49	32
CCOc1ccccc1CNC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875137624	EF	On-Demand	Anodyne	EPHX2	24	51
CCOc1ccccc1CNC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875137624	EF	On-Demand	Anodyne	HCN1	50	33
CCOc1ccccc1CNC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875137624	EF	On-Demand	Anodyne	HCN4	42	32
CCOc1ccccc1CNC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875137625	EF	On-Demand	Anodyne	EPHX2	24	51
CCOc1ccccc1CNC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875137625	EF	On-Demand	Anodyne	HCN1	50	33
CCOc1ccccc1CNC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875137625	EF	On-Demand	Anodyne	HCN4	42	32
C[C@@H](Cc1ccccc1F)NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875137655	EG	On-Demand	Anodyne	CACNA1H	47	34
C[C@H](Cc1ccccc1F)NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875137656	EG	On-Demand	Anodyne	CACNA1H	47	34
C[C@@H](Cc1ccccc1F)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875137671	DF	On-Demand	Anodyne	CCR1	27	45
C[C@@H](Cc1ccccc1F)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875137671	DF	On-Demand	Anodyne	DPP4	18	44
C[C@@H](Cc1ccccc1F)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875137671	DF	On-Demand	Anodyne	BIRC2	38	41
C[C@@H](Cc1ccccc1F)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875137672	DF	On-Demand	Anodyne	CCR1	27	45
C[C@@H](Cc1ccccc1F)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875137672	DF	On-Demand	Anodyne	DPP4	18	44
C[C@@H](Cc1ccccc1F)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875137672	DF	On-Demand	Anodyne	BIRC2	38	41
C[C@H](Cc1ccccc1F)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875137673	DF	On-Demand	Anodyne	CCR1	27	45
C[C@H](Cc1ccccc1F)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875137673	DF	On-Demand	Anodyne	DPP4	18	44
C[C@H](Cc1ccccc1F)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875137673	DF	On-Demand	Anodyne	BIRC2	38	41
C[C@H](Cc1ccccc1F)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875137674	DF	On-Demand	Anodyne	CCR1	27	45
C[C@H](Cc1ccccc1F)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875137674	DF	On-Demand	Anodyne	DPP4	18	44
C[C@H](Cc1ccccc1F)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875137674	DF	On-Demand	Anodyne	BIRC2	38	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2ccc(F)c(F)c2)C1	ZINC000875137718	ED	On-Demand	Anodyne	DPP7	43	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2ccc(F)c(F)c2)C1	ZINC000875137718	ED	On-Demand	Anodyne	GPBAR1	24	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2ccc(F)c(F)c2)C1	ZINC000875137719	ED	On-Demand	Anodyne	DPP7	43	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2ccc(F)c(F)c2)C1	ZINC000875137719	ED	On-Demand	Anodyne	GPBAR1	24	42
CCOc1ccccc1CNC(=O)NC1(C)CC(F)(F)C1	ZINC000875137754	CG	On-Demand	Anodyne	HCN1	52	35
CCOc1ccccc1CNC(=O)NC1(C)CC(F)(F)C1	ZINC000875137754	CG	On-Demand	Anodyne	HCN4	43	34
CCOc1ccccc1CNC(=O)NCCN1CCOC[C@@H]1CC	ZINC000875137755	ED	On-Demand	Anodyne	HCN1	52	36
CCOc1ccccc1CNC(=O)NCCN1CCOC[C@@H]1CC	ZINC000875137755	ED	On-Demand	Anodyne	HCN4	43	32
CCOc1ccccc1CNC(=O)NCCN1CCOC[C@H]1CC	ZINC000875137756	ED	On-Demand	Anodyne	HCN1	52	36
CCOc1ccccc1CNC(=O)NCCN1CCOC[C@H]1CC	ZINC000875137756	ED	On-Demand	Anodyne	HCN4	43	32
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)COc1cccc(C)c1	ZINC000875137769	DF	On-Demand	Anodyne	PDS	76	46
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)COc1cccc(C)c1	ZINC000875137772	DF	On-Demand	Anodyne	PDS	76	46
CC(=O)Nc1ccc(CCNC(=O)C(=O)NCC2(OC(C)C)CCC2)cc1	ZINC000875137773	GD	On-Demand	Anodyne	ADRB3	17	40
O=C(NCCc1ccc(F)c(F)c1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875137777	GE	On-Demand	Anodyne	F2	34	40
O=C(NCCc1ccc(F)c(F)c1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875137778	GE	On-Demand	Anodyne	F2	34	40
O=C(NCCc1ccc(F)c(F)c1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875137779	GE	On-Demand	Anodyne	F2	34	40
O=C(NCCc1ccc(F)c(F)c1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875137780	GE	On-Demand	Anodyne	F2	34	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)COc1cccc(C)c1	ZINC000875137782	EE	On-Demand	Anodyne	SLC6A4	20	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)COc1cccc(C)c1	ZINC000875137782	EE	On-Demand	Anodyne	SLC6A3	44	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)COc1cccc(C)c1	ZINC000875137783	EE	On-Demand	Anodyne	SLC6A4	20	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)COc1cccc(C)c1	ZINC000875137783	EE	On-Demand	Anodyne	SLC6A3	44	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)COc1cccc(C)c1	ZINC000875137784	EE	On-Demand	Anodyne	SLC6A4	20	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)COc1cccc(C)c1	ZINC000875137784	EE	On-Demand	Anodyne	SLC6A3	44	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)COc1cccc(C)c1	ZINC000875137785	EE	On-Demand	Anodyne	SLC6A4	20	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)COc1cccc(C)c1	ZINC000875137785	EE	On-Demand	Anodyne	SLC6A3	44	42
O=C(NCCOCC1CC1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875137831	ED	On-Demand	Anodyne	OXTR	42	35
O=C(NCCOCC1CC1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875137832	ED	On-Demand	Anodyne	OXTR	42	35
C[C@@H](Cc1cccc(O)c1)NC(=O)N[C@H](C)c1ccnn1C	ZINC000875137834	DE	On-Demand	Anodyne	CTSV	49	37
C[C@@H](Cc1cccc(O)c1)NC(=O)N[C@@H](C)c1ccnn1C	ZINC000875137835	DE	On-Demand	Anodyne	CTSV	49	37
C[C@H](Cc1ccccc1F)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875137890	EH	On-Demand	Anodyne	CCR1	17	41
C[C@H](Cc1ccccc1F)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875137890	EH	On-Demand	Anodyne	DPP4	15	41
C[C@H](Cc1ccccc1F)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875137890	EH	On-Demand	Anodyne	SCD1	15	41
C[C@H](Cc1ccccc1F)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875137890	EH	On-Demand	Anodyne	BIRC2	30	42
C[C@@H](Cc1ccccc1F)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875137897	EH	On-Demand	Anodyne	CCR1	17	41
C[C@@H](Cc1ccccc1F)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875137897	EH	On-Demand	Anodyne	DPP4	15	41
C[C@@H](Cc1ccccc1F)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875137897	EH	On-Demand	Anodyne	SCD1	15	41
C[C@@H](Cc1ccccc1F)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875137897	EH	On-Demand	Anodyne	BIRC2	30	42
C[C@H](Cc1ccccc1F)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875137899	EH	On-Demand	Anodyne	CCR1	17	41
C[C@H](Cc1ccccc1F)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875137899	EH	On-Demand	Anodyne	DPP4	15	41
C[C@H](Cc1ccccc1F)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875137899	EH	On-Demand	Anodyne	SCD1	15	41
C[C@H](Cc1ccccc1F)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875137899	EH	On-Demand	Anodyne	BIRC2	30	42
C[C@@H](Cc1ccccc1F)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875137901	EH	On-Demand	Anodyne	CCR1	17	41
C[C@@H](Cc1ccccc1F)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875137901	EH	On-Demand	Anodyne	DPP4	15	41
C[C@@H](Cc1ccccc1F)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875137901	EH	On-Demand	Anodyne	SCD1	15	41
C[C@@H](Cc1ccccc1F)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875137901	EH	On-Demand	Anodyne	BIRC2	30	42
C[C@@H](Cc1cccc(O)c1)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875137910	DD	On-Demand	Anodyne	OPRM1	22	41
C[C@@H](Cc1cccc(O)c1)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875137910	DD	On-Demand	Anodyne	OPRD1	19	41
C[C@@H](Cc1cccc(O)c1)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875137910	DD	On-Demand	Anodyne	OPRK1	15	41
C[C@@H](Cc1cccc(O)c1)NC(=O)NC(c1ccnn1C)c1ccnn1C	ZINC000875137930	FD	On-Demand	Anodyne	CTSV	47	37
CCOc1ccccc1CNC(=O)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875137936	FD	On-Demand	Anodyne	HCN1	50	34
CCOc1ccccc1CNC(=O)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875137936	FD	On-Demand	Anodyne	HCN4	42	32
CCOc1ccccc1CNC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875137948	DF	On-Demand	Anodyne	AMY2	42	29
CCOc1ccccc1CNC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875137948	DF	On-Demand	Anodyne	EPHX2	18	50
CCOc1ccccc1CNC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875137948	DF	On-Demand	Anodyne	HCN1	54	37
CCOc1ccccc1CNC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875137948	DF	On-Demand	Anodyne	HCN4	47	36
CCOc1ccccc1CNC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875137949	DF	On-Demand	Anodyne	AMY2	42	29
CCOc1ccccc1CNC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875137949	DF	On-Demand	Anodyne	EPHX2	18	50
CCOc1ccccc1CNC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875137949	DF	On-Demand	Anodyne	HCN1	54	37
CCOc1ccccc1CNC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875137949	DF	On-Demand	Anodyne	HCN4	47	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1ccccc1F	ZINC000875137967	EE	On-Demand	Anodyne	SLC6A4	26	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1ccccc1F	ZINC000875137967	EE	On-Demand	Anodyne	SLC6A3	56	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1ccccc1F	ZINC000875137968	EE	On-Demand	Anodyne	SLC6A4	26	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1ccccc1F	ZINC000875137968	EE	On-Demand	Anodyne	SLC6A3	56	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1ccccc1F	ZINC000875137969	EE	On-Demand	Anodyne	SLC6A4	26	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1ccccc1F	ZINC000875137969	EE	On-Demand	Anodyne	SLC6A3	56	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1ccccc1F	ZINC000875137970	EE	On-Demand	Anodyne	SLC6A4	26	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1ccccc1F	ZINC000875137970	EE	On-Demand	Anodyne	SLC6A3	56	40
COC(=O)N(C)NC(=O)N[C@H](C)COc1cccc(C)c1	ZINC000875137988	CD	On-Demand	Reactive	PDS	49	41
COC(=O)N(C)NC(=O)N[C@@H](C)COc1cccc(C)c1	ZINC000875137989	CD	On-Demand	Reactive	PDS	49	41
CCOc1ccccc1CNC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875137990	CD	On-Demand	Anodyne	HCN1	52	34
CCOc1ccccc1CNC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875137990	CD	On-Demand	Anodyne	HCN4	44	33
O=C(CNC(=O)N1CC[C@@H]2CSC[C@@H]2C1)Nc1ccc(Cl)cc1	ZINC000875138021	FF	On-Demand	Anodyne	EPHX2	28	41
O=C(CNC(=O)N1CC[C@H]2CSC[C@H]2C1)Nc1ccc(Cl)cc1	ZINC000875138022	FF	On-Demand	Anodyne	EPHX2	28	41
O=C(CNC(=O)N1CC[C@H]2CSC[C@@H]2C1)Nc1ccc(Cl)cc1	ZINC000875138023	FF	On-Demand	Anodyne	EPHX2	28	41
O=C(CNC(=O)N1CC[C@@H]2CSC[C@H]2C1)Nc1ccc(Cl)cc1	ZINC000875138024	FF	On-Demand	Anodyne	EPHX2	28	41
O=C(NCCc1ccc([N+](=O)[O-])cc1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875138034	EE	On-Demand	Bother	KCNJ1	27	40
O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875138049	FF	On-Demand	Bother	LUXR	16	40
O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875138049	FF	On-Demand	Bother	KCNJ1	29	41
O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875138050	FF	On-Demand	Bother	LUXR	16	40
O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875138050	FF	On-Demand	Bother	KCNJ1	29	41
C[C@@H](Cc1cccc(O)c1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875138066	DF	On-Demand	Anodyne	REN	16	40
C[C@@H](Cc1cccc(O)c1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875138069	DF	On-Demand	Anodyne	REN	16	40
COc1ccc(N2CCN(C(=O)C(=O)NCCOCC3CC3)CC2)c(OC)c1	ZINC000875138074	GC	On-Demand	Clean	DRD2	31	41
COc1ccc(N2CCN(C(=O)C(=O)NCCOCC3CC3)CC2)c(OC)c1	ZINC000875138074	GC	On-Demand	Clean	DRD4	42	33
COc1ccc(N2CCN(C(=O)C(=O)NCCOCC3CC3)CC2)c(OC)c1	ZINC000875138074	GC	On-Demand	Clean	DRD3	48	40
COc1ccc(N2CCN(C(=O)C(=O)NCCOCC3CC3)CC2)c(OC)c1	ZINC000875138074	GC	On-Demand	Clean	MTNR1B	15	40
CCOc1ccccc1CNC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875138087	EE	On-Demand	Anodyne	SLC6A4	34	44
CCOc1ccccc1CNC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875138087	EE	On-Demand	Anodyne	SLC6A3	65	44
CCOc1ccccc1CNC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875138087	EE	On-Demand	Anodyne	HCN1	49	36
CCOc1ccccc1CNC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875138087	EE	On-Demand	Anodyne	HCN4	43	36
CCOc1ccccc1CNC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875138089	EE	On-Demand	Anodyne	SLC6A4	34	44
CCOc1ccccc1CNC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875138089	EE	On-Demand	Anodyne	SLC6A3	65	44
CCOc1ccccc1CNC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875138089	EE	On-Demand	Anodyne	HCN1	49	36
CCOc1ccccc1CNC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875138089	EE	On-Demand	Anodyne	HCN4	43	36
CC(=O)C1CCN(C(=O)NCC(=O)Nc2ccc(Cl)cc2)CC1	ZINC000875138098	EE	On-Demand	Anodyne	CCR1	42	39
CC(=O)C1CCN(C(=O)NCC(=O)Nc2ccc(Cl)cc2)CC1	ZINC000875138098	EE	On-Demand	Anodyne	CCR2	17	40
CC(=O)C1CCN(C(=O)NCC(=O)Nc2ccc(Cl)cc2)CC1	ZINC000875138098	EE	On-Demand	Anodyne	EPHX2	50	45
O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875138114	FG	On-Demand	Bother	KCNJ1	28	42
O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875138116	FG	On-Demand	Bother	KCNJ1	28	42
C[C@@H](Cc1cccc(O)c1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875138128	DE	On-Demand	Anodyne	ST14	58	32
C[C@@H](Cc1cccc(O)c1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875138130	DE	On-Demand	Anodyne	ST14	58	32
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)COc2cccc(C)c2)C1	ZINC000875138153	EF	On-Demand	Anodyne	PDS	57	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)COc2cccc(C)c2)C1	ZINC000875138154	EF	On-Demand	Anodyne	PDS	57	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccccc2OCC)C1	ZINC000875138162	EE	On-Demand	Anodyne	HCN1	50	33
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccccc2OCC)C1	ZINC000875138162	EE	On-Demand	Anodyne	HCN4	42	33
C[C@@H](Cc1ccccc1F)NC(=O)N1CCN(C)C(C)(C)CC1	ZINC000875138192	DF	On-Demand	Anodyne	CACNA1H	45	33
C[C@H](Cc1ccccc1F)NC(=O)N1CCN(C)C(C)(C)CC1	ZINC000875138193	DF	On-Demand	Anodyne	CACNA1H	45	33
CCOc1ccccc1CNC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875138194	DE	On-Demand	Anodyne	TACR1	17	42
CCOc1ccccc1CNC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875138194	DE	On-Demand	Anodyne	EPHX2	24	52
CCOc1ccccc1CNC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875138194	DE	On-Demand	Anodyne	HCN1	53	36
CCOc1ccccc1CNC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875138194	DE	On-Demand	Anodyne	HCN4	45	35
CCOc1ccccc1CNC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875138195	DE	On-Demand	Anodyne	TACR1	17	42
CCOc1ccccc1CNC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875138195	DE	On-Demand	Anodyne	EPHX2	24	52
CCOc1ccccc1CNC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875138195	DE	On-Demand	Anodyne	HCN1	53	36
CCOc1ccccc1CNC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875138195	DE	On-Demand	Anodyne	HCN4	45	35
C[C@@H](Cc1cccc(O)c1)NC(=O)N(C)Cc1ccc2cc[nH]c2c1	ZINC000875138253	EH	On-Demand	Anodyne	HSD17B2	19	42
O=C(NCCOCC1CC1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875138273	GD	On-Demand	Anodyne	ETHR	54	47
C[C@@H](Cc1cccc(O)c1)NC(=O)N1CCc2c(CC(N)=O)cccc2C1	ZINC000875138298	FE	On-Demand	Anodyne	TRY2_BOVIN	45	32
C[C@@H](Cc1cccc(O)c1)NC(=O)N1CCc2c(CC(N)=O)cccc2C1	ZINC000875138298	FE	On-Demand	Anodyne	Q6PRC7_IXORI	53	37
C[C@H](Cc1ccccc1F)NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875138313	FD	On-Demand	Anodyne	EPHX2	18	40
C[C@H](Cc1ccccc1F)NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875138313	FD	On-Demand	Anodyne	CACNA1G	32	42
C[C@@H](Cc1ccccc1F)NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875138314	FD	On-Demand	Anodyne	EPHX2	18	40
C[C@@H](Cc1ccccc1F)NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875138314	FD	On-Demand	Anodyne	CACNA1G	32	42
CN1CCN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)CCC1(C)C	ZINC000875138323	EE	On-Demand	Bother	KCNJ1	32	47
CCOC(=O)C1=CC[C@H](NC(=O)N[C@H](C)Cc2cccc(O)c2)C1	ZINC000875138415	EE	On-Demand	Anodyne	CAPNS1	51	32
CCOC(=O)C1=CC[C@H](NC(=O)N[C@H](C)Cc2cccc(O)c2)C1	ZINC000875138415	EE	On-Demand	Anodyne	CAPN2	70	33
CCOC(=O)C1=CC[C@@H](NC(=O)N[C@H](C)Cc2cccc(O)c2)C1	ZINC000875138416	EE	On-Demand	Anodyne	CAPNS1	51	32
CCOC(=O)C1=CC[C@@H](NC(=O)N[C@H](C)Cc2cccc(O)c2)C1	ZINC000875138416	EE	On-Demand	Anodyne	CAPN2	70	33
CCOC(=O)C1=CC[C@@H](NC(=O)N[C@@H](C)Cc2cccc(O)c2)C1	ZINC000875138417	EE	On-Demand	Anodyne	CAPNS1	51	32
CCOC(=O)C1=CC[C@@H](NC(=O)N[C@@H](C)Cc2cccc(O)c2)C1	ZINC000875138417	EE	On-Demand	Anodyne	CAPN2	70	33
CCOC(=O)C1=CC[C@H](NC(=O)N[C@@H](C)Cc2cccc(O)c2)C1	ZINC000875138418	EE	On-Demand	Anodyne	CAPNS1	51	32
CCOC(=O)C1=CC[C@H](NC(=O)N[C@@H](C)Cc2cccc(O)c2)C1	ZINC000875138418	EE	On-Demand	Anodyne	CAPN2	70	33
C[C@H](NC(=O)C(=O)NCCOCC1CC1)c1ccc(C(F)(F)F)nc1	ZINC000875138430	FD	On-Demand	Anodyne	TRPV1	54	37
O=CN1CCCN(C(=O)NCC(=O)Nc2ccc(Cl)cc2)CC1	ZINC000875138441	ED	On-Demand	Anodyne	EPHX2	20	43
C[C@@H](Cc1cccc(O)c1)NC(=O)NC[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000875138454	GF	On-Demand	Anodyne	PAPA1_CARPA	30	41
C[C@@H](Cc1cccc(O)c1)NC(=O)NC[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000875138454	GF	On-Demand	Anodyne	FPR1	45	36
C[C@@H](Cc1cccc(O)c1)NC(=O)NC[C@@H]1C[C@H](NC(=O)OC(C)(C)C)C1	ZINC000875138455	GF	On-Demand	Anodyne	PAPA1_CARPA	30	41
C[C@@H](Cc1cccc(O)c1)NC(=O)NC[C@@H]1C[C@H](NC(=O)OC(C)(C)C)C1	ZINC000875138455	GF	On-Demand	Anodyne	FPR1	45	36
C[C@@H](Cc1cccc(O)c1)NC(=O)NCC1CC(NC(=O)OC(C)(C)C)C1	ZINC000875138458	GF	On-Demand	Anodyne	PAPA1_CARPA	30	41
C[C@@H](Cc1cccc(O)c1)NC(=O)NCC1CC(NC(=O)OC(C)(C)C)C1	ZINC000875138458	GF	On-Demand	Anodyne	FPR1	45	36
COC(=O)N(C)NC(=O)NCCc1ccccc1C(F)(F)F	ZINC000875138469	DE	On-Demand	Reactive	MTNR1A	41	40
C[C@@H](Cc1cccc(O)c1)NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875138495	ED	On-Demand	Anodyne	GHRHR	47	36
CONC(=O)C1CCN(C(=O)NCC(=O)Nc2ccc(Cl)cc2)CC1	ZINC000875138496	FD	On-Demand	Anodyne	EPHX2	52	47
C[C@@H](Cc1cccc(O)c1)NC(=O)N[C@@H](C)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875138497	GF	On-Demand	Anodyne	GPR119	16	42
C[C@@H](Cc1cccc(O)c1)NC(=O)N[C@H](C)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875138499	GF	On-Demand	Anodyne	GPR119	16	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCN(C)c2ccccc2)C1	ZINC000875138558	FF	On-Demand	Anodyne	ACE	20	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCN(C)c2ccccc2)C1	ZINC000875138558	FF	On-Demand	Anodyne	AMY2	47	33
O=C(NCCc1ccc([N+](=O)[O-])cc1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875138573	GG	On-Demand	Bother	ADRA1A	20	40
C[C@H](Cc1ccccc1F)NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875138582	EG	On-Demand	Anodyne	BIRC2	15	40
C[C@@H](Cc1ccccc1F)NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875138583	EG	On-Demand	Anodyne	BIRC2	15	40
C[C@H](Cc1ccccc1F)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875138600	DD	On-Demand	Anodyne	CACNA1H	45	36
C[C@@H](Cc1ccccc1F)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875138601	DD	On-Demand	Anodyne	CACNA1H	45	36
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2ccccc2C(F)(F)F)C1	ZINC000875138638	FG	On-Demand	Anodyne	RBP4	68	41
CCOC(=O)[C@@H]1CN(C(=O)N[C@H](C)Cc2cccc(O)c2)CCC1(F)F	ZINC000875138646	FF	On-Demand	Anodyne	GHRHR	41	33
CCOC(=O)[C@@H]1CN(C(=O)N[C@@H](C)Cc2cccc(O)c2)CCC1(F)F	ZINC000875138649	FF	On-Demand	Anodyne	GHRHR	41	33
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@H](C)Cc1cccc(O)c1	ZINC000875138651	DF	On-Demand	Anodyne	TIMP3	71	36
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@@H](C)Cc1cccc(O)c1	ZINC000875138652	DF	On-Demand	Anodyne	TIMP3	71	36
CCOC1CC2(C1)C[C@H]2NC(=O)N[C@@H](C)Cc1cccc(O)c1	ZINC000875138654	DF	On-Demand	Anodyne	TIMP3	71	36
CN1CCN(C2CCN(C(=O)NCC(=O)Nc3ccc(Cl)cc3)CC2)CC1	ZINC000875138689	GD	On-Demand	Anodyne	EPHX2	36	50
CN1CCN(C2CCN(C(=O)NCC(=O)Nc3ccc(Cl)cc3)CC2)CC1	ZINC000875138689	GD	On-Demand	Anodyne	MCHR1	31	41
CN1CCN(C2CCN(C(=O)NCC(=O)Nc3ccc(Cl)cc3)CC2)CC1	ZINC000875138689	GD	On-Demand	Anodyne	L3MBTL3	70	42
O=C(NCCO)C1CCN(C(=O)NCCc2ccccc2C(F)(F)F)CC1	ZINC000875138692	GD	On-Demand	Anodyne	EPHX2	22	48
O=C(NCCO)C1CCN(C(=O)NCCc2ccccc2C(F)(F)F)CC1	ZINC000875138692	GD	On-Demand	Anodyne	RBP4	81	38
O=C(NCCO)C1CCN(C(=O)NCCc2ccccc2C(F)(F)F)CC1	ZINC000875138692	GD	On-Demand	Anodyne	SFRP1	82	32
O=C(NCCO)C1CCN(C(=O)NCCc2ccccc2C(F)(F)F)CC1	ZINC000875138692	GD	On-Demand	Anodyne	WNT3	57	32
C[C@H](Cc1ccccc1F)NC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875138743	EG	On-Demand	Anodyne	CCR1	21	43
C[C@@H](Cc1ccccc1F)NC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875138744	EG	On-Demand	Anodyne	CCR1	21	43
C[C@H](Cc1ccccc1F)NC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875138745	EG	On-Demand	Anodyne	CCR1	21	43
C[C@@H](Cc1ccccc1F)NC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875138746	EG	On-Demand	Anodyne	CCR1	21	43
CCOc1ccccc1CNC(=O)N1CCC[C@@H](CCC(=O)OC)C1	ZINC000875138766	EF	On-Demand	Anodyne	HCN1	59	39
CCOc1ccccc1CNC(=O)N1CCC[C@@H](CCC(=O)OC)C1	ZINC000875138766	EF	On-Demand	Anodyne	HCN4	46	36
CCOc1ccccc1CNC(=O)N1CCC[C@H](CCC(=O)OC)C1	ZINC000875138767	EF	On-Demand	Anodyne	HCN1	59	39
CCOc1ccccc1CNC(=O)N1CCC[C@H](CCC(=O)OC)C1	ZINC000875138767	EF	On-Demand	Anodyne	HCN4	46	36
C[C@H](Cc1ccccc1F)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875138801	ED	On-Demand	Anodyne	BIRC2	44	45
C[C@@H](Cc1ccccc1F)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875138802	ED	On-Demand	Anodyne	BIRC2	44	45
CN(C)C[C@@H]1CN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)C[C@H]1CN(C)C	ZINC000875138815	GD	On-Demand	Bother	KCNJ1	29	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccoc1C	ZINC000875138818	CD	On-Demand	Anodyne	SLC6A3	53	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccoc1C	ZINC000875138819	CD	On-Demand	Anodyne	SLC6A3	53	37
C[C@@H](Cc1cccc(O)c1)NC(=O)N(C)CCc1cccc(C#N)c1	ZINC000875138833	EG	On-Demand	Mild	HSD17B2	15	41
C[C@@H](Cc1cccc(O)c1)NC(=O)N1CCN([S@@](C)(=N)=O)CC1	ZINC000875138854	ED	On-Demand	Anodyne	TRY2_BOVIN	98	41
C[C@@H](Cc1cccc(O)c1)NC(=O)N1CCN([S@@](C)(=N)=O)CC1	ZINC000875138854	ED	On-Demand	Anodyne	ST14	43	35
C[C@@H](Cc1cccc(O)c1)NC(=O)N1CCN([S@](C)(=N)=O)CC1	ZINC000875138856	ED	On-Demand	Anodyne	TRY2_BOVIN	98	41
C[C@@H](Cc1cccc(O)c1)NC(=O)N1CCN([S@](C)(=N)=O)CC1	ZINC000875138856	ED	On-Demand	Anodyne	ST14	43	35
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCOCC1CC1)CC2	ZINC000875138861	GD	On-Demand	Anodyne	SLC18A2	48	38
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCOCC1CC1)CC2	ZINC000875138863	GD	On-Demand	Anodyne	SLC18A2	48	38
Cc1cncc([C@@H]2CCCN2C(=O)N[C@H](C)Cc2cccc(O)c2)c1	ZINC000875138881	EH	On-Demand	Anodyne	BRCA1	42	30
Cc1cncc([C@H]2CCCN2C(=O)N[C@H](C)Cc2cccc(O)c2)c1	ZINC000875138883	EH	On-Demand	Anodyne	BRCA1	42	30
Cc1cncc([C@H]2CCCN2C(=O)N[C@@H](C)Cc2cccc(O)c2)c1	ZINC000875138885	EH	On-Demand	Anodyne	BRCA1	42	30
Cc1cncc([C@@H]2CCCN2C(=O)N[C@@H](C)Cc2cccc(O)c2)c1	ZINC000875138887	EH	On-Demand	Anodyne	BRCA1	42	30
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC(=O)Nc1ccc(Cl)cc1	ZINC000875138891	FE	On-Demand	Anodyne	SLC6A4	28	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC(=O)Nc1ccc(Cl)cc1	ZINC000875138891	FE	On-Demand	Anodyne	SLC6A3	56	43
C[C@@H](Cc1cccc(O)c1)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875138924	ED	On-Demand	Anodyne	CHRM3	15	45
C[C@@H](Cc1cccc(O)c1)NC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875138938	FD	On-Demand	Anodyne	CALCRL	47	40
C[C@@H](Cc1cccc(O)c1)NC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875138938	FD	On-Demand	Anodyne	L3MBTL3	103	42
C[C@@H](CN(C)C(=O)N[C@@H](C)Cc1cccc(O)c1)NC(=O)OC(C)(C)C	ZINC000875138988	FF	On-Demand	Anodyne	PAPA1_CARPA	40	42
C[C@@H](CN(C)C(=O)N[C@@H](C)Cc1cccc(O)c1)NC(=O)OC(C)(C)C	ZINC000875138988	FF	On-Demand	Anodyne	FPR1	46	37
C[C@@H](CN(C)C(=O)N[C@H](C)Cc1cccc(O)c1)NC(=O)OC(C)(C)C	ZINC000875138989	FF	On-Demand	Anodyne	PAPA1_CARPA	40	42
C[C@@H](CN(C)C(=O)N[C@H](C)Cc1cccc(O)c1)NC(=O)OC(C)(C)C	ZINC000875138989	FF	On-Demand	Anodyne	FPR1	46	37
C[C@@H](Cc1cccc(O)c1)NC(=O)N(C)C[C@@H](C)NC(=O)OC(C)(C)C	ZINC000875138990	FF	On-Demand	Anodyne	PAPA1_CARPA	40	42
C[C@@H](Cc1cccc(O)c1)NC(=O)N(C)C[C@@H](C)NC(=O)OC(C)(C)C	ZINC000875138990	FF	On-Demand	Anodyne	FPR1	46	37
CC[C@H](C[C@H](C)O)NC(=O)NCCc1ccccc1C(F)(F)F	ZINC000875139004	EG	On-Demand	Anodyne	ANPEP	15	45
C[C@@H](Cc1cccc(O)c1)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875139030	GH	On-Demand	Anodyne	OPRM1	41	42
C[C@@H](Cc1cccc(O)c1)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875139030	GH	On-Demand	Anodyne	OPRD1	32	40
C[C@@H](Cc1cccc(O)c1)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875139030	GH	On-Demand	Anodyne	OPRK1	32	42
CC(=O)[C@@H]1CCCN(C(=O)NCC(=O)Nc2ccc(Cl)cc2)C1	ZINC000875139054	EE	On-Demand	Anodyne	CCR1	30	41
CC(=O)[C@@H]1CCCN(C(=O)NCC(=O)Nc2ccc(Cl)cc2)C1	ZINC000875139054	EE	On-Demand	Anodyne	CCR2	15	43
CC(=O)[C@@H]1CCCN(C(=O)NCC(=O)Nc2ccc(Cl)cc2)C1	ZINC000875139054	EE	On-Demand	Anodyne	EPHX2	34	41
CC(=O)[C@@H]1CCCN(C(=O)NCC(=O)Nc2ccc(Cl)cc2)C1	ZINC000875139054	EE	On-Demand	Anodyne	MCHR1	16	40
CC(=O)[C@H]1CCCN(C(=O)NCC(=O)Nc2ccc(Cl)cc2)C1	ZINC000875139055	EE	On-Demand	Anodyne	CCR1	30	41
CC(=O)[C@H]1CCCN(C(=O)NCC(=O)Nc2ccc(Cl)cc2)C1	ZINC000875139055	EE	On-Demand	Anodyne	CCR2	15	43
CC(=O)[C@H]1CCCN(C(=O)NCC(=O)Nc2ccc(Cl)cc2)C1	ZINC000875139055	EE	On-Demand	Anodyne	EPHX2	34	41
CC(=O)[C@H]1CCCN(C(=O)NCC(=O)Nc2ccc(Cl)cc2)C1	ZINC000875139055	EE	On-Demand	Anodyne	MCHR1	16	40
COC(=O)C1(O)CN(C(=O)NCCc2ccccc2C(F)(F)F)C1	ZINC000875139056	ED	On-Demand	Anodyne	RBP4	44	35
CCCCCCCNC(=O)C(=O)NC[C@@H]1CCCN(C(C)C)C1	ZINC000875139086	EE	On-Demand	Mild	TPP2	20	43
CCCCCCCNC(=O)C(=O)NC[C@H]1CCCN(C(C)C)C1	ZINC000875139087	EE	On-Demand	Mild	TPP2	20	43
O=CN1CCCN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000875139090	DD	On-Demand	Bother	KCNJ1	30	45
C[C@@H](Cc1cccc(O)c1)NC(=O)N[C@H](C)c1ccc(C(F)(F)F)nc1	ZINC000875139092	FH	On-Demand	Anodyne	TRPV1	20	42
C[C@@H](Cc1cccc(O)c1)NC(=O)N[C@@H](C)c1ccc(C(F)(F)F)nc1	ZINC000875139093	FH	On-Demand	Anodyne	TRPV1	20	42
O=C(NCCc1ccccc1C(F)(F)F)N1CCC(CO)(CO)CC1	ZINC000875139133	FE	On-Demand	Anodyne	EPHX2	15	45
O=C(NCCc1ccccc1C(F)(F)F)N1CCC(CO)(CO)CC1	ZINC000875139133	FE	On-Demand	Anodyne	RBP4	78	39
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1ccc(N2CCOC2=O)cc1	ZINC000875139136	GF	On-Demand	Mild	ASAH1	89	36
CCCCCCCNC(=O)C(=O)N[C@H](C)c1ccc(N2CCOC2=O)cc1	ZINC000875139137	GF	On-Demand	Mild	ASAH1	89	36
O=CN1CCCN(C(=O)NCCc2ccccc2C(F)(F)F)CC1	ZINC000875139143	EE	On-Demand	Anodyne	RBP4	60	36
C[C@@H](Cc1cccc(O)c1)NC(=O)N1CCCN(C=O)CC1	ZINC000875139156	DD	On-Demand	Anodyne	TRY2_BOVIN	44	37
C[C@@H](Cc1cccc(O)c1)NC(=O)N1CCCN(C=O)CC1	ZINC000875139156	DD	On-Demand	Anodyne	Q6PRC7_IXORI	50	34
O=C(CNC(=O)N1CCO[C@@H](C(F)(F)F)CC1)Nc1ccc(Cl)cc1	ZINC000875139169	GF	On-Demand	Anodyne	EPHX2	44	40
O=C(CNC(=O)N1CCO[C@H](C(F)(F)F)CC1)Nc1ccc(Cl)cc1	ZINC000875139170	GF	On-Demand	Anodyne	EPHX2	44	40
C[C@@H](Cc1cccc(O)c1)NC(=O)N[C@@H]1CC[C@@H](NC(=O)OC(C)(C)C)CC1	ZINC000875139177	GG	On-Demand	Anodyne	PAPA1_CARPA	34	42
C[C@@H](Cc1cccc(O)c1)NC(=O)N[C@@H]1CC[C@@H](NC(=O)OC(C)(C)C)CC1	ZINC000875139177	GG	On-Demand	Anodyne	CTSK	18	41
C[C@@H](Cc1cccc(O)c1)NC(=O)N[C@@H]1CC[C@@H](NC(=O)OC(C)(C)C)CC1	ZINC000875139177	GG	On-Demand	Anodyne	CTSL	20	42
C[C@@H](Cc1cccc(O)c1)NC(=O)N[C@@H]1CC[C@@H](NC(=O)OC(C)(C)C)CC1	ZINC000875139177	GG	On-Demand	Anodyne	REN	45	40
C[C@@H](Cc1cccc(O)c1)NC(=O)N[C@@H]1CC[C@@H](NC(=O)OC(C)(C)C)CC1	ZINC000875139177	GG	On-Demand	Anodyne	FPR1	48	38
O=C(NCCc1ccccc1C(F)(F)F)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875139179	GF	On-Demand	Anodyne	RBP4	66	42
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccc(OCC3CC3)nc2)C1	ZINC000875139188	FD	On-Demand	Anodyne	HCRTR2	23	41
C[C@@H](Cc1cccc(O)c1)NC(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875139206	EF	On-Demand	Anodyne	BRCA1	50	30
O=C(CNC(=O)N1CCC[C@H](OC2CCC2)CC1)Nc1ccc(Cl)cc1	ZINC000875139213	GG	On-Demand	Anodyne	CCR1	24	41
O=C(CNC(=O)N1CCC[C@H](OC2CCC2)CC1)Nc1ccc(Cl)cc1	ZINC000875139213	GG	On-Demand	Anodyne	EPHX2	40	46
O=C(CNC(=O)N1CCC[C@@H](OC2CCC2)CC1)Nc1ccc(Cl)cc1	ZINC000875139214	GG	On-Demand	Anodyne	CCR1	24	41
O=C(CNC(=O)N1CCC[C@@H](OC2CCC2)CC1)Nc1ccc(Cl)cc1	ZINC000875139214	GG	On-Demand	Anodyne	EPHX2	40	46
O=C(CNC(=O)N1CCC2(CCNC2=O)CC1)Nc1ccc(Cl)cc1	ZINC000875139216	FD	On-Demand	Anodyne	CACNA1H	65	38
O=C(CNC(=O)N1CCC2(CCNC2=O)CC1)Nc1ccc(Cl)cc1	ZINC000875139216	FD	On-Demand	Anodyne	EPHX2	15	43
CC(=O)Nc1cccc2c1CN(C(=O)N[C@@H](C)Cc1cccc(O)c1)CC2	ZINC000875139217	FG	On-Demand	Anodyne	P2RY14	41	31
CC(=O)Nc1cccc2c1CN(C(=O)N[C@H](C)Cc1cccc(O)c1)CC2	ZINC000875139218	FG	On-Demand	Anodyne	P2RY14	41	31
C[C@@H](Cc1cccc(O)c1)NC(=O)N1CCC(c2nnnn2C)CC1	ZINC000875139240	ED	On-Demand	Anodyne	IL2RA	53	34
C[C@@H](Cc1cccc(O)c1)NC(=O)N1CCC(c2nnnn2C)CC1	ZINC000875139240	ED	On-Demand	Anodyne	CCR3	41	34
O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N1CC=CC1	ZINC000875139247	GE	On-Demand	Clean	NPY2R	62	36
O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)N1CC=CC1	ZINC000875139247	GE	On-Demand	Clean	ABCC1	46	33
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1cccc(O)c1	ZINC000875139287	EE	On-Demand	Anodyne	SLC6A4	24	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1cccc(O)c1	ZINC000875139287	EE	On-Demand	Anodyne	SLC6A3	50	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1cccc(O)c1	ZINC000875139288	EE	On-Demand	Anodyne	SLC6A4	24	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1cccc(O)c1	ZINC000875139288	EE	On-Demand	Anodyne	SLC6A3	50	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1cccc(O)c1	ZINC000875139289	EE	On-Demand	Anodyne	SLC6A4	24	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1cccc(O)c1	ZINC000875139289	EE	On-Demand	Anodyne	SLC6A3	50	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1cccc(O)c1	ZINC000875139290	EE	On-Demand	Anodyne	SLC6A4	24	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1cccc(O)c1	ZINC000875139290	EE	On-Demand	Anodyne	SLC6A3	50	42
COc1cccc([C@H](O)C2CCN(C(=O)N[C@@H](C)Cc3cccc(O)c3)CC2)c1	ZINC000875139314	GG	On-Demand	Anodyne	OPRD1	15	42
COc1cccc([C@H](O)C2CCN(C(=O)N[C@@H](C)Cc3cccc(O)c3)CC2)c1	ZINC000875139314	GG	On-Demand	Anodyne	GRIN2B	15	40
COc1cccc([C@H](O)C2CCN(C(=O)N[C@H](C)Cc3cccc(O)c3)CC2)c1	ZINC000875139315	GG	On-Demand	Anodyne	OPRD1	15	42
COc1cccc([C@H](O)C2CCN(C(=O)N[C@H](C)Cc3cccc(O)c3)CC2)c1	ZINC000875139315	GG	On-Demand	Anodyne	GRIN2B	15	40
CCn1ncc(CNC(=O)N[C@H](C)Cc2cccc(O)c2)n1	ZINC000875139333	DD	On-Demand	Anodyne	CTSV	50	36
CCn1ncc(CNC(=O)N[C@@H](C)Cc2cccc(O)c2)n1	ZINC000875139334	DD	On-Demand	Anodyne	CTSV	50	36
CC[C@@H]1COCCN1CCNC(=O)NCC(=O)Nc1ccc(Cl)cc1	ZINC000875139338	FD	On-Demand	Anodyne	MTOR	45	41
CC[C@@H]1COCCN1CCNC(=O)NCC(=O)Nc1ccc(Cl)cc1	ZINC000875139338	FD	On-Demand	Anodyne	EPHX2	16	45
CN1CC[C@H]2CN(C(=O)NCC(=O)Nc3ccc(Cl)cc3)CC[C@H]21	ZINC000875139341	FE	On-Demand	Anodyne	SLC6A3	15	42
CN1CC[C@H]2CN(C(=O)NCC(=O)Nc3ccc(Cl)cc3)CC[C@H]21	ZINC000875139341	FE	On-Demand	Anodyne	EPHX2	32	42
CN1CC[C@H]2CN(C(=O)NCC(=O)Nc3ccc(Cl)cc3)CC[C@@H]21	ZINC000875139342	FE	On-Demand	Anodyne	SLC6A3	15	42
CN1CC[C@H]2CN(C(=O)NCC(=O)Nc3ccc(Cl)cc3)CC[C@@H]21	ZINC000875139342	FE	On-Demand	Anodyne	EPHX2	32	42
O=C(NCCc1ccccc1C(F)(F)F)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875139350	FH	On-Demand	Anodyne	RBP4	49	34
C[C@@H](CCc1ccc(Br)cc1)NC(=O)N1CCCN(C=O)CC1	ZINC000875139351	GF	On-Demand	Anodyne	BIRC2	27	41
C[C@H](CCc1ccc(Br)cc1)NC(=O)N1CCCN(C=O)CC1	ZINC000875139352	GF	On-Demand	Anodyne	BIRC2	27	41
C[C@@H](Cc1cccc(O)c1)NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875139371	GH	On-Demand	Anodyne	SMO	40	41
C[C@@H](Cc1cccc(O)c1)NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875139371	GH	On-Demand	Anodyne	ETHR	62	43
CN(C)C[C@@H]1CN(C(=O)NCC(=O)Nc2ccc(Cl)cc2)C[C@H]1CN(C)C	ZINC000875139386	GD	On-Demand	Anodyne	EPHX2	19	40
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@@H](C)Cc1cccc(O)c1)CC2	ZINC000875139398	FG	On-Demand	Anodyne	MAPK1	41	37
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@@H](C)Cc1cccc(O)c1)CC2	ZINC000875139398	FG	On-Demand	Anodyne	P2RY14	41	31
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@H](C)Cc1cccc(O)c1)CC2	ZINC000875139399	FG	On-Demand	Anodyne	MAPK1	41	37
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@H](C)Cc1cccc(O)c1)CC2	ZINC000875139399	FG	On-Demand	Anodyne	P2RY14	41	31
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)Cc2cccc(O)c2)C1	ZINC000875139411	DE	On-Demand	Anodyne	OPRM1	38	41
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)Cc2cccc(O)c2)C1	ZINC000875139411	DE	On-Demand	Anodyne	DPP7	55	36
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)Cc2cccc(O)c2)C1	ZINC000875139412	DE	On-Demand	Anodyne	OPRM1	38	41
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)Cc2cccc(O)c2)C1	ZINC000875139412	DE	On-Demand	Anodyne	DPP7	55	36
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)Cc2cccc(O)c2)C1	ZINC000875139413	DE	On-Demand	Anodyne	OPRM1	38	41
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)Cc2cccc(O)c2)C1	ZINC000875139413	DE	On-Demand	Anodyne	DPP7	55	36
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)Cc2cccc(O)c2)C1	ZINC000875139414	DE	On-Demand	Anodyne	OPRM1	38	41
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)Cc2cccc(O)c2)C1	ZINC000875139414	DE	On-Demand	Anodyne	DPP7	55	36
O=C(CNC(=O)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1)Nc1ccc(Cl)cc1	ZINC000875139418	GD	On-Demand	Anodyne	CCR2	17	41
O=C(CNC(=O)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1)Nc1ccc(Cl)cc1	ZINC000875139418	GD	On-Demand	Anodyne	EPHX2	30	41
O=C(CNC(=O)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1)Nc1ccc(Cl)cc1	ZINC000875139419	GD	On-Demand	Anodyne	CCR2	17	41
O=C(CNC(=O)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1)Nc1ccc(Cl)cc1	ZINC000875139419	GD	On-Demand	Anodyne	EPHX2	30	41
O=C(CNC(=O)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1)Nc1ccc(Cl)cc1	ZINC000875139420	GD	On-Demand	Anodyne	CCR2	17	41
O=C(CNC(=O)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1)Nc1ccc(Cl)cc1	ZINC000875139420	GD	On-Demand	Anodyne	EPHX2	30	41
O=C(CNC(=O)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1)Nc1ccc(Cl)cc1	ZINC000875139421	GD	On-Demand	Anodyne	CCR2	17	41
O=C(CNC(=O)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1)Nc1ccc(Cl)cc1	ZINC000875139421	GD	On-Demand	Anodyne	EPHX2	30	41
CN1CC[C@H]2CN(C(=O)NCCN3C(=O)c4ccccc4C3=O)CC[C@@H]21	ZINC000875139422	FD	On-Demand	Anodyne	PLD1	56	35
CN1CC[C@H]2CN(C(=O)NCCN3C(=O)c4ccccc4C3=O)CC[C@@H]21	ZINC000875139422	FD	On-Demand	Anodyne	PLD2	41	35
CN1CC[C@H]2CN(C(=O)NCCN3C(=O)c4ccccc4C3=O)CC[C@H]21	ZINC000875139425	FD	On-Demand	Anodyne	PLD1	56	35
CN1CC[C@H]2CN(C(=O)NCCN3C(=O)c4ccccc4C3=O)CC[C@H]21	ZINC000875139425	FD	On-Demand	Anodyne	PLD2	41	35
O=C(NCc1ccc(F)cc1Br)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875139444	GG	On-Demand	Anodyne	P2RX7	25	50
C[C@H](NC(=O)C(=O)NC1CCN(CC(F)F)CC1)c1cc2cnccc2o1	ZINC000875139447	GD	On-Demand	Anodyne	SSTR5	44	37
CC[C@H](C[C@H](C)O)NC(=O)NCCN(C)Cc1ccccc1	ZINC000875139455	DD	On-Demand	Anodyne	CAPN2	58	32
CC[C@H](C[C@H](C)O)NC(=O)NCCN(C)Cc1ccccc1	ZINC000875139455	DD	On-Demand	Anodyne	NPR	47	34
CC[C@H](C[C@H](C)O)NC(=O)NCCN(C)Cc1ccccc1	ZINC000875139455	DD	On-Demand	Anodyne	PDS	41	32
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(C)s1	ZINC000875139461	DF	On-Demand	Anodyne	SLC6A4	24	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(C)s1	ZINC000875139461	DF	On-Demand	Anodyne	SLC6A3	53	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(C)s1	ZINC000875139462	DF	On-Demand	Anodyne	SLC6A4	24	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(C)s1	ZINC000875139462	DF	On-Demand	Anodyne	SLC6A3	53	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(C)s1	ZINC000875139463	DF	On-Demand	Anodyne	SLC6A4	24	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(C)s1	ZINC000875139463	DF	On-Demand	Anodyne	SLC6A3	53	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(C)s1	ZINC000875139464	DF	On-Demand	Anodyne	SLC6A4	24	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(C)s1	ZINC000875139464	DF	On-Demand	Anodyne	SLC6A3	53	40
COC(=O)N(C)NC(=O)NCCc1cc(OC)ccc1OC	ZINC000875139465	DD	On-Demand	Reactive	NQO2	41	47
COC(=O)N(C)NC(=O)NCCc1cc(OC)ccc1OC	ZINC000875139465	DD	On-Demand	Reactive	MTNR1A	135	51
COC(=O)N(C)NC(=O)NCCc1cc(OC)ccc1OC	ZINC000875139465	DD	On-Demand	Reactive	MTNR1B	106	55
COC(=O)N(C)NC(=O)NCCc1cc(OC)ccc1OC	ZINC000875139465	DD	On-Demand	Reactive	MT-ND1	19	44
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875139481	GD	On-Demand	Anodyne	DRD4	18	41
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875139481	GD	On-Demand	Anodyne	ACHE	23	41
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875139481	GD	On-Demand	Anodyne	OPRM1	17	40
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875139481	GD	On-Demand	Anodyne	HTR4	41	49
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875139481	GD	On-Demand	Anodyne	GRIN2B	45	38
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875139481	GD	On-Demand	Anodyne	SIGMAR1	37	46
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875139481	GD	On-Demand	Anodyne	CCR3	33	43
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875139481	GD	On-Demand	Anodyne	CCR5	21	41
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875139481	GD	On-Demand	Anodyne	CACNA1G	28	41
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875139481	GD	On-Demand	Anodyne	CACNA1I	42	36
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875139482	GD	On-Demand	Anodyne	DRD4	18	41
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875139482	GD	On-Demand	Anodyne	ACHE	23	41
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875139482	GD	On-Demand	Anodyne	OPRM1	17	40
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875139482	GD	On-Demand	Anodyne	HTR4	41	49
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875139482	GD	On-Demand	Anodyne	GRIN2B	45	38
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875139482	GD	On-Demand	Anodyne	SIGMAR1	37	46
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875139482	GD	On-Demand	Anodyne	CCR3	33	43
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875139482	GD	On-Demand	Anodyne	CCR5	21	41
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875139482	GD	On-Demand	Anodyne	CACNA1G	28	41
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875139482	GD	On-Demand	Anodyne	CACNA1I	42	36
COC(=O)N(C)NC(=O)NCc1ccc(F)cc1Br	ZINC000875139493	EE	On-Demand	Reactive	P2RX7	38	46
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875139496	FD	On-Demand	Anodyne	OPRM1	20	40
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875139496	FD	On-Demand	Anodyne	HTR4	30	43
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875139496	FD	On-Demand	Anodyne	SIGMAR1	41	42
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875139496	FD	On-Demand	Anodyne	CCR3	24	41
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875139496	FD	On-Demand	Anodyne	BIRC2	37	40
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875139497	FD	On-Demand	Anodyne	OPRM1	20	40
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875139497	FD	On-Demand	Anodyne	HTR4	30	43
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875139497	FD	On-Demand	Anodyne	SIGMAR1	41	42
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875139497	FD	On-Demand	Anodyne	CCR3	24	41
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875139497	FD	On-Demand	Anodyne	BIRC2	37	40
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875139498	FD	On-Demand	Anodyne	OPRM1	20	40
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875139498	FD	On-Demand	Anodyne	HTR4	30	43
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875139498	FD	On-Demand	Anodyne	SIGMAR1	41	42
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875139498	FD	On-Demand	Anodyne	CCR3	24	41
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875139498	FD	On-Demand	Anodyne	BIRC2	37	40
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875139499	FD	On-Demand	Anodyne	OPRM1	20	40
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875139499	FD	On-Demand	Anodyne	HTR4	30	43
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875139499	FD	On-Demand	Anodyne	SIGMAR1	41	42
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875139499	FD	On-Demand	Anodyne	CCR3	24	41
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875139499	FD	On-Demand	Anodyne	BIRC2	37	40
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(c3ccccc3)CC2)C1	ZINC000875139522	EF	On-Demand	Anodyne	SLC6A1	79	34
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(c3ccccc3)CC2)C1	ZINC000875139522	EF	On-Demand	Anodyne	EPHX2	32	46
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(c3ccccc3)CC2)C1	ZINC000875139522	EF	On-Demand	Anodyne	ADAM10	36	41
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(c3ccccc3)CC2)C1	ZINC000875139523	EF	On-Demand	Anodyne	SLC6A1	79	34
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(c3ccccc3)CC2)C1	ZINC000875139523	EF	On-Demand	Anodyne	EPHX2	32	46
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(c3ccccc3)CC2)C1	ZINC000875139523	EF	On-Demand	Anodyne	ADAM10	36	41
C#CC[C@@H](COC)NC(=O)C(=O)NCc1cccc(CN2CCCCCC2)c1	ZINC000875139524	GD	On-Demand	Mild	HRH2	38	46
C#CC[C@H](COC)NC(=O)C(=O)NCc1cccc(CN2CCCCCC2)c1	ZINC000875139527	GD	On-Demand	Mild	HRH2	38	46
O=CN1CCCN(C(=O)NCc2ccc(F)cc2Br)CC1	ZINC000875139537	FD	On-Demand	Anodyne	P2RX7	21	44
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(F)cc1Br	ZINC000875139563	EF	On-Demand	Anodyne	P2RX7	28	43
O=C(NC1CCN(CC(F)F)CC1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875139581	GD	On-Demand	Anodyne	SIGMAR1	15	40
COc1ccc([C@@H]2CN(C(=O)NC3CCN(c4ccccc4)CC3)CCO2)cc1	ZINC000875139582	GG	On-Demand	Anodyne	EPHX2	19	42
O=C(NC1CCN(CC(F)F)CC1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875139583	GD	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NC1CCN(CC(F)F)CC1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875139584	GD	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NC1CCN(CC(F)F)CC1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875139586	GD	On-Demand	Anodyne	SIGMAR1	15	40
COC(=O)N(C)NC(=O)NCC1(c2ccccc2OC)CCCC1	ZINC000875139620	EE	On-Demand	Reactive	KCNA3	47	39
COC(=O)N(C)NC(=O)NCC1(c2ccccc2OC)CCCC1	ZINC000875139620	EE	On-Demand	Reactive	HCN1	54	38
COC(=O)N(C)NC(=O)NCC1(c2ccccc2OC)CCCC1	ZINC000875139620	EE	On-Demand	Reactive	HCN4	50	36
O=C(NCc1ccc(F)cc1Br)NC[C@H]1C[C@H](O)C1	ZINC000875139646	EE	On-Demand	Anodyne	P2RX7	33	47
O=C(NCc1ccccc1Oc1ccccc1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875139650	GD	On-Demand	Anodyne	CCR8	33	48
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3ccc(F)cc3Br)C[C@@H]1C2	ZINC000875139656	GF	On-Demand	Anodyne	P2RX7	29	44
C[C@]1(C(F)(F)F)CCN(C(=O)NCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000875139663	GG	On-Demand	Anodyne	EPHX2	17	43
O=C1CCN(C(=O)NC2CCN(c3ccccc3)CC2)CCCCCCN1	ZINC000875139672	FF	On-Demand	Anodyne	EPHX2	18	43
CN(CCNC(=O)NC[C@H]1CC(C(F)(F)F)=NO1)Cc1ccccc1	ZINC000875139675	FE	On-Demand	Anodyne	LUCI_PHOPY	51	33
CN(CCNC(=O)NC[C@@H]1CC(C(F)(F)F)=NO1)Cc1ccccc1	ZINC000875139677	FE	On-Demand	Anodyne	LUCI_PHOPY	51	33
CN1CCN(C2CCN(C(=O)C(=O)N[C@H]3CCCCc4ccccc43)CC2)CC1	ZINC000875139684	GD	On-Demand	Anodyne	XIAP	22	41
CN1CCN(C2CCN(C(=O)C(=O)N[C@H]3CCCCc4ccccc43)CC2)CC1	ZINC000875139684	GD	On-Demand	Anodyne	BIRC3	30	40
CN1CCN(C2CCN(C(=O)C(=O)N[C@H]3CCCCc4ccccc43)CC2)CC1	ZINC000875139684	GD	On-Demand	Anodyne	BIRC2	41	40
CN1CCN(C2CCN(C(=O)C(=O)N[C@H]3CCCCc4ccccc43)CC2)CC1	ZINC000875139684	GD	On-Demand	Anodyne	L3MBTL3	77	43
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3CCCCc4ccccc43)CC2)CC1	ZINC000875139687	GD	On-Demand	Anodyne	XIAP	22	41
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3CCCCc4ccccc43)CC2)CC1	ZINC000875139687	GD	On-Demand	Anodyne	BIRC3	30	40
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3CCCCc4ccccc43)CC2)CC1	ZINC000875139687	GD	On-Demand	Anodyne	BIRC2	41	40
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3CCCCc4ccccc43)CC2)CC1	ZINC000875139687	GD	On-Demand	Anodyne	L3MBTL3	77	43
C[C@]1(NC(=O)C(F)(F)F)CCN(C(=O)NC2CCN(c3ccccc3)CC2)C1	ZINC000875139699	GF	On-Demand	Anodyne	EPHX2	33	40
O=C(NC1CCN(c2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875139705	ED	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NC1CCN(c2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875139705	ED	On-Demand	Anodyne	EPHX2	37	48
CCOC(=O)[C@H](C)C1CN(C(=O)NCCN(C)Cc2ccccc2)C1	ZINC000875139718	ED	On-Demand	Anodyne	ACE	30	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCCN(C)Cc2ccccc2)C1	ZINC000875139718	ED	On-Demand	Anodyne	AMY2	42	29
CCOC(=O)[C@H](C)C1CN(C(=O)NCCN(C)Cc2ccccc2)C1	ZINC000875139718	ED	On-Demand	Anodyne	Q6PRC7_IXORI	43	34
CC(=O)[C@@H]1CCCN(C(=O)NCCN2C(=O)c3ccccc3C2=O)C1	ZINC000875139732	ED	On-Demand	Anodyne	SLC6A1	80	37
CC(=O)[C@H]1CCCN(C(=O)NCCN2C(=O)c3ccccc3C2=O)C1	ZINC000875139734	ED	On-Demand	Anodyne	SLC6A1	80	37
COCCN(CC1CCN(C)CC1)C(=O)NCCc1cc(OC)ccc1OC	ZINC000875139735	GE	On-Demand	Anodyne	MTNR1A	61	37
COCCN(CC1CCN(C)CC1)C(=O)NCCc1cc(OC)ccc1OC	ZINC000875139735	GE	On-Demand	Anodyne	MTNR1B	51	43
COCCN(CC1CCN(C)CC1)C(=O)NCCc1cc(OC)ccc1OC	ZINC000875139735	GE	On-Demand	Anodyne	ACKR3	70	35
CC[C@@H]1COCCN1CCNC(=O)NC1CCN(c2ccccc2)CC1	ZINC000875139736	FE	On-Demand	Anodyne	EPHX2	22	44
C[S@](=N)(=O)N1CCN(C(=O)C(=O)N[C@@H]2CCCCc3ccccc32)CC1	ZINC000875139778	GD	On-Demand	Anodyne	BDKRB1	40	38
C[S@](=N)(=O)N1CCN(C(=O)C(=O)N[C@@H]2CCCCc3ccccc32)CC1	ZINC000875139778	GD	On-Demand	Anodyne	XIAP	22	40
C[S@](=N)(=O)N1CCN(C(=O)C(=O)N[C@H]2CCCCc3ccccc32)CC1	ZINC000875139781	GD	On-Demand	Anodyne	BDKRB1	40	38
C[S@](=N)(=O)N1CCN(C(=O)C(=O)N[C@H]2CCCCc3ccccc32)CC1	ZINC000875139781	GD	On-Demand	Anodyne	XIAP	22	40
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1ccc(CN2CCCCCC2)cc1	ZINC000875139811	GE	On-Demand	Mild	HRH3	21	43
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1ccc(CN2CCCCCC2)cc1	ZINC000875139813	GE	On-Demand	Mild	HRH3	21	43
CC(=O)C1CCN(C(=O)NC2CCN(c3ccccc3)CC2)CC1	ZINC000875139815	EF	On-Demand	Anodyne	EPHX2	57	49
CC(=O)Nc1ccc2c(c1)CN(C(=O)NC1CCN(c3ccccc3)CC1)CC2	ZINC000875139827	GG	On-Demand	Anodyne	EPHX2	20	40
C[C@H](NC(=O)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1)c1ccnn1C	ZINC000875139833	GD	On-Demand	Anodyne	HTR4	51	49
C[C@H](NC(=O)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1)c1ccnn1C	ZINC000875139833	GD	On-Demand	Anodyne	CCR3	31	45
C[C@H](NC(=O)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1)c1ccnn1C	ZINC000875139833	GD	On-Demand	Anodyne	BIRC2	48	42
C[C@H](NC(=O)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1)c1ccnn1C	ZINC000875139837	GD	On-Demand	Anodyne	HTR4	51	49
C[C@H](NC(=O)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1)c1ccnn1C	ZINC000875139837	GD	On-Demand	Anodyne	CCR3	31	45
C[C@H](NC(=O)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1)c1ccnn1C	ZINC000875139837	GD	On-Demand	Anodyne	BIRC2	48	42
CC(=O)[C@@H]1CCCN(C(=O)NCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000875139842	FE	On-Demand	Anodyne	APP	42	35
CC(=O)[C@@H]1CCCN(C(=O)NCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000875139842	FE	On-Demand	Anodyne	EPHX2	18	41
CC(=O)[C@@H]1CCCN(C(=O)NCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000875139842	FE	On-Demand	Anodyne	DPP7	40	37
CC(=O)[C@H]1CCCN(C(=O)NCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000875139844	FE	On-Demand	Anodyne	APP	42	35
CC(=O)[C@H]1CCCN(C(=O)NCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000875139844	FE	On-Demand	Anodyne	EPHX2	18	41
CC(=O)[C@H]1CCCN(C(=O)NCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000875139844	FE	On-Demand	Anodyne	DPP7	40	37
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(CN3CCCCCC3)cc2)CC1	ZINC000875139862	GF	On-Demand	Anodyne	HRH3	38	49
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(CN3CCCCCC3)cc2)CC1	ZINC000875139862	GF	On-Demand	Anodyne	SIGMAR1	24	49
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(CN3CCCCCC3)cc2)CC1	ZINC000875139862	GF	On-Demand	Anodyne	MCHR1	15	40
Cn1nnnc1C1CCN(C(=O)NC2CCN(c3ccccc3)CC2)CC1	ZINC000875139869	FD	On-Demand	Anodyne	EPHX2	27	42
O=C(NC1CCN(c2ccccc2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875139888	FH	On-Demand	Anodyne	EPHX2	40	45
O=C(NC1CCN(c2ccccc2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875139890	FH	On-Demand	Anodyne	EPHX2	40	45
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc3c(c2)OCCCO3)C1	ZINC000875139891	FD	On-Demand	Anodyne	NOS2	88	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc3c(c2)OCCCO3)C1	ZINC000875139892	FD	On-Demand	Anodyne	NOS2	88	37
CONC(=O)C1CCN(C(=O)NC2CCN(c3ccccc3)CC2)CC1	ZINC000875139893	FD	On-Demand	Anodyne	EPHX2	54	45
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875139898	GE	On-Demand	Anodyne	DRD4	15	41
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875139898	GE	On-Demand	Anodyne	HTR4	34	45
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875139898	GE	On-Demand	Anodyne	SIGMAR1	37	46
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875139898	GE	On-Demand	Anodyne	CCR3	26	41
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875139899	GE	On-Demand	Anodyne	DRD4	15	41
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875139899	GE	On-Demand	Anodyne	HTR4	34	45
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875139899	GE	On-Demand	Anodyne	SIGMAR1	37	46
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875139899	GE	On-Demand	Anodyne	CCR3	26	41
O=C(NCc1ccc2c(c1)OCCCO2)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875139903	FD	On-Demand	Anodyne	NOS2	85	33
Cc1nnc(NNC(=O)NCc2ccc(F)cc2Br)n1C	ZINC000875139904	FD	On-Demand	Reactive	P2RX7	47	46
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCCCc3ccccc32)C1	ZINC000875139905	EE	On-Demand	Anodyne	BDKRB1	44	38
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCCCc3ccccc32)C1	ZINC000875139905	EE	On-Demand	Anodyne	XIAP	26	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCCCc3ccccc32)C1	ZINC000875139905	EE	On-Demand	Anodyne	BIRC3	37	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCCCc3ccccc32)C1	ZINC000875139905	EE	On-Demand	Anodyne	BIRC2	42	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCCc3ccccc32)C1	ZINC000875139907	EE	On-Demand	Anodyne	BDKRB1	44	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCCc3ccccc32)C1	ZINC000875139907	EE	On-Demand	Anodyne	XIAP	26	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCCc3ccccc32)C1	ZINC000875139907	EE	On-Demand	Anodyne	BIRC3	37	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCCc3ccccc32)C1	ZINC000875139907	EE	On-Demand	Anodyne	BIRC2	42	38
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCCc3ccccc32)C1	ZINC000875139909	EE	On-Demand	Anodyne	BDKRB1	44	38
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCCc3ccccc32)C1	ZINC000875139909	EE	On-Demand	Anodyne	XIAP	26	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCCc3ccccc32)C1	ZINC000875139909	EE	On-Demand	Anodyne	BIRC3	37	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCCc3ccccc32)C1	ZINC000875139909	EE	On-Demand	Anodyne	BIRC2	42	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H]2CCCCc3ccccc32)C1	ZINC000875139911	EE	On-Demand	Anodyne	BDKRB1	44	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H]2CCCCc3ccccc32)C1	ZINC000875139911	EE	On-Demand	Anodyne	XIAP	26	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H]2CCCCc3ccccc32)C1	ZINC000875139911	EE	On-Demand	Anodyne	BIRC3	37	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H]2CCCCc3ccccc32)C1	ZINC000875139911	EE	On-Demand	Anodyne	BIRC2	42	38
COCCN(CC1CCN(C)CC1)C(=O)NCCN(C)Cc1ccccc1	ZINC000875139923	GE	On-Demand	Anodyne	ACHE	35	41
COCCN(CC1CCN(C)CC1)C(=O)NCCN(C)Cc1ccccc1	ZINC000875139923	GE	On-Demand	Anodyne	SIGMAR1	19	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875139930	GD	On-Demand	Anodyne	SLC6A1	106	36
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875139930	GD	On-Demand	Anodyne	OPRM1	16	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875139930	GD	On-Demand	Anodyne	HTR4	38	46
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875139930	GD	On-Demand	Anodyne	SIGMAR1	29	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875139930	GD	On-Demand	Anodyne	CCR3	31	44
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875139930	GD	On-Demand	Anodyne	CACNA1G	27	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875139930	GD	On-Demand	Anodyne	BIRC2	45	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875139931	GD	On-Demand	Anodyne	SLC6A1	106	36
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875139931	GD	On-Demand	Anodyne	OPRM1	16	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875139931	GD	On-Demand	Anodyne	HTR4	38	46
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875139931	GD	On-Demand	Anodyne	SIGMAR1	29	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875139931	GD	On-Demand	Anodyne	CCR3	31	44
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875139931	GD	On-Demand	Anodyne	CACNA1G	27	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875139931	GD	On-Demand	Anodyne	BIRC2	45	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875139932	GD	On-Demand	Anodyne	SLC6A1	106	36
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875139932	GD	On-Demand	Anodyne	OPRM1	16	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875139932	GD	On-Demand	Anodyne	HTR4	38	46
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875139932	GD	On-Demand	Anodyne	SIGMAR1	29	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875139932	GD	On-Demand	Anodyne	CCR3	31	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875139932	GD	On-Demand	Anodyne	CACNA1G	27	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875139932	GD	On-Demand	Anodyne	BIRC2	45	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875139933	GD	On-Demand	Anodyne	SLC6A1	106	36
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875139933	GD	On-Demand	Anodyne	OPRM1	16	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875139933	GD	On-Demand	Anodyne	HTR4	38	46
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875139933	GD	On-Demand	Anodyne	SIGMAR1	29	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875139933	GD	On-Demand	Anodyne	CCR3	31	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875139933	GD	On-Demand	Anodyne	CACNA1G	27	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875139933	GD	On-Demand	Anodyne	BIRC2	45	42
O=C(NC1CCN(c2ccccc2)CC1)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875139939	EG	On-Demand	Anodyne	EPHX2	23	49
O=C(NC1CCN(c2ccccc2)CC1)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875139939	EG	On-Demand	Anodyne	RBP4	44	31
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(c4ccccc4)CC3)C[C@@H]1C2	ZINC000875139944	FE	On-Demand	Anodyne	EPHX2	35	55
O=C(N[C@H]1CCCCc2ccccc21)C(=O)N1CCC(CO)(CO)CC1	ZINC000875139959	FD	On-Demand	Anodyne	BIRC2	41	38
O=C(N[C@@H]1CCCCc2ccccc21)C(=O)N1CCC(CO)(CO)CC1	ZINC000875139960	FD	On-Demand	Anodyne	BIRC2	41	38
CN1CCN(C2CCN(C(=O)NC3CCN(c4ccccc4)CC3)CC2)CC1	ZINC000875139969	GE	On-Demand	Anodyne	EPHX2	37	47
CN1CCN(C2CCN(C(=O)NC3CCN(c4ccccc4)CC3)CC2)CC1	ZINC000875139969	GE	On-Demand	Anodyne	L3MBTL3	115	44
O=C(NC1CCN(c2ccccc2)CC1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875139970	GD	On-Demand	Anodyne	EPHX2	28	45
O=C(NC1CCN(c2ccccc2)CC1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875139971	GD	On-Demand	Anodyne	EPHX2	28	45
O=C(NC1CCN(c2ccccc2)CC1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875139972	GD	On-Demand	Anodyne	EPHX2	28	45
O=C(NC1CCN(c2ccccc2)CC1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875139973	GD	On-Demand	Anodyne	EPHX2	28	45
C[C@]1(C(F)(F)F)CN(C(=O)NC2CCN(c3ccccc3)CC2)CCO1	ZINC000875139979	FG	On-Demand	Anodyne	EPHX2	32	43
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2cc(OC)ccc2OC)C1	ZINC000875140003	FE	On-Demand	Anodyne	NQO2	32	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2cc(OC)ccc2OC)C1	ZINC000875140003	FE	On-Demand	Anodyne	MTNR1A	86	43
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2cc(OC)ccc2OC)C1	ZINC000875140003	FE	On-Demand	Anodyne	MTNR1B	70	46
Cc1cncc([C@@H]2CCCN2C(=O)NC2CCN(c3ccccc3)CC2)c1	ZINC000875140013	FH	On-Demand	Anodyne	SSTR5	30	41
Cc1cncc([C@H]2CCCN2C(=O)NC2CCN(c3ccccc3)CC2)c1	ZINC000875140016	FH	On-Demand	Anodyne	SSTR5	30	41
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1cccc(N2CCOC2=O)c1	ZINC000875140031	GF	On-Demand	Mild	ASAH1	63	34
CCCCCCCNC(=O)C(=O)N[C@H](C)c1cccc(N2CCOC2=O)c1	ZINC000875140032	GF	On-Demand	Mild	ASAH1	63	34
O=C(NCc1ccc2c(c1)OCCCO2)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875140041	GD	On-Demand	Anodyne	NOS2	82	34
O=C(NCc1ccc2c(c1)OCCCO2)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875140043	GD	On-Demand	Anodyne	NOS2	82	34
O=C(NCc1ccc2c(c1)OCCCO2)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875140045	GD	On-Demand	Anodyne	NOS2	82	34
O=C(NCc1ccc2c(c1)OCCCO2)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875140047	GD	On-Demand	Anodyne	NOS2	82	34
CN1CC[C@H]2CN(C(=O)NC3CCN(c4ccccc4)CC3)CC[C@@H]21	ZINC000875140052	EE	On-Demand	Anodyne	DRD2	15	50
CN1CC[C@H]2CN(C(=O)NC3CCN(c4ccccc4)CC3)CC[C@@H]21	ZINC000875140052	EE	On-Demand	Anodyne	DRD3	17	50
CN1CC[C@H]2CN(C(=O)NC3CCN(c4ccccc4)CC3)CC[C@@H]21	ZINC000875140052	EE	On-Demand	Anodyne	EPHX2	31	45
CN1CC[C@H]2CN(C(=O)NC3CCN(c4ccccc4)CC3)CC[C@H]21	ZINC000875140053	EE	On-Demand	Anodyne	DRD2	15	50
CN1CC[C@H]2CN(C(=O)NC3CCN(c4ccccc4)CC3)CC[C@H]21	ZINC000875140053	EE	On-Demand	Anodyne	DRD3	17	50
CN1CC[C@H]2CN(C(=O)NC3CCN(c4ccccc4)CC3)CC[C@H]21	ZINC000875140053	EE	On-Demand	Anodyne	EPHX2	31	45
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCCCc3ccccc32)CC1	ZINC000875140055	EE	On-Demand	Anodyne	BDKRB1	45	37
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCCCc3ccccc32)CC1	ZINC000875140055	EE	On-Demand	Anodyne	XIAP	22	41
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCCCc3ccccc32)CC1	ZINC000875140055	EE	On-Demand	Anodyne	BIRC3	26	40
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCCCc3ccccc32)CC1	ZINC000875140055	EE	On-Demand	Anodyne	BIRC2	41	40
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCCCc3ccccc32)CC1	ZINC000875140056	EE	On-Demand	Anodyne	BDKRB1	45	37
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCCCc3ccccc32)CC1	ZINC000875140056	EE	On-Demand	Anodyne	XIAP	22	41
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCCCc3ccccc32)CC1	ZINC000875140056	EE	On-Demand	Anodyne	BIRC3	26	40
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCCCc3ccccc32)CC1	ZINC000875140056	EE	On-Demand	Anodyne	BIRC2	41	40
CONC(=O)C1CCN(C(=O)NCC2(c3ccccc3OC)CCCC2)CC1	ZINC000875140057	GF	On-Demand	Anodyne	KCNA3	45	39
CONC(=O)C1CCN(C(=O)NCC2(c3ccccc3OC)CCCC2)CC1	ZINC000875140057	GF	On-Demand	Anodyne	MTNR1A	15	42
CONC(=O)C1CCN(C(=O)NCC2(c3ccccc3OC)CCCC2)CC1	ZINC000875140057	GF	On-Demand	Anodyne	MTNR1B	16	42
CONC(=O)C1CCN(C(=O)NCC2(c3ccccc3OC)CCCC2)CC1	ZINC000875140057	GF	On-Demand	Anodyne	CACNA1G	25	44
CONC(=O)C1CCN(C(=O)NCC2(c3ccccc3OC)CCCC2)CC1	ZINC000875140057	GF	On-Demand	Anodyne	HCN1	55	39
CONC(=O)C1CCN(C(=O)NCC2(c3ccccc3OC)CCCC2)CC1	ZINC000875140057	GF	On-Demand	Anodyne	HCN4	51	36
COC(=O)C1(O)CN(C(=O)NCCc2cc(OC)ccc2OC)C1	ZINC000875140063	EC	On-Demand	Anodyne	NQO2	39	42
COC(=O)C1(O)CN(C(=O)NCCc2cc(OC)ccc2OC)C1	ZINC000875140063	EC	On-Demand	Anodyne	MTNR1A	102	42
COC(=O)C1(O)CN(C(=O)NCCc2cc(OC)ccc2OC)C1	ZINC000875140063	EC	On-Demand	Anodyne	MTNR1B	84	51
O=C(NCc1ccc2c(c1)OCCCO2)C(=O)N[C@H]1CC12CCC2	ZINC000875140068	ED	On-Demand	Anodyne	NOS2	51	33
O=C(NCc1ccc2c(c1)OCCCO2)C(=O)N[C@@H]1CC12CCC2	ZINC000875140070	ED	On-Demand	Anodyne	NOS2	51	33
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875140106	FC	On-Demand	Mild	DRD4	19	42
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875140106	FC	On-Demand	Mild	ACHE	23	41
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875140106	FC	On-Demand	Mild	SLC6A3	20	40
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875140106	FC	On-Demand	Mild	HTR4	42	47
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875140107	FC	On-Demand	Mild	DRD4	19	42
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875140107	FC	On-Demand	Mild	ACHE	23	41
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875140107	FC	On-Demand	Mild	SLC6A3	20	40
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875140107	FC	On-Demand	Mild	HTR4	42	47
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875140108	FC	On-Demand	Mild	DRD4	19	42
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875140108	FC	On-Demand	Mild	ACHE	23	41
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875140108	FC	On-Demand	Mild	SLC6A3	20	40
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875140108	FC	On-Demand	Mild	HTR4	42	47
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875140109	FC	On-Demand	Mild	DRD4	19	42
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875140109	FC	On-Demand	Mild	ACHE	23	41
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875140109	FC	On-Demand	Mild	SLC6A3	20	40
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875140109	FC	On-Demand	Mild	HTR4	42	47
CN(CCNC(=O)N1CCC(C(=O)NCCO)CC1)Cc1ccccc1	ZINC000875140115	FC	On-Demand	Anodyne	TACR1	16	41
CN(CCNC(=O)N1CCC(C(=O)NCCO)CC1)Cc1ccccc1	ZINC000875140115	FC	On-Demand	Anodyne	EPHX2	19	41
CN(CCNC(=O)N1CCC(C(=O)NCCO)CC1)Cc1ccccc1	ZINC000875140115	FC	On-Demand	Anodyne	CACNA1G	37	40
CN(C)C[C@@H]1CN(C(=O)NC2CCN(c3ccccc3)CC2)C[C@H]1CN(C)C	ZINC000875140120	GE	On-Demand	Anodyne	EPHX2	35	45
O=C(NCCC[C@@H]1C=CCC1)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875140172	GF	On-Demand	Anodyne	HTR4	32	42
O=C(NCCC[C@@H]1C=CCC1)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875140172	GF	On-Demand	Anodyne	CCR3	31	42
O=C(NCCC[C@H]1C=CCC1)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875140174	GF	On-Demand	Anodyne	HTR4	32	42
O=C(NCCC[C@H]1C=CCC1)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875140174	GF	On-Demand	Anodyne	CCR3	31	42
O=C(NCCC[C@H]1C=CCC1)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875140176	GF	On-Demand	Anodyne	HTR4	32	42
O=C(NCCC[C@H]1C=CCC1)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875140176	GF	On-Demand	Anodyne	CCR3	31	42
O=C(NCCC[C@@H]1C=CCC1)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875140178	GF	On-Demand	Anodyne	HTR4	32	42
O=C(NCCC[C@@H]1C=CCC1)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875140178	GF	On-Demand	Anodyne	CCR3	31	42
CC(=O)C1CCN(C(=O)NCCN2C(=O)c3ccccc3C2=O)CC1	ZINC000875140214	ED	On-Demand	Anodyne	HTR4	25	42
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(c3ccccc3)CC2)C1	ZINC000875140229	FE	On-Demand	Anodyne	CHRM1	16	42
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(c3ccccc3)CC2)C1	ZINC000875140229	FE	On-Demand	Anodyne	ACE	36	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(c3ccccc3)CC2)C1	ZINC000875140229	FE	On-Demand	Anodyne	P2RY12	89	36
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(c3ccccc3)CC2)C1	ZINC000875140229	FE	On-Demand	Anodyne	EPHX2	25	44
Cc1ccc([C@H](C)NC(=O)N(Cc2cccc(O)c2)[C@@H]2CC[C@@H](O)CC2)s1	ZINC000875140241	GI	On-Demand	Anodyne	HSD17B2	19	41
C=CCCC(C)(C)CNC(=O)C(=O)N[C@@H](C)c1cccc(N2CCOC2=O)c1	ZINC000875140246	GF	On-Demand	Mild	KCNQ2	16	45
C=CCCC(C)(C)CNC(=O)C(=O)N[C@H](C)c1cccc(N2CCOC2=O)c1	ZINC000875140247	GF	On-Demand	Mild	KCNQ2	16	45
O=C(NCC[C@H](O)C1CCCC1)NC1CCN(c2ccccc2)CC1	ZINC000875140251	EF	On-Demand	Anodyne	EPHX2	34	50
O=C(NCC[C@@H](O)C1CCCC1)NC1CCN(c2ccccc2)CC1	ZINC000875140253	EF	On-Demand	Anodyne	EPHX2	34	50
O=C(NCc1ccc(N2CCCCC2=O)cc1)N1CCC(CO)(CO)CC1	ZINC000875140282	GD	On-Demand	Anodyne	NAMPT	17	40
O=C(NCCS(=O)(=O)c1ccc(Cl)cc1)N1CCC2(CCNC2=O)CC1	ZINC000875140288	GD	On-Demand	Anodyne	CACNA1H	47	34
O=C(NC1CCN(c2ccccc2)CC1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875140298	FH	On-Demand	Anodyne	EPHX2	35	60
O=C(NCC1CCSCC1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875140336	FD	On-Demand	Anodyne	F2	27	42
O=C(NCC1CCSCC1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875140337	FD	On-Demand	Anodyne	F2	27	42
O=C(NCC1CCSCC1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875140338	FD	On-Demand	Anodyne	F2	27	42
O=C(NCC1CCSCC1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875140339	FD	On-Demand	Anodyne	F2	27	42
O=C(NCc1ccc(N2CCOCC2)cc1)N1CC=CC1	ZINC000875140341	CD	On-Demand	Clean	AKR1C3	17	43
O=C(NCc1ccc(N2CCOCC2)cc1)N1CC=CC1	ZINC000875140341	CD	On-Demand	Clean	STAT6	66	39
O=C(NCc1ccc(N2CCOCC2)cc1)N1CC=CC1	ZINC000875140341	CD	On-Demand	Clean	NAMPT	32	43
COC(=O)C1(O)CN(C(=O)NCc2ccc(N3CCOCC3)cc2)C1	ZINC000875140344	EB	On-Demand	Clean	STAT6	56	35
COC(=O)C1(O)CN(C(=O)NCc2ccc(N3CCOCC3)cc2)C1	ZINC000875140344	EB	On-Demand	Clean	NAMPT	29	40
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1CCCOc2ccc(F)cc21	ZINC000875140370	GG	On-Demand	Anodyne	ACKR3	47	34
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1CCCOc2ccc(F)cc21	ZINC000875140371	GG	On-Demand	Anodyne	ACKR3	47	34
O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875140372	FC	On-Demand	Clean	STAT6	62	38
O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875140372	FC	On-Demand	Clean	NAMPT	28	40
O=C(NCc1ccc(N2CCOCC2)cc1)N(C1CC1)C1CC1	ZINC000875140373	DE	On-Demand	Clean	STAT6	53	36
O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875140385	GG	On-Demand	Clean	EPHX2	20	42
O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875140386	GG	On-Demand	Clean	EPHX2	20	42
O=C(NCc1ccc(N2CCOCC2)cc1)N[C@]12CCCC[C@@H]1C2	ZINC000875140392	EF	On-Demand	Clean	STAT6	43	34
O=C(NCc1ccc(N2CCOCC2)cc1)N[C@]12CCCC[C@H]1C2	ZINC000875140393	EF	On-Demand	Clean	STAT6	43	34
O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@]12CCCC[C@H]1C2	ZINC000875140394	EF	On-Demand	Clean	STAT6	43	34
O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@]12CCCC[C@@H]1C2	ZINC000875140395	EF	On-Demand	Clean	STAT6	43	34
COc1cc(CNC(=O)N2CC3(CC(=O)N3Cc3ccccc3)C2)ccc1C	ZINC000875140412	GF	On-Demand	Anodyne	TSHR	48	32
COc1cc(CNC(=O)N2CC3(CC(=O)N3Cc3ccccc3)C2)ccc1C	ZINC000875140412	GF	On-Demand	Anodyne	ACHE	16	41
COc1cc(CNC(=O)N2CC3(CC(=O)N3Cc3ccccc3)C2)ccc1C	ZINC000875140412	GF	On-Demand	Anodyne	BCHE	19	41
O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC[C@@H]1Cn1ccnc1	ZINC000875140414	FE	On-Demand	Clean	NOS2	46	36
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875140429	GD	On-Demand	Anodyne	DRD4	18	42
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875140429	GD	On-Demand	Anodyne	ACHE	22	40
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875140429	GD	On-Demand	Anodyne	OPRM1	17	44
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875140429	GD	On-Demand	Anodyne	HTR4	47	45
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875140429	GD	On-Demand	Anodyne	SIGMAR1	30	42
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875140429	GD	On-Demand	Anodyne	CCR3	26	40
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875140429	GD	On-Demand	Anodyne	CACNA1I	50	36
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875140431	GD	On-Demand	Anodyne	DRD4	18	42
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875140431	GD	On-Demand	Anodyne	ACHE	22	40
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875140431	GD	On-Demand	Anodyne	OPRM1	17	44
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875140431	GD	On-Demand	Anodyne	HTR4	47	45
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875140431	GD	On-Demand	Anodyne	SIGMAR1	30	42
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875140431	GD	On-Demand	Anodyne	CCR3	26	40
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875140431	GD	On-Demand	Anodyne	CACNA1I	50	36
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1cccc(CN2CCCCCC2)c1	ZINC000875140432	GE	On-Demand	Mild	HRH2	41	46
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1cccc(CN2CCCCCC2)c1	ZINC000875140432	GE	On-Demand	Mild	CHRM3	15	40
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1cccc(CN2CCCCCC2)c1	ZINC000875140433	GE	On-Demand	Mild	HRH2	41	46
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1cccc(CN2CCCCCC2)c1	ZINC000875140433	GE	On-Demand	Mild	CHRM3	15	40
C#CC[C@@H](COC)NC(=O)C(=O)NCc1ccc(CN2CCCCCC2)cc1	ZINC000875140437	GD	On-Demand	Mild	HRH3	21	43
C#CC[C@H](COC)NC(=O)C(=O)NCc1ccc(CN2CCCCCC2)cc1	ZINC000875140438	GD	On-Demand	Mild	HRH3	21	43
CN(CCNC(=O)N[C@H]1CCN(CC(C)(C)O)C1)Cc1ccccc1	ZINC000875140448	ED	On-Demand	Anodyne	DRD4	24	43
CN(CCNC(=O)N[C@H]1CCN(CC(C)(C)O)C1)Cc1ccccc1	ZINC000875140448	ED	On-Demand	Anodyne	CCR3	26	40
CN(CCNC(=O)N[C@H]1CCN(CC(C)(C)O)C1)Cc1ccccc1	ZINC000875140448	ED	On-Demand	Anodyne	CCR5	15	41
COC(=O)C1(O)CN(C(=O)NCc2ccc(F)cc2Br)C1	ZINC000875140500	FD	On-Demand	Anodyne	P2RX7	37	47
CCCCCCCNC(=O)C(=O)NC1CCN(CC(F)F)CC1	ZINC000875140505	ED	On-Demand	Mild	EPHX2	20	55
CCCCCCCNC(=O)C(=O)NC1CCN(CC(F)F)CC1	ZINC000875140505	ED	On-Demand	Mild	ASAH1	72	36
O=C(NC1CCN(c2ccccc2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875140515	FG	On-Demand	Anodyne	EPHX2	35	43
O=C(NC1CCN(c2ccccc2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875140515	FG	On-Demand	Anodyne	SFRP1	42	35
O=C(NC1CCN(c2ccccc2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875140516	FG	On-Demand	Anodyne	EPHX2	35	43
O=C(NC1CCN(c2ccccc2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875140516	FG	On-Demand	Anodyne	SFRP1	42	35
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCc1ccc2c(c1)OCCCO2	ZINC000875140527	GD	On-Demand	Anodyne	NOS2	74	33
Cc1ccc([C@H](C)NC(=O)N2CCc3nc(C4CC4)ncc3C2)s1	ZINC000875140528	EH	On-Demand	Anodyne	MAPK1	52	37
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCc1ccc2c(c1)OCCCO2	ZINC000875140530	GD	On-Demand	Anodyne	NOS2	74	33
COC(=O)[C@@]12C[C@@H](NC(=O)NCCc3cc(OC)ccc3OC)C[C@@H]1C2	ZINC000875140534	FD	On-Demand	Anodyne	MTNR1A	63	41
COC(=O)[C@@]12C[C@@H](NC(=O)NCCc3cc(OC)ccc3OC)C[C@@H]1C2	ZINC000875140534	FD	On-Demand	Anodyne	MTNR1B	49	46
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(c2ccccc2)CC1	ZINC000875140558	DD	On-Demand	Anodyne	EPHX2	43	56
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCN1C(=O)c2ccccc2C1=O	ZINC000875140559	FD	On-Demand	Anodyne	SLC6A4	29	51
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCN1C(=O)c2ccccc2C1=O	ZINC000875140559	FD	On-Demand	Anodyne	SLC6A3	60	51
CC(=O)C1CCN(C(=O)NCCS(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000875140563	FE	On-Demand	Anodyne	F10	17	40
CC(=O)C1CCN(C(=O)NCCS(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000875140563	FE	On-Demand	Anodyne	APP	41	36
CC(=O)C1CCN(C(=O)NCCS(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000875140563	FE	On-Demand	Anodyne	EPHX2	20	50
C[C@H](NC(=O)NC1CCN(c2ccccc2)CC1)c1ccccc1O	ZINC000875140576	EG	On-Demand	Clean	EPHX2	32	52
C[C@@H](NC(=O)NC1CCN(c2ccccc2)CC1)c1ccccc1O	ZINC000875140577	EG	On-Demand	Clean	EPHX2	32	52
C=CC(C)(C)CCNC(=O)C(=O)N[C@@H](C)c1cccc(N2CCOC2=O)c1	ZINC000875140587	FF	On-Demand	Mild	KCNQ2	16	41
C=CC(C)(C)CCNC(=O)C(=O)N[C@H](C)c1cccc(N2CCOC2=O)c1	ZINC000875140588	FF	On-Demand	Mild	KCNQ2	16	41
O=C(N[C@@H]1CCCCc2ccccc21)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875140597	FF	On-Demand	Anodyne	XIAP	23	41
O=C(N[C@@H]1CCCCc2ccccc21)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875140598	FF	On-Demand	Anodyne	XIAP	23	41
O=C(N[C@@H](C1CCC1)[C@@H]1CCOC1)C(=O)N[C@@H]1CCCCc2ccccc21	ZINC000875140599	FF	On-Demand	Anodyne	XIAP	23	41
O=C(N[C@@H](C1CCC1)[C@H]1CCOC1)C(=O)N[C@@H]1CCCCc2ccccc21	ZINC000875140600	FF	On-Demand	Anodyne	XIAP	23	41
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc4c(c3)OCCCO4)CC[C@@H]21	ZINC000875140602	FD	On-Demand	Anodyne	NOS2	79	34
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc4c(c3)OCCCO4)CC[C@H]21	ZINC000875140604	FD	On-Demand	Anodyne	NOS2	79	34
O=C(NCc1ccc(N2CCOCC2)cc1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875140630	GF	On-Demand	Clean	STAT6	65	40
O=C(NCc1ccc(N2CCOCC2)cc1)N[C@H]1COC[C@H]1O	ZINC000875140636	DC	On-Demand	Clean	STAT6	52	35
O=C(NCc1ccc(N2CCOCC2)cc1)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875140654	GD	On-Demand	Clean	STAT6	42	32
O=C(NCc1ccc(N2CCOCC2)cc1)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875140655	GD	On-Demand	Clean	STAT6	42	32
O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875140670	GF	On-Demand	Clean	NPSR1	26	40
O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875140670	GF	On-Demand	Clean	STAT6	49	38
O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875140671	GF	On-Demand	Clean	NPSR1	26	40
O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875140671	GF	On-Demand	Clean	STAT6	49	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C)c(OC)c1	ZINC000875140676	EE	On-Demand	Anodyne	SLC6A3	55	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C)c(OC)c1	ZINC000875140677	EE	On-Demand	Anodyne	SLC6A3	55	39
CC[C@@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)[C@H](O)c1ccccc1	ZINC000875140692	GF	On-Demand	Clean	KCNQ2	15	40
CC[C@@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)[C@H](O)c1ccccc1	ZINC000875140692	GF	On-Demand	Clean	STAT6	41	36
CC[C@@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)[C@@H](O)c1ccccc1	ZINC000875140693	GF	On-Demand	Clean	KCNQ2	15	40
CC[C@@H](NC(=O)NCc1ccc(N2CCOCC2)cc1)[C@@H](O)c1ccccc1	ZINC000875140693	GF	On-Demand	Clean	STAT6	41	36
O=C(NCc1ccc(N2CCOCC2)cc1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875140697	GE	On-Demand	Clean	STAT6	48	34
O=C(NCc1ccc(N2CCOCC2)cc1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875140698	GE	On-Demand	Clean	STAT6	48	34
COC(=O)C1=NO[C@@]2(CCN(C(=O)NCCc3cc(OC)ccc3OC)C2)C1	ZINC000875140733	GD	On-Demand	Anodyne	MTNR1A	49	36
COC(=O)C1=NO[C@@]2(CCN(C(=O)NCCc3cc(OC)ccc3OC)C2)C1	ZINC000875140733	GD	On-Demand	Anodyne	MTNR1B	39	41
COC(=O)C1=NO[C@]2(CCN(C(=O)NCCc3cc(OC)ccc3OC)C2)C1	ZINC000875140734	GD	On-Demand	Anodyne	MTNR1A	49	36
COC(=O)C1=NO[C@]2(CCN(C(=O)NCCc3cc(OC)ccc3OC)C2)C1	ZINC000875140734	GD	On-Demand	Anodyne	MTNR1B	39	41
O=C(NCc1ccc(F)cc1Br)N1CCC(CO)(CO)CC1	ZINC000875140742	GD	On-Demand	Anodyne	P2RX7	24	46
O=C(NC1CCN(CC(F)F)CC1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875140747	GD	On-Demand	Anodyne	OXTR	48	35
O=C(NC1CCN(CC(F)F)CC1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875140747	GD	On-Demand	Anodyne	SIGMAR1	21	40
O=C(NC1CCN(CC(F)F)CC1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875140748	GD	On-Demand	Anodyne	OXTR	48	35
O=C(NC1CCN(CC(F)F)CC1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875140748	GD	On-Demand	Anodyne	SIGMAR1	21	40
Cc1ccc([C@@H](C)NC(=O)N[C@@H]2Cc3ccccc3NC2=O)s1	ZINC000875140753	EF	On-Demand	Anodyne	PYGL	23	49
Cc1ccc([C@@H](C)NC(=O)N[C@@H]2Cc3ccccc3NC2=O)s1	ZINC000875140753	EF	On-Demand	Anodyne	PYGM	28	43
Cc1ccc([C@H](C)NC(=O)N[C@H]2Cc3ccccc3NC2=O)s1	ZINC000875140754	EF	On-Demand	Anodyne	PYGL	23	49
Cc1ccc([C@H](C)NC(=O)N[C@H]2Cc3ccccc3NC2=O)s1	ZINC000875140754	EF	On-Demand	Anodyne	PYGM	28	43
Cc1ccc([C@@H](C)NC(=O)N[C@H]2Cc3ccccc3NC2=O)s1	ZINC000875140755	EF	On-Demand	Anodyne	PYGL	23	49
Cc1ccc([C@@H](C)NC(=O)N[C@H]2Cc3ccccc3NC2=O)s1	ZINC000875140755	EF	On-Demand	Anodyne	PYGM	28	43
Cc1ccc([C@H](C)NC(=O)N[C@@H]2Cc3ccccc3NC2=O)s1	ZINC000875140756	EF	On-Demand	Anodyne	PYGL	23	49
Cc1ccc([C@H](C)NC(=O)N[C@@H]2Cc3ccccc3NC2=O)s1	ZINC000875140756	EF	On-Demand	Anodyne	PYGM	28	43
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875140777	GD	On-Demand	Anodyne	ACHE	29	44
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875140777	GD	On-Demand	Anodyne	HTR4	24	43
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875140777	GD	On-Demand	Anodyne	SIGMAR1	27	42
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875140777	GD	On-Demand	Anodyne	CCR3	18	40
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875140778	GD	On-Demand	Anodyne	ACHE	29	44
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875140778	GD	On-Demand	Anodyne	HTR4	24	43
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875140778	GD	On-Demand	Anodyne	SIGMAR1	27	42
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875140778	GD	On-Demand	Anodyne	CCR3	18	40
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875140779	GD	On-Demand	Anodyne	ACHE	29	44
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875140779	GD	On-Demand	Anodyne	HTR4	24	43
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875140779	GD	On-Demand	Anodyne	SIGMAR1	27	42
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875140779	GD	On-Demand	Anodyne	CCR3	18	40
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875140780	GD	On-Demand	Anodyne	ACHE	29	44
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875140780	GD	On-Demand	Anodyne	HTR4	24	43
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875140780	GD	On-Demand	Anodyne	SIGMAR1	27	42
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875140780	GD	On-Demand	Anodyne	CCR3	18	40
O=C(NCc1ccc(N2CCCCC2=O)cc1)N1Cc2cccc(O)c2C1	ZINC000875140783	FG	On-Demand	Clean	NAMPT	24	47
COC(=O)N(C)NC(=O)NCCN(C)Cc1ccccc1	ZINC000875140786	CD	On-Demand	Reactive	LTA4H	22	43
CN1CCN(C2CCN(C(=O)NCCN3C(=O)c4ccccc4C3=O)CC2)CC1	ZINC000875140793	GC	On-Demand	Anodyne	HTR4	16	45
CN1CCN(C2CCN(C(=O)NCCN3C(=O)c4ccccc4C3=O)CC2)CC1	ZINC000875140793	GC	On-Demand	Anodyne	PLD1	41	35
CN1CCN(C2CCN(C(=O)NCCN3C(=O)c4ccccc4C3=O)CC2)CC1	ZINC000875140793	GC	On-Demand	Anodyne	L3MBTL3	77	43
C[S@](=N)(=O)N1CCN(C(=O)NC2CCN(c3ccccc3)CC2)CC1	ZINC000875140811	FD	On-Demand	Anodyne	NPY5R	15	56
C[S@](=N)(=O)N1CCN(C(=O)NC2CCN(c3ccccc3)CC2)CC1	ZINC000875140811	FD	On-Demand	Anodyne	EPHX2	43	49
C[S@](=N)(=O)N1CCN(C(=O)NC2CCN(c3ccccc3)CC2)CC1	ZINC000875140811	FD	On-Demand	Anodyne	SFRP1	47	37
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(C)c(OC)c1	ZINC000875140854	CE	On-Demand	Anodyne	ANPEP	15	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(C)c(OC)c1	ZINC000875140854	CE	On-Demand	Anodyne	TRPV1	23	40
O=C(NC1CCN(c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875140855	EG	On-Demand	Clean	EPHX2	23	48
CONC(=O)C1CCN(C(=O)NCc2ccc(C)c(OC)c2)CC1	ZINC000875140877	ED	On-Demand	Anodyne	HTR4	18	40
CONC(=O)C1CCN(C(=O)NCc2ccc(C)c(OC)c2)CC1	ZINC000875140877	ED	On-Demand	Anodyne	EPHX2	27	45
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCCCc2ccccc21	ZINC000875140882	EE	On-Demand	Mild	BIRC2	47	35
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H]1CCCCc2ccccc21	ZINC000875140883	EE	On-Demand	Mild	BIRC2	47	35
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCCCc2ccccc21	ZINC000875140885	EE	On-Demand	Mild	BIRC2	47	35
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H]1CCCCc2ccccc21	ZINC000875140887	EE	On-Demand	Mild	BIRC2	47	35
O=C(NC1CCN(c2ccccc2)CC1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875140889	EG	On-Demand	Anodyne	EPHX2	31	46
O=C(NC1CCN(c2ccccc2)CC1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875140891	EG	On-Demand	Anodyne	EPHX2	31	46
O=C(NC1CCN(c2ccccc2)CC1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875140893	EG	On-Demand	Anodyne	EPHX2	31	46
O=C(NC1CCN(c2ccccc2)CC1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875140895	EG	On-Demand	Anodyne	EPHX2	31	46
CCCCCCCNC(=O)C(=O)NCc1ccc2c(c1)OCCCO2	ZINC000875140909	EF	On-Demand	Mild	ASAH1	58	33
C[C@@]1(CO)CN(C(=O)NCc2ccc(N3CCOCC3)cc2)C[C@]1(C)CO	ZINC000875140945	GD	On-Demand	Clean	AKR1C3	15	42
C[C@@]1(CO)CN(C(=O)NCc2ccc(N3CCOCC3)cc2)C[C@]1(C)CO	ZINC000875140945	GD	On-Demand	Clean	STAT6	63	38
C[C@@]1(CO)CN(C(=O)NCc2ccc(N3CCOCC3)cc2)C[C@]1(C)CO	ZINC000875140945	GD	On-Demand	Clean	NAMPT	32	42
O=C(NCC1CCSCC1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875140948	GE	On-Demand	Anodyne	SMO	31	43
O=C(NCC1CCSCC1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875140948	GE	On-Demand	Anodyne	ETHR	62	48
O=C(NCC1CCSCC1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875140955	FE	On-Demand	Anodyne	OXTR	53	38
O=C(NCC1CCSCC1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875140958	FE	On-Demand	Anodyne	OXTR	53	38
O=C(NCc1ccc(N2CCOCC2)cc1)NC1CN(c2ccncn2)C1	ZINC000875140966	FD	On-Demand	Clean	STAT6	47	36
O=C(NCc1ccc(N2CCOCC2)cc1)NC1CN(c2ccncn2)C1	ZINC000875140966	FD	On-Demand	Clean	NAMPT	27	40
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(c2ccccc2)CC1	ZINC000875140968	DF	On-Demand	Anodyne	EPHX2	28	49
O=C(NCc1ccc(N2CCOCC2)cc1)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875140971	ED	On-Demand	Clean	STAT6	53	36
COc1cc(CNC(=O)N2CCC(N3CCN(C)CC3)CC2)ccc1C	ZINC000875140973	FD	On-Demand	Anodyne	CCR3	23	40
COc1cc(CNC(=O)N2CCC(N3CCN(C)CC3)CC2)ccc1C	ZINC000875140973	FD	On-Demand	Anodyne	L3MBTL3	73	40
O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875140975	GF	On-Demand	Clean	F2	30	40
O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875140975	GF	On-Demand	Clean	PREP	23	44
O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875140975	GF	On-Demand	Clean	TMPRSS11D	64	39
O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875140977	GF	On-Demand	Clean	F2	30	40
O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875140977	GF	On-Demand	Clean	PREP	23	44
O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875140977	GF	On-Demand	Clean	TMPRSS11D	64	39
O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875140979	GF	On-Demand	Clean	F2	30	40
O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875140979	GF	On-Demand	Clean	PREP	23	44
O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875140979	GF	On-Demand	Clean	TMPRSS11D	64	39
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccc3c(c2)OCCCO3)C1	ZINC000875140980	FD	On-Demand	Anodyne	NOS2	57	33
O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875140981	GF	On-Demand	Clean	F2	30	40
O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875140981	GF	On-Demand	Clean	PREP	23	44
O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875140981	GF	On-Demand	Clean	TMPRSS11D	64	39
C[C@]1(C(F)(F)F)CCN(C(=O)NC2CCN(c3ccccc3)CC2)C1	ZINC000875140983	FH	On-Demand	Anodyne	EPHX2	43	43
C[C@]1(C(F)(F)F)CCN(C(=O)NC2CCN(c3ccccc3)CC2)C1	ZINC000875140983	FH	On-Demand	Anodyne	SFRP1	109	41
C[C@]1(C(F)(F)F)CCN(C(=O)NC2CCN(c3ccccc3)CC2)C1	ZINC000875140983	FH	On-Demand	Anodyne	WNT3	69	34
CS(=O)(=O)NC1CN(C(=O)NCc2ccc(N3CCOCC3)cc2)C1	ZINC000875140984	FB	On-Demand	Clean	NAMPT	35	42
CC(=O)N(C)c1ccc(CNC(=O)NC2CCN(c3ccccc3)CC2)cc1	ZINC000875140986	GG	On-Demand	Anodyne	EPHX2	25	49
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN(c2ccccc2)CC1	ZINC000875141004	FH	On-Demand	Anodyne	DRD4	23	41
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN(c2ccccc2)CC1	ZINC000875141004	FH	On-Demand	Anodyne	DRD3	15	41
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN(c2ccccc2)CC1	ZINC000875141004	FH	On-Demand	Anodyne	SIGMAR1	18	57
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN(c2ccccc2)CC1	ZINC000875141004	FH	On-Demand	Anodyne	EPHX2	31	50
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN(c2ccccc2)CC1	ZINC000875141004	FH	On-Demand	Anodyne	MCHR1	15	43
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN(c2ccccc2)CC1	ZINC000875141004	FH	On-Demand	Anodyne	NCE103	16	49
CCOC(=O)c1cc(CNC(=O)NC2CCN(c3ccccc3)CC2)on1	ZINC000875141019	FE	On-Demand	Anodyne	P2RY12	57	37
CCOC(=O)c1cc(CNC(=O)NC2CCN(c3ccccc3)CC2)on1	ZINC000875141019	FE	On-Demand	Anodyne	NPY1R	22	40
CCOC(=O)c1cc(CNC(=O)NC2CCN(c3ccccc3)CC2)on1	ZINC000875141019	FE	On-Demand	Anodyne	EPHX2	22	44
COc1cc(CNC(=O)N2CCC[C@@H](C(C)=O)C2)ccc1C	ZINC000875141020	DF	On-Demand	Anodyne	DPP7	51	40
COC(=O)[C@@]1(OC)CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)C1	ZINC000875141024	GC	On-Demand	Clean	STAT6	57	35
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cc(OC)ccc1OC	ZINC000875141045	FD	On-Demand	Anodyne	MTNR1A	76	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cc(OC)ccc1OC	ZINC000875141045	FD	On-Demand	Anodyne	MTNR1B	63	46
COc1cc(CNC(=O)N2CCC(c3nc(C4CCC4)no3)CC2)ccc1C	ZINC000875141048	GH	On-Demand	Anodyne	EPHX2	15	40
COc1cc(CNC(=O)N2CCC(c3nc(C4CCC4)no3)CC2)ccc1C	ZINC000875141048	GH	On-Demand	Anodyne	SMO	37	42
COc1cc(CNC(=O)N2CCC(c3nc(C4CCC4)no3)CC2)ccc1C	ZINC000875141048	GH	On-Demand	Anodyne	ETHR	60	43
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NC2CCN(CC(F)F)CC2)c1	ZINC000875141058	GD	On-Demand	Anodyne	SSTR5	34	45
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NC2CCN(CC(F)F)CC2)c1	ZINC000875141061	GD	On-Demand	Anodyne	SSTR5	34	45
COc1cc(CNC(=O)N2CCC(NC(=O)c3cccc(C)c3)CC2)ccc1C	ZINC000875141064	GG	On-Demand	Anodyne	DRD2	22	49
COc1cc(CNC(=O)N2CCC(NC(=O)c3cccc(C)c3)CC2)ccc1C	ZINC000875141064	GG	On-Demand	Anodyne	DRD4	45	37
COc1cc(CNC(=O)N2CCC(NC(=O)c3cccc(C)c3)CC2)ccc1C	ZINC000875141064	GG	On-Demand	Anodyne	DRD3	25	40
COc1cc(CNC(=O)N2CCC(NC(=O)c3cccc(C)c3)CC2)ccc1C	ZINC000875141064	GG	On-Demand	Anodyne	MAPK14	27	49
COc1cc(CNC(=O)N2CCC(NC(=O)c3cccc(C)c3)CC2)ccc1C	ZINC000875141064	GG	On-Demand	Anodyne	SSTR5	51	46
COc1cc(CNC(=O)N2CCC(NC(=O)c3cccc(C)c3)CC2)ccc1C	ZINC000875141064	GG	On-Demand	Anodyne	CCR2	25	42
COc1cc(CNC(=O)N2CCC(NC(=O)c3cccc(C)c3)CC2)ccc1C	ZINC000875141064	GG	On-Demand	Anodyne	EPHX2	24	42
COc1cc(CNC(=O)N2CCC(NC(=O)c3cccc(C)c3)CC2)ccc1C	ZINC000875141064	GG	On-Demand	Anodyne	MCHR1	26	48
COc1cc(CNC(=O)N2CCC(NC(=O)c3cccc(C)c3)CC2)ccc1C	ZINC000875141064	GG	On-Demand	Anodyne	KCNK3	51	38
COc1cc(CNC(=O)N2CCC(NC(=O)c3cccc(C)c3)CC2)ccc1C	ZINC000875141064	GG	On-Demand	Anodyne	KCNK9	41	37
CN(CCNC(=O)N1CCC[C@H](C(C)(C)O)C1)Cc1ccccc1	ZINC000875141067	EE	On-Demand	Anodyne	AMY2	47	33
CN(CCNC(=O)N1CCC[C@@H](C(C)(C)O)C1)Cc1ccccc1	ZINC000875141068	EE	On-Demand	Anodyne	AMY2	47	33
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(F)cc2Br)C1	ZINC000875141079	GF	On-Demand	Anodyne	P2RX7	36	45
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(CN3CCCCCC3)c2)CC1	ZINC000875141095	GF	On-Demand	Anodyne	HRH2	39	43
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(CN3CCCCCC3)c2)CC1	ZINC000875141095	GF	On-Demand	Anodyne	CHRM3	22	43
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(CN3CCCCCC3)c2)CC1	ZINC000875141095	GF	On-Demand	Anodyne	HRH3	24	42
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(CN3CCCCCC3)c2)CC1	ZINC000875141095	GF	On-Demand	Anodyne	SIGMAR1	26	45
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(CN3CCCCCC3)c2)CC1	ZINC000875141095	GF	On-Demand	Anodyne	BDKRB1	44	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCN(C)Cc1ccccc1	ZINC000875141096	ED	On-Demand	Anodyne	SLC6A4	23	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCN(C)Cc1ccccc1	ZINC000875141096	ED	On-Demand	Anodyne	SLC6A3	49	42
CC(=O)C1CCN(C(=O)NC2CCN(c3ccc(C(C)(C)C)cc3)CC2)CC1	ZINC000875141106	GH	On-Demand	Anodyne	EPHX2	35	42
O=C(NCc1ccc(N2CCOCC2)cc1)N1CCc2nc(C3CC3)ncc2C1	ZINC000875141114	GE	On-Demand	Clean	MAPK1	18	43
O=C(NCc1ccc(N2CCOCC2)cc1)N1CCc2nc(C3CC3)ncc2C1	ZINC000875141114	GE	On-Demand	Clean	STAT6	57	35
O=C(NCc1ccc(N2CCOCC2)cc1)N1CCc2nc(C3CC3)ncc2C1	ZINC000875141114	GE	On-Demand	Clean	NAMPT	37	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(N2CCOCC2)cc1	ZINC000875141137	FD	On-Demand	Clean	SLC6A3	42	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(N2CCOCC2)cc1	ZINC000875141140	FD	On-Demand	Clean	SLC6A3	42	37
O=C(NCc1ccc(F)cc1Br)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875141147	GG	On-Demand	Anodyne	P2RX7	17	45
O=C(NCc1ccc(F)cc1Br)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875141148	GG	On-Demand	Anodyne	P2RX7	17	45
O=C(NCc1ccc(N2CCOCC2)cc1)N1CC(c2ccccc2)C1	ZINC000875141168	FF	On-Demand	Clean	EPHX2	15	40
O=C(NCc1ccc(N2CCOCC2)cc1)N1CC(c2ccccc2)C1	ZINC000875141168	FF	On-Demand	Clean	NPSR1	28	43
O=C(NCc1ccc(N2CCOCC2)cc1)N1CC(c2ccccc2)C1	ZINC000875141168	FF	On-Demand	Clean	STAT6	55	40
O=C(NCc1ccc(N2CCOCC2)cc1)N1CC(c2ccccc2)C1	ZINC000875141168	FF	On-Demand	Clean	NAMPT	27	41
O=C(NCC[C@H](O)C(F)F)NCc1ccc(N2CCOCC2)cc1	ZINC000875141199	ED	On-Demand	Clean	STAT6	48	33
O=C(NCC[C@@H](O)C(F)F)NCc1ccc(N2CCOCC2)cc1	ZINC000875141200	ED	On-Demand	Clean	STAT6	48	33
COC(=O)C1(O)CN(C(=O)NC2CCN(c3ccccc3)CC2)C1	ZINC000875141222	EC	On-Demand	Anodyne	EPHX2	25	45
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCc2ccc3c(c2)OCCCO3)c1	ZINC000875141225	GF	On-Demand	Anodyne	NOS2	80	40
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCc2ccc3c(c2)OCCCO3)c1	ZINC000875141226	GF	On-Demand	Anodyne	NOS2	80	40
COC(=O)N(C)NC(=O)NC1CCN(c2ccccc2)CC1	ZINC000875141228	DD	On-Demand	Reactive	EPHX2	38	54
C[C@]1(C(F)(F)F)CCN(C(=O)NCCN2C(=O)c3ccccc3C2=O)C1	ZINC000875141265	FE	On-Demand	Anodyne	EPHX2	18	40
COCCN(CC1CCN(C)CC1)C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875141291	GF	On-Demand	Anodyne	DRD3	16	47
O=C(NC1CCN(c2ccccc2)CC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875141307	GF	On-Demand	Anodyne	SMO	40	44
O=C(NC1CCN(c2ccccc2)CC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875141307	GF	On-Demand	Anodyne	ETHR	52	35
O=C(NC1CCN(c2ccccc2)CC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875141308	GF	On-Demand	Anodyne	SMO	40	44
O=C(NC1CCN(c2ccccc2)CC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875141308	GF	On-Demand	Anodyne	ETHR	52	35
CN(CCNC(=O)N1CCCN(C=O)CC1)Cc1ccccc1	ZINC000875141323	DC	On-Demand	Anodyne	Q6PRC7_IXORI	42	38
COc1cc(CNC(=O)N(C)OCC(F)(F)F)ccc1C	ZINC000875141362	DF	On-Demand	Anodyne	TRPV1	18	40
COc1cc(CNC(=O)N(C)OCC(F)(F)F)ccc1C	ZINC000875141362	DF	On-Demand	Anodyne	MT-ND1	24	40
COc1cc(CNC(=O)N2CCC(C(=O)NCCO)CC2)ccc1C	ZINC000875141372	ED	On-Demand	Anodyne	EPHX2	27	49
COc1cc(CNC(=O)N2CCC(C(=O)NCCO)CC2)ccc1C	ZINC000875141372	ED	On-Demand	Anodyne	CACNA1G	19	40
O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@H]1COCC[C@H]1O	ZINC000875141390	EC	On-Demand	Clean	STAT6	47	34
CC[C@H](C[C@H](C)O)NC(=O)NCCc1cc(OC)ccc1OC	ZINC000875141393	DE	On-Demand	Anodyne	NQO2	37	43
CC[C@H](C[C@H](C)O)NC(=O)NCCc1cc(OC)ccc1OC	ZINC000875141393	DE	On-Demand	Anodyne	MTNR1A	93	47
CC[C@H](C[C@H](C)O)NC(=O)NCCc1cc(OC)ccc1OC	ZINC000875141393	DE	On-Demand	Anodyne	MTNR1B	72	50
CN(CCNC(=O)N1CC[C@H](C(C)(C)O)C1)Cc1ccccc1	ZINC000875141401	DD	On-Demand	Anodyne	SIGMAR1	17	40
CN(CCNC(=O)N1CC[C@@H](C(C)(C)O)C1)Cc1ccccc1	ZINC000875141402	DD	On-Demand	Anodyne	SIGMAR1	17	40
O=C(NCc1ccc(N2CCOCC2)cc1)N1CC(Cc2cccs2)C1	ZINC000875141415	FF	On-Demand	Clean	STAT6	47	35
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(N2CCOCC2)cc1	ZINC000875141441	FE	On-Demand	Clean	STAT6	51	34
Cc1nnc(NNC(=O)NCc2ccc(N3CCOCC3)cc2)n1C	ZINC000875141461	EC	On-Demand	Reactive	STAT6	58	35
COC(=O)N(C)NC(=O)NCc1ccc(N2CCOCC2)cc1	ZINC000875141469	DC	On-Demand	Reactive	EPHB4	56	35
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)NCC1CCSCC1	ZINC000875141470	GE	On-Demand	Anodyne	ROCK1	23	42
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)NCC1CCSCC1	ZINC000875141470	GE	On-Demand	Anodyne	ROCK2	16	42
CN1CCN(C(=O)NC2CCN(c3ccccc3)CC2)CCC1(C)C	ZINC000875141497	EF	On-Demand	Anodyne	EPHX2	27	45
O=C(NC1CCN(c2ccccc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875141539	EF	On-Demand	Anodyne	EPHX2	21	65
O=C(NC1CCN(c2ccccc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875141540	EF	On-Demand	Anodyne	EPHX2	21	65
O=C(NC1CCN(c2ccccc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875141541	EF	On-Demand	Anodyne	EPHX2	21	65
O=C(NC1CCN(c2ccccc2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875141542	EF	On-Demand	Anodyne	EPHX2	21	65
C=CC(C)(C)CCCNC(=O)C(=O)N[C@@H](C)c1cccc(N2CCOC2=O)c1	ZINC000875141543	GF	On-Demand	Mild	KCNQ2	16	41
C=CC(C)(C)CCCNC(=O)C(=O)N[C@H](C)c1cccc(N2CCOC2=O)c1	ZINC000875141544	GF	On-Demand	Mild	KCNQ2	16	41
O=C(NCCO)C1CCN(C(=O)NC2CCN(c3ccccc3)CC2)CC1	ZINC000875141558	FD	On-Demand	Anodyne	EPHX2	45	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875141561	FE	On-Demand	Anodyne	SLC6A4	29	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(c2ccccc2)CC1	ZINC000875141561	FE	On-Demand	Anodyne	SLC6A3	58	45
COc1cccc([C@H](O)C2CCN(C(=O)NCc3ccc(C)c(OC)c3)CC2)c1	ZINC000875141586	GH	On-Demand	Anodyne	DRD4	43	35
COc1cccc([C@H](O)C2CCN(C(=O)NCc3ccc(C)c(OC)c3)CC2)c1	ZINC000875141586	GH	On-Demand	Anodyne	MTNR1B	44	39
COc1cc(CNC(=O)N2CCC(C(C)=O)CC2)ccc1C	ZINC000875141592	DF	On-Demand	Anodyne	EPHX2	24	43
O=CN1CCCN(C(=O)NCc2ccc(N3CCOCC3)cc2)CC1	ZINC000875141614	EC	On-Demand	Clean	AKR1C3	16	41
O=CN1CCCN(C(=O)NCc2ccc(N3CCOCC3)cc2)CC1	ZINC000875141614	EC	On-Demand	Clean	STAT6	43	36
O=C(NCc1ccc(N2CCOCC2)cc1)N1OC2CCC1CC2	ZINC000875141621	EE	On-Demand	Clean	STAT6	51	35
O=C(NCc1ccc(N2CCOCC2)cc1)N1OC2CCC1CC2	ZINC000875141621	EE	On-Demand	Clean	L3MBTL3	28	40
O=C(NCc1ccc(N2CCOCC2)cc1)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875141623	GF	On-Demand	Clean	NAMPT	29	40
O=C(NCc1ccc(N2CCOCC2)cc1)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875141624	GF	On-Demand	Clean	NAMPT	29	40
O=C(NCc1cccc2ncccc12)C(=O)NCC1CCSCC1	ZINC000875141627	EE	On-Demand	Anodyne	CDK5	17	41
C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(N2CCOCC2)cc1	ZINC000875141634	FD	On-Demand	Clean	STAT6	47	34
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(N2CCOCC2)cc1	ZINC000875141636	FD	On-Demand	Clean	STAT6	47	34
C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(N2CCOCC2)cc1	ZINC000875141637	FD	On-Demand	Clean	STAT6	47	34
CN1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)CCC1(C)C	ZINC000875141661	FE	On-Demand	Clean	STAT6	56	34
COC(=O)N(C)NC(=O)NCc1ccc(C)c(OC)c1	ZINC000875141669	CD	On-Demand	Reactive	TRPV1	17	41
COC(=O)N(C)NC(=O)NCc1ccc(C)c(OC)c1	ZINC000875141669	CD	On-Demand	Reactive	MT-ND1	23	40
O=C(NCc1ccc(N2CCOCC2)cc1)N[C@H]1Cc2cncn2C1	ZINC000875141670	ED	On-Demand	Clean	STAT6	57	36
O=C(NCc1ccc(N2CCOCC2)cc1)N[C@@H]1Cc2cncn2C1	ZINC000875141671	ED	On-Demand	Clean	STAT6	57	36
O=C(NCc1ccc(N2CCOCC2)cc1)N1Cc2cccc(O)c2C1	ZINC000875141673	FE	On-Demand	Clean	STAT6	43	34
O=C(NCc1ccc(N2CCOCC2)cc1)N1Cc2cccc(O)c2C1	ZINC000875141673	FE	On-Demand	Clean	NAMPT	33	46
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)C1	ZINC000875141676	FF	On-Demand	Anodyne	CHRM1	15	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)C1	ZINC000875141677	FF	On-Demand	Anodyne	CHRM1	15	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)C1	ZINC000875141678	FF	On-Demand	Anodyne	CHRM1	15	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)C1	ZINC000875141679	FF	On-Demand	Anodyne	CHRM1	15	43
O=C(NC1CCN(c2ccccc2)CC1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875141684	GD	On-Demand	Anodyne	EPHX2	21	42
O=C(NCc1ccc2c(c1)OCCCO2)C(=O)NCc1ncc(Cl)s1	ZINC000875141685	GD	On-Demand	Anodyne	NOS2	76	37
O=C(NCc1ccc(N2CCOCC2)cc1)N1C[C@H](O)C[C@H]1C1CC1	ZINC000875141708	ED	On-Demand	Clean	STAT6	51	34
O=C(NCc1ccc(N2CCOCC2)cc1)N1C[C@H](O)C[C@@H]1C1CC1	ZINC000875141709	ED	On-Demand	Clean	STAT6	51	34
O=C(NCc1ccc(N2CCOCC2)cc1)N1C[C@@H](O)C[C@H]1C1CC1	ZINC000875141710	ED	On-Demand	Clean	STAT6	51	34
O=C(NCc1ccc(N2CCOCC2)cc1)N1C[C@@H](O)C[C@@H]1C1CC1	ZINC000875141711	ED	On-Demand	Clean	STAT6	51	34
CN(Cc1ccns1)C(=O)NCc1ccc(N2CCOCC2)cc1	ZINC000875141713	EE	On-Demand	Clean	EPHB4	54	33
CN(Cc1ccns1)C(=O)NCc1ccc(N2CCOCC2)cc1	ZINC000875141713	EE	On-Demand	Clean	STAT6	46	34
COC(=O)N(C)NC(=O)NC1CCN(c2ccc(C(C)(C)C)cc2)CC1	ZINC000875141727	FF	On-Demand	Reactive	EPHX2	30	42
O=C(NCc1ccc(N2CCOCC2)cc1)N1CCn2nnc(CO)c2C1	ZINC000875141738	FC	On-Demand	Clean	STAT6	51	34
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H]1CCCCc2ccccc21	ZINC000875141755	ED	On-Demand	Mild	BIRC2	48	36
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CCCCc2ccccc21	ZINC000875141757	ED	On-Demand	Mild	BIRC2	48	36
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H]1CCCCc2ccccc21	ZINC000875141759	ED	On-Demand	Mild	BIRC2	48	36
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CCCCc2ccccc21	ZINC000875141761	ED	On-Demand	Mild	BIRC2	48	36
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(CN3CCC(C)CC3)c2)CC1	ZINC000875141789	GE	On-Demand	Anodyne	ACHE	22	43
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(CN3CCC(C)CC3)c2)CC1	ZINC000875141789	GE	On-Demand	Anodyne	CHRM3	22	42
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(CN3CCC(C)CC3)c2)CC1	ZINC000875141789	GE	On-Demand	Anodyne	SIGMAR1	27	46
O=C(NCc1ccc(N2CCOCC2)cc1)N1CCCC2(CC1)CC2	ZINC000875141791	EF	On-Demand	Clean	STAT6	52	35
O=C(NC1CCN(c2ccccc2)CC1)N1CCC2(CCNC2=O)CC1	ZINC000875141793	FD	On-Demand	Anodyne	EPHX2	20	43
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCC1CCSCC1)CC2	ZINC000875141811	GE	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCC1CCSCC1)CC2	ZINC000875141811	GE	On-Demand	Anodyne	MTNR1B	15	44
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCC1CCSCC1)CC2	ZINC000875141812	GE	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCC1CCSCC1)CC2	ZINC000875141812	GE	On-Demand	Anodyne	MTNR1B	15	44
CN1CCO[C@H](CN(C)C(=O)NCc2ccc(N3CCOCC3)cc2)C1	ZINC000875141815	FC	On-Demand	Clean	STAT6	42	32
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc3c(c2)OCCCO3)CC1	ZINC000875141833	FD	On-Demand	Anodyne	NOS2	85	37
COc1cc(CNC(=O)N2CCC(c3nnnn3C)CC2)ccc1C	ZINC000875141858	ED	On-Demand	Anodyne	IL2RA	49	30
O=CN1CCCN(C(=O)NC2CCN(c3ccccc3)CC2)CC1	ZINC000875141871	ED	On-Demand	Anodyne	EPHX2	22	47
O=CN1CCCN(C(=O)NC2CCN(c3ccccc3)CC2)CC1	ZINC000875141871	ED	On-Demand	Anodyne	ADAM10	33	40
COCCCCCNC(=O)C(=O)NCC1(c2cccc(Cl)c2)CCC1	ZINC000875141878	FF	On-Demand	Anodyne	KCNA3	46	43
CCC1(CC)CCCN1C(=O)NCc1ccc(N2CCOCC2)cc1	ZINC000875141893	EG	On-Demand	Clean	STAT6	56	37
CCC1(CC)CCCN1C(=O)NCc1ccc(N2CCOCC2)cc1	ZINC000875141893	EG	On-Demand	Clean	SLC12A5	45	32
O=C(NCc1ccc(N2CCOCC2)cc1)N1CCCC(F)(F)CC1	ZINC000875141925	FF	On-Demand	Clean	STAT6	54	35
O=C(NCCN1CC[C@H](O)C1)NCc1ccc(N2CCOCC2)cc1	ZINC000875141927	EC	On-Demand	Clean	CCR3	15	42
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc(N2CCOCC2)cc1	ZINC000875141929	EC	On-Demand	Clean	CCR3	15	42
COCCCCCNC(=O)C(=O)NCC1(c2ccc(Br)cc2)CC1	ZINC000875141932	GF	On-Demand	Anodyne	KCNA3	44	44
O=C(NCc1ccc(N2CCOCC2)cc1)N1CCC(CCO)(CCO)CC1	ZINC000875141933	GD	On-Demand	Clean	STAT6	52	35
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(C)c(OC)c1	ZINC000875141935	FF	On-Demand	Anodyne	ACKR3	62	32
COCCCCCNC(=O)C(=O)N1CCN(c2ccc(F)cc2C#N)CC1	ZINC000875141938	GD	On-Demand	Mild	HTR1A	18	41
COCCCCCNC(=O)C(=O)N1CCN(c2ccc(F)cc2C#N)CC1	ZINC000875141938	GD	On-Demand	Mild	DRD2	27	41
COCCCCCNC(=O)C(=O)N1CCN(c2ccc(F)cc2C#N)CC1	ZINC000875141938	GD	On-Demand	Mild	DRD4	40	32
COCCCCCNC(=O)C(=O)N1CCN(c2ccc(F)cc2C#N)CC1	ZINC000875141938	GD	On-Demand	Mild	ADRA1D	16	40
COCCCCCNC(=O)C(=O)N1CCN(c2ccc(F)cc2C#N)CC1	ZINC000875141938	GD	On-Demand	Mild	DRD3	52	41
O=C(NCc1ccc(N2CCOCC2)cc1)N1CC(Cc2ccco2)C1	ZINC000875141951	FF	On-Demand	Clean	STAT6	45	35
O=C(NCc1ccc(N2CCOCC2)cc1)N1CC2(CCCO2)C1	ZINC000875141957	ED	On-Demand	Clean	STAT6	59	37
O=C(NCc1ccc(N2CCOCC2)cc1)N1CC2(CCCO2)C1	ZINC000875141957	ED	On-Demand	Clean	NAMPT	33	40
O=C(NCc1ccc(N2CCOCC2)cc1)NC[C@@H]1C[C@H](O)C1	ZINC000875141958	DD	On-Demand	Clean	STAT6	51	35
O=C(NCc1ccc(N2CCOCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875141959	DD	On-Demand	Clean	STAT6	51	35
O=C(NCc1ccc(N2CCOCC2)cc1)NCC1CC(O)C1	ZINC000875141960	DD	On-Demand	Clean	STAT6	51	35
COCCCCCNC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875142026	FD	On-Demand	Anodyne	ROCK1	24	43
COCCCCCNC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875142026	FD	On-Demand	Anodyne	ROCK2	18	43
C[C@@H](CN(C)C(=O)NC1CCN(c2ccccc2)CC1)NC(=O)OC(C)(C)C	ZINC000875142061	GG	On-Demand	Anodyne	CACNA1B	18	42
C[C@@H](CN(C)C(=O)NC1CCN(c2ccccc2)CC1)NC(=O)OC(C)(C)C	ZINC000875142061	GG	On-Demand	Anodyne	FPR1	44	36
Cn1cc(CNC(=O)N2CC[C@@H](c3cccc(Cl)c3)C2(C)C)cn1	ZINC000875142117	EH	On-Demand	Anodyne	P2RX7	18	40
Cn1cc(CNC(=O)N2CC[C@@H](c3cccc(Cl)c3)C2(C)C)cn1	ZINC000875142117	EH	On-Demand	Anodyne	MDM2	52	33
Cn1cc(CNC(=O)N2CC[C@H](c3cccc(Cl)c3)C2(C)C)cn1	ZINC000875142118	EH	On-Demand	Anodyne	P2RX7	18	40
Cn1cc(CNC(=O)N2CC[C@H](c3cccc(Cl)c3)C2(C)C)cn1	ZINC000875142118	EH	On-Demand	Anodyne	MDM2	52	33
COCCCCCNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875142132	GD	On-Demand	Anodyne	ETHR	59	46
COCCCCCNC(=O)C(=O)N1CCO[C@H](c2ccccc2OC)C1	ZINC000875142147	FD	On-Demand	Anodyne	DRD2	26	40
COCCCCCNC(=O)C(=O)N1CCO[C@H](c2ccccc2OC)C1	ZINC000875142147	FD	On-Demand	Anodyne	DRD4	21	40
COCCCCCNC(=O)C(=O)N1CCO[C@H](c2ccccc2OC)C1	ZINC000875142147	FD	On-Demand	Anodyne	DRD3	43	39
COCCCCCNC(=O)C(=O)N1CCO[C@@H](c2ccccc2OC)C1	ZINC000875142148	FD	On-Demand	Anodyne	DRD2	26	40
COCCCCCNC(=O)C(=O)N1CCO[C@@H](c2ccccc2OC)C1	ZINC000875142148	FD	On-Demand	Anodyne	DRD4	21	40
COCCCCCNC(=O)C(=O)N1CCO[C@@H](c2ccccc2OC)C1	ZINC000875142148	FD	On-Demand	Anodyne	DRD3	43	39
COCCCCCNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875142184	GD	On-Demand	Clean	HTR1A	47	49
COCCCCCNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875142184	GD	On-Demand	Clean	DRD2	46	49
COCCCCCNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875142184	GD	On-Demand	Clean	DRD4	46	37
COCCCCCNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875142184	GD	On-Demand	Clean	ADRA1D	25	46
COCCCCCNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875142184	GD	On-Demand	Clean	ADRA1A	25	46
COCCCCCNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875142184	GD	On-Demand	Clean	DRD3	77	49
COCCCCCNC(=O)C(=O)N1CCN(c2ccc(C#N)cc2)CC1	ZINC000875142193	FD	On-Demand	Mild	DRD3	25	45
Cn1cc(CNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)cn1	ZINC000875142231	DD	On-Demand	Anodyne	EPHX2	15	50
Cn1cc(CNC(=O)N2CCC[C@](O)(c3ccccc3)C2)cn1	ZINC000875142232	DD	On-Demand	Anodyne	EPHX2	15	50
COCCCCCNC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875142301	FD	On-Demand	Anodyne	HTR1A	20	42
COCCCCCNC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875142301	FD	On-Demand	Anodyne	DRD2	29	42
COCCCCCNC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875142301	FD	On-Demand	Anodyne	ADRA1B	18	41
COCCCCCNC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875142301	FD	On-Demand	Anodyne	DRD3	55	42
Cn1cc(CNC(=O)N2CCC(c3nccc(-c4cccnc4)n3)CC2)cn1	ZINC000875142331	GE	On-Demand	Anodyne	NAMPT	55	39
COCCCCCNC(=O)C(=O)NC[C@H]1c2ccccc2CN1C	ZINC000875142346	ED	On-Demand	Anodyne	DRD3	44	36
COCCCCCNC(=O)C(=O)NC[C@@H]1c2ccccc2CN1C	ZINC000875142347	ED	On-Demand	Anodyne	DRD3	44	36
COC(=O)N(C)NC(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875142414	CD	On-Demand	Reactive	GRIA1	46	32
COC(=O)N(C)NC(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875142414	CD	On-Demand	Reactive	YARS	56	33
COC(=O)N(C)NC(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875142415	CD	On-Demand	Reactive	GRIA1	46	32
COC(=O)N(C)NC(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875142415	CD	On-Demand	Reactive	YARS	56	33
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H](C)C(=O)NCc2ccccc2)cc1	ZINC000875142426	GE	On-Demand	Anodyne	MME	45	38
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H](C)C(=O)NCc2ccccc2)cc1	ZINC000875142426	GE	On-Demand	Anodyne	ANPEP	38	50
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H](C)C(=O)NCc2ccccc2)cc1	ZINC000875142426	GE	On-Demand	Anodyne	CTSB	23	45
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H](C)C(=O)NCc2ccccc2)cc1	ZINC000875142426	GE	On-Demand	Anodyne	PAPA1_CARPA	39	42
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H](C)C(=O)NCc2ccccc2)cc1	ZINC000875142426	GE	On-Demand	Anodyne	FURIN	47	38
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H](C)C(=O)NCc2ccccc2)cc1	ZINC000875142426	GE	On-Demand	Anodyne	AMP1_PLAFQ	46	42
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H](C)C(=O)NCc2ccccc2)cc1	ZINC000875142426	GE	On-Demand	Anodyne	PSMB8	40	32
CC(=O)N(C)c1ccc(CNC(=O)N[C@H](C)C(=O)NCc2ccccc2)cc1	ZINC000875142427	GE	On-Demand	Anodyne	MME	45	38
CC(=O)N(C)c1ccc(CNC(=O)N[C@H](C)C(=O)NCc2ccccc2)cc1	ZINC000875142427	GE	On-Demand	Anodyne	ANPEP	38	50
CC(=O)N(C)c1ccc(CNC(=O)N[C@H](C)C(=O)NCc2ccccc2)cc1	ZINC000875142427	GE	On-Demand	Anodyne	CTSB	23	45
CC(=O)N(C)c1ccc(CNC(=O)N[C@H](C)C(=O)NCc2ccccc2)cc1	ZINC000875142427	GE	On-Demand	Anodyne	PAPA1_CARPA	39	42
CC(=O)N(C)c1ccc(CNC(=O)N[C@H](C)C(=O)NCc2ccccc2)cc1	ZINC000875142427	GE	On-Demand	Anodyne	FURIN	47	38
CC(=O)N(C)c1ccc(CNC(=O)N[C@H](C)C(=O)NCc2ccccc2)cc1	ZINC000875142427	GE	On-Demand	Anodyne	AMP1_PLAFQ	46	42
CC(=O)N(C)c1ccc(CNC(=O)N[C@H](C)C(=O)NCc2ccccc2)cc1	ZINC000875142427	GE	On-Demand	Anodyne	PSMB8	40	32
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875142450	DF	On-Demand	Anodyne	OPRM1	44	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875142450	DF	On-Demand	Anodyne	NTSR1	105	36
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875142450	DF	On-Demand	Anodyne	NTSR2	80	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875142450	DF	On-Demand	Anodyne	CACNA1B	25	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875142450	DF	On-Demand	Anodyne	SORT1	43	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875142450	DF	On-Demand	Anodyne	YARS	46	32
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875142450	DF	On-Demand	Anodyne	BIRC2	28	43
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875142453	DF	On-Demand	Anodyne	OPRM1	44	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875142453	DF	On-Demand	Anodyne	NTSR1	105	36
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875142453	DF	On-Demand	Anodyne	NTSR2	80	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875142453	DF	On-Demand	Anodyne	CACNA1B	25	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875142453	DF	On-Demand	Anodyne	SORT1	43	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875142453	DF	On-Demand	Anodyne	YARS	46	32
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875142453	DF	On-Demand	Anodyne	BIRC2	28	43
CS[C@@H]1C[C@@H](NC(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875142456	CF	On-Demand	Anodyne	YARS	77	34
CS[C@@H]1C[C@@H](NC(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875142457	CF	On-Demand	Anodyne	YARS	77	34
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@H](C)c1ccnn1C	ZINC000875142460	DE	On-Demand	Anodyne	ACE	20	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@H](C)c1ccnn1C	ZINC000875142460	DE	On-Demand	Anodyne	MME	33	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@H](C)c1ccnn1C	ZINC000875142460	DE	On-Demand	Anodyne	NAALAD2	23	44
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@H](C)c1ccnn1C	ZINC000875142460	DE	On-Demand	Anodyne	GRIA1	47	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@H](C)c1ccnn1C	ZINC000875142460	DE	On-Demand	Anodyne	YARS	51	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@H](C)c1ccnn1C	ZINC000875142460	DE	On-Demand	Anodyne	ACE2	39	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@@H](C)c1ccnn1C	ZINC000875142461	DE	On-Demand	Anodyne	ACE	20	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@@H](C)c1ccnn1C	ZINC000875142461	DE	On-Demand	Anodyne	MME	33	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@@H](C)c1ccnn1C	ZINC000875142461	DE	On-Demand	Anodyne	NAALAD2	23	44
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@@H](C)c1ccnn1C	ZINC000875142461	DE	On-Demand	Anodyne	GRIA1	47	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@@H](C)c1ccnn1C	ZINC000875142461	DE	On-Demand	Anodyne	YARS	51	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@@H](C)c1ccnn1C	ZINC000875142461	DE	On-Demand	Anodyne	ACE2	39	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875142473	DE	On-Demand	Anodyne	NTSR1	47	31
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875142473	DE	On-Demand	Anodyne	CACNA1B	26	40
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875142473	DE	On-Demand	Anodyne	YARS	57	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875142473	DE	On-Demand	Anodyne	MARS	44	31
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875142473	DE	On-Demand	Anodyne	BIRC2	15	40
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875142474	DE	On-Demand	Anodyne	NTSR1	47	31
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875142474	DE	On-Demand	Anodyne	CACNA1B	26	40
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875142474	DE	On-Demand	Anodyne	YARS	57	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875142474	DE	On-Demand	Anodyne	MARS	44	31
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875142474	DE	On-Demand	Anodyne	BIRC2	15	40
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875142479	DF	On-Demand	Anodyne	TIMP3	41	36
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875142479	DF	On-Demand	Anodyne	YARS	58	35
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875142480	DF	On-Demand	Anodyne	TIMP3	41	36
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875142480	DF	On-Demand	Anodyne	YARS	58	35
C[C@@H](CNC(=O)N1CCCN(C=O)CC1)COCc1ccccc1	ZINC000875142485	ED	On-Demand	Anodyne	CAPN1	44	37
C[C@@H](CNC(=O)N1CCCN(C=O)CC1)COCc1ccccc1	ZINC000875142485	ED	On-Demand	Anodyne	CAPN2	55	36
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCOc2ccc(C)cc2)C1	ZINC000875142489	ED	On-Demand	Anodyne	HRH2	33	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCOc2ccc(C)cc2)C1	ZINC000875142489	ED	On-Demand	Anodyne	HRH3	50	38
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCOc2ccc(C)cc2)C1	ZINC000875142490	ED	On-Demand	Anodyne	HRH2	33	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCOc2ccc(C)cc2)C1	ZINC000875142490	ED	On-Demand	Anodyne	HRH3	50	38
C[C@@H](Cc1ccc(O)cc1)NC(=O)NC1(C)CC(F)(F)C1	ZINC000875142504	CF	On-Demand	Anodyne	GRIA1	42	32
C[C@@H](Cc1ccc(O)cc1)NC(=O)NC1(C)CC(F)(F)C1	ZINC000875142504	CF	On-Demand	Anodyne	YARS	61	32
CONC(=O)C1CCN(C(=O)N[C@H](C)Cc2ccc(O)cc2)CC1	ZINC000875142507	ED	On-Demand	Anodyne	OPRM1	39	41
CONC(=O)C1CCN(C(=O)N[C@H](C)Cc2ccc(O)cc2)CC1	ZINC000875142507	ED	On-Demand	Anodyne	NTSR1	45	31
CONC(=O)C1CCN(C(=O)N[C@H](C)Cc2ccc(O)cc2)CC1	ZINC000875142507	ED	On-Demand	Anodyne	YARS	74	35
CONC(=O)C1CCN(C(=O)N[C@H](C)Cc2ccc(O)cc2)CC1	ZINC000875142507	ED	On-Demand	Anodyne	MARS	41	31
CONC(=O)C1CCN(C(=O)N[C@@H](C)Cc2ccc(O)cc2)CC1	ZINC000875142508	ED	On-Demand	Anodyne	OPRM1	39	41
CONC(=O)C1CCN(C(=O)N[C@@H](C)Cc2ccc(O)cc2)CC1	ZINC000875142508	ED	On-Demand	Anodyne	NTSR1	45	31
CONC(=O)C1CCN(C(=O)N[C@@H](C)Cc2ccc(O)cc2)CC1	ZINC000875142508	ED	On-Demand	Anodyne	YARS	74	35
CONC(=O)C1CCN(C(=O)N[C@@H](C)Cc2ccc(O)cc2)CC1	ZINC000875142508	ED	On-Demand	Anodyne	MARS	41	31
O=CN1CCCN(C(=O)NCCSCc2cccc3ccccc23)CC1	ZINC000875142525	FF	On-Demand	Anodyne	Q6PRC7_IXORI	49	37
CCCCCCCNC(=O)C(=O)NCc1ncc(C)c(OC)c1C	ZINC000875142559	EE	On-Demand	Mild	ASAH1	57	32
CC(=O)C1CCN(C(=O)C(=O)NCC(C)(C)c2ccccc2C)CC1	ZINC000875142613	EE	On-Demand	Anodyne	CCR8	42	32
CC(=O)C1CCN(C(=O)C(=O)NCC(C)(C)c2ccccc2C)CC1	ZINC000875142613	EE	On-Demand	Anodyne	SFRP1	41	33
CC(=O)C1CCN(C(=O)C(=O)NCC(C)(C)c2ccccc2C)CC1	ZINC000875142613	EE	On-Demand	Anodyne	WNT3	41	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875142622	CD	On-Demand	Anodyne	OPRM1	18	40
C[C@@H](Cc1ccc(O)cc1)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875142622	CD	On-Demand	Anodyne	GRIA1	49	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875142622	CD	On-Demand	Anodyne	YARS	76	34
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCC(C)(C)C(C)(F)F	ZINC000875142625	DG	On-Demand	Anodyne	GRIA1	49	37
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCC(C)(C)C(C)(F)F	ZINC000875142625	DG	On-Demand	Anodyne	YARS	57	33
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)COCc1ccccc1	ZINC000875142635	FF	On-Demand	Anodyne	SLC6A4	22	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)COCc1ccccc1	ZINC000875142635	FF	On-Demand	Anodyne	SLC6A3	50	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)COCc1ccccc1	ZINC000875142636	FF	On-Demand	Anodyne	SLC6A4	22	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)COCc1ccccc1	ZINC000875142636	FF	On-Demand	Anodyne	SLC6A3	50	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)COCc1ccccc1	ZINC000875142637	FF	On-Demand	Anodyne	SLC6A4	22	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)COCc1ccccc1	ZINC000875142637	FF	On-Demand	Anodyne	SLC6A3	50	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)COCc1ccccc1	ZINC000875142638	FF	On-Demand	Anodyne	SLC6A4	22	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)COCc1ccccc1	ZINC000875142638	FF	On-Demand	Anodyne	SLC6A3	50	42
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@@H]1C[C@H]1C1CCOCC1	ZINC000875142641	DE	On-Demand	Anodyne	YARS	55	31
C[C@@H](CNC(=O)N1CC[C@@H](C(C)(C)O)C1)COCc1ccccc1	ZINC000875142649	EF	On-Demand	Anodyne	GHSR	46	43
C[C@@H](CNC(=O)N1CC[C@@H](C(C)(C)O)C1)COCc1ccccc1	ZINC000875142649	EF	On-Demand	Anodyne	CAPN2	43	33
C[C@@H](CNC(=O)N1CC[C@@H](C(C)(C)O)C1)COCc1ccccc1	ZINC000875142649	EF	On-Demand	Anodyne	BIRC2	26	40
C[C@@H](CNC(=O)N1CC[C@H](C(C)(C)O)C1)COCc1ccccc1	ZINC000875142651	EF	On-Demand	Anodyne	GHSR	46	43
C[C@@H](CNC(=O)N1CC[C@H](C(C)(C)O)C1)COCc1ccccc1	ZINC000875142651	EF	On-Demand	Anodyne	CAPN2	43	33
C[C@@H](CNC(=O)N1CC[C@H](C(C)(C)O)C1)COCc1ccccc1	ZINC000875142651	EF	On-Demand	Anodyne	BIRC2	26	40
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875142655	EG	On-Demand	Anodyne	NTSR1	88	34
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875142655	EG	On-Demand	Anodyne	NTSR2	53	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875142655	EG	On-Demand	Anodyne	YARS	73	35
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875142656	EG	On-Demand	Anodyne	NTSR1	88	34
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875142656	EG	On-Demand	Anodyne	NTSR2	53	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875142656	EG	On-Demand	Anodyne	YARS	73	35
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875142657	CE	On-Demand	Anodyne	ACE	19	42
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875142657	CE	On-Demand	Anodyne	MME	43	42
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875142657	CE	On-Demand	Anodyne	GRIA1	46	34
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875142657	CE	On-Demand	Anodyne	YARS	46	33
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875142657	CE	On-Demand	Anodyne	ACE2	36	42
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875142659	CE	On-Demand	Anodyne	ACE	19	42
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875142659	CE	On-Demand	Anodyne	MME	43	42
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875142659	CE	On-Demand	Anodyne	GRIA1	46	34
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875142659	CE	On-Demand	Anodyne	YARS	46	33
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875142659	CE	On-Demand	Anodyne	ACE2	36	42
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@@H](C)c1ccns1	ZINC000875142677	DF	On-Demand	Anodyne	NAALAD2	18	40
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@@H](C)c1ccns1	ZINC000875142677	DF	On-Demand	Anodyne	GRIA1	41	31
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@H](C)c1ccns1	ZINC000875142678	DF	On-Demand	Anodyne	NAALAD2	18	40
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@H](C)c1ccns1	ZINC000875142678	DF	On-Demand	Anodyne	GRIA1	41	31
CCOC(=O)[C@@H]1CN(C(=O)N[C@H](C)Cc2ccc(O)cc2)C[C@H]1C(F)(F)F	ZINC000875142691	GF	On-Demand	Anodyne	YARS	54	37
CCOC(=O)[C@@H]1CN(C(=O)N[C@@H](C)Cc2ccc(O)cc2)C[C@H]1C(F)(F)F	ZINC000875142693	GF	On-Demand	Anodyne	YARS	54	37
C[C@@H](CNC(=O)NC1(C)CC(F)(F)C1)COCc1ccccc1	ZINC000875142707	EG	On-Demand	Anodyne	CAPN2	47	35
COc1ccc([C@@H]2CN(C(=O)N[C@H](C)Cc3ccc(O)cc3)CCO2)cc1	ZINC000875142715	FG	On-Demand	Anodyne	YARS	46	32
COc1ccc([C@@H]2CN(C(=O)N[C@H](C)Cc3ccc(O)cc3)CCO2)cc1	ZINC000875142715	FG	On-Demand	Anodyne	PSMB8	46	33
COc1ccc([C@@H]2CN(C(=O)N[C@@H](C)Cc3ccc(O)cc3)CCO2)cc1	ZINC000875142716	FG	On-Demand	Anodyne	YARS	46	32
COc1ccc([C@@H]2CN(C(=O)N[C@@H](C)Cc3ccc(O)cc3)CCO2)cc1	ZINC000875142716	FG	On-Demand	Anodyne	PSMB8	46	33
Cn1cc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cn1	ZINC000875142729	DD	On-Demand	Anodyne	PREP	55	44
Cn1cc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cn1	ZINC000875142729	DD	On-Demand	Anodyne	TMPRSS11D	50	33
Cn1cc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cn1	ZINC000875142730	DD	On-Demand	Anodyne	PREP	55	44
Cn1cc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cn1	ZINC000875142730	DD	On-Demand	Anodyne	TMPRSS11D	50	33
Cn1cc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cn1	ZINC000875142731	DD	On-Demand	Anodyne	PREP	55	44
Cn1cc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cn1	ZINC000875142731	DD	On-Demand	Anodyne	TMPRSS11D	50	33
Cn1cc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cn1	ZINC000875142732	DD	On-Demand	Anodyne	PREP	55	44
Cn1cc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cn1	ZINC000875142732	DD	On-Demand	Anodyne	TMPRSS11D	50	33
Cn1cc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cn1	ZINC000875142736	EE	On-Demand	Anodyne	CCR5	19	40
Cn1cc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cn1	ZINC000875142736	EE	On-Demand	Anodyne	PREP	39	42
Cn1cc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cn1	ZINC000875142737	EE	On-Demand	Anodyne	CCR5	19	40
Cn1cc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cn1	ZINC000875142737	EE	On-Demand	Anodyne	PREP	39	42
Cn1cc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cn1	ZINC000875142738	EE	On-Demand	Anodyne	CCR5	19	40
Cn1cc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cn1	ZINC000875142738	EE	On-Demand	Anodyne	PREP	39	42
Cn1cc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cn1	ZINC000875142739	EE	On-Demand	Anodyne	CCR5	19	40
Cn1cc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cn1	ZINC000875142739	EE	On-Demand	Anodyne	PREP	39	42
COCCCCCNC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1C	ZINC000875142776	GE	On-Demand	Anodyne	SLC18A2	49	37
COCCCCCNC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1C	ZINC000875142777	GE	On-Demand	Anodyne	SLC18A2	49	37
Cn1cc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)cn1	ZINC000875142782	DE	On-Demand	Anodyne	EPHX2	18	40
Cn1cc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)cn1	ZINC000875142783	DE	On-Demand	Anodyne	EPHX2	18	40
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cnn(C)c2)CC1	ZINC000875142806	EF	On-Demand	Anodyne	HTR1A	19	40
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cnn(C)c2)CC1	ZINC000875142806	EF	On-Demand	Anodyne	DRD2	20	43
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cnn(C)c2)CC1	ZINC000875142806	EF	On-Demand	Anodyne	EPHX2	17	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cnn(C)c2)CC1	ZINC000875142807	EF	On-Demand	Anodyne	HTR1A	19	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cnn(C)c2)CC1	ZINC000875142807	EF	On-Demand	Anodyne	DRD2	20	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cnn(C)c2)CC1	ZINC000875142807	EF	On-Demand	Anodyne	EPHX2	17	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCOc2ccc(F)cc2)C1	ZINC000875142838	FD	On-Demand	Anodyne	HRH3	45	39
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCOc2ccc(F)cc2)C1	ZINC000875142841	FD	On-Demand	Anodyne	HRH3	45	39
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1	ZINC000875142842	FD	On-Demand	Anodyne	YARS	62	34
Cn1cc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)cn1	ZINC000875142857	ED	On-Demand	Anodyne	FAAH	18	41
C=CCc1cc(C(=O)OCCC(N)=O)cc(OC)c1OC	ZINC000875142885	CD	On-Demand	Mild	SLC29A1	15	49
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCCN(C=O)CC1	ZINC000875142913	DD	On-Demand	Anodyne	GRIA1	47	32
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCCN(C=O)CC1	ZINC000875142913	DD	On-Demand	Anodyne	YARS	40	32
Cn1cc(CNC(=O)N2Cc3cccc(O)c3C2)cn1	ZINC000875142925	CD	On-Demand	Clean	NAMPT	27	43
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCc2c(CC(N)=O)cccc2C1	ZINC000875142933	FE	On-Demand	Anodyne	FABI	47	32
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCc2c(CC(N)=O)cccc2C1	ZINC000875142933	FE	On-Demand	Anodyne	Q6PRC7_IXORI	45	36
Cn1cc(CNC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)cn1	ZINC000875142941	EE	On-Demand	Mild	CTSF	55	31
Cn1cc(CNC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)cn1	ZINC000875142941	EE	On-Demand	Mild	CTSL	23	40
Cn1cc(CNC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)cn1	ZINC000875142941	EE	On-Demand	Mild	CTSS	16	40
Cn1cc(CNC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)cn1	ZINC000875142943	EE	On-Demand	Mild	CTSF	55	31
Cn1cc(CNC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)cn1	ZINC000875142943	EE	On-Demand	Mild	CTSL	23	40
Cn1cc(CNC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)cn1	ZINC000875142943	EE	On-Demand	Mild	CTSS	16	40
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875142948	DF	On-Demand	Anodyne	TIMP3	80	41
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875142948	DF	On-Demand	Anodyne	GRIA1	41	32
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875142948	DF	On-Demand	Anodyne	YARS	56	35
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875142950	DF	On-Demand	Anodyne	TIMP3	80	41
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875142950	DF	On-Demand	Anodyne	GRIA1	41	32
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875142950	DF	On-Demand	Anodyne	YARS	56	35
CCOC1CC2(C1)C[C@H]2NC(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875142956	DF	On-Demand	Anodyne	TIMP3	80	41
CCOC1CC2(C1)C[C@H]2NC(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875142956	DF	On-Demand	Anodyne	GRIA1	41	32
CCOC1CC2(C1)C[C@H]2NC(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875142956	DF	On-Demand	Anodyne	YARS	56	35
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@@H]1CC[C@@H](NC(=O)OC(C)(C)C)CC1	ZINC000875142961	GG	On-Demand	Anodyne	PAPA1_CARPA	32	48
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@@H]1CC[C@@H](NC(=O)OC(C)(C)C)CC1	ZINC000875142961	GG	On-Demand	Anodyne	CACNA1B	20	40
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@@H]1CC[C@@H](NC(=O)OC(C)(C)C)CC1	ZINC000875142961	GG	On-Demand	Anodyne	REN	39	40
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@@H]1CC[C@@H](NC(=O)OC(C)(C)C)CC1	ZINC000875142961	GG	On-Demand	Anodyne	YARS	63	36
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@@H]1CC[C@@H](NC(=O)OC(C)(C)C)CC1	ZINC000875142961	GG	On-Demand	Anodyne	FPR1	49	39
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H](C)Cc2ccc(O)cc2)cc1	ZINC000875142987	FF	On-Demand	Anodyne	GRIA1	43	34
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H](C)Cc2ccc(O)cc2)cc1	ZINC000875142987	FF	On-Demand	Anodyne	YARS	40	33
CC(=O)N(C)c1ccc(CNC(=O)N[C@H](C)Cc2ccc(O)cc2)cc1	ZINC000875142990	FF	On-Demand	Anodyne	GRIA1	43	34
CC(=O)N(C)c1ccc(CNC(=O)N[C@H](C)Cc2ccc(O)cc2)cc1	ZINC000875142990	FF	On-Demand	Anodyne	YARS	40	33
C[C@@H](CNC(=O)N1CCC[C@@H](C(C)(C)O)C1)COCc1ccccc1	ZINC000875142997	EG	On-Demand	Anodyne	FKBP1A	22	40
C[C@@H](CNC(=O)N1CCC[C@@H](C(C)(C)O)C1)COCc1ccccc1	ZINC000875142997	EG	On-Demand	Anodyne	ELANE	31	42
C[C@@H](CNC(=O)N1CCC[C@@H](C(C)(C)O)C1)COCc1ccccc1	ZINC000875142997	EG	On-Demand	Anodyne	AMY2	43	30
C[C@@H](CNC(=O)N1CCC[C@@H](C(C)(C)O)C1)COCc1ccccc1	ZINC000875142997	EG	On-Demand	Anodyne	REN	15	40
C[C@@H](CNC(=O)N1CCC[C@@H](C(C)(C)O)C1)COCc1ccccc1	ZINC000875142997	EG	On-Demand	Anodyne	GHSR	43	40
C[C@@H](CNC(=O)N1CCC[C@@H](C(C)(C)O)C1)COCc1ccccc1	ZINC000875142997	EG	On-Demand	Anodyne	BIRC2	36	42
C[C@@H](CNC(=O)N1CCC[C@H](C(C)(C)O)C1)COCc1ccccc1	ZINC000875143000	EG	On-Demand	Anodyne	FKBP1A	22	40
C[C@@H](CNC(=O)N1CCC[C@H](C(C)(C)O)C1)COCc1ccccc1	ZINC000875143000	EG	On-Demand	Anodyne	ELANE	31	42
C[C@@H](CNC(=O)N1CCC[C@H](C(C)(C)O)C1)COCc1ccccc1	ZINC000875143000	EG	On-Demand	Anodyne	AMY2	43	30
C[C@@H](CNC(=O)N1CCC[C@H](C(C)(C)O)C1)COCc1ccccc1	ZINC000875143000	EG	On-Demand	Anodyne	REN	15	40
C[C@@H](CNC(=O)N1CCC[C@H](C(C)(C)O)C1)COCc1ccccc1	ZINC000875143000	EG	On-Demand	Anodyne	GHSR	43	40
C[C@@H](CNC(=O)N1CCC[C@H](C(C)(C)O)C1)COCc1ccccc1	ZINC000875143000	EG	On-Demand	Anodyne	BIRC2	36	42
C[C@@H](CN(C)C(=O)N[C@@H](C)Cc1ccc(O)cc1)NC(=O)OC(C)(C)C	ZINC000875143002	FF	On-Demand	Anodyne	PAPA1_CARPA	34	49
C[C@@H](CN(C)C(=O)N[C@@H](C)Cc1ccc(O)cc1)NC(=O)OC(C)(C)C	ZINC000875143002	FF	On-Demand	Anodyne	FPR1	49	38
C[C@@H](CN(C)C(=O)N[C@H](C)Cc1ccc(O)cc1)NC(=O)OC(C)(C)C	ZINC000875143003	FF	On-Demand	Anodyne	PAPA1_CARPA	34	49
C[C@@H](CN(C)C(=O)N[C@H](C)Cc1ccc(O)cc1)NC(=O)OC(C)(C)C	ZINC000875143003	FF	On-Demand	Anodyne	FPR1	49	38
C[C@@H](Cc1ccc(O)cc1)NC(=O)N(C)C[C@@H](C)NC(=O)OC(C)(C)C	ZINC000875143004	FF	On-Demand	Anodyne	PAPA1_CARPA	34	49
C[C@@H](Cc1ccc(O)cc1)NC(=O)N(C)C[C@@H](C)NC(=O)OC(C)(C)C	ZINC000875143004	FF	On-Demand	Anodyne	FPR1	49	38
CCCCCCCNC(=O)C(=O)NCC1CCSCC1	ZINC000875143030	DE	On-Demand	Mild	EPHX2	31	47
CCCCCCCNC(=O)C(=O)NCC1CCSCC1	ZINC000875143030	DE	On-Demand	Mild	ASAH1	64	36
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@H](C)c1ccccc1O	ZINC000875143058	DG	On-Demand	Clean	ACE	28	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@H](C)c1ccccc1O	ZINC000875143058	DG	On-Demand	Clean	MME	66	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@H](C)c1ccccc1O	ZINC000875143058	DG	On-Demand	Clean	NAALAD2	28	40
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@H](C)c1ccccc1O	ZINC000875143058	DG	On-Demand	Clean	GRIA1	49	34
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@H](C)c1ccccc1O	ZINC000875143058	DG	On-Demand	Clean	YARS	51	38
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@H](C)c1ccccc1O	ZINC000875143058	DG	On-Demand	Clean	ACE2	51	40
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@@H](C)c1ccccc1O	ZINC000875143060	DG	On-Demand	Clean	ACE	28	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@@H](C)c1ccccc1O	ZINC000875143060	DG	On-Demand	Clean	MME	66	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@@H](C)c1ccccc1O	ZINC000875143060	DG	On-Demand	Clean	NAALAD2	28	40
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@@H](C)c1ccccc1O	ZINC000875143060	DG	On-Demand	Clean	GRIA1	49	34
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@@H](C)c1ccccc1O	ZINC000875143060	DG	On-Demand	Clean	YARS	51	38
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@@H](C)c1ccccc1O	ZINC000875143060	DG	On-Demand	Clean	ACE2	51	40
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCc1ccc(Br)cn1	ZINC000875143064	FF	On-Demand	Anodyne	GRIA1	42	31
C[C@@H](Cc1ccc(O)cc1)NC(=O)NC(c1ccnn1C)c1ccnn1C	ZINC000875143077	FD	On-Demand	Anodyne	NAALAD2	23	44
C[C@@H](Cc1ccc(O)cc1)NC(=O)NC(c1ccnn1C)c1ccnn1C	ZINC000875143077	FD	On-Demand	Anodyne	GRIA1	47	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)NC(c1ccnn1C)c1ccnn1C	ZINC000875143077	FD	On-Demand	Anodyne	YARS	51	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cnn(C)c1	ZINC000875143126	CC	On-Demand	Anodyne	SLC6A3	53	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cnn(C)c1	ZINC000875143127	CC	On-Demand	Anodyne	SLC6A3	53	38
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@@H](C)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875143150	GF	On-Demand	Anodyne	YARS	51	31
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@H](C)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875143152	GF	On-Demand	Anodyne	YARS	51	31
COCC1CC(NC(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875143156	CE	On-Demand	Anodyne	YARS	78	35
COCC1CC(NC(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875143157	CE	On-Demand	Anodyne	YARS	78	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875143168	EE	On-Demand	Anodyne	OPRM1	40	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875143168	EE	On-Demand	Anodyne	GRIA1	46	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875143168	EE	On-Demand	Anodyne	YARS	80	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875143170	EE	On-Demand	Anodyne	OPRM1	40	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875143170	EE	On-Demand	Anodyne	GRIA1	46	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875143170	EE	On-Demand	Anodyne	YARS	80	42
C[C@H](NC(=O)C(=O)NCC(C)(C)c1cccc(Cl)c1)c1ccnn1C	ZINC000875143173	FE	On-Demand	Anodyne	CTSV	40	37
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@@H]1COC[C@@H]1Oc1cnn(C)c1	ZINC000875143192	FD	On-Demand	Anodyne	YARS	41	32
CN1CC[C@H]2CN(C(=O)C(=O)NCC(C)(C)c3cccc(Cl)c3)CC[C@H]21	ZINC000875143199	GE	On-Demand	Anodyne	CACNA1I	43	39
CN1CC[C@H]2CN(C(=O)C(=O)NCC(C)(C)c3cccc(Cl)c3)CC[C@@H]21	ZINC000875143200	GE	On-Demand	Anodyne	CACNA1I	43	39
CC(C)c1cc([C@@H]2CCCN(C(=O)N[C@@H](C)Cc3ccc(O)cc3)C2)n[nH]1	ZINC000875143205	FH	On-Demand	Anodyne	NTSR1	56	32
CC(C)c1cc([C@@H]2CCCN(C(=O)N[C@H](C)Cc3ccc(O)cc3)C2)n[nH]1	ZINC000875143206	FH	On-Demand	Anodyne	NTSR1	56	32
Cn1cc(CNC(=O)N2Cc3cccnc3N3CCC[C@H]3C2)cn1	ZINC000875143249	ED	On-Demand	Anodyne	NAMPT	29	40
O=C(NCCSCc1cccc2ccccc12)N1CCC(CO)(CO)CC1	ZINC000875143256	GF	On-Demand	Anodyne	Q6PRC7_IXORI	47	33
CC(=O)Nc1cccc2c1CN(C(=O)N[C@@H](C)Cc1ccc(O)cc1)CC2	ZINC000875143277	FG	On-Demand	Anodyne	YARS	40	33
CC(=O)Nc1cccc2c1CN(C(=O)N[C@H](C)Cc1ccc(O)cc1)CC2	ZINC000875143278	FG	On-Demand	Anodyne	YARS	40	33
CC(=O)C1CCN(C(=O)N[C@H](C)Cc2ccc(O)cc2)CC1	ZINC000875143288	DE	On-Demand	Anodyne	OPRM1	40	42
CC(=O)C1CCN(C(=O)N[C@H](C)Cc2ccc(O)cc2)CC1	ZINC000875143288	DE	On-Demand	Anodyne	YARS	77	36
CC(=O)C1CCN(C(=O)N[C@@H](C)Cc2ccc(O)cc2)CC1	ZINC000875143289	DE	On-Demand	Anodyne	OPRM1	40	42
CC(=O)C1CCN(C(=O)N[C@@H](C)Cc2ccc(O)cc2)CC1	ZINC000875143289	DE	On-Demand	Anodyne	YARS	77	36
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@H]1CC12CCC2	ZINC000875143293	CF	On-Demand	Anodyne	GRIA1	46	34
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@H]1CC12CCC2	ZINC000875143293	CF	On-Demand	Anodyne	YARS	61	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@@H]1CC12CCC2	ZINC000875143295	CF	On-Demand	Anodyne	GRIA1	46	34
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@@H]1CC12CCC2	ZINC000875143295	CF	On-Demand	Anodyne	YARS	61	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1C[C@H]2C(=O)N(C)C(=O)[C@H]2C1	ZINC000875143302	EC	On-Demand	Anodyne	YARS	69	36
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875143303	FD	On-Demand	Anodyne	YARS	47	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875143303	FD	On-Demand	Anodyne	CALCRL	31	49
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875143303	FD	On-Demand	Anodyne	L3MBTL3	108	45
O=C1CCN(C(=O)C(=O)NCCCOc2ccc(F)cc2)CCCCCCN1	ZINC000875143307	GD	On-Demand	Anodyne	HRH3	20	41
C[C@H]1CN(C(=O)N[C@H](C)Cc2ccc(O)cc2)CC[C@H](C(F)(F)F)O1	ZINC000875143311	FG	On-Demand	Anodyne	YARS	51	32
C[C@H]1CN(C(=O)N[C@H](C)Cc2ccc(O)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000875143312	FG	On-Demand	Anodyne	YARS	51	32
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875143315	GH	On-Demand	Anodyne	YARS	40	31
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875143315	GH	On-Demand	Anodyne	SMO	42	43
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875143315	GH	On-Demand	Anodyne	ETHR	63	45
C[C@H](CNC(=O)N(C)OCC(F)(F)F)COCc1ccccc1	ZINC000875143340	EF	On-Demand	Anodyne	NPR	44	34
C[C@@H](CNC(=O)N(C)OCC(F)(F)F)COCc1ccccc1	ZINC000875143341	EF	On-Demand	Anodyne	NPR	44	34
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875143350	EF	On-Demand	Anodyne	YARS	69	34
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875143352	DD	On-Demand	Anodyne	ACE	23	42
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875143352	DD	On-Demand	Anodyne	MME	41	42
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875143352	DD	On-Demand	Anodyne	GRIA1	40	31
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875143352	DD	On-Demand	Anodyne	YARS	64	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC(c2nnnn2C)CC1	ZINC000875143363	ED	On-Demand	Anodyne	IL2RA	51	32
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875143376	FF	On-Demand	Anodyne	OPRM1	51	36
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875143376	FF	On-Demand	Anodyne	OPRD1	44	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875143376	FF	On-Demand	Anodyne	MME	49	37
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875143376	FF	On-Demand	Anodyne	YARS	47	35
COc1ccccc1[C@H]1CN(C(=O)N[C@H](C)Cc2ccc(O)cc2)CCO1	ZINC000875143382	FG	On-Demand	Anodyne	MME	16	42
COc1ccccc1[C@H]1CN(C(=O)N[C@@H](C)Cc2ccc(O)cc2)CCO1	ZINC000875143383	FG	On-Demand	Anodyne	MME	16	42
COc1ccccc1[C@@H]1CN(C(=O)N[C@H](C)Cc2ccc(O)cc2)CCO1	ZINC000875143384	FG	On-Demand	Anodyne	MME	16	42
COc1ccccc1[C@@H]1CN(C(=O)N[C@@H](C)Cc2ccc(O)cc2)CCO1	ZINC000875143385	FG	On-Demand	Anodyne	MME	16	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC(C)(C)c2ccccc2C)C1	ZINC000875143391	EE	On-Demand	Anodyne	SLC6A1	44	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC(C)(C)c2ccccc2C)C1	ZINC000875143392	EE	On-Demand	Anodyne	SLC6A1	44	34
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CC2(CC(=O)N2Cc2ccccc2)C1	ZINC000875143402	GF	On-Demand	Anodyne	OPRM1	43	35
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CC2(CC(=O)N2Cc2ccccc2)C1	ZINC000875143402	GF	On-Demand	Anodyne	MME	62	39
Cc1nccnc1[C@H](C)NC(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875143404	DE	On-Demand	Anodyne	GRIA1	48	34
Cc1nccnc1[C@@H](C)NC(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875143405	DE	On-Demand	Anodyne	GRIA1	48	34
Cc1nccnc1[C@@H](C)NC(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875143406	DE	On-Demand	Anodyne	GRIA1	48	34
Cc1nccnc1[C@H](C)NC(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875143407	DE	On-Demand	Anodyne	GRIA1	48	34
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@@H]1CCCC[C@@H]1F	ZINC000875143409	CF	On-Demand	Anodyne	OPRM1	37	40
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@@H]1CCCC[C@@H]1F	ZINC000875143409	CF	On-Demand	Anodyne	OPRD1	25	40
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@@H]1CCCC[C@@H]1F	ZINC000875143409	CF	On-Demand	Anodyne	YARS	75	35
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC(C)(N2CCCCC2)CC1	ZINC000875143410	FG	On-Demand	Anodyne	MME	19	40
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCC[C@@H]1CCSC1	ZINC000875143412	DF	On-Demand	Anodyne	GRIA1	43	34
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCC[C@@H]1CCSC1	ZINC000875143412	DF	On-Demand	Anodyne	YARS	45	31
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCC[C@H]1CCSC1	ZINC000875143413	DF	On-Demand	Anodyne	GRIA1	43	34
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCC[C@H]1CCSC1	ZINC000875143413	DF	On-Demand	Anodyne	YARS	45	31
C[C@@H](Cc1ccc(O)cc1)NC(=O)NC[C@@H]1C[C@H]1C1CCOCC1	ZINC000875143427	EF	On-Demand	Anodyne	YARS	40	31
C[C@@H](Cc1ccc(O)cc1)NC(=O)NC[C@@H]1c2ccccc2CN1C	ZINC000875143448	EF	On-Demand	Anodyne	OPRD1	33	40
C[C@@H](Cc1ccc(O)cc1)NC(=O)NC[C@H]1c2ccccc2CN1C	ZINC000875143450	EF	On-Demand	Anodyne	OPRD1	33	40
C[C@@H](Cc1ccc(O)cc1)NC(=O)NC1([C@H]2CCCCO2)CCC1	ZINC000875143453	EG	On-Demand	Anodyne	YARS	73	34
C[C@@H](Cc1ccc(O)cc1)NC(=O)NC1([C@@H]2CCCCO2)CCC1	ZINC000875143454	EG	On-Demand	Anodyne	YARS	73	34
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000875143455	FD	On-Demand	Anodyne	YARS	50	32
CC(=O)C1CCN(C(=O)C(=O)NCCCOc2ccc(C)cc2)CC1	ZINC000875143471	ED	On-Demand	Anodyne	HRH2	31	40
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875143481	ED	On-Demand	Anodyne	BIRC2	36	44
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1Cc2cccc(O)c2C1	ZINC000875143487	DF	On-Demand	Clean	YARS	45	33
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H](C)COCc2ccccc2)C1	ZINC000875143490	FF	On-Demand	Anodyne	ACE	23	40
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H](C)COCc2ccccc2)C1	ZINC000875143490	FF	On-Demand	Anodyne	CAPNS1	47	33
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H](C)COCc2ccccc2)C1	ZINC000875143490	FF	On-Demand	Anodyne	CTSS	28	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H](C)COCc2ccccc2)C1	ZINC000875143490	FF	On-Demand	Anodyne	CAPN1	53	38
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H](C)COCc2ccccc2)C1	ZINC000875143490	FF	On-Demand	Anodyne	CAPN2	90	37
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H](C)COCc2ccccc2)C1	ZINC000875143490	FF	On-Demand	Anodyne	Q6PRC7_IXORI	41	35
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H](C)COCc2ccccc2)C1	ZINC000875143491	FF	On-Demand	Anodyne	ACE	23	40
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H](C)COCc2ccccc2)C1	ZINC000875143491	FF	On-Demand	Anodyne	CAPNS1	47	33
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H](C)COCc2ccccc2)C1	ZINC000875143491	FF	On-Demand	Anodyne	CTSS	28	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H](C)COCc2ccccc2)C1	ZINC000875143491	FF	On-Demand	Anodyne	CAPN1	53	38
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H](C)COCc2ccccc2)C1	ZINC000875143491	FF	On-Demand	Anodyne	CAPN2	90	37
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H](C)COCc2ccccc2)C1	ZINC000875143491	FF	On-Demand	Anodyne	Q6PRC7_IXORI	41	35
Cc1cncc([C@@H]2CCCN2C(=O)N[C@H](C)Cc2ccc(O)cc2)c1	ZINC000875143495	EH	On-Demand	Anodyne	OPRD1	21	40
Cc1cncc([C@@H]2CCCN2C(=O)N[C@H](C)Cc2ccc(O)cc2)c1	ZINC000875143495	EH	On-Demand	Anodyne	NTSR1	79	32
Cc1cncc([C@@H]2CCCN2C(=O)N[C@H](C)Cc2ccc(O)cc2)c1	ZINC000875143495	EH	On-Demand	Anodyne	NTSR2	42	32
Cc1cncc([C@@H]2CCCN2C(=O)N[C@H](C)Cc2ccc(O)cc2)c1	ZINC000875143495	EH	On-Demand	Anodyne	HLA-A	45	33
Cc1cncc([C@H]2CCCN2C(=O)N[C@H](C)Cc2ccc(O)cc2)c1	ZINC000875143496	EH	On-Demand	Anodyne	OPRD1	21	40
Cc1cncc([C@H]2CCCN2C(=O)N[C@H](C)Cc2ccc(O)cc2)c1	ZINC000875143496	EH	On-Demand	Anodyne	NTSR1	79	32
Cc1cncc([C@H]2CCCN2C(=O)N[C@H](C)Cc2ccc(O)cc2)c1	ZINC000875143496	EH	On-Demand	Anodyne	NTSR2	42	32
Cc1cncc([C@H]2CCCN2C(=O)N[C@H](C)Cc2ccc(O)cc2)c1	ZINC000875143496	EH	On-Demand	Anodyne	HLA-A	45	33
Cc1cncc([C@H]2CCCN2C(=O)N[C@@H](C)Cc2ccc(O)cc2)c1	ZINC000875143497	EH	On-Demand	Anodyne	OPRD1	21	40
Cc1cncc([C@H]2CCCN2C(=O)N[C@@H](C)Cc2ccc(O)cc2)c1	ZINC000875143497	EH	On-Demand	Anodyne	NTSR1	79	32
Cc1cncc([C@H]2CCCN2C(=O)N[C@@H](C)Cc2ccc(O)cc2)c1	ZINC000875143497	EH	On-Demand	Anodyne	NTSR2	42	32
Cc1cncc([C@H]2CCCN2C(=O)N[C@@H](C)Cc2ccc(O)cc2)c1	ZINC000875143497	EH	On-Demand	Anodyne	HLA-A	45	33
Cc1cncc([C@@H]2CCCN2C(=O)N[C@@H](C)Cc2ccc(O)cc2)c1	ZINC000875143498	EH	On-Demand	Anodyne	OPRD1	21	40
Cc1cncc([C@@H]2CCCN2C(=O)N[C@@H](C)Cc2ccc(O)cc2)c1	ZINC000875143498	EH	On-Demand	Anodyne	NTSR1	79	32
Cc1cncc([C@@H]2CCCN2C(=O)N[C@@H](C)Cc2ccc(O)cc2)c1	ZINC000875143498	EH	On-Demand	Anodyne	NTSR2	42	32
Cc1cncc([C@@H]2CCCN2C(=O)N[C@@H](C)Cc2ccc(O)cc2)c1	ZINC000875143498	EH	On-Demand	Anodyne	HLA-A	45	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCCC[C@@H]1CCOC1=O	ZINC000875143499	DD	On-Demand	Anodyne	CXCR4	40	32
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCCC[C@@H]1CCOC1=O	ZINC000875143499	DD	On-Demand	Anodyne	GRIA1	51	37
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCCC[C@@H]1CCOC1=O	ZINC000875143499	DD	On-Demand	Anodyne	LUXR	43	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCCC[C@H]1CCOC1=O	ZINC000875143500	DD	On-Demand	Anodyne	CXCR4	40	32
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCCC[C@H]1CCOC1=O	ZINC000875143500	DD	On-Demand	Anodyne	GRIA1	51	37
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCCC[C@H]1CCOC1=O	ZINC000875143500	DD	On-Demand	Anodyne	LUXR	43	33
C[C@@H](CNC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)COCc1ccccc1	ZINC000875143509	GE	On-Demand	Anodyne	CAPN2	40	31
C[C@@H](CNC(=O)N1CCC(CO)(CO)CC1)COCc1ccccc1	ZINC000875143511	FD	On-Demand	Anodyne	GHRHR	33	42
C[C@@H](CNC(=O)N1CCC(CO)(CO)CC1)COCc1ccccc1	ZINC000875143511	FD	On-Demand	Anodyne	UGCG	21	41
C[C@@H](CNC(=O)N1CCC(CO)(CO)CC1)COCc1ccccc1	ZINC000875143511	FD	On-Demand	Anodyne	CTSS	17	41
C[C@@H](CNC(=O)N1CCC(CO)(CO)CC1)COCc1ccccc1	ZINC000875143511	FD	On-Demand	Anodyne	GHSR	40	42
C[C@@H](CNC(=O)N1CCC(CO)(CO)CC1)COCc1ccccc1	ZINC000875143511	FD	On-Demand	Anodyne	CAPN2	58	32
C[C@@H](CNC(=O)N1CCC(CO)(CO)CC1)COCc1ccccc1	ZINC000875143511	FD	On-Demand	Anodyne	SLC12A5	45	34
C[C@H](CNC(=O)N1CCC(CO)(CO)CC1)COCc1ccccc1	ZINC000875143512	FD	On-Demand	Anodyne	GHRHR	33	42
C[C@H](CNC(=O)N1CCC(CO)(CO)CC1)COCc1ccccc1	ZINC000875143512	FD	On-Demand	Anodyne	UGCG	21	41
C[C@H](CNC(=O)N1CCC(CO)(CO)CC1)COCc1ccccc1	ZINC000875143512	FD	On-Demand	Anodyne	CTSS	17	41
C[C@H](CNC(=O)N1CCC(CO)(CO)CC1)COCc1ccccc1	ZINC000875143512	FD	On-Demand	Anodyne	GHSR	40	42
C[C@H](CNC(=O)N1CCC(CO)(CO)CC1)COCc1ccccc1	ZINC000875143512	FD	On-Demand	Anodyne	CAPN2	58	32
C[C@H](CNC(=O)N1CCC(CO)(CO)CC1)COCc1ccccc1	ZINC000875143512	FD	On-Demand	Anodyne	SLC12A5	45	34
CC(=O)C1CCN(C(=O)C(=O)NCCCOc2ccc(F)cc2)CC1	ZINC000875143519	FD	On-Demand	Anodyne	CACNA1G	33	40
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875143527	EF	On-Demand	Anodyne	ACE	17	40
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875143527	EF	On-Demand	Anodyne	MME	25	40
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875143527	EF	On-Demand	Anodyne	YARS	55	33
C#C[C@@H]1CC[C@@H](NC(=O)N[C@@H](C)Cc2ccc(O)cc2)CC1	ZINC000875143529	DF	On-Demand	Mild	GRIA1	44	36
C#C[C@@H]1CC[C@@H](NC(=O)N[C@@H](C)Cc2ccc(O)cc2)CC1	ZINC000875143529	DF	On-Demand	Mild	YARS	61	33
C#C[C@@H]1CC[C@@H](NC(=O)N[C@H](C)Cc2ccc(O)cc2)CC1	ZINC000875143530	DF	On-Demand	Mild	GRIA1	44	36
C#C[C@@H]1CC[C@@H](NC(=O)N[C@H](C)Cc2ccc(O)cc2)CC1	ZINC000875143530	DF	On-Demand	Mild	YARS	61	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875143534	EF	On-Demand	Anodyne	YARS	45	31
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875143536	EF	On-Demand	Anodyne	YARS	45	31
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CC[C@](C)(C(F)(F)F)C1	ZINC000875143544	EG	On-Demand	Anodyne	YARS	59	30
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CC[C@@](C)(C(F)(F)F)C1	ZINC000875143545	EG	On-Demand	Anodyne	YARS	59	30
CCOC(=O)C1=CC[C@H](NC(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875143555	EE	On-Demand	Anodyne	CHRM2	17	42
CCOC(=O)C1=CC[C@H](NC(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875143555	EE	On-Demand	Anodyne	OPRM1	27	40
CCOC(=O)C1=CC[C@H](NC(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875143555	EE	On-Demand	Anodyne	OPRD1	24	40
CCOC(=O)C1=CC[C@H](NC(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875143555	EE	On-Demand	Anodyne	CHRM3	20	43
CCOC(=O)C1=CC[C@H](NC(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875143555	EE	On-Demand	Anodyne	NTSR1	44	31
CCOC(=O)C1=CC[C@H](NC(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875143555	EE	On-Demand	Anodyne	CAPNS1	47	32
CCOC(=O)C1=CC[C@H](NC(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875143555	EE	On-Demand	Anodyne	GRIA1	41	33
CCOC(=O)C1=CC[C@H](NC(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875143555	EE	On-Demand	Anodyne	YARS	67	40
CCOC(=O)C1=CC[C@@H](NC(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875143556	EE	On-Demand	Anodyne	CHRM2	17	42
CCOC(=O)C1=CC[C@@H](NC(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875143556	EE	On-Demand	Anodyne	OPRM1	27	40
CCOC(=O)C1=CC[C@@H](NC(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875143556	EE	On-Demand	Anodyne	OPRD1	24	40
CCOC(=O)C1=CC[C@@H](NC(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875143556	EE	On-Demand	Anodyne	CHRM3	20	43
CCOC(=O)C1=CC[C@@H](NC(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875143556	EE	On-Demand	Anodyne	NTSR1	44	31
CCOC(=O)C1=CC[C@@H](NC(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875143556	EE	On-Demand	Anodyne	CAPNS1	47	32
CCOC(=O)C1=CC[C@@H](NC(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875143556	EE	On-Demand	Anodyne	GRIA1	41	33
CCOC(=O)C1=CC[C@@H](NC(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875143556	EE	On-Demand	Anodyne	YARS	67	40
CCOC(=O)C1=CC[C@@H](NC(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875143557	EE	On-Demand	Anodyne	CHRM2	17	42
CCOC(=O)C1=CC[C@@H](NC(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875143557	EE	On-Demand	Anodyne	OPRM1	27	40
CCOC(=O)C1=CC[C@@H](NC(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875143557	EE	On-Demand	Anodyne	OPRD1	24	40
CCOC(=O)C1=CC[C@@H](NC(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875143557	EE	On-Demand	Anodyne	CHRM3	20	43
CCOC(=O)C1=CC[C@@H](NC(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875143557	EE	On-Demand	Anodyne	NTSR1	44	31
CCOC(=O)C1=CC[C@@H](NC(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875143557	EE	On-Demand	Anodyne	CAPNS1	47	32
CCOC(=O)C1=CC[C@@H](NC(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875143557	EE	On-Demand	Anodyne	GRIA1	41	33
CCOC(=O)C1=CC[C@@H](NC(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875143557	EE	On-Demand	Anodyne	YARS	67	40
CCOC(=O)C1=CC[C@H](NC(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875143558	EE	On-Demand	Anodyne	CHRM2	17	42
CCOC(=O)C1=CC[C@H](NC(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875143558	EE	On-Demand	Anodyne	OPRM1	27	40
CCOC(=O)C1=CC[C@H](NC(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875143558	EE	On-Demand	Anodyne	OPRD1	24	40
CCOC(=O)C1=CC[C@H](NC(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875143558	EE	On-Demand	Anodyne	CHRM3	20	43
CCOC(=O)C1=CC[C@H](NC(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875143558	EE	On-Demand	Anodyne	NTSR1	44	31
CCOC(=O)C1=CC[C@H](NC(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875143558	EE	On-Demand	Anodyne	CAPNS1	47	32
CCOC(=O)C1=CC[C@H](NC(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875143558	EE	On-Demand	Anodyne	GRIA1	41	33
CCOC(=O)C1=CC[C@H](NC(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875143558	EE	On-Demand	Anodyne	YARS	67	40
COc1cccc([C@H](O)C2CCN(C(=O)N[C@@H](C)Cc3ccc(O)cc3)CC2)c1	ZINC000875143562	GG	On-Demand	Anodyne	OPRD1	18	43
COc1cccc([C@H](O)C2CCN(C(=O)N[C@@H](C)Cc3ccc(O)cc3)CC2)c1	ZINC000875143562	GG	On-Demand	Anodyne	GRIN2B	18	41
COc1cccc([C@H](O)C2CCN(C(=O)N[C@@H](C)Cc3ccc(O)cc3)CC2)c1	ZINC000875143562	GG	On-Demand	Anodyne	YARS	45	33
COc1cccc([C@H](O)C2CCN(C(=O)N[C@H](C)Cc3ccc(O)cc3)CC2)c1	ZINC000875143563	GG	On-Demand	Anodyne	OPRD1	18	43
COc1cccc([C@H](O)C2CCN(C(=O)N[C@H](C)Cc3ccc(O)cc3)CC2)c1	ZINC000875143563	GG	On-Demand	Anodyne	GRIN2B	18	41
COc1cccc([C@H](O)C2CCN(C(=O)N[C@H](C)Cc3ccc(O)cc3)CC2)c1	ZINC000875143563	GG	On-Demand	Anodyne	YARS	45	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875143565	CC	On-Demand	Anodyne	YARS	78	38
CCn1ncc(CNC(=O)N[C@H](C)Cc2ccc(O)cc2)n1	ZINC000875143570	DD	On-Demand	Anodyne	GRIA1	54	37
CCn1ncc(CNC(=O)N[C@@H](C)Cc2ccc(O)cc2)n1	ZINC000875143571	DD	On-Demand	Anodyne	GRIA1	54	37
CCCCCCCNC(=O)C(=O)NCc1cccc(OC)n1	ZINC000875143586	DD	On-Demand	Mild	ASAH1	77	34
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](C)COCc1ccccc1	ZINC000875143588	DF	On-Demand	Anodyne	MME	37	42
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](C)COCc1ccccc1	ZINC000875143588	DF	On-Demand	Anodyne	CTSB	56	38
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](C)COCc1ccccc1	ZINC000875143588	DF	On-Demand	Anodyne	PAPA1_CARPA	62	38
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](C)COCc1ccccc1	ZINC000875143588	DF	On-Demand	Anodyne	CTSK	27	41
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](C)COCc1ccccc1	ZINC000875143588	DF	On-Demand	Anodyne	CAPNS1	54	34
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](C)COCc1ccccc1	ZINC000875143588	DF	On-Demand	Anodyne	CAPN1	78	40
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](C)COCc1ccccc1	ZINC000875143588	DF	On-Demand	Anodyne	CAPN2	114	38
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](C)COCc1ccccc1	ZINC000875143588	DF	On-Demand	Anodyne	NPR	73	39
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](C)COCc1ccccc1	ZINC000875143588	DF	On-Demand	Anodyne	PDS	42	34
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](C)COCc1ccccc1	ZINC000875143589	DF	On-Demand	Anodyne	MME	37	42
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](C)COCc1ccccc1	ZINC000875143589	DF	On-Demand	Anodyne	CTSB	56	38
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](C)COCc1ccccc1	ZINC000875143589	DF	On-Demand	Anodyne	PAPA1_CARPA	62	38
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](C)COCc1ccccc1	ZINC000875143589	DF	On-Demand	Anodyne	CTSK	27	41
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](C)COCc1ccccc1	ZINC000875143589	DF	On-Demand	Anodyne	CAPNS1	54	34
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](C)COCc1ccccc1	ZINC000875143589	DF	On-Demand	Anodyne	CAPN1	78	40
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](C)COCc1ccccc1	ZINC000875143589	DF	On-Demand	Anodyne	CAPN2	114	38
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](C)COCc1ccccc1	ZINC000875143589	DF	On-Demand	Anodyne	NPR	73	39
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](C)COCc1ccccc1	ZINC000875143589	DF	On-Demand	Anodyne	PDS	42	34
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCO[C@H]([C@@H]2COC(C)(C)O2)C1	ZINC000875143596	FD	On-Demand	Anodyne	YARS	58	33
C#CC[C@H](COC)NC(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875143597	CD	On-Demand	Mild	YARS	51	33
C#CC[C@@H](COC)NC(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875143598	CD	On-Demand	Mild	YARS	51	33
C#CC[C@@H](COC)NC(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875143599	CD	On-Demand	Mild	YARS	51	33
C#CC[C@H](COC)NC(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875143600	CD	On-Demand	Mild	YARS	51	33
C[C@@H](CNC(=O)N[C@H]1CCN(CC(C)(C)O)C1)COCc1ccccc1	ZINC000875143612	FD	On-Demand	Anodyne	GHSR	33	42
C[C@@H](CNC(=O)N[C@H]1CCN(CC(C)(C)O)C1)COCc1ccccc1	ZINC000875143612	FD	On-Demand	Anodyne	BIRC2	43	41
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875143614	DE	On-Demand	Anodyne	OPRM1	47	47
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875143614	DE	On-Demand	Anodyne	NTSR1	76	34
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875143614	DE	On-Demand	Anodyne	CACNA1B	24	41
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875143614	DE	On-Demand	Anodyne	HLA-A	45	31
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875143614	DE	On-Demand	Anodyne	YARS	75	35
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875143614	DE	On-Demand	Anodyne	DPP7	52	35
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875143615	DE	On-Demand	Anodyne	OPRM1	47	47
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875143615	DE	On-Demand	Anodyne	NTSR1	76	34
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875143615	DE	On-Demand	Anodyne	CACNA1B	24	41
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875143615	DE	On-Demand	Anodyne	HLA-A	45	31
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875143615	DE	On-Demand	Anodyne	YARS	75	35
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875143615	DE	On-Demand	Anodyne	DPP7	52	35
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875143616	DE	On-Demand	Anodyne	OPRM1	47	47
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875143616	DE	On-Demand	Anodyne	NTSR1	76	34
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875143616	DE	On-Demand	Anodyne	CACNA1B	24	41
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875143616	DE	On-Demand	Anodyne	HLA-A	45	31
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875143616	DE	On-Demand	Anodyne	YARS	75	35
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875143616	DE	On-Demand	Anodyne	DPP7	52	35
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875143617	DE	On-Demand	Anodyne	OPRM1	47	47
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875143617	DE	On-Demand	Anodyne	NTSR1	76	34
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875143617	DE	On-Demand	Anodyne	CACNA1B	24	41
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875143617	DE	On-Demand	Anodyne	HLA-A	45	31
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875143617	DE	On-Demand	Anodyne	YARS	75	35
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875143617	DE	On-Demand	Anodyne	DPP7	52	35
COCC(C)(C)CCNC(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875143635	DF	On-Demand	Anodyne	PAPA1_CARPA	16	40
COCC(C)(C)CCNC(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875143635	DF	On-Demand	Anodyne	GRIA1	50	37
COCC(C)(C)CCNC(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875143636	DF	On-Demand	Anodyne	PAPA1_CARPA	16	40
COCC(C)(C)CCNC(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875143636	DF	On-Demand	Anodyne	GRIA1	50	37
C[C@@H](Cc1ccc(O)cc1)NC(=O)NC[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000875143650	GF	On-Demand	Anodyne	PAPA1_CARPA	31	47
C[C@@H](Cc1ccc(O)cc1)NC(=O)NC[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000875143650	GF	On-Demand	Anodyne	YARS	62	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)NC[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000875143650	GF	On-Demand	Anodyne	FPR1	46	36
C[C@@H](Cc1ccc(O)cc1)NC(=O)NC[C@@H]1C[C@H](NC(=O)OC(C)(C)C)C1	ZINC000875143651	GF	On-Demand	Anodyne	PAPA1_CARPA	31	47
C[C@@H](Cc1ccc(O)cc1)NC(=O)NC[C@@H]1C[C@H](NC(=O)OC(C)(C)C)C1	ZINC000875143651	GF	On-Demand	Anodyne	YARS	62	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)NC[C@@H]1C[C@H](NC(=O)OC(C)(C)C)C1	ZINC000875143651	GF	On-Demand	Anodyne	FPR1	46	36
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCC1CC(NC(=O)OC(C)(C)C)C1	ZINC000875143654	GF	On-Demand	Anodyne	PAPA1_CARPA	31	47
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCC1CC(NC(=O)OC(C)(C)C)C1	ZINC000875143654	GF	On-Demand	Anodyne	YARS	62	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCC1CC(NC(=O)OC(C)(C)C)C1	ZINC000875143654	GF	On-Demand	Anodyne	FPR1	46	36
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875143659	EH	On-Demand	Anodyne	YARS	46	31
COCC(C)(C)CCNC(=O)C(=O)NCc1ccc2c(c1)CCCN2C	ZINC000875143661	FD	On-Demand	Clean	DRD4	40	32
C[C@@H](Cc1ccc(O)cc1)NC(=O)NC1CCC(OC(C)(C)C)CC1	ZINC000875143680	EH	On-Demand	Anodyne	GRIA1	43	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)NC1CCC(OC(C)(C)C)CC1	ZINC000875143680	EH	On-Demand	Anodyne	YARS	56	36
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCc1ncc(Cl)s1	ZINC000875143693	EF	On-Demand	Anodyne	GRIA1	43	32
COC(=O)C1(O)CN(C(=O)N[C@@H](C)Cc2ccc(O)cc2)C1	ZINC000875143694	DC	On-Demand	Anodyne	YARS	57	32
COC(=O)C1(O)CN(C(=O)N[C@H](C)Cc2ccc(O)cc2)C1	ZINC000875143695	DC	On-Demand	Anodyne	YARS	57	32
C[C@@H](CNC(=O)N1CCO[C@@H](C(F)(F)F)CC1)COCc1ccccc1	ZINC000875143697	FG	On-Demand	Anodyne	CTSS	27	43
C[C@@H](CNC(=O)N1CCO[C@H](C(F)(F)F)CC1)COCc1ccccc1	ZINC000875143698	FG	On-Demand	Anodyne	CTSS	27	43
C[C@@H](Cc1ccc(O)cc1)NC(=O)NC1CCC(C)(N(C)C)CC1	ZINC000875143703	EF	On-Demand	Anodyne	YARS	55	32
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCC[C@@H](O)C1CCCC1	ZINC000875143708	DF	On-Demand	Anodyne	OPRM1	31	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCC[C@@H](O)C1CCCC1	ZINC000875143708	DF	On-Demand	Anodyne	OPRD1	23	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCC[C@@H](O)C1CCCC1	ZINC000875143708	DF	On-Demand	Anodyne	GRIA1	52	39
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCC[C@@H](O)C1CCCC1	ZINC000875143708	DF	On-Demand	Anodyne	YARS	64	34
COC(=O)C1(O)CN(C(=O)NC[C@@H](C)COCc2ccccc2)C1	ZINC000875143719	EC	On-Demand	Anodyne	CAPN2	49	32
COC(=O)C1(O)CN(C(=O)NC[C@@H](C)COCc2ccccc2)C1	ZINC000875143719	EC	On-Demand	Anodyne	SLC12A5	52	36
COC(=O)C1(O)CN(C(=O)NC[C@H](C)COCc2ccccc2)C1	ZINC000875143720	EC	On-Demand	Anodyne	CAPN2	49	32
COC(=O)C1(O)CN(C(=O)NC[C@H](C)COCc2ccccc2)C1	ZINC000875143720	EC	On-Demand	Anodyne	SLC12A5	52	36
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1C[C@H]2C(=O)OC[C@H]2C1	ZINC000875143722	DD	On-Demand	Anodyne	YARS	52	35
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCc1ncc(Br)s1	ZINC000875143728	FG	On-Demand	Anodyne	GRIA1	42	31
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H](C)C(=O)NCc3ccccc3)C[C@@H]1C2	ZINC000875143729	FD	On-Demand	Anodyne	ANPEP	20	40
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H](C)C(=O)NCc3ccccc3)C[C@@H]1C2	ZINC000875143730	FD	On-Demand	Anodyne	ANPEP	20	40
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCCc1cn(C)c2ncccc12	ZINC000875143742	FF	On-Demand	Anodyne	GRIA1	40	34
C[C@@H](Cc1ccc(O)cc1)NC(=O)N[C@@H]1CC(C)(C)CC[C@H]1O	ZINC000875143748	DF	On-Demand	Anodyne	YARS	76	36
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCc1ccc(C2(C)OCCO2)cc1	ZINC000875143771	FG	On-Demand	Anodyne	GRIA1	40	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCc1ccc(C2(C)OCCO2)cc1	ZINC000875143771	FG	On-Demand	Anodyne	YARS	73	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCO[C@](C)(C(F)(F)F)C1	ZINC000875143775	EF	On-Demand	Anodyne	YARS	73	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCO[C@@](C)(C(F)(F)F)C1	ZINC000875143776	EF	On-Demand	Anodyne	YARS	73	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)NC[C@H]1CCC12CCOCC2	ZINC000875143784	EF	On-Demand	Anodyne	YARS	40	31
C[C@@H](Cc1ccc(O)cc1)NC(=O)NC[C@@H]1CCC12CCOCC2	ZINC000875143785	EF	On-Demand	Anodyne	YARS	40	31
C[C@@H]1CN(C(=O)N[C@H](C)Cc2ccc(O)cc2)C[C@H]1CNC(=O)OC(C)(C)C	ZINC000875143787	GG	On-Demand	Anodyne	PAPA1_CARPA	25	43
C[C@@H]1CN(C(=O)N[C@H](C)Cc2ccc(O)cc2)C[C@@H]1CNC(=O)OC(C)(C)C	ZINC000875143788	GG	On-Demand	Anodyne	PAPA1_CARPA	25	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875143805	EE	On-Demand	Anodyne	SLC6A3	53	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875143805	EE	On-Demand	Anodyne	YARS	56	34
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875143806	EE	On-Demand	Anodyne	SLC6A3	53	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875143806	EE	On-Demand	Anodyne	YARS	56	34
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875143807	EE	On-Demand	Anodyne	SLC6A3	53	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875143807	EE	On-Demand	Anodyne	YARS	56	34
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875143808	EE	On-Demand	Anodyne	SLC6A3	53	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875143808	EE	On-Demand	Anodyne	YARS	56	34
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCc1ccnc(F)c1	ZINC000875143810	DE	On-Demand	Anodyne	GRIA1	51	35
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875143811	FD	On-Demand	Anodyne	GRIA1	43	34
CCOC(=O)[C@@H]1CN(C(=O)N[C@H](C)Cc2ccc(O)cc2)CCC1(F)F	ZINC000875143832	FF	On-Demand	Anodyne	YARS	57	36
CCOC(=O)[C@@H]1CN(C(=O)N[C@@H](C)Cc2ccc(O)cc2)CCC1(F)F	ZINC000875143835	FF	On-Demand	Anodyne	YARS	57	36
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875143848	GH	On-Demand	Anodyne	OPRM1	55	45
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875143848	GH	On-Demand	Anodyne	OPRD1	41	37
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875143848	GH	On-Demand	Anodyne	OPRL1	15	45
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875143848	GH	On-Demand	Anodyne	MME	53	37
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875143848	GH	On-Demand	Anodyne	TIMP3	61	36
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875143848	GH	On-Demand	Anodyne	YARS	48	36
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCCSCCC(F)(F)F	ZINC000875143854	FG	On-Demand	Anodyne	GRIA1	48	34
C[C@@H](Cc1ccc(O)cc1)NC(=O)NNC(=O)[C@@H]1CCCN(C)[C@@H]1C	ZINC000875143869	ED	On-Demand	Reactive	NTSR1	41	31
C[C@@H](Cc1ccc(O)cc1)NC(=O)NNC(=O)[C@@H]1CCCN(C)[C@@H]1C	ZINC000875143869	ED	On-Demand	Reactive	YARS	44	31
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875143871	EF	On-Demand	Anodyne	OPRM1	36	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875143871	EF	On-Demand	Anodyne	NTSR1	81	34
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875143871	EF	On-Demand	Anodyne	NTSR2	62	31
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875143871	EF	On-Demand	Anodyne	HLA-A	45	32
C[C@@H](Cc1ccc(O)cc1)NC(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875143871	EF	On-Demand	Anodyne	YARS	56	32
COC(=O)N(C)NC(=O)NC[C@@H](C)COCc1ccccc1	ZINC000875143879	DD	On-Demand	Reactive	CAPN2	44	34
COC(=O)N(C)NC(=O)NC[C@@H](C)COCc1ccccc1	ZINC000875143879	DD	On-Demand	Reactive	NPR	56	35
COC(=O)N(C)NC(=O)NC[C@H](C)COCc1ccccc1	ZINC000875143880	DD	On-Demand	Reactive	CAPN2	44	34
COC(=O)N(C)NC(=O)NC[C@H](C)COCc1ccccc1	ZINC000875143880	DD	On-Demand	Reactive	NPR	56	35
C[C@@H](Cc1ccc(O)cc1)NC(=O)NC(C)(C)[C@@H]1CCCCO1	ZINC000875143884	DF	On-Demand	Anodyne	YARS	74	34
C[C@@H](Cc1ccc(O)cc1)NC(=O)NC(C)(C)[C@H]1CCCCO1	ZINC000875143887	DF	On-Demand	Anodyne	YARS	74	34
C[C@@H](Cc1ccc(O)cc1)NC(=O)NC[C@H]1CC(C)(C)CO1	ZINC000875143900	DE	On-Demand	Anodyne	GRIA1	43	32
C[C@@H](Cc1ccc(O)cc1)NC(=O)NC[C@H]1CC(C)(C)CO1	ZINC000875143900	DE	On-Demand	Anodyne	YARS	74	35
C[C@@H](Cc1ccc(O)cc1)NC(=O)NC[C@@H]1CC(C)(C)CO1	ZINC000875143901	DE	On-Demand	Anodyne	GRIA1	43	32
C[C@@H](Cc1ccc(O)cc1)NC(=O)NC[C@@H]1CC(C)(C)CO1	ZINC000875143901	DE	On-Demand	Anodyne	YARS	74	35
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCC[C@H]1CCCS1	ZINC000875143912	DF	On-Demand	Anodyne	GRIA1	43	36
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCC[C@H]1CCCS1	ZINC000875143912	DF	On-Demand	Anodyne	YARS	44	31
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCC[C@@H]1CCCS1	ZINC000875143913	DF	On-Demand	Anodyne	GRIA1	43	36
C[C@@H](Cc1ccc(O)cc1)NC(=O)NCC[C@@H]1CCCS1	ZINC000875143913	DF	On-Demand	Anodyne	YARS	44	31
C#CC[C@H](CCOC)NC(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875143921	DE	On-Demand	Mild	YARS	61	32
C#CC[C@@H](CCOC)NC(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875143922	DE	On-Demand	Mild	YARS	61	32
C#CC[C@H](CCOC)NC(=O)N[C@H](C)Cc1ccc(O)cc1	ZINC000875143923	DE	On-Demand	Mild	YARS	61	32
C#CC[C@@H](CCOC)NC(=O)N[C@@H](C)Cc1ccc(O)cc1	ZINC000875143924	DE	On-Demand	Mild	YARS	61	32
CC(=O)C1CCN(C(=O)C(=O)NCC(C)(C)c2cccc(Cl)c2)CC1	ZINC000875143931	FF	On-Demand	Anodyne	CACNA1I	42	39
CC(=O)C1CCN(C(=O)NCc2ccc(Cn3ccccc3=O)cc2)CC1	ZINC000875143943	FE	On-Demand	Anodyne	HRH3	15	45
CC(=O)C1CCN(C(=O)NCc2ccc(Cn3ccccc3=O)cc2)CC1	ZINC000875143943	FE	On-Demand	Anodyne	SIGMAR1	17	46
CC(=O)C1CCN(C(=O)NCc2ccc(Cn3ccccc3=O)cc2)CC1	ZINC000875143943	FE	On-Demand	Anodyne	EPHX2	26	41
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCOc3c(Cl)cccc32)CC1	ZINC000875143944	GD	On-Demand	Anodyne	EPHX2	20	43
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCOc3c(Cl)cccc32)CC1	ZINC000875143945	GD	On-Demand	Anodyne	EPHX2	20	43
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(Cn3ccccc3=O)cc2)C1	ZINC000875143968	FE	On-Demand	Anodyne	HRH3	15	47
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(Cn3ccccc3=O)cc2)C1	ZINC000875143968	FE	On-Demand	Anodyne	PREP	15	40
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(Cn3ccccc3=O)cc2)C1	ZINC000875143968	FE	On-Demand	Anodyne	DPP7	52	33
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(Cn3ccccc3=O)cc2)C1	ZINC000875143969	FE	On-Demand	Anodyne	HRH3	15	47
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(Cn3ccccc3=O)cc2)C1	ZINC000875143969	FE	On-Demand	Anodyne	PREP	15	40
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(Cn3ccccc3=O)cc2)C1	ZINC000875143969	FE	On-Demand	Anodyne	DPP7	52	33
O=C1CCN(C(=O)NCCNC(=O)c2ccc(F)cc2)CCCCCCN1	ZINC000875143972	GD	On-Demand	Anodyne	PLD1	43	38
O=C1CCN(C(=O)NCCNC(=O)c2ccc(F)cc2)CCCCCCN1	ZINC000875143972	GD	On-Demand	Anodyne	PLD2	62	42
CONC(=O)C1CCN(C(=O)NCC2(c3cccc(Cl)c3)CCCC2)CC1	ZINC000875143984	GG	On-Demand	Anodyne	EPHX2	25	44
O=C(NCC1(c2cccc(Cl)c2)CCCC1)N1CCC(CO)(CO)CC1	ZINC000875143985	GF	On-Demand	Anodyne	EPHX2	19	46
COCCN(CC1CCN(C)CC1)C(=O)NCCNC(=O)c1ccc(F)cc1	ZINC000875144021	GD	On-Demand	Anodyne	DRD3	16	41
COCCN(CC1CCN(C)CC1)C(=O)NCCNC(=O)c1ccc(F)cc1	ZINC000875144021	GD	On-Demand	Anodyne	CCR3	20	45
COCCN(CC1CCN(C)CC1)C(=O)NCCNC(=O)c1ccc(F)cc1	ZINC000875144021	GD	On-Demand	Anodyne	CACNA1I	61	34
COCCN(CC1CCN(C)CC1)C(=O)NCCNC(=O)c1ccc(F)cc1	ZINC000875144021	GD	On-Demand	Anodyne	ACKR3	59	36
O=C(NCc1ccc(Cn2ccccc2=O)cc1)N1CCC(CO)(CO)CC1	ZINC000875144067	GD	On-Demand	Anodyne	NPSR1	26	40
O=C(NCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144069	GE	On-Demand	Anodyne	ACE	32	41
O=C(NCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144069	GE	On-Demand	Anodyne	SLC6A3	15	45
O=C(NCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144069	GE	On-Demand	Anodyne	BCHE	21	42
O=C(NCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144069	GE	On-Demand	Anodyne	PLD1	69	39
O=C(NCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144069	GE	On-Demand	Anodyne	DPP4	17	49
O=C(NCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144069	GE	On-Demand	Anodyne	PREP	21	40
O=C(NCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144069	GE	On-Demand	Anodyne	PLD2	66	38
O=C(NCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144069	GE	On-Demand	Anodyne	CYP24A1	27	41
O=C(NCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144069	GE	On-Demand	Anodyne	CYP27B1	32	41
O=C(NCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144070	GE	On-Demand	Anodyne	ACE	32	41
O=C(NCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144070	GE	On-Demand	Anodyne	SLC6A3	15	45
O=C(NCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144070	GE	On-Demand	Anodyne	BCHE	21	42
O=C(NCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144070	GE	On-Demand	Anodyne	PLD1	69	39
O=C(NCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144070	GE	On-Demand	Anodyne	DPP4	17	49
O=C(NCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144070	GE	On-Demand	Anodyne	PREP	21	40
O=C(NCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144070	GE	On-Demand	Anodyne	PLD2	66	38
O=C(NCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144070	GE	On-Demand	Anodyne	CYP24A1	27	41
O=C(NCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144070	GE	On-Demand	Anodyne	CYP27B1	32	41
O=C(NCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144071	GE	On-Demand	Anodyne	ACE	32	41
O=C(NCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144071	GE	On-Demand	Anodyne	SLC6A3	15	45
O=C(NCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144071	GE	On-Demand	Anodyne	BCHE	21	42
O=C(NCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144071	GE	On-Demand	Anodyne	PLD1	69	39
O=C(NCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144071	GE	On-Demand	Anodyne	DPP4	17	49
O=C(NCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144071	GE	On-Demand	Anodyne	PREP	21	40
O=C(NCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144071	GE	On-Demand	Anodyne	PLD2	66	38
O=C(NCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144071	GE	On-Demand	Anodyne	CYP24A1	27	41
O=C(NCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144071	GE	On-Demand	Anodyne	CYP27B1	32	41
O=C(NCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144072	GE	On-Demand	Anodyne	ACE	32	41
O=C(NCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144072	GE	On-Demand	Anodyne	SLC6A3	15	45
O=C(NCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144072	GE	On-Demand	Anodyne	BCHE	21	42
O=C(NCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144072	GE	On-Demand	Anodyne	PLD1	69	39
O=C(NCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144072	GE	On-Demand	Anodyne	DPP4	17	49
O=C(NCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144072	GE	On-Demand	Anodyne	PREP	21	40
O=C(NCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144072	GE	On-Demand	Anodyne	PLD2	66	38
O=C(NCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144072	GE	On-Demand	Anodyne	CYP24A1	27	41
O=C(NCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000875144072	GE	On-Demand	Anodyne	CYP27B1	32	41
CSc1ccc([N+](=O)[O-])c(C(=O)OCC[C@H]2CCCCN2C)c1	ZINC000875144077	EG	On-Demand	Bother	CHRNA10	48	32
CSc1ccc([N+](=O)[O-])c(C(=O)OCC[C@H]2CCCCN2C)c1	ZINC000875144077	EG	On-Demand	Bother	ACKR3	62	30
CSc1ccc([N+](=O)[O-])c(C(=O)OCC[C@@H]2CCCCN2C)c1	ZINC000875144078	EG	On-Demand	Bother	CHRNA10	48	32
CSc1ccc([N+](=O)[O-])c(C(=O)OCC[C@@H]2CCCCN2C)c1	ZINC000875144078	EG	On-Demand	Bother	ACKR3	62	30
CCCCCCCNC(=O)C(=O)NCc1nccn1C(F)F	ZINC000875144173	DD	On-Demand	Mild	ASAH1	94	37
COCCN(CC1CCN(C)CC1)C(=O)NCC1CCC(C)CC1	ZINC000875144195	EF	On-Demand	Anodyne	CACNA1I	41	33
CN1CC[C@H]2CN(C(=O)NCc3ccc(Cn4ccccc4=O)cc3)CC[C@@H]21	ZINC000875144196	GE	On-Demand	Anodyne	PLD1	42	32
CN1CC[C@H]2CN(C(=O)NCc3ccc(Cn4ccccc4=O)cc3)CC[C@@H]21	ZINC000875144196	GE	On-Demand	Anodyne	BIRC2	41	33
CN1CC[C@H]2CN(C(=O)NCc3ccc(Cn4ccccc4=O)cc3)CC[C@H]21	ZINC000875144198	GE	On-Demand	Anodyne	PLD1	42	32
CN1CC[C@H]2CN(C(=O)NCc3ccc(Cn4ccccc4=O)cc3)CC[C@H]21	ZINC000875144198	GE	On-Demand	Anodyne	BIRC2	41	33
COc1ccc(-n2ccc(CNC(=O)N3CCC[C@H](OC4CCC4)CC3)n2)cc1	ZINC000875144262	GH	On-Demand	Anodyne	EPHX2	17	41
COc1ccc(-n2ccc(CNC(=O)N3CCC[C@@H](OC4CCC4)CC3)n2)cc1	ZINC000875144263	GH	On-Demand	Anodyne	EPHX2	17	41
O=C(NCCNC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1ccc(F)cc1	ZINC000875144337	FD	On-Demand	Anodyne	PLD1	44	39
CC(C)(C)CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875144362	DG	On-Demand	Anodyne	FKBP1A	41	57
CC(C)(C)CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875144362	DG	On-Demand	Anodyne	CPT1A	77	33
CC(C)(C)CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875144362	DG	On-Demand	Anodyne	PREP	41	37
CC(C)(C)CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875144362	DG	On-Demand	Anodyne	AMY2	43	30
CC(C)(C)CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875144362	DG	On-Demand	Anodyne	WNT3	41	34
CC(C)(C)CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875144363	DG	On-Demand	Anodyne	FKBP1A	41	57
CC(C)(C)CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875144363	DG	On-Demand	Anodyne	CPT1A	77	33
CC(C)(C)CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875144363	DG	On-Demand	Anodyne	PREP	41	37
CC(C)(C)CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875144363	DG	On-Demand	Anodyne	AMY2	43	30
CC(C)(C)CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875144363	DG	On-Demand	Anodyne	WNT3	41	34
CC(C)(C)CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875144364	DG	On-Demand	Anodyne	FKBP1A	41	57
CC(C)(C)CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875144364	DG	On-Demand	Anodyne	CPT1A	77	33
CC(C)(C)CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875144364	DG	On-Demand	Anodyne	PREP	41	37
CC(C)(C)CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875144364	DG	On-Demand	Anodyne	AMY2	43	30
CC(C)(C)CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875144364	DG	On-Demand	Anodyne	WNT3	41	34
CC(C)(C)CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875144365	DG	On-Demand	Anodyne	FKBP1A	41	57
CC(C)(C)CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875144365	DG	On-Demand	Anodyne	CPT1A	77	33
CC(C)(C)CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875144365	DG	On-Demand	Anodyne	PREP	41	37
CC(C)(C)CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875144365	DG	On-Demand	Anodyne	AMY2	43	30
CC(C)(C)CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875144365	DG	On-Demand	Anodyne	WNT3	41	34
COc1ccccc1NC(=O)COc1ccc(C(=O)N2CCCc3cc(C)ccc32)cc1OC	ZINC000875144377	JJ	On-Demand	Anodyne	AVPR2	85	50
C[C@@H](NC(=O)N1CC2(CCCO2)C1)c1ccccc1C(F)(F)F	ZINC000875144401	EG	On-Demand	Anodyne	RBP4	46	38
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1ccccc1C(F)(F)F	ZINC000875144406	FI	On-Demand	Anodyne	RBP4	65	39
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1ccccc1C(F)(F)F	ZINC000875144408	FI	On-Demand	Anodyne	RBP4	65	39
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccccc1-n1ccnc1	ZINC000875144422	GE	On-Demand	Anodyne	NOS2	85	34
C[C@@H](NC(=O)N1C[C@H]2C[C@@H](O)C[C@H]1C2)c1ccccc1C(F)(F)F	ZINC000875144429	EG	On-Demand	Anodyne	RBP4	61	39
O=C(NCC1(c2cccc(Cl)c2)CCCC1)N1CCC2(CCNC2=O)CC1	ZINC000875144430	GG	On-Demand	Anodyne	CACNA1H	48	40
O=C(NCC1(c2cccc(Cl)c2)CCCC1)N1CCC2(CCNC2=O)CC1	ZINC000875144430	GG	On-Demand	Anodyne	EPHX2	15	40
C[C@H](NC(=O)N1C[C@H]2C[C@H](O)C[C@H]1C2)c1ccccc1C(F)(F)F	ZINC000875144431	EG	On-Demand	Anodyne	RBP4	61	39
C[C@@H](NC(=O)N1C[C@H]2C[C@H](O)C[C@H]1C2)c1ccccc1C(F)(F)F	ZINC000875144432	EG	On-Demand	Anodyne	RBP4	61	39
C[C@H](NC(=O)N1C[C@H]2C[C@@H](O)C[C@H]1C2)c1ccccc1C(F)(F)F	ZINC000875144433	EG	On-Demand	Anodyne	RBP4	61	39
CC[C@@H]1COCCN1CCNC(=O)NCCNC(=O)c1ccc(F)cc1	ZINC000875144436	FC	On-Demand	Anodyne	PLD1	48	41
CC[C@@H]1COCCN1CCNC(=O)NCCNC(=O)c1ccc(F)cc1	ZINC000875144436	FC	On-Demand	Anodyne	PLD2	52	40
O=CN1CCCN(C(=O)NCc2ccccc2-n2ccnc2)CC1	ZINC000875144475	ED	On-Demand	Anodyne	NOS2	93	39
O=C1CCN(C(=O)NCc2ccccc2-n2ccnc2)CCCCCCN1	ZINC000875144477	FE	On-Demand	Anodyne	NOS2	44	34
CN1CCN(C(=O)NCc2ccccc2-n2ccnc2)CCC1(C)C	ZINC000875144493	EE	On-Demand	Anodyne	NOS2	55	36
O=C(NCCNC(=O)c1ccc(F)cc1)NCC[C@H](O)C1CCCC1	ZINC000875144499	FD	On-Demand	Anodyne	FOLH1	19	41
O=C(NCCNC(=O)c1ccc(F)cc1)NCC[C@H](O)C1CCCC1	ZINC000875144499	FD	On-Demand	Anodyne	SSTR3	18	41
O=C(NCCNC(=O)c1ccc(F)cc1)NCC[C@@H](O)C1CCCC1	ZINC000875144501	FD	On-Demand	Anodyne	FOLH1	19	41
O=C(NCCNC(=O)c1ccc(F)cc1)NCC[C@@H](O)C1CCCC1	ZINC000875144501	FD	On-Demand	Anodyne	SSTR3	18	41
O=C(NCc1nccn1C(F)F)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875144559	GE	On-Demand	Anodyne	C3AR1	41	39
O=C(NCc1nccn1C(F)F)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875144560	GE	On-Demand	Anodyne	C3AR1	41	39
O=C1CCN(C(=O)N[C@H]2CCc3c(F)cccc32)CCCCCCN1	ZINC000875144691	EF	On-Demand	Anodyne	CALCRL	43	38
O=C1CCN(C(=O)N[C@@H]2CCc3c(F)cccc32)CCCCCCN1	ZINC000875144692	EF	On-Demand	Anodyne	CALCRL	43	38
C[C@@H](NC(=O)N1CC=CC1)c1ccccc1C(F)(F)F	ZINC000875144714	CG	On-Demand	Anodyne	RBP4	83	44
C[C@@H](NC(=O)N1CCn2nnc(CO)c2C1)c1ccccc1C(F)(F)F	ZINC000875144719	FE	On-Demand	Anodyne	RBP4	47	37
O=C(NCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000875144723	GF	On-Demand	Anodyne	PLD1	48	40
O=C(NCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000875144723	GF	On-Demand	Anodyne	EPHX2	23	45
O=C(NCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000875144723	GF	On-Demand	Anodyne	PLD2	50	40
O=C(NCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000875144723	GF	On-Demand	Anodyne	SCD1	20	40
O=C(NCCNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000875144724	GF	On-Demand	Anodyne	PLD1	48	40
O=C(NCCNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000875144724	GF	On-Demand	Anodyne	EPHX2	23	45
O=C(NCCNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000875144724	GF	On-Demand	Anodyne	PLD2	50	40
O=C(NCCNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000875144724	GF	On-Demand	Anodyne	SCD1	20	40
C[C@H](NC(=O)N1OC2CCC1CC2)c1ccccc1C(F)(F)F	ZINC000875144725	EI	On-Demand	Anodyne	RBP4	65	38
C[C@H](NC(=O)N1OC2CCC1CC2)c1ccccc1C(F)(F)F	ZINC000875144725	EI	On-Demand	Anodyne	SFRP1	96	33
C[C@H](NC(=O)N1OC2CCC1CC2)c1ccccc1C(F)(F)F	ZINC000875144725	EI	On-Demand	Anodyne	WNT3	74	33
C[C@@H](NC(=O)N1OC2CCC1CC2)c1ccccc1C(F)(F)F	ZINC000875144726	EI	On-Demand	Anodyne	RBP4	65	38
C[C@@H](NC(=O)N1OC2CCC1CC2)c1ccccc1C(F)(F)F	ZINC000875144726	EI	On-Demand	Anodyne	SFRP1	96	33
C[C@@H](NC(=O)N1OC2CCC1CC2)c1ccccc1C(F)(F)F	ZINC000875144726	EI	On-Demand	Anodyne	WNT3	74	33
O=C1CCN(C(=O)N[C@H]2CCc3cc(F)ccc32)CCCCCCN1	ZINC000875144727	EF	On-Demand	Anodyne	BDKRB1	41	39
O=C1CCN(C(=O)N[C@@H]2CCc3cc(F)ccc32)CCCCCCN1	ZINC000875144728	EF	On-Demand	Anodyne	BDKRB1	41	39
COC(=O)N(C)NC(=O)NCC1(c2ccc(F)cc2)CCOCC1	ZINC000875144783	ED	On-Demand	Reactive	KCNA3	41	37
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(Cn2ccccc2=O)cc1	ZINC000875144790	FE	On-Demand	Anodyne	ANPEP	16	40
C[C@H]1CCC[C@@H](CNC(=O)N2CCC(N3CCN(C)CC3)CC2)C1	ZINC000875144802	EE	On-Demand	Anodyne	L3MBTL3	54	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cn2ccccc2=O)cc1	ZINC000875144806	GE	On-Demand	Anodyne	SLC6A4	33	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cn2ccccc2=O)cc1	ZINC000875144806	GE	On-Demand	Anodyne	SLC6A3	60	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cn2ccccc2=O)cc1	ZINC000875144807	GE	On-Demand	Anodyne	SLC6A4	33	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cn2ccccc2=O)cc1	ZINC000875144807	GE	On-Demand	Anodyne	SLC6A3	60	43
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H](C)COc1ccc(F)cc1F	ZINC000875144849	GF	On-Demand	Anodyne	ACKR3	61	36
COCCN(CC1CCN(C)CC1)C(=O)N[C@H](C)COc1ccc(F)cc1F	ZINC000875144850	GF	On-Demand	Anodyne	ACKR3	61	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1-n1ccnc1	ZINC000875144853	FE	On-Demand	Anodyne	NOS2	46	32
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1-n1ccnc1	ZINC000875144854	FE	On-Demand	Anodyne	NOS2	46	32
C[C@@H](NC(=O)N1CCc2nc(C3CC3)ncc2C1)c1ccccc1C(F)(F)F	ZINC000875144868	GI	On-Demand	Anodyne	MAPK1	51	43
C[C@@H](NC(=O)N1CCc2nc(C3CC3)ncc2C1)c1ccccc1C(F)(F)F	ZINC000875144868	GI	On-Demand	Anodyne	RBP4	65	36
C[C@H](NC(=O)Nc1cnn(C2CCN(C)CC2)c1)c1ccccc1C(F)(F)F	ZINC000875144883	GI	On-Demand	Anodyne	RBP4	43	32
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2ccccc2C(F)(F)F)C1	ZINC000875144886	FH	On-Demand	Anodyne	RBP4	75	45
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2ccccc2C(F)(F)F)C1	ZINC000875144889	FH	On-Demand	Anodyne	RBP4	75	45
CONC(=O)C1CCN(C(=O)NCc2ccc(Cn3ccccc3=O)cc2)CC1	ZINC000875144959	GD	On-Demand	Anodyne	EPHX2	27	43
CN1CCN(C(=O)NCCNC(=O)c2ccc(F)cc2)CCC1(C)C	ZINC000875144967	FD	On-Demand	Anodyne	PLD1	45	37
CN1CCN(C(=O)NCCNC(=O)c2ccc(F)cc2)CCC1(C)C	ZINC000875144967	FD	On-Demand	Anodyne	PLD2	68	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1(c2ccc(F)cc2)CCOCC1	ZINC000875144982	GF	On-Demand	Anodyne	KCNA3	40	33
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H](C)Cn1cncn1	ZINC000875144992	DB	On-Demand	Mild	HIS3	86	41
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](C)Cn1cncn1	ZINC000875144995	DB	On-Demand	Mild	HIS3	86	41
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H](C)Cn1cncn1	ZINC000875144996	DB	On-Demand	Mild	HIS3	86	41
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](C)Cn1cncn1	ZINC000875144997	DB	On-Demand	Mild	HIS3	86	41
C[C@@H](Cn1cncn1)NC(=O)C(=O)NCC1(c2cccc(Cl)c2)CCC1	ZINC000875145000	GD	On-Demand	Anodyne	HIS3	72	34
O=C(N[C@H]1CCc2c(Cl)cccc21)N1CCC(CO)(CO)CC1	ZINC000875145001	EE	On-Demand	Anodyne	EPHX2	15	45
O=C(N[C@@H]1CCc2c(Cl)cccc21)N1CCC(CO)(CO)CC1	ZINC000875145002	EE	On-Demand	Anodyne	EPHX2	15	45
CSc1ccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000875145013	EI	On-Demand	Anodyne	EPHX2	22	40
CSc1ccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000875145014	EI	On-Demand	Anodyne	EPHX2	22	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccn(-c2ccc(OC)cc2)n1	ZINC000875145019	GE	On-Demand	Anodyne	SLC6A4	19	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccn(-c2ccc(OC)cc2)n1	ZINC000875145019	GE	On-Demand	Anodyne	SLC6A3	34	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccn(-c2ccc(OC)cc2)n1	ZINC000875145020	GE	On-Demand	Anodyne	SLC6A4	19	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccn(-c2ccc(OC)cc2)n1	ZINC000875145020	GE	On-Demand	Anodyne	SLC6A3	34	41
O=C(NCc1ccccc1N1CCCC1)N[C@@H]1C[C@H]1C1CCOCC1	ZINC000875145021	EF	On-Demand	Anodyne	KCNQ2	60	38
C[C@H]1CCC[C@@H](CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875145031	DD	On-Demand	Anodyne	CACNA1I	41	32
C[C@@H](Cn1cncn1)NC(=O)C(=O)N1CCC(C)(N2CCCCC2)CC1	ZINC000875145053	FC	On-Demand	Anodyne	HIS3	76	35
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1ccc(F)c(Cl)c1	ZINC000875145064	FH	On-Demand	Anodyne	MAPK1	44	38
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1ccc(F)c(Cl)c1	ZINC000875145067	FH	On-Demand	Anodyne	MAPK1	44	38
O=C(NCc1ccccc1N1CCCC1)N1Cc2cccc(O)c2C1	ZINC000875145070	EG	On-Demand	Clean	KCNQ2	70	40
O=C(NCc1ccccc1N1CCCC1)N1Cc2cccc(O)c2C1	ZINC000875145070	EG	On-Demand	Clean	SCN2A	18	43
O=C(NCc1ccccc1N1CCCC1)N1Cc2cccc(O)c2C1	ZINC000875145070	EG	On-Demand	Clean	SCN10A	15	43
CC(C)c1ccc(CNC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875145091	DE	On-Demand	Anodyne	NAMPT	20	41
O=C(NCc1ccccc1N1CCCC1)NC[C@H]1CC2(CCOCC2)CO1	ZINC000875145103	FF	On-Demand	Anodyne	KCNQ2	68	38
O=C(NCc1ccccc1N1CCCC1)NC[C@@H]1CC2(CCOCC2)CO1	ZINC000875145104	FF	On-Demand	Anodyne	KCNQ2	68	38
CC(C)c1ccc(CNC(=O)N2CCC(C(=O)NCCO)CC2)cc1	ZINC000875145106	ED	On-Demand	Anodyne	EPHX2	25	48
Cc1cncc([C@H]2CCCN2C(=O)C(=O)N[C@@H](C)Cn2cncn2)c1	ZINC000875145123	EC	On-Demand	Anodyne	HIS3	63	34
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)N[C@H](C)Cn2cncn2)c1	ZINC000875145124	EC	On-Demand	Anodyne	HIS3	63	34
Cc1cncc([C@H]2CCCN2C(=O)C(=O)N[C@H](C)Cn2cncn2)c1	ZINC000875145125	EC	On-Demand	Anodyne	HIS3	63	34
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)N[C@@H](C)Cn2cncn2)c1	ZINC000875145126	EC	On-Demand	Anodyne	HIS3	63	34
C[C@@H](NC(=O)N1CCO[C@H](C(F)F)CC1)c1ccccc1C(F)(F)F	ZINC000875145142	FH	On-Demand	Anodyne	RBP4	90	41
C[C@@H](NC(=O)N1CCO[C@H](C(F)F)CC1)c1ccccc1C(F)(F)F	ZINC000875145142	FH	On-Demand	Anodyne	SFRP1	115	35
C[C@@H](NC(=O)N1CCO[C@H](C(F)F)CC1)c1ccccc1C(F)(F)F	ZINC000875145142	FH	On-Demand	Anodyne	WNT3	82	35
C[C@@H](NC(=O)N1CCO[C@@H](C(F)F)CC1)c1ccccc1C(F)(F)F	ZINC000875145143	FH	On-Demand	Anodyne	RBP4	90	41
C[C@@H](NC(=O)N1CCO[C@@H](C(F)F)CC1)c1ccccc1C(F)(F)F	ZINC000875145143	FH	On-Demand	Anodyne	SFRP1	115	35
C[C@@H](NC(=O)N1CCO[C@@H](C(F)F)CC1)c1ccccc1C(F)(F)F	ZINC000875145143	FH	On-Demand	Anodyne	WNT3	82	35
O=C(NCc1ccccc1N1CCCC1)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875145147	FG	On-Demand	Anodyne	KCNQ2	70	37
C[C@H](NC(=O)N1C[C@@H](O)C[C@@H]1C1CC1)c1ccccc1C(F)(F)F	ZINC000875145148	EG	On-Demand	Anodyne	RBP4	75	42
C[C@H](NC(=O)N1C[C@@H](O)C[C@@H]1C1CC1)c1ccccc1C(F)(F)F	ZINC000875145148	EG	On-Demand	Anodyne	SFRP1	50	32
C[C@H](NC(=O)N1C[C@@H](O)C[C@@H]1C1CC1)c1ccccc1C(F)(F)F	ZINC000875145148	EG	On-Demand	Anodyne	WNT3	41	32
C[C@H](NC(=O)N1C[C@H](O)C[C@@H]1C1CC1)c1ccccc1C(F)(F)F	ZINC000875145149	EG	On-Demand	Anodyne	RBP4	75	42
C[C@H](NC(=O)N1C[C@H](O)C[C@@H]1C1CC1)c1ccccc1C(F)(F)F	ZINC000875145149	EG	On-Demand	Anodyne	SFRP1	50	32
C[C@H](NC(=O)N1C[C@H](O)C[C@@H]1C1CC1)c1ccccc1C(F)(F)F	ZINC000875145149	EG	On-Demand	Anodyne	WNT3	41	32
C[C@H](NC(=O)N1C[C@H](O)C[C@H]1C1CC1)c1ccccc1C(F)(F)F	ZINC000875145150	EG	On-Demand	Anodyne	RBP4	75	42
C[C@H](NC(=O)N1C[C@H](O)C[C@H]1C1CC1)c1ccccc1C(F)(F)F	ZINC000875145150	EG	On-Demand	Anodyne	SFRP1	50	32
C[C@H](NC(=O)N1C[C@H](O)C[C@H]1C1CC1)c1ccccc1C(F)(F)F	ZINC000875145150	EG	On-Demand	Anodyne	WNT3	41	32
O=C(NCc1ccccc1N1CCCC1)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875145151	FG	On-Demand	Anodyne	KCNQ2	70	37
C[C@H](NC(=O)N1C[C@@H](O)C[C@H]1C1CC1)c1ccccc1C(F)(F)F	ZINC000875145152	EG	On-Demand	Anodyne	RBP4	75	42
C[C@H](NC(=O)N1C[C@@H](O)C[C@H]1C1CC1)c1ccccc1C(F)(F)F	ZINC000875145152	EG	On-Demand	Anodyne	SFRP1	50	32
C[C@H](NC(=O)N1C[C@@H](O)C[C@H]1C1CC1)c1ccccc1C(F)(F)F	ZINC000875145152	EG	On-Demand	Anodyne	WNT3	41	32
O=C(NCc1ccccc1N1CCCC1)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875145154	FG	On-Demand	Anodyne	KCNQ2	70	37
O=C(NCc1ccccc1N1CCCC1)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875145158	FG	On-Demand	Anodyne	KCNQ2	70	37
O=C(NCc1ccccc1N1CCCC1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875145161	EG	On-Demand	Anodyne	KCNQ2	70	40
O=C(NCc1ccccc1N1CCCC1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875145161	EG	On-Demand	Anodyne	SCN2A	17	40
O=C(NCc1ccccc1N1CCCC1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875145161	EG	On-Demand	Anodyne	EPHX2	17	40
O=C(NCc1ccccc1N1CCCC1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875145162	EG	On-Demand	Anodyne	KCNQ2	70	40
O=C(NCc1ccccc1N1CCCC1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875145162	EG	On-Demand	Anodyne	SCN2A	17	40
O=C(NCc1ccccc1N1CCCC1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875145162	EG	On-Demand	Anodyne	EPHX2	17	40
O=C(NCc1ccccc1N1CCCC1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875145164	EG	On-Demand	Anodyne	KCNQ2	70	40
O=C(NCc1ccccc1N1CCCC1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875145164	EG	On-Demand	Anodyne	SCN2A	17	40
O=C(NCc1ccccc1N1CCCC1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875145164	EG	On-Demand	Anodyne	EPHX2	17	40
O=C(NCc1ccccc1N1CCCC1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875145168	EG	On-Demand	Anodyne	KCNQ2	70	40
O=C(NCc1ccccc1N1CCCC1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875145168	EG	On-Demand	Anodyne	SCN2A	17	40
O=C(NCc1ccccc1N1CCCC1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875145168	EG	On-Demand	Anodyne	EPHX2	17	40
C[C@@H](NC(=O)N1CC(CNC(=O)C(F)(F)F)C1)c1ccc(F)c(Cl)c1	ZINC000875145181	GF	On-Demand	Anodyne	MAPK1	47	42
C[C@@H](NC(=O)N1CC(CNC(=O)C(F)(F)F)C1)c1ccc(F)c(Cl)c1	ZINC000875145181	GF	On-Demand	Anodyne	CACNA1I	42	34
CO[C@@H]1C[C@@H]2CN(C(=O)NCc3ccc(SC)cc3)Cc3cccnc3N2C1	ZINC000875145199	GG	On-Demand	Anodyne	NAMPT	22	41
CO[C@H]1C[C@H]2CN(C(=O)NCc3ccc(SC)cc3)Cc3cccnc3N2C1	ZINC000875145201	GG	On-Demand	Anodyne	NAMPT	22	41
C[C@@H](Cn1cncn1)NC(=O)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875145221	EC	On-Demand	Anodyne	HIS3	77	36
C[C@@H](NC(=O)N1CCC(CCO)(CCO)CC1)c1ccccc1C(F)(F)F	ZINC000875145225	GG	On-Demand	Anodyne	RBP4	83	42
C[C@@H](Cn1cncn1)NC(=O)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875145228	EC	On-Demand	Anodyne	HIS3	77	36
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1C(F)(F)F	ZINC000875145238	GE	On-Demand	Anodyne	EPHX2	19	41
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1C(F)(F)F	ZINC000875145238	GE	On-Demand	Anodyne	RBP4	72	40
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1C(F)(F)F	ZINC000875145238	GE	On-Demand	Anodyne	CACNA1G	34	40
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1C(F)(F)F	ZINC000875145238	GE	On-Demand	Anodyne	SFRP1	108	35
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1C(F)(F)F	ZINC000875145238	GE	On-Demand	Anodyne	SCD	22	42
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1C(F)(F)F	ZINC000875145238	GE	On-Demand	Anodyne	WNT3	81	35
O=C(NCc1ccccc1N1CCCC1)NC[C@@]12COCCN1C(=O)COC2	ZINC000875145249	GC	On-Demand	Anodyne	KCNQ2	68	39
O=C(NCc1ccccc1N1CCCC1)NC[C@]12COCCN1C(=O)COC2	ZINC000875145250	GC	On-Demand	Anodyne	KCNQ2	68	39
CCN(C(=O)c1cccn(C(C)(C)C)c1=O)c1ccccc1Cl	ZINC000875145251	EH	On-Demand	Anodyne	ECR	47	36
C[C@@H](Cn1cncn1)NC(=O)C(=O)NC[C@@H]1c2ccccc2CN1C	ZINC000875145268	EC	On-Demand	Anodyne	HIS3	81	38
O=C(N[C@H]1CCc2c(F)cccc21)N1Cc2cccnc2N2C[C@H](O)C[C@H]2C1	ZINC000875145269	GE	On-Demand	Anodyne	CALCRL	40	37
O=C(N[C@@H]1CCc2c(F)cccc21)N1Cc2cccnc2N2C[C@H](O)C[C@H]2C1	ZINC000875145270	GE	On-Demand	Anodyne	CALCRL	40	37
C[C@@H](Cn1cncn1)NC(=O)C(=O)NC[C@H]1c2ccccc2CN1C	ZINC000875145271	EC	On-Demand	Anodyne	HIS3	81	38
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(SC)cc1	ZINC000875145307	CF	On-Demand	Anodyne	ANPEP	17	44
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2ccc(F)c(Cl)c2)C1	ZINC000875145310	FG	On-Demand	Anodyne	MAPK1	50	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2ccc(F)c(Cl)c2)C1	ZINC000875145312	FG	On-Demand	Anodyne	MAPK1	50	41
C[C@@H]1CN(C(=O)NCc2ccccc2-n2ccnc2)CC[C@@H](C(F)(F)F)O1	ZINC000875145319	GG	On-Demand	Anodyne	NOS2	92	37
C[C@@H]1CN(C(=O)NCc2ccccc2-n2ccnc2)CC[C@H](C(F)(F)F)O1	ZINC000875145321	GG	On-Demand	Anodyne	NOS2	92	37
O=C(NCC[C@H]1CCSC1)NCc1ccccc1N1CCCC1	ZINC000875145323	EG	On-Demand	Anodyne	KCNQ2	63	38
O=C(NCC[C@@H]1CCSC1)NCc1ccccc1N1CCCC1	ZINC000875145324	EG	On-Demand	Anodyne	KCNQ2	63	38
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(F)c(Cl)c1	ZINC000875145329	EG	On-Demand	Anodyne	CACNA1H	58	42
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(F)c(Cl)c1	ZINC000875145329	EG	On-Demand	Anodyne	PRCP	50	35
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(F)c(Cl)c1	ZINC000875145329	EG	On-Demand	Anodyne	MAPK1	53	44
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(F)c(Cl)c1	ZINC000875145330	EG	On-Demand	Anodyne	CACNA1H	58	42
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(F)c(Cl)c1	ZINC000875145330	EG	On-Demand	Anodyne	PRCP	50	35
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(F)c(Cl)c1	ZINC000875145330	EG	On-Demand	Anodyne	MAPK1	53	44
COC(=O)N(C)NC(=O)NCc1ccccc1N1CCCC1	ZINC000875145337	DD	On-Demand	Reactive	KCNQ2	77	42
COC(=O)N(C)NC(=O)NCc1ccccc1N1CCCC1	ZINC000875145337	DD	On-Demand	Reactive	SCN2A	18	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)COc1ccc(F)cc1F	ZINC000875145341	FE	On-Demand	Anodyne	SLC6A4	17	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)COc1ccc(F)cc1F	ZINC000875145341	FE	On-Demand	Anodyne	SLC6A3	40	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)COc1ccc(F)cc1F	ZINC000875145342	FE	On-Demand	Anodyne	SLC6A4	17	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)COc1ccc(F)cc1F	ZINC000875145342	FE	On-Demand	Anodyne	SLC6A3	40	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)COc1ccc(F)cc1F	ZINC000875145343	FE	On-Demand	Anodyne	SLC6A4	17	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)COc1ccc(F)cc1F	ZINC000875145343	FE	On-Demand	Anodyne	SLC6A3	40	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)COc1ccc(F)cc1F	ZINC000875145344	FE	On-Demand	Anodyne	SLC6A4	17	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)COc1ccc(F)cc1F	ZINC000875145344	FE	On-Demand	Anodyne	SLC6A3	40	43
CN1CCN(C(=O)N[C@H]2CCc3c(F)cccc32)CCC1(C)C	ZINC000875145352	DF	On-Demand	Anodyne	CALCRL	40	40
CN1CCN(C(=O)N[C@@H]2CCc3c(F)cccc32)CCC1(C)C	ZINC000875145356	DF	On-Demand	Anodyne	CALCRL	40	40
COC(=O)N(C)NC(=O)N[C@H](C)COc1ccccc1C(F)(F)F	ZINC000875145361	EE	On-Demand	Reactive	RBP4	17	41
COC(=O)N(C)NC(=O)N[C@@H](C)COc1ccccc1C(F)(F)F	ZINC000875145363	EE	On-Demand	Reactive	RBP4	17	41
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2N2CCCC2)CC1	ZINC000875145371	FD	On-Demand	Anodyne	KCNQ2	68	40
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2N2CCCC2)CC1	ZINC000875145371	FD	On-Demand	Anodyne	SCN2A	18	42
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2N2CCCC2)CC1	ZINC000875145371	FD	On-Demand	Anodyne	EPHX2	32	50
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2N2CCCC2)CC1	ZINC000875145371	FD	On-Demand	Anodyne	SCN10A	15	42
CC[C@@H]1COCCN1CCNC(=O)NCc1ccccc1-n1ccnc1	ZINC000875145388	FD	On-Demand	Anodyne	NOS2	92	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(-c3csc(C)n3)cc2)C1	ZINC000875145390	GF	On-Demand	Anodyne	VHL	59	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(-c3csc(C)n3)cc2)C1	ZINC000875145392	GF	On-Demand	Anodyne	VHL	59	37
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccccc1C(F)(F)F	ZINC000875145398	EF	On-Demand	Anodyne	RBP4	78	39
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccccc1C(F)(F)F	ZINC000875145398	EF	On-Demand	Anodyne	WNT3	40	32
C[C@@H](Cn1cncn1)NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875145399	FC	On-Demand	Anodyne	OXTR	51	36
C[C@@H](Cn1cncn1)NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875145399	FC	On-Demand	Anodyne	HIS3	66	36
C[C@@H](Cn1cncn1)NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875145403	FC	On-Demand	Anodyne	OXTR	51	36
C[C@@H](Cn1cncn1)NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875145403	FC	On-Demand	Anodyne	HIS3	66	36
O=C(NCc1ccnc(-n2cncn2)c1)NCc1ccccc1N1CCCC1	ZINC000875145405	GE	On-Demand	Anodyne	KCNQ2	56	35
O=C(NCc1ccnc(-n2cncn2)c1)NCc1ccccc1N1CCCC1	ZINC000875145405	GE	On-Demand	Anodyne	SCN2A	19	42
O=C(NCc1ccnc(-n2cncn2)c1)NCc1ccccc1N1CCCC1	ZINC000875145405	GE	On-Demand	Anodyne	NOS2	53	32
O=C(NCc1ccnc(-n2cncn2)c1)NCc1ccccc1N1CCCC1	ZINC000875145405	GE	On-Demand	Anodyne	SCN10A	15	42
CC(=O)N(C)c1ccc(CNC(=O)NCc2ccccc2N2CCCC2)cc1	ZINC000875145413	GG	On-Demand	Anodyne	AVPR2	23	41
CC(=O)N(C)c1ccc(CNC(=O)NCc2ccccc2N2CCCC2)cc1	ZINC000875145413	GG	On-Demand	Anodyne	KCNQ2	74	40
CC(=O)N(C)c1ccc(CNC(=O)NCc2ccccc2N2CCCC2)cc1	ZINC000875145413	GG	On-Demand	Anodyne	SCN2A	17	40
CC(C)(C)CNC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875145418	CF	On-Demand	Anodyne	EPHX2	16	48
CC(C)(C)CNC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875145421	CF	On-Demand	Anodyne	EPHX2	16	48
O=C(NCc1ccc(Br)cn1)NCc1ccccc1N1CCCC1	ZINC000875145425	GG	On-Demand	Anodyne	KCNQ2	69	40
O=C(NCc1ccc(Br)cn1)NCc1ccccc1N1CCCC1	ZINC000875145425	GG	On-Demand	Anodyne	SCN2A	19	45
O=C(NCc1ccc(Br)cn1)NCc1ccccc1N1CCCC1	ZINC000875145425	GG	On-Demand	Anodyne	SCN10A	20	45
CC(C)c1ccc(CNC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875145430	DH	On-Demand	Clean	NAMPT	25	49
O=CN1CCCN(C(=O)NCCNC(=O)c2ccc(F)cc2)CC1	ZINC000875145460	EC	On-Demand	Anodyne	BCHE	20	40
CC[C@@H](NC(=O)NCCNC(=O)c1ccc(F)cc1)[C@@H](O)c1ccccc1	ZINC000875145479	FE	On-Demand	Anodyne	FOLH1	27	42
CC[C@@H](NC(=O)NCCNC(=O)c1ccc(F)cc1)[C@H](O)c1ccccc1	ZINC000875145480	FE	On-Demand	Anodyne	FOLH1	27	42
O=C(NCC[C@@H](O)C1CCCC1)NCc1ccccc1-n1ccnc1	ZINC000875145491	EF	On-Demand	Anodyne	NOS2	57	32
O=C(NCC[C@H](O)C1CCCC1)NCc1ccccc1-n1ccnc1	ZINC000875145492	EF	On-Demand	Anodyne	NOS2	57	32
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCNC(=O)c1ccc(F)cc1	ZINC000875145501	FD	On-Demand	Anodyne	SLC6A4	25	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCNC(=O)c1ccc(F)cc1	ZINC000875145501	FD	On-Demand	Anodyne	SLC6A3	50	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCNC(=O)c1ccc(F)cc1	ZINC000875145501	FD	On-Demand	Anodyne	PLD1	45	39
C[C@@H](NC(=O)N1CC(CNC(=O)C(F)(F)F)C1)c1ccccc1C(F)(F)F	ZINC000875145504	GG	On-Demand	Anodyne	RBP4	73	44
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1C(F)(F)F	ZINC000875145507	EH	On-Demand	Anodyne	RBP4	92	44
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1C(F)(F)F	ZINC000875145507	EH	On-Demand	Anodyne	SFRP1	115	37
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1C(F)(F)F	ZINC000875145507	EH	On-Demand	Anodyne	WNT3	82	37
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1C(F)(F)F	ZINC000875145510	EH	On-Demand	Anodyne	RBP4	92	44
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1C(F)(F)F	ZINC000875145510	EH	On-Demand	Anodyne	SFRP1	115	37
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1C(F)(F)F	ZINC000875145510	EH	On-Demand	Anodyne	WNT3	82	37
CC(C)(C)CNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875145513	DG	On-Demand	Anodyne	OPRL1	17	47
C[C@@H](Cn1cncn1)NC(=O)C(=O)NCc1cn(C(F)F)c2ccccc12	ZINC000875145530	GD	On-Demand	Anodyne	HIS3	81	39
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@H](C)Cn1cncn1)CC2	ZINC000875145531	GC	On-Demand	Anodyne	SLC18A2	49	34
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@H](C)Cn1cncn1)CC2	ZINC000875145531	GC	On-Demand	Anodyne	HIS3	53	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H](C)Cn1cncn1)CC2	ZINC000875145532	GC	On-Demand	Anodyne	SLC18A2	49	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H](C)Cn1cncn1)CC2	ZINC000875145532	GC	On-Demand	Anodyne	HIS3	53	34
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@@H](C)Cn1cncn1)CC2	ZINC000875145533	GC	On-Demand	Anodyne	SLC18A2	49	34
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@@H](C)Cn1cncn1)CC2	ZINC000875145533	GC	On-Demand	Anodyne	HIS3	53	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H](C)Cn1cncn1)CC2	ZINC000875145534	GC	On-Demand	Anodyne	SLC18A2	49	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H](C)Cn1cncn1)CC2	ZINC000875145534	GC	On-Demand	Anodyne	HIS3	53	34
O=C(NCc1ccccc1N1CCCC1)NC[C@@]12COCCN1C(=O)OC2	ZINC000875145540	FD	On-Demand	Anodyne	KCNQ2	67	39
O=C(NCc1ccccc1N1CCCC1)NC[C@]12COCCN1C(=O)OC2	ZINC000875145541	FD	On-Demand	Anodyne	KCNQ2	67	39
O=C(NCc1ncc(Br)s1)NCc1ccccc1N1CCCC1	ZINC000875145543	GH	On-Demand	Anodyne	KCNQ2	69	40
O=C(NCc1ncc(Br)s1)NCc1ccccc1N1CCCC1	ZINC000875145543	GH	On-Demand	Anodyne	SCN2A	19	45
O=C(NCc1ncc(Br)s1)NCc1ccccc1N1CCCC1	ZINC000875145543	GH	On-Demand	Anodyne	SCN10A	20	45
C[C@@H](NC(=O)N1CC[C@H]2CC[C@@H](C1)S2(=O)=O)c1ccccc1C(F)(F)F	ZINC000875145549	GG	On-Demand	Anodyne	RBP4	89	42
C[C@@H](NC(=O)N1CC[C@H]2CC[C@@H](C1)S2(=O)=O)c1ccccc1C(F)(F)F	ZINC000875145549	GG	On-Demand	Anodyne	SFRP1	106	35
C[C@@H](NC(=O)N1CC[C@H]2CC[C@@H](C1)S2(=O)=O)c1ccccc1C(F)(F)F	ZINC000875145549	GG	On-Demand	Anodyne	WNT3	79	35
C[C@@H](Cn1cncn1)NC(=O)C(=O)N1CC[C@@H](c2cccc(Cl)c2)C1(C)C	ZINC000875145552	GE	On-Demand	Anodyne	HIS3	67	34
C[C@@H](Cn1cncn1)NC(=O)C(=O)N1CC[C@H](c2cccc(Cl)c2)C1(C)C	ZINC000875145556	GE	On-Demand	Anodyne	HIS3	67	34
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)N[C@H](C)Cn2cncn2)C1	ZINC000875145558	DB	On-Demand	Anodyne	HIS3	76	37
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)N[C@@H](C)Cn2cncn2)C1	ZINC000875145559	DB	On-Demand	Anodyne	HIS3	76	37
CC(C)c1ccc(CNC(=O)N2Cc3cccnc3N3C[C@H](O)C[C@H]3C2)cc1	ZINC000875145569	GF	On-Demand	Anodyne	NAMPT	23	43
CC(C)c1ccc(CNC(=O)N2Cc3cccnc3N3C[C@H](O)C[C@H]3C2)cc1	ZINC000875145569	GF	On-Demand	Anodyne	VHL	40	31
C[C@@H](NC(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1)c1ccccc1C(F)(F)F	ZINC000875145572	GH	On-Demand	Anodyne	RBP4	84	39
C[C@@H](NC(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1)c1ccccc1C(F)(F)F	ZINC000875145572	GH	On-Demand	Anodyne	SFRP1	110	35
C[C@@H](NC(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1)c1ccccc1C(F)(F)F	ZINC000875145572	GH	On-Demand	Anodyne	WNT3	77	34
C[C@@H](NC(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1)c1ccccc1C(F)(F)F	ZINC000875145573	GH	On-Demand	Anodyne	RBP4	84	39
C[C@@H](NC(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1)c1ccccc1C(F)(F)F	ZINC000875145573	GH	On-Demand	Anodyne	SFRP1	110	35
C[C@@H](NC(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1)c1ccccc1C(F)(F)F	ZINC000875145573	GH	On-Demand	Anodyne	WNT3	77	34
O=C(NCc1ccccc1N1CCCC1)NCc1noc2ccc(F)cc12	ZINC000875145576	FH	On-Demand	Anodyne	KCNQ2	62	40
O=C(NCc1ccccc1N1CCCC1)NCc1noc2ccc(F)cc12	ZINC000875145576	FH	On-Demand	Anodyne	P2RX7	37	40
O=C(NCc1ccccc1N1CCCC1)NCc1noc2ccc(F)cc12	ZINC000875145576	FH	On-Demand	Anodyne	SCN2A	17	41
C[C@@H](NC(=O)N1CC(NS(C)(=O)=O)C1)c1ccccc1C(F)(F)F	ZINC000875145583	FD	On-Demand	Anodyne	RBP4	85	45
C[C@@H](NC(=O)N1CC(NS(C)(=O)=O)C1)c1ccccc1C(F)(F)F	ZINC000875145583	FD	On-Demand	Anodyne	SFRP1	124	36
C[C@@H](NC(=O)N1CC(NS(C)(=O)=O)C1)c1ccccc1C(F)(F)F	ZINC000875145583	FD	On-Demand	Anodyne	WNT3	87	36
NC(=O)Cc1cccc2c1CCN(C(=O)NCc1ccccc1N1CCCC1)C2	ZINC000875145595	GF	On-Demand	Anodyne	AVPR2	28	40
NC(=O)Cc1cccc2c1CCN(C(=O)NCc1ccccc1N1CCCC1)C2	ZINC000875145595	GF	On-Demand	Anodyne	KCNQ2	65	37
NC(=O)Cc1cccc2c1CCN(C(=O)NCc1ccccc1N1CCCC1)C2	ZINC000875145595	GF	On-Demand	Anodyne	SCN2A	17	40
C[C@@H](Cn1cncn1)NC(=O)C(=O)NCC[C@H]1CCSC1	ZINC000875145604	DC	On-Demand	Anodyne	HIS3	80	40
C[C@@H](Cn1cncn1)NC(=O)C(=O)NCC[C@@H]1CCSC1	ZINC000875145606	DC	On-Demand	Anodyne	HIS3	80	40
C[C@@H]1[C@H](C(=O)NNC(=O)NCc2ccccc2N2CCCC2)CCCN1C	ZINC000875145608	FD	On-Demand	Reactive	KCNQ2	66	37
C[C@@H]1[C@H](C(=O)NNC(=O)NCc2ccccc2N2CCCC2)CCCN1C	ZINC000875145608	FD	On-Demand	Reactive	SCN2A	17	40
COC(=O)C1(O)CN(C(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875145610	EC	On-Demand	Anodyne	KCNQ2	74	40
COC(=O)C1(O)CN(C(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875145610	EC	On-Demand	Anodyne	SCN2A	18	43
COC(=O)C1(O)CN(C(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875145610	EC	On-Demand	Anodyne	SCN10A	15	43
C[C@@H](Cn1cncn1)NC(=O)C(=O)NCCCCC1CC1	ZINC000875145614	CC	On-Demand	Anodyne	HIS3	80	42
C[C@@H](Cn1cncn1)NC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875145615	DC	On-Demand	Anodyne	HIS3	81	39
CCOC(=O)c1cc(CNC(=O)NCc2ccccc2N2CCCC2)on1	ZINC000875145619	FE	On-Demand	Anodyne	KCNQ2	69	36
CCOC(=O)c1cc(CNC(=O)NCc2ccccc2N2CCCC2)on1	ZINC000875145619	FE	On-Demand	Anodyne	SCN2A	17	41
CCOC(=O)c1cc(CNC(=O)NCc2ccccc2N2CCCC2)on1	ZINC000875145619	FE	On-Demand	Anodyne	SCN10A	18	41
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2-n2ccnc2)CC1	ZINC000875145622	FC	On-Demand	Anodyne	NOS2	70	36
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2-n2ccnc2)CC1	ZINC000875145622	FC	On-Demand	Anodyne	EPHX2	19	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCc2cc(Cl)ccc21	ZINC000875145627	EG	On-Demand	Anodyne	SLC6A3	38	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCc2cc(Cl)ccc21	ZINC000875145629	EG	On-Demand	Anodyne	SLC6A3	38	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCc2cc(Cl)ccc21	ZINC000875145630	EG	On-Demand	Anodyne	SLC6A3	38	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCc2cc(Cl)ccc21	ZINC000875145632	EG	On-Demand	Anodyne	SLC6A3	38	40
O=C(NCc1ccccc1N1CCCC1)NC[C@H]1CCC12CCOCC2	ZINC000875145634	FG	On-Demand	Anodyne	KCNQ2	66	38
O=C(NCc1ccccc1N1CCCC1)NC[C@H]1CCC12CCOCC2	ZINC000875145634	FG	On-Demand	Anodyne	SCN10A	15	40
O=C(NCc1ccccc1N1CCCC1)NC[C@@H]1CCC12CCOCC2	ZINC000875145636	FG	On-Demand	Anodyne	KCNQ2	66	38
O=C(NCc1ccccc1N1CCCC1)NC[C@@H]1CCC12CCOCC2	ZINC000875145636	FG	On-Demand	Anodyne	SCN10A	15	40
C[C@@H](Cn1cncn1)NC(=O)C(=O)N1C[C@@H]2CN(Cc3ccccc3)C[C@]2(C)C1	ZINC000875145642	GC	On-Demand	Anodyne	HIS3	57	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCc2cc(F)ccc21	ZINC000875145660	EF	On-Demand	Anodyne	SLC6A3	36	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCc2cc(F)ccc21	ZINC000875145664	EF	On-Demand	Anodyne	SLC6A3	36	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCc2cc(F)ccc21	ZINC000875145665	EF	On-Demand	Anodyne	SLC6A3	36	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCc2cc(F)ccc21	ZINC000875145668	EF	On-Demand	Anodyne	SLC6A3	36	41
C=CC(C)(C)CCCNC(=O)C(=O)N[C@H](C)Cn1cncn1	ZINC000875145676	DC	On-Demand	Mild	HIS3	77	36
C=CC(C)(C)CCCNC(=O)C(=O)N[C@@H](C)Cn1cncn1	ZINC000875145677	DC	On-Demand	Mild	HIS3	77	36
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCc3c(Cl)cccc32)CC1	ZINC000875145679	FD	On-Demand	Anodyne	EPHX2	21	46
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCc3c(Cl)cccc32)CC1	ZINC000875145681	FD	On-Demand	Anodyne	EPHX2	21	46
COC(=O)[C@@]1(OC)CCN(C(=O)N[C@H](C)c2ccccc2C(F)(F)F)C1	ZINC000875145682	FF	On-Demand	Anodyne	RBP4	63	38
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCc3cc(Cl)ccc32)CC1	ZINC000875145683	FD	On-Demand	Anodyne	EPHX2	21	49
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCc3cc(Cl)ccc32)CC1	ZINC000875145685	FD	On-Demand	Anodyne	EPHX2	21	49
COC(=O)[C@@]1(OC)CCN(C(=O)N[C@@H](C)c2ccccc2C(F)(F)F)C1	ZINC000875145686	FF	On-Demand	Anodyne	RBP4	63	38
O=C(NCc1ccccc1-n1ccnc1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875145703	GF	On-Demand	Anodyne	NOS2	88	37
O=C(NCC1(c2ccc(Cl)cc2)CCCC1)N1CCC2(CCNC2=O)CC1	ZINC000875145704	GG	On-Demand	Anodyne	CACNA1H	47	34
O=C(CCc1nc(O)c2ccccc2n1)Oc1ccc(-c2ccc(I)cc2)cc1	ZINC000875145705	JK	On-Demand	Anodyne	TNKS	46	32
O=CN1CCCN(C(=O)NCc2ccccc2N2CCCC2)CC1	ZINC000875145710	ED	On-Demand	Anodyne	KCNQ2	74	43
O=CN1CCCN(C(=O)NCc2ccccc2N2CCCC2)CC1	ZINC000875145710	ED	On-Demand	Anodyne	SCN2A	18	43
O=CN1CCCN(C(=O)NCc2ccccc2N2CCCC2)CC1	ZINC000875145710	ED	On-Demand	Anodyne	SCN10A	15	43
CC(C)c1ccc(CNC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875145711	DE	On-Demand	Anodyne	DPP7	49	36
COC(=O)C1(O)CN(C(=O)NCc2ccccc2-n2ccnc2)C1	ZINC000875145717	EC	On-Demand	Anodyne	NOS2	41	34
O=C(NCc1ccccc1N1CCCC1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875145723	FF	On-Demand	Anodyne	KCNQ2	60	37
O=C(NCc1ccccc1N1CCCC1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875145725	FF	On-Demand	Anodyne	KCNQ2	60	37
O=C(N[C@H]1CCc2cc(Cl)ccc21)N1CCC(CO)(CO)CC1	ZINC000875145727	EE	On-Demand	Anodyne	CACNA1H	47	32
O=C(N[C@H]1CCc2cc(Cl)ccc21)N1CCC(CO)(CO)CC1	ZINC000875145727	EE	On-Demand	Anodyne	EPHX2	20	46
COC(=O)C1=NO[C@@]2(CCN(C(=O)NCc3ccccc3-n3ccnc3)C2)C1	ZINC000875145732	GD	On-Demand	Anodyne	NOS2	42	34
COC(=O)C1=NO[C@]2(CCN(C(=O)NCc3ccccc3-n3ccnc3)C2)C1	ZINC000875145733	GD	On-Demand	Anodyne	NOS2	42	34
O=C(N[C@@H]1CCc2cc(Cl)ccc21)N1CCC(CO)(CO)CC1	ZINC000875145734	EE	On-Demand	Anodyne	CACNA1H	47	32
O=C(N[C@@H]1CCc2cc(Cl)ccc21)N1CCC(CO)(CO)CC1	ZINC000875145734	EE	On-Demand	Anodyne	EPHX2	20	46
CN1CCN(C2CCN(C(=O)NCc3ccccc3N3CCCC3)CC2)CC1	ZINC000875145735	GE	On-Demand	Anodyne	KCNQ2	73	40
CN1CCN(C2CCN(C(=O)NCc3ccccc3N3CCCC3)CC2)CC1	ZINC000875145735	GE	On-Demand	Anodyne	SCN2A	24	40
CN1CCN(C2CCN(C(=O)NCc3ccccc3N3CCCC3)CC2)CC1	ZINC000875145735	GE	On-Demand	Anodyne	EPHX2	27	42
CN1CCN(C2CCN(C(=O)NCc3ccccc3N3CCCC3)CC2)CC1	ZINC000875145735	GE	On-Demand	Anodyne	L3MBTL3	116	46
C[C@@H](Cn1cncn1)NC(=O)C(=O)NCc1ccc(OC(F)F)cc1F	ZINC000875145764	FC	On-Demand	Anodyne	HIS3	68	38
CN(Cc1ccc2cc[nH]c2c1)C(=O)NCc1ccccc1N1CCCC1	ZINC000875145768	FI	On-Demand	Anodyne	KCNQ2	64	37
CN(Cc1ccc2cc[nH]c2c1)C(=O)NCc1ccccc1N1CCCC1	ZINC000875145768	FI	On-Demand	Anodyne	SCN2A	17	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(SC)cc1	ZINC000875145772	EF	On-Demand	Anodyne	SLC6A4	30	49
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(SC)cc1	ZINC000875145772	EF	On-Demand	Anodyne	SLC6A3	54	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(SC)cc1	ZINC000875145773	EF	On-Demand	Anodyne	SLC6A4	30	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(SC)cc1	ZINC000875145773	EF	On-Demand	Anodyne	SLC6A3	54	49
CSc1ccc(CNC(=O)N2Cc3cccnc3N3C[C@H](O)C[C@H]3C2)cc1	ZINC000875145775	GE	On-Demand	Anodyne	NAMPT	23	43
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccccc2-n2ccnc2)C1	ZINC000875145789	FE	On-Demand	Anodyne	NOS2	68	36
O=C(N[C@@H]1CCc2cc(Cl)ccc21)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875145801	GF	On-Demand	Anodyne	CACNA1I	48	33
O=C(N[C@H]1CCc2cc(Cl)ccc21)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875145803	GF	On-Demand	Anodyne	CACNA1I	48	33
CSc1ccc(CNC(=O)N2Cc3cccnc3N3CCC[C@H]3C2)cc1	ZINC000875145811	FG	On-Demand	Anodyne	NAMPT	27	43
CC(C)c1ccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875145812	DG	On-Demand	Anodyne	EPHX2	15	41
CC(C)c1ccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875145814	DG	On-Demand	Anodyne	EPHX2	15	41
N#Cc1ccc2c(c1)C[C@@H](NC(=O)NCc1ccccc1N1CCCC1)C2	ZINC000875145819	FG	On-Demand	Mild	KCNQ2	64	37
N#Cc1ccc2c(c1)C[C@H](NC(=O)NCc1ccccc1N1CCCC1)C2	ZINC000875145822	FG	On-Demand	Mild	KCNQ2	64	37
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3ccccc3-n3ccnc3)C[C@@H]1C2	ZINC000875145838	FE	On-Demand	Anodyne	NOS2	90	34
C[C@H](NC(=O)N1O[C@H]2C=C[C@H]1CC2)c1ccccc1C(F)(F)F	ZINC000875145839	EH	On-Demand	Anodyne	RBP4	42	36
C[C@H](NC(=O)N1O[C@H]2C=C[C@H]1CC2)c1ccccc1C(F)(F)F	ZINC000875145839	EH	On-Demand	Anodyne	SFRP1	57	31
C[C@@H](NC(=O)N1O[C@H]2C=C[C@H]1CC2)c1ccccc1C(F)(F)F	ZINC000875145840	EH	On-Demand	Anodyne	RBP4	42	36
C[C@@H](NC(=O)N1O[C@H]2C=C[C@H]1CC2)c1ccccc1C(F)(F)F	ZINC000875145840	EH	On-Demand	Anodyne	SFRP1	57	31
COC(=O)C1(O)CN(C(=O)N[C@H](C)c2ccc(F)c(Cl)c2)C1	ZINC000875145846	ED	On-Demand	Anodyne	CACNA1H	43	39
COC(=O)C1(O)CN(C(=O)N[C@H](C)c2ccc(F)c(Cl)c2)C1	ZINC000875145846	ED	On-Demand	Anodyne	MAPK1	49	44
COC(=O)C1(O)CN(C(=O)N[C@@H](C)c2ccc(F)c(Cl)c2)C1	ZINC000875145847	ED	On-Demand	Anodyne	CACNA1H	43	39
COC(=O)C1(O)CN(C(=O)N[C@@H](C)c2ccc(F)c(Cl)c2)C1	ZINC000875145847	ED	On-Demand	Anodyne	MAPK1	49	44
O=C(NCCNC(=O)c1ccc(F)cc1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875145880	FF	On-Demand	Anodyne	SSTR3	15	40
CN(C)C[C@@H]1CN(C(=O)NCc2ccccc2N2CCCC2)C[C@H]1CN(C)C	ZINC000875145882	GE	On-Demand	Anodyne	KCNQ2	74	40
CN(C)C[C@@H]1CN(C(=O)NCc2ccccc2N2CCCC2)C[C@H]1CN(C)C	ZINC000875145882	GE	On-Demand	Anodyne	SCN2A	17	41
CN(C)C[C@@H]1CN(C(=O)NCc2ccccc2N2CCCC2)C[C@H]1CN(C)C	ZINC000875145882	GE	On-Demand	Anodyne	EPHX2	17	40
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)Cn1cncn1	ZINC000875145883	CA	On-Demand	Mild	HIS3	83	40
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](C)Cn1cncn1	ZINC000875145889	CA	On-Demand	Mild	HIS3	83	40
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](C)Cn1cncn1	ZINC000875145890	CA	On-Demand	Mild	HIS3	83	40
C[C@@H](NC(=O)N(C1CC1)C1CC1)c1ccccc1C(F)(F)F	ZINC000875145893	DI	On-Demand	Anodyne	HSD11B1	17	40
C[C@@H](NC(=O)N(C1CC1)C1CC1)c1ccccc1C(F)(F)F	ZINC000875145893	DI	On-Demand	Anodyne	RBP4	49	37
O=C(NCCNC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1ccc(F)cc1	ZINC000875145914	GD	On-Demand	Anodyne	PLD2	40	38
O=C(NCCNC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1ccc(F)cc1	ZINC000875145915	GD	On-Demand	Anodyne	PLD2	40	38
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)Cn1cncn1	ZINC000875145934	CA	On-Demand	Mild	HIS3	83	40
C[C@@H](Cn1cncn1)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875145935	GD	On-Demand	Anodyne	DRD4	31	40
C[C@@H](Cn1cncn1)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875145935	GD	On-Demand	Anodyne	ACHE	54	53
C[C@@H](Cn1cncn1)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875145935	GD	On-Demand	Anodyne	HTR4	32	46
C[C@@H](Cn1cncn1)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875145935	GD	On-Demand	Anodyne	SIGMAR1	35	42
C[C@@H](Cn1cncn1)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875145935	GD	On-Demand	Anodyne	HIS3	79	42
O=C(NCc1ccccc1N1CCCC1)N[C@@H]1[C@@H]2C[C@H]3[C@H](CO[C@H]31)C2	ZINC000875145953	EF	On-Demand	Anodyne	KCNQ2	49	39
O=C(NCc1ccccc1N1CCCC1)N[C@@H]1[C@H]2C[C@@H]3CO[C@H]1[C@H]3C2	ZINC000875145954	EF	On-Demand	Anodyne	KCNQ2	49	39
O=C(NCc1ccccc1N1CCCC1)N[C@@H]1[C@@H]2C[C@@H]3[C@@H]1OC[C@@H]3C2	ZINC000875145955	EF	On-Demand	Anodyne	KCNQ2	49	39
O=C(NCc1ccccc1N1CCCC1)N[C@@H]1[C@H]2C[C@@H]3CO[C@@H]1[C@H]3C2	ZINC000875145956	EF	On-Demand	Anodyne	KCNQ2	49	39
CSc1ccc(CNC(=O)N2CCC(C(=O)NCCO)CC2)cc1	ZINC000875145958	FD	On-Demand	Anodyne	EPHX2	18	45
CCN(C(=O)[C@H]1COC(=O)N1C)c1ccccc1Cl	ZINC000875145961	CE	On-Demand	Anodyne	P2RX7	16	41
COCC(C)(C)CCNC(=O)C(=O)N[C@H](C)Cn1cncn1	ZINC000875145966	DB	On-Demand	Anodyne	HIS3	78	37
COCC(C)(C)CCNC(=O)C(=O)N[C@@H](C)Cn1cncn1	ZINC000875145967	DB	On-Demand	Anodyne	HIS3	78	37
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(F)c(Cl)c1	ZINC000875145969	EE	On-Demand	Anodyne	CACNA1H	71	46
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(F)c(Cl)c1	ZINC000875145969	EE	On-Demand	Anodyne	CCR1	40	36
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(F)c(Cl)c1	ZINC000875145969	EE	On-Demand	Anodyne	MAPK1	57	46
C[C@@H](Cn1cncn1)NC(=O)C(=O)N1CCN(C)c2ncccc2C1	ZINC000875145972	EB	On-Demand	Anodyne	HIS3	70	34
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccc(F)c(Cl)c1	ZINC000875145974	EE	On-Demand	Anodyne	CACNA1H	42	40
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccc(F)c(Cl)c1	ZINC000875145974	EE	On-Demand	Anodyne	MAPK1	52	43
C[C@@H](Cn1cncn1)NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875145984	CB	On-Demand	Anodyne	HIS3	79	37
C[C@@H](Cn1cncn1)NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875145985	CB	On-Demand	Anodyne	HIS3	79	37
C[C@@H](Cn1cncn1)NC(=O)C(=O)NCCSCCC(F)(F)F	ZINC000875145992	FC	On-Demand	Anodyne	HIS3	76	36
O=C(NCc1ccnc(F)c1)NCc1ccccc1N1CCCC1	ZINC000875145993	EF	On-Demand	Anodyne	AVPR2	15	40
O=C(NCc1ccnc(F)c1)NCc1ccccc1N1CCCC1	ZINC000875145993	EF	On-Demand	Anodyne	KCNQ2	73	42
O=C(NCc1ccnc(F)c1)NCc1ccccc1N1CCCC1	ZINC000875145993	EF	On-Demand	Anodyne	SCN2A	20	45
O=C(NCc1ccnc(F)c1)NCc1ccccc1N1CCCC1	ZINC000875145993	EF	On-Demand	Anodyne	SCN10A	21	45
C[C@@H](Cn1cncn1)NC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875145995	GC	On-Demand	Anodyne	HIS3	74	33
C[C@@H](Cn1cncn1)NC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875145995	GC	On-Demand	Anodyne	NPY2R	54	36
CC(=O)Nc1cccc2c1CN(C(=O)NCc1ccccc1N1CCCC1)CC2	ZINC000875145997	GH	On-Demand	Anodyne	AVPR2	34	40
CC(=O)Nc1cccc2c1CN(C(=O)NCc1ccccc1N1CCCC1)CC2	ZINC000875145997	GH	On-Demand	Anodyne	KCNQ2	80	43
Cn1nccc1C(NC(=O)NCc1ccccc1N1CCCC1)c1ccnn1C	ZINC000875146008	GE	On-Demand	Anodyne	KCNQ2	75	39
Cn1nccc1C(NC(=O)NCc1ccccc1N1CCCC1)c1ccnn1C	ZINC000875146008	GE	On-Demand	Anodyne	SCN2A	19	43
Cn1nccc1C(NC(=O)NCc1ccccc1N1CCCC1)c1ccnn1C	ZINC000875146008	GE	On-Demand	Anodyne	SCN10A	15	43
C[C@@H](Cn1cncn1)NC(=O)C(=O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000875146013	GD	On-Demand	Anodyne	HIS3	79	38
O=C1OC[C@H]2CN(C(=O)NCc3ccccc3N3CCCC3)C[C@@H]12	ZINC000875146027	ED	On-Demand	Anodyne	KCNQ2	60	38
CN1CCN(C(=O)NCc2ccccc2N2CCCC2)CCC1(C)C	ZINC000875146030	EF	On-Demand	Anodyne	KCNQ2	72	42
CN1CCN(C(=O)NCc2ccccc2N2CCCC2)CCC1(C)C	ZINC000875146030	EF	On-Demand	Anodyne	SCN2A	17	40
C[C@@H](NC(=O)N(C)C[C@H]1CN(C)CCO1)c1ccccc1C(F)(F)F	ZINC000875146041	FF	On-Demand	Anodyne	RBP4	50	35
C[C@@H](NC(=O)N(C)C[C@@H]1CN(C)CCO1)c1ccccc1C(F)(F)F	ZINC000875146042	FF	On-Demand	Anodyne	RBP4	50	35
O=C(NCc1ccccc1-n1ccnc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875146056	FF	On-Demand	Anodyne	NOS2	89	37
O=C(NCc1ccccc1-n1ccnc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875146057	FF	On-Demand	Anodyne	NOS2	89	37
COC(=O)C1(O)CN(C(=O)N[C@H](C)c2ccccc2C(F)(F)F)C1	ZINC000875146067	ED	On-Demand	Anodyne	RBP4	56	40
COC(=O)C1(O)CN(C(=O)N[C@@H](C)c2ccccc2C(F)(F)F)C1	ZINC000875146068	ED	On-Demand	Anodyne	RBP4	56	40
C[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C)[C@@H](O)C2)c1ccccc1C(F)(F)F	ZINC000875146071	FH	On-Demand	Anodyne	RBP4	60	37
C[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C)[C@@H](O)C2)c1ccccc1C(F)(F)F	ZINC000875146072	FH	On-Demand	Anodyne	RBP4	60	37
C[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C)[C@H](O)C2)c1ccccc1C(F)(F)F	ZINC000875146073	FH	On-Demand	Anodyne	RBP4	60	37
C[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C)[C@H](O)C2)c1ccccc1C(F)(F)F	ZINC000875146074	FH	On-Demand	Anodyne	RBP4	60	37
O=C(NCc1ccccc1-n1ccnc1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875146083	GD	On-Demand	Anodyne	NOS2	73	37
C[C@@H](NC(=O)N1CC[C@@H]2CC[C@@H](O)[C@@H]21)c1ccccc1C(F)(F)F	ZINC000875146088	EG	On-Demand	Anodyne	RBP4	82	39
C[C@@H](NC(=O)N1CC[C@@H]2CC[C@@H](O)[C@@H]21)c1ccccc1C(F)(F)F	ZINC000875146088	EG	On-Demand	Anodyne	SFRP1	104	35
C[C@@H](NC(=O)N1CC[C@@H]2CC[C@@H](O)[C@@H]21)c1ccccc1C(F)(F)F	ZINC000875146088	EG	On-Demand	Anodyne	WNT3	74	35
CC(C)(C)CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875146109	CF	On-Demand	Anodyne	F2	35	40
CC(C)(C)CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875146109	CF	On-Demand	Anodyne	PRSS1	18	40
CC(C)(C)CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875146109	CF	On-Demand	Anodyne	ACE	42	39
CC(C)(C)CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875146109	CF	On-Demand	Anodyne	FKBP1A	34	53
CC(C)(C)CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875146109	CF	On-Demand	Anodyne	PREP	56	40
CC(C)(C)CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875146109	CF	On-Demand	Anodyne	WNT3	42	35
CC(C)(C)CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875146110	CF	On-Demand	Anodyne	F2	35	40
CC(C)(C)CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875146110	CF	On-Demand	Anodyne	PRSS1	18	40
CC(C)(C)CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875146110	CF	On-Demand	Anodyne	ACE	42	39
CC(C)(C)CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875146110	CF	On-Demand	Anodyne	FKBP1A	34	53
CC(C)(C)CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875146110	CF	On-Demand	Anodyne	PREP	56	40
CC(C)(C)CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875146110	CF	On-Demand	Anodyne	WNT3	42	35
CC(C)(C)CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875146111	CF	On-Demand	Anodyne	F2	35	40
CC(C)(C)CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875146111	CF	On-Demand	Anodyne	PRSS1	18	40
CC(C)(C)CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875146111	CF	On-Demand	Anodyne	ACE	42	39
CC(C)(C)CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875146111	CF	On-Demand	Anodyne	FKBP1A	34	53
CC(C)(C)CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875146111	CF	On-Demand	Anodyne	PREP	56	40
CC(C)(C)CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875146111	CF	On-Demand	Anodyne	WNT3	42	35
CC(C)(C)CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875146112	CF	On-Demand	Anodyne	F2	35	40
CC(C)(C)CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875146112	CF	On-Demand	Anodyne	PRSS1	18	40
CC(C)(C)CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875146112	CF	On-Demand	Anodyne	ACE	42	39
CC(C)(C)CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875146112	CF	On-Demand	Anodyne	FKBP1A	34	53
CC(C)(C)CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875146112	CF	On-Demand	Anodyne	PREP	56	40
CC(C)(C)CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875146112	CF	On-Demand	Anodyne	WNT3	42	35
C[C@@H](Cn1cncn1)NC(=O)C(=O)N1CCN(C)C(C)(C)CC1	ZINC000875146147	DB	On-Demand	Anodyne	HIS3	76	36
O=C(NCc1ccccc1N1CCCC1)NCc1noc2cc(F)ccc12	ZINC000875146163	FH	On-Demand	Anodyne	KCNQ2	62	40
O=C(NCc1ccccc1N1CCCC1)NCc1noc2cc(F)ccc12	ZINC000875146163	FH	On-Demand	Anodyne	P2RX7	38	40
O=C(NCc1ccccc1N1CCCC1)NCc1noc2cc(F)ccc12	ZINC000875146163	FH	On-Demand	Anodyne	SCN2A	17	41
CCCCCCCNC(=O)C(=O)N[C@H](C)Cn1cncn1	ZINC000875146166	CC	On-Demand	Mild	HIS3	85	47
CCCCCCCNC(=O)C(=O)N[C@H](C)Cn1cncn1	ZINC000875146166	CC	On-Demand	Mild	ASAH1	67	33
CCCCCCCNC(=O)C(=O)N[C@@H](C)Cn1cncn1	ZINC000875146167	CC	On-Demand	Mild	HIS3	85	47
CCCCCCCNC(=O)C(=O)N[C@@H](C)Cn1cncn1	ZINC000875146167	CC	On-Demand	Mild	ASAH1	67	33
Cc1nnc(NNC(=O)NCc2ccccc2N2CCCC2)n1C	ZINC000875146171	ED	On-Demand	Reactive	KCNQ2	68	38
Cc1nnc(NNC(=O)NCc2ccccc2N2CCCC2)n1C	ZINC000875146171	ED	On-Demand	Reactive	SCN2A	17	41
CCn1ncc(CNC(=O)NCc2ccccc2N2CCCC2)n1	ZINC000875146172	ED	On-Demand	Anodyne	KCNQ2	75	40
CCn1ncc(CNC(=O)NCc2ccccc2N2CCCC2)n1	ZINC000875146172	ED	On-Demand	Anodyne	SCN2A	20	47
CCn1ncc(CNC(=O)NCc2ccccc2N2CCCC2)n1	ZINC000875146172	ED	On-Demand	Anodyne	SCN10A	25	47
C[C@@H](Cn1cncn1)NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1	ZINC000875146174	EC	On-Demand	Anodyne	HIS3	79	35
COC(=O)C1=NO[C@]2(CCN(C(=O)N[C@H](C)c3ccc(F)c(Cl)c3)C2)C1	ZINC000875146192	GF	On-Demand	Anodyne	CACNA1H	48	38
COC(=O)C1=NO[C@]2(CCN(C(=O)N[C@H](C)c3ccc(F)c(Cl)c3)C2)C1	ZINC000875146192	GF	On-Demand	Anodyne	MAPK1	45	39
COC(=O)C1=NO[C@@]2(CCN(C(=O)N[C@@H](C)c3ccc(F)c(Cl)c3)C2)C1	ZINC000875146193	GF	On-Demand	Anodyne	CACNA1H	48	38
COC(=O)C1=NO[C@@]2(CCN(C(=O)N[C@@H](C)c3ccc(F)c(Cl)c3)C2)C1	ZINC000875146193	GF	On-Demand	Anodyne	MAPK1	45	39
COC(=O)C1=NO[C@]2(CCN(C(=O)N[C@@H](C)c3ccc(F)c(Cl)c3)C2)C1	ZINC000875146194	GF	On-Demand	Anodyne	CACNA1H	48	38
COC(=O)C1=NO[C@]2(CCN(C(=O)N[C@@H](C)c3ccc(F)c(Cl)c3)C2)C1	ZINC000875146194	GF	On-Demand	Anodyne	MAPK1	45	39
COC(=O)C1=NO[C@@]2(CCN(C(=O)N[C@H](C)c3ccc(F)c(Cl)c3)C2)C1	ZINC000875146195	GF	On-Demand	Anodyne	CACNA1H	48	38
COC(=O)C1=NO[C@@]2(CCN(C(=O)N[C@H](C)c3ccc(F)c(Cl)c3)C2)C1	ZINC000875146195	GF	On-Demand	Anodyne	MAPK1	45	39
O=C(NCc1ccccc1-n1ccnc1)N1CCC(CO)(CO)CC1	ZINC000875146262	ED	On-Demand	Anodyne	NOS2	83	38
O=C(NCc1ccccc1-n1ccnc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875146276	FH	On-Demand	Anodyne	NOS2	75	36
O=C(NCc1ccccc1-n1ccnc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875146276	FH	On-Demand	Anodyne	EPHX2	21	47
O=C(NCc1ccccc1-n1ccnc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875146277	FH	On-Demand	Anodyne	NOS2	75	36
O=C(NCc1ccccc1-n1ccnc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875146277	FH	On-Demand	Anodyne	EPHX2	21	47
O=C(NC(c1ccc(F)cc1)c1ccc(F)cc1)N1CCC(CO)(CO)CC1	ZINC000875146291	GF	On-Demand	Anodyne	CACNA1H	42	38
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(-c3csc(C)n3)cc2)CC1	ZINC000875146307	GF	On-Demand	Anodyne	VHL	58	35
C[C@H](NC(=O)N1C[C@@](C)(CO)[C@@](C)(CO)C1)c1ccccc1C(F)(F)F	ZINC000875146326	FF	On-Demand	Anodyne	RBP4	80	46
C[C@H](NC(=O)N1C[C@@](C)(CO)[C@@](C)(CO)C1)c1ccccc1C(F)(F)F	ZINC000875146326	FF	On-Demand	Anodyne	SFRP1	47	32
C[C@@H](NC(=O)N1C[C@@](C)(CO)[C@@](C)(CO)C1)c1ccccc1C(F)(F)F	ZINC000875146327	FF	On-Demand	Anodyne	RBP4	80	46
C[C@@H](NC(=O)N1C[C@@](C)(CO)[C@@](C)(CO)C1)c1ccccc1C(F)(F)F	ZINC000875146327	FF	On-Demand	Anodyne	SFRP1	47	32
C[C@@H](NC(=O)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O)c1ccccc1C(F)(F)F	ZINC000875146328	FG	On-Demand	Anodyne	RBP4	87	42
C[C@@H](NC(=O)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O)c1ccccc1C(F)(F)F	ZINC000875146328	FG	On-Demand	Anodyne	SFRP1	102	34
C[C@@H](NC(=O)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O)c1ccccc1C(F)(F)F	ZINC000875146328	FG	On-Demand	Anodyne	WNT3	76	34
C[C@@H](NC(=O)N1CC[C@H]2CC[C@@H](C1)[S@]2=O)c1ccccc1C(F)(F)F	ZINC000875146331	FG	On-Demand	Anodyne	RBP4	87	42
C[C@@H](NC(=O)N1CC[C@H]2CC[C@@H](C1)[S@]2=O)c1ccccc1C(F)(F)F	ZINC000875146331	FG	On-Demand	Anodyne	SFRP1	102	34
C[C@@H](NC(=O)N1CC[C@H]2CC[C@@H](C1)[S@]2=O)c1ccccc1C(F)(F)F	ZINC000875146331	FG	On-Demand	Anodyne	WNT3	76	34
O=C(NCc1nc(-c2ccncc2)cs1)NCc1ccccc1N1CCCC1	ZINC000875146346	GH	On-Demand	Anodyne	KCNQ2	57	38
O=C(NCc1nc(-c2ccncc2)cs1)NCc1ccccc1N1CCCC1	ZINC000875146346	GH	On-Demand	Anodyne	SCN2A	19	45
O=C(NCc1nc(-c2ccncc2)cs1)NCc1ccccc1N1CCCC1	ZINC000875146346	GH	On-Demand	Anodyne	CPT1A	15	42
O=C(NCc1nc(-c2ccncc2)cs1)NCc1ccccc1N1CCCC1	ZINC000875146346	GH	On-Demand	Anodyne	ROCK1	29	53
O=C(NCc1nc(-c2ccncc2)cs1)NCc1ccccc1N1CCCC1	ZINC000875146346	GH	On-Demand	Anodyne	ROCK2	21	53
O=C(NCc1nc(-c2ccncc2)cs1)NCc1ccccc1N1CCCC1	ZINC000875146346	GH	On-Demand	Anodyne	SCN10A	26	45
Cc1ncc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)s1	ZINC000875146355	EG	On-Demand	Anodyne	CPT1A	79	34
Cc1ncc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)s1	ZINC000875146356	EG	On-Demand	Anodyne	CPT1A	79	34
Cc1ncc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)s1	ZINC000875146357	EG	On-Demand	Anodyne	CPT1A	79	34
Cc1ncc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)s1	ZINC000875146358	EG	On-Demand	Anodyne	CPT1A	79	34
N#Cc1ccc(N2CCN(C(=O)NCc3ccccc3N3CCCC3)CC2)cn1	ZINC000875146370	GF	On-Demand	Mild	KCNQ2	50	36
N#Cc1ccc(N2CCN(C(=O)NCc3ccccc3N3CCCC3)CC2)cn1	ZINC000875146370	GF	On-Demand	Mild	SCN2A	18	41
O=C(NCc1nc(O)c2c(n1)CCOC2)NCc1ccccc1N1CCCC1	ZINC000875146378	GD	On-Demand	Anodyne	KCNQ2	54	38
O=C(NCc1nc(O)c2c(n1)CCOC2)NCc1ccccc1N1CCCC1	ZINC000875146378	GD	On-Demand	Anodyne	SCN2A	17	40
O=C(NCc1nc(O)c2c(n1)CCOC2)NCc1ccccc1N1CCCC1	ZINC000875146378	GD	On-Demand	Anodyne	SCN10A	15	40
O=C(NCc1nc(O)c2c(n1)CCOC2)NCc1ccccc1N1CCCC1	ZINC000875146378	GD	On-Demand	Anodyne	WNT3A	53	35
C[S@](=N)(=O)N1CCN(C(=O)NCc2ccccc2N2CCCC2)CC1	ZINC000875146384	FD	On-Demand	Anodyne	KCNQ2	75	41
C[S@](=N)(=O)N1CCN(C(=O)NCc2ccccc2N2CCCC2)CC1	ZINC000875146384	FD	On-Demand	Anodyne	SCN2A	17	42
CONC(=O)C1CCN(C(=O)NCc2ccccc2N2CCCC2)CC1	ZINC000875146386	FD	On-Demand	Anodyne	HTR1A	18	42
CONC(=O)C1CCN(C(=O)NCc2ccccc2N2CCCC2)CC1	ZINC000875146386	FD	On-Demand	Anodyne	DRD3	15	40
CONC(=O)C1CCN(C(=O)NCc2ccccc2N2CCCC2)CC1	ZINC000875146386	FD	On-Demand	Anodyne	KCNQ2	72	39
CONC(=O)C1CCN(C(=O)NCc2ccccc2N2CCCC2)CC1	ZINC000875146386	FD	On-Demand	Anodyne	SCN2A	17	42
CONC(=O)C1CCN(C(=O)NCc2ccccc2N2CCCC2)CC1	ZINC000875146386	FD	On-Demand	Anodyne	EPHX2	38	46
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1N1CCCC1	ZINC000875146391	DF	On-Demand	Anodyne	ANPEP	18	42
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1N1CCCC1	ZINC000875146391	DF	On-Demand	Anodyne	KCNQ2	83	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1N1CCCC1	ZINC000875146391	DF	On-Demand	Anodyne	SCN2A	17	41
COc1ccc(OCCCNC(=O)N(C)OCC(F)(F)F)cc1	ZINC000875146402	EF	On-Demand	Anodyne	FDPS	20	41
COc1ccc(OCCCNC(=O)N(C)OCC(F)(F)F)cc1	ZINC000875146402	EF	On-Demand	Anodyne	SCNN1A	21	40
COC(=O)C1(O)CN(C(=O)NCc2cccc(OCC(C)C)c2)C1	ZINC000875146404	ED	On-Demand	Anodyne	PDS	82	40
CCOc1ccc(C2(CNC(=O)N3CCCN(C=O)CC3)CCOCC2)cc1	ZINC000875146435	GE	On-Demand	Anodyne	HCN1	43	35
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(C)C)cc1	ZINC000875146440	EG	On-Demand	Anodyne	SLC6A4	37	50
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(C)C)cc1	ZINC000875146440	EG	On-Demand	Anodyne	SLC6A3	75	50
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(C)C)cc1	ZINC000875146441	EG	On-Demand	Anodyne	SLC6A4	37	50
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(C)C)cc1	ZINC000875146441	EG	On-Demand	Anodyne	SLC6A3	75	50
C[C@@H](Cn1cncn1)NC(=O)C(=O)N(C)C[C@H]1CCCCN1Cc1ccccc1	ZINC000875146449	GD	On-Demand	Anodyne	HIS3	53	38
CSc1ccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875146451	EE	On-Demand	Anodyne	CCR2	23	45
CS[C@@H]1C[C@@H](NC(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875146461	DF	On-Demand	Anodyne	KCNQ2	74	40
CS[C@@H]1C[C@@H](NC(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875146461	DF	On-Demand	Anodyne	SCN2A	17	41
CS[C@@H]1C[C@@H](NC(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875146461	DF	On-Demand	Anodyne	EPHX2	15	42
C[C@@H](Cn1cncn1)NC(=O)C(=O)NC[C@H]1CCN1C1CCCCCC1	ZINC000875146477	FC	On-Demand	Anodyne	HIS3	70	38
C[C@@H](Cn1cncn1)NC(=O)C(=O)NC[C@@H]1CCN1C1CCCCCC1	ZINC000875146478	FC	On-Demand	Anodyne	HIS3	70	38
CO[C@@H]1CC[C@@H](C)N(C(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875146486	EF	On-Demand	Anodyne	AVPR2	24	46
CO[C@@H]1CC[C@@H](C)N(C(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875146486	EF	On-Demand	Anodyne	KCNQ2	72	38
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccc(F)c(Cl)c1	ZINC000875146490	EH	On-Demand	Anodyne	CACNA1H	49	41
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccc(F)c(Cl)c1	ZINC000875146490	EH	On-Demand	Anodyne	MAPK1	53	43
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccc(F)c(Cl)c1	ZINC000875146492	EH	On-Demand	Anodyne	CACNA1H	49	41
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccc(F)c(Cl)c1	ZINC000875146492	EH	On-Demand	Anodyne	MAPK1	53	43
CONC(=O)C1CCN(C(=O)NCC2(c3ccc(Cl)cc3)CCCC2)CC1	ZINC000875146496	GG	On-Demand	Anodyne	EPHX2	24	44
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccc(F)c(Cl)c1	ZINC000875146499	FE	On-Demand	Anodyne	CACNA1H	46	39
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccc(F)c(Cl)c1	ZINC000875146499	FE	On-Demand	Anodyne	MAPK1	56	44
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccc(F)c(Cl)c1	ZINC000875146499	FE	On-Demand	Anodyne	EPHX2	21	47
Cn1cc(CCNC(=O)NCc2ccccc2N2CCCC2)c2cccnc21	ZINC000875146506	GG	On-Demand	Anodyne	KCNQ2	64	37
O=C(NCc1ccccc1N1CCCC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875146508	FH	On-Demand	Anodyne	KCNQ2	71	40
O=C(NCc1ccccc1N1CCCC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875146508	FH	On-Demand	Anodyne	SCN2A	17	40
O=C(NCc1ccccc1N1CCCC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875146508	FH	On-Demand	Anodyne	EPHX2	31	47
O=C(NCc1ccccc1N1CCCC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875146509	FH	On-Demand	Anodyne	KCNQ2	71	40
O=C(NCc1ccccc1N1CCCC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875146509	FH	On-Demand	Anodyne	SCN2A	17	40
O=C(NCc1ccccc1N1CCCC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875146509	FH	On-Demand	Anodyne	EPHX2	31	47
O=C(NCc1ccccc1N1CCCC1)N[C@H]1CCCC[C@H]1F	ZINC000875146510	DG	On-Demand	Anodyne	KCNQ2	74	41
O=C(NCc1ccccc1N1CCCC1)N[C@H]1CCCC[C@H]1F	ZINC000875146510	DG	On-Demand	Anodyne	SCN2A	17	42
O=C(NCc1ccccc1N1CCCC1)N[C@H]1CCCC[C@H]1F	ZINC000875146510	DG	On-Demand	Anodyne	EPHX2	15	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)Cn2cncn2)C1	ZINC000875146521	DB	On-Demand	Anodyne	HIS3	76	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)Cn2cncn2)C1	ZINC000875146522	DB	On-Demand	Anodyne	HIS3	76	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)Cn2cncn2)C1	ZINC000875146523	DB	On-Demand	Anodyne	HIS3	76	38
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)Cn2cncn2)C1	ZINC000875146524	DB	On-Demand	Anodyne	HIS3	76	38
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3ccccc3N3CCCC3)C[C@@H]1C2	ZINC000875146525	FE	On-Demand	Anodyne	KCNQ2	66	37
CSc1ccc(CNC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875146526	DD	On-Demand	Anodyne	NAMPT	22	41
O=C(NCC[C@@H]1CCCS1)NCc1ccccc1N1CCCC1	ZINC000875146527	EG	On-Demand	Anodyne	KCNQ2	67	39
O=C(NCC[C@@H]1CCCS1)NCc1ccccc1N1CCCC1	ZINC000875146527	EG	On-Demand	Anodyne	SCN2A	17	40
O=C(NCC[C@H]1CCCS1)NCc1ccccc1N1CCCC1	ZINC000875146528	EG	On-Demand	Anodyne	KCNQ2	67	39
O=C(NCC[C@H]1CCCS1)NCc1ccccc1N1CCCC1	ZINC000875146528	EG	On-Demand	Anodyne	SCN2A	17	40
NC(=O)C1CC(NC(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875146531	DD	On-Demand	Anodyne	KCNQ2	74	43
NC(=O)C1CC(NC(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875146531	DD	On-Demand	Anodyne	SCN2A	18	43
NC(=O)C1CC(NC(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875146531	DD	On-Demand	Anodyne	EPHX2	17	44
NC(=O)C1CC(NC(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875146531	DD	On-Demand	Anodyne	SCN10A	15	43
O=C(NCc1ccccc1N1CCCC1)NC[C@H]1C[C@H](O)C1	ZINC000875146562	DD	On-Demand	Anodyne	KCNQ2	76	43
O=C(NCc1ccccc1N1CCCC1)NC[C@H]1C[C@H](O)C1	ZINC000875146562	DD	On-Demand	Anodyne	SCN2A	18	44
O=C(NCc1ccccc1N1CCCC1)NC[C@H]1C[C@H](O)C1	ZINC000875146562	DD	On-Demand	Anodyne	SCN10A	15	44
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccccc1C(F)(F)F	ZINC000875146565	FF	On-Demand	Anodyne	GHRHR	49	34
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccccc1C(F)(F)F	ZINC000875146565	FF	On-Demand	Anodyne	RBP4	87	44
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccccc1C(F)(F)F	ZINC000875146565	FF	On-Demand	Anodyne	SFRP1	101	34
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccccc1C(F)(F)F	ZINC000875146565	FF	On-Demand	Anodyne	WNT3	74	34
C#C[C@@H]1CC[C@@H](NC(=O)NCc2ccccc2N2CCCC2)CC1	ZINC000875146568	EG	On-Demand	Mild	KCNQ2	69	40
C#C[C@@H]1CC[C@@H](NC(=O)NCc2ccccc2N2CCCC2)CC1	ZINC000875146568	EG	On-Demand	Mild	SCN2A	17	41
C#C[C@@H]1CC[C@@H](NC(=O)NCc2ccccc2N2CCCC2)CC1	ZINC000875146568	EG	On-Demand	Mild	EPHX2	27	47
CN(C)C[C@@H]1CN(C(=O)NCc2ccccc2-n2ccnc2)C[C@H]1CN(C)C	ZINC000875146591	GD	On-Demand	Anodyne	NOS2	94	38
COC(=O)N(C)NC(=O)N[C@H](CC(=O)N(C)C)c1ccccc1	ZINC000875146595	DD	On-Demand	Reactive	TACR3	27	40
COC(=O)N(C)NC(=O)N[C@@H](CC(=O)N(C)C)c1ccccc1	ZINC000875146597	DD	On-Demand	Reactive	TACR3	27	40
CC[C@H](C[C@H](C)O)NC(=O)NCCNC(=O)c1ccc(F)cc1	ZINC000875146623	ED	On-Demand	Anodyne	FOLH1	18	41
CC(=O)[C@H]1CCCN(C(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875146629	EF	On-Demand	Anodyne	AVPR2	25	40
CC(=O)[C@H]1CCCN(C(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875146629	EF	On-Demand	Anodyne	SLC6A1	76	34
CC(=O)[C@H]1CCCN(C(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875146629	EF	On-Demand	Anodyne	MC4R	17	43
CC(=O)[C@H]1CCCN(C(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875146629	EF	On-Demand	Anodyne	KCNQ2	75	41
CC(=O)[C@H]1CCCN(C(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875146629	EF	On-Demand	Anodyne	SCN2A	18	44
CC(=O)[C@H]1CCCN(C(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875146629	EF	On-Demand	Anodyne	EPHX2	21	41
CC(=O)[C@H]1CCCN(C(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875146629	EF	On-Demand	Anodyne	DPP7	41	36
CC(=O)[C@H]1CCCN(C(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875146629	EF	On-Demand	Anodyne	SCN10A	15	44
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875146631	EF	On-Demand	Anodyne	AVPR2	25	40
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875146631	EF	On-Demand	Anodyne	SLC6A1	76	34
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875146631	EF	On-Demand	Anodyne	MC4R	17	43
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875146631	EF	On-Demand	Anodyne	KCNQ2	75	41
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875146631	EF	On-Demand	Anodyne	SCN2A	18	44
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875146631	EF	On-Demand	Anodyne	EPHX2	21	41
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875146631	EF	On-Demand	Anodyne	DPP7	41	36
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875146631	EF	On-Demand	Anodyne	SCN10A	15	44
COc1ccc(OCCCNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875146663	FD	On-Demand	Anodyne	DRD4	21	41
COc1ccc(OCCCNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875146663	FD	On-Demand	Anodyne	HRH2	38	44
COc1ccc(OCCCNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875146663	FD	On-Demand	Anodyne	LTA4H	18	43
COc1ccc(OCCCNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875146663	FD	On-Demand	Anodyne	HRH3	19	45
COc1ccc(OCCCNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875146663	FD	On-Demand	Anodyne	CCR3	20	42
COc1ccc(OCCCNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875146663	FD	On-Demand	Anodyne	EPHX2	19	42
COc1ccc(OCCCNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875146663	FD	On-Demand	Anodyne	PDK1	40	33
COc1ccc(OCCCNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875146663	FD	On-Demand	Anodyne	MCHR1	18	44
COC(=O)N(C)NC(=O)NCc1cccc(OCC(C)C)c1	ZINC000875146667	DE	On-Demand	Reactive	ROCK1	21	41
COC(=O)N(C)NC(=O)NCc1cccc(OCC(C)C)c1	ZINC000875146667	DE	On-Demand	Reactive	ROCK2	30	41
COC(=O)N(C)NC(=O)NCc1cccc(OCC(C)C)c1	ZINC000875146667	DE	On-Demand	Reactive	AMP1_PLAFQ	20	43
COC(=O)N(C)NC(=O)NCc1cccc(OCC(C)C)c1	ZINC000875146667	DE	On-Demand	Reactive	PDS	96	43
O=C(NCc1ccccc1-n1ccnc1)NC[C@H]1C[C@H](O)C1	ZINC000875146668	DD	On-Demand	Anodyne	NOS2	70	31
C[C@@H](NC(=O)NCCN1CC[C@H](O)C1)c1ccccc1C(F)(F)F	ZINC000875146681	EE	On-Demand	Anodyne	OPRK1	20	41
C[C@@H](NC(=O)NCCN1CC[C@H](O)C1)c1ccccc1C(F)(F)F	ZINC000875146681	EE	On-Demand	Anodyne	CCR3	15	42
C[C@H](NC(=O)NCCN1CC[C@@H](O)C1)c1ccccc1C(F)(F)F	ZINC000875146682	EE	On-Demand	Anodyne	OPRK1	20	41
C[C@H](NC(=O)NCCN1CC[C@@H](O)C1)c1ccccc1C(F)(F)F	ZINC000875146682	EE	On-Demand	Anodyne	CCR3	15	42
C[C@H](NC(=O)NCCN1CC[C@H](O)C1)c1ccccc1C(F)(F)F	ZINC000875146684	EE	On-Demand	Anodyne	OPRK1	20	41
C[C@H](NC(=O)NCCN1CC[C@H](O)C1)c1ccccc1C(F)(F)F	ZINC000875146684	EE	On-Demand	Anodyne	CCR3	15	42
C[C@@H](NC(=O)NCCN1CC[C@@H](O)C1)c1ccccc1C(F)(F)F	ZINC000875146686	EE	On-Demand	Anodyne	OPRK1	20	41
C[C@@H](NC(=O)NCCN1CC[C@@H](O)C1)c1ccccc1C(F)(F)F	ZINC000875146686	EE	On-Demand	Anodyne	CCR3	15	42
COc1ccc(OCCCNC(=O)NC[C@H]2C[C@H](O)C2)cc1	ZINC000875146687	DD	On-Demand	Anodyne	HRH2	23	42
COc1ccc(OCCCNC(=O)NC[C@H]2C[C@H](O)C2)cc1	ZINC000875146687	DD	On-Demand	Anodyne	SCNN1A	21	40
COc1ccc(OCCCNC(=O)NC[C@H]2C[C@H](O)C2)cc1	ZINC000875146687	DD	On-Demand	Anodyne	MTNR1A	45	38
COc1ccc(OCCCNC(=O)NC[C@H]2C[C@H](O)C2)cc1	ZINC000875146687	DD	On-Demand	Anodyne	EPHX2	21	41
O=C(NCc1ccccc1-n1ccnc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875146703	GG	On-Demand	Anodyne	NOS2	79	34
O=C(NCc1ccccc1-n1ccnc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875146705	GG	On-Demand	Anodyne	NOS2	79	34
O=C(NCc1ccccc1-n1ccnc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875146707	GG	On-Demand	Anodyne	NOS2	79	34
O=C(NCc1ccccc1-n1ccnc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875146709	GG	On-Demand	Anodyne	NOS2	79	34
O=C(NC(c1ccc(F)cc1)c1ccc(F)cc1)N1CCC2(CCNC2=O)CC1	ZINC000875146719	GG	On-Demand	Anodyne	CACNA1H	55	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC(=O)N1CCCc2ccccc21	ZINC000875146725	FD	On-Demand	Anodyne	AVPR2	36	40
O=C(NCCNC(=O)N1Cc2cccnc2N2CCC[C@H]2C1)c1ccc(F)cc1	ZINC000875146734	GE	On-Demand	Anodyne	PLD2	41	35
O=C(NCC1(c2ccc(Cl)cc2)CCCC1)N1CCC(CO)(CO)CC1	ZINC000875146742	GF	On-Demand	Anodyne	EPHX2	15	46
C[C@@H](Cn1cncn1)NC(=O)C(=O)NCCC[C@@H]1C=CCC1	ZINC000875146747	DC	On-Demand	Anodyne	HIS3	51	35
C[C@@H](Cn1cncn1)NC(=O)C(=O)NCCC[C@H]1C=CCC1	ZINC000875146748	DC	On-Demand	Anodyne	HIS3	51	35
O=C1CCN(C(=O)NCc2ccccc2N2CCCC2)CCCCCCN1	ZINC000875146757	FF	On-Demand	Anodyne	KCNQ2	68	40
O=C1CCN(C(=O)NCc2ccccc2N2CCCC2)CCCCCCN1	ZINC000875146757	FF	On-Demand	Anodyne	SCN2A	18	42
O=C1CCN(C(=O)NCc2ccccc2N2CCCC2)CCCCCCN1	ZINC000875146757	FF	On-Demand	Anodyne	SCN10A	15	42
CCOc1ccc(C2(CNC(=O)NC3CC(C(=O)OC)C3)CCOCC2)cc1	ZINC000875146758	GE	On-Demand	Anodyne	KCNA3	40	37
CN1CC[C@H]2CN(C(=O)NCc3ccccc3N3CCCC3)CC[C@@H]21	ZINC000875146761	EF	On-Demand	Anodyne	KCNQ2	72	39
CN1CC[C@H]2CN(C(=O)NCc3ccccc3N3CCCC3)CC[C@@H]21	ZINC000875146761	EF	On-Demand	Anodyne	SCN2A	17	42
CN1CC[C@H]2CN(C(=O)NCc3ccccc3N3CCCC3)CC[C@@H]21	ZINC000875146761	EF	On-Demand	Anodyne	EPHX2	20	40
CN1CC[C@H]2CN(C(=O)NCc3ccccc3N3CCCC3)CC[C@H]21	ZINC000875146762	EF	On-Demand	Anodyne	KCNQ2	72	39
CN1CC[C@H]2CN(C(=O)NCc3ccccc3N3CCCC3)CC[C@H]21	ZINC000875146762	EF	On-Demand	Anodyne	SCN2A	17	42
CN1CC[C@H]2CN(C(=O)NCc3ccccc3N3CCCC3)CC[C@H]21	ZINC000875146762	EF	On-Demand	Anodyne	EPHX2	20	40
C#CC[C@@H](COC)NC(=O)NCc1ccccc1N1CCCC1	ZINC000875146764	DE	On-Demand	Mild	KCNQ2	70	38
C#CC[C@H](COC)NC(=O)NCc1ccccc1N1CCCC1	ZINC000875146765	DE	On-Demand	Mild	KCNQ2	70	38
C[C@@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccc(F)c(Cl)c1	ZINC000875146769	GF	On-Demand	Anodyne	MAPK1	55	43
C[C@@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccc(F)c(Cl)c1	ZINC000875146769	GF	On-Demand	Anodyne	UTS2	43	33
C[C@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccc(F)c(Cl)c1	ZINC000875146770	GF	On-Demand	Anodyne	MAPK1	55	43
C[C@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccc(F)c(Cl)c1	ZINC000875146770	GF	On-Demand	Anodyne	UTS2	43	33
O=C(NCc1ccccc1N1CCCC1)NC[C@@H]1C[C@H]1C1CCOCC1	ZINC000875146771	FG	On-Demand	Anodyne	KCNQ2	59	37
CC(=O)[C@H]1CCCN(C(=O)N[C@H](CC(=O)N(C)C)c2ccccc2)C1	ZINC000875146799	EE	On-Demand	Anodyne	CCR5	45	43
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](CC(=O)N(C)C)c2ccccc2)C1	ZINC000875146801	EE	On-Demand	Anodyne	CCR5	45	43
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](CC(=O)N(C)C)c2ccccc2)C1	ZINC000875146803	EE	On-Demand	Anodyne	CCR5	45	43
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](CC(=O)N(C)C)c2ccccc2)C1	ZINC000875146805	EE	On-Demand	Anodyne	CCR5	45	43
C#CC[C@@H](CCOC)NC(=O)NCc1ccccc1N1CCCC1	ZINC000875146811	EF	On-Demand	Mild	KCNQ2	69	37
C#CC[C@@H](CCOC)NC(=O)NCc1ccccc1N1CCCC1	ZINC000875146811	EF	On-Demand	Mild	SCN2A	17	40
C#CC[C@H](CCOC)NC(=O)NCc1ccccc1N1CCCC1	ZINC000875146813	EF	On-Demand	Mild	KCNQ2	69	37
C#CC[C@H](CCOC)NC(=O)NCc1ccccc1N1CCCC1	ZINC000875146813	EF	On-Demand	Mild	SCN2A	17	40
COC(=O)N1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(F)cc2)CC1	ZINC000875146814	FD	On-Demand	Anodyne	GRIN2B	15	41
COC(=O)N1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(F)cc2)CC1	ZINC000875146814	FD	On-Demand	Anodyne	CCR3	43	37
COC(=O)N1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(F)cc2)CC1	ZINC000875146814	FD	On-Demand	Anodyne	EPHX2	41	38
COc1ccccc1[C@@H]1CN(C(=O)C(=O)N[C@@H](C)Cn2cncn2)CCO1	ZINC000875146815	FC	On-Demand	Anodyne	HIS3	45	35
COC(=O)N1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(F)cc2)CC1	ZINC000875146816	FD	On-Demand	Anodyne	GRIN2B	15	41
COC(=O)N1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(F)cc2)CC1	ZINC000875146816	FD	On-Demand	Anodyne	CCR3	43	37
COC(=O)N1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(F)cc2)CC1	ZINC000875146816	FD	On-Demand	Anodyne	EPHX2	41	38
COc1ccccc1[C@@H]1CN(C(=O)C(=O)N[C@H](C)Cn2cncn2)CCO1	ZINC000875146820	FC	On-Demand	Anodyne	HIS3	45	35
COc1ccccc1[C@H]1CN(C(=O)C(=O)N[C@H](C)Cn2cncn2)CCO1	ZINC000875146822	FC	On-Demand	Anodyne	HIS3	45	35
COc1ccccc1[C@H]1CN(C(=O)C(=O)N[C@@H](C)Cn2cncn2)CCO1	ZINC000875146824	FC	On-Demand	Anodyne	HIS3	45	35
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccccc1N1CCCC1	ZINC000875146826	GF	On-Demand	Anodyne	KCNQ2	64	35
COc1ccc([C@@H]2CN(C(=O)C(=O)N[C@@H](C)Cn3cncn3)CCO2)cc1	ZINC000875146833	FC	On-Demand	Anodyne	HIS3	54	34
COc1ccc([C@@H]2CN(C(=O)C(=O)N[C@H](C)Cn3cncn3)CCO2)cc1	ZINC000875146835	FC	On-Demand	Anodyne	HIS3	54	34
COCC1CC(NC(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875146841	DF	On-Demand	Anodyne	KCNQ2	74	40
COCC1CC(NC(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875146841	DF	On-Demand	Anodyne	SCN2A	17	40
COCC1CC(NC(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875146841	DF	On-Demand	Anodyne	EPHX2	17	41
CC(=O)C1CCN(C(=O)N[C@@H](CC(=O)N(C)C)c2ccccc2)CC1	ZINC000875146854	EE	On-Demand	Anodyne	CCR5	42	42
CC(=O)C1CCN(C(=O)N[C@H](CC(=O)N(C)C)c2ccccc2)CC1	ZINC000875146855	EE	On-Demand	Anodyne	CCR5	42	42
CC[C@H](C)[C@H](C)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875146857	DG	On-Demand	Anodyne	ACE	51	52
CC[C@H](C)[C@H](C)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875146857	DG	On-Demand	Anodyne	MME	21	52
CC[C@H](C)[C@H](C)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875146857	DG	On-Demand	Anodyne	ACE2	55	36
CC[C@H](C)[C@H](C)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875146857	DG	On-Demand	Anodyne	XIAP	59	45
CC[C@H](C)[C@H](C)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875146858	DG	On-Demand	Anodyne	ACE	51	52
CC[C@H](C)[C@H](C)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875146858	DG	On-Demand	Anodyne	MME	21	52
CC[C@H](C)[C@H](C)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875146858	DG	On-Demand	Anodyne	ACE2	55	36
CC[C@H](C)[C@H](C)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875146858	DG	On-Demand	Anodyne	XIAP	59	45
CC[C@H](C)[C@H](C)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875146859	DG	On-Demand	Anodyne	ACE	51	52
CC[C@H](C)[C@H](C)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875146859	DG	On-Demand	Anodyne	MME	21	52
CC[C@H](C)[C@H](C)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875146859	DG	On-Demand	Anodyne	ACE2	55	36
CC[C@H](C)[C@H](C)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875146859	DG	On-Demand	Anodyne	XIAP	59	45
CC[C@H](C)[C@H](C)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875146860	DG	On-Demand	Anodyne	ACE	51	52
CC[C@H](C)[C@H](C)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875146860	DG	On-Demand	Anodyne	MME	21	52
CC[C@H](C)[C@H](C)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875146860	DG	On-Demand	Anodyne	ACE2	55	36
CC[C@H](C)[C@H](C)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875146860	DG	On-Demand	Anodyne	XIAP	59	45
CCCCN1CCC(NC(=O)C(=O)NC[C@H]2c3ccccc3CN2C)CC1	ZINC000875146862	FD	On-Demand	Anodyne	HTR1A	34	40
CCCCN1CCC(NC(=O)C(=O)NC[C@H]2c3ccccc3CN2C)CC1	ZINC000875146862	FD	On-Demand	Anodyne	DRD2	40	40
CCCCN1CCC(NC(=O)C(=O)NC[C@H]2c3ccccc3CN2C)CC1	ZINC000875146862	FD	On-Demand	Anodyne	DRD3	55	36
CCCCN1CCC(NC(=O)C(=O)NC[C@H]2c3ccccc3CN2C)CC1	ZINC000875146862	FD	On-Demand	Anodyne	HTR4	61	40
CCCCN1CCC(NC(=O)C(=O)NC[C@H]2c3ccccc3CN2C)CC1	ZINC000875146862	FD	On-Demand	Anodyne	SIGMAR1	23	40
CCCCN1CCC(NC(=O)C(=O)NC[C@@H]2c3ccccc3CN2C)CC1	ZINC000875146863	FD	On-Demand	Anodyne	HTR1A	34	40
CCCCN1CCC(NC(=O)C(=O)NC[C@@H]2c3ccccc3CN2C)CC1	ZINC000875146863	FD	On-Demand	Anodyne	DRD2	40	40
CCCCN1CCC(NC(=O)C(=O)NC[C@@H]2c3ccccc3CN2C)CC1	ZINC000875146863	FD	On-Demand	Anodyne	DRD3	55	36
CCCCN1CCC(NC(=O)C(=O)NC[C@@H]2c3ccccc3CN2C)CC1	ZINC000875146863	FD	On-Demand	Anodyne	HTR4	61	40
CCCCN1CCC(NC(=O)C(=O)NC[C@@H]2c3ccccc3CN2C)CC1	ZINC000875146863	FD	On-Demand	Anodyne	SIGMAR1	23	40
COC(=O)N1CCC(NC(=O)N[C@H](C)[C@H](O)C(F)(F)F)CC1	ZINC000875146869	EC	On-Demand	Anodyne	EPHX2	33	40
COC(=O)N1CCC(NC(=O)N[C@@H](C)[C@H](O)C(F)(F)F)CC1	ZINC000875146870	EC	On-Demand	Anodyne	EPHX2	33	40
COC(=O)N1CCC(NC(=O)N[C@@H](C)[C@@H](O)C(F)(F)F)CC1	ZINC000875146871	EC	On-Demand	Anodyne	EPHX2	33	40
COC(=O)N1CCC(NC(=O)N[C@H](C)[C@@H](O)C(F)(F)F)CC1	ZINC000875146872	EC	On-Demand	Anodyne	EPHX2	33	40
CCCCN1CCC(NC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000875146878	GE	On-Demand	Anodyne	OXTR	52	36
CCCCN1CCC(NC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000875146878	GE	On-Demand	Anodyne	SIGMAR1	33	56
CCCCN1CCC(NC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000875146878	GE	On-Demand	Anodyne	EBP	20	51
CCCCN1CCC(NC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000875146879	GE	On-Demand	Anodyne	OXTR	52	36
CCCCN1CCC(NC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000875146879	GE	On-Demand	Anodyne	SIGMAR1	33	56
CCCCN1CCC(NC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000875146879	GE	On-Demand	Anodyne	EBP	20	51
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCC(C)(C)c1ccccc1	ZINC000875146881	EG	On-Demand	Anodyne	SLC6A4	25	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCC(C)(C)c1ccccc1	ZINC000875146881	EG	On-Demand	Anodyne	SLC6A3	50	41
COC(=O)N1CCC(NC(=O)Nc2cnn(C3CCN(C)CC3)c2)CC1	ZINC000875146890	FD	On-Demand	Anodyne	MTOR	36	49
COC(=O)N1CCC(NC(=O)Nc2cnn(C3CCN(C)CC3)c2)CC1	ZINC000875146890	FD	On-Demand	Anodyne	EPHX2	41	43
CC[C@H](C)[C@H](C)NC(=O)N(C)C[C@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000875146900	EE	On-Demand	Anodyne	ECE1	20	41
CC[C@H](C)[C@H](C)NC(=O)N(C)C[C@@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000875146901	EE	On-Demand	Anodyne	ECE1	20	41
COC(=O)N1CCC(NC(=O)NC[C@H]2C[C@H](O)C2)CC1	ZINC000875146907	CC	On-Demand	Anodyne	EPHX2	37	40
COC(=O)N1CCC(NC(=O)NC[C@@H]2C[C@H](O)C2)CC1	ZINC000875146908	CC	On-Demand	Anodyne	EPHX2	37	40
COC(=O)N1CCC(NC(=O)NCC2CC(O)C2)CC1	ZINC000875146909	CC	On-Demand	Anodyne	EPHX2	37	40
COC(=O)N1CCC(NC(=O)NC2([C@@H]3CCCCO3)CCC2)CC1	ZINC000875146912	EE	On-Demand	Anodyne	EPHX2	16	40
COC(=O)N1CCC(NC(=O)NC2([C@H]3CCCCO3)CCC2)CC1	ZINC000875146913	EE	On-Demand	Anodyne	EPHX2	16	40
CC[C@@H]1COCCN1CCNC(=O)NCC(=O)N1CCCc2ccccc21	ZINC000875146926	FD	On-Demand	Anodyne	AVPR2	38	41
COc1ccc(OCCCNC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875146927	EF	On-Demand	Clean	DRD4	41	31
COc1ccc(OCCCNC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875146927	EF	On-Demand	Clean	HRH2	24	41
COc1ccc(OCCCNC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875146927	EF	On-Demand	Clean	DRD3	15	40
COc1ccc(OCCCNC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875146927	EF	On-Demand	Clean	MTNR1A	54	40
COc1ccc(OCCCNC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875146927	EF	On-Demand	Clean	MTNR1B	48	40
COC(=O)C1=NO[C@@]2(CCN(C(=O)NCc3cccc(OCC(C)C)c3)C2)C1	ZINC000875146931	GE	On-Demand	Anodyne	PDS	43	34
COC(=O)C1=NO[C@]2(CCN(C(=O)NCc3cccc(OCC(C)C)c3)C2)C1	ZINC000875146932	GE	On-Demand	Anodyne	PDS	43	34
CCOC(=O)[C@H](C)C1CN(C(=O)NCC(=O)N2CCCc3ccccc32)C1	ZINC000875146935	FD	On-Demand	Anodyne	ACE	20	44
CCOC(=O)[C@H](C)C1CN(C(=O)NCC(=O)N2CCCc3ccccc32)C1	ZINC000875146935	FD	On-Demand	Anodyne	AVPR2	42	45
Cc1nnc(NNC(=O)NCc2cccc(OCC(C)C)c2)n1C	ZINC000875146944	ED	On-Demand	Reactive	PDS	71	39
Cc1ncc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)s1	ZINC000875146953	EF	On-Demand	Anodyne	TRY1_BOVIN	40	38
Cc1ncc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)s1	ZINC000875146953	EF	On-Demand	Anodyne	PREP	45	39
Cc1ncc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)s1	ZINC000875146954	EF	On-Demand	Anodyne	TRY1_BOVIN	40	38
Cc1ncc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)s1	ZINC000875146954	EF	On-Demand	Anodyne	PREP	45	39
Cc1ncc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)s1	ZINC000875146955	EF	On-Demand	Anodyne	TRY1_BOVIN	40	38
Cc1ncc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)s1	ZINC000875146955	EF	On-Demand	Anodyne	PREP	45	39
Cc1ncc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)s1	ZINC000875146956	EF	On-Demand	Anodyne	TRY1_BOVIN	40	38
Cc1ncc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)s1	ZINC000875146956	EF	On-Demand	Anodyne	PREP	45	39
COC(=O)C1(O)CN(C(=O)NCC(=O)N2CCCc3ccccc32)C1	ZINC000875146957	EB	On-Demand	Anodyne	AVPR2	39	43
O=C(NCC(=O)N1CCCc2ccccc21)N1CCC[C@H](OC2CCC2)CC1	ZINC000875146967	GG	On-Demand	Anodyne	AVPR2	38	41
O=C(NCC(=O)N1CCCc2ccccc21)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875146968	GG	On-Demand	Anodyne	AVPR2	38	41
O=CN1CCCN(C(=O)NCC(=O)N2CCCc3ccccc32)CC1	ZINC000875146969	EC	On-Demand	Anodyne	AVPR2	37	43
O=C(NCc1ccccc1N1CCCC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875146977	FG	On-Demand	Anodyne	KCNQ2	63	37
O=C(NCc1ccccc1N1CCCC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875146977	FG	On-Demand	Anodyne	SCN2A	17	40
O=C(NCc1ccccc1N1CCCC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875146977	FG	On-Demand	Anodyne	EPHX2	22	44
O=C(NCc1ccccc1N1CCCC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875146978	FG	On-Demand	Anodyne	KCNQ2	63	37
O=C(NCc1ccccc1N1CCCC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875146978	FG	On-Demand	Anodyne	SCN2A	17	40
O=C(NCc1ccccc1N1CCCC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875146978	FG	On-Demand	Anodyne	EPHX2	22	44
CN1CCN(C(=O)NCc2ccccc2N2CCCC2)Cc2cccnc21	ZINC000875146984	FF	On-Demand	Anodyne	KCNQ2	65	37
CN1CCN(C(=O)NCc2ccccc2N2CCCC2)Cc2cccnc21	ZINC000875146984	FF	On-Demand	Anodyne	SCN2A	19	40
CN1CCN(C(=O)NCc2ccccc2N2CCCC2)Cc2cccnc21	ZINC000875146984	FF	On-Demand	Anodyne	SCN10A	21	40
COc1ccc([C@@H](NC(=O)N2CCC(C(C)=O)CC2)c2ccc(F)cc2)cc1	ZINC000875146991	GH	On-Demand	Anodyne	SLC6A3	15	46
COc1ccc([C@@H](NC(=O)N2CCC(C(C)=O)CC2)c2ccc(F)cc2)cc1	ZINC000875146991	GH	On-Demand	Anodyne	SLC18A3	18	44
COc1ccc([C@@H](NC(=O)N2CCC(C(C)=O)CC2)c2ccc(F)cc2)cc1	ZINC000875146991	GH	On-Demand	Anodyne	CACNA1G	20	40
COc1ccc([C@H](NC(=O)N2CCC(C(C)=O)CC2)c2ccc(F)cc2)cc1	ZINC000875146992	GH	On-Demand	Anodyne	SLC6A3	15	46
COc1ccc([C@H](NC(=O)N2CCC(C(C)=O)CC2)c2ccc(F)cc2)cc1	ZINC000875146992	GH	On-Demand	Anodyne	SLC18A3	18	44
COc1ccc([C@H](NC(=O)N2CCC(C(C)=O)CC2)c2ccc(F)cc2)cc1	ZINC000875146992	GH	On-Demand	Anodyne	CACNA1G	20	40
COc1ccc(OCCCNC(=O)NNc2cccc(C)n2)cc1	ZINC000875147013	EE	On-Demand	Reactive	HRH2	23	42
COc1ccc(OCCCNC(=O)NNc2cccc(C)n2)cc1	ZINC000875147013	EE	On-Demand	Reactive	SCNN1A	29	43
COc1ccc(OCCCNC(=O)NNc2cccc(C)n2)cc1	ZINC000875147013	EE	On-Demand	Reactive	MTNR1A	66	44
COc1ccc(OCCCNC(=O)NNc2cccc(C)n2)cc1	ZINC000875147013	EE	On-Demand	Reactive	MTNR1B	58	44
COc1ccc(OCCCNC(=O)NNc2cccc(C)n2)cc1	ZINC000875147013	EE	On-Demand	Reactive	GRM5	22	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2ccc(F)cc2)C1	ZINC000875147014	GE	On-Demand	Anodyne	SLC6A4	23	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2ccc(F)cc2)C1	ZINC000875147014	GE	On-Demand	Anodyne	SLC6A3	45	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2ccc(F)cc2)C1	ZINC000875147015	GE	On-Demand	Anodyne	SLC6A4	23	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2ccc(F)cc2)C1	ZINC000875147015	GE	On-Demand	Anodyne	SLC6A3	45	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2ccc(F)cc2)C1	ZINC000875147016	GE	On-Demand	Anodyne	SLC6A4	23	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2ccc(F)cc2)C1	ZINC000875147016	GE	On-Demand	Anodyne	SLC6A3	45	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2ccc(F)cc2)C1	ZINC000875147017	GE	On-Demand	Anodyne	SLC6A4	23	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2ccc(F)cc2)C1	ZINC000875147017	GE	On-Demand	Anodyne	SLC6A3	45	42
O=C(NCC(=O)N1CCCc2ccccc21)N1CCC(CO)(CO)CC1	ZINC000875147018	FC	On-Demand	Anodyne	AVPR2	44	43
COC(=O)N1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875147033	FD	On-Demand	Anodyne	DRD4	17	41
COC(=O)N1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875147033	FD	On-Demand	Anodyne	SIGMAR1	15	48
COC(=O)N1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875147033	FD	On-Demand	Anodyne	CCR1	17	42
COC(=O)N1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875147033	FD	On-Demand	Anodyne	EPHX2	45	49
COC(=O)N1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875147033	FD	On-Demand	Anodyne	MCHR1	17	41
COC(=O)N1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875147034	FD	On-Demand	Anodyne	DRD4	17	41
COC(=O)N1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875147034	FD	On-Demand	Anodyne	SIGMAR1	15	48
COC(=O)N1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875147034	FD	On-Demand	Anodyne	CCR1	17	42
COC(=O)N1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875147034	FD	On-Demand	Anodyne	EPHX2	45	49
COC(=O)N1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875147034	FD	On-Demand	Anodyne	MCHR1	17	41
COC(=O)N1CCC(NC(=O)NCC[C@H](O)C2CCCC2)CC1	ZINC000875147039	ED	On-Demand	Anodyne	EPHX2	29	45
COC(=O)N1CCC(NC(=O)NCC[C@@H](O)C2CCCC2)CC1	ZINC000875147040	ED	On-Demand	Anodyne	EPHX2	29	45
COC(=O)N1CCC(NC(=O)N[C@@H]2C[C@H](CO)C2)CC1	ZINC000875147050	CC	On-Demand	Anodyne	EPHX2	37	50
CC(=O)C1CCN(C(=O)N[C@H](c2ccc(Cl)cc2)c2ccsc2)CC1	ZINC000875147084	GJ	On-Demand	Anodyne	CCR1	44	36
CC(=O)C1CCN(C(=O)N[C@@H](c2ccc(Cl)cc2)c2ccsc2)CC1	ZINC000875147085	GJ	On-Demand	Anodyne	CCR1	44	36
COC(=O)N1CCC(NC(=O)NC(C)(C)C(C)(C)O)CC1	ZINC000875147119	DD	On-Demand	Anodyne	EPHX2	31	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCOc1ccc(OC)cc1	ZINC000875147124	FE	On-Demand	Anodyne	SLC6A4	27	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCOc1ccc(OC)cc1	ZINC000875147124	FE	On-Demand	Anodyne	SLC6A3	47	43
COc1ccc(OCCCNC(=O)N2CCN(C)C(C)(C)CC2)cc1	ZINC000875147131	EF	On-Demand	Anodyne	MMP13	21	40
COc1ccc(OCCCNC(=O)N2CCN(C)C(C)(C)CC2)cc1	ZINC000875147131	EF	On-Demand	Anodyne	MMP9	16	40
COc1ccc(OCCCNC(=O)N2CCN(C)C(C)(C)CC2)cc1	ZINC000875147131	EF	On-Demand	Anodyne	MMP7	16	40
Cc1cncc([C@@H]2CCCN2C(=O)NCc2ccccc2N2CCCC2)c1	ZINC000875147176	FI	On-Demand	Anodyne	AVPR2	24	45
Cc1cncc([C@@H]2CCCN2C(=O)NCc2ccccc2N2CCCC2)c1	ZINC000875147176	FI	On-Demand	Anodyne	KCNQ2	67	37
Cc1cncc([C@@H]2CCCN2C(=O)NCc2ccccc2N2CCCC2)c1	ZINC000875147176	FI	On-Demand	Anodyne	SCN2A	20	48
Cc1cncc([C@@H]2CCCN2C(=O)NCc2ccccc2N2CCCC2)c1	ZINC000875147176	FI	On-Demand	Anodyne	SCN10A	26	48
Cc1cncc([C@H]2CCCN2C(=O)NCc2ccccc2N2CCCC2)c1	ZINC000875147177	FI	On-Demand	Anodyne	AVPR2	24	45
Cc1cncc([C@H]2CCCN2C(=O)NCc2ccccc2N2CCCC2)c1	ZINC000875147177	FI	On-Demand	Anodyne	KCNQ2	67	37
Cc1cncc([C@H]2CCCN2C(=O)NCc2ccccc2N2CCCC2)c1	ZINC000875147177	FI	On-Demand	Anodyne	SCN2A	20	48
Cc1cncc([C@H]2CCCN2C(=O)NCc2ccccc2N2CCCC2)c1	ZINC000875147177	FI	On-Demand	Anodyne	SCN10A	26	48
Cn1nnnc1C1CCN(C(=O)NCc2ccccc2N2CCCC2)CC1	ZINC000875147178	FD	On-Demand	Anodyne	IL2RA	41	36
Cn1nnnc1C1CCN(C(=O)NCc2ccccc2N2CCCC2)CC1	ZINC000875147178	FD	On-Demand	Anodyne	KCNQ2	64	36
Cn1nnnc1C1CCN(C(=O)NCc2ccccc2N2CCCC2)CC1	ZINC000875147178	FD	On-Demand	Anodyne	SCN2A	18	43
Cn1nnnc1C1CCN(C(=O)NCc2ccccc2N2CCCC2)CC1	ZINC000875147178	FD	On-Demand	Anodyne	EPHX2	23	41
Cn1nnnc1C1CCN(C(=O)NCc2ccccc2N2CCCC2)CC1	ZINC000875147178	FD	On-Demand	Anodyne	SCN10A	15	43
COC(=O)N(C)NC(=O)NCCCOc1ccc(OC)cc1	ZINC000875147181	DD	On-Demand	Reactive	HRH2	21	41
COC(=O)N(C)NC(=O)NCCCOc1ccc(OC)cc1	ZINC000875147181	DD	On-Demand	Reactive	SCNN1A	25	42
COC(=O)N(C)NC(=O)NCCCOc1ccc(OC)cc1	ZINC000875147181	DD	On-Demand	Reactive	MTNR1A	78	44
COC(=O)N(C)NC(=O)NCCCOc1ccc(OC)cc1	ZINC000875147181	DD	On-Demand	Reactive	MTNR1B	56	41
COCC(C)(C)CCNC(=O)C(=O)NCCN1c2ccccc2C[C@@H]1C	ZINC000875147189	FD	On-Demand	Anodyne	DRD2	20	41
COCC(C)(C)CCNC(=O)C(=O)NCCN1c2ccccc2C[C@H]1C	ZINC000875147190	FD	On-Demand	Anodyne	DRD2	20	41
CC[C@@H](C)[C@H](C)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875147225	EH	On-Demand	Anodyne	OPRL1	20	47
CC[C@H](C)[C@H](C)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875147226	EH	On-Demand	Anodyne	OPRL1	20	47
CC[C@@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)C(C)C	ZINC000875147236	EG	On-Demand	Mild	ITK	17	52
COC(=O)N1CCC(NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CC1	ZINC000875147239	EC	On-Demand	Anodyne	EPHX2	27	41
C[C@@H](CNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)C1CC1	ZINC000875147241	EG	On-Demand	Anodyne	OPRL1	22	47
CC[C@@H]1COCCN1CCNC(=O)NC1CCN(C(=O)OC)CC1	ZINC000875147249	EC	On-Demand	Anodyne	EPHX2	19	41
CCCCN1CCC(NC(=O)C(=O)N2CCN(c3ccc(C#N)cc3)CC2)CC1	ZINC000875147255	GD	On-Demand	Mild	HTR7	15	41
COC(=O)N1CCC(NC(=O)NNc2cccc(C)n2)CC1	ZINC000875147256	DD	On-Demand	Reactive	CCR8	55	34
CCN(Cc1ccccc1)C(=O)CNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875147283	GD	On-Demand	Anodyne	SIGMAR1	17	42
COC(=O)N1CCC(NC(=O)N[C@H]2CCC[C@H]2N2CC[C@H](OC)C2)CC1	ZINC000875147284	FD	On-Demand	Anodyne	EPHX2	17	40
COC(=O)N1CCC(NC(=O)N[C@H]2CCC[C@H]2N2CC[C@@H](OC)C2)CC1	ZINC000875147285	FD	On-Demand	Anodyne	EPHX2	17	40
COC(=O)N1CCC(NC(=O)N[C@@]23C[C@@H]2COC3(C)C)CC1	ZINC000875147287	DD	On-Demand	Anodyne	EPHX2	19	44
COC(=O)N1CCC(NC(=O)N[C@@]23C[C@H]2COC3(C)C)CC1	ZINC000875147288	DD	On-Demand	Anodyne	EPHX2	19	44
COC(=O)N1CCC(NC(=O)N[C@]23C[C@@H]2COC3(C)C)CC1	ZINC000875147289	DD	On-Demand	Anodyne	EPHX2	19	44
COC(=O)N1CCC(NC(=O)N[C@]23C[C@H]2COC3(C)C)CC1	ZINC000875147290	DD	On-Demand	Anodyne	EPHX2	19	44
COC(=O)N1CCC(NC(=O)NCCN2CC[C@@H](O)C2)CC1	ZINC000875147296	DB	On-Demand	Anodyne	EPHX2	22	43
COC(=O)N1CCC(NC(=O)NCCN2CC[C@H](O)C2)CC1	ZINC000875147297	DB	On-Demand	Anodyne	EPHX2	22	43
COC(=O)N1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(Cl)cc2)CC1	ZINC000875147316	GE	On-Demand	Anodyne	CCR1	27	44
COC(=O)N1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(Cl)cc2)CC1	ZINC000875147316	GE	On-Demand	Anodyne	EPHX2	38	45
COC(=O)N1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(Cl)cc2)CC1	ZINC000875147317	GE	On-Demand	Anodyne	CCR1	27	44
COC(=O)N1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(Cl)cc2)CC1	ZINC000875147317	GE	On-Demand	Anodyne	EPHX2	38	45
COc1ccc(OCCCNC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875147324	EE	On-Demand	Anodyne	HRH2	31	40
COc1ccc(OCCCNC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875147324	EE	On-Demand	Anodyne	SCNN1A	24	40
COc1ccc(OCCCNC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875147324	EE	On-Demand	Anodyne	HRH3	25	40
COc1ccc(OCCCNC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875147324	EE	On-Demand	Anodyne	MMP13	35	43
COc1ccc(OCCCNC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875147324	EE	On-Demand	Anodyne	MMP3	30	43
COc1ccc(OCCCNC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875147324	EE	On-Demand	Anodyne	MMP9	22	43
COc1ccc(OCCCNC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875147324	EE	On-Demand	Anodyne	MMP7	23	43
COc1ccc(OCCCNC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875147324	EE	On-Demand	Anodyne	IKBKE	41	33
COc1ccc(OCCCNC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875147324	EE	On-Demand	Anodyne	MMP1	28	43
COc1ccc(OCCCNC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875147324	EE	On-Demand	Anodyne	MEN1	41	33
COc1ccc(OCCCNC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875147325	EE	On-Demand	Anodyne	HRH2	31	40
COc1ccc(OCCCNC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875147325	EE	On-Demand	Anodyne	SCNN1A	24	40
COc1ccc(OCCCNC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875147325	EE	On-Demand	Anodyne	HRH3	25	40
COc1ccc(OCCCNC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875147325	EE	On-Demand	Anodyne	MMP13	35	43
COc1ccc(OCCCNC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875147325	EE	On-Demand	Anodyne	MMP3	30	43
COc1ccc(OCCCNC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875147325	EE	On-Demand	Anodyne	MMP9	22	43
COc1ccc(OCCCNC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875147325	EE	On-Demand	Anodyne	MMP7	23	43
COc1ccc(OCCCNC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875147325	EE	On-Demand	Anodyne	IKBKE	41	33
COc1ccc(OCCCNC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875147325	EE	On-Demand	Anodyne	MMP1	28	43
COc1ccc(OCCCNC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875147325	EE	On-Demand	Anodyne	MEN1	41	33
CN(C)C(=O)CCCNC(=O)N(C)C[C@H]1CCCCN1Cc1ccccc1	ZINC000875147327	FF	On-Demand	Anodyne	SIGMAR1	19	46
O=C1CCN(C(=O)NCC(=O)N2CCCc3ccccc32)CCCCCCN1	ZINC000875147340	GE	On-Demand	Anodyne	AVPR2	38	45
O=C(NCc1ccc2oc(O)nc2c1)NCc1ccccc1N1CCCC1	ZINC000875147343	FG	On-Demand	Anodyne	KCNQ2	65	37
O=C(NCc1ccc2oc(O)nc2c1)NCc1ccccc1N1CCCC1	ZINC000875147343	FG	On-Demand	Anodyne	SCN2A	18	41
O=C(NCc1ccc2oc(O)nc2c1)NCc1ccccc1N1CCCC1	ZINC000875147343	FG	On-Demand	Anodyne	SCN10A	15	41
O=C(NCc1ccccc1N1CCCC1)N1CCC2(CCNC2=O)CC1	ZINC000875147344	FE	On-Demand	Anodyne	KCNQ2	64	38
CCOC1CC2(C1)C[C@@H]2NC(=O)NCc1ccccc1N1CCCC1	ZINC000875147365	EG	On-Demand	Anodyne	KCNQ2	72	38
CCOC1CC2(C1)C[C@@H]2NC(=O)NCc1ccccc1N1CCCC1	ZINC000875147365	EG	On-Demand	Anodyne	TIMP3	59	32
CCOC1CC2(C1)C[C@H]2NC(=O)NCc1ccccc1N1CCCC1	ZINC000875147366	EG	On-Demand	Anodyne	KCNQ2	72	38
CCOC1CC2(C1)C[C@H]2NC(=O)NCc1ccccc1N1CCCC1	ZINC000875147366	EG	On-Demand	Anodyne	TIMP3	59	32
COc1ccccc1[C@H]1CCCN(C(=O)NCCCC(=O)N(C)C)CC1	ZINC000875147385	FF	On-Demand	Anodyne	DRD2	25	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCC(=O)N(C)C)CC1	ZINC000875147386	FF	On-Demand	Anodyne	DRD2	25	43
COc1ccc(OCCCNC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875147420	FD	On-Demand	Anodyne	HRH2	22	40
COc1ccc(OCCCNC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875147420	FD	On-Demand	Anodyne	MMP13	26	41
COc1ccc(OCCCNC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875147420	FD	On-Demand	Anodyne	MMP9	20	41
COc1ccc(OCCCNC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875147420	FD	On-Demand	Anodyne	MMP7	17	40
COc1ccc(OCCCNC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875147420	FD	On-Demand	Anodyne	MMP1	18	40
CCN(Cc1ccccc1)C(=O)CNC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875147431	FE	On-Demand	Anodyne	AMY2	45	32
CCN(Cc1ccccc1)C(=O)CNC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875147432	FE	On-Demand	Anodyne	AMY2	45	32
COC(=O)N1CCC(NC(=O)NNc2cccc(F)c2Cl)CC1	ZINC000875147446	EE	On-Demand	Reactive	EPHX2	44	40
COC(=O)N1CCC(NC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875147447	GF	On-Demand	Mild	LGMN	50	33
COC(=O)N1CCC(NC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875147447	GF	On-Demand	Mild	EPHX2	37	41
COC(=O)N1CCC(NC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875147447	GF	On-Demand	Mild	MCHR1	26	42
COC(=O)N1CCC(NC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875147448	GF	On-Demand	Mild	LGMN	50	33
COC(=O)N1CCC(NC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875147448	GF	On-Demand	Mild	EPHX2	37	41
COC(=O)N1CCC(NC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875147448	GF	On-Demand	Mild	MCHR1	26	42
COC(=O)N1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875147458	EE	On-Demand	Anodyne	GRIN2B	23	40
COC(=O)N1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875147458	EE	On-Demand	Anodyne	SIGMAR1	18	42
COC(=O)N1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875147458	EE	On-Demand	Anodyne	EPHX2	70	46
COC(=O)N1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875147458	EE	On-Demand	Anodyne	CCR8	51	37
CCN(Cc1ccccc1)C(=O)CNC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875147476	FD	On-Demand	Anodyne	SLC6A4	20	42
CCN(Cc1ccccc1)C(=O)CNC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875147476	FD	On-Demand	Anodyne	OPRD1	23	40
CCN(Cc1ccccc1)C(=O)CNC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875147476	FD	On-Demand	Anodyne	SLC6A3	43	42
CCN(Cc1ccccc1)C(=O)CNC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875147477	FD	On-Demand	Anodyne	SLC6A4	20	42
CCN(Cc1ccccc1)C(=O)CNC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875147477	FD	On-Demand	Anodyne	OPRD1	23	40
CCN(Cc1ccccc1)C(=O)CNC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875147477	FD	On-Demand	Anodyne	SLC6A3	43	42
CCCCN1CCC(NC(=O)C(=O)NCc2ccc(C(C)(C)C)o2)CC1	ZINC000875147482	FF	On-Demand	Anodyne	HTR4	44	39
COC(=O)N1CCC(NC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875147497	GF	On-Demand	Anodyne	WNT3	41	32
COC(=O)N1CCC(NC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875147498	GF	On-Demand	Anodyne	WNT3	41	32
COC(=O)N1CCC(NC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875147499	GF	On-Demand	Anodyne	WNT3	41	32
COC(=O)N1CCC(NC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875147500	GF	On-Demand	Anodyne	WNT3	41	32
COC(=O)N1CCC(NC(=O)N[C@@](C)(CO)Cc2ccccc2F)CC1	ZINC000875147501	FD	On-Demand	Anodyne	GRIN2B	15	41
COC(=O)N1CCC(NC(=O)N[C@@](C)(CO)Cc2ccccc2F)CC1	ZINC000875147501	FD	On-Demand	Anodyne	EPHX2	41	37
COC(=O)N1CCC(NC(=O)N[C@](C)(CO)Cc2ccccc2F)CC1	ZINC000875147502	FD	On-Demand	Anodyne	GRIN2B	15	41
COC(=O)N1CCC(NC(=O)N[C@](C)(CO)Cc2ccccc2F)CC1	ZINC000875147502	FD	On-Demand	Anodyne	EPHX2	41	37
CC[C@@H](NC(=O)NNc1cccc(C)n1)C(C)C	ZINC000875147503	CE	On-Demand	Reactive	GRM5	16	40
COC(=O)N1CCC(NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)CC1	ZINC000875147513	FD	On-Demand	Anodyne	SIGMAR1	16	40
COC(=O)N1CCC(NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)CC1	ZINC000875147513	FD	On-Demand	Anodyne	EPHX2	39	46
COC(=O)N1CCC(NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)CC1	ZINC000875147513	FD	On-Demand	Anodyne	CCR8	46	35
COC(=O)N1CCC(NC(=O)N2CCC[C@](O)(c3ccccc3)C2)CC1	ZINC000875147514	FD	On-Demand	Anodyne	SIGMAR1	16	40
COC(=O)N1CCC(NC(=O)N2CCC[C@](O)(c3ccccc3)C2)CC1	ZINC000875147514	FD	On-Demand	Anodyne	EPHX2	39	46
COC(=O)N1CCC(NC(=O)N2CCC[C@](O)(c3ccccc3)C2)CC1	ZINC000875147514	FD	On-Demand	Anodyne	CCR8	46	35
CCN(Cc1ccccc1)C(=O)CNC(=O)N1CCCN(C=O)CC1	ZINC000875147521	EC	On-Demand	Anodyne	OPRD1	16	43
COCC(C)(C)CCNC(=O)NCc1ccccc1N1CCCC1	ZINC000875147523	EG	On-Demand	Anodyne	AVPR2	19	41
COCC(C)(C)CCNC(=O)NCc1ccccc1N1CCCC1	ZINC000875147523	EG	On-Demand	Anodyne	KCNQ2	73	41
COCC(C)(C)CCNC(=O)NCc1ccccc1N1CCCC1	ZINC000875147523	EG	On-Demand	Anodyne	SCN2A	17	42
CC[C@@H]1COCCN1CCNC(=O)NCc1ccccc1N1CCCC1	ZINC000875147530	FE	On-Demand	Anodyne	KCNQ2	65	35
Cc1nnc(NNC(=O)NC[C@H]2CCN(c3ccc(F)cc3)C2)n1C	ZINC000875147532	ED	On-Demand	Reactive	CCR3	45	38
Cc1nnc(NNC(=O)NC[C@@H]2CCN(c3ccc(F)cc3)C2)n1C	ZINC000875147533	ED	On-Demand	Reactive	CCR3	45	38
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCc1ccccc1N1CCCC1)CC2	ZINC000875147534	GH	On-Demand	Anodyne	AVPR2	40	39
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCc1ccccc1N1CCCC1)CC2	ZINC000875147534	GH	On-Demand	Anodyne	KCNQ2	73	38
COc1ccc(OCCCNC(=O)N2CCO[C@H](C(F)(F)F)CC2)cc1	ZINC000875147553	GF	On-Demand	Anodyne	NQO2	16	40
COc1ccc(OCCCNC(=O)N2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000875147554	GF	On-Demand	Anodyne	NQO2	16	40
O=C(NCc1ccccc1N1CCCC1)N1CCC(CO)(CO)CC1	ZINC000875147556	ED	On-Demand	Anodyne	KCNQ2	76	43
O=C(NCc1ccccc1N1CCCC1)N1CCC(CO)(CO)CC1	ZINC000875147556	ED	On-Demand	Anodyne	SCN2A	18	43
O=C(NCc1ccccc1N1CCCC1)N1CCC(CO)(CO)CC1	ZINC000875147556	ED	On-Demand	Anodyne	EPHX2	19	44
O=C(NCc1ccccc1N1CCCC1)N1CCC(CO)(CO)CC1	ZINC000875147556	ED	On-Demand	Anodyne	SCN10A	15	43
CN(C)C(=O)CCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875147569	ED	On-Demand	Anodyne	TRY1_BOVIN	43	35
CN(C)C(=O)CCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875147570	ED	On-Demand	Anodyne	TRY1_BOVIN	43	35
CN(C)C(=O)CCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875147571	ED	On-Demand	Anodyne	TRY1_BOVIN	43	35
CN(C)C(=O)CCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875147572	ED	On-Demand	Anodyne	TRY1_BOVIN	43	35
O=C(NCc1ccccc1N1CCCC1)NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000875147580	GE	On-Demand	Anodyne	KCNQ2	67	40
O=C(NCc1ccccc1N1CCCC1)NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000875147580	GE	On-Demand	Anodyne	SCN2A	17	40
COC(=O)C1(O)CN(C(=O)NCCCOc2ccc(OC)cc2)C1	ZINC000875147581	EC	On-Demand	Anodyne	SCNN1A	21	40
COC(=O)C1(O)CN(C(=O)NCCCOc2ccc(OC)cc2)C1	ZINC000875147581	EC	On-Demand	Anodyne	MMP13	15	40
COC(=O)C1(O)CN(C(=O)NCCCOc2ccc(OC)cc2)C1	ZINC000875147581	EC	On-Demand	Anodyne	MTNR1A	43	38
O=C(NCc1ccccc1N1CCCC1)NC[C@@H]1C[C@H]2CCC[C@@H]2O1	ZINC000875147582	EG	On-Demand	Anodyne	KCNQ2	59	37
O=C(NCc1ccccc1N1CCCC1)NC[C@@H]1C[C@H]2CCC[C@H]2O1	ZINC000875147583	EG	On-Demand	Anodyne	KCNQ2	59	37
O=C(NCc1ccccc1N1CCCC1)NC[C@@H]1C[C@@H]2CCC[C@@H]2O1	ZINC000875147584	EG	On-Demand	Anodyne	KCNQ2	59	37
O=C(NCc1ccccc1N1CCCC1)NC[C@@H]1C[C@@H]2CCC[C@H]2O1	ZINC000875147585	EG	On-Demand	Anodyne	KCNQ2	59	37
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCOc2ccc(OC)cc2)C1	ZINC000875147591	FE	On-Demand	Anodyne	MMP3	34	43
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCOc2ccc(OC)cc2)C1	ZINC000875147591	FE	On-Demand	Anodyne	MMP9	19	43
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCOc2ccc(OC)cc2)C1	ZINC000875147591	FE	On-Demand	Anodyne	MMP7	25	43
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCOc2ccc(OC)cc2)C1	ZINC000875147591	FE	On-Demand	Anodyne	MMP1	23	43
O=C(NCCC[C@H]1CCOC1=O)NCc1ccccc1N1CCCC1	ZINC000875147592	EE	On-Demand	Anodyne	KCNQ2	59	37
O=C(NCCC[C@H]1CCOC1=O)NCc1ccccc1N1CCCC1	ZINC000875147592	EE	On-Demand	Anodyne	SCN2A	17	40
O=C(NCCC[C@@H]1CCOC1=O)NCc1ccccc1N1CCCC1	ZINC000875147593	EE	On-Demand	Anodyne	KCNQ2	59	37
O=C(NCCC[C@@H]1CCOC1=O)NCc1ccccc1N1CCCC1	ZINC000875147593	EE	On-Demand	Anodyne	SCN2A	17	40
Cc1nccnc1[C@H](C)NC(=O)NCc1ccccc1N1CCCC1	ZINC000875147594	EF	On-Demand	Anodyne	ANPEP	15	41
Cc1nccnc1[C@H](C)NC(=O)NCc1ccccc1N1CCCC1	ZINC000875147594	EF	On-Demand	Anodyne	KCNQ2	71	38
Cc1nccnc1[C@H](C)NC(=O)NCc1ccccc1N1CCCC1	ZINC000875147594	EF	On-Demand	Anodyne	SCN2A	19	43
Cc1nccnc1[C@H](C)NC(=O)NCc1ccccc1N1CCCC1	ZINC000875147594	EF	On-Demand	Anodyne	SCN10A	19	43
Cc1nccnc1[C@@H](C)NC(=O)NCc1ccccc1N1CCCC1	ZINC000875147595	EF	On-Demand	Anodyne	ANPEP	15	41
Cc1nccnc1[C@@H](C)NC(=O)NCc1ccccc1N1CCCC1	ZINC000875147595	EF	On-Demand	Anodyne	KCNQ2	71	38
Cc1nccnc1[C@@H](C)NC(=O)NCc1ccccc1N1CCCC1	ZINC000875147595	EF	On-Demand	Anodyne	SCN2A	19	43
Cc1nccnc1[C@@H](C)NC(=O)NCc1ccccc1N1CCCC1	ZINC000875147595	EF	On-Demand	Anodyne	SCN10A	19	43
COC(=O)N(C)NC(=O)NCC(=O)N1CCCc2ccccc21	ZINC000875147606	DC	On-Demand	Reactive	AVPR2	45	46
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875147614	FF	On-Demand	Anodyne	ACE	34	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875147614	FF	On-Demand	Anodyne	KCNQ2	75	41
CC[C@H](C[C@H](C)O)NC(=O)NCC1(c2ccc(OC)cc2)CCOCC1	ZINC000875147617	FF	On-Demand	Anodyne	SOAT1	16	40
COc1ccc(OCCCNC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875147621	ED	On-Demand	Anodyne	HRH2	26	41
COc1ccc(OCCCNC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875147621	ED	On-Demand	Anodyne	MMP13	18	41
COc1ccc(OCCCNC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875147621	ED	On-Demand	Anodyne	MMP9	15	41
COc1ccc(OCCCNC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875147621	ED	On-Demand	Anodyne	MMP7	16	41
COc1ccc(OCCCNC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875147621	ED	On-Demand	Anodyne	MMP1	16	41
CCCCN1CCC(NC(=O)C(=O)N(Cc2ccccc2)[C@H](CC)CO)CC1	ZINC000875147625	GE	On-Demand	Anodyne	CHRM1	16	42
CCCCN1CCC(NC(=O)C(=O)N(Cc2ccccc2)[C@H](CC)CO)CC1	ZINC000875147625	GE	On-Demand	Anodyne	DRD4	20	43
CCCCN1CCC(NC(=O)C(=O)N(Cc2ccccc2)[C@H](CC)CO)CC1	ZINC000875147625	GE	On-Demand	Anodyne	HTR4	41	36
CCCCN1CCC(NC(=O)C(=O)N(Cc2ccccc2)[C@H](CC)CO)CC1	ZINC000875147625	GE	On-Demand	Anodyne	CHRM3	15	40
CCCCN1CCC(NC(=O)C(=O)N(Cc2ccccc2)[C@H](CC)CO)CC1	ZINC000875147625	GE	On-Demand	Anodyne	SIGMAR1	29	46
CCCCN1CCC(NC(=O)C(=O)N(Cc2ccccc2)[C@H](CC)CO)CC1	ZINC000875147625	GE	On-Demand	Anodyne	CYP2J2	40	35
COC(=O)N1CCC(NC(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)CC1	ZINC000875147648	EE	On-Demand	Anodyne	EPHX2	36	40
O=C(N[C@@H](c1ccc(Cl)cc1)c1ccsc1)N1CCC(CO)(CO)CC1	ZINC000875147669	GG	On-Demand	Anodyne	CACNA1H	41	34
O=C(N[C@H](c1ccc(Cl)cc1)c1ccsc1)N1CCC(CO)(CO)CC1	ZINC000875147670	GG	On-Demand	Anodyne	CACNA1H	41	34
CCOC(=O)[C@H](C)C1CN(C(=O)NCCC(C)(C)c2ccccc2)C1	ZINC000875147672	EG	On-Demand	Anodyne	AMY2	56	33
CC[C@@H](C)[C@H](C)NC(=O)NNc1cccc(C)n1	ZINC000875147676	CE	On-Demand	Reactive	GRM5	19	40
CC[C@H](C)[C@H](C)NC(=O)NNc1cccc(C)n1	ZINC000875147678	CE	On-Demand	Reactive	GRM5	19	40
COC(=O)N1CCC(NC(=O)NC2(C)COC2)CC1	ZINC000875147679	CC	On-Demand	Anodyne	EPHX2	35	48
Cc1csc([C@H]2CCN(C(=O)N[C@H](CC(=O)N(C)C)c3ccccc3)C2)n1	ZINC000875147700	GG	On-Demand	Anodyne	CCR5	30	42
CC[C@@](C)(NC(=O)NC1CCN(C(=O)OC)CC1)c1ccc(F)cc1	ZINC000875147706	FF	On-Demand	Anodyne	EPHX2	49	47
CC[C@@](C)(NC(=O)NC1CCN(C(=O)OC)CC1)c1ccc(F)cc1	ZINC000875147706	FF	On-Demand	Anodyne	CCR8	45	38
COC(=O)N1CCC(NC(=O)NC2CN(c3ccncn3)C2)CC1	ZINC000875147716	EC	On-Demand	Anodyne	GRIN2B	19	44
COC(=O)N1CCC(NC(=O)NC2CN(c3ccncn3)C2)CC1	ZINC000875147716	EC	On-Demand	Anodyne	EPHX2	34	41
CC(=O)C1CCN(C(=O)NCc2ccccc2N2CCCC2)CC1	ZINC000875147734	EF	On-Demand	Anodyne	MC4R	23	41
CC(=O)C1CCN(C(=O)NCc2ccccc2N2CCCC2)CC1	ZINC000875147734	EF	On-Demand	Anodyne	KCNQ2	77	43
CC(=O)C1CCN(C(=O)NCc2ccccc2N2CCCC2)CC1	ZINC000875147734	EF	On-Demand	Anodyne	SCN2A	19	45
CC(=O)C1CCN(C(=O)NCc2ccccc2N2CCCC2)CC1	ZINC000875147734	EF	On-Demand	Anodyne	EPHX2	37	47
CC(=O)C1CCN(C(=O)NCc2ccccc2N2CCCC2)CC1	ZINC000875147734	EF	On-Demand	Anodyne	SCN10A	19	45
O=C(NCC(=O)N1CCCc2ccccc21)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875147737	GD	On-Demand	Anodyne	AVPR2	34	42
O=C(NCC(=O)N1CCCc2ccccc21)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875147738	GD	On-Demand	Anodyne	AVPR2	34	42
O=C(NCc1ccccc1N1CCCC1)NNC(=O)c1nc2ccccc2s1	ZINC000875147742	GG	On-Demand	Reactive	KCNQ2	63	37
O=C(NCc1ccccc1N1CCCC1)NNC(=O)c1nc2ccccc2s1	ZINC000875147742	GG	On-Demand	Reactive	SCN2A	19	44
O=C(NCc1ccccc1N1CCCC1)NNC(=O)c1nc2ccccc2s1	ZINC000875147742	GG	On-Demand	Reactive	SCN10A	19	44
O=C(NCc1ccccc1N1CCCC1)NNC(=O)c1nc2ccccc2s1	ZINC000875147742	GG	On-Demand	Reactive	ST14	49	35
O=C(NCc1ccccc1N1CCCC1)NNC(=O)c1nc2ccccc2s1	ZINC000875147742	GG	On-Demand	Reactive	TMPRSS6	77	35
O=C(NCc1ccccc1N1CCCC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875147761	FG	On-Demand	Anodyne	KCNQ2	67	39
O=C(NCc1ccccc1N1CCCC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875147761	FG	On-Demand	Anodyne	SCN2A	17	40
COC(=O)[C@@]12C[C@@H](NC(=O)NCC(=O)N3CCCc4ccccc43)C[C@@H]1C2	ZINC000875147763	FD	On-Demand	Anodyne	AVPR2	36	43
O=C(NCc1ccccc1N1CCCC1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875147766	GD	On-Demand	Anodyne	KCNQ2	70	40
O=C(NCc1ccccc1N1CCCC1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875147766	GD	On-Demand	Anodyne	SCN2A	18	42
O=C(NCc1ccccc1N1CCCC1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875147766	GD	On-Demand	Anodyne	EPHX2	17	40
O=C(NCc1ccccc1N1CCCC1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875147766	GD	On-Demand	Anodyne	SCN10A	15	42
O=C(NCc1ccccc1N1CCCC1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875147767	GD	On-Demand	Anodyne	KCNQ2	70	40
O=C(NCc1ccccc1N1CCCC1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875147767	GD	On-Demand	Anodyne	SCN2A	18	42
O=C(NCc1ccccc1N1CCCC1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875147767	GD	On-Demand	Anodyne	EPHX2	17	40
O=C(NCc1ccccc1N1CCCC1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875147767	GD	On-Demand	Anodyne	SCN10A	15	42
O=C(NCc1ccccc1N1CCCC1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875147768	GD	On-Demand	Anodyne	KCNQ2	70	40
O=C(NCc1ccccc1N1CCCC1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875147768	GD	On-Demand	Anodyne	SCN2A	18	42
O=C(NCc1ccccc1N1CCCC1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875147768	GD	On-Demand	Anodyne	EPHX2	17	40
O=C(NCc1ccccc1N1CCCC1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875147768	GD	On-Demand	Anodyne	SCN10A	15	42
O=C(NCc1ccccc1N1CCCC1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875147769	GD	On-Demand	Anodyne	KCNQ2	70	40
O=C(NCc1ccccc1N1CCCC1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875147769	GD	On-Demand	Anodyne	SCN2A	18	42
O=C(NCc1ccccc1N1CCCC1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875147769	GD	On-Demand	Anodyne	EPHX2	17	40
O=C(NCc1ccccc1N1CCCC1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875147769	GD	On-Demand	Anodyne	SCN10A	15	42
O=C(NCC(=O)N1CCCc2ccccc21)NC[C@H]1C[C@H](O)C1	ZINC000875147780	DD	On-Demand	Anodyne	AVPR2	42	47
O=C(NCc1ncc(Cl)s1)NCc1ccccc1N1CCCC1	ZINC000875147781	FG	On-Demand	Anodyne	KCNQ2	71	45
O=C(NCc1ncc(Cl)s1)NCc1ccccc1N1CCCC1	ZINC000875147781	FG	On-Demand	Anodyne	SCN2A	22	50
O=C(NCc1ncc(Cl)s1)NCc1ccccc1N1CCCC1	ZINC000875147781	FG	On-Demand	Anodyne	SCN10A	26	50
CCCCN1CCC(NC(=O)C(=O)NCc2ccc(Br)cn2)CC1	ZINC000875147825	GD	On-Demand	Anodyne	HTR4	39	40
CCC[C@H](CCO)NC(=O)NC1CCN(C(=O)OC)CC1	ZINC000875147826	DD	On-Demand	Anodyne	EPHX2	25	41
CCC[C@@H](CCO)NC(=O)NC1CCN(C(=O)OC)CC1	ZINC000875147827	DD	On-Demand	Anodyne	EPHX2	25	41
CC[C@H](C)[C@H](C)NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875147832	EG	On-Demand	Mild	ITK	18	52
CC[C@H](C)[C@H](C)NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875147832	EG	On-Demand	Mild	CTRB_BOVIN	43	30
CC[C@H](C)[C@H](C)NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875147832	EG	On-Demand	Mild	PANC	41	35
CC[C@@H](C)[C@H](C)NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875147833	EG	On-Demand	Mild	ITK	18	52
CC[C@@H](C)[C@H](C)NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875147833	EG	On-Demand	Mild	CTRB_BOVIN	43	30
CC[C@@H](C)[C@H](C)NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875147833	EG	On-Demand	Mild	PANC	41	35
CCN(Cc1ccccc1)C(=O)CNC(=O)N1CCC(CO)(CO)CC1	ZINC000875147864	FC	On-Demand	Anodyne	GHRHR	47	31
O=CN1CCCN(C(=O)N[C@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000875147867	EF	On-Demand	Anodyne	EPHX2	26	48
O=CN1CCCN(C(=O)N[C@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000875147867	EF	On-Demand	Anodyne	SMO	19	43
O=CN1CCCN(C(=O)N[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000875147868	EF	On-Demand	Anodyne	EPHX2	26	48
O=CN1CCCN(C(=O)N[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000875147868	EF	On-Demand	Anodyne	SMO	19	43
O=CN1CCCN(C(=O)N[C@H]2CCCC[C@H]2c2ccccc2)CC1	ZINC000875147869	EF	On-Demand	Anodyne	EPHX2	26	48
O=CN1CCCN(C(=O)N[C@H]2CCCC[C@H]2c2ccccc2)CC1	ZINC000875147869	EF	On-Demand	Anodyne	SMO	19	43
O=CN1CCCN(C(=O)N[C@@H]2CCCC[C@H]2c2ccccc2)CC1	ZINC000875147870	EF	On-Demand	Anodyne	EPHX2	26	48
O=CN1CCCN(C(=O)N[C@@H]2CCCC[C@H]2c2ccccc2)CC1	ZINC000875147870	EF	On-Demand	Anodyne	SMO	19	43
CCCCN1CCC(NC(=O)C(=O)NC2CCC(C)(N(C)C)CC2)CC1	ZINC000875147888	FD	On-Demand	Anodyne	HTR4	44	42
CCCCN1CCC(NC(=O)C(=O)NCc2cccc3ncccc23)CC1	ZINC000875147895	FE	On-Demand	Anodyne	HTR1A	52	40
CCCCN1CCC(NC(=O)C(=O)NCc2cccc3ncccc23)CC1	ZINC000875147895	FE	On-Demand	Anodyne	DRD2	39	41
CCCCN1CCC(NC(=O)C(=O)NCc2cccc3ncccc23)CC1	ZINC000875147895	FE	On-Demand	Anodyne	ADRA1D	17	40
CCCCN1CCC(NC(=O)C(=O)NCc2cccc3ncccc23)CC1	ZINC000875147895	FE	On-Demand	Anodyne	HTR1D	42	34
CCCCN1CCC(NC(=O)C(=O)NCc2cccc3ncccc23)CC1	ZINC000875147895	FE	On-Demand	Anodyne	HTR2A	31	40
CCCCN1CCC(NC(=O)C(=O)NCc2cccc3ncccc23)CC1	ZINC000875147895	FE	On-Demand	Anodyne	ADRA1A	22	40
CCCCN1CCC(NC(=O)C(=O)NCc2cccc3ncccc23)CC1	ZINC000875147895	FE	On-Demand	Anodyne	DRD3	35	41
CCCCN1CCC(NC(=O)C(=O)NCc2cccc3ncccc23)CC1	ZINC000875147895	FE	On-Demand	Anodyne	HTR4	59	39
CCCCN1CCC(NC(=O)C(=O)NCc2cccc3ncccc23)CC1	ZINC000875147895	FE	On-Demand	Anodyne	HRP1_PLAFA	43	36
CCCCN1CCC(NC(=O)C(=O)NCc2cccc3ncccc23)CC1	ZINC000875147895	FE	On-Demand	Anodyne	HTR7	56	36
CCCCN1CCC(NC(=O)C(=O)NCc2cccc3ncccc23)CC1	ZINC000875147895	FE	On-Demand	Anodyne	HNMT	57	36
O=C(NCc1ccccc1N1CCCC1)N[C@H]1CC12CCC2	ZINC000875147939	CG	On-Demand	Anodyne	KCNQ2	73	42
O=C(NCc1ccccc1N1CCCC1)N[C@H]1CC12CCC2	ZINC000875147939	CG	On-Demand	Anodyne	SCN2A	18	42
O=C(NCc1ccccc1N1CCCC1)N[C@@H]1CC12CCC2	ZINC000875147940	CG	On-Demand	Anodyne	KCNQ2	73	42
O=C(NCc1ccccc1N1CCCC1)N[C@@H]1CC12CCC2	ZINC000875147940	CG	On-Demand	Anodyne	SCN2A	18	42
CCn1ncc(CNC(=O)N[C@@H](CC(=O)N(C)C)c2ccccc2)n1	ZINC000875147948	ED	On-Demand	Anodyne	TACR3	46	39
CCn1ncc(CNC(=O)N[C@H](CC(=O)N(C)C)c2ccccc2)n1	ZINC000875147949	ED	On-Demand	Anodyne	TACR3	46	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1N1CCCC1	ZINC000875147950	FF	On-Demand	Anodyne	SLC6A4	24	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1N1CCCC1	ZINC000875147950	FF	On-Demand	Anodyne	SLC6A3	49	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1N1CCCC1	ZINC000875147950	FF	On-Demand	Anodyne	KCNQ2	66	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1N1CCCC1	ZINC000875147951	FF	On-Demand	Anodyne	SLC6A4	24	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1N1CCCC1	ZINC000875147951	FF	On-Demand	Anodyne	SLC6A3	49	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1N1CCCC1	ZINC000875147951	FF	On-Demand	Anodyne	KCNQ2	66	37
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H](CC(=O)N(C)C)c2ccccc2)cc1	ZINC000875147963	GF	On-Demand	Anodyne	ANPEP	15	42
CC(=O)N(C)c1ccc(CNC(=O)N[C@H](CC(=O)N(C)C)c2ccccc2)cc1	ZINC000875147964	GF	On-Demand	Anodyne	ANPEP	15	42
C[C@@H]1CN(C(=O)NCc2ccccc2N2CCCC2)CC[C@@H](C(F)(F)F)O1	ZINC000875147982	GH	On-Demand	Anodyne	KCNQ2	66	36
C[C@@H]1CN(C(=O)NCc2ccccc2N2CCCC2)CC[C@@H](C(F)(F)F)O1	ZINC000875147982	GH	On-Demand	Anodyne	EPHX2	18	43
C[C@@H]1CN(C(=O)NCc2ccccc2N2CCCC2)CC[C@H](C(F)(F)F)O1	ZINC000875147983	GH	On-Demand	Anodyne	KCNQ2	66	36
C[C@@H]1CN(C(=O)NCc2ccccc2N2CCCC2)CC[C@H](C(F)(F)F)O1	ZINC000875147983	GH	On-Demand	Anodyne	EPHX2	18	43
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCC(=O)N(C)C)C[C@@H]1C2	ZINC000875147991	DC	On-Demand	Anodyne	EPHX2	18	42
COc1ccc(OCCCNC(=O)NC2(C)CC(F)(F)C2)cc1	ZINC000875147999	EF	On-Demand	Anodyne	HRH2	23	41
COc1ccc(OCCCNC(=O)NC2(C)CC(F)(F)C2)cc1	ZINC000875147999	EF	On-Demand	Anodyne	SCNN1A	19	40
COc1ccc(OCCCNC(=O)NC2(C)CC(F)(F)C2)cc1	ZINC000875147999	EF	On-Demand	Anodyne	EPHX2	20	46
O=C(NCC(=O)N1CCCc2ccccc21)N1Cc2cccc(O)c2C1	ZINC000875148004	FE	On-Demand	Clean	AVPR2	44	44
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCOc3ccc(OC)cc3)C[C@@H]1C2	ZINC000875148007	FE	On-Demand	Anodyne	HRH2	20	40
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCOc3ccc(OC)cc3)C[C@@H]1C2	ZINC000875148007	FE	On-Demand	Anodyne	EPHX2	27	43
CC[C@@H](NC(=O)N1CCC[C@@](O)(c2ccccc2)C1)C(C)C	ZINC000875148028	DG	On-Demand	Anodyne	OPRL1	15	40
CC[C@@H](NC(=O)N1CCC[C@](O)(c2ccccc2)C1)C(C)C	ZINC000875148030	DG	On-Demand	Anodyne	OPRL1	15	40
CCCCN1CCC(NC(=O)C(=O)NCc2ncc(Cl)s2)CC1	ZINC000875148041	FD	On-Demand	Anodyne	HTR4	46	41
CCCCN1CCC(NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875148044	EC	On-Demand	Anodyne	CYP2J2	40	34
CCCCN1CCC(NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875148045	EC	On-Demand	Anodyne	CYP2J2	40	34
COC(=O)N1CCC(NC(=O)NC2(C)CCC(C)(C)CC2)CC1	ZINC000875148052	EF	On-Demand	Anodyne	EPHX2	34	55
COC(=O)N1CCC(NC(=O)N2CCC[C@H](c3ccccc3OC)CC2)CC1	ZINC000875148063	GG	On-Demand	Anodyne	EPHX2	35	42
COC(=O)N1CCC(NC(=O)N2CCC[C@H](c3ccccc3OC)CC2)CC1	ZINC000875148063	GG	On-Demand	Anodyne	RBP4	46	44
COC(=O)N1CCC(NC(=O)N2CCC[C@@H](c3ccccc3OC)CC2)CC1	ZINC000875148064	GG	On-Demand	Anodyne	EPHX2	35	42
COC(=O)N1CCC(NC(=O)N2CCC[C@@H](c3ccccc3OC)CC2)CC1	ZINC000875148064	GG	On-Demand	Anodyne	RBP4	46	44
CC[C@@H](C)[C@H](C)NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875148065	CF	On-Demand	Anodyne	CACNA1H	21	40
CC[C@H](C)[C@H](C)NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875148066	CF	On-Demand	Anodyne	CACNA1H	21	40
CCCCN1CCC(NC(=O)C(=O)NCCCCC2CC2)CC1	ZINC000875148069	DE	On-Demand	Anodyne	DRD3	28	40
CCCCN1CCC(NC(=O)C(=O)NCCCCC2CC2)CC1	ZINC000875148069	DE	On-Demand	Anodyne	HTR4	41	39
CCN(Cc1ccccc1)C(=O)CNC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875148076	GG	On-Demand	Anodyne	EPHX2	21	40
CCN(Cc1ccccc1)C(=O)CNC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875148077	GG	On-Demand	Anodyne	EPHX2	21	40
COC(=O)N1CCC(NC(=O)NCC[C@@H](O)C(F)F)CC1	ZINC000875148078	DC	On-Demand	Anodyne	EPHX2	26	43
COC(=O)N1CCC(NC(=O)NCC[C@H](O)C(F)F)CC1	ZINC000875148079	DC	On-Demand	Anodyne	EPHX2	26	43
COC(=O)N1CCC(NC(=O)NC2(C)CC(F)(F)C2)CC1	ZINC000875148096	DD	On-Demand	Anodyne	EPHX2	34	45
CC[C@H](C)[C@H](C)NC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875148103	DG	On-Demand	Anodyne	OPRL1	16	40
CC[C@H](C)[C@H](C)NC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875148104	DG	On-Demand	Anodyne	OPRL1	16	40
CCCCN1CCC(NC(=O)C(=O)NCc2cnn(CC)n2)CC1	ZINC000875148119	EC	On-Demand	Anodyne	HTR4	43	37
COC(=O)N1CCC(NC(=O)NCCN(C)CC(F)F)CC1	ZINC000875148120	DC	On-Demand	Anodyne	EPHX2	23	42
O=C(NCc1ccccc1N1CCCC1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875148125	GE	On-Demand	Anodyne	KCNQ2	68	38
COc1ccc(OCCCNC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)cc1	ZINC000875148129	GD	On-Demand	Anodyne	MMP13	23	41
COc1ccc(OCCCNC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)cc1	ZINC000875148129	GD	On-Demand	Anodyne	MMP3	22	41
COc1ccc(OCCCNC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)cc1	ZINC000875148129	GD	On-Demand	Anodyne	MMP9	17	41
COc1ccc(OCCCNC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)cc1	ZINC000875148129	GD	On-Demand	Anodyne	MMP7	16	41
COc1ccc(OCCCNC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)cc1	ZINC000875148129	GD	On-Demand	Anodyne	MMP1	18	41
CN(C)C(=O)CCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875148141	FF	On-Demand	Reactive	ALOX5	16	49
CN(C)C(=O)CCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875148141	FF	On-Demand	Reactive	MAOB	20	43
CN(C)C(=O)CCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875148141	FF	On-Demand	Reactive	LTA4H	47	46
CN(C)C(=O)CCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875148141	FF	On-Demand	Reactive	SCN2A	17	43
CN(C)C(=O)CCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875148141	FF	On-Demand	Reactive	FFAR1	37	42
C[C@]1(NC(=O)C(F)(F)F)CCN(C(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875148148	GF	On-Demand	Anodyne	KCNQ2	64	36
C[C@]1(NC(=O)C(F)(F)F)CCN(C(=O)NCc2ccccc2N2CCCC2)C1	ZINC000875148148	GF	On-Demand	Anodyne	SCN2A	17	41
O=C(NCC[C@H](O)C1CCCC1)NCc1ccccc1N1CCCC1	ZINC000875148154	EG	On-Demand	Anodyne	KCNQ2	74	40
O=C(NCC[C@H](O)C1CCCC1)NCc1ccccc1N1CCCC1	ZINC000875148154	EG	On-Demand	Anodyne	SCN2A	17	40
O=C(NCC[C@@H](O)C1CCCC1)NCc1ccccc1N1CCCC1	ZINC000875148155	EG	On-Demand	Anodyne	KCNQ2	74	40
O=C(NCC[C@@H](O)C1CCCC1)NCc1ccccc1N1CCCC1	ZINC000875148155	EG	On-Demand	Anodyne	SCN2A	17	40
COc1ccc(OCCCNC(=O)N(C)CCN2CC3(CCOCC3)C2)cc1	ZINC000875148156	GE	On-Demand	Anodyne	MMP13	15	45
CC[C@H](C[C@H](C)O)NC(=O)NCC(=O)N1CCCc2ccccc21	ZINC000875148158	ED	On-Demand	Anodyne	AVPR2	37	44
CC[C@H](C[C@H](C)O)NC(=O)NCC(=O)N1CCCc2ccccc21	ZINC000875148158	ED	On-Demand	Anodyne	KCNQ2	40	31
NC(=O)CCOC(=O)[C@@H]1CCCN(C(=O)c2ccc(F)cc2)C1	ZINC000875148179	DD	On-Demand	Anodyne	SLC6A1	41	38
NC(=O)CCOC(=O)[C@@H]1CCCN(C(=O)c2ccc(F)cc2)C1	ZINC000875148179	DD	On-Demand	Anodyne	SLC18A3	16	40
NC(=O)CCOC(=O)[C@@H]1CCCN(C(=O)c2ccc(F)cc2)C1	ZINC000875148179	DD	On-Demand	Anodyne	L3MBTL3	59	40
NC(=O)CCOC(=O)[C@H]1CCCN(C(=O)c2ccc(F)cc2)C1	ZINC000875148180	DD	On-Demand	Anodyne	SLC6A1	41	38
NC(=O)CCOC(=O)[C@H]1CCCN(C(=O)c2ccc(F)cc2)C1	ZINC000875148180	DD	On-Demand	Anodyne	SLC18A3	16	40
NC(=O)CCOC(=O)[C@H]1CCCN(C(=O)c2ccc(F)cc2)C1	ZINC000875148180	DD	On-Demand	Anodyne	L3MBTL3	59	40
CC[C@H](C[C@H](C)O)NC(=O)NCCCOc1ccc(OC)cc1	ZINC000875148183	DE	On-Demand	Anodyne	ADRB1	21	41
CC[C@H](C[C@H](C)O)NC(=O)NCCCOc1ccc(OC)cc1	ZINC000875148183	DE	On-Demand	Anodyne	HRH2	16	42
O=C(NCc1ccccc1N1CCCC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875148193	GF	On-Demand	Anodyne	ETHR	53	35
O=C(NCc1ccccc1N1CCCC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875148194	GF	On-Demand	Anodyne	ETHR	53	35
COC(=O)N1CCC(NC(=O)N[C@@H]2[C@H]3Cc4cc(Cl)ccc4[C@H]32)CC1	ZINC000875148214	FF	On-Demand	Anodyne	EPHX2	31	42
COC(=O)N1CCC(NC(=O)N[C@H]2[C@@H]3c4ccc(Cl)cc4C[C@H]32)CC1	ZINC000875148215	FF	On-Demand	Anodyne	EPHX2	31	42
COC(=O)N1CCC(NC(=O)N[C@@H]2[C@H]3Cc4cc(Cl)ccc4[C@@H]32)CC1	ZINC000875148216	FF	On-Demand	Anodyne	EPHX2	31	42
COC(=O)N1CCC(NC(=O)N[C@@H]2[C@@H]3Cc4cc(Cl)ccc4[C@@H]32)CC1	ZINC000875148217	FF	On-Demand	Anodyne	EPHX2	31	42
CCN(C(=O)c1c(Cl)nn(C)c1Cl)c1cccc(OC)c1	ZINC000875148218	EG	On-Demand	Anodyne	DRD4	46	35
CCN(C(=O)c1c(Cl)nn(C)c1Cl)c1cccc(OC)c1	ZINC000875148218	EG	On-Demand	Anodyne	MTNR1A	30	44
CCN(C(=O)c1c(Cl)nn(C)c1Cl)c1cccc(OC)c1	ZINC000875148218	EG	On-Demand	Anodyne	MTNR1B	33	44
CCN(C(=O)c1c(Cl)nn(C)c1Cl)c1cccc(OC)c1	ZINC000875148218	EG	On-Demand	Anodyne	HSD17B2	21	44
CCCCN1CCC(NC(=O)C(=O)NCCC(C)(C)COC)CC1	ZINC000875148227	ED	On-Demand	Anodyne	HTR4	44	42
CC[C@H](C)[C@H](C)NC(=O)N[C@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875148234	EF	On-Demand	Anodyne	MTNR1A	44	39
CC[C@H](C)[C@H](C)NC(=O)N[C@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875148234	EF	On-Demand	Anodyne	MTNR1B	42	39
CC[C@H](C)[C@H](C)NC(=O)N[C@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875148234	EF	On-Demand	Anodyne	ACE2	42	31
CC[C@H](C)[C@H](C)NC(=O)N[C@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875148235	EF	On-Demand	Anodyne	MTNR1A	44	39
CC[C@H](C)[C@H](C)NC(=O)N[C@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875148235	EF	On-Demand	Anodyne	MTNR1B	42	39
CC[C@H](C)[C@H](C)NC(=O)N[C@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875148235	EF	On-Demand	Anodyne	ACE2	42	31
CC[C@H](C)[C@H](C)NC(=O)N[C@@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875148236	EF	On-Demand	Anodyne	MTNR1A	44	39
CC[C@H](C)[C@H](C)NC(=O)N[C@@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875148236	EF	On-Demand	Anodyne	MTNR1B	42	39
CC[C@H](C)[C@H](C)NC(=O)N[C@@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875148236	EF	On-Demand	Anodyne	ACE2	42	31
CC[C@H](C)[C@H](C)NC(=O)N[C@@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875148237	EF	On-Demand	Anodyne	MTNR1A	44	39
CC[C@H](C)[C@H](C)NC(=O)N[C@@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875148237	EF	On-Demand	Anodyne	MTNR1B	42	39
CC[C@H](C)[C@H](C)NC(=O)N[C@@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875148237	EF	On-Demand	Anodyne	ACE2	42	31
CCN(Cc1ccccc1)C(=O)CNC(=O)NNc1cccc(C)n1	ZINC000875148239	EE	On-Demand	Reactive	TSPO	28	40
COC(=O)N1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)CC1	ZINC000875148243	DD	On-Demand	Anodyne	EPHX2	22	42
COC(=O)N1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)CC1	ZINC000875148244	DD	On-Demand	Anodyne	EPHX2	22	42
COC(=O)N1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)CC1	ZINC000875148245	DD	On-Demand	Anodyne	EPHX2	22	42
COC(=O)N1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)CC1	ZINC000875148246	DD	On-Demand	Anodyne	EPHX2	22	42
CCN(Cc1ccccc1)C(=O)CNC(=O)N1CCCC[C@H]1CNC(=O)NC	ZINC000875148250	GD	On-Demand	Anodyne	FKBP1A	47	39
CCN(Cc1ccccc1)C(=O)CNC(=O)N1CCCC[C@@H]1CNC(=O)NC	ZINC000875148251	GD	On-Demand	Anodyne	FKBP1A	47	39
COC(=O)N1CCC(NC(=O)NC2(c3c(F)cccc3F)CCC2)CC1	ZINC000875148252	FF	On-Demand	Anodyne	EPHX2	58	42
CCN(Cc1ccccc1)C(=O)CNC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875148253	GF	On-Demand	Anodyne	OPRD1	23	41
CC[C@H](C)[C@H](C)NC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O	ZINC000875148260	EE	On-Demand	Anodyne	GPR119	29	40
CC[C@H](C)[C@H](C)NC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O	ZINC000875148261	EE	On-Demand	Anodyne	GPR119	29	40
CC[C@H](C)[C@H](C)NC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O	ZINC000875148262	EE	On-Demand	Anodyne	GPR119	29	40
CC[C@H](C)[C@H](C)NC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O	ZINC000875148263	EE	On-Demand	Anodyne	GPR119	29	40
COC(=O)N1CCC(NC(=O)NNc2cccc(F)c2Br)CC1	ZINC000875148280	GE	On-Demand	Reactive	CCR8	52	36
C[C@@H](CNC(=O)N1CCC[C@](O)(c2ccccc2)C1)C1CC1	ZINC000875148292	DF	On-Demand	Anodyne	OPRL1	19	40
C[C@@H](CNC(=O)N1CCC[C@@](O)(c2ccccc2)C1)C1CC1	ZINC000875148294	DF	On-Demand	Anodyne	OPRL1	19	40
COC(=O)N1CCC(NC(=O)N[C@H]2CCC[C@@H]2O)CC1	ZINC000875148297	CC	On-Demand	Anodyne	EPHX2	38	49
CCCCN1CCC(NC(=O)C(=O)N2C[C@H](OC)CC[C@H]2C)CC1	ZINC000875148300	ED	On-Demand	Anodyne	HTR4	35	40
CCCCN1CCC(NC(=O)C(=O)N2C[C@H](OC)CC[C@@H]2C)CC1	ZINC000875148301	ED	On-Demand	Anodyne	HTR4	35	40
CCCCN1CCC(NC(=O)C(=O)N2C[C@@H](OC)CC[C@@H]2C)CC1	ZINC000875148302	ED	On-Demand	Anodyne	HTR4	35	40
CCCCN1CCC(NC(=O)C(=O)N2C[C@@H](OC)CC[C@H]2C)CC1	ZINC000875148303	ED	On-Demand	Anodyne	HTR4	35	40
COC(=O)N1CCC(NC(=O)N2CCC[C@H](C3CCC3)CC2)CC1	ZINC000875148313	EF	On-Demand	Anodyne	EPHX2	22	43
COC(=O)N1CCC(NC(=O)N2CCC[C@@H](C3CCC3)CC2)CC1	ZINC000875148314	EF	On-Demand	Anodyne	EPHX2	22	43
CCCCN1CCC(NC(=O)C(=O)NCCC2CCN(C(C)C)CC2)CC1	ZINC000875148329	GD	On-Demand	Anodyne	HTR4	47	38
COC(=O)N1CCC(NC(=O)NC(C)(C)[C@H]2CCCCO2)CC1	ZINC000875148331	ED	On-Demand	Anodyne	EPHX2	22	42
COC(=O)N1CCC(NC(=O)NC(C)(C)[C@@H]2CCCCO2)CC1	ZINC000875148332	ED	On-Demand	Anodyne	EPHX2	22	42
CCCCN1CCC(NC(=O)C(=O)N[C@@H](C)c2cc3cnccc3o2)CC1	ZINC000875148334	FE	On-Demand	Anodyne	HTR4	48	36
CCCCN1CCC(NC(=O)C(=O)N[C@@H](C)c2cc3cnccc3o2)CC1	ZINC000875148334	FE	On-Demand	Anodyne	SSTR5	47	35
CCCCN1CCC(NC(=O)C(=O)N[C@H](C)c2cc3cnccc3o2)CC1	ZINC000875148335	FE	On-Demand	Anodyne	HTR4	48	36
CCCCN1CCC(NC(=O)C(=O)N[C@H](C)c2cc3cnccc3o2)CC1	ZINC000875148335	FE	On-Demand	Anodyne	SSTR5	47	35
COC(=O)N1CCC(NC(=O)N2CC[C@H](c3ccc(O)cc3)C2)CC1	ZINC000875148336	EE	On-Demand	Anodyne	EPHX2	31	42
COC(=O)N1CCC(NC(=O)N2CC[C@@H](c3ccc(O)cc3)C2)CC1	ZINC000875148337	EE	On-Demand	Anodyne	EPHX2	31	42
COC(=O)N1CCC(NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875148358	FE	On-Demand	Anodyne	WNT3	41	32
COC(=O)N1CCC(NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875148359	FE	On-Demand	Anodyne	WNT3	41	32
COC(=O)N1CCC(NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875148360	FE	On-Demand	Anodyne	WNT3	41	32
COC(=O)N1CCC(NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875148361	FE	On-Demand	Anodyne	WNT3	41	32
CC[C@H](C[C@H](C)O)NC(=O)NCC(=O)N(CC)Cc1ccccc1	ZINC000875148371	ED	On-Demand	Anodyne	PTGES	17	42
CC[C@H](C[C@H](C)O)NC(=O)NCC(=O)N(CC)Cc1ccccc1	ZINC000875148371	ED	On-Demand	Anodyne	PDS	42	38
COC(=O)N1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875148378	FD	On-Demand	Anodyne	CHRM2	19	41
COC(=O)N1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875148378	FD	On-Demand	Anodyne	CHRM1	19	41
COC(=O)N1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875148378	FD	On-Demand	Anodyne	DRD2	18	47
COC(=O)N1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875148378	FD	On-Demand	Anodyne	DRD4	44	47
COC(=O)N1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875148378	FD	On-Demand	Anodyne	ACHE	30	45
COC(=O)N1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875148378	FD	On-Demand	Anodyne	DRD3	15	46
COC(=O)N1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875148378	FD	On-Demand	Anodyne	HTR4	23	45
COC(=O)N1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875148378	FD	On-Demand	Anodyne	CHRM3	24	41
COC(=O)N1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875148378	FD	On-Demand	Anodyne	SIGMAR1	54	53
COC(=O)N1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875148378	FD	On-Demand	Anodyne	SSTR5	41	37
COC(=O)N1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875148378	FD	On-Demand	Anodyne	CCR3	29	45
COC(=O)N1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875148378	FD	On-Demand	Anodyne	FAAH	24	40
COC(=O)N1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875148378	FD	On-Demand	Anodyne	EPHX2	38	44
COC(=O)N1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875148378	FD	On-Demand	Anodyne	MCHR1	32	48
COC(=O)N1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875148378	FD	On-Demand	Anodyne	CCR8	54	46
COC(=O)N1CCC(NC(=O)N[C@@H]2CC(C)(C)CC[C@H]2O)CC1	ZINC000875148380	ED	On-Demand	Anodyne	EPHX2	29	56
COC(=O)N(C)NC(=O)N[C@H]1CCCC[C@H]1c1ccccc1	ZINC000875148384	DF	On-Demand	Reactive	GRIA4	15	42
COC(=O)N(C)NC(=O)N[C@H]1CCCC[C@@H]1c1ccccc1	ZINC000875148385	DF	On-Demand	Reactive	GRIA4	15	42
COC(=O)N(C)NC(=O)N[C@@H]1CCCC[C@H]1c1ccccc1	ZINC000875148386	DF	On-Demand	Reactive	GRIA4	15	42
COC(=O)N(C)NC(=O)N[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000875148387	DF	On-Demand	Reactive	GRIA4	15	42
CCN(Cc1ccccc1)C(=O)CNC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875148388	ED	On-Demand	Anodyne	OPRD1	28	40
CCN(Cc1ccccc1)C(=O)CNC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875148388	ED	On-Demand	Anodyne	NPY2R	21	45
CCN(Cc1ccccc1)C(=O)CNC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875148389	ED	On-Demand	Anodyne	OPRD1	28	40
CCN(Cc1ccccc1)C(=O)CNC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875148389	ED	On-Demand	Anodyne	NPY2R	21	45
CC[C@@H](NC(=O)N(C)C[C@H](O)CN(C)C(=O)OC(C)(C)C)C(C)C	ZINC000875148405	EE	On-Demand	Anodyne	ECE1	21	40
CC[C@@H](NC(=O)N(C)C[C@@H](O)CN(C)C(=O)OC(C)(C)C)C(C)C	ZINC000875148406	EE	On-Demand	Anodyne	ECE1	21	40
COC(=O)N1CCC(NC(=O)N[C@@H](CCO)c2ccc(Cl)c(F)c2)CC1	ZINC000875148408	GE	On-Demand	Anodyne	MAPK1	52	38
COC(=O)N1CCC(NC(=O)N[C@@H](CCO)c2ccc(Cl)c(F)c2)CC1	ZINC000875148408	GE	On-Demand	Anodyne	EPHX2	32	40
COC(=O)N1CCC(NC(=O)N[C@H](CCO)c2ccc(Cl)c(F)c2)CC1	ZINC000875148409	GE	On-Demand	Anodyne	MAPK1	52	38
COC(=O)N1CCC(NC(=O)N[C@H](CCO)c2ccc(Cl)c(F)c2)CC1	ZINC000875148409	GE	On-Demand	Anodyne	EPHX2	32	40
COC(=O)N1CCC(NC(=O)N[C@@H](CO)CCC(C)C)CC1	ZINC000875148416	DD	On-Demand	Anodyne	EPHX2	28	40
COC(=O)N1CCC(NC(=O)N[C@H](CO)CCC(C)C)CC1	ZINC000875148417	DD	On-Demand	Anodyne	EPHX2	28	40
CC[C@@H](NC(=O)NC1CCN(C(=O)OC)CC1)[C@@H](O)c1ccccc1	ZINC000875148438	EE	On-Demand	Anodyne	CHRM1	16	40
CC[C@@H](NC(=O)NC1CCN(C(=O)OC)CC1)[C@@H](O)c1ccccc1	ZINC000875148438	EE	On-Demand	Anodyne	GRIN2B	21	40
CC[C@@H](NC(=O)NC1CCN(C(=O)OC)CC1)[C@@H](O)c1ccccc1	ZINC000875148438	EE	On-Demand	Anodyne	EPHX2	43	46
CC[C@@H](NC(=O)NC1CCN(C(=O)OC)CC1)[C@@H](O)c1ccccc1	ZINC000875148438	EE	On-Demand	Anodyne	XIAP	46	36
CC[C@@H](NC(=O)NC1CCN(C(=O)OC)CC1)[C@H](O)c1ccccc1	ZINC000875148440	EE	On-Demand	Anodyne	CHRM1	16	40
CC[C@@H](NC(=O)NC1CCN(C(=O)OC)CC1)[C@H](O)c1ccccc1	ZINC000875148440	EE	On-Demand	Anodyne	GRIN2B	21	40
CC[C@@H](NC(=O)NC1CCN(C(=O)OC)CC1)[C@H](O)c1ccccc1	ZINC000875148440	EE	On-Demand	Anodyne	EPHX2	43	46
CC[C@@H](NC(=O)NC1CCN(C(=O)OC)CC1)[C@H](O)c1ccccc1	ZINC000875148440	EE	On-Demand	Anodyne	XIAP	46	36
CONC(=O)C1CCN(C(=O)N[C@@H](CC(=O)N(C)C)c2ccccc2)CC1	ZINC000875148443	GD	On-Demand	Anodyne	CCR5	33	41
CONC(=O)C1CCN(C(=O)N[C@@H](CC(=O)N(C)C)c2ccccc2)CC1	ZINC000875148443	GD	On-Demand	Anodyne	AMY2	45	31
CONC(=O)C1CCN(C(=O)N[C@H](CC(=O)N(C)C)c2ccccc2)CC1	ZINC000875148444	GD	On-Demand	Anodyne	CCR5	33	41
CONC(=O)C1CCN(C(=O)N[C@H](CC(=O)N(C)C)c2ccccc2)CC1	ZINC000875148444	GD	On-Demand	Anodyne	AMY2	45	31
COC(=O)N1CCC(NC(=O)N2CC(c3ccccc3)C2)CC1	ZINC000875148452	DE	On-Demand	Anodyne	CHRM1	15	42
COC(=O)N1CCC(NC(=O)N2CC(c3ccccc3)C2)CC1	ZINC000875148452	DE	On-Demand	Anodyne	SIGMAR1	21	42
COC(=O)N1CCC(NC(=O)N2CC(c3ccccc3)C2)CC1	ZINC000875148452	DE	On-Demand	Anodyne	EPHX2	55	44
COC(=O)N1CCC(NC(=O)N2CC(c3ccccc3)C2)CC1	ZINC000875148452	DE	On-Demand	Anodyne	RBP4	52	35
COC(=O)N1CCC(NC(=O)N2CC(c3ccccc3)C2)CC1	ZINC000875148452	DE	On-Demand	Anodyne	ADAM10	30	43
COC(=O)N1CCC(NC(=O)N2CC(c3ccccc3)C2)CC1	ZINC000875148452	DE	On-Demand	Anodyne	CCR8	44	38
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@@H](CC(=O)N(C)C)c1ccccc1	ZINC000875148456	FE	On-Demand	Anodyne	TIMP3	76	35
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@H](CC(=O)N(C)C)c1ccccc1	ZINC000875148458	FE	On-Demand	Anodyne	TIMP3	76	35
CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)C(C)C	ZINC000875148463	EH	On-Demand	Anodyne	OPRL1	19	48
CCCCN1CCC(NC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875148472	GE	On-Demand	Anodyne	CHRM1	17	40
CCCCN1CCC(NC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875148472	GE	On-Demand	Anodyne	HTR4	41	36
CCCCN1CCC(NC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875148472	GE	On-Demand	Anodyne	CHRM3	16	41
CCCCN1CCC(NC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875148473	GE	On-Demand	Anodyne	CHRM1	17	40
CCCCN1CCC(NC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875148473	GE	On-Demand	Anodyne	HTR4	41	36
CCCCN1CCC(NC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875148473	GE	On-Demand	Anodyne	CHRM3	16	41
CCCCN1CCC(NC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875148474	GE	On-Demand	Anodyne	CHRM1	17	40
CCCCN1CCC(NC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875148474	GE	On-Demand	Anodyne	HTR4	41	36
CCCCN1CCC(NC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875148474	GE	On-Demand	Anodyne	CHRM3	16	41
CCCCN1CCC(NC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875148475	GE	On-Demand	Anodyne	CHRM1	17	40
CCCCN1CCC(NC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875148475	GE	On-Demand	Anodyne	HTR4	41	36
CCCCN1CCC(NC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875148475	GE	On-Demand	Anodyne	CHRM3	16	41
COC(=O)N1CCC(NC(=O)N[C@@H]2[C@@H](c3ccccc3)C2(C)C)CC1	ZINC000875148481	EF	On-Demand	Anodyne	SIGMAR1	16	42
COC(=O)N1CCC(NC(=O)N[C@@H]2[C@@H](c3ccccc3)C2(C)C)CC1	ZINC000875148481	EF	On-Demand	Anodyne	EPHX2	53	47
COC(=O)N1CCC(NC(=O)N[C@@H]2[C@@H](c3ccccc3)C2(C)C)CC1	ZINC000875148481	EF	On-Demand	Anodyne	CCR8	38	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CC(=O)N(C)C)c1ccccc1	ZINC000875148501	FD	On-Demand	Anodyne	SLC6A4	23	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CC(=O)N(C)C)c1ccccc1	ZINC000875148501	FD	On-Demand	Anodyne	SLC6A3	55	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CC(=O)N(C)C)c1ccccc1	ZINC000875148502	FD	On-Demand	Anodyne	SLC6A4	23	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CC(=O)N(C)C)c1ccccc1	ZINC000875148502	FD	On-Demand	Anodyne	SLC6A3	55	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CC(=O)N(C)C)c1ccccc1	ZINC000875148503	FD	On-Demand	Anodyne	SLC6A4	23	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CC(=O)N(C)C)c1ccccc1	ZINC000875148503	FD	On-Demand	Anodyne	SLC6A3	55	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CC(=O)N(C)C)c1ccccc1	ZINC000875148504	FD	On-Demand	Anodyne	SLC6A4	23	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CC(=O)N(C)C)c1ccccc1	ZINC000875148504	FD	On-Demand	Anodyne	SLC6A3	55	42
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(C(=O)OC)CC1	ZINC000875148525	DD	On-Demand	Anodyne	EPHX2	24	45
C[C@@H](CNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)C1CC1	ZINC000875148527	DF	On-Demand	Mild	CCR3	17	40
C[C@@H](CNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)C1CC1	ZINC000875148527	DF	On-Demand	Mild	ITK	21	53
C[C@@H](CNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)C1CC1	ZINC000875148527	DF	On-Demand	Mild	PANC	60	41
COC(=O)N1CCC(NC(=O)NC[C@@]2(O)CCCC(C)(C)CC2)CC1	ZINC000875148534	FE	On-Demand	Anodyne	EPHX2	28	47
COC(=O)N1CCC(NC(=O)NC[C@]2(O)CCCC(C)(C)CC2)CC1	ZINC000875148535	FE	On-Demand	Anodyne	EPHX2	28	47
COC(=O)N1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@@]3(C(=O)OC)C2)CC1	ZINC000875148551	EC	On-Demand	Anodyne	EPHX2	27	44
COC(=O)N1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875148564	GG	On-Demand	Reactive	TSHR	43	33
COC(=O)N1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875148564	GG	On-Demand	Reactive	DRD4	19	43
COC(=O)N1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875148564	GG	On-Demand	Reactive	GRIN2B	39	41
COC(=O)N1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875148564	GG	On-Demand	Reactive	LTA4H	58	46
COC(=O)N1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875148564	GG	On-Demand	Reactive	SIGMAR1	21	47
COC(=O)N1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875148564	GG	On-Demand	Reactive	MMP13	21	40
COC(=O)N1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875148564	GG	On-Demand	Reactive	CACNA1B	22	41
COC(=O)N1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875148564	GG	On-Demand	Reactive	ADAM17	45	44
COC(=O)N1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875148564	GG	On-Demand	Reactive	SLC6A5	42	46
COC(=O)N1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875148564	GG	On-Demand	Reactive	MMP9	15	41
COC(=O)N1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875148564	GG	On-Demand	Reactive	EPHX2	65	49
COC(=O)N1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875148564	GG	On-Demand	Reactive	TGM2	26	43
COC(=O)N1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875148564	GG	On-Demand	Reactive	MCHR1	27	41
COC(=O)N1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875148564	GG	On-Demand	Reactive	F13A1	32	43
COC(=O)N1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875148564	GG	On-Demand	Reactive	CCR8	75	47
COC(=O)N1CCC(NC(=O)N[C@]23CCCC[C@@H]2C3)CC1	ZINC000875148565	CD	On-Demand	Anodyne	EPHX2	27	43
COC(=O)N1CCC(NC(=O)N[C@@]23CCCC[C@@H]2C3)CC1	ZINC000875148566	CD	On-Demand	Anodyne	EPHX2	27	43
COC(=O)N1CCC(NC(=O)N[C@]23CCCC[C@H]2C3)CC1	ZINC000875148567	CD	On-Demand	Anodyne	EPHX2	27	43
COC(=O)N1CCC(NC(=O)N[C@@]23CCCC[C@H]2C3)CC1	ZINC000875148568	CD	On-Demand	Anodyne	EPHX2	27	43
COC(=O)N1CCC(NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)CC1	ZINC000875148577	GE	On-Demand	Anodyne	SIGMAR1	16	40
CCCCN1CCC(NC(=O)C(=O)N2CCC[C@H]2c2cncc(C)c2)CC1	ZINC000875148578	FE	On-Demand	Anodyne	SSTR5	33	43
CCCCN1CCC(NC(=O)C(=O)N2CCC[C@@H]2c2cncc(C)c2)CC1	ZINC000875148579	FE	On-Demand	Anodyne	SSTR5	33	43
CCCCN1CCC(NC(=O)C(=O)N[C@H](C)c2ccnn2C)CC1	ZINC000875148603	EC	On-Demand	Anodyne	HTR4	44	37
CCCCN1CCC(NC(=O)C(=O)N[C@@H](C)c2ccnn2C)CC1	ZINC000875148604	EC	On-Demand	Anodyne	HTR4	44	37
CCN(Cc1ccccc1)C(=O)CNC(=O)NN(C)C(=O)OC	ZINC000875148605	DC	On-Demand	Reactive	LIMK2	25	40
CCN(Cc1ccccc1)C(=O)CNC(=O)NN(C)C(=O)OC	ZINC000875148605	DC	On-Demand	Reactive	PDS	15	40
C[C@@H](CNC(=O)N1CCC(c2nnnn2C)CC1)c1ccc(F)cc1	ZINC000875148627	EE	On-Demand	Anodyne	CCR3	60	36
C[C@@H](CNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000875148650	EI	On-Demand	Anodyne	EPHX2	19	46
C[C@@H](CNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000875148651	EI	On-Demand	Anodyne	EPHX2	19	46
C[C@@H](CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F)C1CC1	ZINC000875148666	EH	On-Demand	Mild	CTSF	44	35
C[C@@H](CNC(=O)N1CCC2(CCNC2=O)CC1)c1ccc(F)cc1	ZINC000875148695	EE	On-Demand	Anodyne	CACNA1H	51	40
COc1cc(F)ccc1NC(=O)[C@@]1(C#N)CCN(C(=O)OC(C)(C)C)C1	ZINC000875148704	FF	On-Demand	Mild	GPR119	24	42
COc1cc(F)ccc1NC(=O)[C@]1(C#N)CCN(C(=O)OC(C)(C)C)C1	ZINC000875148705	FF	On-Demand	Mild	GPR119	24	42
CN1CCN(C2CCN(C(=O)NCCNc3ncccc3C#N)CC2)CC1	ZINC000875148722	FC	On-Demand	Mild	L3MBTL3	56	39
COCC(C)(C)CCNC(=O)C(=O)NCCN1CCCc2ccccc21	ZINC000875148728	FD	On-Demand	Anodyne	DRD2	20	41
COCC(C)(C)CCNC(=O)C(=O)NCCN1CCCc2ccccc21	ZINC000875148728	FD	On-Demand	Anodyne	DRD4	43	36
Cc1cncc([C@@H]2CCCN2C(=O)NCCNc2ncccc2C#N)c1	ZINC000875148759	FF	On-Demand	Mild	DPP4	16	42
Cc1cncc([C@H]2CCCN2C(=O)NCCNc2ncccc2C#N)c1	ZINC000875148760	FF	On-Demand	Mild	DPP4	16	42
Cn1nc(Cl)c(C(=O)N2CCC[C@@H]2C(=O)Nc2nccs2)c1Cl	ZINC000875148769	FE	On-Demand	Anodyne	MAP1	83	39
Cn1nc(Cl)c(C(=O)N2CCC[C@H]2C(=O)Nc2nccs2)c1Cl	ZINC000875148770	FE	On-Demand	Anodyne	MAP1	83	39
O=C(NCc1ccoc1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875148782	DE	On-Demand	Anodyne	NPSR1	26	41
O=C(NCc1ccoc1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875148783	DE	On-Demand	Anodyne	NPSR1	26	41
C[C@@H](CNC(=O)N1CC2(CCN(C(=O)OC(C)(C)C)CC2)C1)C1CC1	ZINC000875148784	FG	On-Demand	Anodyne	GPR119	24	50
C[C@H](CNC(=O)N1CC2(CCN(C(=O)OC(C)(C)C)CC2)C1)C1CC1	ZINC000875148785	FG	On-Demand	Anodyne	GPR119	24	50
NC(=O)CCOC(=O)c1ccc(C#Cc2ccccc2)cc1	ZINC000875148788	CE	On-Demand	Mild	FFAR1	37	45
CN(CCNC(=O)NCCNc1ncccc1C#N)CC(F)F	ZINC000875148814	EC	On-Demand	Mild	ADRB1	41	32
C[C@@H](CNC(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccc(F)cc1	ZINC000875148848	FE	On-Demand	Anodyne	L3MBTL3	72	42
C[C@H](CNC(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccc(F)cc1	ZINC000875148849	FE	On-Demand	Anodyne	L3MBTL3	72	42
O=C(NCc1ccoc1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875148875	DE	On-Demand	Anodyne	SIGMAR1	22	41
C[S@](=O)Cc1cccc(C(=O)OCC(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)c1	ZINC000875148899	JH	On-Demand	Anodyne	TRY2_BOVIN	48	33
C[S@@](=O)Cc1cccc(C(=O)OCC(=O)N2CCN(C(c3ccccc3)c3ccccc3)CC2)c1	ZINC000875148900	JH	On-Demand	Anodyne	TRY2_BOVIN	48	33
COc1cc(F)ccc1NC(=O)[C@@H]1CC(=O)N(C)[C@H]1c1cccc(F)c1	ZINC000875148918	FG	On-Demand	Anodyne	HSD17B2	17	40
C[C@@H](CNC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)c1ccc(F)cc1	ZINC000875148924	FF	On-Demand	Anodyne	ETHR	58	35
C[C@@H](CNC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)c1ccc(F)cc1	ZINC000875148925	FF	On-Demand	Anodyne	ETHR	58	35
C[C@@H](CNC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccc(F)cc1	ZINC000875148980	DG	On-Demand	Anodyne	CCR3	46	32
C[C@@H](CNC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccc(F)cc1	ZINC000875148983	DG	On-Demand	Anodyne	CCR3	46	32
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)c1ccc(F)cc1	ZINC000875149018	EF	On-Demand	Anodyne	SLC6A4	30	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)c1ccc(F)cc1	ZINC000875149018	EF	On-Demand	Anodyne	SLC6A3	74	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)c1ccc(F)cc1	ZINC000875149019	EF	On-Demand	Anodyne	SLC6A4	30	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)c1ccc(F)cc1	ZINC000875149019	EF	On-Demand	Anodyne	SLC6A3	74	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)c1ccc(F)cc1	ZINC000875149020	EF	On-Demand	Anodyne	SLC6A4	30	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)c1ccc(F)cc1	ZINC000875149020	EF	On-Demand	Anodyne	SLC6A3	74	49
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)c1ccc(F)cc1	ZINC000875149021	EF	On-Demand	Anodyne	SLC6A4	30	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)c1ccc(F)cc1	ZINC000875149021	EF	On-Demand	Anodyne	SLC6A3	74	49
C[C@H]1CN(Cc2cccc(CNC(=O)NC3(C)CC(F)(F)C3)c2)CCO1	ZINC000875149023	FF	On-Demand	Anodyne	CHRM3	19	41
C[C@@H]1CN(Cc2cccc(CNC(=O)NC3(C)CC(F)(F)C3)c2)CCO1	ZINC000875149024	FF	On-Demand	Anodyne	CHRM3	19	41
COc1ccc([C@@H]2CN(C(=O)NCCNc3ncccc3C#N)CCO2)cc1	ZINC000875149048	GE	On-Demand	Mild	PROKR1	54	33
O=C(NCc1ccoc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875149049	DF	On-Demand	Anodyne	F2	35	40
O=C(NCc1ccoc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875149049	DF	On-Demand	Anodyne	PREP	35	44
O=C(NCc1ccoc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875149049	DF	On-Demand	Anodyne	TMPRSS11D	61	35
O=C(NCc1ccoc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875149050	DF	On-Demand	Anodyne	F2	35	40
O=C(NCc1ccoc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875149050	DF	On-Demand	Anodyne	PREP	35	44
O=C(NCc1ccoc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875149050	DF	On-Demand	Anodyne	TMPRSS11D	61	35
O=C(NCc1ccoc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875149051	DF	On-Demand	Anodyne	F2	35	40
O=C(NCc1ccoc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875149051	DF	On-Demand	Anodyne	PREP	35	44
O=C(NCc1ccoc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875149051	DF	On-Demand	Anodyne	TMPRSS11D	61	35
O=C(NCc1ccoc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875149052	DF	On-Demand	Anodyne	F2	35	40
O=C(NCc1ccoc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875149052	DF	On-Demand	Anodyne	PREP	35	44
O=C(NCc1ccoc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875149052	DF	On-Demand	Anodyne	TMPRSS11D	61	35
O=C(NCc1ccoc1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875149072	FG	On-Demand	Anodyne	NAMPT	47	35
O=C(NCc1ccoc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875149073	CF	On-Demand	Anodyne	EPHX2	21	41
O=C(NCc1ccoc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875149074	CF	On-Demand	Anodyne	EPHX2	21	41
C[C@H]1CN(Cc2cccc(CNC(=O)N3CCC[C@@H](C(C)(C)O)C3)c2)CCO1	ZINC000875149117	GF	On-Demand	Anodyne	CCR3	23	40
C[C@H]1CN(Cc2cccc(CNC(=O)N3CCC[C@H](C(C)(C)O)C3)c2)CCO1	ZINC000875149118	GF	On-Demand	Anodyne	CCR3	23	40
C[C@@H]1CN(Cc2cccc(CNC(=O)N3CCC[C@H](C(C)(C)O)C3)c2)CCO1	ZINC000875149119	GF	On-Demand	Anodyne	CCR3	23	40
C[C@@H]1CN(Cc2cccc(CNC(=O)N3CCC[C@@H](C(C)(C)O)C3)c2)CCO1	ZINC000875149120	GF	On-Demand	Anodyne	CCR3	23	40
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccoc2)CC1	ZINC000875149128	EH	On-Demand	Anodyne	EPHX2	15	41
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccoc2)CC1	ZINC000875149128	EH	On-Demand	Anodyne	RBP4	25	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccoc2)CC1	ZINC000875149129	EH	On-Demand	Anodyne	EPHX2	15	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccoc2)CC1	ZINC000875149129	EH	On-Demand	Anodyne	RBP4	25	41
N#Cc1cccnc1NCCNC(=O)N1CCC(Oc2cccc(F)c2)CC1	ZINC000875149148	GF	On-Demand	Mild	EPHX2	17	45
O=C(NCc1ccoc1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875149163	DE	On-Demand	Anodyne	NAMPT	23	40
C[C@@H](CNC(=O)N1CCC(c2nc(C3CCC3)no2)CC1)c1ccc(F)cc1	ZINC000875149225	GI	On-Demand	Anodyne	SMO	41	44
C[C@@H](CNC(=O)N1CCC(c2nc(C3CCC3)no2)CC1)c1ccc(F)cc1	ZINC000875149225	GI	On-Demand	Anodyne	ETHR	65	47
O=C(NCc1ccoc1)N1Cc2cccnc2N2C[C@H](O)C[C@H]2C1	ZINC000875149227	ED	On-Demand	Anodyne	NAMPT	20	40
C[C@@H](CNC(=O)N(C)CCc1cccc(C#N)c1)c1ccc(F)cc1	ZINC000875149249	EH	On-Demand	Mild	MCHR1	15	48
C[C@H](CNC(=O)N(C)CCc1cccc(C#N)c1)c1ccc(F)cc1	ZINC000875149250	EH	On-Demand	Mild	MCHR1	15	48
N#CCc1ccsc1C(=O)N1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000875149273	EF	On-Demand	Mild	MAP1	94	39
N#CCc1ccsc1C(=O)N1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000875149273	EF	On-Demand	Mild	LGMN	67	34
N#CCc1ccsc1C(=O)N1CCC[C@H]1C(=O)Nc1nccs1	ZINC000875149274	EF	On-Demand	Mild	MAP1	94	39
N#CCc1ccsc1C(=O)N1CCC[C@H]1C(=O)Nc1nccs1	ZINC000875149274	EF	On-Demand	Mild	LGMN	67	34
COc1cc(F)ccc1NC(=O)[C@]12CCCC[C@@H]1C2	ZINC000875149283	CG	On-Demand	Anodyne	ACKR3	45	32
COc1cc(F)ccc1NC(=O)[C@]12CCCC[C@H]1C2	ZINC000875149284	CG	On-Demand	Anodyne	ACKR3	45	32
COc1cc(F)ccc1NC(=O)[C@@]12CCCC[C@@H]1C2	ZINC000875149285	CG	On-Demand	Anodyne	ACKR3	45	32
COc1cc(F)ccc1NC(=O)[C@@]12CCCC[C@H]1C2	ZINC000875149286	CG	On-Demand	Anodyne	ACKR3	45	32
O=C(NCc1ccoc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875149298	DE	On-Demand	Anodyne	PDS	45	38
O=C(NCc1ccoc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875149299	DE	On-Demand	Anodyne	PDS	45	38
N#Cc1cccnc1NCCNC(=O)N1CC(OCC(F)F)C1	ZINC000875149312	ED	On-Demand	Mild	ADRB1	40	31
C[C@@H](CNC(=O)N1CCC(c2nccc(-c3cccnc3)n2)CC1)C1CC1	ZINC000875149313	FG	On-Demand	Anodyne	ABL1	15	44
CONC(=O)C1CCN(C(=O)NC[C@@H](C)c2ccc(F)cc2)CC1	ZINC000875149316	EE	On-Demand	Anodyne	SLC6A3	21	41
CONC(=O)C1CCN(C(=O)NC[C@@H](C)c2ccc(F)cc2)CC1	ZINC000875149316	EE	On-Demand	Anodyne	DPP4	15	42
CONC(=O)C1CCN(C(=O)NC[C@H](C)c2ccc(F)cc2)CC1	ZINC000875149317	EE	On-Demand	Anodyne	SLC6A3	21	41
CONC(=O)C1CCN(C(=O)NC[C@H](C)c2ccc(F)cc2)CC1	ZINC000875149317	EE	On-Demand	Anodyne	DPP4	15	42
CCCCCCCNC(=O)C(=O)NCCc1ccc2ccccc2n1	ZINC000875149360	EF	On-Demand	Mild	CYSLTR1	48	41
CCCCCCCNC(=O)C(=O)NCCc1ccc2ccccc2n1	ZINC000875149360	EF	On-Demand	Mild	TSPO	15	41
CCCCCCCNC(=O)C(=O)NCCc1ccc2ccccc2n1	ZINC000875149360	EF	On-Demand	Mild	MTNR1A	41	41
CCCCCCCNC(=O)C(=O)NCCc1ccc2ccccc2n1	ZINC000875149360	EF	On-Demand	Mild	ASAH1	88	38
CC[C@@H](NC(=O)NCc1ccoc1)[C@@H](O)c1ccccc1	ZINC000875149399	CF	On-Demand	Anodyne	ANPEP	15	42
CC[C@@H](NC(=O)NCc1ccoc1)[C@@H](O)c1ccccc1	ZINC000875149399	CF	On-Demand	Anodyne	PDS	42	34
CC[C@@H](NC(=O)NCc1ccoc1)[C@H](O)c1ccccc1	ZINC000875149401	CF	On-Demand	Anodyne	ANPEP	15	42
CC[C@@H](NC(=O)NCc1ccoc1)[C@H](O)c1ccccc1	ZINC000875149401	CF	On-Demand	Anodyne	PDS	42	34
C[C@H]1CN(Cc2cccc(CNC(=O)N3Cc4cccc(O)c4C3)c2)CCO1	ZINC000875149413	GF	On-Demand	Clean	CHRM3	16	40
C[C@@H]1CN(Cc2cccc(CNC(=O)N3Cc4cccc(O)c4C3)c2)CCO1	ZINC000875149414	GF	On-Demand	Clean	CHRM3	16	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccoc1	ZINC000875149422	CD	On-Demand	Anodyne	SLC6A4	32	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccoc1	ZINC000875149422	CD	On-Demand	Anodyne	SLC6A3	57	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccoc1	ZINC000875149423	CD	On-Demand	Anodyne	SLC6A4	32	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccoc1	ZINC000875149423	CD	On-Demand	Anodyne	SLC6A3	57	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	ACE	47	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	OPRM1	42	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	MME	91	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	ANPEP	65	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	TACR1	20	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	CMA1	65	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	CTRA_BOVIN	70	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	FCER2	95	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	CASP3	24	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	BMP1	16	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	KLK3	72	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	CTSB	85	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	PAPA1_CARPA	89	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	CYSP_TRYCR	67	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	CCKAR	51	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	CTSK	38	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	CTSL	75	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	TIMP3	93	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	PYGL	17	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	CAPNS1	69	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	HLA-DRB1	105	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	CELA2A	50	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	REN	56	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	MMP11	40	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	CTSS	39	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	CAPN1	111	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	MMP9	24	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	CTRC	48	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	CAPN2	129	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	ACE2	68	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	MC1R	43	31
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	FPR1	67	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	CTRB_BOVIN	48	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	LEF	41	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	BLA1_STEMA	44	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	PSMB8	48	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(F)cc1OC	ZINC000875149425	FG	On-Demand	Anodyne	GPR142	71	40
O=C(NCc1ccoc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875149461	DG	On-Demand	Anodyne	PREP	27	41
O=C(NCc1ccoc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875149461	DG	On-Demand	Anodyne	TMPRSS11D	51	33
O=C(NCc1ccoc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875149462	DG	On-Demand	Anodyne	PREP	27	41
O=C(NCc1ccoc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875149462	DG	On-Demand	Anodyne	TMPRSS11D	51	33
O=C(NCc1ccoc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875149463	DG	On-Demand	Anodyne	PREP	27	41
O=C(NCc1ccoc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875149463	DG	On-Demand	Anodyne	TMPRSS11D	51	33
O=C(NCc1ccoc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875149464	DG	On-Demand	Anodyne	PREP	27	41
O=C(NCc1ccoc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875149464	DG	On-Demand	Anodyne	TMPRSS11D	51	33
C[C@@H](CNC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1ccc(F)cc1	ZINC000875149467	EG	On-Demand	Anodyne	SLC6A3	22	42
C[C@@H](CNC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(F)cc1	ZINC000875149488	DF	On-Demand	Anodyne	DPP4	17	45
C[C@@H](CNC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(F)cc1	ZINC000875149488	DF	On-Demand	Anodyne	DPP7	15	42
C[C@@H](CNC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(F)cc1	ZINC000875149489	DF	On-Demand	Anodyne	DPP4	17	45
C[C@@H](CNC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(F)cc1	ZINC000875149489	DF	On-Demand	Anodyne	DPP7	15	42
C[C@@H]1CN(Cc2cccc(CNC(=O)N3CC[C@H](C(C)(C)O)C3)c2)CCO1	ZINC000875149499	GE	On-Demand	Anodyne	CCR3	20	41
C[C@H]1CN(Cc2cccc(CNC(=O)N3CC[C@H](C(C)(C)O)C3)c2)CCO1	ZINC000875149500	GE	On-Demand	Anodyne	CCR3	20	41
C[C@H]1CN(Cc2cccc(CNC(=O)N3CC[C@@H](C(C)(C)O)C3)c2)CCO1	ZINC000875149501	GE	On-Demand	Anodyne	CCR3	20	41
C[C@@H]1CN(Cc2cccc(CNC(=O)N3CC[C@@H](C(C)(C)O)C3)c2)CCO1	ZINC000875149502	GE	On-Demand	Anodyne	CCR3	20	41
C[C@@H](CNC(=O)N[C@H]1CCN(CC(C)(C)O)C1)c1ccc(F)cc1	ZINC000875149523	EE	On-Demand	Anodyne	CCR3	36	40
COc1cccc(C(C)(C)C(=O)Nc2ccc(F)cc2OC)c1	ZINC000875149525	DH	On-Demand	Anodyne	DHODH	18	43
COc1cccc(C(C)(C)C(=O)Nc2ccc(F)cc2OC)c1	ZINC000875149525	DH	On-Demand	Anodyne	MTNR1B	25	40
C[C@@H]1CN(Cc2cccc(CNC(=O)N3CCN(C)C(C)(C)CC3)c2)CCO1	ZINC000875149530	GF	On-Demand	Anodyne	CHRM3	15	40
C[C@H]1CN(Cc2cccc(CNC(=O)N3CCN(C)C(C)(C)CC3)c2)CCO1	ZINC000875149531	GF	On-Demand	Anodyne	CHRM3	15	40
C[C@@H](CNC(=O)N1CCn2c(nnc2-c2cn(C)cn2)C1)c1ccc(F)cc1	ZINC000875149614	GE	On-Demand	Anodyne	P2RX7	23	43
CC(=O)[C@H]1CCCN(C(=O)NC[C@@H](C)c2ccc(F)cc2)C1	ZINC000875149615	DF	On-Demand	Anodyne	CCR3	40	34
CC(=O)[C@@H]1CCCN(C(=O)NC[C@@H](C)c2ccc(F)cc2)C1	ZINC000875149616	DF	On-Demand	Anodyne	CCR3	40	34
CC(=O)[C@@H]1CCCN(C(=O)NC[C@H](C)c2ccc(F)cc2)C1	ZINC000875149617	DF	On-Demand	Anodyne	CCR3	40	34
CC(=O)[C@H]1CCCN(C(=O)NC[C@H](C)c2ccc(F)cc2)C1	ZINC000875149618	DF	On-Demand	Anodyne	CCR3	40	34
N#Cc1ccc(N2CCN(C(=O)NCc3ccc(F)c(F)c3)CC2)cn1	ZINC000875149620	FE	On-Demand	Mild	ABCC1	47	34
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)N[C@H]2C[C@@H]2c2ccccc2)C1	ZINC000875149632	GE	On-Demand	Anodyne	EPHX2	44	53
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)N[C@@H]2C[C@@H]2c2ccccc2)C1	ZINC000875149634	GE	On-Demand	Anodyne	EPHX2	44	53
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)N[C@H]2C[C@H]2c2ccccc2)C1	ZINC000875149635	GE	On-Demand	Anodyne	EPHX2	44	53
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1	ZINC000875149636	GE	On-Demand	Anodyne	EPHX2	44	53
C[C@@H]1CCCC[C@@H]1CNC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875149640	EE	On-Demand	Anodyne	L3MBTL3	53	41
C[C@@H]1CCCC[C@H]1CNC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875149644	EE	On-Demand	Anodyne	L3MBTL3	53	41
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875149651	ED	On-Demand	Reactive	CHRM2	24	47
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875149651	ED	On-Demand	Reactive	DRD2	32	57
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875149651	ED	On-Demand	Reactive	DRD4	63	57
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875149651	ED	On-Demand	Reactive	ACHE	65	53
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875149651	ED	On-Demand	Reactive	HRH1	20	42
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875149651	ED	On-Demand	Reactive	DRD3	21	48
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875149651	ED	On-Demand	Reactive	SLC6A3	21	44
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875149651	ED	On-Demand	Reactive	KCNH2	16	45
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875149651	ED	On-Demand	Reactive	HTR4	62	49
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875149651	ED	On-Demand	Reactive	GRIN2B	59	40
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875149651	ED	On-Demand	Reactive	LTA4H	28	45
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875149651	ED	On-Demand	Reactive	HRH3	15	43
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875149651	ED	On-Demand	Reactive	SIGMAR1	82	50
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875149651	ED	On-Demand	Reactive	BCHE	20	45
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875149651	ED	On-Demand	Reactive	CCR3	68	45
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875149651	ED	On-Demand	Reactive	CCR5	32	44
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875149651	ED	On-Demand	Reactive	MCHR1	40	45
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875149651	ED	On-Demand	Reactive	CACNA1G	39	41
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875149651	ED	On-Demand	Reactive	CACNA1I	70	45
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875149651	ED	On-Demand	Reactive	NPFFR1	40	36
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1C[C@H]1c1ccccc1	ZINC000875149654	CD	On-Demand	Anodyne	EPHX2	26	48
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1C[C@@H]1c1ccccc1	ZINC000875149656	CD	On-Demand	Anodyne	EPHX2	26	48
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1C[C@H]1c1ccccc1	ZINC000875149658	CD	On-Demand	Anodyne	EPHX2	26	48
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1C[C@@H]1c1ccccc1	ZINC000875149660	CD	On-Demand	Anodyne	EPHX2	26	48
CN1CCN(C(=O)NCc2ccc(F)c(F)c2)Cc2cccnc21	ZINC000875149675	EF	On-Demand	Anodyne	ABCC1	98	37
CN1CCN(C(=O)NCc2ccc(F)c(F)c2)Cc2cccnc21	ZINC000875149675	EF	On-Demand	Anodyne	MAPK1	17	43
CN1CCN(C(=O)NCc2ccc(F)c(F)c2)Cc2cccnc21	ZINC000875149675	EF	On-Demand	Anodyne	ABCB1A	51	34
CN1CCN(C(=O)NCc2ccc(F)c(F)c2)Cc2cccnc21	ZINC000875149675	EF	On-Demand	Anodyne	NAMPT	26	45
O=C(NCc1ccc(F)c(F)c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875149681	EG	On-Demand	Anodyne	F2	50	44
O=C(NCc1ccc(F)c(F)c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875149681	EG	On-Demand	Anodyne	TRY1_BOVIN	35	41
O=C(NCc1ccc(F)c(F)c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875149681	EG	On-Demand	Anodyne	DPP4	23	48
O=C(NCc1ccc(F)c(F)c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875149681	EG	On-Demand	Anodyne	PREP	49	45
O=C(NCc1ccc(F)c(F)c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875149681	EG	On-Demand	Anodyne	TMPRSS11D	65	35
O=C(NCc1ccc(F)c(F)c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875149683	EG	On-Demand	Anodyne	F2	50	44
O=C(NCc1ccc(F)c(F)c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875149683	EG	On-Demand	Anodyne	TRY1_BOVIN	35	41
O=C(NCc1ccc(F)c(F)c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875149683	EG	On-Demand	Anodyne	DPP4	23	48
O=C(NCc1ccc(F)c(F)c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875149683	EG	On-Demand	Anodyne	PREP	49	45
O=C(NCc1ccc(F)c(F)c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875149683	EG	On-Demand	Anodyne	TMPRSS11D	65	35
O=C(NCc1ccc(F)c(F)c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875149685	EG	On-Demand	Anodyne	F2	50	44
O=C(NCc1ccc(F)c(F)c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875149685	EG	On-Demand	Anodyne	TRY1_BOVIN	35	41
O=C(NCc1ccc(F)c(F)c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875149685	EG	On-Demand	Anodyne	DPP4	23	48
O=C(NCc1ccc(F)c(F)c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875149685	EG	On-Demand	Anodyne	PREP	49	45
O=C(NCc1ccc(F)c(F)c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875149685	EG	On-Demand	Anodyne	TMPRSS11D	65	35
O=C(NCc1ccc(F)c(F)c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875149687	EG	On-Demand	Anodyne	F2	50	44
O=C(NCc1ccc(F)c(F)c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875149687	EG	On-Demand	Anodyne	TRY1_BOVIN	35	41
O=C(NCc1ccc(F)c(F)c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875149687	EG	On-Demand	Anodyne	DPP4	23	48
O=C(NCc1ccc(F)c(F)c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875149687	EG	On-Demand	Anodyne	PREP	49	45
O=C(NCc1ccc(F)c(F)c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875149687	EG	On-Demand	Anodyne	TMPRSS11D	65	35
O=C(NCc1ccc(F)c(F)c1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875149720	EG	On-Demand	Anodyne	EPHX2	20	52
O=C(NCc1ccc(F)c(F)c1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875149720	EG	On-Demand	Anodyne	NPSR1	27	43
O=C(NCc1ccc(F)c(F)c1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875149721	EG	On-Demand	Anodyne	EPHX2	20	52
O=C(NCc1ccc(F)c(F)c1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875149721	EG	On-Demand	Anodyne	NPSR1	27	43
CC(=O)[C@H]1CCCN(C(=O)NCCS(=O)(=O)c2ccccc2)C1	ZINC000875149736	ED	On-Demand	Anodyne	FKBP1A	18	40
CC(=O)[C@H]1CCCN(C(=O)NCCS(=O)(=O)c2ccccc2)C1	ZINC000875149736	ED	On-Demand	Anodyne	SLC6A1	63	33
CC(=O)[C@H]1CCCN(C(=O)NCCS(=O)(=O)c2ccccc2)C1	ZINC000875149736	ED	On-Demand	Anodyne	SFRP1	90	35
CC(=O)[C@H]1CCCN(C(=O)NCCS(=O)(=O)c2ccccc2)C1	ZINC000875149736	ED	On-Demand	Anodyne	WNT3	66	35
CC(=O)[C@@H]1CCCN(C(=O)NCCS(=O)(=O)c2ccccc2)C1	ZINC000875149738	ED	On-Demand	Anodyne	FKBP1A	18	40
CC(=O)[C@@H]1CCCN(C(=O)NCCS(=O)(=O)c2ccccc2)C1	ZINC000875149738	ED	On-Demand	Anodyne	SLC6A1	63	33
CC(=O)[C@@H]1CCCN(C(=O)NCCS(=O)(=O)c2ccccc2)C1	ZINC000875149738	ED	On-Demand	Anodyne	SFRP1	90	35
CC(=O)[C@@H]1CCCN(C(=O)NCCS(=O)(=O)c2ccccc2)C1	ZINC000875149738	ED	On-Demand	Anodyne	WNT3	66	35
COC(=O)C1(O)CN(C(=O)NCc2ccc(-n3ccnc3)c(F)c2)C1	ZINC000875149757	EC	On-Demand	Anodyne	NOS2	85	36
O=C(NCCN1CC[C@H](O)C1)NCCS(=O)(=O)Cc1ccccc1	ZINC000875149771	FB	On-Demand	Anodyne	ACHE	16	41
O=C(NCCN1CC[C@H](O)C1)NCCS(=O)(=O)Cc1ccccc1	ZINC000875149771	FB	On-Demand	Anodyne	OPRK1	23	42
O=C(NCCN1CC[C@H](O)C1)NCCS(=O)(=O)Cc1ccccc1	ZINC000875149771	FB	On-Demand	Anodyne	CCR3	34	44
O=C(NCCN1CC[C@@H](O)C1)NCCS(=O)(=O)Cc1ccccc1	ZINC000875149772	FB	On-Demand	Anodyne	ACHE	16	41
O=C(NCCN1CC[C@@H](O)C1)NCCS(=O)(=O)Cc1ccccc1	ZINC000875149772	FB	On-Demand	Anodyne	OPRK1	23	42
O=C(NCCN1CC[C@@H](O)C1)NCCS(=O)(=O)Cc1ccccc1	ZINC000875149772	FB	On-Demand	Anodyne	CCR3	34	44
O=C(NCCS(=O)(=O)c1ccccc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875149774	GE	On-Demand	Anodyne	PRSS2	41	32
O=C(NCCS(=O)(=O)c1ccccc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875149774	GE	On-Demand	Anodyne	CCR3	35	42
O=C(NCCS(=O)(=O)c1ccccc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875149774	GE	On-Demand	Anodyne	EPHX2	29	47
O=C(NCCS(=O)(=O)c1ccccc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875149774	GE	On-Demand	Anodyne	SFRP1	55	32
COc1cccc([C@H](O)C2CCN(C(=O)NCc3ccc(F)c(F)c3)CC2)c1	ZINC000875149786	GH	On-Demand	Anodyne	DRD4	41	34
COc1cccc([C@H](O)C2CCN(C(=O)NCc3ccc(F)c(F)c3)CC2)c1	ZINC000875149786	GH	On-Demand	Anodyne	CCR3	17	41
O=C(NCc1ccc(-n2ccnc2)c(F)c1)N1CCC(CO)(CO)CC1	ZINC000875149787	FD	On-Demand	Anodyne	NOS2	94	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(C)on1	ZINC000875149796	CD	On-Demand	Anodyne	SLC6A3	42	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(C)on1	ZINC000875149798	CD	On-Demand	Anodyne	SLC6A3	42	36
CC(=O)C1CCN(C(=O)NCCS(=O)(=O)c2ccccc2)CC1	ZINC000875149800	ED	On-Demand	Anodyne	EPHX2	27	42
CC(=O)C1CCN(C(=O)NCCS(=O)(=O)c2ccccc2)CC1	ZINC000875149800	ED	On-Demand	Anodyne	SFRP1	94	36
CC(=O)C1CCN(C(=O)NCCS(=O)(=O)c2ccccc2)CC1	ZINC000875149800	ED	On-Demand	Anodyne	WNT3	70	36
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(OCC)cc2)C1	ZINC000875149801	EE	On-Demand	Anodyne	PDS	50	38
CN1CCC(N2CCC(NC(=O)C(=O)NCCCCC3CC3)CC2)CC1	ZINC000875149807	FD	On-Demand	Anodyne	SLC6A5	16	41
O=C(NCCO)C1CCN(C(=O)NCc2ccc(F)c(F)c2)CC1	ZINC000875149822	EC	On-Demand	Anodyne	EPHX2	25	51
O=C(NCc1ccc(F)c(F)c1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875149830	FF	On-Demand	Anodyne	ETHR	59	36
O=C(NCc1ccc(F)c(F)c1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875149831	FF	On-Demand	Anodyne	ETHR	59	36
Cc1noc(C)c1CNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875149835	EE	On-Demand	Anodyne	P2RX7	17	50
Cc1noc(C)c1CNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875149836	EE	On-Demand	Anodyne	P2RX7	17	50
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(F)c(F)c1	ZINC000875149839	CE	On-Demand	Anodyne	ANPEP	16	43
CN1CC[C@H]2CN(C(=O)NCc3ccc(F)c(F)c3)CC[C@H]21	ZINC000875149845	DE	On-Demand	Anodyne	P2RX7	21	40
CN1CC[C@H]2CN(C(=O)NCc3ccc(F)c(F)c3)CC[C@@H]21	ZINC000875149846	DE	On-Demand	Anodyne	P2RX7	21	40
CC(=O)Nc1cccc2c1CN(C(=O)NCc1ccc(F)c(F)c1)CC2	ZINC000875149859	FG	On-Demand	Anodyne	MAPK1	24	44
O=C(N[C@@H]1C[C@H]1c1ccccc1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875149866	DH	On-Demand	Anodyne	EPHX2	21	50
O=C(NCc1ccc(F)c(F)c1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875149868	DF	On-Demand	Anodyne	P2RX7	16	41
O=C(NCCS(=O)(=O)Cc1ccccc1)N1CC(c2ccccc2)C1	ZINC000875149869	FE	On-Demand	Anodyne	CCR5	19	40
O=C(NCCS(=O)(=O)Cc1ccccc1)N1CC(c2ccccc2)C1	ZINC000875149869	FE	On-Demand	Anodyne	TMPRSS11D	59	32
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875149871	GF	On-Demand	Anodyne	CHRM2	27	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875149871	GF	On-Demand	Anodyne	ACE	32	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875149871	GF	On-Demand	Anodyne	DRD2	24	48
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875149871	GF	On-Demand	Anodyne	DRD4	49	48
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875149871	GF	On-Demand	Anodyne	ACHE	55	48
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875149871	GF	On-Demand	Anodyne	DRD3	15	45
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875149871	GF	On-Demand	Anodyne	SLC6A3	22	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875149871	GF	On-Demand	Anodyne	HTR4	70	50
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875149871	GF	On-Demand	Anodyne	CHRM3	28	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875149871	GF	On-Demand	Anodyne	SIGMAR1	57	48
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875149871	GF	On-Demand	Anodyne	SSTR5	47	36
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875149871	GF	On-Demand	Anodyne	BCHE	15	45
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875149871	GF	On-Demand	Anodyne	CCR3	47	37
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875149871	GF	On-Demand	Anodyne	CCR5	54	39
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875149871	GF	On-Demand	Anodyne	MCHR1	29	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875149871	GF	On-Demand	Anodyne	CACNA1I	66	44
O=C(N[C@H]1C[C@@H]1c1ccccc1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875149874	DH	On-Demand	Anodyne	EPHX2	21	50
O=C(N[C@H]1C[C@H]1c1ccccc1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875149875	DH	On-Demand	Anodyne	EPHX2	21	50
O=C(NCCO)C1CCN(C(=O)NCc2ccc(-n3ccnc3)c(F)c2)CC1	ZINC000875149908	GD	On-Demand	Anodyne	NOS2	98	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2C[C@@H]2c2ccccc2)C1	ZINC000875149913	DE	On-Demand	Anodyne	EPHX2	29	51
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2C[C@@H]2c2ccccc2)C1	ZINC000875149913	DE	On-Demand	Anodyne	KDM1A	43	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2C[C@H]2c2ccccc2)C1	ZINC000875149914	DE	On-Demand	Anodyne	EPHX2	29	51
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2C[C@H]2c2ccccc2)C1	ZINC000875149914	DE	On-Demand	Anodyne	KDM1A	43	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1	ZINC000875149915	DE	On-Demand	Anodyne	EPHX2	29	51
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1	ZINC000875149915	DE	On-Demand	Anodyne	KDM1A	43	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2C[C@@H]2c2ccccc2)C1	ZINC000875149917	DE	On-Demand	Anodyne	EPHX2	29	51
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2C[C@@H]2c2ccccc2)C1	ZINC000875149917	DE	On-Demand	Anodyne	KDM1A	43	34
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)NCCS(=O)(=O)Cc1ccccc1	ZINC000875149920	FD	On-Demand	Anodyne	PLG	53	33
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)NCCS(=O)(=O)Cc1ccccc1	ZINC000875149920	FD	On-Demand	Anodyne	TRYP_PIG	40	33
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)Cc2ccc(Cl)cc2Cl)CC1	ZINC000875149925	GF	On-Demand	Anodyne	UGCG	34	41
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)Cc2ccc(Cl)cc2Cl)CC1	ZINC000875149925	GF	On-Demand	Anodyne	MC4R	77	40
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)Cc2ccc(Cl)cc2Cl)CC1	ZINC000875149925	GF	On-Demand	Anodyne	P2RX7	29	42
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)Cc2ccc(Cl)cc2Cl)CC1	ZINC000875149925	GF	On-Demand	Anodyne	CCR1	43	37
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)Cc2ccc(Cl)cc2Cl)CC1	ZINC000875149925	GF	On-Demand	Anodyne	EPHX2	19	48
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)Cc2ccc(Cl)cc2Cl)CC1	ZINC000875149927	GF	On-Demand	Anodyne	UGCG	34	41
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)Cc2ccc(Cl)cc2Cl)CC1	ZINC000875149927	GF	On-Demand	Anodyne	MC4R	77	40
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)Cc2ccc(Cl)cc2Cl)CC1	ZINC000875149927	GF	On-Demand	Anodyne	P2RX7	29	42
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)Cc2ccc(Cl)cc2Cl)CC1	ZINC000875149927	GF	On-Demand	Anodyne	CCR1	43	37
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)Cc2ccc(Cl)cc2Cl)CC1	ZINC000875149927	GF	On-Demand	Anodyne	EPHX2	19	48
O=C(N[C@H]1C[C@@H]1c1ccccc1)N1Cc2cccnc2N2C[C@H](O)C[C@H]2C1	ZINC000875149928	FE	On-Demand	Anodyne	EPHX2	24	49
O=C(N[C@H]1C[C@H]1c1ccccc1)N1Cc2cccnc2N2C[C@H](O)C[C@H]2C1	ZINC000875149931	FE	On-Demand	Anodyne	EPHX2	24	49
O=C(N[C@@H]1C[C@H]1c1ccccc1)N1Cc2cccnc2N2C[C@H](O)C[C@H]2C1	ZINC000875149935	FE	On-Demand	Anodyne	EPHX2	24	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCS(=O)(=O)Cc1ccccc1	ZINC000875149940	GD	On-Demand	Anodyne	SLC6A4	24	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCS(=O)(=O)Cc1ccccc1	ZINC000875149940	GD	On-Demand	Anodyne	SLC6A3	50	44
O=C(NCCS(=O)(=O)c1ccccc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875149942	GE	On-Demand	Anodyne	FBP1	31	40
O=C(NCCS(=O)(=O)c1ccccc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875149943	GE	On-Demand	Anodyne	FBP1	31	40
O=C(NCc1ccc(F)c(F)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875149945	EH	On-Demand	Anodyne	EPHX2	25	48
O=C(N[C@H]1C[C@@H]1c1ccccc1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875149946	DF	On-Demand	Anodyne	SLC6A3	15	44
O=C(N[C@H]1C[C@@H]1c1ccccc1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875149946	DF	On-Demand	Anodyne	EPHX2	26	51
O=C(N[C@@H]1C[C@H]1c1ccccc1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875149948	DF	On-Demand	Anodyne	SLC6A3	15	44
O=C(N[C@@H]1C[C@H]1c1ccccc1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875149948	DF	On-Demand	Anodyne	EPHX2	26	51
O=C(N[C@H]1C[C@H]1c1ccccc1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875149949	DF	On-Demand	Anodyne	SLC6A3	15	44
O=C(N[C@H]1C[C@H]1c1ccccc1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875149949	DF	On-Demand	Anodyne	EPHX2	26	51
O=C(NCc1ccc(F)c(F)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875149951	EH	On-Demand	Anodyne	EPHX2	25	48
CN1CC[C@H]2CN(C(=O)NCc3ccc(Oc4cccnc4)c(F)c3)CC[C@@H]21	ZINC000875149952	GG	On-Demand	Anodyne	CHRNA7	51	36
CN1CC[C@H]2CN(C(=O)NCc3ccc(Oc4cccnc4)c(F)c3)CC[C@@H]21	ZINC000875149952	GG	On-Demand	Anodyne	NAMPT	52	36
CN1CC[C@H]2CN(C(=O)NCc3ccc(Oc4cccnc4)c(F)c3)CC[C@H]21	ZINC000875149954	GG	On-Demand	Anodyne	CHRNA7	51	36
CN1CC[C@H]2CN(C(=O)NCc3ccc(Oc4cccnc4)c(F)c3)CC[C@H]21	ZINC000875149954	GG	On-Demand	Anodyne	NAMPT	52	36
Cc1nnc(NNC(=O)N[C@H]2C[C@@H]2c2ccccc2)n1C	ZINC000875149972	CD	On-Demand	Reactive	EPHX2	21	45
Cc1nnc(NNC(=O)N[C@@H]2C[C@H]2c2ccccc2)n1C	ZINC000875149974	CD	On-Demand	Reactive	EPHX2	21	45
Cc1nnc(NNC(=O)N[C@H]2C[C@H]2c2ccccc2)n1C	ZINC000875149976	CD	On-Demand	Reactive	EPHX2	21	45
Cc1nnc(NNC(=O)N[C@@H]2C[C@@H]2c2ccccc2)n1C	ZINC000875149978	CD	On-Demand	Reactive	EPHX2	21	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1C[C@H]1c1ccccc1	ZINC000875149980	DE	On-Demand	Anodyne	SLC6A2	18	52
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1C[C@H]1c1ccccc1	ZINC000875149980	DE	On-Demand	Anodyne	SLC6A4	50	52
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1C[C@H]1c1ccccc1	ZINC000875149980	DE	On-Demand	Anodyne	SLC6A3	95	52
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1C[C@H]1c1ccccc1	ZINC000875149980	DE	On-Demand	Anodyne	EPHX2	25	49
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1C[C@@H]1c1ccccc1	ZINC000875149983	DE	On-Demand	Anodyne	SLC6A2	18	52
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1C[C@@H]1c1ccccc1	ZINC000875149983	DE	On-Demand	Anodyne	SLC6A4	50	52
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1C[C@@H]1c1ccccc1	ZINC000875149983	DE	On-Demand	Anodyne	SLC6A3	95	52
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1C[C@@H]1c1ccccc1	ZINC000875149983	DE	On-Demand	Anodyne	EPHX2	25	49
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1C[C@@H]1c1ccccc1	ZINC000875149984	DE	On-Demand	Anodyne	SLC6A2	18	52
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1C[C@@H]1c1ccccc1	ZINC000875149984	DE	On-Demand	Anodyne	SLC6A4	50	52
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1C[C@@H]1c1ccccc1	ZINC000875149984	DE	On-Demand	Anodyne	SLC6A3	95	52
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1C[C@@H]1c1ccccc1	ZINC000875149984	DE	On-Demand	Anodyne	EPHX2	25	49
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1C[C@H]1c1ccccc1	ZINC000875149987	DE	On-Demand	Anodyne	SLC6A2	18	52
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1C[C@H]1c1ccccc1	ZINC000875149987	DE	On-Demand	Anodyne	SLC6A4	50	52
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1C[C@H]1c1ccccc1	ZINC000875149987	DE	On-Demand	Anodyne	SLC6A3	95	52
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1C[C@H]1c1ccccc1	ZINC000875149987	DE	On-Demand	Anodyne	EPHX2	25	49
O=C(N[C@@H]1C[C@H]1c1ccccc1)N1Cc2cccc(O)c2C1	ZINC000875150002	CF	On-Demand	Clean	EPHX2	28	53
O=C(N[C@H]1C[C@H]1c1ccccc1)N1Cc2cccc(O)c2C1	ZINC000875150003	CF	On-Demand	Clean	EPHX2	28	53
O=C(N[C@H]1C[C@@H]1c1ccccc1)N1Cc2cccc(O)c2C1	ZINC000875150004	CF	On-Demand	Clean	EPHX2	28	53
O=C(NCc1ccc(F)c(F)c1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875150019	GH	On-Demand	Anodyne	SMO	38	43
O=C(NCc1ccc(F)c(F)c1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875150019	GH	On-Demand	Anodyne	ETHR	65	48
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2=O)C1	ZINC000875150023	FC	On-Demand	Anodyne	ACE	40	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2=O)C1	ZINC000875150023	FC	On-Demand	Anodyne	SLC6A1	52	32
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2=O)C1	ZINC000875150023	FC	On-Demand	Anodyne	SAP2	35	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2=O)C1	ZINC000875150024	FC	On-Demand	Anodyne	ACE	40	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2=O)C1	ZINC000875150024	FC	On-Demand	Anodyne	SLC6A1	52	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2=O)C1	ZINC000875150024	FC	On-Demand	Anodyne	SAP2	35	44
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)C2=O)C1	ZINC000875150025	FC	On-Demand	Anodyne	ACE	40	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)C2=O)C1	ZINC000875150025	FC	On-Demand	Anodyne	SLC6A1	52	32
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)C2=O)C1	ZINC000875150025	FC	On-Demand	Anodyne	SAP2	35	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)C2=O)C1	ZINC000875150026	FC	On-Demand	Anodyne	ACE	40	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)C2=O)C1	ZINC000875150026	FC	On-Demand	Anodyne	SLC6A1	52	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)C2=O)C1	ZINC000875150026	FC	On-Demand	Anodyne	SAP2	35	44
O=C(NCCS(=O)(=O)Cc1ccccc1)N1OC2CCC1CC2	ZINC000875150032	ED	On-Demand	Anodyne	TMPRSS11D	43	32
CO[C@@H]1CC[C@@H](C)N(C(=O)NCc2ccc(F)c(F)c2)C1	ZINC000875150036	CF	On-Demand	Anodyne	P2RX7	34	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(F)c(F)c1	ZINC000875150041	DE	On-Demand	Anodyne	SLC6A4	35	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(F)c(F)c1	ZINC000875150041	DE	On-Demand	Anodyne	SLC6A3	65	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(F)c(F)c1	ZINC000875150041	DE	On-Demand	Anodyne	P2RX7	17	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(F)c(F)c1	ZINC000875150042	DE	On-Demand	Anodyne	SLC6A4	35	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(F)c(F)c1	ZINC000875150042	DE	On-Demand	Anodyne	SLC6A3	65	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(F)c(F)c1	ZINC000875150042	DE	On-Demand	Anodyne	P2RX7	17	40
O=C(NCc1ccc(F)c(F)c1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875150050	FG	On-Demand	Anodyne	NAMPT	23	41
CCC1(CC)CCCN1C(=O)NCCS(=O)(=O)c1ccccc1	ZINC000875150051	EF	On-Demand	Anodyne	SLC12A5	57	36
O=C(NCC1CCN(Cc2ccccc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875150056	GG	On-Demand	Anodyne	DRD2	20	48
O=C(NCC1CCN(Cc2ccccc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875150056	GG	On-Demand	Anodyne	DRD4	47	48
O=C(NCC1CCN(Cc2ccccc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875150056	GG	On-Demand	Anodyne	ACHE	58	50
O=C(NCC1CCN(Cc2ccccc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875150056	GG	On-Demand	Anodyne	DRD3	15	43
O=C(NCC1CCN(Cc2ccccc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875150056	GG	On-Demand	Anodyne	SLC6A3	22	41
O=C(NCC1CCN(Cc2ccccc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875150056	GG	On-Demand	Anodyne	HTR4	48	45
O=C(NCC1CCN(Cc2ccccc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875150056	GG	On-Demand	Anodyne	SIGMAR1	64	45
O=C(NCC1CCN(Cc2ccccc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875150056	GG	On-Demand	Anodyne	CCR3	41	38
O=C(NCC1CCN(Cc2ccccc2)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875150056	GG	On-Demand	Anodyne	CACNA1I	58	41
O=C(NCCS(=O)(=O)c1ccccc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875150059	GD	On-Demand	Anodyne	SFRP1	109	35
O=C(NCCS(=O)(=O)c1ccccc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875150059	GD	On-Demand	Anodyne	WNT3	71	35
O=C(NCCS(=O)(=O)c1ccccc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875150060	GD	On-Demand	Anodyne	SFRP1	109	35
O=C(NCCS(=O)(=O)c1ccccc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875150060	GD	On-Demand	Anodyne	WNT3	71	35
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875150073	GF	On-Demand	Anodyne	CHRM2	15	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875150073	GF	On-Demand	Anodyne	DRD2	23	50
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875150073	GF	On-Demand	Anodyne	DRD4	47	50
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875150073	GF	On-Demand	Anodyne	ACHE	57	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875150073	GF	On-Demand	Anodyne	SLC6A4	30	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875150073	GF	On-Demand	Anodyne	DRD3	18	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875150073	GF	On-Demand	Anodyne	SLC6A3	65	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875150073	GF	On-Demand	Anodyne	HTR4	62	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875150073	GF	On-Demand	Anodyne	SIGMAR1	64	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875150073	GF	On-Demand	Anodyne	SSTR5	45	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875150073	GF	On-Demand	Anodyne	BCHE	17	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875150073	GF	On-Demand	Anodyne	CCR3	42	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875150073	GF	On-Demand	Anodyne	MCHR1	19	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875150073	GF	On-Demand	Anodyne	CACNA1I	61	42
O=C(NCc1ccc(F)c(F)c1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875150075	ED	On-Demand	Anodyne	EPHX2	15	42
O=C(NCc1ccc(F)c(F)c1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875150076	ED	On-Demand	Anodyne	EPHX2	15	42
O=C(NCc1ccc(F)c(F)c1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875150077	ED	On-Demand	Anodyne	EPHX2	15	42
O=C(NCc1ccc(F)c(F)c1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875150078	ED	On-Demand	Anodyne	EPHX2	15	42
O=C(NCc1ccc(F)c(F)c1)N1CCC2(CCNC2=O)CC1	ZINC000875150104	DD	On-Demand	Anodyne	CACNA1H	64	39
O=C(NCc1ccc(F)c(F)c1)N1CCC2(CCNC2=O)CC1	ZINC000875150104	DD	On-Demand	Anodyne	NPSR1	26	42
CC(=O)C1CCN(C(=O)NCc2ccc(F)c(F)c2)CC1	ZINC000875150107	CE	On-Demand	Anodyne	P2RX7	23	40
CC(=O)C1CCN(C(=O)NCc2ccc(F)c(F)c2)CC1	ZINC000875150107	CE	On-Demand	Anodyne	EPHX2	27	48
COC(=O)C1=NO[C@]2(CCN(C(=O)N[C@@H]3C[C@@H]3c3ccccc3)C2)C1	ZINC000875150126	ED	On-Demand	Anodyne	EPHX2	33	53
COC(=O)C1=NO[C@]2(CCN(C(=O)N[C@@H]3C[C@H]3c3ccccc3)C2)C1	ZINC000875150127	ED	On-Demand	Anodyne	EPHX2	33	53
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875150128	GG	On-Demand	Anodyne	DRD2	19	45
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875150128	GG	On-Demand	Anodyne	DRD4	47	45
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875150128	GG	On-Demand	Anodyne	ACHE	56	49
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875150128	GG	On-Demand	Anodyne	HTR4	52	43
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875150128	GG	On-Demand	Anodyne	SIGMAR1	55	44
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875150128	GG	On-Demand	Anodyne	BCHE	16	47
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875150128	GG	On-Demand	Anodyne	FAAH	16	41
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875150128	GG	On-Demand	Anodyne	CCR2	15	41
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875150128	GG	On-Demand	Anodyne	EPHX2	15	47
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875150128	GG	On-Demand	Anodyne	CACNA1G	32	42
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875150128	GG	On-Demand	Anodyne	CACNA1I	61	45
COC(=O)C1=NO[C@]2(CCN(C(=O)N[C@H]3C[C@@H]3c3ccccc3)C2)C1	ZINC000875150129	ED	On-Demand	Anodyne	EPHX2	33	53
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875150130	GG	On-Demand	Anodyne	DRD2	19	45
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875150130	GG	On-Demand	Anodyne	DRD4	47	45
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875150130	GG	On-Demand	Anodyne	ACHE	56	49
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875150130	GG	On-Demand	Anodyne	HTR4	52	43
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875150130	GG	On-Demand	Anodyne	SIGMAR1	55	44
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875150130	GG	On-Demand	Anodyne	BCHE	16	47
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875150130	GG	On-Demand	Anodyne	FAAH	16	41
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875150130	GG	On-Demand	Anodyne	CCR2	15	41
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875150130	GG	On-Demand	Anodyne	EPHX2	15	47
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875150130	GG	On-Demand	Anodyne	CACNA1G	32	42
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875150130	GG	On-Demand	Anodyne	CACNA1I	61	45
COC(=O)C1=NO[C@]2(CCN(C(=O)N[C@H]3C[C@H]3c3ccccc3)C2)C1	ZINC000875150131	ED	On-Demand	Anodyne	EPHX2	33	53
Cc1cncc([C@@H]2CCCN2C(=O)NCc2ccc(F)c(F)c2)c1	ZINC000875150136	EH	On-Demand	Anodyne	DPP4	15	43
Cc1cncc([C@@H]2CCCN2C(=O)NCc2ccc(F)c(F)c2)c1	ZINC000875150136	EH	On-Demand	Anodyne	PREP	27	40
Cc1cncc([C@H]2CCCN2C(=O)NCc2ccc(F)c(F)c2)c1	ZINC000875150139	EH	On-Demand	Anodyne	DPP4	15	43
Cc1cncc([C@H]2CCCN2C(=O)NCc2ccc(F)c(F)c2)c1	ZINC000875150139	EH	On-Demand	Anodyne	PREP	27	40
CCCCCCCNC(=O)C(=O)N[C@@H](c1ccccc1)c1nccs1	ZINC000875150140	FG	On-Demand	Mild	SOAT1	46	38
CCCCCCCNC(=O)C(=O)N[C@@H](c1ccccc1)c1nccs1	ZINC000875150140	FG	On-Demand	Mild	HPN	44	32
CCCCCCCNC(=O)C(=O)N[C@H](c1ccccc1)c1nccs1	ZINC000875150152	FG	On-Demand	Mild	SOAT1	46	38
CCCCCCCNC(=O)C(=O)N[C@H](c1ccccc1)c1nccs1	ZINC000875150152	FG	On-Demand	Mild	HPN	44	32
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875150153	GD	On-Demand	Anodyne	CHRM2	22	45
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875150153	GD	On-Demand	Anodyne	DRD2	25	50
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875150153	GD	On-Demand	Anodyne	DRD4	52	50
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875150153	GD	On-Demand	Anodyne	ACHE	62	53
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875150153	GD	On-Demand	Anodyne	DRD3	17	44
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875150153	GD	On-Demand	Anodyne	SLC6A3	15	44
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875150153	GD	On-Demand	Anodyne	HTR4	53	48
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875150153	GD	On-Demand	Anodyne	CHRM3	30	45
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875150153	GD	On-Demand	Anodyne	GRIN2B	56	37
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875150153	GD	On-Demand	Anodyne	SIGMAR1	93	47
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875150153	GD	On-Demand	Anodyne	BCHE	22	48
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875150153	GD	On-Demand	Anodyne	CCR3	44	42
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875150153	GD	On-Demand	Anodyne	NPFFR2	35	43
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875150153	GD	On-Demand	Anodyne	FAAH	28	41
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875150153	GD	On-Demand	Anodyne	EPHX2	20	55
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875150153	GD	On-Demand	Anodyne	MCHR1	25	41
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875150153	GD	On-Demand	Anodyne	CACNA1G	27	42
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875150153	GD	On-Demand	Anodyne	CACNA1I	67	43
O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875150153	GD	On-Demand	Anodyne	NPFFR1	45	43
O=C(NCC[C@H](O)C1CCCC1)N[C@@H]1C[C@H]1c1ccccc1	ZINC000875150177	DF	On-Demand	Anodyne	EPHX2	29	48
O=C(NCC[C@H](O)C1CCCC1)N[C@H]1C[C@@H]1c1ccccc1	ZINC000875150178	DF	On-Demand	Anodyne	EPHX2	29	48
O=C(NCC[C@H](O)C1CCCC1)N[C@H]1C[C@H]1c1ccccc1	ZINC000875150179	DF	On-Demand	Anodyne	EPHX2	29	48
O=C(NCC[C@H](O)C1CCCC1)N[C@@H]1C[C@@H]1c1ccccc1	ZINC000875150180	DF	On-Demand	Anodyne	EPHX2	29	48
C[C@]1(C(F)(F)F)CCN(C(=O)NCCS(=O)(=O)c2ccccc2)C1	ZINC000875150194	FE	On-Demand	Anodyne	EPHX2	22	40
C[C@]1(C(F)(F)F)CCN(C(=O)NCCS(=O)(=O)c2ccccc2)C1	ZINC000875150194	FE	On-Demand	Anodyne	SFRP1	102	38
C[C@]1(C(F)(F)F)CCN(C(=O)NCCS(=O)(=O)c2ccccc2)C1	ZINC000875150194	FE	On-Demand	Anodyne	WNT3	70	38
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1C[C@H]1c1ccccc1	ZINC000875150196	CE	On-Demand	Anodyne	EPHX2	20	48
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1C[C@@H]1c1ccccc1	ZINC000875150197	CE	On-Demand	Anodyne	EPHX2	20	48
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1C[C@H]1c1ccccc1	ZINC000875150198	CE	On-Demand	Anodyne	EPHX2	20	48
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1C[C@@H]1c1ccccc1	ZINC000875150199	CE	On-Demand	Anodyne	EPHX2	20	48
COCCN(CC(C)C)C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875150222	EF	On-Demand	Anodyne	KLK3	62	34
COCCN(CC(C)C)C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875150222	EF	On-Demand	Anodyne	CTSB	45	37
COCCN(CC(C)C)C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875150222	EF	On-Demand	Anodyne	PAPA1_CARPA	62	37
COCCN(CC(C)C)C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875150222	EF	On-Demand	Anodyne	CTSK	31	47
COCCN(CC(C)C)C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875150222	EF	On-Demand	Anodyne	CAPNS1	64	38
COCCN(CC(C)C)C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875150222	EF	On-Demand	Anodyne	CAPN1	68	44
COCCN(CC(C)C)C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875150222	EF	On-Demand	Anodyne	CAPN2	110	37
COCCN(CC(C)C)C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875150222	EF	On-Demand	Anodyne	NPR	83	43
COCCN(CC(C)C)C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875150222	EF	On-Demand	Anodyne	SLC12A5	61	37
O=C(NCCCCC1CC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000875150228	FD	On-Demand	Anodyne	ACHE	33	42
O=C(NCCCCC1CC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000875150229	FD	On-Demand	Anodyne	ACHE	33	42
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1ccc(OCC(F)(F)F)cc1	ZINC000875150247	FH	On-Demand	Anodyne	ACACA	25	42
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1ccc(OCC(F)(F)F)cc1	ZINC000875150247	FH	On-Demand	Anodyne	ACACB	26	43
CC[C@@H](NC(=O)NCc1ccc(F)c(F)c1)[C@H](O)c1ccccc1	ZINC000875150259	EG	On-Demand	Anodyne	ANPEP	15	41
CC[C@@H](NC(=O)NCc1ccc(F)c(F)c1)[C@H](O)c1ccccc1	ZINC000875150259	EG	On-Demand	Anodyne	PDS	53	36
CC[C@@H](NC(=O)NCc1ccc(F)c(F)c1)[C@@H](O)c1ccccc1	ZINC000875150261	EG	On-Demand	Anodyne	ANPEP	15	41
CC[C@@H](NC(=O)NCc1ccc(F)c(F)c1)[C@@H](O)c1ccccc1	ZINC000875150261	EG	On-Demand	Anodyne	PDS	53	36
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(F)c(F)c1	ZINC000875150274	FE	On-Demand	Anodyne	CACNA1I	53	36
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(F)c(F)c1	ZINC000875150274	FE	On-Demand	Anodyne	ACKR3	44	30
Cc1noc(C)c1CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875150278	EF	On-Demand	Anodyne	F2	26	42
Cc1noc(C)c1CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875150279	EF	On-Demand	Anodyne	F2	26	42
Cc1noc(C)c1CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875150280	EF	On-Demand	Anodyne	F2	26	42
Cc1noc(C)c1CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875150281	EF	On-Demand	Anodyne	F2	26	42
CC[C@H](C[C@H](C)O)NC(=O)NCCS(=O)(=O)Cc1ccccc1	ZINC000875150284	ED	On-Demand	Anodyne	CAPN2	57	31
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875150290	EF	On-Demand	Anodyne	DRD2	23	51
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875150290	EF	On-Demand	Anodyne	DRD4	47	51
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875150290	EF	On-Demand	Anodyne	ACHE	57	48
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875150290	EF	On-Demand	Anodyne	HRH2	17	40
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875150290	EF	On-Demand	Anodyne	DRD3	15	43
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875150290	EF	On-Demand	Anodyne	SLC6A3	23	43
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875150290	EF	On-Demand	Anodyne	HTR4	72	51
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875150290	EF	On-Demand	Anodyne	SIGMAR1	58	46
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875150290	EF	On-Demand	Anodyne	BCHE	15	44
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875150290	EF	On-Demand	Anodyne	CCR3	44	39
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875150290	EF	On-Demand	Anodyne	CAPN1	46	40
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875150290	EF	On-Demand	Anodyne	CAPN2	83	40
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875150290	EF	On-Demand	Anodyne	BACE1	18	43
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875150290	EF	On-Demand	Anodyne	MCHR1	24	41
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(Cc2ccccc2)CC1	ZINC000875150290	EF	On-Demand	Anodyne	CACNA1I	68	42
COC(=O)[C@@]12C[C@@H](NC(=O)NCC3CCN(Cc4ccccc4)CC3)C[C@@H]1C2	ZINC000875150295	GF	On-Demand	Anodyne	CHRM2	15	40
COC(=O)[C@@]12C[C@@H](NC(=O)NCC3CCN(Cc4ccccc4)CC3)C[C@@H]1C2	ZINC000875150295	GF	On-Demand	Anodyne	DRD2	23	48
COC(=O)[C@@]12C[C@@H](NC(=O)NCC3CCN(Cc4ccccc4)CC3)C[C@@H]1C2	ZINC000875150295	GF	On-Demand	Anodyne	DRD4	46	48
COC(=O)[C@@]12C[C@@H](NC(=O)NCC3CCN(Cc4ccccc4)CC3)C[C@@H]1C2	ZINC000875150295	GF	On-Demand	Anodyne	ACHE	53	45
COC(=O)[C@@]12C[C@@H](NC(=O)NCC3CCN(Cc4ccccc4)CC3)C[C@@H]1C2	ZINC000875150295	GF	On-Demand	Anodyne	DRD3	18	47
COC(=O)[C@@]12C[C@@H](NC(=O)NCC3CCN(Cc4ccccc4)CC3)C[C@@H]1C2	ZINC000875150295	GF	On-Demand	Anodyne	HTR4	45	44
COC(=O)[C@@]12C[C@@H](NC(=O)NCC3CCN(Cc4ccccc4)CC3)C[C@@H]1C2	ZINC000875150295	GF	On-Demand	Anodyne	SIGMAR1	68	46
COC(=O)[C@@]12C[C@@H](NC(=O)NCC3CCN(Cc4ccccc4)CC3)C[C@@H]1C2	ZINC000875150295	GF	On-Demand	Anodyne	CCR3	44	39
COC(=O)[C@@]12C[C@@H](NC(=O)NCC3CCN(Cc4ccccc4)CC3)C[C@@H]1C2	ZINC000875150295	GF	On-Demand	Anodyne	EPHX2	19	58
COC(=O)[C@@]12C[C@@H](NC(=O)NCC3CCN(Cc4ccccc4)CC3)C[C@@H]1C2	ZINC000875150295	GF	On-Demand	Anodyne	MCHR1	25	46
COC(=O)[C@@]12C[C@@H](NC(=O)NCC3CCN(Cc4ccccc4)CC3)C[C@@H]1C2	ZINC000875150295	GF	On-Demand	Anodyne	CACNA1I	60	40
Cc1ccccc1CN1CCO[C@@H](CNC(=O)C(=O)NCc2cscn2)C1	ZINC000875150331	GD	On-Demand	Anodyne	SCN5A	19	41
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCCN2C)C1	ZINC000875150351	CB	On-Demand	Anodyne	CHRNA10	53	36
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCCN2C)C1	ZINC000875150352	CB	On-Demand	Anodyne	CHRNA10	53	36
CS(=O)(=O)N1CCC[C@H](NC(=O)NC2CC(Nc3ccccc3)C2)C1	ZINC000875150375	FD	On-Demand	Anodyne	EPHX2	35	44
O=C(NCC(=O)N1CCN(c2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875150387	FC	On-Demand	Anodyne	ADAM10	38	43
O=C(NCC(=O)N1CCN(c2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875150390	FC	On-Demand	Anodyne	ADAM10	38	43
O=C(NCc1cc2ccccc2s1)NC[C@H]1C[C@H](O)C1	ZINC000875150397	CE	On-Demand	Anodyne	AROQ	29	44
CS(=O)(=O)N1CCC[C@H](NC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875150398	EC	On-Demand	Clean	EPHX2	15	45
O=CN1CCCN(C(=O)NCc2cccc(C(=O)N3CCOCC3)c2)CC1	ZINC000875150433	FC	On-Demand	Anodyne	PARP1	17	53
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1C[C@@H]1c1ccccc1	ZINC000875150445	EF	On-Demand	Anodyne	SLC6A3	19	44
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1C[C@@H]1c1ccccc1	ZINC000875150445	EF	On-Demand	Anodyne	EPHX2	22	42
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1C[C@H]1c1ccccc1	ZINC000875150447	EF	On-Demand	Anodyne	SLC6A3	19	44
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1C[C@H]1c1ccccc1	ZINC000875150447	EF	On-Demand	Anodyne	EPHX2	22	42
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1C[C@H]1c1ccccc1	ZINC000875150450	EF	On-Demand	Anodyne	SLC6A3	19	44
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1C[C@H]1c1ccccc1	ZINC000875150450	EF	On-Demand	Anodyne	EPHX2	22	42
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1C[C@@H]1c1ccccc1	ZINC000875150451	EF	On-Demand	Anodyne	SLC6A3	19	44
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1C[C@@H]1c1ccccc1	ZINC000875150451	EF	On-Demand	Anodyne	EPHX2	22	42
CC(=O)[C@@H]1CCCN(C(=O)NCc2cccc(C(=O)NC[C@@H]3CCCO3)c2)C1	ZINC000875150485	GE	On-Demand	Anodyne	PDE8B	17	40
CC(=O)[C@H]1CCCN(C(=O)NCc2cccc(C(=O)NC[C@@H]3CCCO3)c2)C1	ZINC000875150486	GE	On-Demand	Anodyne	PDE8B	17	40
CC(=O)[C@H]1CCCN(C(=O)NCc2cccc(C(=O)NC[C@H]3CCCO3)c2)C1	ZINC000875150487	GE	On-Demand	Anodyne	PDE8B	17	40
CC(=O)[C@@H]1CCCN(C(=O)NCc2cccc(C(=O)NC[C@H]3CCCO3)c2)C1	ZINC000875150488	GE	On-Demand	Anodyne	PDE8B	17	40
CN1CCN(C(=O)N[C@H]2C[C@@H]2c2ccccc2)CCC1(C)C	ZINC000875150517	DF	On-Demand	Anodyne	EPHX2	35	63
CN1CCN(C(=O)N[C@H]2C[C@H]2c2ccccc2)CCC1(C)C	ZINC000875150519	DF	On-Demand	Anodyne	EPHX2	35	63
CN1CCN(C(=O)N[C@@H]2C[C@@H]2c2ccccc2)CCC1(C)C	ZINC000875150521	DF	On-Demand	Anodyne	EPHX2	35	63
CN1CCN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)CCC1(C)C	ZINC000875150523	DF	On-Demand	Anodyne	EPHX2	35	63
O=C(N[C@@H]1C[C@H]1c1ccccc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875150525	EF	On-Demand	Anodyne	EPHX2	36	60
O=C(NC[C@H]1CCCCO1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875150526	GF	On-Demand	Anodyne	PRKD1	49	33
O=C(NC[C@H]1CCCCO1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875150526	GF	On-Demand	Anodyne	TNK2	50	37
O=C(NC[C@H]1CCCCO1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875150526	GF	On-Demand	Anodyne	PDE8B	28	42
O=C(NC[C@H]1CCCCO1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875150526	GF	On-Demand	Anodyne	SMO	36	40
O=C(N[C@@H]1C[C@H]1c1ccccc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875150533	EF	On-Demand	Anodyne	EPHX2	36	60
CC(=O)C1CCN(C(=O)NCc2ccc(Oc3cccnc3)c(F)c2)CC1	ZINC000875150540	FH	On-Demand	Anodyne	CHRNA7	42	38
CC(=O)C1CCN(C(=O)NCc2ccc(Oc3cccnc3)c(F)c2)CC1	ZINC000875150540	FH	On-Demand	Anodyne	NAMPT	71	39
COC(=O)N1CCC[C@H](NC(=O)C(=O)N2Cc3cccc(OC)c3C2)C1	ZINC000875150545	FC	On-Demand	Anodyne	SSTR1	52	39
O=C(NCc1ccc(-n2ccnc2)c(F)c1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875150564	GF	On-Demand	Anodyne	NOS2	82	33
COC(=O)N1CCC[C@H](NC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)C1	ZINC000875150569	GD	On-Demand	Anodyne	BIRC2	27	40
COC(=O)N1CCC[C@H](NC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)C1	ZINC000875150570	GD	On-Demand	Anodyne	BIRC2	27	40
O=C(NCc1ccc(-n2ccnc2)c(F)c1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875150571	GF	On-Demand	Anodyne	NOS2	82	33
COC(=O)N1CCC[C@H](NC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)C1	ZINC000875150572	GD	On-Demand	Anodyne	BIRC2	27	40
COC(=O)N1CCC[C@H](NC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)C1	ZINC000875150573	GD	On-Demand	Anodyne	BIRC2	27	40
O=C(NCc1cccc2cccnc12)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875150585	GF	On-Demand	Anodyne	HCRTR1	15	40
O=C(NCc1cccc2cccnc12)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875150586	GF	On-Demand	Anodyne	HCRTR1	15	40
O=C(NCc1cccc2cccnc12)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875150587	GF	On-Demand	Anodyne	HCRTR1	15	40
O=C(NCc1cccc2cccnc12)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875150588	GF	On-Demand	Anodyne	HCRTR1	15	40
CC(=O)C1CCN(C(=O)NCc2cccc(C(=O)NC[C@@H]3CCCO3)c2)CC1	ZINC000875150593	GE	On-Demand	Anodyne	CHRM3	15	41
CC(=O)C1CCN(C(=O)NCc2cccc(C(=O)NC[C@H]3CCCO3)c2)CC1	ZINC000875150594	GE	On-Demand	Anodyne	CHRM3	15	41
COC(=O)N1CCC[C@H](NC(=O)C(=O)N[C@@H]2CCO[C@H]2c2ccccc2)C1	ZINC000875150611	GC	On-Demand	Anodyne	EPHX2	18	45
COC(=O)N1CCC[C@H](NC(=O)C(=O)N[C@@H]2CCO[C@H]2c2ccccc2)C1	ZINC000875150611	GC	On-Demand	Anodyne	BIRC2	18	40
Cn1nc(Cl)c(C(=O)N2CCC[C@H]2C(=O)NCc2ccco2)c1Cl	ZINC000875150641	FE	On-Demand	Anodyne	F2	53	37
Cn1nc(Cl)c(C(=O)N2CCC[C@H]2C(=O)NCc2ccco2)c1Cl	ZINC000875150641	FE	On-Demand	Anodyne	TRY1_BOVIN	45	34
Cn1nc(Cl)c(C(=O)N2CCC[C@H]2C(=O)NCc2ccco2)c1Cl	ZINC000875150641	FE	On-Demand	Anodyne	XIAP	19	54
Cn1nc(Cl)c(C(=O)N2CCC[C@@H]2C(=O)NCc2ccco2)c1Cl	ZINC000875150642	FE	On-Demand	Anodyne	F2	53	37
Cn1nc(Cl)c(C(=O)N2CCC[C@@H]2C(=O)NCc2ccco2)c1Cl	ZINC000875150642	FE	On-Demand	Anodyne	TRY1_BOVIN	45	34
Cn1nc(Cl)c(C(=O)N2CCC[C@@H]2C(=O)NCc2ccco2)c1Cl	ZINC000875150642	FE	On-Demand	Anodyne	XIAP	19	54
COC(=O)N(C)NC(=O)NCC1(c2ccc(OC)cc2)CCCCC1	ZINC000875150674	EF	On-Demand	Reactive	KCNA3	41	36
COC(=O)N(C)NC(=O)NCC1(c2ccc(OC)cc2)CCCCC1	ZINC000875150674	EF	On-Demand	Reactive	NMBR	50	39
COC(=O)N(C)NC(=O)NCC1(c2ccc(OC)cc2)CCCCC1	ZINC000875150674	EF	On-Demand	Reactive	MTNR1A	26	42
COC(=O)N(C)NC(=O)NCC1(c2ccc(OC)cc2)CCCCC1	ZINC000875150674	EF	On-Demand	Reactive	MTNR1B	15	42
Cc1noc(C)c1CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875150675	EG	On-Demand	Anodyne	CPT1A	70	34
CCCOc1ncccc1CNC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875150685	FF	On-Demand	Anodyne	EPHX2	16	45
CCCOc1ncccc1CNC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875150686	FF	On-Demand	Anodyne	EPHX2	16	45
O=C(NCCCN1CCN(c2ccccc2Cl)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875150687	GD	On-Demand	Anodyne	HTR1A	120	48
O=C(NCCCN1CCN(c2ccccc2Cl)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875150687	GD	On-Demand	Anodyne	DRD2	105	52
O=C(NCCCN1CCN(c2ccccc2Cl)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875150687	GD	On-Demand	Anodyne	DRD1	27	47
O=C(NCCCN1CCN(c2ccccc2Cl)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875150687	GD	On-Demand	Anodyne	DRD4	57	50
O=C(NCCCN1CCN(c2ccccc2Cl)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875150687	GD	On-Demand	Anodyne	ADRA1D	57	47
O=C(NCCCN1CCN(c2ccccc2Cl)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875150687	GD	On-Demand	Anodyne	HTR2A	86	51
O=C(NCCCN1CCN(c2ccccc2Cl)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875150687	GD	On-Demand	Anodyne	HTR2C	53	51
O=C(NCCCN1CCN(c2ccccc2Cl)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875150687	GD	On-Demand	Anodyne	SLC6A4	27	51
O=C(NCCCN1CCN(c2ccccc2Cl)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875150687	GD	On-Demand	Anodyne	ADRA1A	70	47
O=C(NCCCN1CCN(c2ccccc2Cl)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875150687	GD	On-Demand	Anodyne	ADRA1B	46	47
O=C(NCCCN1CCN(c2ccccc2Cl)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875150687	GD	On-Demand	Anodyne	DRD3	136	54
O=C(NCCCN1CCN(c2ccccc2Cl)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875150687	GD	On-Demand	Anodyne	HTR7	114	46
O=C(NCCCN1CCN(c2ccccc2Cl)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875150687	GD	On-Demand	Anodyne	CCR3	27	42
COC(=O)c1ccc(OC)c2c1CCN(C(=O)NC[C@H]1CCCN1C)C2	ZINC000875150689	FD	On-Demand	Anodyne	CHRNA10	53	34
COC(=O)c1ccc(OC)c2c1CCN(C(=O)NC[C@H]1CCCN1C)C2	ZINC000875150689	FD	On-Demand	Anodyne	ACKR3	72	38
COC(=O)c1ccc(OC)c2c1CCN(C(=O)NC[C@@H]1CCCN1C)C2	ZINC000875150690	FD	On-Demand	Anodyne	CHRNA10	53	34
COC(=O)c1ccc(OC)c2c1CCN(C(=O)NC[C@@H]1CCCN1C)C2	ZINC000875150690	FD	On-Demand	Anodyne	ACKR3	72	38
C[C@H](NC(=O)C(=O)NCCCOC1CCCC1)c1ccc(C(F)(F)F)nc1	ZINC000875150700	GF	On-Demand	Anodyne	TRPV1	49	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc2ccccc2s1	ZINC000875150701	EG	On-Demand	Anodyne	SLC6A4	29	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc2ccccc2s1	ZINC000875150701	EG	On-Demand	Anodyne	SLC6A3	53	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc2ccccc2s1	ZINC000875150702	EG	On-Demand	Anodyne	SLC6A4	29	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc2ccccc2s1	ZINC000875150702	EG	On-Demand	Anodyne	SLC6A3	53	41
Cc1noc(C)c1CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875150714	EG	On-Demand	Anodyne	CPT1A	70	34
Cc1noc(C)c1CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875150715	EG	On-Demand	Anodyne	CPT1A	70	34
Cc1noc(C)c1CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875150717	EG	On-Demand	Anodyne	CPT1A	70	34
O=C(NCCO)C1CCN(C(=O)NCc2nc3cc(Cl)ccc3s2)CC1	ZINC000875150730	GD	On-Demand	Anodyne	EPHX2	21	51
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCc2ccc(F)c(F)c2)C1	ZINC000875150736	GE	On-Demand	Anodyne	EPHX2	25	42
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCc2ccc(F)c(F)c2)C1	ZINC000875150738	GE	On-Demand	Anodyne	EPHX2	25	42
O=C(N[C@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCc2ccc(F)c(F)c2)C1	ZINC000875150740	GE	On-Demand	Anodyne	EPHX2	25	42
O=C(N[C@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCc2ccc(F)c(F)c2)C1	ZINC000875150742	GE	On-Demand	Anodyne	EPHX2	25	42
O=C(NCc1ccc(F)c(F)c1)N1CCC(CO)(CO)CC1	ZINC000875150770	DD	On-Demand	Anodyne	CACNA1H	52	36
CCCOc1ncccc1CNC(=O)N1Cc2cccc(O)c2C1	ZINC000875150783	EF	On-Demand	Clean	NAMPT	20	40
CC(=O)NC[C@@H]1CCCCN1C(=O)NCCS(=O)(=O)Cc1ccccc1	ZINC000875150792	GD	On-Demand	Anodyne	FKBP1A	42	43
CC(=O)NC[C@@H]1CCCCN1C(=O)NCCS(=O)(=O)Cc1ccccc1	ZINC000875150792	GD	On-Demand	Anodyne	HCRTR1	16	40
CC(=O)NC[C@@H]1CCCCN1C(=O)NCCS(=O)(=O)Cc1ccccc1	ZINC000875150792	GD	On-Demand	Anodyne	TMPRSS11D	51	33
O=C(NCCO)C1CCN(C(=O)NCc2cc3ccccc3s2)CC1	ZINC000875150802	FD	On-Demand	Anodyne	EPHX2	23	45
C[C@H](NC(=O)C(=O)NC[C@@H](C)CN1CCOCC1)c1ccnn1C	ZINC000875150807	EB	On-Demand	Anodyne	CASR	43	36
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@H]2CCCN2C)CC1	ZINC000875150812	EG	On-Demand	Anodyne	HTR1A	31	42
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@H]2CCCN2C)CC1	ZINC000875150812	EG	On-Demand	Anodyne	DRD2	46	48
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@H]2CCCN2C)CC1	ZINC000875150812	EG	On-Demand	Anodyne	DRD4	23	47
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@H]2CCCN2C)CC1	ZINC000875150812	EG	On-Demand	Anodyne	HTR1D	17	40
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@H]2CCCN2C)CC1	ZINC000875150812	EG	On-Demand	Anodyne	HTR1B	18	40
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@H]2CCCN2C)CC1	ZINC000875150812	EG	On-Demand	Anodyne	CHRNA10	62	43
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@H]2CCCN2C)CC1	ZINC000875150812	EG	On-Demand	Anodyne	RBP4	36	40
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@H]2CCCN2C)CC1	ZINC000875150812	EG	On-Demand	Anodyne	ACKR3	75	39
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@H]2CCCN2C)CC1	ZINC000875150813	EG	On-Demand	Anodyne	HTR1A	31	42
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@H]2CCCN2C)CC1	ZINC000875150813	EG	On-Demand	Anodyne	DRD2	46	48
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@H]2CCCN2C)CC1	ZINC000875150813	EG	On-Demand	Anodyne	DRD4	23	47
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@H]2CCCN2C)CC1	ZINC000875150813	EG	On-Demand	Anodyne	HTR1D	17	40
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@H]2CCCN2C)CC1	ZINC000875150813	EG	On-Demand	Anodyne	HTR1B	18	40
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@H]2CCCN2C)CC1	ZINC000875150813	EG	On-Demand	Anodyne	CHRNA10	62	43
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@H]2CCCN2C)CC1	ZINC000875150813	EG	On-Demand	Anodyne	RBP4	36	40
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@H]2CCCN2C)CC1	ZINC000875150813	EG	On-Demand	Anodyne	ACKR3	75	39
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@@H]2CCCN2C)CC1	ZINC000875150814	EG	On-Demand	Anodyne	HTR1A	31	42
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@@H]2CCCN2C)CC1	ZINC000875150814	EG	On-Demand	Anodyne	DRD2	46	48
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@@H]2CCCN2C)CC1	ZINC000875150814	EG	On-Demand	Anodyne	DRD4	23	47
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@@H]2CCCN2C)CC1	ZINC000875150814	EG	On-Demand	Anodyne	HTR1D	17	40
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@@H]2CCCN2C)CC1	ZINC000875150814	EG	On-Demand	Anodyne	HTR1B	18	40
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@@H]2CCCN2C)CC1	ZINC000875150814	EG	On-Demand	Anodyne	CHRNA10	62	43
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@@H]2CCCN2C)CC1	ZINC000875150814	EG	On-Demand	Anodyne	RBP4	36	40
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@@H]2CCCN2C)CC1	ZINC000875150814	EG	On-Demand	Anodyne	ACKR3	75	39
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@@H]2CCCN2C)CC1	ZINC000875150815	EG	On-Demand	Anodyne	HTR1A	31	42
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@@H]2CCCN2C)CC1	ZINC000875150815	EG	On-Demand	Anodyne	DRD2	46	48
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@@H]2CCCN2C)CC1	ZINC000875150815	EG	On-Demand	Anodyne	DRD4	23	47
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@@H]2CCCN2C)CC1	ZINC000875150815	EG	On-Demand	Anodyne	HTR1D	17	40
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@@H]2CCCN2C)CC1	ZINC000875150815	EG	On-Demand	Anodyne	HTR1B	18	40
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@@H]2CCCN2C)CC1	ZINC000875150815	EG	On-Demand	Anodyne	CHRNA10	62	43
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@@H]2CCCN2C)CC1	ZINC000875150815	EG	On-Demand	Anodyne	RBP4	36	40
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@@H]2CCCN2C)CC1	ZINC000875150815	EG	On-Demand	Anodyne	ACKR3	75	39
Cc1nnc(NNC(=O)NC[C@H]2CCCN2C)n1C	ZINC000875150816	CB	On-Demand	Reactive	ACKR3	61	32
Cc1nnc(NNC(=O)NC[C@@H]2CCCN2C)n1C	ZINC000875150817	CB	On-Demand	Reactive	ACKR3	61	32
O=C(NCCO)C1CCN(C(=O)NC[C@H]2CCCO[C@H]2c2ccccc2)CC1	ZINC000875150822	GD	On-Demand	Anodyne	EPHX2	27	41
O=C(NCCO)C1CCN(C(=O)NC[C@@H]2CCCO[C@H]2c2ccccc2)CC1	ZINC000875150823	GD	On-Demand	Anodyne	EPHX2	27	41
O=C(NCCO)C1CCN(C(=O)NC[C@@H]2CCCO[C@@H]2c2ccccc2)CC1	ZINC000875150824	GD	On-Demand	Anodyne	EPHX2	27	41
O=C(NCCO)C1CCN(C(=O)NC[C@H]2CCCO[C@@H]2c2ccccc2)CC1	ZINC000875150825	GD	On-Demand	Anodyne	EPHX2	27	41
COC(=O)N1CCC[C@H](NC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000875150839	GD	On-Demand	Anodyne	OXTR	46	37
COC(=O)N1CCC[C@H](NC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000875150843	GD	On-Demand	Anodyne	OXTR	46	37
C[C@@H](O)C1CCN(C(=O)N[C@@H]2C[C@@H]2c2ccccc2)CC1	ZINC000875150850	CE	On-Demand	Anodyne	EPHX2	38	65
C[C@@H](O)C1CCN(C(=O)N[C@@H]2C[C@@H]2c2ccccc2)CC1	ZINC000875150850	CE	On-Demand	Anodyne	KDM1A	44	36
C[C@@H](O)C1CCN(C(=O)N[C@H]2C[C@H]2c2ccccc2)CC1	ZINC000875150852	CE	On-Demand	Anodyne	EPHX2	38	65
C[C@@H](O)C1CCN(C(=O)N[C@H]2C[C@H]2c2ccccc2)CC1	ZINC000875150852	CE	On-Demand	Anodyne	KDM1A	44	36
C[C@@H](O)C1CCN(C(=O)N[C@H]2C[C@@H]2c2ccccc2)CC1	ZINC000875150854	CE	On-Demand	Anodyne	EPHX2	38	65
C[C@@H](O)C1CCN(C(=O)N[C@H]2C[C@@H]2c2ccccc2)CC1	ZINC000875150854	CE	On-Demand	Anodyne	KDM1A	44	36
O=C(NCCS(=O)(=O)c1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875150875	GF	On-Demand	Anodyne	EPHX2	26	40
O=C(NCCS(=O)(=O)c1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875150875	GF	On-Demand	Anodyne	SFRP1	68	32
O=C(NCCS(=O)(=O)c1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875150875	GF	On-Demand	Anodyne	WNT3	56	32
O=C(NCCS(=O)(=O)c1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875150876	GF	On-Demand	Anodyne	EPHX2	26	40
O=C(NCCS(=O)(=O)c1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875150876	GF	On-Demand	Anodyne	SFRP1	68	32
O=C(NCCS(=O)(=O)c1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875150876	GF	On-Demand	Anodyne	WNT3	56	32
O=C(NCc1ccc(-n2ccnc2)c(F)c1)NC[C@H]1C[C@H](O)C1	ZINC000875150892	DD	On-Demand	Anodyne	NOS2	92	35
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(-n3ccnc3)c(F)c2)C1	ZINC000875150946	FE	On-Demand	Anodyne	NOS2	95	39
O=C(NC1(C(=O)N2CCOc3ccccc32)CC1)OCc1ccccc1	ZINC000875150955	FF	On-Demand	Anodyne	CTSK	15	43
O=C(NC1(C(=O)N2CCOc3ccccc32)CC1)OCc1ccccc1	ZINC000875150955	FF	On-Demand	Anodyne	SLC12A5	60	35
O=C(NCc1ccc(-n2ccnc2)c(F)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875150960	GH	On-Demand	Anodyne	NOS2	100	37
O=C(NCc1ccc(-n2ccnc2)c(F)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875150963	GH	On-Demand	Anodyne	NOS2	100	37
O=C(N[C@H]1C[C@@H]1c1ccccc1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875151000	GH	On-Demand	Anodyne	EPHX2	33	68
O=C(N[C@@H]1C[C@H]1c1ccccc1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875151002	GH	On-Demand	Anodyne	EPHX2	33	68
O=C(N[C@H]1C[C@H]1c1ccccc1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875151003	GH	On-Demand	Anodyne	EPHX2	33	68
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(-n2ccnc2)c(F)c1	ZINC000875151010	FE	On-Demand	Anodyne	NOS2	87	34
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(-n2ccnc2)c(F)c1	ZINC000875151011	FE	On-Demand	Anodyne	NOS2	87	34
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875151042	FC	On-Demand	Anodyne	CHRM2	21	43
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875151042	FC	On-Demand	Anodyne	DRD2	28	52
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875151042	FC	On-Demand	Anodyne	DRD4	55	52
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875151042	FC	On-Demand	Anodyne	ACHE	61	48
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875151042	FC	On-Demand	Anodyne	DRD3	18	48
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875151042	FC	On-Demand	Anodyne	SLC6A3	20	43
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875151042	FC	On-Demand	Anodyne	HTR4	60	48
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875151042	FC	On-Demand	Anodyne	CHRM3	28	40
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875151042	FC	On-Demand	Anodyne	GRIN2B	53	36
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875151042	FC	On-Demand	Anodyne	HRH3	15	44
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875151042	FC	On-Demand	Anodyne	SIGMAR1	88	50
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875151042	FC	On-Demand	Anodyne	BCHE	19	43
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875151042	FC	On-Demand	Anodyne	CCR3	44	40
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875151042	FC	On-Demand	Anodyne	FAAH	25	42
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875151042	FC	On-Demand	Anodyne	MCHR1	26	44
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875151042	FC	On-Demand	Anodyne	CACNA1G	32	40
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875151042	FC	On-Demand	Anodyne	CACNA1I	67	44
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCc1ccc(F)c(F)c1)CC2	ZINC000875151046	FG	On-Demand	Anodyne	MAPK1	29	45
Cn1cnc(-c2nnc3n2CCN(C(=O)NCc2ccc(F)c(F)c2)C3)c1	ZINC000875151057	FD	On-Demand	Anodyne	P2RX7	25	43
COC(=O)N(C)NC(=O)N[C@H](C)c1ccc(OCC(F)(F)F)cc1	ZINC000875151075	EF	On-Demand	Reactive	ACACA	24	40
COC(=O)N(C)NC(=O)N[C@H](C)c1ccc(OCC(F)(F)F)cc1	ZINC000875151075	EF	On-Demand	Reactive	ACACB	25	41
COC(=O)N(C)NC(=O)N[C@@H](C)c1ccc(OCC(F)(F)F)cc1	ZINC000875151076	EF	On-Demand	Reactive	ACACA	24	40
COC(=O)N(C)NC(=O)N[C@@H](C)c1ccc(OCC(F)(F)F)cc1	ZINC000875151076	EF	On-Demand	Reactive	ACACB	25	41
CONC(=O)C1CCN(C(=O)NCc2ccc(F)c(F)c2)CC1	ZINC000875151079	ED	On-Demand	Anodyne	EPHX2	31	49
O=C(NCc1nc2cc(Cl)ccc2s1)N1CCC(CO)(CO)CC1	ZINC000875151132	FE	On-Demand	Anodyne	AKR1B1	16	45
O=C(NCc1cccc(C(=O)N2CCOCC2)c1)N1Cc2cccc(O)c2C1	ZINC000875151136	GE	On-Demand	Clean	NAMPT	22	40
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OC(C)(C)C)cc1	ZINC000875151139	DG	On-Demand	Anodyne	ANPEP	18	45
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OC(C)(C)C)cc1	ZINC000875151139	DG	On-Demand	Anodyne	PDS	48	34
CONC(=O)C1CCN(C(=O)NCc2ccc(OC(C)(C)C)cc2)CC1	ZINC000875151185	FE	On-Demand	Anodyne	EPHX2	29	43
O=C(NCC(=O)N1CCN(c2ccccc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875151328	GC	On-Demand	Anodyne	ADAM10	36	40
CS(=O)(=O)N1CCC[C@H](NC(=O)N2CCC[C@](O)(c3ccccc3)C2)C1	ZINC000875151399	GD	On-Demand	Anodyne	EPHX2	19	48
CS(=O)(=O)N1CCC[C@H](NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)C1	ZINC000875151401	GD	On-Demand	Anodyne	EPHX2	19	48
O=C(NCC1CCN(Cc2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875151420	FG	On-Demand	Clean	CHRM2	17	43
O=C(NCC1CCN(Cc2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875151420	FG	On-Demand	Clean	DRD2	28	47
O=C(NCC1CCN(Cc2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875151420	FG	On-Demand	Clean	DRD4	57	47
O=C(NCC1CCN(Cc2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875151420	FG	On-Demand	Clean	ACHE	59	49
O=C(NCC1CCN(Cc2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875151420	FG	On-Demand	Clean	DRD3	16	41
O=C(NCC1CCN(Cc2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875151420	FG	On-Demand	Clean	HTR4	48	45
O=C(NCC1CCN(Cc2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875151420	FG	On-Demand	Clean	GRIN2B	48	38
O=C(NCC1CCN(Cc2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875151420	FG	On-Demand	Clean	SIGMAR1	68	48
O=C(NCC1CCN(Cc2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875151420	FG	On-Demand	Clean	CCR3	43	39
O=C(NCC1CCN(Cc2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875151420	FG	On-Demand	Clean	MCHR1	20	41
O=C(NCC1CCN(Cc2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875151420	FG	On-Demand	Clean	CACNA1G	33	40
O=C(NCC1CCN(Cc2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875151420	FG	On-Demand	Clean	CACNA1I	64	45
C[C@@H](O)C1CCN(C(=O)NC[C@H]2CCCO[C@H]2c2ccccc2)CC1	ZINC000875151423	EF	On-Demand	Anodyne	SMO	36	43
C[C@@H](O)C1CCN(C(=O)NC[C@@H]2CCCO[C@H]2c2ccccc2)CC1	ZINC000875151425	EF	On-Demand	Anodyne	SMO	36	43
O=C(NCCS(=O)(=O)Cc1ccccc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875151430	GD	On-Demand	Anodyne	SFRP1	56	32
O=C(NCCS(=O)(=O)Cc1ccccc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875151431	GD	On-Demand	Anodyne	SFRP1	56	32
O=C(NCc1ccc(Cn2cnc3ccccc32)cc1)C(=O)N[C@H]1CC12CCC2	ZINC000875151435	GF	On-Demand	Anodyne	NR1I2	40	33
O=C(NCc1ccc(Cn2cnc3ccccc32)cc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875151436	GF	On-Demand	Anodyne	NR1I2	40	33
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875151437	ED	On-Demand	Anodyne	CHRM2	24	46
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875151437	ED	On-Demand	Anodyne	CHRM1	19	41
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875151437	ED	On-Demand	Anodyne	DRD2	33	54
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875151437	ED	On-Demand	Anodyne	DRD4	66	54
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875151437	ED	On-Demand	Anodyne	ACHE	65	56
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875151437	ED	On-Demand	Anodyne	HRH1	21	43
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875151437	ED	On-Demand	Anodyne	DRD3	22	50
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875151437	ED	On-Demand	Anodyne	OPRK1	15	42
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875151437	ED	On-Demand	Anodyne	SLC6A3	24	46
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875151437	ED	On-Demand	Anodyne	HTR4	70	51
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875151437	ED	On-Demand	Anodyne	CHRM3	37	41
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875151437	ED	On-Demand	Anodyne	GRIN2B	65	38
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875151437	ED	On-Demand	Anodyne	LTA4H	32	41
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875151437	ED	On-Demand	Anodyne	HRH3	16	44
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875151437	ED	On-Demand	Anodyne	SIGMAR1	94	52
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875151437	ED	On-Demand	Anodyne	BCHE	20	46
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875151437	ED	On-Demand	Anodyne	CCR3	66	45
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875151437	ED	On-Demand	Anodyne	FAAH	15	42
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875151437	ED	On-Demand	Anodyne	EPHX2	15	66
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875151437	ED	On-Demand	Anodyne	MCHR1	34	44
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875151437	ED	On-Demand	Anodyne	CACNA1G	34	42
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875151437	ED	On-Demand	Anodyne	CACNA1I	72	46
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875151437	ED	On-Demand	Anodyne	NPFFR1	42	38
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(C2CCN(C)CC2)CC1	ZINC000875151444	GC	On-Demand	Anodyne	SLC6A5	18	41
O=CN1CCCN(C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875151447	FD	On-Demand	Anodyne	CHRM2	17	42
O=CN1CCCN(C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875151447	FD	On-Demand	Anodyne	DRD2	21	48
O=CN1CCCN(C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875151447	FD	On-Demand	Anodyne	DRD4	44	48
O=CN1CCCN(C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875151447	FD	On-Demand	Anodyne	ACHE	58	48
O=CN1CCCN(C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875151447	FD	On-Demand	Anodyne	DRD3	15	43
O=CN1CCCN(C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875151447	FD	On-Demand	Anodyne	HTR4	56	46
O=CN1CCCN(C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875151447	FD	On-Demand	Anodyne	CHRM3	19	40
O=CN1CCCN(C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875151447	FD	On-Demand	Anodyne	GRIN2B	45	36
O=CN1CCCN(C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875151447	FD	On-Demand	Anodyne	LTA4H	23	40
O=CN1CCCN(C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875151447	FD	On-Demand	Anodyne	HRH3	17	45
O=CN1CCCN(C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875151447	FD	On-Demand	Anodyne	SIGMAR1	68	46
O=CN1CCCN(C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875151447	FD	On-Demand	Anodyne	BCHE	17	44
O=CN1CCCN(C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875151447	FD	On-Demand	Anodyne	CCR3	42	48
O=CN1CCCN(C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875151447	FD	On-Demand	Anodyne	FAAH	26	42
O=CN1CCCN(C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875151447	FD	On-Demand	Anodyne	MCHR1	20	40
O=CN1CCCN(C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875151447	FD	On-Demand	Anodyne	CACNA1G	33	41
O=CN1CCCN(C(=O)NCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875151447	FD	On-Demand	Anodyne	CACNA1I	62	42
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875151459	GF	On-Demand	Anodyne	DRD2	16	44
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875151459	GF	On-Demand	Anodyne	DRD4	37	44
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875151459	GF	On-Demand	Anodyne	ACHE	52	46
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875151459	GF	On-Demand	Anodyne	HTR4	47	46
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875151459	GF	On-Demand	Anodyne	SIGMAR1	55	48
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875151459	GF	On-Demand	Anodyne	CCR3	40	39
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875151459	GF	On-Demand	Anodyne	CCR2	15	42
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875151459	GF	On-Demand	Anodyne	CACNA1G	30	41
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875151459	GF	On-Demand	Anodyne	CACNA1I	63	46
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875151460	GF	On-Demand	Anodyne	DRD2	16	44
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875151460	GF	On-Demand	Anodyne	DRD4	37	44
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875151460	GF	On-Demand	Anodyne	ACHE	52	46
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875151460	GF	On-Demand	Anodyne	HTR4	47	46
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875151460	GF	On-Demand	Anodyne	SIGMAR1	55	48
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875151460	GF	On-Demand	Anodyne	CCR3	40	39
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875151460	GF	On-Demand	Anodyne	CCR2	15	42
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875151460	GF	On-Demand	Anodyne	CACNA1G	30	41
O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875151460	GF	On-Demand	Anodyne	CACNA1I	63	46
O=C(NCC[C@@H]1CCSC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000875151474	GD	On-Demand	Anodyne	ACE	27	41
O=C(NCC[C@@H]1CCSC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000875151474	GD	On-Demand	Anodyne	ACHE	18	41
O=C(NCC[C@@H]1CCSC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000875151474	GD	On-Demand	Anodyne	MME	19	41
O=C(NCC[C@H]1CCSC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000875151475	GD	On-Demand	Anodyne	ACE	27	41
O=C(NCC[C@H]1CCSC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000875151475	GD	On-Demand	Anodyne	ACHE	18	41
O=C(NCC[C@H]1CCSC1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000875151475	GD	On-Demand	Anodyne	MME	19	41
O=C(NCC[C@@H]1CCSC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000875151476	GD	On-Demand	Anodyne	ACE	27	41
O=C(NCC[C@@H]1CCSC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000875151476	GD	On-Demand	Anodyne	ACHE	18	41
O=C(NCC[C@@H]1CCSC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000875151476	GD	On-Demand	Anodyne	MME	19	41
O=C(NCC[C@H]1CCSC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000875151477	GD	On-Demand	Anodyne	ACE	27	41
O=C(NCC[C@H]1CCSC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000875151477	GD	On-Demand	Anodyne	ACHE	18	41
O=C(NCC[C@H]1CCSC1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000875151477	GD	On-Demand	Anodyne	MME	19	41
C[C@]1(C(F)(F)F)CCN(C(=O)NCc2ccc(F)c(F)c2)C1	ZINC000875151488	DG	On-Demand	Anodyne	EPHX2	19	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](c2ccccc2)c2nccs2)C1	ZINC000875151489	FE	On-Demand	Anodyne	BIRC8	44	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](c2ccccc2)c2nccs2)C1	ZINC000875151490	FE	On-Demand	Anodyne	BIRC8	44	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](c2ccccc2)c2nccs2)C1	ZINC000875151491	FE	On-Demand	Anodyne	BIRC8	44	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](c2ccccc2)c2nccs2)C1	ZINC000875151492	FE	On-Demand	Anodyne	BIRC8	44	33
O=C(NCCS(=O)(=O)Cc1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875151512	GF	On-Demand	Anodyne	TMPRSS11D	50	32
O=C(NCCS(=O)(=O)Cc1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875151513	GF	On-Demand	Anodyne	TMPRSS11D	50	32
CN1CCN(C(=O)NCc2ccc(F)c(F)c2)CCC1(C)C	ZINC000875151517	DF	On-Demand	Anodyne	CACNA1H	49	36
CCCOc1ncccc1CNC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875151530	FH	On-Demand	Anodyne	EPHX2	19	48
CCCOc1ncccc1CNC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875151531	FH	On-Demand	Anodyne	EPHX2	19	48
O=C(NCC[C@H](O)C1CCCC1)NCc1cccc(C(=O)N2CCOCC2)c1	ZINC000875151539	GD	On-Demand	Anodyne	EPHX2	15	41
O=C(NCC[C@@H](O)C1CCCC1)NCc1cccc(C(=O)N2CCOCC2)c1	ZINC000875151540	GD	On-Demand	Anodyne	EPHX2	15	41
COc1ccc(N2CCN(C(=O)C(=O)NCc3cscn3)CC2)c(OC)c1	ZINC000875151552	GD	On-Demand	Clean	DRD4	40	32
COc1ccc(N2CCN(C(=O)C(=O)NCc3cscn3)CC2)c(OC)c1	ZINC000875151552	GD	On-Demand	Clean	DRD3	47	36
COc1ccc(N2CCN(C(=O)C(=O)NCc3cscn3)CC2)c(OC)c1	ZINC000875151552	GD	On-Demand	Clean	PDGFRB	42	36
Cn1nnnc1C1CCN(C(=O)NCc2ccc(OC(C)(C)C)cc2)CC1	ZINC000875151555	FE	On-Demand	Anodyne	EPHX2	15	40
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CN(C(=O)C(=O)NCc1cscn1)C2	ZINC000875151615	GD	On-Demand	Anodyne	GPR119	30	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	ACE	40	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	OPRM1	42	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	OPRD1	40	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	MME	110	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	ANPEP	86	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	CTRA_BOVIN	42	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	FCER2	101	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	MAPK14	25	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	KLK3	74	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	CTSB	87	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	PAPA1_CARPA	88	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	CYSP_TRYCR	73	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	CCKAR	48	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	CTSK	41	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	CTSL	75	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	TIMP3	85	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	CAPNS1	70	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	MMP2	24	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	MMP3	43	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	MMP8	30	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	GRIA1	48	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	HLA-DRB1	105	49
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	REN	39	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	MMP11	49	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	CTSS	36	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	CAPN1	107	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	MMP9	32	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	CAPN2	131	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	ACE2	51	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	PLAU	34	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	LAP3	42	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	MMP7	19	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	MMP1	46	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	FPR1	69	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	CTRB_BOVIN	65	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	NPR	61	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	BLA1_STEMA	48	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	ERAP2	59	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	NPFFR1	47	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000875151618	GF	On-Demand	Anodyne	GPR142	63	39
O=C(NC[C@H]1CCCCO1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875151671	EE	On-Demand	Anodyne	TNK2	41	37
Cn1nnnc1C1CCN(C(=O)NCc2ccc(F)c(F)c2)CC1	ZINC000875151720	ED	On-Demand	Anodyne	IL2RA	41	33
Cn1nnnc1C1CCN(C(=O)NCc2ccc(F)c(F)c2)CC1	ZINC000875151720	ED	On-Demand	Anodyne	CCR3	43	35
O=C(NCc1ccc(Oc2cccnc2)c(F)c1)N1CCC(CO)(CO)CC1	ZINC000875151731	GE	On-Demand	Anodyne	NAMPT	53	38
O=C(NCCCCC1CC1)C(=O)NCC(=O)N1CCN(c2ccccc2)CC1	ZINC000875151742	GD	On-Demand	Anodyne	HTR1A	22	47
O=C(NCCCCC1CC1)C(=O)NCC(=O)N1CCN(c2ccccc2)CC1	ZINC000875151742	GD	On-Demand	Anodyne	DRD2	19	45
O=C(NCCCCC1CC1)C(=O)NCC(=O)N1CCN(c2ccccc2)CC1	ZINC000875151742	GD	On-Demand	Anodyne	HTR2A	19	44
O=C(NCCCCC1CC1)C(=O)NCC(=O)N1CCN(c2ccccc2)CC1	ZINC000875151742	GD	On-Demand	Anodyne	DRD3	32	45
O=C(NCCCCC1CC1)C(=O)NCC(=O)N1CCN(c2ccccc2)CC1	ZINC000875151742	GD	On-Demand	Anodyne	SSTR1	40	37
O=C(NCCCCC1CC1)C(=O)NCC(=O)N1CCN(c2ccccc2)CC1	ZINC000875151742	GD	On-Demand	Anodyne	ADAM10	36	44
O=C(NCCCCC1CC1)C(=O)NCC(=O)N1CCN(c2ccccc2)CC1	ZINC000875151742	GD	On-Demand	Anodyne	SCD	19	43
C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875151750	GF	On-Demand	Anodyne	P2RX7	25	48
C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875151752	GF	On-Demand	Anodyne	P2RX7	25	48
O=C(NCc1ccc(F)c(F)c1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875151771	DG	On-Demand	Anodyne	SSTR3	16	42
O=C(NCc1ccc(F)c(F)c1)NC1([C@H]2CCCCO2)CCC1	ZINC000875151773	DG	On-Demand	Anodyne	SSTR3	16	42
O=C(NCc1ccc(F)c(F)c1)N1Cc2cccnc2N2C[C@H](O)C[C@H]2C1	ZINC000875151775	FE	On-Demand	Anodyne	NAMPT	22	41
O=CN1CCCN(C(=O)N[C@H]2C[C@@H]2c2ccccc2)CC1	ZINC000875151782	CD	On-Demand	Anodyne	EPHX2	31	59
O=CN1CCCN(C(=O)N[C@H]2C[C@@H]2c2ccccc2)CC1	ZINC000875151782	CD	On-Demand	Anodyne	SMO	29	42
O=CN1CCCN(C(=O)N[C@H]2C[C@H]2c2ccccc2)CC1	ZINC000875151784	CD	On-Demand	Anodyne	EPHX2	31	59
O=CN1CCCN(C(=O)N[C@H]2C[C@H]2c2ccccc2)CC1	ZINC000875151784	CD	On-Demand	Anodyne	SMO	29	42
O=CN1CCCN(C(=O)N[C@@H]2C[C@@H]2c2ccccc2)CC1	ZINC000875151786	CD	On-Demand	Anodyne	EPHX2	31	59
O=CN1CCCN(C(=O)N[C@@H]2C[C@@H]2c2ccccc2)CC1	ZINC000875151786	CD	On-Demand	Anodyne	SMO	29	42
O=CN1CCCN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)CC1	ZINC000875151787	CD	On-Demand	Anodyne	EPHX2	31	59
O=CN1CCCN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)CC1	ZINC000875151787	CD	On-Demand	Anodyne	SMO	29	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCCS(=O)(=O)Cc2ccccc2)C1	ZINC000875151792	GD	On-Demand	Anodyne	ACE	25	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCCS(=O)(=O)Cc2ccccc2)C1	ZINC000875151792	GD	On-Demand	Anodyne	TMPRSS11D	43	33
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCc2ccc(F)c(F)c2)[C@@H](O)C1	ZINC000875151809	GE	On-Demand	Anodyne	GPR119	47	47
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NCc2ccc(F)c(F)c2)[C@@H](O)C1	ZINC000875151810	GE	On-Demand	Anodyne	GPR119	47	47
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCc2ccc(F)c(F)c2)[C@H](O)C1	ZINC000875151811	GE	On-Demand	Anodyne	GPR119	47	47
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NCc2ccc(F)c(F)c2)[C@H](O)C1	ZINC000875151813	GE	On-Demand	Anodyne	GPR119	47	47
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(-n2ccnc2)c(F)c1	ZINC000875151828	EE	On-Demand	Anodyne	NOS2	60	33
CN1CCCC[C@H](N(C)C(=O)NCCS(=O)(=O)Cc2ccccc2)C1=O	ZINC000875151841	GD	On-Demand	Anodyne	FKBP1A	33	40
CN1CCCC[C@H](N(C)C(=O)NCCS(=O)(=O)Cc2ccccc2)C1=O	ZINC000875151841	GD	On-Demand	Anodyne	CCR5	34	43
CN1CCCC[C@@H](N(C)C(=O)NCCS(=O)(=O)Cc2ccccc2)C1=O	ZINC000875151843	GD	On-Demand	Anodyne	FKBP1A	33	40
CN1CCCC[C@@H](N(C)C(=O)NCCS(=O)(=O)Cc2ccccc2)C1=O	ZINC000875151843	GD	On-Demand	Anodyne	CCR5	34	43
C[C@@H]1CN(C(=O)NCc2ccc(F)c(F)c2)CC[C@H](C(F)(F)F)O1	ZINC000875151852	FG	On-Demand	Anodyne	NPSR1	25	40
CN1CCN(C(=O)NCCS(=O)(=O)c2ccccc2)Cc2cccnc21	ZINC000875151856	FD	On-Demand	Anodyne	NAMPT	23	48
C[C@@H]1CN(C(=O)NCc2ccc(F)c(F)c2)CC[C@@H](C(F)(F)F)O1	ZINC000875151864	FG	On-Demand	Anodyne	NPSR1	25	40
N#CCc1ccsc1C(=O)N1CCC[C@H]1C(=O)NCc1ccco1	ZINC000875151870	EE	On-Demand	Mild	PREP	41	39
N#CCc1ccsc1C(=O)N1CCC[C@H]1C(=O)NCc1ccco1	ZINC000875151870	EE	On-Demand	Mild	LGMN	70	35
C[C@@H]1CCCC[C@@H]1CNC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875151871	EF	On-Demand	Anodyne	SMO	39	43
C[C@@H]1CCCC[C@@H]1CNC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875151871	EF	On-Demand	Anodyne	ETHR	47	39
N#CCc1ccsc1C(=O)N1CCC[C@@H]1C(=O)NCc1ccco1	ZINC000875151872	EE	On-Demand	Mild	PREP	41	39
N#CCc1ccsc1C(=O)N1CCC[C@@H]1C(=O)NCc1ccco1	ZINC000875151872	EE	On-Demand	Mild	LGMN	70	35
C[C@@H]1CCCC[C@H]1CNC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875151873	EF	On-Demand	Anodyne	SMO	39	43
C[C@@H]1CCCC[C@H]1CNC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875151873	EF	On-Demand	Anodyne	ETHR	47	39
C[C@@H]1CCCC[C@H]1CNC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875151875	EF	On-Demand	Anodyne	SMO	39	43
C[C@@H]1CCCC[C@H]1CNC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875151875	EF	On-Demand	Anodyne	ETHR	47	39
C[C@@H]1CCCC[C@@H]1CNC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875151877	EF	On-Demand	Anodyne	SMO	39	43
C[C@@H]1CCCC[C@@H]1CNC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875151877	EF	On-Demand	Anodyne	ETHR	47	39
O=C(NCCS(=O)(=O)Cc1ccccc1)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875151903	GF	On-Demand	Anodyne	CCR1	21	43
O=C(NCCS(=O)(=O)Cc1ccccc1)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875151903	GF	On-Demand	Anodyne	TMPRSS11D	53	32
O=C(NCCS(=O)(=O)Cc1ccccc1)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875151904	GF	On-Demand	Anodyne	CCR1	21	43
O=C(NCCS(=O)(=O)Cc1ccccc1)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875151904	GF	On-Demand	Anodyne	TMPRSS11D	53	32
COC(=O)[C@@]1(C)CN(C(=O)NCCS(=O)(=O)Cc2ccccc2)C[C@@H]1C	ZINC000875151912	GD	On-Demand	Anodyne	MMP3	15	41
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(F)c(F)c2)C1	ZINC000875151922	CE	On-Demand	Anodyne	EPHX2	16	49
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(F)c(F)c2)C1	ZINC000875151922	CE	On-Demand	Anodyne	DPP7	62	37
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(F)c(F)c2)C1	ZINC000875151923	CE	On-Demand	Anodyne	EPHX2	16	49
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(F)c(F)c2)C1	ZINC000875151923	CE	On-Demand	Anodyne	DPP7	62	37
O=C(NCc1ccc(F)c(F)c1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875151930	EF	On-Demand	Anodyne	EPHX2	15	41
O=C(NCc1ccc(F)c(F)c1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875151931	EF	On-Demand	Anodyne	EPHX2	15	41
CN1CCN(C2CCN(C(=O)NCc3ccc(F)c(F)c3)CC2)CC1	ZINC000875151937	FD	On-Demand	Anodyne	CCR3	21	40
CN1CCN(C2CCN(C(=O)NCc3ccc(F)c(F)c3)CC2)CC1	ZINC000875151937	FD	On-Demand	Anodyne	EPHX2	18	41
CN1CCN(C2CCN(C(=O)NCc3ccc(F)c(F)c3)CC2)CC1	ZINC000875151937	FD	On-Demand	Anodyne	L3MBTL3	98	43
CN1CCN(C2CCN(C(=O)NCc3ccc(F)c(F)c3)CC2)CC1	ZINC000875151937	FD	On-Demand	Anodyne	NAMPT	24	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCS(=O)(=O)c1ccccc1	ZINC000875151956	FD	On-Demand	Anodyne	SLC6A4	23	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCS(=O)(=O)c1ccccc1	ZINC000875151956	FD	On-Demand	Anodyne	SLC6A3	48	41
Cc1nnc(NNC(=O)NCC2CCN(Cc3ccccc3)CC2)n1C	ZINC000875151971	FD	On-Demand	Reactive	DRD2	23	49
Cc1nnc(NNC(=O)NCC2CCN(Cc3ccccc3)CC2)n1C	ZINC000875151971	FD	On-Demand	Reactive	DRD4	49	49
Cc1nnc(NNC(=O)NCC2CCN(Cc3ccccc3)CC2)n1C	ZINC000875151971	FD	On-Demand	Reactive	ACHE	59	49
Cc1nnc(NNC(=O)NCC2CCN(Cc3ccccc3)CC2)n1C	ZINC000875151971	FD	On-Demand	Reactive	DRD3	17	44
Cc1nnc(NNC(=O)NCC2CCN(Cc3ccccc3)CC2)n1C	ZINC000875151971	FD	On-Demand	Reactive	HTR4	59	49
Cc1nnc(NNC(=O)NCC2CCN(Cc3ccccc3)CC2)n1C	ZINC000875151971	FD	On-Demand	Reactive	SIGMAR1	55	45
Cc1nnc(NNC(=O)NCC2CCN(Cc3ccccc3)CC2)n1C	ZINC000875151971	FD	On-Demand	Reactive	SSTR5	48	34
Cc1nnc(NNC(=O)NCC2CCN(Cc3ccccc3)CC2)n1C	ZINC000875151971	FD	On-Demand	Reactive	BCHE	18	41
Cc1nnc(NNC(=O)NCC2CCN(Cc3ccccc3)CC2)n1C	ZINC000875151971	FD	On-Demand	Reactive	CCR3	51	45
Cc1nnc(NNC(=O)NCC2CCN(Cc3ccccc3)CC2)n1C	ZINC000875151971	FD	On-Demand	Reactive	CACNA1I	63	43
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NCc3cscn3)C2)c1	ZINC000875152048	GD	On-Demand	Anodyne	SCN5A	19	41
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NCc3cscn3)C2)c1	ZINC000875152049	GD	On-Demand	Anodyne	SCN5A	19	41
CN1CCN(C2CCN(C(=O)C(=O)NCc3cccc4cccnc34)CC2)CC1	ZINC000875152074	GD	On-Demand	Anodyne	L3MBTL3	41	37
COC(=O)N1CCC[C@H](NC(=O)C(=O)NCc2cccc(F)c2F)C1	ZINC000875152111	FC	On-Demand	Anodyne	P2RX7	40	38
COC(=O)N(C)NC(=O)N[C@@H]1C[C@@H]1c1ccccc1	ZINC000875152140	CD	On-Demand	Reactive	EPHX2	24	48
COC(=O)N(C)NC(=O)N[C@H]1C[C@@H]1c1ccccc1	ZINC000875152141	CD	On-Demand	Reactive	EPHX2	24	48
COC(=O)N(C)NC(=O)N[C@H]1C[C@H]1c1ccccc1	ZINC000875152142	CD	On-Demand	Reactive	EPHX2	24	48
COC(=O)N(C)NC(=O)N[C@@H]1C[C@H]1c1ccccc1	ZINC000875152143	CD	On-Demand	Reactive	EPHX2	24	48
O=C(NCc1ccc(-n2ccnc2)c(F)c1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875152220	FF	On-Demand	Anodyne	NOS2	86	33
N#Cc1ccc(N2CCN(C(=O)NCCS(=O)(=O)c3ccccc3)CC2)cc1	ZINC000875152230	GD	On-Demand	Mild	ITGA4	15	44
O=C(N[C@H]1C[C@@H]1c1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875152250	DD	On-Demand	Anodyne	EPHX2	39	63
O=C(N[C@H]1C[C@@H]1c1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875152250	DD	On-Demand	Anodyne	KDM1A	42	34
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@H]2CCCCO2)CC1	ZINC000875152262	EH	On-Demand	Anodyne	DRD2	18	46
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@H]2CCCCO2)CC1	ZINC000875152262	EH	On-Demand	Anodyne	SMO	32	40
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@H]2CCCCO2)CC1	ZINC000875152264	EH	On-Demand	Anodyne	DRD2	18	46
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@H]2CCCCO2)CC1	ZINC000875152264	EH	On-Demand	Anodyne	SMO	32	40
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@@H]2CCCCO2)CC1	ZINC000875152266	EH	On-Demand	Anodyne	DRD2	18	46
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@@H]2CCCCO2)CC1	ZINC000875152266	EH	On-Demand	Anodyne	SMO	32	40
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@@H]2CCCCO2)CC1	ZINC000875152269	EH	On-Demand	Anodyne	DRD2	18	46
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@@H]2CCCCO2)CC1	ZINC000875152269	EH	On-Demand	Anodyne	SMO	32	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cscn1	ZINC000875152276	GE	On-Demand	Anodyne	DRD2	21	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cscn1	ZINC000875152276	GE	On-Demand	Anodyne	DRD4	43	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cscn1	ZINC000875152276	GE	On-Demand	Anodyne	ACHE	63	63
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cscn1	ZINC000875152276	GE	On-Demand	Anodyne	DRD3	17	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cscn1	ZINC000875152276	GE	On-Demand	Anodyne	HTR4	16	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cscn1	ZINC000875152276	GE	On-Demand	Anodyne	GRIN2B	43	37
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cscn1	ZINC000875152276	GE	On-Demand	Anodyne	SIGMAR1	58	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cscn1	ZINC000875152276	GE	On-Demand	Anodyne	BCHE	18	48
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cscn1	ZINC000875152276	GE	On-Demand	Anodyne	CCR3	35	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cscn1	ZINC000875152276	GE	On-Demand	Anodyne	SCN5A	63	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cscn1	ZINC000875152276	GE	On-Demand	Anodyne	MCHR1	21	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cscn1	ZINC000875152276	GE	On-Demand	Anodyne	SIRT3	52	33
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cscn1	ZINC000875152276	GE	On-Demand	Anodyne	SIRT2	53	34
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cscn1	ZINC000875152276	GE	On-Demand	Anodyne	SIRT1	52	33
CCCCCCCNC(=O)C(=O)NCc1cscn1	ZINC000875152286	CD	On-Demand	Mild	ASAH1	93	36
O=C(N[C@H]1C[C@H]1c1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875152296	DD	On-Demand	Anodyne	EPHX2	39	63
O=C(N[C@H]1C[C@H]1c1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875152296	DD	On-Demand	Anodyne	KDM1A	42	34
O=C(N[C@@H]1C[C@H]1c1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875152303	DD	On-Demand	Anodyne	EPHX2	39	63
O=C(N[C@@H]1C[C@H]1c1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875152303	DD	On-Demand	Anodyne	KDM1A	42	34
O=C(NC[C@H]1CCCO[C@H]1c1ccccc1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875152313	GE	On-Demand	Anodyne	RBP4	41	37
O=C(NC[C@H]1CCCO[C@@H]1c1ccccc1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875152318	GE	On-Demand	Anodyne	RBP4	41	37
O=C(NCc1ccc(Oc2cccnc2)c(F)c1)NC[C@@H]1CCC12CCOCC2	ZINC000875152331	GI	On-Demand	Anodyne	NAMPT	41	35
CN(C)C[C@@H]1CN(C(=O)NC[C@H]2CCCN2C)C[C@H]1CN(C)C	ZINC000875152342	EC	On-Demand	Anodyne	CHRNA10	41	33
CN(C)C[C@@H]1CN(C(=O)NC[C@@H]2CCCN2C)C[C@H]1CN(C)C	ZINC000875152343	EC	On-Demand	Anodyne	CHRNA10	41	33
O=C(NCc1ccc(Oc2cccnc2)c(F)c1)NC[C@H]1CCC12CCOCC2	ZINC000875152422	GI	On-Demand	Anodyne	NAMPT	41	35
COC(=O)C1(O)CN(C(=O)NCc2cc3ccccc3s2)C1	ZINC000875152467	DD	On-Demand	Anodyne	AROQ	28	42
O=C(NCc1cscn1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875152509	FE	On-Demand	Anodyne	C3AR1	37	40
O=C(NCc1cscn1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875152512	FE	On-Demand	Anodyne	C3AR1	37	40
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3ccc(-n4ccnc4)c(F)c3)C[C@@H]1C2	ZINC000875152520	FE	On-Demand	Anodyne	NOS2	98	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCCO[C@@H]1c1ccccc1	ZINC000875152522	FF	On-Demand	Anodyne	SLC6A4	21	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCCO[C@@H]1c1ccccc1	ZINC000875152522	FF	On-Demand	Anodyne	SLC6A3	44	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCCO[C@H]1c1ccccc1	ZINC000875152525	FF	On-Demand	Anodyne	SLC6A4	21	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCCO[C@H]1c1ccccc1	ZINC000875152525	FF	On-Demand	Anodyne	SLC6A3	44	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCCO[C@@H]1c1ccccc1	ZINC000875152536	FF	On-Demand	Anodyne	SLC6A4	21	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCCO[C@@H]1c1ccccc1	ZINC000875152536	FF	On-Demand	Anodyne	SLC6A3	44	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCCO[C@H]1c1ccccc1	ZINC000875152538	FF	On-Demand	Anodyne	SLC6A4	21	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCCO[C@H]1c1ccccc1	ZINC000875152538	FF	On-Demand	Anodyne	SLC6A3	44	40
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000875152566	GD	On-Demand	Reactive	HTR1A	165	52
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000875152566	GD	On-Demand	Reactive	ADRA2A	17	49
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000875152566	GD	On-Demand	Reactive	DRD2	135	52
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000875152566	GD	On-Demand	Reactive	DRD1	36	47
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000875152566	GD	On-Demand	Reactive	DRD4	72	52
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000875152566	GD	On-Demand	Reactive	ADRA1D	91	48
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000875152566	GD	On-Demand	Reactive	HTR1B	16	46
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000875152566	GD	On-Demand	Reactive	HTR2A	99	50
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000875152566	GD	On-Demand	Reactive	HTR2C	59	50
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000875152566	GD	On-Demand	Reactive	SLC6A4	33	50
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000875152566	GD	On-Demand	Reactive	ADRA1A	109	48
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000875152566	GD	On-Demand	Reactive	ADRA1B	76	48
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000875152566	GD	On-Demand	Reactive	DRD3	166	53
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000875152566	GD	On-Demand	Reactive	HTR4	30	43
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000875152566	GD	On-Demand	Reactive	DRD5	17	47
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000875152566	GD	On-Demand	Reactive	HTR7	135	49
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000875152566	GD	On-Demand	Reactive	SIGMAR1	15	51
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000875152566	GD	On-Demand	Reactive	HTR6	15	49
O=C1CCN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)CCCCCCN1	ZINC000875152591	EF	On-Demand	Anodyne	EPHX2	29	53
O=C1CCN(C(=O)N[C@@H]2C[C@@H]2c2ccccc2)CCCCCCN1	ZINC000875152592	EF	On-Demand	Anodyne	EPHX2	29	53
O=C1CCN(C(=O)N[C@H]2C[C@H]2c2ccccc2)CCCCCCN1	ZINC000875152593	EF	On-Demand	Anodyne	EPHX2	29	53
O=C1CCN(C(=O)N[C@H]2C[C@@H]2c2ccccc2)CCCCCCN1	ZINC000875152594	EF	On-Demand	Anodyne	EPHX2	29	53
CS(=O)(=O)N1CCC[C@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875152602	GC	On-Demand	Anodyne	DRD4	27	44
CS(=O)(=O)N1CCC[C@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875152602	GC	On-Demand	Anodyne	SIGMAR1	32	42
CS(=O)(=O)N1CCC[C@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875152602	GC	On-Demand	Anodyne	CCR3	18	42
CS(=O)(=O)N1CCC[C@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875152602	GC	On-Demand	Anodyne	EPHX2	16	45
CS(=O)(=O)N1CCC[C@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875152602	GC	On-Demand	Anodyne	BIRC2	40	42
COCCN(CC1CCN(C)CC1)C(=O)NC[C@@H]1CCCN1C	ZINC000875152614	ED	On-Demand	Anodyne	CHRNA10	52	33
COCCN(CC1CCN(C)CC1)C(=O)NC[C@@H]1CCCN1C	ZINC000875152614	ED	On-Demand	Anodyne	ACKR3	65	34
COCCN(CC1CCN(C)CC1)C(=O)NC[C@H]1CCCN1C	ZINC000875152615	ED	On-Demand	Anodyne	CHRNA10	52	33
COCCN(CC1CCN(C)CC1)C(=O)NC[C@H]1CCCN1C	ZINC000875152615	ED	On-Demand	Anodyne	ACKR3	65	34
O=C(NCCCCCCc1ccccc1)C(=O)NCc1cscn1	ZINC000875152625	EF	On-Demand	Anodyne	SIGMAR1	15	42
O=C(NCCCCCCc1ccccc1)C(=O)NCc1cscn1	ZINC000875152625	EF	On-Demand	Anodyne	FAAH	70	45
O=C(NCCCCCCc1ccccc1)C(=O)NCc1cscn1	ZINC000875152625	EF	On-Demand	Anodyne	SLC6A5	22	41
O=C(NCCCCCCc1ccccc1)C(=O)NCc1cscn1	ZINC000875152625	EF	On-Demand	Anodyne	CES1	71	42
O=C(NCCCCCCc1ccccc1)C(=O)NCc1cscn1	ZINC000875152625	EF	On-Demand	Anodyne	AMP1_PLAFQ	25	45
O=C(NCCCCCCc1ccccc1)C(=O)NCc1cscn1	ZINC000875152625	EF	On-Demand	Anodyne	GPR142	42	42
O=C(N[C@H]1C[C@@H]1c1ccccc1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875152644	ED	On-Demand	Anodyne	EPHX2	26	49
O=C(N[C@@H]1C[C@H]1c1ccccc1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875152645	ED	On-Demand	Anodyne	EPHX2	26	49
O=C(N[C@H]1C[C@H]1c1ccccc1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875152646	ED	On-Demand	Anodyne	EPHX2	26	49
O=C(NC[C@H]1CCCO[C@H]1c1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875152649	FD	On-Demand	Anodyne	SMO	26	43
CO[C@@H]1C[C@@H]2CN(C(=O)NC[C@H]3CCCN3C)Cc3cccnc3N2C1	ZINC000875152695	FD	On-Demand	Anodyne	CHRNA10	63	37
CO[C@@H]1C[C@@H]2CN(C(=O)NC[C@@H]3CCCN3C)Cc3cccnc3N2C1	ZINC000875152696	FD	On-Demand	Anodyne	CHRNA10	63	37
O=C(NC[C@H]1CCCO[C@@H]1c1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875152698	FD	On-Demand	Anodyne	SMO	26	43
O=C(N[C@H]1C[C@H]1c1ccccc1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875152710	EG	On-Demand	Anodyne	EPHX2	26	52
O=C(N[C@H]1C[C@H]1c1ccccc1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875152710	EG	On-Demand	Anodyne	SMO	25	40
O=C(N[C@@H]1C[C@H]1c1ccccc1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875152713	EG	On-Demand	Anodyne	EPHX2	26	52
O=C(N[C@@H]1C[C@H]1c1ccccc1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875152713	EG	On-Demand	Anodyne	SMO	25	40
O=C(N[C@H]1C[C@@H]1c1ccccc1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875152718	EG	On-Demand	Anodyne	EPHX2	26	52
O=C(N[C@H]1C[C@@H]1c1ccccc1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875152718	EG	On-Demand	Anodyne	SMO	25	40
O=C1CCN(C(=O)NCc2ccc(-n3ccnc3)c(F)c2)CCCCCCN1	ZINC000875152751	GF	On-Demand	Anodyne	NOS2	96	37
CS(=O)(=O)N1CCC[C@H](NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000875152763	GC	On-Demand	Anodyne	EPHX2	21	43
CS(=O)(=O)N1CCC[C@H](NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000875152765	GC	On-Demand	Anodyne	EPHX2	21	43
CCN(C)C(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875152773	CG	On-Demand	Anodyne	HSD17B2	28	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCC(=O)Nc2ccc(OCC)cc2)C1	ZINC000875152797	GD	On-Demand	Anodyne	NR5A1	15	42
N#Cc1ccc(Cn2cc(NC(=O)NC[C@@H]3CCCCO3)cn2)cc1	ZINC000875152805	EE	On-Demand	Mild	ITK	28	48
N#Cc1ccc(Cn2cc(NC(=O)NC[C@@H]3CCCCO3)cn2)cc1	ZINC000875152805	EE	On-Demand	Mild	PANC	59	40
N#Cc1ccc(Cn2cc(NC(=O)NC[C@H]3CCCCO3)cn2)cc1	ZINC000875152806	EE	On-Demand	Mild	ITK	28	48
N#Cc1ccc(Cn2cc(NC(=O)NC[C@H]3CCCCO3)cn2)cc1	ZINC000875152806	EE	On-Demand	Mild	PANC	59	40
COC(=O)C1(O)CN(C(=O)N[C@H]2C[C@@H]2c2ccccc2)C1	ZINC000875152826	CC	On-Demand	Anodyne	EPHX2	29	57
COC(=O)C1(O)CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C1	ZINC000875152827	CC	On-Demand	Anodyne	EPHX2	29	57
COC(=O)C1(O)CN(C(=O)N[C@H]2C[C@H]2c2ccccc2)C1	ZINC000875152828	CC	On-Demand	Anodyne	EPHX2	29	57
COC(=O)C1(O)CN(C(=O)N[C@@H]2C[C@@H]2c2ccccc2)C1	ZINC000875152829	CC	On-Demand	Anodyne	EPHX2	29	57
O=C(NCC[C@@H](O)C1CCCC1)NCc1ccc(-n2ccnc2)c(F)c1	ZINC000875152854	FF	On-Demand	Anodyne	NOS2	96	35
O=C(NCC[C@H](O)C1CCCC1)NCc1ccc(-n2ccnc2)c(F)c1	ZINC000875152855	FF	On-Demand	Anodyne	NOS2	96	35
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3C[C@@H]3c3ccccc3)C[C@@H]1C2	ZINC000875152856	DE	On-Demand	Anodyne	EPHX2	28	53
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3C[C@H]3c3ccccc3)C[C@@H]1C2	ZINC000875152857	DE	On-Demand	Anodyne	EPHX2	28	53
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3C[C@@H]3c3ccccc3)C[C@@H]1C2	ZINC000875152858	DE	On-Demand	Anodyne	EPHX2	28	53
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3C[C@H]3c3ccccc3)C[C@@H]1C2	ZINC000875152859	DE	On-Demand	Anodyne	EPHX2	28	53
CC[C@@H]1COCCN1CCNC(=O)NCc1ccc(-n2ccnc2)c(F)c1	ZINC000875152865	GD	On-Demand	Anodyne	NOS2	100	41
O=C(NCc1ccc(-n2ccnc2)c(F)c1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875152874	EF	On-Demand	Anodyne	NOS2	82	33
O=C(NCc1ccc(-n2ccnc2)c(F)c1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875152875	EF	On-Demand	Anodyne	NOS2	82	33
O=C(NCc1ccc(-n2ccnc2)c(F)c1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875152876	EF	On-Demand	Anodyne	NOS2	82	33
O=C(NCc1ccc(-n2ccnc2)c(F)c1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875152877	EF	On-Demand	Anodyne	NOS2	82	33
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)N[C@@H]1C[C@@H]1c1ccccc1	ZINC000875152879	EF	On-Demand	Anodyne	EPHX2	19	42
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)N[C@@H]1C[C@H]1c1ccccc1	ZINC000875152880	EF	On-Demand	Anodyne	EPHX2	19	42
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)N[C@H]1C[C@H]1c1ccccc1	ZINC000875152881	EF	On-Demand	Anodyne	EPHX2	19	42
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)N[C@H]1C[C@@H]1c1ccccc1	ZINC000875152882	EF	On-Demand	Anodyne	EPHX2	19	42
O=C(N[C@@H]1C[C@H]1c1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875152883	EH	On-Demand	Anodyne	EPHX2	46	76
O=C(N[C@@H]1C[C@H]1c1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875152884	EH	On-Demand	Anodyne	EPHX2	46	76
O=C(NCc1nc2cc(Cl)ccc2s1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875152891	GG	On-Demand	Anodyne	AKR1B1	15	45
O=C(NCc1nc2cc(Cl)ccc2s1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875152895	GG	On-Demand	Anodyne	AKR1B1	15	45
CC(=O)C1CCN(C(=O)NCc2ccc(OC(C)(C)C)cc2)CC1	ZINC000875152974	EG	On-Demand	Anodyne	EPHX2	31	43
CC[C@]1(C(=O)Nc2cc(C(=O)NC)ccc2C)CCNC1=O	ZINC000875152994	DD	On-Demand	Anodyne	MAPK11	21	42
CC[C@]1(C(=O)Nc2cc(C(=O)NC)ccc2C)CCNC1=O	ZINC000875152994	DD	On-Demand	Anodyne	MAPK14	26	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nc2cc(Cl)ccc2s1	ZINC000875153019	GG	On-Demand	Anodyne	SLC6A3	47	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nc2cc(Cl)ccc2s1	ZINC000875153020	GG	On-Demand	Anodyne	SLC6A3	47	38
O=C(N[C@@]1(C(=O)N2CCOc3ccccc32)CCOC1)OCc1ccccc1	ZINC000875153054	GE	On-Demand	Anodyne	SLC12A5	42	35
O=C(N[C@]1(C(=O)N2CCOc3ccccc32)CCOC1)OCc1ccccc1	ZINC000875153055	GE	On-Demand	Anodyne	SLC12A5	42	35
Cc1cncc([C@H]2CCCN2C(=O)NCCS(=O)(=O)c2ccccc2)c1	ZINC000875153070	FF	On-Demand	Anodyne	SFRP1	54	35
Cc1cncc([C@H]2CCCN2C(=O)NCCS(=O)(=O)c2ccccc2)c1	ZINC000875153070	FF	On-Demand	Anodyne	WNT3	57	35
Cc1cncc([C@@H]2CCCN2C(=O)NCCS(=O)(=O)c2ccccc2)c1	ZINC000875153071	FF	On-Demand	Anodyne	SFRP1	54	35
Cc1cncc([C@@H]2CCCN2C(=O)NCCS(=O)(=O)c2ccccc2)c1	ZINC000875153071	FF	On-Demand	Anodyne	WNT3	57	35
CO[C@@H]1C[C@@H]2CN(C(=O)N[C@@H]3C[C@@H]3c3ccccc3)Cc3cccnc3N2C1	ZINC000875153131	GF	On-Demand	Anodyne	EPHX2	24	50
CO[C@@H]1C[C@@H]2CN(C(=O)N[C@H]3C[C@@H]3c3ccccc3)Cc3cccnc3N2C1	ZINC000875153133	GF	On-Demand	Anodyne	EPHX2	24	50
N#CCc1ccsc1C(=O)N1CCCc2cc(Cl)ccc21	ZINC000875153134	DI	On-Demand	Mild	CNR1	53	33
N#CCc1ccsc1C(=O)N1CCCc2cc(Cl)ccc21	ZINC000875153134	DI	On-Demand	Mild	AVPR2	33	47
CO[C@@H]1C[C@@H]2CN(C(=O)N[C@@H]3C[C@H]3c3ccccc3)Cc3cccnc3N2C1	ZINC000875153135	GF	On-Demand	Anodyne	EPHX2	24	50
CO[C@@H]1C[C@@H]2CN(C(=O)N[C@H]3C[C@H]3c3ccccc3)Cc3cccnc3N2C1	ZINC000875153136	GF	On-Demand	Anodyne	EPHX2	24	50
CCN(CC)C(=O)CNC(=O)NNc1cccc(C)n1	ZINC000875153162	CC	On-Demand	Reactive	GRM5	19	40
CN1CCN(C(=O)NCc2ccc(-n3ccnc3)c(F)c2)CCC1(C)C	ZINC000875153180	FF	On-Demand	Anodyne	NOS2	88	37
COC[C@H](NC(=O)C(=O)NCCCCC1CC1)c1ccccc1	ZINC000875153203	DE	On-Demand	Anodyne	TACR3	17	40
COC[C@@H](NC(=O)C(=O)NCCCCC1CC1)c1ccccc1	ZINC000875153204	DE	On-Demand	Anodyne	TACR3	17	40
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(NC(=O)CC(C)C)c1	ZINC000875153221	EG	On-Demand	Anodyne	ANPEP	20	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(NC(=O)CC(C)C)c1	ZINC000875153221	EG	On-Demand	Anodyne	PDS	41	31
COC[C@H](NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875153231	ED	On-Demand	Anodyne	AMY2	45	31
COC[C@H](NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875153231	ED	On-Demand	Anodyne	GHSR	17	40
COC[C@H](NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875153232	ED	On-Demand	Anodyne	AMY2	45	31
COC[C@H](NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875153232	ED	On-Demand	Anodyne	GHSR	17	40
O=C(NCc1ccc(-n2ccnc2)c(F)c1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875153239	GF	On-Demand	Anodyne	NOS2	104	39
O=C(NCc1ccc(-n2ccnc2)c(F)c1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875153240	GF	On-Demand	Anodyne	NOS2	104	39
O=C(NCc1cccc(C(=O)N2CCOCC2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875153268	EC	On-Demand	Anodyne	EPHX2	17	47
COC(=O)N(C)NC(=O)NC[C@H]1CCCN1C	ZINC000875153276	BB	On-Demand	Reactive	CHRNA10	44	32
COC(=O)N(C)NC(=O)NC[C@H]1CCCN1C	ZINC000875153276	BB	On-Demand	Reactive	ACKR3	61	31
COC(=O)N(C)NC(=O)NC[C@@H]1CCCN1C	ZINC000875153277	BB	On-Demand	Reactive	CHRNA10	44	32
COC(=O)N(C)NC(=O)NC[C@@H]1CCCN1C	ZINC000875153277	BB	On-Demand	Reactive	ACKR3	61	31
CN1CCN(C2CCN(C(=O)NCc3ccc(OC(C)(C)C)cc3)CC2)CC1	ZINC000875153300	GF	On-Demand	Anodyne	SLC6A5	22	41
CN1CCN(C2CCN(C(=O)NCc3ccc(OC(C)(C)C)cc3)CC2)CC1	ZINC000875153300	GF	On-Demand	Anodyne	EPHX2	22	40
CN1CCN(C2CCN(C(=O)NCc3ccc(OC(C)(C)C)cc3)CC2)CC1	ZINC000875153300	GF	On-Demand	Anodyne	L3MBTL3	85	41
CN1CCN(C2CCN(C(=O)NCc3ccc(OC(C)(C)C)cc3)CC2)CC1	ZINC000875153300	GF	On-Demand	Anodyne	NAMPT	24	41
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1cscn1)CC2	ZINC000875153314	GD	On-Demand	Anodyne	SLC18A2	46	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1cscn1)CC2	ZINC000875153315	GD	On-Demand	Anodyne	SLC18A2	46	34
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(OC(C)(C)C)cc2)C1	ZINC000875153327	EG	On-Demand	Anodyne	EPHX2	20	43
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(OC(C)(C)C)cc2)C1	ZINC000875153327	EG	On-Demand	Anodyne	DPP7	42	40
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(OC(C)(C)C)cc2)C1	ZINC000875153328	EG	On-Demand	Anodyne	EPHX2	20	43
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(OC(C)(C)C)cc2)C1	ZINC000875153328	EG	On-Demand	Anodyne	DPP7	42	40
COC[C@@H](NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875153358	ED	On-Demand	Anodyne	AMY2	45	31
COC[C@@H](NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875153358	ED	On-Demand	Anodyne	GHSR	17	40
COC[C@@H](NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875153360	ED	On-Demand	Anodyne	AMY2	45	31
COC[C@@H](NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875153360	ED	On-Demand	Anodyne	GHSR	17	40
CCCCCCCNC(=O)C(=O)NCc1cccc2cccnc12	ZINC000875153407	EF	On-Demand	Mild	ASAH1	73	34
O=C(NCCCc1cccc(C(F)(F)F)c1)NC[C@H]1C[C@H](O)C1	ZINC000875153446	EF	On-Demand	Anodyne	PTGFR	32	41
O=C(NCCCc1cccc(C(F)(F)F)c1)NC[C@H]1C[C@H](O)C1	ZINC000875153446	EF	On-Demand	Anodyne	PDS	37	43
Cc1ccc(N2CCCC2)c(C(=O)N2CCOc3ccccc32)c1	ZINC000875153465	DH	On-Demand	Anodyne	AVPR2	32	45
Cc1ccc(N2CCCC2)c(C(=O)N2CCOc3ccccc32)c1	ZINC000875153465	DH	On-Demand	Anodyne	KCNQ2	57	35
O=C(NCc1ccc(-n2ccnc2)c(F)c1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875153482	GD	On-Demand	Anodyne	NOS2	93	39
COC[C@H](NC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1)c1ccccc1	ZINC000875153485	ED	On-Demand	Anodyne	CCR5	17	41
COC[C@@H](NC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1)c1ccccc1	ZINC000875153487	ED	On-Demand	Anodyne	CCR5	17	41
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)N[C@@H]2C[C@H]2c2ccccc2)[C@H](O)C1	ZINC000875153547	GE	On-Demand	Anodyne	EPHX2	32	53
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)N[C@@H]2C[C@H]2c2ccccc2)[C@H](O)C1	ZINC000875153547	GE	On-Demand	Anodyne	GPR119	35	41
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)N[C@@H]2C[C@H]2c2ccccc2)[C@H](O)C1	ZINC000875153547	GE	On-Demand	Anodyne	SFRP1	18	40
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)N[C@@H]2C[C@H]2c2ccccc2)[C@@H](O)C1	ZINC000875153550	GE	On-Demand	Anodyne	EPHX2	32	53
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)N[C@@H]2C[C@H]2c2ccccc2)[C@@H](O)C1	ZINC000875153550	GE	On-Demand	Anodyne	GPR119	35	41
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)N[C@@H]2C[C@H]2c2ccccc2)[C@@H](O)C1	ZINC000875153550	GE	On-Demand	Anodyne	SFRP1	18	40
CCCCCCCNC(=O)C(=O)NCCn1ccnc1C	ZINC000875153552	CD	On-Demand	Mild	ASAH1	103	44
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)N[C@@H]2C[C@@H]2c2ccccc2)[C@@H](O)C1	ZINC000875153553	GE	On-Demand	Anodyne	EPHX2	32	53
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)N[C@@H]2C[C@@H]2c2ccccc2)[C@@H](O)C1	ZINC000875153553	GE	On-Demand	Anodyne	GPR119	35	41
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)N[C@@H]2C[C@@H]2c2ccccc2)[C@@H](O)C1	ZINC000875153553	GE	On-Demand	Anodyne	SFRP1	18	40
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)N[C@@H]2C[C@@H]2c2ccccc2)[C@H](O)C1	ZINC000875153556	GE	On-Demand	Anodyne	EPHX2	32	53
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)N[C@@H]2C[C@@H]2c2ccccc2)[C@H](O)C1	ZINC000875153556	GE	On-Demand	Anodyne	GPR119	35	41
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)N[C@@H]2C[C@@H]2c2ccccc2)[C@H](O)C1	ZINC000875153556	GE	On-Demand	Anodyne	SFRP1	18	40
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cc(C)on2)CC1	ZINC000875153573	EG	On-Demand	Anodyne	EPHX2	18	41
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cc(C)on2)CC1	ZINC000875153573	EG	On-Demand	Anodyne	RBP4	32	41
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cc(C)on2)CC1	ZINC000875153573	EG	On-Demand	Anodyne	SMO	33	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cc(C)on2)CC1	ZINC000875153575	EG	On-Demand	Anodyne	EPHX2	18	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cc(C)on2)CC1	ZINC000875153575	EG	On-Demand	Anodyne	RBP4	32	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cc(C)on2)CC1	ZINC000875153575	EG	On-Demand	Anodyne	SMO	33	42
O=CN1CCCN(C(=O)NCCCc2cccc(C(F)(F)F)c2)CC1	ZINC000875153583	FF	On-Demand	Anodyne	TACR1	15	42
O=CN1CCCN(C(=O)NCCCc2cccc(C(F)(F)F)c2)CC1	ZINC000875153583	FF	On-Demand	Anodyne	PDS	28	40
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C[C@H]1CN(C)C	ZINC000875153584	ED	On-Demand	Anodyne	EPHX2	30	55
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)C[C@H]1CN(C)C	ZINC000875153584	ED	On-Demand	Anodyne	KDM1A	38	40
CN(C)C[C@@H]1CN(C(=O)N[C@H]2C[C@@H]2c2ccccc2)C[C@H]1CN(C)C	ZINC000875153587	ED	On-Demand	Anodyne	EPHX2	30	55
CN(C)C[C@@H]1CN(C(=O)N[C@H]2C[C@@H]2c2ccccc2)C[C@H]1CN(C)C	ZINC000875153587	ED	On-Demand	Anodyne	KDM1A	38	40
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2C[C@@H]2c2ccccc2)C[C@H]1CN(C)C	ZINC000875153591	ED	On-Demand	Anodyne	EPHX2	30	55
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2C[C@@H]2c2ccccc2)C[C@H]1CN(C)C	ZINC000875153591	ED	On-Demand	Anodyne	KDM1A	38	40
CN(C)C[C@@H]1CN(C(=O)N[C@H]2C[C@H]2c2ccccc2)C[C@H]1CN(C)C	ZINC000875153595	ED	On-Demand	Anodyne	EPHX2	30	55
CN(C)C[C@@H]1CN(C(=O)N[C@H]2C[C@H]2c2ccccc2)C[C@H]1CN(C)C	ZINC000875153595	ED	On-Demand	Anodyne	KDM1A	38	40
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCn1ccnc1C)CC2	ZINC000875153597	GD	On-Demand	Anodyne	SLC18A2	45	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCn1ccnc1C)CC2	ZINC000875153603	GD	On-Demand	Anodyne	SLC18A2	45	34
COC[C@H](NC(=O)C(=O)NCCC1CCN(C(C)C)CC1)c1ccccc1	ZINC000875153606	GE	On-Demand	Anodyne	SLC6A3	16	41
COC[C@@H](NC(=O)C(=O)NCCC1CCN(C(C)C)CC1)c1ccccc1	ZINC000875153607	GE	On-Demand	Anodyne	SLC6A3	16	41
COc1ccc2c(C)c(CCC(=O)OCCC(N)=O)c(=O)oc2c1	ZINC000875153628	ED	On-Demand	Anodyne	MAOB	57	57
COc1ccc2c(C)c(CCC(=O)OCCC(N)=O)c(=O)oc2c1	ZINC000875153628	ED	On-Demand	Anodyne	NQO1	56	52
O=C(NCCO)C1CCN(C(=O)N[C@H]2C[C@@H]2c2ccccc2)CC1	ZINC000875153630	ED	On-Demand	Anodyne	EPHX2	50	60
O=C(NCCO)C1CCN(C(=O)N[C@H]2C[C@H]2c2ccccc2)CC1	ZINC000875153631	ED	On-Demand	Anodyne	EPHX2	50	60
O=C(NCCO)C1CCN(C(=O)N[C@@H]2C[C@@H]2c2ccccc2)CC1	ZINC000875153632	ED	On-Demand	Anodyne	EPHX2	50	60
O=C(NCCO)C1CCN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)CC1	ZINC000875153633	ED	On-Demand	Anodyne	EPHX2	50	60
O=C(NCc1ccc(Oc2cccnc2)c(F)c1)N1CCC2(CCNC2=O)CC1	ZINC000875153643	GF	On-Demand	Anodyne	CACNA1H	46	34
O=CN1CCCN(C(=O)NCc2ccc(-n3ccnc3)c(F)c2)CC1	ZINC000875153651	ED	On-Demand	Anodyne	NOS2	99	41
C[C@@H]1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)CC[C@@H](C(F)(F)F)O1	ZINC000875153658	EG	On-Demand	Anodyne	EPHX2	31	54
C[C@@H]1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2)CC[C@H](C(F)(F)F)O1	ZINC000875153659	EG	On-Demand	Anodyne	EPHX2	31	54
C[C@@H]1CN(C(=O)N[C@@H]2C[C@@H]2c2ccccc2)CC[C@@H](C(F)(F)F)O1	ZINC000875153660	EG	On-Demand	Anodyne	EPHX2	31	54
C[C@@H]1CN(C(=O)N[C@@H]2C[C@@H]2c2ccccc2)CC[C@H](C(F)(F)F)O1	ZINC000875153661	EG	On-Demand	Anodyne	EPHX2	31	54
CN1CCN(C2CCN(C(=O)NCCS(=O)(=O)c3ccccc3)CC2)CC1	ZINC000875153678	GC	On-Demand	Anodyne	L3MBTL3	74	42
O=C(NCc1ccc(Oc2cccnc2)c(F)c1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875153679	GH	On-Demand	Anodyne	CHRNA7	51	37
O=C(NCc1ccc(Oc2cccnc2)c(F)c1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875153679	GH	On-Demand	Anodyne	NAMPT	47	36
O=C(NCc1ccc(Oc2cccnc2)c(F)c1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875153680	GH	On-Demand	Anodyne	CHRNA7	51	37
O=C(NCc1ccc(Oc2cccnc2)c(F)c1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875153680	GH	On-Demand	Anodyne	NAMPT	47	36
O=C(NCc1ccc(Oc2cccnc2)c(F)c1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875153681	GH	On-Demand	Anodyne	CHRNA7	51	37
O=C(NCc1ccc(Oc2cccnc2)c(F)c1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875153681	GH	On-Demand	Anodyne	NAMPT	47	36
O=C(NCc1ccc(Oc2cccnc2)c(F)c1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875153682	GH	On-Demand	Anodyne	CHRNA7	51	37
O=C(NCc1ccc(Oc2cccnc2)c(F)c1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875153682	GH	On-Demand	Anodyne	NAMPT	47	36
O=C(N[C@@H]1CCOC[C@H]1O)N[C@@H]1C[C@@H]1c1ccccc1	ZINC000875153687	CC	On-Demand	Anodyne	EPHX2	25	53
O=C(N[C@H]1C[C@H]1c1ccccc1)N[C@@H]1CCOC[C@H]1O	ZINC000875153688	CC	On-Demand	Anodyne	EPHX2	25	53
O=C(N[C@H]1C[C@@H]1c1ccccc1)N[C@@H]1CCOC[C@H]1O	ZINC000875153689	CC	On-Demand	Anodyne	EPHX2	25	53
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(Oc3cccnc3)c(F)c2)C1	ZINC000875153691	FH	On-Demand	Anodyne	NAMPT	51	38
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(Oc3cccnc3)c(F)c2)C1	ZINC000875153692	FH	On-Demand	Anodyne	NAMPT	51	38
CCN(CC)C(=O)CNC(=O)N[C@@H]1Cc2ccccc2NC1=O	ZINC000875153701	DC	On-Demand	Anodyne	PYGM	15	43
CCN(CC)C(=O)CNC(=O)N[C@H]1Cc2ccccc2NC1=O	ZINC000875153703	DC	On-Demand	Anodyne	PYGM	15	43
CCN(CC)C(=O)CNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875153756	ED	On-Demand	Anodyne	PDS	55	41
CCN(CC)C(=O)CNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875153758	ED	On-Demand	Anodyne	PDS	55	41
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2cccc3cccnc23)C1	ZINC000875153774	ED	On-Demand	Anodyne	HCRTR1	26	45
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2cccc3cccnc23)C1	ZINC000875153774	ED	On-Demand	Anodyne	HCRTR2	33	45
CCN(CC)C(=O)CNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875153790	ED	On-Demand	Anodyne	SIGMAR1	20	46
CCN(CC)C(=O)CNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875153790	ED	On-Demand	Anodyne	FAAH	17	41
O=C(N1CCCc2cc(Cl)ccc21)C1(F)CCOCC1	ZINC000875153821	CG	On-Demand	Anodyne	AVPR2	16	49
COC[C@H](NC(=O)C(=O)N1CC[C@@H](c2nc(C)cs2)C1)c1ccccc1	ZINC000875153824	FE	On-Demand	Anodyne	P2RY12	41	31
COC[C@H](NC(=O)C(=O)N1CC[C@H](c2nc(C)cs2)C1)c1ccccc1	ZINC000875153825	FE	On-Demand	Anodyne	P2RY12	41	31
COC[C@@H](NC(=O)C(=O)N1CC[C@@H](c2nc(C)cs2)C1)c1ccccc1	ZINC000875153827	FE	On-Demand	Anodyne	P2RY12	41	31
COC[C@@H](NC(=O)C(=O)N1CC[C@H](c2nc(C)cs2)C1)c1ccccc1	ZINC000875153828	FE	On-Demand	Anodyne	P2RY12	41	31
COC[C@@H](NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1)c1ccccc1	ZINC000875153840	GF	On-Demand	Anodyne	PDE4A	16	45
COC[C@@H](NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1)c1ccccc1	ZINC000875153840	GF	On-Demand	Anodyne	C3AR1	41	43
COC[C@@H](NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1)c1ccccc1	ZINC000875153842	GF	On-Demand	Anodyne	PDE4A	16	45
COC[C@@H](NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1)c1ccccc1	ZINC000875153842	GF	On-Demand	Anodyne	C3AR1	41	43
COC[C@H](NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1)c1ccccc1	ZINC000875153843	GF	On-Demand	Anodyne	PDE4A	16	45
COC[C@H](NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1)c1ccccc1	ZINC000875153843	GF	On-Demand	Anodyne	C3AR1	41	43
COC[C@H](NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1)c1ccccc1	ZINC000875153845	GF	On-Demand	Anodyne	PDE4A	16	45
COC[C@H](NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1)c1ccccc1	ZINC000875153845	GF	On-Demand	Anodyne	C3AR1	41	43
CCN(CC)C(=O)CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875153967	EE	On-Demand	Anodyne	FKBP1A	48	40
CCN(CC)C(=O)CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875153967	EE	On-Demand	Anodyne	OPRD1	18	44
CCN(CC)C(=O)CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875153967	EE	On-Demand	Anodyne	CPT1A	52	40
CCN(CC)C(=O)CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875153968	EE	On-Demand	Anodyne	FKBP1A	48	40
CCN(CC)C(=O)CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875153968	EE	On-Demand	Anodyne	OPRD1	18	44
CCN(CC)C(=O)CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875153968	EE	On-Demand	Anodyne	CPT1A	52	40
CCN(CC)C(=O)CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875153969	EE	On-Demand	Anodyne	FKBP1A	48	40
CCN(CC)C(=O)CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875153969	EE	On-Demand	Anodyne	OPRD1	18	44
CCN(CC)C(=O)CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875153969	EE	On-Demand	Anodyne	CPT1A	52	40
CCN(CC)C(=O)CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875153970	EE	On-Demand	Anodyne	FKBP1A	48	40
CCN(CC)C(=O)CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875153970	EE	On-Demand	Anodyne	OPRD1	18	44
CCN(CC)C(=O)CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875153970	EE	On-Demand	Anodyne	CPT1A	52	40
CCN(CC)C(=O)CNC(=O)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875154009	GE	On-Demand	Anodyne	ABL1	15	44
COC[C@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccccc1	ZINC000875154015	GC	On-Demand	Anodyne	CHRM2	40	36
COC[C@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccccc1	ZINC000875154015	GC	On-Demand	Anodyne	CCR5	30	41
COC[C@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccccc1	ZINC000875154015	GC	On-Demand	Anodyne	L3MBTL3	59	39
COC[C@@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccccc1	ZINC000875154016	GC	On-Demand	Anodyne	CHRM2	40	36
COC[C@@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccccc1	ZINC000875154016	GC	On-Demand	Anodyne	CCR5	30	41
COC[C@@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccccc1	ZINC000875154016	GC	On-Demand	Anodyne	L3MBTL3	59	39
CCN(CC)C(=O)CNC(=O)N(Cc1cccc(O)c1)[C@@H]1CC[C@@H](O)CC1	ZINC000875154027	GE	On-Demand	Anodyne	HSD17B2	19	40
O=C(c1scnc1C(F)F)N1CCCc2cc(Cl)ccc21	ZINC000875154036	EI	On-Demand	Anodyne	CNR1	56	35
O=C(c1scnc1C(F)F)N1CCCc2cc(Cl)ccc21	ZINC000875154036	EI	On-Demand	Anodyne	AVPR2	21	50
O=C(NCCCc1cccc(C(F)(F)F)c1)N1CCC(CO)(CO)CC1	ZINC000875154037	FE	On-Demand	Anodyne	TACR1	24	43
O=C(NCCCc1cccc(C(F)(F)F)c1)N1CCC(CO)(CO)CC1	ZINC000875154037	FE	On-Demand	Anodyne	CCR2	50	38
O=C(NCCCc1cccc(C(F)(F)F)c1)N1CCC(CO)(CO)CC1	ZINC000875154037	FE	On-Demand	Anodyne	PDS	29	41
O=C(c1c(C(F)F)nc2n1CCCC2)N1CCCc2cc(Cl)ccc21	ZINC000875154038	FI	On-Demand	Anodyne	CNR1	54	34
O=C(c1c(C(F)F)nc2n1CCCC2)N1CCCc2cc(Cl)ccc21	ZINC000875154038	FI	On-Demand	Anodyne	AVPR2	29	53
COC[C@H](NC(=O)C(=O)N1CCC(C(C)=O)CC1)c1ccccc1	ZINC000875154077	ED	On-Demand	Anodyne	CCR5	28	42
COC[C@@H](NC(=O)C(=O)N1CCC(C(C)=O)CC1)c1ccccc1	ZINC000875154078	ED	On-Demand	Anodyne	CCR5	28	42
COC[C@H](NC(=O)C(=O)N1CCC(C)(N2CCCCC2)CC1)c1ccccc1	ZINC000875154090	GE	On-Demand	Anodyne	CCR5	48	38
COC[C@@H](NC(=O)C(=O)N1CCC(C)(N2CCCCC2)CC1)c1ccccc1	ZINC000875154091	GE	On-Demand	Anodyne	CCR5	48	38
COCCN1CCC(NC(=O)NNc2cccc(F)c2Cl)CC1	ZINC000875154101	EE	On-Demand	Reactive	DRD2	20	41
COCCN1CCC(NC(=O)NNc2cccc(F)c2Cl)CC1	ZINC000875154101	EE	On-Demand	Reactive	DRD3	22	40
COCCN1CCC(NC(=O)NNc2cccc(F)c2Cl)CC1	ZINC000875154101	EE	On-Demand	Reactive	HTR4	44	37
COCCN1CCC(NC(=O)NNc2cccc(F)c2Cl)CC1	ZINC000875154101	EE	On-Demand	Reactive	SIGMAR1	17	41
COCCN1CCC(NC(=O)NNc2cccc(F)c2Cl)CC1	ZINC000875154101	EE	On-Demand	Reactive	CCR3	26	40
C[C@@]1(C(=O)N2CCCc3cc(Cl)ccc32)CCC(=O)N1	ZINC000875154106	CE	On-Demand	Anodyne	CNR1	40	31
COC[C@@H](NC(=O)C(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccccc1	ZINC000875154107	GC	On-Demand	Anodyne	UTS2	37	40
COC[C@H](NC(=O)C(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccccc1	ZINC000875154108	GC	On-Demand	Anodyne	UTS2	37	40
COC(=O)N(C)NC(=O)NCCCc1cccc(C(F)(F)F)c1	ZINC000875154154	EF	On-Demand	Reactive	TACR1	15	45
COC(=O)N(C)NC(=O)NCCCc1cccc(C(F)(F)F)c1	ZINC000875154154	EF	On-Demand	Reactive	MTNR1A	23	44
COC(=O)N(C)NC(=O)NCCCc1cccc(C(F)(F)F)c1	ZINC000875154154	EF	On-Demand	Reactive	MTNR1B	21	44
COC(=O)N(C)NC(=O)NCCCc1cccc(C(F)(F)F)c1	ZINC000875154154	EF	On-Demand	Reactive	CRTM	40	39
COC(=O)N(C)NC(=O)NCCCc1cccc(C(F)(F)F)c1	ZINC000875154154	EF	On-Demand	Reactive	PDS	42	45
COC[C@H](NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1)c1ccccc1	ZINC000875154159	ED	On-Demand	Anodyne	SLC6A1	63	39
COC[C@H](NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1)c1ccccc1	ZINC000875154159	ED	On-Demand	Anodyne	CCR5	32	45
COC[C@H](NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1)c1ccccc1	ZINC000875154160	ED	On-Demand	Anodyne	SLC6A1	63	39
COC[C@H](NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1)c1ccccc1	ZINC000875154160	ED	On-Demand	Anodyne	CCR5	32	45
COC[C@@H](NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1)c1ccccc1	ZINC000875154161	ED	On-Demand	Anodyne	SLC6A1	63	39
COC[C@@H](NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1)c1ccccc1	ZINC000875154161	ED	On-Demand	Anodyne	CCR5	32	45
COC[C@@H](NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1)c1ccccc1	ZINC000875154162	ED	On-Demand	Anodyne	SLC6A1	63	39
COC[C@@H](NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1)c1ccccc1	ZINC000875154162	ED	On-Demand	Anodyne	CCR5	32	45
CCN(CC)C(=O)CNC(=O)N1CC(c2ccccc2)C1	ZINC000875154163	CD	On-Demand	Anodyne	RBP4	16	40
COC[C@H](NC(=O)C(=O)N1CC[C@H]2CSC[C@@H]2C1)c1ccccc1	ZINC000875154173	ED	On-Demand	Anodyne	CCR5	25	40
COC[C@H](NC(=O)C(=O)N1CC[C@@H]2CSC[C@H]2C1)c1ccccc1	ZINC000875154174	ED	On-Demand	Anodyne	CCR5	25	40
COC[C@H](NC(=O)C(=O)N1CC[C@@H]2CSC[C@@H]2C1)c1ccccc1	ZINC000875154175	ED	On-Demand	Anodyne	CCR5	25	40
COC[C@H](NC(=O)C(=O)N1CC[C@H]2CSC[C@H]2C1)c1ccccc1	ZINC000875154176	ED	On-Demand	Anodyne	CCR5	25	40
COC[C@@H](NC(=O)C(=O)N(C)C[C@@H](C)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000875154188	GD	On-Demand	Anodyne	FPR1	43	37
COC[C@@H](NC(=O)C(=O)N(C)C[C@H](C)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000875154189	GD	On-Demand	Anodyne	FPR1	43	37
COC[C@H](NC(=O)C(=O)N(C)C[C@H](C)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000875154190	GD	On-Demand	Anodyne	FPR1	43	37
COC[C@H](NC(=O)C(=O)N(C)C[C@@H](C)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000875154191	GD	On-Demand	Anodyne	FPR1	43	37
COC[C@@H](NC(=O)C(=O)N1CCC[C@H]1c1cncc(C)c1)c1ccccc1	ZINC000875154209	FF	On-Demand	Anodyne	CPT1A	42	34
COC[C@H](NC(=O)C(=O)N1CCC[C@H]1c1cncc(C)c1)c1ccccc1	ZINC000875154210	FF	On-Demand	Anodyne	CPT1A	42	34
COC[C@H](NC(=O)C(=O)N1CCC[C@@H]1c1cncc(C)c1)c1ccccc1	ZINC000875154211	FF	On-Demand	Anodyne	CPT1A	42	34
COC[C@@H](NC(=O)C(=O)N1CCC[C@@H]1c1cncc(C)c1)c1ccccc1	ZINC000875154212	FF	On-Demand	Anodyne	CPT1A	42	34
COC(=O)C1(O)CN(C(=O)NCCCc2cccc(C(F)(F)F)c2)C1	ZINC000875154225	FD	On-Demand	Anodyne	PDS	40	42
CCN(CC)C(=O)CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875154235	ED	On-Demand	Anodyne	OPRD1	18	42
CCN(CC)C(=O)CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875154236	ED	On-Demand	Anodyne	OPRD1	18	42
CCN(CC)C(=O)CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875154237	ED	On-Demand	Anodyne	OPRD1	18	42
CCN(CC)C(=O)CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875154238	ED	On-Demand	Anodyne	OPRD1	18	42
COC[C@@H](NC(=O)C(=O)N(C)CCN1CC2(CCOCC2)C1)c1ccccc1	ZINC000875154264	GD	On-Demand	Anodyne	CASR	47	38
COC[C@H](NC(=O)C(=O)N(C)CCN1CC2(CCOCC2)C1)c1ccccc1	ZINC000875154265	GD	On-Demand	Anodyne	CASR	47	38
CCN(CC)C(=O)CNC(=O)NNc1ccc(OC)cc1Br	ZINC000875154281	FD	On-Demand	Reactive	MTNR1A	42	36
CCN(CC)C(=O)CNC(=O)NCCc1ccc(OC)c(O)c1	ZINC000875154282	DD	On-Demand	Anodyne	INHA	95	38
CCN(CC)C(=O)CNC(=O)NCCc1ccc(OC)c(O)c1	ZINC000875154282	DD	On-Demand	Anodyne	MTNR1A	19	44
CCN(CC)C(=O)CNC(=O)NCCc1ccc(OC)c(O)c1	ZINC000875154282	DD	On-Demand	Anodyne	MTNR1B	15	44
COC[C@@H](NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21)c1ccccc1	ZINC000875154283	FD	On-Demand	Anodyne	FKBP1A	30	40
COC[C@H](NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21)c1ccccc1	ZINC000875154284	FD	On-Demand	Anodyne	FKBP1A	30	40
CCN(CC)C(=O)CNC(=O)N[C@@H](CCO)c1ccc(Cl)c(F)c1	ZINC000875154316	FE	On-Demand	Anodyne	UTS2	41	31
CCN(CC)C(=O)CNC(=O)N[C@H](CCO)c1ccc(Cl)c(F)c1	ZINC000875154317	FE	On-Demand	Anodyne	UTS2	41	31
COC(=O)N(C)NC(=O)NCc1cccc(NC(=O)CC(C)C)c1	ZINC000875154341	EE	On-Demand	Reactive	ANPEP	15	40
COCCN1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875154380	GG	On-Demand	Reactive	CHRM1	19	41
COCCN1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875154380	GG	On-Demand	Reactive	DRD2	28	46
COCCN1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875154380	GG	On-Demand	Reactive	TSHR	42	33
COCCN1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875154380	GG	On-Demand	Reactive	DRD4	35	46
COCCN1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875154380	GG	On-Demand	Reactive	ACHE	19	41
COCCN1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875154380	GG	On-Demand	Reactive	DRD3	25	46
COCCN1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875154380	GG	On-Demand	Reactive	KCNH2	25	42
COCCN1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875154380	GG	On-Demand	Reactive	LTA4H	77	57
COCCN1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875154380	GG	On-Demand	Reactive	HTR7	22	44
COCCN1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875154380	GG	On-Demand	Reactive	HRH3	32	41
COCCN1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875154380	GG	On-Demand	Reactive	SIGMAR1	40	47
COCCN1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875154380	GG	On-Demand	Reactive	CACNA1B	22	43
COCCN1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875154380	GG	On-Demand	Reactive	CCR3	34	41
COCCN1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875154380	GG	On-Demand	Reactive	ADAM17	37	42
COCCN1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875154380	GG	On-Demand	Reactive	SLC6A5	47	51
COCCN1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875154380	GG	On-Demand	Reactive	EPHX2	51	43
COCCN1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875154380	GG	On-Demand	Reactive	MCHR1	44	45
COCCN1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875154380	GG	On-Demand	Reactive	CCR8	19	41
COCCN1CCC(NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)CC1	ZINC000875154385	FD	On-Demand	Anodyne	CHRM1	15	42
COCCN1CCC(NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)CC1	ZINC000875154385	FD	On-Demand	Anodyne	SIGMAR1	25	42
COCCN1CCC(NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)CC1	ZINC000875154385	FD	On-Demand	Anodyne	CCR1	21	40
COCCN1CCC(NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)CC1	ZINC000875154385	FD	On-Demand	Anodyne	EPHX2	20	42
COCCN1CCC(NC(=O)N2CCC[C@](O)(c3ccccc3)C2)CC1	ZINC000875154386	FD	On-Demand	Anodyne	CHRM1	15	42
COCCN1CCC(NC(=O)N2CCC[C@](O)(c3ccccc3)C2)CC1	ZINC000875154386	FD	On-Demand	Anodyne	SIGMAR1	25	42
COCCN1CCC(NC(=O)N2CCC[C@](O)(c3ccccc3)C2)CC1	ZINC000875154386	FD	On-Demand	Anodyne	CCR1	21	40
COCCN1CCC(NC(=O)N2CCC[C@](O)(c3ccccc3)C2)CC1	ZINC000875154386	FD	On-Demand	Anodyne	EPHX2	20	42
COC[C@H](NC(=O)C(=O)N1CC[C@H]2[C@H](CCN2C)C1)c1ccccc1	ZINC000875154391	ED	On-Demand	Anodyne	CCR5	35	41
COC[C@H](NC(=O)C(=O)N1CC[C@@H]2[C@H](CCN2C)C1)c1ccccc1	ZINC000875154392	ED	On-Demand	Anodyne	CCR5	35	41
COC[C@H](NC(=O)C(=O)N1CC[C@H]2[C@@H](CCN2C)C1)c1ccccc1	ZINC000875154393	ED	On-Demand	Anodyne	CCR5	35	41
COC[C@H](NC(=O)C(=O)N1CC[C@@H]2[C@@H](CCN2C)C1)c1ccccc1	ZINC000875154394	ED	On-Demand	Anodyne	CCR5	35	41
COCCN1CCC(NC(=O)NNc2cccc(C)n2)CC1	ZINC000875154420	DD	On-Demand	Reactive	HTR4	40	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(NC(=O)CC(C)C)c1	ZINC000875154424	GF	On-Demand	Anodyne	SLC6A3	44	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(NC(=O)CC(C)C)c1	ZINC000875154425	GF	On-Demand	Anodyne	SLC6A3	44	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1sccc1C	ZINC000875154474	DE	On-Demand	Anodyne	SLC6A3	51	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1sccc1C	ZINC000875154475	DE	On-Demand	Anodyne	SLC6A3	51	38
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	ACE	77	46
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	TYR	33	41
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	OPRM1	59	42
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	OPRD1	55	42
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	CELA1	31	42
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	ELANE	34	44
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	MME	117	42
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	ANPEP	56	34
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	TACR1	36	57
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	CTSD	36	40
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	PGC	61	33
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	CMA1	25	40
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	CTRA_BOVIN	57	37
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	HRAS	41	42
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	FCER2	57	37
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	CASP3	20	47
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	BMP1	21	45
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	KLK3	97	43
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	CTSB	102	61
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	PAPA1_CARPA	107	61
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	CYSP_TRYCR	76	51
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	CCKAR	22	40
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	CTSG	46	37
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	CTSK	69	61
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	CTSL	70	61
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	CACNA1B	51	39
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	PGA	42	39
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	TIMP3	79	36
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	PREP	15	43
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	CAPNS1	106	52
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	MMP3	27	40
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	HLA-DRB1	86	39
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	CELA2A	55	37
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	REN	103	46
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	REN1	41	39
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	MMP11	64	35
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	CTSS	42	61
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	CAPN1	151	53
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	MMP9	24	41
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	CASP1	31	46
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	CTRC	21	46
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	CAPN2	183	54
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	ACE2	84	37
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	PLAU	18	42
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	CASP9	30	41
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	MMP1	26	40
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	FPR1	72	43
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	NPR	88	44
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	PSMB5	52	46
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	PSMB8	52	32
C[C@@H](C1CC1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000875154488	GH	On-Demand	Anodyne	KDM1A	15	48
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N(C)[C@@H](C)C3CC3)c2c1	ZINC000875154499	EK	On-Demand	Anodyne	DHODH	15	43
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N(C)[C@@H](C)C3CC3)c2c1	ZINC000875154499	EK	On-Demand	Anodyne	PRS	58	38
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N(C)[C@@H](C)C3CC3)c2c1	ZINC000875154499	EK	On-Demand	Anodyne	TACR3	23	42
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N(C)[C@@H](C)C3CC3)c2c1	ZINC000875154499	EK	On-Demand	Anodyne	MT-CO2	51	38
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N(C)[C@H](C)C3CC3)c2c1	ZINC000875154500	EK	On-Demand	Anodyne	DHODH	15	43
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N(C)[C@H](C)C3CC3)c2c1	ZINC000875154500	EK	On-Demand	Anodyne	PRS	58	38
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N(C)[C@H](C)C3CC3)c2c1	ZINC000875154500	EK	On-Demand	Anodyne	TACR3	23	42
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N(C)[C@H](C)C3CC3)c2c1	ZINC000875154500	EK	On-Demand	Anodyne	MT-CO2	51	38
CCOC1CC2(C1)C[C@H]2C(=O)Nc1ccccc1S(=O)(=O)CC	ZINC000875154515	EF	On-Demand	Anodyne	TIMP3	67	32
CCC1(N(C)C)CCN(C(=O)NCCCCCCCN(C)C)CC1	ZINC000875154611	EG	On-Demand	Anodyne	ASAH1	67	31
C[C@@H](C1CC1)N(C)C(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1	ZINC000875154666	EE	On-Demand	Bother	SLC6A9	15	50
COc1ccc([C@@H]2CN(C(=O)NCCCCCCCN(C)C)CCO2)cc1	ZINC000875154735	GG	On-Demand	Anodyne	EDNRA	24	40
C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)[C@@H]1C[C@@]1(C)Br	ZINC000875154750	EG	On-Demand	Bother	NOD2	19	48
C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)[C@H]1C[C@]1(C)Br	ZINC000875154751	EG	On-Demand	Bother	NOD2	19	48
C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)[C@H]1C[C@@]1(C)Br	ZINC000875154752	EG	On-Demand	Bother	NOD2	19	48
C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)[C@@H]1C[C@]1(C)Br	ZINC000875154753	EG	On-Demand	Bother	NOD2	19	48
C[C@@H](C1CC1)N(C)C(=O)c1ccc(Cl)c(S(=O)(=O)N2CCC(Cc3ccccc3)CC2)c1	ZINC000875154763	JJ	On-Demand	Anodyne	GRIN2B	44	42
C[C@@H](C1CC1)N(C)C(=O)c1ccc(Cl)c(S(=O)(=O)N2CCC(Cc3ccccc3)CC2)c1	ZINC000875154763	JJ	On-Demand	Anodyne	CCR5	15	43
C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)[C@@]12CC[C@@](C)(C(=O)O1)C2(C)C	ZINC000875154806	FF	On-Demand	Bother	NOD2	17	40
C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)[C@@]12CC[C@@](C)(C(=O)O1)C2(C)C	ZINC000875154807	FF	On-Demand	Bother	NOD2	17	40
C[C@H](NC(=O)C(=O)NCC(C)(C)c1ccc2c(c1)OCO2)c1ccnn1C	ZINC000875154852	FD	On-Demand	Anodyne	DYRK2	44	38
CCC[C@@H](CC)C(=O)Nc1ccccc1S(=O)(=O)CC	ZINC000875154891	CG	On-Demand	Anodyne	MME	16	45
CCC[C@@H](CC)C(=O)Nc1ccccc1S(=O)(=O)CC	ZINC000875154891	CG	On-Demand	Anodyne	KCNQ2	43	38
CCC[C@H](CC)C(=O)Nc1ccccc1S(=O)(=O)CC	ZINC000875154892	CG	On-Demand	Anodyne	MME	16	45
CCC[C@H](CC)C(=O)Nc1ccccc1S(=O)(=O)CC	ZINC000875154892	CG	On-Demand	Anodyne	KCNQ2	43	38
Cc1cccc(C(=O)Nc2ccccc2C(=O)N(C)[C@@H](C)C2CC2)c1	ZINC000875154895	EI	On-Demand	Anodyne	ECR	29	42
Cc1cccc(C(=O)Nc2ccccc2C(=O)N(C)[C@@H](C)C2CC2)c1	ZINC000875154895	EI	On-Demand	Anodyne	KCNK3	112	51
Cc1cccc(C(=O)Nc2ccccc2C(=O)N(C)[C@@H](C)C2CC2)c1	ZINC000875154895	EI	On-Demand	Anodyne	KCNK9	73	47
Cc1cccc(C(=O)Nc2ccccc2C(=O)N(C)[C@H](C)C2CC2)c1	ZINC000875154896	EI	On-Demand	Anodyne	ECR	29	42
Cc1cccc(C(=O)Nc2ccccc2C(=O)N(C)[C@H](C)C2CC2)c1	ZINC000875154896	EI	On-Demand	Anodyne	KCNK3	112	51
Cc1cccc(C(=O)Nc2ccccc2C(=O)N(C)[C@H](C)C2CC2)c1	ZINC000875154896	EI	On-Demand	Anodyne	KCNK9	73	47
C[C@@H](C1CC1)N(C)C(=O)c1cc(-c2ccccc2)nn1-c1ccccc1	ZINC000875154914	EI	On-Demand	Anodyne	P2RY12	54	33
COC(=O)N(C)NC(=O)NCCc1ccc(C)cc1C	ZINC000875154920	CD	On-Demand	Reactive	MTNR1A	52	40
CN1CC[C@H]2CN(C(=O)C(=O)NCC(C)(C)c3ccc4c(c3)OCO4)CC[C@H]21	ZINC000875154923	GD	On-Demand	Anodyne	DYRK2	43	36
CN1CC[C@H]2CN(C(=O)C(=O)NCC(C)(C)c3ccc4c(c3)OCO4)CC[C@@H]21	ZINC000875154924	GD	On-Demand	Anodyne	DYRK2	43	36
CC(=O)C1CCN(C(=O)C(=O)NCc2ccccc2CN2CCCCCC2)CC1	ZINC000875154932	GF	On-Demand	Anodyne	HRH3	15	40
CC(=O)C1CCN(C(=O)C(=O)NCc2ccccc2CN2CCCCCC2)CC1	ZINC000875154932	GF	On-Demand	Anodyne	SIGMAR1	17	40
C[C@@H](C1CC1)N(C)C(=O)/C=C\c1ccccc1F	ZINC000875154955	BG	On-Demand	Anodyne	KCNQ2	41	39
C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1c(Cl)nn(C)c1Cl	ZINC000875155066	FG	On-Demand	Bother	NOD2	18	41
C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1c(Cl)nn(C)c1Cl	ZINC000875155067	FG	On-Demand	Bother	NOD2	18	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@H](C)C1CC1	ZINC000875155142	EH	On-Demand	Anodyne	ACE	25	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@H](C)C1CC1	ZINC000875155142	EH	On-Demand	Anodyne	CELA1	24	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@H](C)C1CC1	ZINC000875155142	EH	On-Demand	Anodyne	ELANE	36	48
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@H](C)C1CC1	ZINC000875155142	EH	On-Demand	Anodyne	CTRA_BOVIN	41	31
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@H](C)C1CC1	ZINC000875155142	EH	On-Demand	Anodyne	CASP3	18	51
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@H](C)C1CC1	ZINC000875155142	EH	On-Demand	Anodyne	BMP1	25	52
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@H](C)C1CC1	ZINC000875155142	EH	On-Demand	Anodyne	KLK3	86	38
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@H](C)C1CC1	ZINC000875155142	EH	On-Demand	Anodyne	CTSB	75	64
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@H](C)C1CC1	ZINC000875155142	EH	On-Demand	Anodyne	PAPA1_CARPA	87	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@H](C)C1CC1	ZINC000875155142	EH	On-Demand	Anodyne	CYSP_TRYCR	52	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@H](C)C1CC1	ZINC000875155142	EH	On-Demand	Anodyne	CTSK	51	64
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@H](C)C1CC1	ZINC000875155142	EH	On-Demand	Anodyne	CTSL	58	64
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@H](C)C1CC1	ZINC000875155142	EH	On-Demand	Anodyne	PGA	22	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@H](C)C1CC1	ZINC000875155142	EH	On-Demand	Anodyne	AMY2	46	31
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@H](C)C1CC1	ZINC000875155142	EH	On-Demand	Anodyne	CAPNS1	69	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@H](C)C1CC1	ZINC000875155142	EH	On-Demand	Anodyne	CTSS	31	64
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@H](C)C1CC1	ZINC000875155142	EH	On-Demand	Anodyne	CAPN1	92	55
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@H](C)C1CC1	ZINC000875155142	EH	On-Demand	Anodyne	CASP1	28	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@H](C)C1CC1	ZINC000875155142	EH	On-Demand	Anodyne	CAPN2	150	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@H](C)C1CC1	ZINC000875155142	EH	On-Demand	Anodyne	CASP6	15	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@H](C)C1CC1	ZINC000875155142	EH	On-Demand	Anodyne	CASP9	33	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@H](C)C1CC1	ZINC000875155142	EH	On-Demand	Anodyne	NPR	75	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@H](C)C1CC1	ZINC000875155142	EH	On-Demand	Anodyne	PSMB5	51	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@H](C)C1CC1	ZINC000875155142	EH	On-Demand	Anodyne	Q6PRC7_IXORI	24	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@@H](C)C1CC1	ZINC000875155143	EH	On-Demand	Anodyne	ACE	25	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@@H](C)C1CC1	ZINC000875155143	EH	On-Demand	Anodyne	CELA1	24	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@@H](C)C1CC1	ZINC000875155143	EH	On-Demand	Anodyne	ELANE	36	48
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@@H](C)C1CC1	ZINC000875155143	EH	On-Demand	Anodyne	CTRA_BOVIN	41	31
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@@H](C)C1CC1	ZINC000875155143	EH	On-Demand	Anodyne	CASP3	18	51
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@@H](C)C1CC1	ZINC000875155143	EH	On-Demand	Anodyne	BMP1	25	52
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@@H](C)C1CC1	ZINC000875155143	EH	On-Demand	Anodyne	KLK3	86	38
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@@H](C)C1CC1	ZINC000875155143	EH	On-Demand	Anodyne	CTSB	75	64
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@@H](C)C1CC1	ZINC000875155143	EH	On-Demand	Anodyne	PAPA1_CARPA	87	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@@H](C)C1CC1	ZINC000875155143	EH	On-Demand	Anodyne	CYSP_TRYCR	52	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@@H](C)C1CC1	ZINC000875155143	EH	On-Demand	Anodyne	CTSK	51	64
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@@H](C)C1CC1	ZINC000875155143	EH	On-Demand	Anodyne	CTSL	58	64
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@@H](C)C1CC1	ZINC000875155143	EH	On-Demand	Anodyne	PGA	22	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@@H](C)C1CC1	ZINC000875155143	EH	On-Demand	Anodyne	AMY2	46	31
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@@H](C)C1CC1	ZINC000875155143	EH	On-Demand	Anodyne	CAPNS1	69	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@@H](C)C1CC1	ZINC000875155143	EH	On-Demand	Anodyne	CTSS	31	64
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@@H](C)C1CC1	ZINC000875155143	EH	On-Demand	Anodyne	CAPN1	92	55
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@@H](C)C1CC1	ZINC000875155143	EH	On-Demand	Anodyne	CASP1	28	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@@H](C)C1CC1	ZINC000875155143	EH	On-Demand	Anodyne	CAPN2	150	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@@H](C)C1CC1	ZINC000875155143	EH	On-Demand	Anodyne	CASP6	15	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@@H](C)C1CC1	ZINC000875155143	EH	On-Demand	Anodyne	CASP9	33	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@@H](C)C1CC1	ZINC000875155143	EH	On-Demand	Anodyne	NPR	75	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@@H](C)C1CC1	ZINC000875155143	EH	On-Demand	Anodyne	PSMB5	51	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N(C)[C@@H](C)C1CC1	ZINC000875155143	EH	On-Demand	Anodyne	Q6PRC7_IXORI	24	42
CC(=O)C1CCN(C(=O)C(=O)NCC2(c3ccc(F)cc3)CCC2)CC1	ZINC000875155179	FE	On-Demand	Anodyne	CACNA1G	35	54
CCC(F)(F)C(C)(C)CNC(=O)C(=O)NC[C@@H](C)NC(=O)OC(C)(C)C	ZINC000875155197	GE	On-Demand	Anodyne	CTSK	15	41
CCC(F)(F)C(C)(C)CNC(=O)C(=O)NC[C@H](C)NC(=O)OC(C)(C)C	ZINC000875155198	GE	On-Demand	Anodyne	CTSK	15	41
O=C(NCCOc1cccnc1)C(=O)NCC1CC=CC1	ZINC000875155217	CC	On-Demand	Anodyne	GRIN2B	20	40
O=C(NCCOc1cccnc1)C(=O)NCC1CC=CC1	ZINC000875155217	CC	On-Demand	Anodyne	CHRNA7	18	40
C[C@@H](C1CC1)N(C)C(=O)C(O)(c1ccccc1)c1ccccc1	ZINC000875155272	DG	On-Demand	Anodyne	CHRM2	18	40
C[C@@H](C1CC1)N(C)C(=O)C(O)(c1ccccc1)c1ccccc1	ZINC000875155272	DG	On-Demand	Anodyne	CHRM3	21	40
C[C@@H](C1CC1)N(C)C(=O)C(O)(c1ccccc1)c1ccccc1	ZINC000875155272	DG	On-Demand	Anodyne	AMY2	60	36
C[C@@H](C1CC1)N(C)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000875155290	HI	On-Demand	Bother	KCNMA1	32	45
C[C@@H](C1CC1)N(C)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000875155290	HI	On-Demand	Bother	WDR5	32	42
C[C@@H](C1CC1)N(C)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000875155290	HI	On-Demand	Bother	G2YM83_BOTF4	44	32
C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)[C@@H]1COC(=O)N1C	ZINC000875155314	DD	On-Demand	Bother	NOD2	18	46
C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)[C@H]1COC(=O)N1C	ZINC000875155315	DD	On-Demand	Bother	NOD2	18	46
C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)[C@H]1COC(=O)N1C	ZINC000875155316	DD	On-Demand	Bother	NOD2	18	46
C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)[C@@H]1COC(=O)N1C	ZINC000875155317	DD	On-Demand	Bother	NOD2	18	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccc(C)cc1C	ZINC000875155323	EF	On-Demand	Anodyne	SLC6A3	41	38
COc1cccc(C(C)(C)C(=O)N2CCOC[C@H]2C)c1	ZINC000875155415	CE	On-Demand	Anodyne	DRD4	40	31
COc1cccc(C(C)(C)C(=O)N2CCOC[C@@H]2C)c1	ZINC000875155416	CE	On-Demand	Anodyne	DRD4	40	31
COCCN1CCC(NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875155419	FE	On-Demand	Anodyne	SLC6A1	49	38
COCCN1CCC(NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875155419	FE	On-Demand	Anodyne	SLC6A3	24	43
COCCN1CCC(NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875155419	FE	On-Demand	Anodyne	HTR4	44	35
COCCN1CCC(NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875155419	FE	On-Demand	Anodyne	LTA4H	24	45
COCCN1CCC(NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875155419	FE	On-Demand	Anodyne	HTR7	16	42
COCCN1CCC(NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875155419	FE	On-Demand	Anodyne	CCR5	25	41
COCCN1CCC(NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875155420	FE	On-Demand	Anodyne	SLC6A1	49	38
COCCN1CCC(NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875155420	FE	On-Demand	Anodyne	SLC6A3	24	43
COCCN1CCC(NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875155420	FE	On-Demand	Anodyne	HTR4	44	35
COCCN1CCC(NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875155420	FE	On-Demand	Anodyne	LTA4H	24	45
COCCN1CCC(NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875155420	FE	On-Demand	Anodyne	HTR7	16	42
COCCN1CCC(NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875155420	FE	On-Demand	Anodyne	CCR5	25	41
COCCN1CCC(NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875155422	FE	On-Demand	Anodyne	SLC6A1	49	38
COCCN1CCC(NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875155422	FE	On-Demand	Anodyne	SLC6A3	24	43
COCCN1CCC(NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875155422	FE	On-Demand	Anodyne	HTR4	44	35
COCCN1CCC(NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875155422	FE	On-Demand	Anodyne	LTA4H	24	45
COCCN1CCC(NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875155422	FE	On-Demand	Anodyne	HTR7	16	42
COCCN1CCC(NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875155422	FE	On-Demand	Anodyne	CCR5	25	41
COCCN1CCC(NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875155424	FE	On-Demand	Anodyne	SLC6A1	49	38
COCCN1CCC(NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875155424	FE	On-Demand	Anodyne	SLC6A3	24	43
COCCN1CCC(NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875155424	FE	On-Demand	Anodyne	HTR4	44	35
COCCN1CCC(NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875155424	FE	On-Demand	Anodyne	LTA4H	24	45
COCCN1CCC(NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875155424	FE	On-Demand	Anodyne	HTR7	16	42
COCCN1CCC(NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875155424	FE	On-Demand	Anodyne	CCR5	25	41
CO[C@H](C(=O)Nc1ccc(-n2cccn2)cc1C(F)(F)F)C(=O)OC(C)(C)C	ZINC000875155447	GG	On-Demand	Anodyne	AMP1_PLAFQ	60	45
C[C@@H](C1CC1)N(C)C(=O)[C@@H]1CC(=O)N(Cc2ccccc2Cl)C1	ZINC000875155452	EF	On-Demand	Anodyne	P2RX7	18	42
COCCN1CCC(NC(=O)NC2(C)CCC(C)(C)CC2)CC1	ZINC000875155455	EF	On-Demand	Anodyne	EPHX2	18	46
C[C@@H](C1CC1)N(C)C(=O)[C@H]1CC(=O)N(Cc2ccccc2Cl)C1	ZINC000875155458	EF	On-Demand	Anodyne	P2RX7	18	42
COCCN1CCC(NC(=O)N2CCC[C@@H](c3ccccc3OC)CC2)CC1	ZINC000875155469	GG	On-Demand	Anodyne	HTR1A	43	43
COCCN1CCC(NC(=O)N2CCC[C@@H](c3ccccc3OC)CC2)CC1	ZINC000875155469	GG	On-Demand	Anodyne	DRD2	51	52
COCCN1CCC(NC(=O)N2CCC[C@@H](c3ccccc3OC)CC2)CC1	ZINC000875155469	GG	On-Demand	Anodyne	DRD4	39	47
COCCN1CCC(NC(=O)N2CCC[C@@H](c3ccccc3OC)CC2)CC1	ZINC000875155469	GG	On-Demand	Anodyne	HTR2A	17	43
COCCN1CCC(NC(=O)N2CCC[C@@H](c3ccccc3OC)CC2)CC1	ZINC000875155469	GG	On-Demand	Anodyne	ADRA1A	24	40
COCCN1CCC(NC(=O)N2CCC[C@@H](c3ccccc3OC)CC2)CC1	ZINC000875155469	GG	On-Demand	Anodyne	HRH1	21	44
COCCN1CCC(NC(=O)N2CCC[C@@H](c3ccccc3OC)CC2)CC1	ZINC000875155469	GG	On-Demand	Anodyne	ADRA1B	22	40
COCCN1CCC(NC(=O)N2CCC[C@@H](c3ccccc3OC)CC2)CC1	ZINC000875155469	GG	On-Demand	Anodyne	DRD3	42	41
COCCN1CCC(NC(=O)N2CCC[C@@H](c3ccccc3OC)CC2)CC1	ZINC000875155469	GG	On-Demand	Anodyne	HTR4	54	40
COCCN1CCC(NC(=O)N2CCC[C@@H](c3ccccc3OC)CC2)CC1	ZINC000875155469	GG	On-Demand	Anodyne	HTR7	37	43
COCCN1CCC(NC(=O)N2CCC[C@@H](c3ccccc3OC)CC2)CC1	ZINC000875155469	GG	On-Demand	Anodyne	SIGMAR1	24	43
COCCN1CCC(NC(=O)N2CCC[C@@H](c3ccccc3OC)CC2)CC1	ZINC000875155469	GG	On-Demand	Anodyne	CCR3	22	40
COCCN1CCC(NC(=O)N2CCC[C@@H](c3ccccc3OC)CC2)CC1	ZINC000875155469	GG	On-Demand	Anodyne	MCHR1	18	41
COCCN1CCC(NC(=O)N2CCC[C@H](c3ccccc3OC)CC2)CC1	ZINC000875155471	GG	On-Demand	Anodyne	HTR1A	43	43
COCCN1CCC(NC(=O)N2CCC[C@H](c3ccccc3OC)CC2)CC1	ZINC000875155471	GG	On-Demand	Anodyne	DRD2	51	52
COCCN1CCC(NC(=O)N2CCC[C@H](c3ccccc3OC)CC2)CC1	ZINC000875155471	GG	On-Demand	Anodyne	DRD4	39	47
COCCN1CCC(NC(=O)N2CCC[C@H](c3ccccc3OC)CC2)CC1	ZINC000875155471	GG	On-Demand	Anodyne	HTR2A	17	43
COCCN1CCC(NC(=O)N2CCC[C@H](c3ccccc3OC)CC2)CC1	ZINC000875155471	GG	On-Demand	Anodyne	ADRA1A	24	40
COCCN1CCC(NC(=O)N2CCC[C@H](c3ccccc3OC)CC2)CC1	ZINC000875155471	GG	On-Demand	Anodyne	HRH1	21	44
COCCN1CCC(NC(=O)N2CCC[C@H](c3ccccc3OC)CC2)CC1	ZINC000875155471	GG	On-Demand	Anodyne	ADRA1B	22	40
COCCN1CCC(NC(=O)N2CCC[C@H](c3ccccc3OC)CC2)CC1	ZINC000875155471	GG	On-Demand	Anodyne	DRD3	42	41
COCCN1CCC(NC(=O)N2CCC[C@H](c3ccccc3OC)CC2)CC1	ZINC000875155471	GG	On-Demand	Anodyne	HTR4	54	40
COCCN1CCC(NC(=O)N2CCC[C@H](c3ccccc3OC)CC2)CC1	ZINC000875155471	GG	On-Demand	Anodyne	HTR7	37	43
COCCN1CCC(NC(=O)N2CCC[C@H](c3ccccc3OC)CC2)CC1	ZINC000875155471	GG	On-Demand	Anodyne	SIGMAR1	24	43
COCCN1CCC(NC(=O)N2CCC[C@H](c3ccccc3OC)CC2)CC1	ZINC000875155471	GG	On-Demand	Anodyne	CCR3	22	40
COCCN1CCC(NC(=O)N2CCC[C@H](c3ccccc3OC)CC2)CC1	ZINC000875155471	GG	On-Demand	Anodyne	MCHR1	18	41
Cn1nc(Cl)c(C(=O)N2CCCc3cc(F)ccc32)c1Cl	ZINC000875155472	EG	On-Demand	Anodyne	AVPR2	31	40
COCCN1CCC(NC(=O)NC[C@H]2C[C@H](O)C2)CC1	ZINC000875155477	CC	On-Demand	Anodyne	CACNA1I	53	38
C[C@@H](C1CC1)N(C)C(=O)c1cc(-c2cccs2)nc2ccccc12	ZINC000875155511	EJ	On-Demand	Anodyne	TACR3	20	51
C[C@H]1CC(=O)N[C@@H](C(=O)Nc2ccc(-n3cccn3)cc2C(F)(F)F)C1	ZINC000875155513	FF	On-Demand	Anodyne	AMP1_PLAFQ	51	36
CCCCCCCNC(=O)C(=O)NCc1ncccc1C	ZINC000875155515	CE	On-Demand	Mild	ASAH1	94	35
CC[C@@H](NC(=O)NC1CCN(CCOC)CC1)[C@@H](O)c1ccccc1	ZINC000875155531	ED	On-Demand	Anodyne	DRD2	15	40
CC[C@@H](NC(=O)NC1CCN(CCOC)CC1)[C@@H](O)c1ccccc1	ZINC000875155531	ED	On-Demand	Anodyne	DRD4	20	40
CC[C@@H](NC(=O)NC1CCN(CCOC)CC1)[C@@H](O)c1ccccc1	ZINC000875155531	ED	On-Demand	Anodyne	HTR4	46	36
CC[C@@H](NC(=O)NC1CCN(CCOC)CC1)[C@@H](O)c1ccccc1	ZINC000875155531	ED	On-Demand	Anodyne	CCR5	44	44
CC[C@@H](NC(=O)NC1CCN(CCOC)CC1)[C@@H](O)c1ccccc1	ZINC000875155531	ED	On-Demand	Anodyne	MCHR1	15	48
CC[C@@H](NC(=O)NC1CCN(CCOC)CC1)[C@H](O)c1ccccc1	ZINC000875155532	ED	On-Demand	Anodyne	DRD2	15	40
CC[C@@H](NC(=O)NC1CCN(CCOC)CC1)[C@H](O)c1ccccc1	ZINC000875155532	ED	On-Demand	Anodyne	DRD4	20	40
CC[C@@H](NC(=O)NC1CCN(CCOC)CC1)[C@H](O)c1ccccc1	ZINC000875155532	ED	On-Demand	Anodyne	HTR4	46	36
CC[C@@H](NC(=O)NC1CCN(CCOC)CC1)[C@H](O)c1ccccc1	ZINC000875155532	ED	On-Demand	Anodyne	CCR5	44	44
CC[C@@H](NC(=O)NC1CCN(CCOC)CC1)[C@H](O)c1ccccc1	ZINC000875155532	ED	On-Demand	Anodyne	MCHR1	15	48
Cc1ccc(CN2CCO[C@H](CNC(=O)NCc3nnc(C)o3)C2)cc1	ZINC000875155544	FD	On-Demand	Anodyne	DRD4	15	41
CCO[C@@H](C(=O)Nc1ccccc1S(=O)(=O)CC)C1CCCC1	ZINC000875155559	EG	On-Demand	Anodyne	KCNQ2	40	33
CCO[C@@H](C(=O)Nc1ccccc1S(=O)(=O)CC)C1CCCC1	ZINC000875155559	EG	On-Demand	Anodyne	AMY2	44	31
COc1cccc(C(C)(C)C(=O)Nc2cc(C(=O)N(C)C)ccc2Cl)c1	ZINC000875155569	FH	On-Demand	Anodyne	TAAR1	21	43
O=C(Oc1ccc(-c2ccc(I)cc2)cc1)c1cc[n+]([O-])cc1	ZINC000875155637	HH	On-Demand	Anodyne	ACR	57	35
CCO[C@@H](C(=O)Nc1ccc(S(=O)(=O)C2CCCC2)cc1)[C@H]1CCOC1	ZINC000875155664	GF	On-Demand	Anodyne	GCK	22	41
CCO[C@@H](C(=O)Nc1ccc(S(=O)(=O)C2CCCC2)cc1)[C@@H]1CCOC1	ZINC000875155670	GF	On-Demand	Anodyne	GCK	22	41
C[C@@]1(Br)C[C@@H]1C(=O)Nc1ccc(-n2cccn2)cc1C(F)(F)F	ZINC000875155682	GI	On-Demand	Anodyne	AMP1_PLAFQ	52	36
C[C@@]1(Br)C[C@H]1C(=O)Nc1ccc(-n2cccn2)cc1C(F)(F)F	ZINC000875155688	GI	On-Demand	Anodyne	AMP1_PLAFQ	52	36
COCCN1CCC(NC(=O)N[C@H](C)[C@@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875155713	GD	On-Demand	Anodyne	HTR4	51	39
COCCN1CCC(NC(=O)N[C@H](C)[C@@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875155713	GD	On-Demand	Anodyne	MCHR1	20	45
COCCN1CCC(NC(=O)N[C@@H](C)[C@@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875155714	GD	On-Demand	Anodyne	HTR4	51	39
COCCN1CCC(NC(=O)N[C@@H](C)[C@@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875155714	GD	On-Demand	Anodyne	MCHR1	20	45
COCCN1CCC(NC(=O)N[C@H](C)[C@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875155715	GD	On-Demand	Anodyne	HTR4	51	39
COCCN1CCC(NC(=O)N[C@H](C)[C@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875155715	GD	On-Demand	Anodyne	MCHR1	20	45
COCCN1CCC(NC(=O)N[C@@H](C)[C@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875155716	GD	On-Demand	Anodyne	HTR4	51	39
COCCN1CCC(NC(=O)N[C@@H](C)[C@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875155716	GD	On-Demand	Anodyne	MCHR1	20	45
CCO[C@@H](C(=O)Nc1ccc(S(=O)(=O)C2CCCC2)cc1)C1CCOCC1	ZINC000875155751	GG	On-Demand	Anodyne	GCK	27	44
O=C(NCc1ccc2cccnc2c1)C(=O)NC[C@@H]1CN2CCC[C@H]2CO1	ZINC000875155790	FC	On-Demand	Anodyne	CCR3	15	44
O=C(NCc1ccc2cccnc2c1)C(=O)NC[C@@H]1CN2CCC[C@@H]2CO1	ZINC000875155792	FC	On-Demand	Anodyne	CCR3	15	44
C[C@@H](C1CC1)N(C)C(=O)/C=C\c1ccccc1Cl	ZINC000875155799	CH	On-Demand	Anodyne	KCNQ2	21	44
C[C@@H](C1CC1)N(C)C(=O)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000875155805	FD	On-Demand	Anodyne	CNR2	15	45
O=C1CC[C@H](C(=O)Nc2ccc(-n3cccn3)cc2C(F)(F)F)O1	ZINC000875155810	EF	On-Demand	Anodyne	AMP1_PLAFQ	49	33
COCCN1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875155813	GE	On-Demand	Mild	DRD4	17	45
COCCN1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875155813	GE	On-Demand	Mild	SSTR5	40	36
COCCN1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875155813	GE	On-Demand	Mild	CCR3	41	43
COCCN1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875155813	GE	On-Demand	Mild	ITK	22	47
COCCN1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875155813	GE	On-Demand	Mild	MCHR1	32	44
COCCN1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875155813	GE	On-Demand	Mild	PANC	57	39
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCOc3cccnc3)C2)cc1	ZINC000875155832	GD	On-Demand	Anodyne	DRD4	36	45
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCOc3cccnc3)C2)cc1	ZINC000875155832	GD	On-Demand	Anodyne	LTA4H	31	44
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCOc3cccnc3)C2)cc1	ZINC000875155832	GD	On-Demand	Anodyne	SIGMAR1	21	48
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCOc3cccnc3)C2)cc1	ZINC000875155832	GD	On-Demand	Anodyne	SSTR5	58	41
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCOc3cccnc3)C2)cc1	ZINC000875155832	GD	On-Demand	Anodyne	CCR3	32	41
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCOc3cccnc3)C2)cc1	ZINC000875155832	GD	On-Demand	Anodyne	CHRNA7	33	40
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCOc3cccnc3)C2)cc1	ZINC000875155832	GD	On-Demand	Anodyne	UTS2R	23	45
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCOc3cccnc3)C2)cc1	ZINC000875155832	GD	On-Demand	Anodyne	MLNR	49	37
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCOc3cccnc3)C2)cc1	ZINC000875155832	GD	On-Demand	Anodyne	CCR2	15	44
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCOc3cccnc3)C2)cc1	ZINC000875155832	GD	On-Demand	Anodyne	SLC6A5	30	43
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCOc3cccnc3)C2)cc1	ZINC000875155832	GD	On-Demand	Anodyne	MCHR1	39	44
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCOc3cccnc3)C2)cc1	ZINC000875155833	GD	On-Demand	Anodyne	DRD4	36	45
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCOc3cccnc3)C2)cc1	ZINC000875155833	GD	On-Demand	Anodyne	LTA4H	31	44
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCOc3cccnc3)C2)cc1	ZINC000875155833	GD	On-Demand	Anodyne	SIGMAR1	21	48
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCOc3cccnc3)C2)cc1	ZINC000875155833	GD	On-Demand	Anodyne	SSTR5	58	41
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCOc3cccnc3)C2)cc1	ZINC000875155833	GD	On-Demand	Anodyne	CCR3	32	41
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCOc3cccnc3)C2)cc1	ZINC000875155833	GD	On-Demand	Anodyne	CHRNA7	33	40
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCOc3cccnc3)C2)cc1	ZINC000875155833	GD	On-Demand	Anodyne	UTS2R	23	45
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCOc3cccnc3)C2)cc1	ZINC000875155833	GD	On-Demand	Anodyne	MLNR	49	37
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCOc3cccnc3)C2)cc1	ZINC000875155833	GD	On-Demand	Anodyne	CCR2	15	44
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCOc3cccnc3)C2)cc1	ZINC000875155833	GD	On-Demand	Anodyne	SLC6A5	30	43
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCOc3cccnc3)C2)cc1	ZINC000875155833	GD	On-Demand	Anodyne	MCHR1	39	44
COc1ccc([C@@H]2CN(C(=O)C(=O)N[C@H](C)c3ccsc3)CCO2)cc1	ZINC000875155844	FF	On-Demand	Anodyne	NPBWR1	72	37
COc1ccc([C@@H]2CN(C(=O)C(=O)N[C@@H](C)c3ccsc3)CCO2)cc1	ZINC000875155845	FF	On-Demand	Anodyne	NPBWR1	72	37
C[C@@H](C1CC1)N(C)C(=O)c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12	ZINC000875155885	GJ	On-Demand	Anodyne	PRS	20	40
C[C@@H](C1CC1)N(C)C(=O)c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12	ZINC000875155885	GJ	On-Demand	Anodyne	TACR3	22	40
C[C@@H](C1CC1)N(C)C(=O)c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12	ZINC000875155885	GJ	On-Demand	Anodyne	MT-CO2	30	40
O=C(NCCOc1cccnc1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875155887	FD	On-Demand	Anodyne	ADRB1	15	41
O=C(NCCOc1cccnc1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875155887	FD	On-Demand	Anodyne	ADRB3	29	41
O=C(NCCOc1cccnc1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875155887	FD	On-Demand	Anodyne	CPT1A	58	38
O=C(NCCOc1cccnc1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875155888	FD	On-Demand	Anodyne	ADRB1	15	41
O=C(NCCOc1cccnc1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875155888	FD	On-Demand	Anodyne	ADRB3	29	41
O=C(NCCOc1cccnc1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875155888	FD	On-Demand	Anodyne	CPT1A	58	38
O=C(NCCOc1cccnc1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875155889	FD	On-Demand	Anodyne	ADRB1	15	41
O=C(NCCOc1cccnc1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875155889	FD	On-Demand	Anodyne	ADRB3	29	41
O=C(NCCOc1cccnc1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875155889	FD	On-Demand	Anodyne	CPT1A	58	38
O=C(NCCOc1cccnc1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875155890	FD	On-Demand	Anodyne	ADRB1	15	41
O=C(NCCOc1cccnc1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875155890	FD	On-Demand	Anodyne	ADRB3	29	41
O=C(NCCOc1cccnc1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875155890	FD	On-Demand	Anodyne	CPT1A	58	38
Cn1cnnc1-c1ccc(NC(=O)C2([C@@H]3CCCCO3)CCOCC2)cc1	ZINC000875155900	FF	On-Demand	Anodyne	MTOR	52	32
Cn1cnnc1-c1ccc(NC(=O)C2([C@H]3CCCCO3)CCOCC2)cc1	ZINC000875155901	FF	On-Demand	Anodyne	MTOR	52	32
O=C(NCc1ccc2cccnc2c1)C(=O)NC[C@H]1CN2CCC[C@H]2CO1	ZINC000875155924	FC	On-Demand	Anodyne	CCR3	15	44
O=C(NCc1ccc2cccnc2c1)C(=O)NC[C@H]1CN2CCC[C@@H]2CO1	ZINC000875155925	FC	On-Demand	Anodyne	CCR3	15	44
CN1CCO[C@H](CNC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875155950	FC	On-Demand	Anodyne	CHRNA7	43	36
CN1CCO[C@H](CNC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875155951	FC	On-Demand	Anodyne	CHRNA7	43	36
CN1CCO[C@@H](CNC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875155952	FC	On-Demand	Anodyne	CHRNA7	43	36
CN1CCO[C@@H](CNC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875155953	FC	On-Demand	Anodyne	CHRNA7	43	36
O=C(NCc1cccc(OCCN2CCOCC2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875156021	FC	On-Demand	Anodyne	ESR1	48	39
O=C(NCc1cccc(OCCN2CCOCC2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875156021	FC	On-Demand	Anodyne	HRH2	35	45
O=C(NCc1cccc(OCCN2CCOCC2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875156021	FC	On-Demand	Anodyne	LTA4H	27	43
O=C(NCc1cccc(OCCN2CCOCC2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875156021	FC	On-Demand	Anodyne	ROCK2	19	40
O=C(NCc1cccc(OCCN2CCOCC2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875156021	FC	On-Demand	Anodyne	EPHX2	40	47
CNC(=O)CN1CCC(NC(=O)c2cc3ncc(Br)cn3n2)CC1	ZINC000875156025	GC	On-Demand	Anodyne	SSTR5	40	35
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NC[C@@H]1CN2CCC[C@H]2CO1	ZINC000875156026	FD	On-Demand	Anodyne	ACE	51	38
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NC[C@@H]1CN2CCC[C@@H]2CO1	ZINC000875156027	FD	On-Demand	Anodyne	ACE	51	38
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NC[C@H]1CN2CCC[C@@H]2CO1	ZINC000875156028	FD	On-Demand	Anodyne	ACE	51	38
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NC[C@H]1CN2CCC[C@H]2CO1	ZINC000875156029	FD	On-Demand	Anodyne	ACE	51	38
C[C@@H](C1CC1)N(C)C(=O)c1cc(-c2cccnc2)nc2ccccc12	ZINC000875156032	EI	On-Demand	Anodyne	PRS	15	40
C[C@@H](C1CC1)N(C)C(=O)c1cc(-c2cccnc2)nc2ccccc12	ZINC000875156032	EI	On-Demand	Anodyne	TACR3	37	44
C[C@@H](C1CC1)N(C)C(=O)c1cc(-c2cccnc2)nc2ccccc12	ZINC000875156032	EI	On-Demand	Anodyne	MT-CO2	47	39
CCO[C@@H](C(=O)Nc1ccc(-n2cccn2)cc1C(F)(F)F)[C@H]1CCOC1	ZINC000875156059	GG	On-Demand	Anodyne	AMP1_PLAFQ	51	36
CCO[C@@H](C(=O)Nc1ccc(-n2cccn2)cc1C(F)(F)F)[C@@H]1CCOC1	ZINC000875156061	GG	On-Demand	Anodyne	AMP1_PLAFQ	51	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1ncccc1C)CC2	ZINC000875156065	GE	On-Demand	Anodyne	HCRTR1	15	45
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1ncccc1C)CC2	ZINC000875156066	GE	On-Demand	Anodyne	HCRTR1	15	45
C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C(=O)Nc1ccc(-n2cccn2)cc1C(F)(F)F	ZINC000875156133	EI	On-Demand	Anodyne	AMP1_PLAFQ	51	36
C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C(=O)Nc1ccc(-n2cccn2)cc1C(F)(F)F	ZINC000875156134	EI	On-Demand	Anodyne	AMP1_PLAFQ	51	36
C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C(=O)Nc1ccc(-n2cccn2)cc1C(F)(F)F	ZINC000875156135	EI	On-Demand	Anodyne	AMP1_PLAFQ	51	36
O=C(Cc1ccc2cnccc2c1)Nc1ccc(S(=O)(=O)C2CCCC2)cc1	ZINC000875156141	GI	On-Demand	Anodyne	CA5B	22	45
O=C(Cc1ccc2cnccc2c1)Nc1ccc(S(=O)(=O)C2CCCC2)cc1	ZINC000875156141	GI	On-Demand	Anodyne	CA5A	25	45
O=C(Cc1ccc2cnccc2c1)Nc1ccc(S(=O)(=O)C2CCCC2)cc1	ZINC000875156141	GI	On-Demand	Anodyne	CYP2C9	18	40
O=C(Cc1ccc2cnccc2c1)Nc1ccc(S(=O)(=O)C2CCCC2)cc1	ZINC000875156141	GI	On-Demand	Anodyne	NAMPT	100	47
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCOc1cccnc1)CC2	ZINC000875156151	GD	On-Demand	Anodyne	SLC18A2	45	33
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCOc1cccnc1)CC2	ZINC000875156151	GD	On-Demand	Anodyne	HCRTR1	17	47
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCOc1cccnc1)CC2	ZINC000875156151	GD	On-Demand	Anodyne	HCRTR2	15	40
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCOc1cccnc1)CC2	ZINC000875156152	GD	On-Demand	Anodyne	SLC18A2	45	33
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCOc1cccnc1)CC2	ZINC000875156152	GD	On-Demand	Anodyne	HCRTR1	17	47
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCOc1cccnc1)CC2	ZINC000875156152	GD	On-Demand	Anodyne	HCRTR2	15	40
NC(=O)CCOC(=O)CCc1cccc(Cl)c1	ZINC000875156162	CD	On-Demand	Anodyne	MAOB	20	42
C[C@@H](C1CC1)N(C)C(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1	ZINC000875156166	FI	On-Demand	Anodyne	F10	42	48
C[C@@H](C1CC1)N(C)C(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1	ZINC000875156166	FI	On-Demand	Anodyne	ECR	43	41
C[C@@H](C1CC1)N(C)C(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1	ZINC000875156166	FI	On-Demand	Anodyne	PRNP	44	34
C[C@@H](C1CC1)N(C)C(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1	ZINC000875156166	FI	On-Demand	Anodyne	NR1H4	15	40
C[C@@H](C1CC1)N(C)C(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1	ZINC000875156166	FI	On-Demand	Anodyne	UTS2	44	34
C[C@@H](C1CC1)N(C)C(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1	ZINC000875156166	FI	On-Demand	Anodyne	G2YM83_BOTF4	46	37
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)c1cccn(C2CC2)c1=O	ZINC000875156246	FF	On-Demand	Anodyne	CCR8	51	36
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)c1cccn(C2CC2)c1=O	ZINC000875156246	FF	On-Demand	Anodyne	L3MBTL3	71	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(Oc3cccc(F)c3)nc2)C1	ZINC000875156291	GE	On-Demand	Anodyne	CCR5	50	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(Oc3cccc(F)c3)nc2)C1	ZINC000875156292	GE	On-Demand	Anodyne	CCR5	50	32
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1ccc(-c2nncn2C)cc1	ZINC000875156309	EG	On-Demand	Anodyne	PPARG	21	40
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1ccc(-c2nncn2C)cc1	ZINC000875156309	EG	On-Demand	Anodyne	MTNR1B	19	41
C[C@H](NC(=O)C(=O)N(C)C[C@@H](C)NC(=O)OC(C)(C)C)c1ccsc1	ZINC000875156319	FE	On-Demand	Anodyne	PAPA1_CARPA	22	41
C[C@@H](CN(C)C(=O)C(=O)N[C@H](C)c1ccsc1)NC(=O)OC(C)(C)C	ZINC000875156320	FE	On-Demand	Anodyne	PAPA1_CARPA	22	41
C[C@@H](CN(C)C(=O)C(=O)N[C@@H](C)c1ccsc1)NC(=O)OC(C)(C)C	ZINC000875156321	FE	On-Demand	Anodyne	PAPA1_CARPA	22	41
O=C(Cn1ncc2cccnc21)Nc1ccc(S(=O)(=O)C2CCCC2)cc1	ZINC000875156325	GF	On-Demand	Anodyne	IMDH_CRYPV	20	40
O=C(Cn1ncc2cccnc21)Nc1ccc(S(=O)(=O)C2CCCC2)cc1	ZINC000875156325	GF	On-Demand	Anodyne	NAMPT	58	39
C[C@@H](C1CC1)N(C)C(=O)c1cc(-c2ccccn2)nc2ccccc12	ZINC000875156333	EI	On-Demand	Anodyne	METAP1	49	42
C[C@@H](C1CC1)N(C)C(=O)c1cc(-c2ccccn2)nc2ccccc12	ZINC000875156333	EI	On-Demand	Anodyne	TACR3	22	40
CCO[C@@H](C(=O)Nc1ccc(-n2cccn2)cc1C(F)(F)F)C1CCOCC1	ZINC000875156358	GH	On-Demand	Anodyne	AMP1_PLAFQ	52	37
COCCN1CCC(NC(=O)N2C[C@@H]3C[C@H]2CN3c2ccccc2)CC1	ZINC000875156363	FD	On-Demand	Anodyne	DRD4	25	42
COCCN1CCC(NC(=O)N2C[C@@H]3C[C@H]2CN3c2ccccc2)CC1	ZINC000875156363	FD	On-Demand	Anodyne	HTR4	49	37
O=CN1CCCN(C(=O)NCc2cccc(OCCN3CCOCC3)c2)CC1	ZINC000875156364	GC	On-Demand	Anodyne	HRH2	40	42
O=CN1CCCN(C(=O)NCc2cccc(OCCN3CCOCC3)c2)CC1	ZINC000875156364	GC	On-Demand	Anodyne	LTA4H	28	44
O=CN1CCCN(C(=O)NCc2cccc(OCCN3CCOCC3)c2)CC1	ZINC000875156364	GC	On-Demand	Anodyne	HRH3	21	43
O=CN1CCCN(C(=O)NCc2cccc(OCCN3CCOCC3)c2)CC1	ZINC000875156364	GC	On-Demand	Anodyne	EPHX2	26	46
CCCCCCCNC(=O)C(=O)NCc1c(C)cc(C)nc1OC	ZINC000875156372	EE	On-Demand	Mild	ASAH1	61	36
NC(=O)[C@@H]1CC[C@H](CCC(=O)Nc2ccc(-n3cccn3)cc2C(F)(F)F)O1	ZINC000875156382	GF	On-Demand	Anodyne	AMP1_PLAFQ	46	30
COCCN1CCC(NC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875156397	GF	On-Demand	Mild	DRD4	20	40
COCCN1CCC(NC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875156397	GF	On-Demand	Mild	SLC6A5	31	40
COCCN1CCC(NC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875156397	GF	On-Demand	Mild	MCHR1	44	45
COCCN1CCC(NC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875156397	GF	On-Demand	Mild	HPGDS	34	41
COCCN1CCC(NC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875156398	GF	On-Demand	Mild	DRD4	20	40
COCCN1CCC(NC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875156398	GF	On-Demand	Mild	SLC6A5	31	40
COCCN1CCC(NC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875156398	GF	On-Demand	Mild	MCHR1	44	45
COCCN1CCC(NC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875156398	GF	On-Demand	Mild	HPGDS	34	41
COCCN1CCC(NC(=O)N2CCC[C@H](C(C)(C)O)C2)CC1	ZINC000875156403	ED	On-Demand	Anodyne	CACNA1I	42	37
O=C(NCCC(=O)N1CCCCCC1)C(=O)NCc1cccc2ncccc12	ZINC000875156447	GD	On-Demand	Anodyne	HNMT	57	37
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2(c3ccc(F)cc3)CCC2)C1	ZINC000875156497	FE	On-Demand	Anodyne	CACNA1G	21	49
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2(c3ccc(F)cc3)CCC2)C1	ZINC000875156498	FE	On-Demand	Anodyne	CACNA1G	21	49
C=CC(C)(C)CCNC(=O)C(=O)NC[C@@H](C)NC(=O)OC(C)(C)C	ZINC000875156551	ED	On-Demand	Mild	CTSK	15	42
C=CC(C)(C)CCNC(=O)C(=O)NC[C@H](C)NC(=O)OC(C)(C)C	ZINC000875156553	ED	On-Demand	Mild	CTSK	15	42
CCC[C@H](CC)C(=O)Nc1c(C)cccc1C(=O)N1CCCC1	ZINC000875156636	DH	On-Demand	Anodyne	KCNQ2	41	35
CCC[C@@H](CC)C(=O)Nc1c(C)cccc1C(=O)N1CCCC1	ZINC000875156642	DH	On-Demand	Anodyne	KCNQ2	41	35
Cn1cnnc1-c1ccc(NC(=O)[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000875156663	GH	On-Demand	Anodyne	C3AR1	43	43
Cn1cnnc1-c1ccc(NC(=O)[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000875156663	GH	On-Demand	Anodyne	NAMPT	50	39
Cn1cnnc1-c1ccc(NC(=O)[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000875156665	GH	On-Demand	Anodyne	C3AR1	43	43
Cn1cnnc1-c1ccc(NC(=O)[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000875156665	GH	On-Demand	Anodyne	NAMPT	50	39
C[C@@H](C1CC1)N(C)C(=O)c1cc(=O)c2ccccc2o1	ZINC000875156744	CF	On-Demand	Anodyne	TNKS	27	41
O=C(Nc1ccc(S(=O)(=O)C2CCCC2)cc1)C1(F)CCOCC1	ZINC000875156747	FF	On-Demand	Anodyne	NAMPT	20	43
COc1ccc(N2CCN(C(=O)C(=O)NCc3ncccc3C)CC2)c(OC)c1	ZINC000875156778	GD	On-Demand	Clean	HTR1A	47	38
COc1ccc(N2CCN(C(=O)C(=O)NCc3ncccc3C)CC2)c(OC)c1	ZINC000875156778	GD	On-Demand	Clean	DRD2	36	40
COc1ccc(N2CCN(C(=O)C(=O)NCc3ncccc3C)CC2)c(OC)c1	ZINC000875156778	GD	On-Demand	Clean	DRD4	42	33
COc1ccc(N2CCN(C(=O)C(=O)NCc3ncccc3C)CC2)c(OC)c1	ZINC000875156778	GD	On-Demand	Clean	ADRA1D	33	45
COc1ccc(N2CCN(C(=O)C(=O)NCc3ncccc3C)CC2)c(OC)c1	ZINC000875156778	GD	On-Demand	Clean	ADRA1A	30	45
COc1ccc(N2CCN(C(=O)C(=O)NCc3ncccc3C)CC2)c(OC)c1	ZINC000875156778	GD	On-Demand	Clean	DRD3	55	37
COc1ccc(N2CCN(C(=O)C(=O)NCc3ncccc3C)CC2)c(OC)c1	ZINC000875156778	GD	On-Demand	Clean	PDGFRB	59	39
COc1ccc(N2CCN(C(=O)C(=O)NCc3ncccc3C)CC2)c(OC)c1	ZINC000875156778	GD	On-Demand	Clean	LCK	20	41
O=C(Nc1ccc(S(=O)(=O)C2CCCC2)cc1)c1scnc1C(F)F	ZINC000875156783	GI	On-Demand	Anodyne	GCK	23	41
COCCN1CCC(NC(=O)N2CCOC[C@H]2c2ccc(OC)cc2)CC1	ZINC000875156801	GD	On-Demand	Anodyne	PDK1	41	34
COCCN1CCC(NC(=O)N2CCOC[C@H]2c2ccc(OC)cc2)CC1	ZINC000875156801	GD	On-Demand	Anodyne	MCHR1	17	40
COCCN1CCC(NC(=O)N2CCOC[C@@H]2c2ccc(OC)cc2)CC1	ZINC000875156802	GD	On-Demand	Anodyne	PDK1	41	34
COCCN1CCC(NC(=O)N2CCOC[C@@H]2c2ccc(OC)cc2)CC1	ZINC000875156802	GD	On-Demand	Anodyne	MCHR1	17	40
COCCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875156812	FD	On-Demand	Anodyne	CHRM2	21	42
COCCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875156812	FD	On-Demand	Anodyne	CHRM1	22	42
COCCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875156812	FD	On-Demand	Anodyne	DRD2	29	50
COCCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875156812	FD	On-Demand	Anodyne	DRD4	52	50
COCCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875156812	FD	On-Demand	Anodyne	ACHE	40	48
COCCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875156812	FD	On-Demand	Anodyne	DRD3	24	48
COCCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875156812	FD	On-Demand	Anodyne	HTR4	59	48
COCCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875156812	FD	On-Demand	Anodyne	CHRM3	31	42
COCCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875156812	FD	On-Demand	Anodyne	LTA4H	25	48
COCCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875156812	FD	On-Demand	Anodyne	HTR7	15	41
COCCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875156812	FD	On-Demand	Anodyne	SIGMAR1	61	50
COCCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875156812	FD	On-Demand	Anodyne	SSTR5	49	41
COCCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875156812	FD	On-Demand	Anodyne	CCR3	38	45
COCCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875156812	FD	On-Demand	Anodyne	SLC6A5	25	41
COCCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875156812	FD	On-Demand	Anodyne	EPHX2	15	44
COCCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875156812	FD	On-Demand	Anodyne	MCHR1	41	51
COCCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875156812	FD	On-Demand	Anodyne	CACNA1G	27	41
COCCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875156812	FD	On-Demand	Anodyne	CCR8	31	44
O=C(Cc1ccc(Cl)cn1)Nc1ccc(S(=O)(=O)C2CCCC2)cc1	ZINC000875156816	GH	On-Demand	Anodyne	CA5B	26	44
O=C(Cc1ccc(Cl)cn1)Nc1ccc(S(=O)(=O)C2CCCC2)cc1	ZINC000875156816	GH	On-Demand	Anodyne	CA5A	30	44
O=C(Cc1ccc(Cl)cn1)Nc1ccc(S(=O)(=O)C2CCCC2)cc1	ZINC000875156816	GH	On-Demand	Anodyne	NAMPT	20	40
COCCN1CCC(NC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875156820	GE	On-Demand	Anodyne	SLC6A1	44	39
COCCN1CCC(NC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875156820	GE	On-Demand	Anodyne	SLC6A3	24	47
COCCN1CCC(NC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875156820	GE	On-Demand	Anodyne	HTR4	43	37
COCCN1CCC(NC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875156820	GE	On-Demand	Anodyne	LTA4H	27	44
COCCN1CCC(NC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875156820	GE	On-Demand	Anodyne	HTR7	15	41
COCCN1CCC(NC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875156820	GE	On-Demand	Anodyne	SIGMAR1	22	42
COCCN1CCC(NC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875156820	GE	On-Demand	Anodyne	CCR5	34	43
COCCN1CCC(NC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875156820	GE	On-Demand	Anodyne	CPT1A	48	33
COCCN1CCC(NC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875156822	GE	On-Demand	Anodyne	SLC6A1	44	39
COCCN1CCC(NC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875156822	GE	On-Demand	Anodyne	SLC6A3	24	47
COCCN1CCC(NC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875156822	GE	On-Demand	Anodyne	HTR4	43	37
COCCN1CCC(NC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875156822	GE	On-Demand	Anodyne	LTA4H	27	44
COCCN1CCC(NC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875156822	GE	On-Demand	Anodyne	HTR7	15	41
COCCN1CCC(NC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875156822	GE	On-Demand	Anodyne	SIGMAR1	22	42
COCCN1CCC(NC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875156822	GE	On-Demand	Anodyne	CCR5	34	43
COCCN1CCC(NC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875156822	GE	On-Demand	Anodyne	CPT1A	48	33
COCCN1CCC(NC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875156824	GE	On-Demand	Anodyne	SLC6A1	44	39
COCCN1CCC(NC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875156824	GE	On-Demand	Anodyne	SLC6A3	24	47
COCCN1CCC(NC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875156824	GE	On-Demand	Anodyne	HTR4	43	37
COCCN1CCC(NC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875156824	GE	On-Demand	Anodyne	LTA4H	27	44
COCCN1CCC(NC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875156824	GE	On-Demand	Anodyne	HTR7	15	41
COCCN1CCC(NC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875156824	GE	On-Demand	Anodyne	SIGMAR1	22	42
COCCN1CCC(NC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875156824	GE	On-Demand	Anodyne	CCR5	34	43
COCCN1CCC(NC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875156824	GE	On-Demand	Anodyne	CPT1A	48	33
COCCN1CCC(NC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875156826	GE	On-Demand	Anodyne	SLC6A1	44	39
COCCN1CCC(NC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875156826	GE	On-Demand	Anodyne	SLC6A3	24	47
COCCN1CCC(NC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875156826	GE	On-Demand	Anodyne	HTR4	43	37
COCCN1CCC(NC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875156826	GE	On-Demand	Anodyne	LTA4H	27	44
COCCN1CCC(NC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875156826	GE	On-Demand	Anodyne	HTR7	15	41
COCCN1CCC(NC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875156826	GE	On-Demand	Anodyne	SIGMAR1	22	42
COCCN1CCC(NC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875156826	GE	On-Demand	Anodyne	CCR5	34	43
COCCN1CCC(NC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875156826	GE	On-Demand	Anodyne	CPT1A	48	33
COCCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875156844	GD	On-Demand	Anodyne	DRD4	18	45
COCCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875156844	GD	On-Demand	Anodyne	LTA4H	16	44
COCCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875156844	GD	On-Demand	Anodyne	SIGMAR1	18	46
COCCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875156844	GD	On-Demand	Anodyne	MMP13	19	41
COCCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875156844	GD	On-Demand	Anodyne	SLC6A5	35	43
COCCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875156844	GD	On-Demand	Anodyne	MMP9	15	41
COCCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875156844	GD	On-Demand	Anodyne	PDK1	41	36
COCCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875156844	GD	On-Demand	Anodyne	MMP1	16	41
COCCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875156844	GD	On-Demand	Anodyne	MCHR1	23	45
COCCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875156845	GD	On-Demand	Anodyne	DRD4	18	45
COCCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875156845	GD	On-Demand	Anodyne	LTA4H	16	44
COCCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875156845	GD	On-Demand	Anodyne	SIGMAR1	18	46
COCCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875156845	GD	On-Demand	Anodyne	MMP13	19	41
COCCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875156845	GD	On-Demand	Anodyne	SLC6A5	35	43
COCCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875156845	GD	On-Demand	Anodyne	MMP9	15	41
COCCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875156845	GD	On-Demand	Anodyne	PDK1	41	36
COCCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875156845	GD	On-Demand	Anodyne	MMP1	16	41
COCCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875156845	GD	On-Demand	Anodyne	MCHR1	23	45
CN1CCO[C@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)C1	ZINC000875156861	FD	On-Demand	Anodyne	FAAH	61	39
CN1CCO[C@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)C1	ZINC000875156861	FD	On-Demand	Anodyne	CES1	58	35
CN1CCO[C@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)C1	ZINC000875156861	FD	On-Demand	Anodyne	AMP1_PLAFQ	21	41
CN1CCO[C@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)C1	ZINC000875156861	FD	On-Demand	Anodyne	CES1D	44	32
CN1CCO[C@@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)C1	ZINC000875156862	FD	On-Demand	Anodyne	FAAH	61	39
CN1CCO[C@@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)C1	ZINC000875156862	FD	On-Demand	Anodyne	CES1	58	35
CN1CCO[C@@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)C1	ZINC000875156862	FD	On-Demand	Anodyne	AMP1_PLAFQ	21	41
CN1CCO[C@@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)C1	ZINC000875156862	FD	On-Demand	Anodyne	CES1D	44	32
COCCN1CCC(NC(=O)N2CC(CNC(=O)C(F)(F)F)C2)CC1	ZINC000875156871	FC	On-Demand	Anodyne	CACNA1I	66	39
C[C@@H](C1CC1)N(C)C(=O)c1cc(-c2ccc(F)cc2)nc2ccccc12	ZINC000875156904	EJ	On-Demand	Anodyne	DHODH	34	46
C[C@@H](C1CC1)N(C)C(=O)c1cc(-c2ccc(F)cc2)nc2ccccc12	ZINC000875156904	EJ	On-Demand	Anodyne	PRS	53	45
C[C@@H](C1CC1)N(C)C(=O)c1cc(-c2ccc(F)cc2)nc2ccccc12	ZINC000875156904	EJ	On-Demand	Anodyne	TACR3	37	45
C[C@@H](C1CC1)N(C)C(=O)c1cc(-c2ccc(F)cc2)nc2ccccc12	ZINC000875156904	EJ	On-Demand	Anodyne	MTTP	43	32
C[C@@H](C1CC1)N(C)C(=O)c1cc(-c2ccc(F)cc2)nc2ccccc12	ZINC000875156904	EJ	On-Demand	Anodyne	MT-CO2	52	45
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000875156907	GD	On-Demand	Anodyne	SLC6A1	41	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000875156907	GD	On-Demand	Anodyne	SIGMAR1	25	41
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCCc3cc(OC(F)F)ccc32)CC1	ZINC000875156911	GF	On-Demand	Anodyne	BDKRB1	61	41
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCCc3cc(OC(F)F)ccc32)CC1	ZINC000875156913	GF	On-Demand	Anodyne	BDKRB1	61	41
O=C(NCCC(=O)N1CCN(c2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875157044	GC	On-Demand	Anodyne	ADAM10	38	42
O=C(NCCC(=O)N1CCN(c2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875157045	GC	On-Demand	Anodyne	ADAM10	38	42
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCC[C@@H]2CCSC2)C1	ZINC000875157080	GD	On-Demand	Anodyne	HTR1A	62	42
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCC[C@@H]2CCSC2)C1	ZINC000875157080	GD	On-Demand	Anodyne	DRD2	46	42
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCC[C@@H]2CCSC2)C1	ZINC000875157080	GD	On-Demand	Anodyne	DRD4	26	40
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCC[C@@H]2CCSC2)C1	ZINC000875157080	GD	On-Demand	Anodyne	ADRA1D	45	38
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCC[C@@H]2CCSC2)C1	ZINC000875157080	GD	On-Demand	Anodyne	ADRA1A	41	38
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCC[C@@H]2CCSC2)C1	ZINC000875157080	GD	On-Demand	Anodyne	DRD3	53	41
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCC[C@@H]2CCSC2)C1	ZINC000875157080	GD	On-Demand	Anodyne	SIRT2	43	29
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCC[C@H]2CCSC2)C1	ZINC000875157081	GD	On-Demand	Anodyne	HTR1A	62	42
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCC[C@H]2CCSC2)C1	ZINC000875157081	GD	On-Demand	Anodyne	DRD2	46	42
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCC[C@H]2CCSC2)C1	ZINC000875157081	GD	On-Demand	Anodyne	DRD4	26	40
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCC[C@H]2CCSC2)C1	ZINC000875157081	GD	On-Demand	Anodyne	ADRA1D	45	38
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCC[C@H]2CCSC2)C1	ZINC000875157081	GD	On-Demand	Anodyne	ADRA1A	41	38
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCC[C@H]2CCSC2)C1	ZINC000875157081	GD	On-Demand	Anodyne	DRD3	53	41
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCC[C@H]2CCSC2)C1	ZINC000875157081	GD	On-Demand	Anodyne	SIRT2	43	29
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCC[C@@H]2CCSC2)C1	ZINC000875157082	GD	On-Demand	Anodyne	HTR1A	62	42
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCC[C@@H]2CCSC2)C1	ZINC000875157082	GD	On-Demand	Anodyne	DRD2	46	42
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCC[C@@H]2CCSC2)C1	ZINC000875157082	GD	On-Demand	Anodyne	DRD4	26	40
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCC[C@@H]2CCSC2)C1	ZINC000875157082	GD	On-Demand	Anodyne	ADRA1D	45	38
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCC[C@@H]2CCSC2)C1	ZINC000875157082	GD	On-Demand	Anodyne	ADRA1A	41	38
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCC[C@@H]2CCSC2)C1	ZINC000875157082	GD	On-Demand	Anodyne	DRD3	53	41
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCC[C@@H]2CCSC2)C1	ZINC000875157082	GD	On-Demand	Anodyne	SIRT2	43	29
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCC[C@H]2CCSC2)C1	ZINC000875157083	GD	On-Demand	Anodyne	HTR1A	62	42
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCC[C@H]2CCSC2)C1	ZINC000875157083	GD	On-Demand	Anodyne	DRD2	46	42
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCC[C@H]2CCSC2)C1	ZINC000875157083	GD	On-Demand	Anodyne	DRD4	26	40
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCC[C@H]2CCSC2)C1	ZINC000875157083	GD	On-Demand	Anodyne	ADRA1D	45	38
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCC[C@H]2CCSC2)C1	ZINC000875157083	GD	On-Demand	Anodyne	ADRA1A	41	38
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCC[C@H]2CCSC2)C1	ZINC000875157083	GD	On-Demand	Anodyne	DRD3	53	41
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCC[C@H]2CCSC2)C1	ZINC000875157083	GD	On-Demand	Anodyne	SIRT2	43	29
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000875157084	GD	On-Demand	Anodyne	SLC6A1	41	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000875157084	GD	On-Demand	Anodyne	SIGMAR1	25	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@H]32)C1	ZINC000875157085	GD	On-Demand	Anodyne	SLC6A1	41	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@H]32)C1	ZINC000875157085	GD	On-Demand	Anodyne	SIGMAR1	25	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@H]32)C1	ZINC000875157086	GD	On-Demand	Anodyne	SLC6A1	41	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@H]32)C1	ZINC000875157086	GD	On-Demand	Anodyne	SIGMAR1	25	41
C[C@@H](NC(=O)N1CCn2nnc(CO)c2C1)c1ccc(N2CCOCC2)cc1	ZINC000875157115	GC	On-Demand	Clean	STAT6	51	32
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccc(N2CCOCC2)cc1	ZINC000875157124	FD	On-Demand	Clean	AKR1C3	15	42
CCOC1CC2(C1)C[C@H]2C(=O)Nc1ccc(S(=O)(=O)C2CCCC2)cc1	ZINC000875157175	GH	On-Demand	Anodyne	TIMP3	47	31
CCCCCCCNC(=O)C(=O)NCCc1ccc(C)nc1	ZINC000875157188	DE	On-Demand	Mild	INHA	42	31
CCCCCCCNC(=O)C(=O)NCCc1ccc(C)nc1	ZINC000875157188	DE	On-Demand	Mild	S1PR2	64	40
CCCCCCCNC(=O)C(=O)NCCc1ccc(C)nc1	ZINC000875157188	DE	On-Demand	Mild	ASAH1	86	36
COCCN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875157227	FD	On-Demand	Anodyne	DRD2	22	41
COCCN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875157227	FD	On-Demand	Anodyne	DRD4	35	45
COCCN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875157227	FD	On-Demand	Anodyne	HRH2	19	40
COCCN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875157227	FD	On-Demand	Anodyne	HTR4	62	39
COCCN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875157227	FD	On-Demand	Anodyne	SIGMAR1	19	48
COCCN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875157227	FD	On-Demand	Anodyne	CCR3	46	38
COCCN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875157227	FD	On-Demand	Anodyne	SLC6A5	27	41
COCCN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875157227	FD	On-Demand	Anodyne	EPHX2	28	43
COCCN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875157227	FD	On-Demand	Anodyne	MCHR1	35	41
COCCN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875157227	FD	On-Demand	Anodyne	CACNA1I	59	41
COCCN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875157229	FD	On-Demand	Anodyne	DRD2	22	41
COCCN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875157229	FD	On-Demand	Anodyne	DRD4	35	45
COCCN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875157229	FD	On-Demand	Anodyne	HRH2	19	40
COCCN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875157229	FD	On-Demand	Anodyne	HTR4	62	39
COCCN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875157229	FD	On-Demand	Anodyne	SIGMAR1	19	48
COCCN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875157229	FD	On-Demand	Anodyne	CCR3	46	38
COCCN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875157229	FD	On-Demand	Anodyne	SLC6A5	27	41
COCCN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875157229	FD	On-Demand	Anodyne	EPHX2	28	43
COCCN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875157229	FD	On-Demand	Anodyne	MCHR1	35	41
COCCN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875157229	FD	On-Demand	Anodyne	CACNA1I	59	41
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)C2CCCC2)cc1	ZINC000875157233	EF	On-Demand	Anodyne	CA1	16	40
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)C2CCCC2)cc1	ZINC000875157233	EF	On-Demand	Anodyne	CA4	17	40
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)C2CCCC2)cc1	ZINC000875157233	EF	On-Demand	Anodyne	F13A1	46	35
Cc1ccnn1CC(=O)Nc1ccc(S(=O)(=O)C2CCCC2)cc1	ZINC000875157233	EF	On-Demand	Anodyne	NAMPT	45	40
CC(C)(C)NS(=O)(=O)c1ccccc1CNC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875157234	GE	On-Demand	Anodyne	EPHX2	18	42
CC(C)(C)NS(=O)(=O)c1ccccc1CNC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875157236	GE	On-Demand	Anodyne	EPHX2	18	42
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCc1ccc(C)nc1)CC2	ZINC000875157246	GE	On-Demand	Anodyne	SLC18A2	47	33
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCc1ccc(C)nc1)CC2	ZINC000875157246	GE	On-Demand	Anodyne	HCRTR1	15	43
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCc1ccc(C)nc1)CC2	ZINC000875157246	GE	On-Demand	Anodyne	MTNR1B	15	43
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCc1ccc(C)nc1)CC2	ZINC000875157250	GE	On-Demand	Anodyne	SLC18A2	47	33
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCc1ccc(C)nc1)CC2	ZINC000875157250	GE	On-Demand	Anodyne	HCRTR1	15	43
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCc1ccc(C)nc1)CC2	ZINC000875157250	GE	On-Demand	Anodyne	MTNR1B	15	43
CCCCCCCNC(=O)C(=O)NC[C@@H]1CN(C)CCO1	ZINC000875157257	CC	On-Demand	Mild	ASAH1	50	35
CCCCCCCNC(=O)C(=O)NC[C@H]1CN(C)CCO1	ZINC000875157259	CC	On-Demand	Mild	ASAH1	50	35
COCCN1CCC(NC(=O)N2Cc3cccc(O)c3C2)CC1	ZINC000875157281	DD	On-Demand	Clean	DRD4	40	31
COCCN1CCC(NC(=O)N2Cc3cccc(O)c3C2)CC1	ZINC000875157281	DD	On-Demand	Clean	HTR7	16	41
COCCN1CCC(NC(=O)N2Cc3cccc(O)c3C2)CC1	ZINC000875157281	DD	On-Demand	Clean	SIGMAR1	15	40
O=C(CCCOC1CCOCC1)Nc1ccc(S(=O)(=O)C2CCCC2)cc1	ZINC000875157292	GG	On-Demand	Anodyne	GCK	15	41
C[C@@H](C1CC1)N(C)C(=O)c1cc(Br)ccc1OCc1ccccc1	ZINC000875157319	GJ	On-Demand	Anodyne	PTGER1	53	40
CN1CC[C@H]2CN(C(=O)C(=O)NCCOc3cccnc3)CC[C@H]21	ZINC000875157322	EC	On-Demand	Anodyne	CHRNA7	46	35
CN1CC[C@H]2CN(C(=O)C(=O)NCCOc3cccnc3)CC[C@@H]21	ZINC000875157326	EC	On-Demand	Anodyne	CHRNA7	46	35
COCCN1CCC(NC(=O)NNc2cccc(F)c2Br)CC1	ZINC000875157329	GE	On-Demand	Reactive	SIGMAR1	17	41
COCCN1CCC(NC(=O)NNc2cccc(F)c2Br)CC1	ZINC000875157329	GE	On-Demand	Reactive	CCR3	25	40
COCCN1CCC(NC(=O)N(C)OCC(F)(F)F)CC1	ZINC000875157337	DD	On-Demand	Anodyne	SLC6A5	29	40
O=C(Nc1ccc(S(=O)(=O)C2CCCC2)cc1)c1cnc2nccn2c1	ZINC000875157374	FF	On-Demand	Anodyne	NAMPT	33	50
CCOC(=O)c1c(NC(=O)[C@H]2CCCN2C(C)=O)sc2ccccc12	ZINC000875157398	FG	On-Demand	Anodyne	F2	64	38
CCOC(=O)c1c(NC(=O)[C@H]2CCCN2C(C)=O)sc2ccccc12	ZINC000875157398	FG	On-Demand	Anodyne	PRSS1	22	42
CCOC(=O)c1c(NC(=O)[C@H]2CCCN2C(C)=O)sc2ccccc12	ZINC000875157398	FG	On-Demand	Anodyne	OPRM1	22	41
CCOC(=O)c1c(NC(=O)[C@H]2CCCN2C(C)=O)sc2ccccc12	ZINC000875157398	FG	On-Demand	Anodyne	ELANE	40	36
CCOC(=O)c1c(NC(=O)[C@H]2CCCN2C(C)=O)sc2ccccc12	ZINC000875157398	FG	On-Demand	Anodyne	CTRA_BOVIN	47	31
CCOC(=O)c1c(NC(=O)[C@H]2CCCN2C(C)=O)sc2ccccc12	ZINC000875157398	FG	On-Demand	Anodyne	ACACA	20	40
CCOC(=O)c1c(NC(=O)[C@H]2CCCN2C(C)=O)sc2ccccc12	ZINC000875157398	FG	On-Demand	Anodyne	TRY1_BOVIN	91	42
CCOC(=O)c1c(NC(=O)[C@H]2CCCN2C(C)=O)sc2ccccc12	ZINC000875157398	FG	On-Demand	Anodyne	ACACB	22	40
CCOC(=O)c1c(NC(=O)[C@H]2CCCN2C(C)=O)sc2ccccc12	ZINC000875157398	FG	On-Demand	Anodyne	PREP	41	40
CCOC(=O)c1c(NC(=O)[C@H]2CCCN2C(C)=O)sc2ccccc12	ZINC000875157398	FG	On-Demand	Anodyne	CELA2A	48	31
CCOC(=O)c1c(NC(=O)[C@H]2CCCN2C(C)=O)sc2ccccc12	ZINC000875157398	FG	On-Demand	Anodyne	LGMN	100	42
CCOC(=O)c1c(NC(=O)[C@H]2CCCN2C(C)=O)sc2ccccc12	ZINC000875157398	FG	On-Demand	Anodyne	XIAP	49	39
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NC[C@@H]1CN(C)CCO1)CC2	ZINC000875157424	GC	On-Demand	Anodyne	SLC18A2	46	34
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NC[C@H]1CN(C)CCO1)CC2	ZINC000875157427	GC	On-Demand	Anodyne	SLC18A2	46	34
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NC[C@@H]1CN(C)CCO1)CC2	ZINC000875157429	GC	On-Demand	Anodyne	SLC18A2	46	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NC[C@H]1CN(C)CCO1)CC2	ZINC000875157432	GC	On-Demand	Anodyne	SLC18A2	46	34
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCCc2cc(OC(F)F)ccc21	ZINC000875157447	GE	On-Demand	Mild	BDKRB1	50	37
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCCc2cc(OC(F)F)ccc21	ZINC000875157448	GE	On-Demand	Mild	BDKRB1	50	37
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H]1CCCc2cc(OC(F)F)ccc21	ZINC000875157450	GE	On-Demand	Mild	BDKRB1	50	37
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H]1CCCc2cc(OC(F)F)ccc21	ZINC000875157452	GE	On-Demand	Mild	BDKRB1	50	37
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCc2ccc(OC)c(OC)c2)C1	ZINC000875157527	GE	On-Demand	Anodyne	MTNR1B	21	46
C[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C)C(=O)C2)c1ccc(N2CCOCC2)cc1	ZINC000875157529	FF	On-Demand	Clean	PRCP	16	41
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C)C(=O)C2)c1ccc(N2CCOCC2)cc1	ZINC000875157530	FF	On-Demand	Clean	PRCP	16	41
C[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C)C(=O)C2)c1ccc(N2CCOCC2)cc1	ZINC000875157531	FF	On-Demand	Clean	PRCP	16	41
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)c1cc2c(Cl)nccc2s1	ZINC000875157558	GJ	On-Demand	Anodyne	LCK	38	43
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)c1cc2c(Cl)nccc2s1	ZINC000875157558	GJ	On-Demand	Anodyne	FYN	36	41
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)c1cc2c(Cl)nccc2s1	ZINC000875157558	GJ	On-Demand	Anodyne	FGR	21	41
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)c1cc2c(Cl)nccc2s1	ZINC000875157558	GJ	On-Demand	Anodyne	G2YM83_BOTF4	45	32
C[C@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccsc1	ZINC000875157565	FD	On-Demand	Anodyne	L3MBTL3	63	43
CC(=O)C1CCN(C(=O)C(=O)NCCNC(=O)Cc2cccc(F)c2)CC1	ZINC000875157574	GC	On-Demand	Anodyne	CACNA1G	28	40
C[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C)[C@H](O)C2)c1ccc(N2CCOCC2)cc1	ZINC000875157599	FF	On-Demand	Clean	PRCP	18	45
C[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C)[C@@H](O)C2)c1ccc(N2CCOCC2)cc1	ZINC000875157602	FF	On-Demand	Clean	PRCP	18	45
C[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C)[C@H](O)C2)c1ccc(N2CCOCC2)cc1	ZINC000875157605	FF	On-Demand	Clean	PRCP	18	45
C[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C)[C@@H](O)C2)c1ccc(N2CCOCC2)cc1	ZINC000875157607	FF	On-Demand	Clean	PRCP	18	45
COCCN1CCC(NC(=O)NC2CC(C(=O)OC)C2)CC1	ZINC000875157634	DC	On-Demand	Anodyne	EPHX2	22	44
Cc1ccn(C[C@H](C)C(=O)Nc2ccc(-n3cccn3)cc2C(F)(F)F)n1	ZINC000875157638	GH	On-Demand	Anodyne	AMP1_PLAFQ	55	39
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2ccc(C)nc2)C1	ZINC000875157641	DC	On-Demand	Anodyne	GPBAR1	25	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2ccc(C)nc2)C1	ZINC000875157643	DC	On-Demand	Anodyne	GPBAR1	25	44
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(OCCN2CCOCC2)c1	ZINC000875157647	GD	On-Demand	Anodyne	HRH2	29	47
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(OCCN2CCOCC2)c1	ZINC000875157647	GD	On-Demand	Anodyne	LTA4H	16	40
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(OCCN2CCOCC2)c1	ZINC000875157647	GD	On-Demand	Anodyne	ROCK2	25	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(OCCN2CCOCC2)c1	ZINC000875157647	GD	On-Demand	Anodyne	EPHX2	27	44
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(OCCN2CCOCC2)c1	ZINC000875157647	GD	On-Demand	Anodyne	PDS	66	36
O=C(N[C@H]1CC12CCC2)C(=O)N[C@@H]1CCCc2cc(OC(F)F)ccc21	ZINC000875157729	FF	On-Demand	Anodyne	BDKRB1	41	35
O=C(N[C@H]1CCCc2cc(OC(F)F)ccc21)C(=O)N[C@H]1CC12CCC2	ZINC000875157731	FF	On-Demand	Anodyne	BDKRB1	41	35
O=C(N[C@@H]1CCCc2cc(OC(F)F)ccc21)C(=O)N[C@@H]1CC12CCC2	ZINC000875157733	FF	On-Demand	Anodyne	BDKRB1	41	35
O=C(N[C@H]1CCCc2cc(OC(F)F)ccc21)C(=O)N[C@@H]1CC12CCC2	ZINC000875157737	FF	On-Demand	Anodyne	BDKRB1	41	35
COCCN1CCC(NC(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875157743	DC	On-Demand	Anodyne	CACNA1I	50	38
COCCN1CCC(NC(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875157745	DC	On-Demand	Anodyne	CACNA1I	50	38
O=C(NCc1cccc(OCCN2CCOCC2)c1)N1Cc2cccc(O)c2C1	ZINC000875157779	GE	On-Demand	Clean	ESR1	62	40
O=C(NCc1cccc(OCCN2CCOCC2)c1)N1Cc2cccc(O)c2C1	ZINC000875157779	GE	On-Demand	Clean	ESR2	42	40
O=C(NCc1cccc(OCCN2CCOCC2)c1)N1Cc2cccc(O)c2C1	ZINC000875157779	GE	On-Demand	Clean	LTA4H	18	41
O=C(NCc1cccc(OCCN2CCOCC2)c1)N1Cc2cccc(O)c2C1	ZINC000875157779	GE	On-Demand	Clean	HRH3	18	42
O=C(NCc1cccc(OCCN2CCOCC2)c1)N1Cc2cccc(O)c2C1	ZINC000875157779	GE	On-Demand	Clean	EPHX2	27	43
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1ccsc1	ZINC000875157848	GG	On-Demand	Anodyne	DRD2	21	42
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1ccsc1	ZINC000875157848	GG	On-Demand	Anodyne	DRD4	36	42
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1ccsc1	ZINC000875157848	GG	On-Demand	Anodyne	ACHE	56	54
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1ccsc1	ZINC000875157848	GG	On-Demand	Anodyne	DRD3	15	42
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1ccsc1	ZINC000875157848	GG	On-Demand	Anodyne	SLC6A3	18	51
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1ccsc1	ZINC000875157848	GG	On-Demand	Anodyne	HTR4	27	43
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1ccsc1	ZINC000875157848	GG	On-Demand	Anodyne	SIGMAR1	49	48
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1ccsc1	ZINC000875157848	GG	On-Demand	Anodyne	CAPN2	55	33
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1ccsc1	ZINC000875157848	GG	On-Demand	Anodyne	MCHR1	19	42
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1ccsc1	ZINC000875157848	GG	On-Demand	Anodyne	CACNA1G	26	40
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCOc1cccnc1	ZINC000875157849	FE	On-Demand	Anodyne	PTAFR	27	41
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCOc1cccnc1	ZINC000875157849	FE	On-Demand	Anodyne	CAPN2	66	36
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCOc1cccnc1	ZINC000875157849	FE	On-Demand	Anodyne	PDS	49	35
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCOc1cccnc1	ZINC000875157850	FE	On-Demand	Anodyne	PTAFR	27	41
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCOc1cccnc1	ZINC000875157850	FE	On-Demand	Anodyne	CAPN2	66	36
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCOc1cccnc1	ZINC000875157850	FE	On-Demand	Anodyne	PDS	49	35
CCO[C@@H](C(=O)Nc1ccc(-c2nncn2C)cc1)C1CCOCC1	ZINC000875157869	EE	On-Demand	Anodyne	MTOR	55	34
CN1CCN(C2CCN(C(=O)C(=O)NCCc3cc(F)cc(F)c3)CC2)CC1	ZINC000875157907	GC	On-Demand	Anodyne	L3MBTL3	58	39
COCCN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875157909	EE	On-Demand	Anodyne	HTR1A	30	45
COCCN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875157909	EE	On-Demand	Anodyne	DRD2	39	51
COCCN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875157909	EE	On-Demand	Anodyne	DRD4	39	51
COCCN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875157909	EE	On-Demand	Anodyne	ACHE	17	40
COCCN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875157909	EE	On-Demand	Anodyne	HTR2A	20	43
COCCN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875157909	EE	On-Demand	Anodyne	DRD3	37	44
COCCN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875157909	EE	On-Demand	Anodyne	HTR4	71	40
COCCN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875157909	EE	On-Demand	Anodyne	LTA4H	37	52
COCCN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875157909	EE	On-Demand	Anodyne	HTR7	28	45
COCCN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875157909	EE	On-Demand	Anodyne	SIGMAR1	41	47
COCCN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875157909	EE	On-Demand	Anodyne	CCR3	42	39
COCCN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875157909	EE	On-Demand	Anodyne	EPHX2	53	45
COCCN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875157909	EE	On-Demand	Anodyne	MCHR1	29	45
COCCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(Cl)cc2)CC1	ZINC000875157932	GE	On-Demand	Anodyne	DRD4	22	40
COCCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(Cl)cc2)CC1	ZINC000875157932	GE	On-Demand	Anodyne	SIGMAR1	18	42
COCCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(Cl)cc2)CC1	ZINC000875157932	GE	On-Demand	Anodyne	MCHR1	27	44
COCCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(Cl)cc2)CC1	ZINC000875157932	GE	On-Demand	Anodyne	CACNA1I	58	38
COCCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(Cl)cc2)CC1	ZINC000875157933	GE	On-Demand	Anodyne	DRD4	22	40
COCCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(Cl)cc2)CC1	ZINC000875157933	GE	On-Demand	Anodyne	SIGMAR1	18	42
COCCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(Cl)cc2)CC1	ZINC000875157933	GE	On-Demand	Anodyne	MCHR1	27	44
COCCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(Cl)cc2)CC1	ZINC000875157933	GE	On-Demand	Anodyne	CACNA1I	58	38
COC(=O)N(C)NC(=O)NCc1cccc(OCCN2CCOCC2)c1	ZINC000875157940	FC	On-Demand	Reactive	ESR1	47	37
COC(=O)N(C)NC(=O)NCc1cccc(OCCN2CCOCC2)c1	ZINC000875157940	FC	On-Demand	Reactive	DRD4	40	32
COC(=O)N(C)NC(=O)NCc1cccc(OCCN2CCOCC2)c1	ZINC000875157940	FC	On-Demand	Reactive	ACHE	19	47
COC(=O)N(C)NC(=O)NCc1cccc(OCCN2CCOCC2)c1	ZINC000875157940	FC	On-Demand	Reactive	HRH2	33	43
COC(=O)N(C)NC(=O)NCc1cccc(OCCN2CCOCC2)c1	ZINC000875157940	FC	On-Demand	Reactive	LTA4H	26	43
COC(=O)N(C)NC(=O)NCc1cccc(OCCN2CCOCC2)c1	ZINC000875157940	FC	On-Demand	Reactive	HRH3	16	40
COC(=O)N(C)NC(=O)NCc1cccc(OCCN2CCOCC2)c1	ZINC000875157940	FC	On-Demand	Reactive	ROCK1	26	42
COC(=O)N(C)NC(=O)NCc1cccc(OCCN2CCOCC2)c1	ZINC000875157940	FC	On-Demand	Reactive	ROCK2	30	43
COC(=O)N(C)NC(=O)NCc1cccc(OCCN2CCOCC2)c1	ZINC000875157940	FC	On-Demand	Reactive	EPHX2	31	51
COC(=O)N(C)NC(=O)NCc1cccc(OCCN2CCOCC2)c1	ZINC000875157940	FC	On-Demand	Reactive	FLT3	15	42
COCCN1CCC(NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)CC1	ZINC000875157945	GE	On-Demand	Anodyne	DRD4	24	40
COCCN1CCC(NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)CC1	ZINC000875157945	GE	On-Demand	Anodyne	OPRL1	18	41
COCCN1CCC(NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)CC1	ZINC000875157945	GE	On-Demand	Anodyne	HTR4	46	36
COCCN1CCC(NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)CC1	ZINC000875157945	GE	On-Demand	Anodyne	SIGMAR1	26	42
CO[C@H](C(=O)Nc1ccc(S(=O)(=O)C2CCCC2)cc1)C(=O)OC(C)(C)C	ZINC000875157947	GF	On-Demand	Anodyne	CA2	17	45
CO[C@H](C(=O)Nc1ccc(S(=O)(=O)C2CCCC2)cc1)C(=O)OC(C)(C)C	ZINC000875157947	GF	On-Demand	Anodyne	CA14	17	45
CO[C@H](C(=O)Nc1ccc(S(=O)(=O)C2CCCC2)cc1)C(=O)OC(C)(C)C	ZINC000875157947	GF	On-Demand	Anodyne	P96878_MYCTU	44	39
CCOC(=O)c1c(NC(=O)c2cn(C3CC3)nn2)sc2ccccc12	ZINC000875158007	FG	On-Demand	Anodyne	ACACA	20	42
CCOC(=O)c1c(NC(=O)c2cn(C3CC3)nn2)sc2ccccc12	ZINC000875158007	FG	On-Demand	Anodyne	ACACB	22	42
COC(=O)c1cc(C(=O)Nc2c(C)cccc2C(=O)N2CCCC2)ccc1C	ZINC000875158018	GH	On-Demand	Anodyne	KCNK3	49	37
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)[C@@H]1CCC(=O)N1C(C)C	ZINC000875158045	FF	On-Demand	Anodyne	P2RX7	17	51
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H]1CCCc2cc(OC(F)F)ccc21	ZINC000875158047	GD	On-Demand	Mild	BDKRB1	50	36
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CCCc2cc(OC(F)F)ccc21	ZINC000875158050	GD	On-Demand	Mild	BDKRB1	50	36
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CCCc2cc(OC(F)F)ccc21	ZINC000875158052	GD	On-Demand	Mild	BDKRB1	50	36
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H]1CCCc2cc(OC(F)F)ccc21	ZINC000875158055	GD	On-Demand	Mild	BDKRB1	50	36
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(CSc2nc3ccccc3s2)cc1	ZINC000875158072	IK	On-Demand	Anodyne	HDAC1	20	59
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(CSc2nc3ccccc3s2)cc1	ZINC000875158072	IK	On-Demand	Anodyne	KCNK3	49	35
O=C(NCCOc1cccnc1)C(=O)N1CCC(CCF)CC1	ZINC000875158075	DD	On-Demand	Anodyne	NAMPT	18	40
CCCCCCCNC(=O)C(=O)NCCC(=O)N1CCCCCC1	ZINC000875158076	ED	On-Demand	Mild	ASAH1	81	34
CCCCCCCNC(=O)C(=O)NC[C@@H]1CCOc2ccccc21	ZINC000875158083	EF	On-Demand	Mild	MTNR1A	30	46
CCCCCCCNC(=O)C(=O)NC[C@@H]1CCOc2ccccc21	ZINC000875158083	EF	On-Demand	Mild	ASAH1	63	34
CCCCCCCNC(=O)C(=O)NC[C@@H]1CCOc2ccccc21	ZINC000875158083	EF	On-Demand	Mild	LASR	41	35
CCCCCCCNC(=O)C(=O)NC[C@H]1CCOc2ccccc21	ZINC000875158086	EF	On-Demand	Mild	MTNR1A	30	46
CCCCCCCNC(=O)C(=O)NC[C@H]1CCOc2ccccc21	ZINC000875158086	EF	On-Demand	Mild	ASAH1	63	34
CCCCCCCNC(=O)C(=O)NC[C@H]1CCOc2ccccc21	ZINC000875158086	EF	On-Demand	Mild	LASR	41	35
C[C@@H](C1CC1)N(C)C(=O)c1ccccc1NC(=O)c1ccccc1	ZINC000875158090	DH	On-Demand	Anodyne	PRNP	50	33
C[C@@H](C1CC1)N(C)C(=O)c1ccccc1NC(=O)c1ccccc1	ZINC000875158090	DH	On-Demand	Anodyne	NR1H4	15	43
C[C@@H](C1CC1)N(C)C(=O)c1ccccc1NC(=O)c1ccccc1	ZINC000875158090	DH	On-Demand	Anodyne	KCNK3	72	39
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875158097	GE	On-Demand	Anodyne	HTR1A	66	43
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875158097	GE	On-Demand	Anodyne	DRD2	48	43
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875158097	GE	On-Demand	Anodyne	DRD4	28	40
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875158097	GE	On-Demand	Anodyne	ADRA1D	44	38
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875158097	GE	On-Demand	Anodyne	ADRA1A	41	38
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875158097	GE	On-Demand	Anodyne	DRD3	54	42
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875158097	GE	On-Demand	Anodyne	HTR7	45	39
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875158099	GE	On-Demand	Anodyne	HTR1A	66	43
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875158099	GE	On-Demand	Anodyne	DRD2	48	43
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875158099	GE	On-Demand	Anodyne	DRD4	28	40
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875158099	GE	On-Demand	Anodyne	ADRA1D	44	38
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875158099	GE	On-Demand	Anodyne	ADRA1A	41	38
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875158099	GE	On-Demand	Anodyne	DRD3	54	42
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875158099	GE	On-Demand	Anodyne	HTR7	45	39
Cn1cnnc1-c1ccc(NC(=O)c2coc(C(C)(C)C)n2)cc1	ZINC000875158102	EG	On-Demand	Anodyne	SCN10A	19	42
O=C(NCCOc1cccnc1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875158103	EC	On-Demand	Anodyne	CHRNA7	42	35
O=C(NCCOc1cccnc1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875158105	EC	On-Demand	Anodyne	CHRNA7	42	35
O=C(NCCOc1cccnc1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875158107	EC	On-Demand	Anodyne	CHRNA7	42	35
O=C(NCCOc1cccnc1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875158109	EC	On-Demand	Anodyne	CHRNA7	42	35
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)c1coc(C#N)c1	ZINC000875158197	DF	On-Demand	Mild	S1PR4	15	43
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCCOc2cccnc2)c1	ZINC000875158200	FD	On-Demand	Anodyne	CHRNA7	21	41
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCCOc2cccnc2)c1	ZINC000875158200	FD	On-Demand	Anodyne	CPT1A	41	35
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCCOc2cccnc2)c1	ZINC000875158201	FD	On-Demand	Anodyne	CHRNA7	21	41
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCCOc2cccnc2)c1	ZINC000875158201	FD	On-Demand	Anodyne	CPT1A	41	35
C[C@@H](NC(=O)N1CC[C@H](c2ccc(O)cc2)C1)c1ccc(N2CCOCC2)cc1	ZINC000875158233	GG	On-Demand	Clean	PRCP	17	40
C[C@@H](NC(=O)N1CC[C@@H](c2ccc(O)cc2)C1)c1ccc(N2CCOCC2)cc1	ZINC000875158234	GG	On-Demand	Clean	PRCP	17	40
CC[C@H](C[C@H](C)O)NC(=O)NCCCc1ccc(OC)c(OC)c1	ZINC000875158249	EE	On-Demand	Anodyne	MTNR1A	19	47
CC[C@H](C[C@H](C)O)NC(=O)NCCCc1ccc(OC)c(OC)c1	ZINC000875158249	EE	On-Demand	Anodyne	MTNR1B	21	50
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)c1cc2c(Cl)nccc2o1	ZINC000875158270	GI	On-Demand	Anodyne	G2YM83_BOTF4	50	31
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCCCCC2CC2)C1	ZINC000875158281	FE	On-Demand	Anodyne	HTR1A	85	52
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCCCCC2CC2)C1	ZINC000875158281	FE	On-Demand	Anodyne	ADRA2A	17	44
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCCCCC2CC2)C1	ZINC000875158281	FE	On-Demand	Anodyne	DRD2	74	50
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCCCCC2CC2)C1	ZINC000875158281	FE	On-Demand	Anodyne	DRD1	15	45
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCCCCC2CC2)C1	ZINC000875158281	FE	On-Demand	Anodyne	DRD4	44	48
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCCCCC2CC2)C1	ZINC000875158281	FE	On-Demand	Anodyne	ACHE	15	43
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCCCCC2CC2)C1	ZINC000875158281	FE	On-Demand	Anodyne	ADRA1D	65	42
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCCCCC2CC2)C1	ZINC000875158281	FE	On-Demand	Anodyne	HTR2A	24	44
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCCCCC2CC2)C1	ZINC000875158281	FE	On-Demand	Anodyne	ADRA1A	59	44
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCCCCC2CC2)C1	ZINC000875158281	FE	On-Demand	Anodyne	ADRA1B	48	42
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCCCCC2CC2)C1	ZINC000875158281	FE	On-Demand	Anodyne	DRD3	89	48
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCCCCC2CC2)C1	ZINC000875158281	FE	On-Demand	Anodyne	HTR7	53	41
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCCCCC2CC2)C1	ZINC000875158282	FE	On-Demand	Anodyne	HTR1A	85	52
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCCCCC2CC2)C1	ZINC000875158282	FE	On-Demand	Anodyne	ADRA2A	17	44
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCCCCC2CC2)C1	ZINC000875158282	FE	On-Demand	Anodyne	DRD2	74	50
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCCCCC2CC2)C1	ZINC000875158282	FE	On-Demand	Anodyne	DRD1	15	45
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCCCCC2CC2)C1	ZINC000875158282	FE	On-Demand	Anodyne	DRD4	44	48
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCCCCC2CC2)C1	ZINC000875158282	FE	On-Demand	Anodyne	ACHE	15	43
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCCCCC2CC2)C1	ZINC000875158282	FE	On-Demand	Anodyne	ADRA1D	65	42
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCCCCC2CC2)C1	ZINC000875158282	FE	On-Demand	Anodyne	HTR2A	24	44
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCCCCC2CC2)C1	ZINC000875158282	FE	On-Demand	Anodyne	ADRA1A	59	44
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCCCCC2CC2)C1	ZINC000875158282	FE	On-Demand	Anodyne	ADRA1B	48	42
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCCCCC2CC2)C1	ZINC000875158282	FE	On-Demand	Anodyne	DRD3	89	48
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCCCCC2CC2)C1	ZINC000875158282	FE	On-Demand	Anodyne	HTR7	53	41
N#CCCN1CCN(C(=O)C(=O)NCCOc2cccnc2)CC1	ZINC000875158283	EB	On-Demand	Mild	PTAFR	16	41
O=C(NCCCCC1CC1)C(=O)NCCOc1cccnc1	ZINC000875158298	DD	On-Demand	Anodyne	GRIN2B	17	42
CCO[C@@H](C(=O)Nc1ccc(-c2nncn2C)cc1)[C@H]1CCOC1	ZINC000875158376	ED	On-Demand	Anodyne	MTOR	41	33
CCO[C@@H](C(=O)Nc1ccc(-c2nncn2C)cc1)[C@@H]1CCOC1	ZINC000875158378	ED	On-Demand	Anodyne	MTOR	41	33
O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)C(=O)N[C@@H](c1ccccn1)C1CCC1	ZINC000875158406	FD	On-Demand	Anodyne	TTK	19	40
O=C(NC[C@@H]1CN2CCC[C@H]2CO1)C(=O)N[C@H](c1ccccn1)C1CCC1	ZINC000875158408	FD	On-Demand	Anodyne	TTK	19	40
O=C(NC[C@@H]1CN2CCC[C@H]2CO1)C(=O)N[C@@H](c1ccccn1)C1CCC1	ZINC000875158411	FD	On-Demand	Anodyne	TTK	19	40
O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)C(=O)N[C@H](c1ccccn1)C1CCC1	ZINC000875158412	FD	On-Demand	Anodyne	TTK	19	40
CCCCCCCNC(=O)C(=O)N[C@H](C)c1ccsc1	ZINC000875158444	CG	On-Demand	Mild	CAPN2	18	40
CCCCCCCNC(=O)C(=O)N[C@H](C)c1ccsc1	ZINC000875158444	CG	On-Demand	Mild	ASAH1	93	37
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1ccsc1	ZINC000875158446	CG	On-Demand	Mild	CAPN2	18	40
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1ccsc1	ZINC000875158446	CG	On-Demand	Mild	ASAH1	93	37
C[C@@H](NC(=O)N1CCCC(F)(F)CC1)c1ccc(N2CCOCC2)cc1	ZINC000875158499	FG	On-Demand	Clean	STAT6	45	31
COC(=O)N(C)NC(=O)NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1	ZINC000875158519	FE	On-Demand	Reactive	CARM1	43	33
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@H]32)CC1	ZINC000875158532	GD	On-Demand	Anodyne	SIGMAR1	29	42
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000875158533	GD	On-Demand	Anodyne	SIGMAR1	29	42
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@H]32)CC1	ZINC000875158534	GD	On-Demand	Anodyne	SIGMAR1	29	42
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000875158535	GD	On-Demand	Anodyne	SIGMAR1	29	42
C[C@@H](C1CC1)N(C)C(=O)COc1ccc(-c2ccccc2)cc1	ZINC000875158553	DH	On-Demand	Anodyne	LTA4H	22	41
C[C@@H](C1CC1)N(C)C(=O)COc1ccc(-c2ccccc2)cc1	ZINC000875158553	DH	On-Demand	Anodyne	MMP3	16	41
Cn1cnnc1-c1ccc(NC(=O)c2ccc3c(c2)OC(C)(C)C3)cc1	ZINC000875158588	EG	On-Demand	Anodyne	PRNP	41	37
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875158599	FC	On-Demand	Mild	HTR1A	55	41
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875158599	FC	On-Demand	Mild	DRD2	44	41
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875158599	FC	On-Demand	Mild	DRD4	26	40
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875158599	FC	On-Demand	Mild	ADRA1D	41	37
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875158599	FC	On-Demand	Mild	DRD3	49	38
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875158599	FC	On-Demand	Mild	HTR7	41	37
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875158600	FC	On-Demand	Mild	HTR1A	55	41
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875158600	FC	On-Demand	Mild	DRD2	44	41
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875158600	FC	On-Demand	Mild	DRD4	26	40
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875158600	FC	On-Demand	Mild	ADRA1D	41	37
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875158600	FC	On-Demand	Mild	DRD3	49	38
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875158600	FC	On-Demand	Mild	HTR7	41	37
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875158601	FC	On-Demand	Mild	HTR1A	55	41
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875158601	FC	On-Demand	Mild	DRD2	44	41
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875158601	FC	On-Demand	Mild	DRD4	26	40
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875158601	FC	On-Demand	Mild	ADRA1D	41	37
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875158601	FC	On-Demand	Mild	DRD3	49	38
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875158601	FC	On-Demand	Mild	HTR7	41	37
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875158602	FC	On-Demand	Mild	HTR1A	55	41
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875158602	FC	On-Demand	Mild	DRD2	44	41
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875158602	FC	On-Demand	Mild	DRD4	26	40
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875158602	FC	On-Demand	Mild	ADRA1D	41	37
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875158602	FC	On-Demand	Mild	DRD3	49	38
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875158602	FC	On-Demand	Mild	HTR7	41	37
C[C@H](NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1)c1ccsc1	ZINC000875158658	GF	On-Demand	Anodyne	ETHR	63	42
CN1CCO[C@@H](CNC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000875158717	FC	On-Demand	Anodyne	OXTR	58	37
CN1CCO[C@@H](CNC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000875158718	FC	On-Demand	Anodyne	OXTR	58	37
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)c1noc2c1CC(C)(C)CC2	ZINC000875158724	GH	On-Demand	Anodyne	PANC	49	36
Cc1cc(C(F)(F)F)nc(C(=O)Nc2c(C)cccc2C(=O)N2CCCC2)n1	ZINC000875158738	GH	On-Demand	Anodyne	SHH	40	36
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)c1ccc(-c2cnn(C)c2)cc1	ZINC000875158740	GH	On-Demand	Anodyne	PRNP	50	36
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)c1ccc(-c2cnn(C)c2)cc1	ZINC000875158740	GH	On-Demand	Anodyne	SHH	52	37
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2C[C@@H](OC)CC[C@@H]2C)C1	ZINC000875158751	GD	On-Demand	Anodyne	HTR1A	59	41
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2C[C@@H](OC)CC[C@@H]2C)C1	ZINC000875158751	GD	On-Demand	Anodyne	DRD2	42	43
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2C[C@@H](OC)CC[C@@H]2C)C1	ZINC000875158751	GD	On-Demand	Anodyne	DRD4	26	40
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2C[C@@H](OC)CC[C@@H]2C)C1	ZINC000875158751	GD	On-Demand	Anodyne	DRD3	51	38
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2C[C@H](OC)CC[C@H]2C)C1	ZINC000875158752	GD	On-Demand	Anodyne	HTR1A	59	41
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2C[C@H](OC)CC[C@H]2C)C1	ZINC000875158752	GD	On-Demand	Anodyne	DRD2	42	43
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2C[C@H](OC)CC[C@H]2C)C1	ZINC000875158752	GD	On-Demand	Anodyne	DRD4	26	40
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2C[C@H](OC)CC[C@H]2C)C1	ZINC000875158752	GD	On-Demand	Anodyne	DRD3	51	38
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2C[C@H](OC)CC[C@@H]2C)C1	ZINC000875158753	GD	On-Demand	Anodyne	HTR1A	59	41
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2C[C@H](OC)CC[C@@H]2C)C1	ZINC000875158753	GD	On-Demand	Anodyne	DRD2	42	43
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2C[C@H](OC)CC[C@@H]2C)C1	ZINC000875158753	GD	On-Demand	Anodyne	DRD4	26	40
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2C[C@H](OC)CC[C@@H]2C)C1	ZINC000875158753	GD	On-Demand	Anodyne	DRD3	51	38
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2C[C@@H](OC)CC[C@H]2C)C1	ZINC000875158754	GD	On-Demand	Anodyne	HTR1A	59	41
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2C[C@@H](OC)CC[C@H]2C)C1	ZINC000875158754	GD	On-Demand	Anodyne	DRD2	42	43
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2C[C@@H](OC)CC[C@H]2C)C1	ZINC000875158754	GD	On-Demand	Anodyne	DRD4	26	40
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2C[C@@H](OC)CC[C@H]2C)C1	ZINC000875158754	GD	On-Demand	Anodyne	DRD3	51	38
CN1CCN(C2CCN(C(=O)C(=O)NCCOc3cccnc3)CC2)CC1	ZINC000875158761	GB	On-Demand	Anodyne	L3MBTL3	42	37
C[C@H](NC(=O)N1OC2CCC1CC2)c1ccc(N2CCOCC2)cc1	ZINC000875158797	EF	On-Demand	Clean	PRCP	16	43
C[C@@H](NC(=O)N1OC2CCC1CC2)c1ccc(N2CCOCC2)cc1	ZINC000875158798	EF	On-Demand	Clean	PRCP	16	43
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(N2CCOCC2)cc1	ZINC000875158804	FE	On-Demand	Clean	STAT6	50	31
CN1CCO[C@H](CNC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000875158805	FC	On-Demand	Anodyne	OXTR	58	37
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(N2CCOCC2)cc1	ZINC000875158807	FE	On-Demand	Clean	STAT6	50	31
CN1CCO[C@H](CNC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000875158808	FC	On-Demand	Anodyne	OXTR	58	37
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(N2CCOCC2)cc1	ZINC000875158811	GD	On-Demand	Clean	STAT6	51	33
N#Cc1ccc(CCC(=O)OCCC(N)=O)cc1	ZINC000875158812	BC	On-Demand	Mild	FFAR1	34	43
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1ccc(N2CCOCC2)cc1	ZINC000875158815	GF	On-Demand	Clean	PRCP	17	42
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1ccc(N2CCOCC2)cc1	ZINC000875158817	GF	On-Demand	Clean	PRCP	17	42
COC(=O)N(C)NC(=O)NCCCc1ccc(OC)c(OC)c1	ZINC000875158825	ED	On-Demand	Reactive	INHA	41	35
COC(=O)N(C)NC(=O)NCCCc1ccc(OC)c(OC)c1	ZINC000875158825	ED	On-Demand	Reactive	MTNR1A	27	52
COC(=O)N(C)NC(=O)NCCCc1ccc(OC)c(OC)c1	ZINC000875158825	ED	On-Demand	Reactive	MTNR1B	24	52
COC(=O)N(C)NC(=O)NCCCc1ccc(OC)c(OC)c1	ZINC000875158825	ED	On-Demand	Reactive	MT-ND1	24	42
CO[C@@H]1C[C@@H](NC(=O)NCCCCCCCN(C)C)C1	ZINC000875158875	CD	On-Demand	Anodyne	EPHX2	21	47
COC(=O)N(C)NC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1	ZINC000875158890	ED	On-Demand	Reactive	EPHB4	47	31
COC(=O)N(C)NC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1	ZINC000875158891	ED	On-Demand	Reactive	EPHB4	47	31
COc1ccc([C@@H]2CN(C(=O)C(=O)NCCOc3cccnc3)CCO2)cc1	ZINC000875158901	GD	On-Demand	Anodyne	CHRNA7	15	41
Cn1cnnc1-c1ccc(NC(=O)c2noc3c2CC(C)(C)CC3)cc1	ZINC000875158910	FG	On-Demand	Anodyne	PANC	54	35
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)c1cc2ccnc(Cl)c2s1	ZINC000875158927	GJ	On-Demand	Anodyne	LCK	40	42
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)c1cc2ccnc(Cl)c2s1	ZINC000875158927	GJ	On-Demand	Anodyne	FYN	36	41
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)c1cc2ccnc(Cl)c2s1	ZINC000875158927	GJ	On-Demand	Anodyne	FGR	21	41
Cc1cccc(C(=O)N2CCCC2)c1NC(=O)c1cc2ccnc(Cl)c2s1	ZINC000875158927	GJ	On-Demand	Anodyne	G2YM83_BOTF4	43	31
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875158929	GD	On-Demand	Mild	HTR1A	56	41
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875158929	GD	On-Demand	Mild	DRD2	49	41
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875158929	GD	On-Demand	Mild	DRD4	31	42
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875158929	GD	On-Demand	Mild	ADRA1D	42	37
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875158929	GD	On-Demand	Mild	DRD3	56	38
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875158929	GD	On-Demand	Mild	HTR7	41	37
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875158930	GD	On-Demand	Mild	HTR1A	56	41
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875158930	GD	On-Demand	Mild	DRD2	49	41
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875158930	GD	On-Demand	Mild	DRD4	31	42
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875158930	GD	On-Demand	Mild	ADRA1D	42	37
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875158930	GD	On-Demand	Mild	DRD3	56	38
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875158930	GD	On-Demand	Mild	HTR7	41	37
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875158931	GD	On-Demand	Mild	HTR1A	56	41
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875158931	GD	On-Demand	Mild	DRD2	49	41
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875158931	GD	On-Demand	Mild	DRD4	31	42
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875158931	GD	On-Demand	Mild	ADRA1D	42	37
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875158931	GD	On-Demand	Mild	DRD3	56	38
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875158931	GD	On-Demand	Mild	HTR7	41	37
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875158932	GD	On-Demand	Mild	HTR1A	56	41
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875158932	GD	On-Demand	Mild	DRD2	49	41
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875158932	GD	On-Demand	Mild	DRD4	31	42
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875158932	GD	On-Demand	Mild	ADRA1D	42	37
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875158932	GD	On-Demand	Mild	DRD3	56	38
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875158932	GD	On-Demand	Mild	HTR7	41	37
C[C@@H](NC(=O)N1CC(c2ccccc2)C1)c1ccc(N2CCOCC2)cc1	ZINC000875158947	FG	On-Demand	Clean	KCNQ2	19	46
C[C@@H](NC(=O)N1CC(c2ccccc2)C1)c1ccc(N2CCOCC2)cc1	ZINC000875158947	FG	On-Demand	Clean	PRCP	22	43
C[C@@H](C1CC1)N(C)C(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	ZINC000875158968	GG	On-Demand	Anodyne	EPHX2	19	42
COC(=O)C1(O)CN(C(=O)NCCCc2ccc(OC)c(OC)c2)C1	ZINC000875158978	FC	On-Demand	Anodyne	MTNR1B	17	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCc1ccc(OC)c(OC)c1	ZINC000875159029	GE	On-Demand	Anodyne	FKBP1A	27	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCc1ccc(OC)c(OC)c1	ZINC000875159029	GE	On-Demand	Anodyne	SLC6A4	19	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCc1ccc(OC)c(OC)c1	ZINC000875159029	GE	On-Demand	Anodyne	MTNR1B	17	45
C/C=C\CNC(=O)NCCCCCCCN(C)C	ZINC000875159052	CE	On-Demand	Anodyne	PAOX	17	43
C/C=C/CNC(=O)NCCCCCCCN(C)C	ZINC000875159053	CE	On-Demand	Anodyne	PAOX	17	43
C[C@@H](NC(=O)N1CC=CC1)c1ccc(N2CCOCC2)cc1	ZINC000875159083	DE	On-Demand	Clean	AKR1C3	15	45
C[C@@H](NC(=O)N1CC=CC1)c1ccc(N2CCOCC2)cc1	ZINC000875159083	DE	On-Demand	Clean	STAT6	52	32
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)C1	ZINC000875159088	GD	On-Demand	Anodyne	HTR1A	63	47
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)C1	ZINC000875159088	GD	On-Demand	Anodyne	DRD2	49	47
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)C1	ZINC000875159088	GD	On-Demand	Anodyne	ADRA1D	45	44
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)C1	ZINC000875159088	GD	On-Demand	Anodyne	ADRA1A	40	44
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)C1	ZINC000875159088	GD	On-Demand	Anodyne	ADRA1B	35	44
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)C1	ZINC000875159088	GD	On-Demand	Anodyne	DRD3	52	38
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)C1	ZINC000875159089	GD	On-Demand	Anodyne	HTR1A	63	47
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)C1	ZINC000875159089	GD	On-Demand	Anodyne	DRD2	49	47
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)C1	ZINC000875159089	GD	On-Demand	Anodyne	ADRA1D	45	44
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)C1	ZINC000875159089	GD	On-Demand	Anodyne	ADRA1A	40	44
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)C1	ZINC000875159089	GD	On-Demand	Anodyne	ADRA1B	35	44
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)C1	ZINC000875159089	GD	On-Demand	Anodyne	DRD3	52	38
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)C1	ZINC000875159090	GD	On-Demand	Anodyne	HTR1A	63	47
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)C1	ZINC000875159090	GD	On-Demand	Anodyne	DRD2	49	47
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)C1	ZINC000875159090	GD	On-Demand	Anodyne	ADRA1D	45	44
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)C1	ZINC000875159090	GD	On-Demand	Anodyne	ADRA1A	40	44
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)C1	ZINC000875159090	GD	On-Demand	Anodyne	ADRA1B	35	44
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)C1	ZINC000875159090	GD	On-Demand	Anodyne	DRD3	52	38
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)C1	ZINC000875159091	GD	On-Demand	Anodyne	HTR1A	63	47
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)C1	ZINC000875159091	GD	On-Demand	Anodyne	DRD2	49	47
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)C1	ZINC000875159091	GD	On-Demand	Anodyne	ADRA1D	45	44
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)C1	ZINC000875159091	GD	On-Demand	Anodyne	ADRA1A	40	44
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)C1	ZINC000875159091	GD	On-Demand	Anodyne	ADRA1B	35	44
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)C1	ZINC000875159091	GD	On-Demand	Anodyne	DRD3	52	38
CC(C)(C)C(=O)NCCNC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875159135	GC	On-Demand	Anodyne	NPY2R	65	44
C[C@@H](NC(=O)N1CCN(C)C(C)(C)CC1)c1cccc(N2CCCC2=O)c1	ZINC000875159137	FG	On-Demand	Anodyne	CACNA1H	25	40
CN(C)C(=O)c1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159151	FF	On-Demand	Anodyne	CHRM2	17	50
CN(C)C(=O)c1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159151	FF	On-Demand	Anodyne	DRD2	19	47
CN(C)C(=O)c1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159151	FF	On-Demand	Anodyne	DRD4	47	47
CN(C)C(=O)c1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159151	FF	On-Demand	Anodyne	ACHE	43	49
CN(C)C(=O)c1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159151	FF	On-Demand	Anodyne	SLC6A1	79	35
CN(C)C(=O)c1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159151	FF	On-Demand	Anodyne	OPRD1	21	48
CN(C)C(=O)c1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159151	FF	On-Demand	Anodyne	LTA4H	41	46
CN(C)C(=O)c1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159151	FF	On-Demand	Anodyne	HRH3	24	40
CN(C)C(=O)c1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159151	FF	On-Demand	Anodyne	SIGMAR1	54	51
CN(C)C(=O)c1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159151	FF	On-Demand	Anodyne	CCR3	21	43
CN(C)C(=O)c1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159151	FF	On-Demand	Anodyne	CCR5	31	51
CN(C)C(=O)c1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159151	FF	On-Demand	Anodyne	SLC18A3	26	51
CN(C)C(=O)c1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159151	FF	On-Demand	Anodyne	MLNR	46	41
CN(C)C(=O)c1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159151	FF	On-Demand	Anodyne	S1PR1	16	42
CN(C)C(=O)c1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159151	FF	On-Demand	Anodyne	S1PR5	23	42
CN(C)C(=O)c1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159151	FF	On-Demand	Anodyne	MCHR1	27	41
CN(C)C(=O)c1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159151	FF	On-Demand	Anodyne	CACNA1G	37	40
CN(C)C(=O)c1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159151	FF	On-Demand	Anodyne	CYP2J2	44	31
CN(C)C(=O)c1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159151	FF	On-Demand	Anodyne	MBTPS1	47	37
CN(C)C(=O)c1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159151	FF	On-Demand	Anodyne	NOD2	40	36
CN(C)C(=O)c1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159152	FF	On-Demand	Anodyne	CHRM2	17	50
CN(C)C(=O)c1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159152	FF	On-Demand	Anodyne	DRD2	19	47
CN(C)C(=O)c1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159152	FF	On-Demand	Anodyne	DRD4	47	47
CN(C)C(=O)c1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159152	FF	On-Demand	Anodyne	ACHE	43	49
CN(C)C(=O)c1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159152	FF	On-Demand	Anodyne	SLC6A1	79	35
CN(C)C(=O)c1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159152	FF	On-Demand	Anodyne	OPRD1	21	48
CN(C)C(=O)c1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159152	FF	On-Demand	Anodyne	LTA4H	41	46
CN(C)C(=O)c1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159152	FF	On-Demand	Anodyne	HRH3	24	40
CN(C)C(=O)c1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159152	FF	On-Demand	Anodyne	SIGMAR1	54	51
CN(C)C(=O)c1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159152	FF	On-Demand	Anodyne	CCR3	21	43
CN(C)C(=O)c1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159152	FF	On-Demand	Anodyne	CCR5	31	51
CN(C)C(=O)c1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159152	FF	On-Demand	Anodyne	SLC18A3	26	51
CN(C)C(=O)c1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159152	FF	On-Demand	Anodyne	MLNR	46	41
CN(C)C(=O)c1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159152	FF	On-Demand	Anodyne	S1PR1	16	42
CN(C)C(=O)c1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159152	FF	On-Demand	Anodyne	S1PR5	23	42
CN(C)C(=O)c1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159152	FF	On-Demand	Anodyne	MCHR1	27	41
CN(C)C(=O)c1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159152	FF	On-Demand	Anodyne	CACNA1G	37	40
CN(C)C(=O)c1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159152	FF	On-Demand	Anodyne	CYP2J2	44	31
CN(C)C(=O)c1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159152	FF	On-Demand	Anodyne	MBTPS1	47	37
CN(C)C(=O)c1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875159152	FF	On-Demand	Anodyne	NOD2	40	36
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875159159	FC	On-Demand	Mild	DRD4	42	32
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875159159	FC	On-Demand	Mild	MTNR1B	15	44
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875159160	FC	On-Demand	Mild	DRD4	42	32
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875159160	FC	On-Demand	Mild	MTNR1B	15	44
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875159161	FC	On-Demand	Mild	DRD4	42	32
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875159161	FC	On-Demand	Mild	MTNR1B	15	44
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875159162	FC	On-Demand	Mild	DRD4	42	32
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875159162	FC	On-Demand	Mild	MTNR1B	15	44
CC(C)(C)C(=O)NCCNC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875159168	FD	On-Demand	Anodyne	GHRHR	57	44
CC(C)(C)C(=O)NCCNC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875159169	FD	On-Demand	Anodyne	GHRHR	57	44
CN(C)C(=O)c1ccc(OC(=O)C2(NC(=O)OCc3ccccc3)CC2)cc1	ZINC000875159171	GF	On-Demand	Anodyne	KLK3	41	33
CN(C)C(=O)c1ccc(OC(=O)C2(NC(=O)OCc3ccccc3)CC2)cc1	ZINC000875159171	GF	On-Demand	Anodyne	CTSB	28	40
CN(C)C(=O)c1ccc(OC(=O)C2(NC(=O)OCc3ccccc3)CC2)cc1	ZINC000875159171	GF	On-Demand	Anodyne	CTSK	22	48
CN(C)C(=O)c1ccc(OC(=O)C2(NC(=O)OCc3ccccc3)CC2)cc1	ZINC000875159171	GF	On-Demand	Anodyne	CAPNS1	58	37
CN(C)C(=O)c1ccc(OC(=O)C2(NC(=O)OCc3ccccc3)CC2)cc1	ZINC000875159171	GF	On-Demand	Anodyne	CAPN1	51	36
CN(C)C(=O)c1ccc(OC(=O)C2(NC(=O)OCc3ccccc3)CC2)cc1	ZINC000875159171	GF	On-Demand	Anodyne	CAPN2	78	35
CN(C)C(=O)c1ccc(OC(=O)C2(NC(=O)OCc3ccccc3)CC2)cc1	ZINC000875159171	GF	On-Demand	Anodyne	NPR	61	35
CN(C)C(=O)c1ccc(OC(=O)C2(NC(=O)OCc3ccccc3)CC2)cc1	ZINC000875159171	GF	On-Demand	Anodyne	SLC12A5	63	36
O=C(NCCc1nc2c(s1)CCCC2)C(=O)NCc1cccc2ncccc12	ZINC000875159172	GF	On-Demand	Anodyne	ACHE	36	42
O=C(NCCc1nc2c(s1)CCCC2)C(=O)NCc1cccc2ncccc12	ZINC000875159172	GF	On-Demand	Anodyne	BCHE	51	42
C[C@@H](C1CC1)N(C)C(=O)c1ccc(Cl)c(S(=O)(=O)Nc2ccc(F)cc2)c1	ZINC000875159189	HI	On-Demand	Anodyne	SGK1	51	34
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875159206	FD	On-Demand	Anodyne	HTR1A	77	44
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875159206	FD	On-Demand	Anodyne	DRD2	59	44
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875159206	FD	On-Demand	Anodyne	DRD4	33	42
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875159206	FD	On-Demand	Anodyne	ADRA1D	51	39
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875159206	FD	On-Demand	Anodyne	HTR2A	19	41
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875159206	FD	On-Demand	Anodyne	ADRA1A	47	39
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875159206	FD	On-Demand	Anodyne	ADRA1B	40	39
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875159206	FD	On-Demand	Anodyne	DRD3	63	42
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875159206	FD	On-Demand	Anodyne	HTR7	49	42
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875159207	FD	On-Demand	Anodyne	HTR1A	77	44
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875159207	FD	On-Demand	Anodyne	DRD2	59	44
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875159207	FD	On-Demand	Anodyne	DRD4	33	42
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875159207	FD	On-Demand	Anodyne	ADRA1D	51	39
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875159207	FD	On-Demand	Anodyne	HTR2A	19	41
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875159207	FD	On-Demand	Anodyne	ADRA1A	47	39
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875159207	FD	On-Demand	Anodyne	ADRA1B	40	39
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875159207	FD	On-Demand	Anodyne	DRD3	63	42
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875159207	FD	On-Demand	Anodyne	HTR7	49	42
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875159208	FD	On-Demand	Anodyne	HTR1A	77	44
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875159208	FD	On-Demand	Anodyne	DRD2	59	44
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875159208	FD	On-Demand	Anodyne	DRD4	33	42
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875159208	FD	On-Demand	Anodyne	ADRA1D	51	39
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875159208	FD	On-Demand	Anodyne	HTR2A	19	41
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875159208	FD	On-Demand	Anodyne	ADRA1A	47	39
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875159208	FD	On-Demand	Anodyne	ADRA1B	40	39
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875159208	FD	On-Demand	Anodyne	DRD3	63	42
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875159208	FD	On-Demand	Anodyne	HTR7	49	42
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875159209	FD	On-Demand	Anodyne	HTR1A	77	44
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875159209	FD	On-Demand	Anodyne	DRD2	59	44
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875159209	FD	On-Demand	Anodyne	DRD4	33	42
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875159209	FD	On-Demand	Anodyne	ADRA1D	51	39
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875159209	FD	On-Demand	Anodyne	HTR2A	19	41
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875159209	FD	On-Demand	Anodyne	ADRA1A	47	39
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875159209	FD	On-Demand	Anodyne	ADRA1B	40	39
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875159209	FD	On-Demand	Anodyne	DRD3	63	42
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875159209	FD	On-Demand	Anodyne	HTR7	49	42
COc1cccc(C(C)(C)C(=O)Oc2ccc(C(=O)N(C)C)cc2)c1	ZINC000875159248	EG	On-Demand	Anodyne	MT-ND1	24	48
COc1cccc(C(C)(C)C(=O)Oc2ccc(C(=O)N(C)C)cc2)c1	ZINC000875159248	EG	On-Demand	Anodyne	HSD17B2	24	41
C[C@@H](C1CC1)N(C)C(=O)c1cc(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)ccc1Cl	ZINC000875159251	JK	On-Demand	Anodyne	CACNA1B	54	36
CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cccc(-c3nn[nH]n3)c2)c1	ZINC000875159259	HE	On-Demand	Anodyne	NR2E3	43	31
CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cccc(-c3nn[nH]n3)c2)c1	ZINC000875159259	HE	On-Demand	Anodyne	SMO	17	42
CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cccc(-c3nn[nH]n3)c2)c1	ZINC000875159259	HE	On-Demand	Anodyne	KCNK3	53	37
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCn1cncn1	ZINC000875159277	ED	On-Demand	Anodyne	ACE	20	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCn1cncn1	ZINC000875159277	ED	On-Demand	Anodyne	OPRM1	17	46
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCn1cncn1	ZINC000875159277	ED	On-Demand	Anodyne	CELA1	16	52
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCn1cncn1	ZINC000875159277	ED	On-Demand	Anodyne	MME	28	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCn1cncn1	ZINC000875159277	ED	On-Demand	Anodyne	CASP3	17	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCn1cncn1	ZINC000875159277	ED	On-Demand	Anodyne	BMP1	20	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCn1cncn1	ZINC000875159277	ED	On-Demand	Anodyne	KLK3	84	38
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCn1cncn1	ZINC000875159277	ED	On-Demand	Anodyne	CTSB	76	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCn1cncn1	ZINC000875159277	ED	On-Demand	Anodyne	PAPA1_CARPA	80	38
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCn1cncn1	ZINC000875159277	ED	On-Demand	Anodyne	CYSP_TRYCR	58	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCn1cncn1	ZINC000875159277	ED	On-Demand	Anodyne	HIS3	64	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCn1cncn1	ZINC000875159277	ED	On-Demand	Anodyne	CTSK	41	48
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCn1cncn1	ZINC000875159277	ED	On-Demand	Anodyne	CTSL	47	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCn1cncn1	ZINC000875159277	ED	On-Demand	Anodyne	PGA	23	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCn1cncn1	ZINC000875159277	ED	On-Demand	Anodyne	CAPNS1	70	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCn1cncn1	ZINC000875159277	ED	On-Demand	Anodyne	HLA-DRB1	61	37
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCn1cncn1	ZINC000875159277	ED	On-Demand	Anodyne	CTSS	19	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCn1cncn1	ZINC000875159277	ED	On-Demand	Anodyne	CAPN1	96	48
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCn1cncn1	ZINC000875159277	ED	On-Demand	Anodyne	CASP1	31	45
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCn1cncn1	ZINC000875159277	ED	On-Demand	Anodyne	CAPN2	151	48
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCn1cncn1	ZINC000875159277	ED	On-Demand	Anodyne	TGM2	28	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCn1cncn1	ZINC000875159277	ED	On-Demand	Anodyne	TPSAB1	32	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCn1cncn1	ZINC000875159277	ED	On-Demand	Anodyne	NPR	83	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCn1cncn1	ZINC000875159277	ED	On-Demand	Anodyne	PSMB5	52	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCn1cncn1	ZINC000875159277	ED	On-Demand	Anodyne	Q6PRC7_IXORI	43	37
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(C(=O)N(C)C)cc1	ZINC000875159280	DD	On-Demand	Anodyne	CTSK	26	41
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(C(=O)N(C)C)cc1	ZINC000875159280	DD	On-Demand	Anodyne	CTSL	15	41
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(C(=O)N(C)C)cc1	ZINC000875159280	DD	On-Demand	Anodyne	CAPNS1	47	34
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(C(=O)N(C)C)cc1	ZINC000875159280	DD	On-Demand	Anodyne	CAPN1	62	46
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(C(=O)N(C)C)cc1	ZINC000875159280	DD	On-Demand	Anodyne	CAPN2	60	34
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(C(=O)N(C)C)cc1	ZINC000875159280	DD	On-Demand	Anodyne	ACR	43	34
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(C(=O)N(C)C)cc1	ZINC000875159280	DD	On-Demand	Anodyne	NPR	67	33
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875159283	GD	On-Demand	Mild	DRD4	44	33
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875159283	GD	On-Demand	Mild	MTNR1B	15	44
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875159284	GD	On-Demand	Mild	DRD4	44	33
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875159284	GD	On-Demand	Mild	MTNR1B	15	44
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875159285	GD	On-Demand	Mild	DRD4	44	33
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875159285	GD	On-Demand	Mild	MTNR1B	15	44
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875159286	GD	On-Demand	Mild	DRD4	44	33
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875159286	GD	On-Demand	Mild	MTNR1B	15	44
O=C(NCCC[C@H]1C=CCC1)C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875159302	GD	On-Demand	Anodyne	HTR1A	46	44
O=C(NCCC[C@H]1C=CCC1)C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875159302	GD	On-Demand	Anodyne	DRD2	36	43
O=C(NCCC[C@H]1C=CCC1)C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875159302	GD	On-Demand	Anodyne	HTR2A	39	44
O=C(NCCC[C@H]1C=CCC1)C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875159302	GD	On-Demand	Anodyne	HTR2C	26	41
O=C(NCCC[C@H]1C=CCC1)C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875159302	GD	On-Demand	Anodyne	ADRA1A	16	40
O=C(NCCC[C@H]1C=CCC1)C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875159302	GD	On-Demand	Anodyne	DRD3	54	44
O=C(NCCC[C@@H]1C=CCC1)C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875159303	GD	On-Demand	Anodyne	HTR1A	46	44
O=C(NCCC[C@@H]1C=CCC1)C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875159303	GD	On-Demand	Anodyne	DRD2	36	43
O=C(NCCC[C@@H]1C=CCC1)C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875159303	GD	On-Demand	Anodyne	HTR2A	39	44
O=C(NCCC[C@@H]1C=CCC1)C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875159303	GD	On-Demand	Anodyne	HTR2C	26	41
O=C(NCCC[C@@H]1C=CCC1)C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875159303	GD	On-Demand	Anodyne	ADRA1A	16	40
O=C(NCCC[C@@H]1C=CCC1)C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875159303	GD	On-Demand	Anodyne	DRD3	54	44
CC(C)(C)C(=O)NCCNC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875159304	GC	On-Demand	Anodyne	FKBP1A	26	42
CC(C)(C)C(=O)NCCNC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875159305	GC	On-Demand	Anodyne	FKBP1A	26	42
CC(C)(C)C(=O)NCCNC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875159306	GC	On-Demand	Anodyne	FKBP1A	26	42
CC(C)(C)C(=O)NCCNC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875159307	GC	On-Demand	Anodyne	FKBP1A	26	42
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875159317	GD	On-Demand	Anodyne	HTR1A	72	42
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875159317	GD	On-Demand	Anodyne	DRD2	51	42
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875159317	GD	On-Demand	Anodyne	DRD4	31	40
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875159317	GD	On-Demand	Anodyne	ADRA1D	59	38
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875159317	GD	On-Demand	Anodyne	HTR2A	16	40
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875159317	GD	On-Demand	Anodyne	ADRA1A	53	38
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875159317	GD	On-Demand	Anodyne	ADRA1B	44	37
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875159317	GD	On-Demand	Anodyne	DRD3	57	40
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875159317	GD	On-Demand	Anodyne	HTR7	44	39
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875159318	GD	On-Demand	Anodyne	HTR1A	72	42
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875159318	GD	On-Demand	Anodyne	DRD2	51	42
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875159318	GD	On-Demand	Anodyne	DRD4	31	40
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875159318	GD	On-Demand	Anodyne	ADRA1D	59	38
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875159318	GD	On-Demand	Anodyne	HTR2A	16	40
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875159318	GD	On-Demand	Anodyne	ADRA1A	53	38
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875159318	GD	On-Demand	Anodyne	ADRA1B	44	37
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875159318	GD	On-Demand	Anodyne	DRD3	57	40
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875159318	GD	On-Demand	Anodyne	HTR7	44	39
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875159319	GD	On-Demand	Anodyne	HTR1A	72	42
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875159319	GD	On-Demand	Anodyne	DRD2	51	42
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875159319	GD	On-Demand	Anodyne	DRD4	31	40
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875159319	GD	On-Demand	Anodyne	ADRA1D	59	38
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875159319	GD	On-Demand	Anodyne	HTR2A	16	40
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875159319	GD	On-Demand	Anodyne	ADRA1A	53	38
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875159319	GD	On-Demand	Anodyne	ADRA1B	44	37
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875159319	GD	On-Demand	Anodyne	DRD3	57	40
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875159319	GD	On-Demand	Anodyne	HTR7	44	39
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875159320	GD	On-Demand	Anodyne	HTR1A	72	42
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875159320	GD	On-Demand	Anodyne	DRD2	51	42
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875159320	GD	On-Demand	Anodyne	DRD4	31	40
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875159320	GD	On-Demand	Anodyne	ADRA1D	59	38
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875159320	GD	On-Demand	Anodyne	HTR2A	16	40
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875159320	GD	On-Demand	Anodyne	ADRA1A	53	38
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875159320	GD	On-Demand	Anodyne	ADRA1B	44	37
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875159320	GD	On-Demand	Anodyne	DRD3	57	40
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875159320	GD	On-Demand	Anodyne	HTR7	44	39
C[C@@H](C1CC1)N(C)C(=O)c1cc(S(=O)(=O)Nc2ccccc2F)ccc1Cl	ZINC000875159334	HI	On-Demand	Anodyne	LIMK2	15	45
COc1ccc([C@@H]2CN(C(=O)C(=O)NCCNC(=O)C(C)(C)C)CCO2)cc1	ZINC000875159352	GC	On-Demand	Anodyne	PROKR1	43	31
C[C@H](NC(=O)C(=O)NCCCN1CCN(c2ccncc2)CC1)c1ccnn1C	ZINC000875159411	GC	On-Demand	Anodyne	HTR1A	51	47
C[C@H](NC(=O)C(=O)NCCCN1CCN(c2ccncc2)CC1)c1ccnn1C	ZINC000875159411	GC	On-Demand	Anodyne	DRD2	40	43
C[C@H](NC(=O)C(=O)NCCCN1CCN(c2ccncc2)CC1)c1ccnn1C	ZINC000875159411	GC	On-Demand	Anodyne	DRD4	23	40
C[C@H](NC(=O)C(=O)NCCCN1CCN(c2ccncc2)CC1)c1ccnn1C	ZINC000875159411	GC	On-Demand	Anodyne	ADRA1D	26	43
C[C@H](NC(=O)C(=O)NCCCN1CCN(c2ccncc2)CC1)c1ccnn1C	ZINC000875159411	GC	On-Demand	Anodyne	HTR2A	43	45
C[C@H](NC(=O)C(=O)NCCCN1CCN(c2ccncc2)CC1)c1ccnn1C	ZINC000875159411	GC	On-Demand	Anodyne	HTR2C	31	40
C[C@H](NC(=O)C(=O)NCCCN1CCN(c2ccncc2)CC1)c1ccnn1C	ZINC000875159411	GC	On-Demand	Anodyne	ADRA1A	31	45
C[C@H](NC(=O)C(=O)NCCCN1CCN(c2ccncc2)CC1)c1ccnn1C	ZINC000875159411	GC	On-Demand	Anodyne	ADRA1B	16	45
C[C@H](NC(=O)C(=O)NCCCN1CCN(c2ccncc2)CC1)c1ccnn1C	ZINC000875159411	GC	On-Demand	Anodyne	DRD3	61	45
C[C@H](NC(=O)C(=O)NCCCN1CCN(c2ccncc2)CC1)c1ccnn1C	ZINC000875159411	GC	On-Demand	Anodyne	HTR7	46	39
O=C(NCCCN1CCN(c2ccncc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875159432	FC	On-Demand	Anodyne	HTR1A	50	44
O=C(NCCCN1CCN(c2ccncc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875159432	FC	On-Demand	Anodyne	DRD2	36	43
O=C(NCCCN1CCN(c2ccncc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875159432	FC	On-Demand	Anodyne	ADRA1D	20	40
O=C(NCCCN1CCN(c2ccncc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875159432	FC	On-Demand	Anodyne	HTR2A	42	44
O=C(NCCCN1CCN(c2ccncc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875159432	FC	On-Demand	Anodyne	ADRA1A	27	40
O=C(NCCCN1CCN(c2ccncc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875159432	FC	On-Demand	Anodyne	DRD3	48	44
O=C(NCCCN1CCN(c2ccncc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875159433	FC	On-Demand	Anodyne	HTR1A	50	44
O=C(NCCCN1CCN(c2ccncc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875159433	FC	On-Demand	Anodyne	DRD2	36	43
O=C(NCCCN1CCN(c2ccncc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875159433	FC	On-Demand	Anodyne	ADRA1D	20	40
O=C(NCCCN1CCN(c2ccncc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875159433	FC	On-Demand	Anodyne	HTR2A	42	44
O=C(NCCCN1CCN(c2ccncc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875159433	FC	On-Demand	Anodyne	ADRA1A	27	40
O=C(NCCCN1CCN(c2ccncc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875159433	FC	On-Demand	Anodyne	DRD3	48	44
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2CCC(C(C)=O)CC2)C1	ZINC000875159434	GD	On-Demand	Anodyne	HTR1A	67	43
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2CCC(C(C)=O)CC2)C1	ZINC000875159434	GD	On-Demand	Anodyne	DRD2	47	43
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2CCC(C(C)=O)CC2)C1	ZINC000875159434	GD	On-Demand	Anodyne	DRD4	28	40
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2CCC(C(C)=O)CC2)C1	ZINC000875159434	GD	On-Demand	Anodyne	ADRA1D	48	38
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2CCC(C(C)=O)CC2)C1	ZINC000875159434	GD	On-Demand	Anodyne	ADRA1A	44	38
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2CCC(C(C)=O)CC2)C1	ZINC000875159434	GD	On-Demand	Anodyne	DRD3	54	42
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2CCC(C(C)=O)CC2)C1	ZINC000875159434	GD	On-Demand	Anodyne	HTR7	43	39
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2CCC(C(C)=O)CC2)C1	ZINC000875159435	GD	On-Demand	Anodyne	HTR1A	67	43
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2CCC(C(C)=O)CC2)C1	ZINC000875159435	GD	On-Demand	Anodyne	DRD2	47	43
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2CCC(C(C)=O)CC2)C1	ZINC000875159435	GD	On-Demand	Anodyne	DRD4	28	40
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2CCC(C(C)=O)CC2)C1	ZINC000875159435	GD	On-Demand	Anodyne	ADRA1D	48	38
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2CCC(C(C)=O)CC2)C1	ZINC000875159435	GD	On-Demand	Anodyne	ADRA1A	44	38
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2CCC(C(C)=O)CC2)C1	ZINC000875159435	GD	On-Demand	Anodyne	DRD3	54	42
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2CCC(C(C)=O)CC2)C1	ZINC000875159435	GD	On-Demand	Anodyne	HTR7	43	39
C#CC[C@@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875159443	GB	On-Demand	Mild	HTR1A	47	41
C#CC[C@@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875159443	GB	On-Demand	Mild	DRD2	39	40
C#CC[C@@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875159443	GB	On-Demand	Mild	DRD4	41	33
C#CC[C@@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875159443	GB	On-Demand	Mild	HTR2A	35	40
C#CC[C@@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875159443	GB	On-Demand	Mild	DRD3	63	40
C#CC[C@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875159444	GB	On-Demand	Mild	HTR1A	47	41
C#CC[C@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875159444	GB	On-Demand	Mild	DRD2	39	40
C#CC[C@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875159444	GB	On-Demand	Mild	DRD4	41	33
C#CC[C@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875159444	GB	On-Demand	Mild	HTR2A	35	40
C#CC[C@H](COC)NC(=O)C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875159444	GB	On-Demand	Mild	DRD3	63	40
CN(C)C(=O)c1ccc(OC(=O)[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000875159456	FH	On-Demand	Anodyne	C3AR1	37	41
CN(C)C(=O)c1ccc(OC(=O)[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000875159457	FH	On-Demand	Anodyne	C3AR1	37	41
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(Cl)c(C(=O)N(C)[C@H](C)C2CC2)c1	ZINC000875159491	JH	On-Demand	Bother	KCNMA1	19	40
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(Cl)c(C(=O)N(C)[C@@H](C)C2CC2)c1	ZINC000875159492	JH	On-Demand	Bother	KCNMA1	19	40
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc([N+](=O)[O-])ccc1N1CCOCC1	ZINC000875159503	GD	On-Demand	Bother	TAAR1	30	47
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc([N+](=O)[O-])ccc1N1CCOCC1	ZINC000875159503	GD	On-Demand	Bother	WDR5	32	40
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875159546	GD	On-Demand	Anodyne	HTR1A	64	43
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875159546	GD	On-Demand	Anodyne	DRD2	49	45
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875159546	GD	On-Demand	Anodyne	DRD4	28	40
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875159546	GD	On-Demand	Anodyne	ADRA1D	52	39
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875159546	GD	On-Demand	Anodyne	ADRA1A	46	39
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875159546	GD	On-Demand	Anodyne	DRD3	55	41
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875159546	GD	On-Demand	Anodyne	HTR7	42	39
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875159547	GD	On-Demand	Anodyne	HTR1A	64	43
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875159547	GD	On-Demand	Anodyne	DRD2	49	45
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875159547	GD	On-Demand	Anodyne	DRD4	28	40
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875159547	GD	On-Demand	Anodyne	ADRA1D	52	39
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875159547	GD	On-Demand	Anodyne	ADRA1A	46	39
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875159547	GD	On-Demand	Anodyne	DRD3	55	41
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875159547	GD	On-Demand	Anodyne	HTR7	42	39
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875159548	GD	On-Demand	Anodyne	HTR1A	64	43
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875159548	GD	On-Demand	Anodyne	DRD2	49	45
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875159548	GD	On-Demand	Anodyne	DRD4	28	40
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875159548	GD	On-Demand	Anodyne	ADRA1D	52	39
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875159548	GD	On-Demand	Anodyne	ADRA1A	46	39
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875159548	GD	On-Demand	Anodyne	DRD3	55	41
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875159548	GD	On-Demand	Anodyne	HTR7	42	39
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875159549	GD	On-Demand	Anodyne	HTR1A	64	43
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875159549	GD	On-Demand	Anodyne	DRD2	49	45
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875159549	GD	On-Demand	Anodyne	DRD4	28	40
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875159549	GD	On-Demand	Anodyne	ADRA1D	52	39
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875159549	GD	On-Demand	Anodyne	ADRA1A	46	39
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875159549	GD	On-Demand	Anodyne	DRD3	55	41
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875159549	GD	On-Demand	Anodyne	HTR7	42	39
Cn1c2ccccc2c2cc(C(=O)Nc3cccc(-c4nn[nH]n4)c3)sc21	ZINC000875159556	FH	On-Demand	Anodyne	KCNK3	45	32
CC[C@]1(C(=O)Oc2cccc(C(=O)NC)c2)CCNC1=O	ZINC000875159576	CC	On-Demand	Anodyne	MMP10	16	40
COc1cc(NC(=O)c2ccccc2)c(C(=O)N(C)[C@@H](C)C2CC2)cc1OC	ZINC000875159587	GH	On-Demand	Anodyne	HDAC2	18	40
COc1cc(NC(=O)c2ccccc2)c(C(=O)N(C)[C@@H](C)C2CC2)cc1OC	ZINC000875159587	GH	On-Demand	Anodyne	KCNK3	87	45
COc1cc(NC(=O)c2ccccc2)c(C(=O)N(C)[C@@H](C)C2CC2)cc1OC	ZINC000875159587	GH	On-Demand	Anodyne	KCNK9	58	37
COc1cc(NC(=O)c2ccccc2)c(C(=O)N(C)[C@H](C)C2CC2)cc1OC	ZINC000875159588	GH	On-Demand	Anodyne	HDAC2	18	40
COc1cc(NC(=O)c2ccccc2)c(C(=O)N(C)[C@H](C)C2CC2)cc1OC	ZINC000875159588	GH	On-Demand	Anodyne	KCNK3	87	45
COc1cc(NC(=O)c2ccccc2)c(C(=O)N(C)[C@H](C)C2CC2)cc1OC	ZINC000875159588	GH	On-Demand	Anodyne	KCNK9	58	37
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCCC[C@@H]2C=CCC2)C1	ZINC000875159595	GF	On-Demand	Anodyne	HTR1A	63	44
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCCC[C@@H]2C=CCC2)C1	ZINC000875159595	GF	On-Demand	Anodyne	DRD2	47	42
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCCC[C@@H]2C=CCC2)C1	ZINC000875159595	GF	On-Demand	Anodyne	DRD4	29	41
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCCC[C@@H]2C=CCC2)C1	ZINC000875159595	GF	On-Demand	Anodyne	ADRA1D	37	40
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCCC[C@@H]2C=CCC2)C1	ZINC000875159595	GF	On-Demand	Anodyne	ADRA1A	36	40
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCCC[C@@H]2C=CCC2)C1	ZINC000875159595	GF	On-Demand	Anodyne	ADRA1B	29	40
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCCC[C@@H]2C=CCC2)C1	ZINC000875159595	GF	On-Demand	Anodyne	DRD3	59	42
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCCC[C@@H]2C=CCC2)C1	ZINC000875159595	GF	On-Demand	Anodyne	HTR7	42	38
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCCC[C@@H]2C=CCC2)C1	ZINC000875159596	GF	On-Demand	Anodyne	HTR1A	63	44
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCCC[C@@H]2C=CCC2)C1	ZINC000875159596	GF	On-Demand	Anodyne	DRD2	47	42
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCCC[C@@H]2C=CCC2)C1	ZINC000875159596	GF	On-Demand	Anodyne	DRD4	29	41
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCCC[C@@H]2C=CCC2)C1	ZINC000875159596	GF	On-Demand	Anodyne	ADRA1D	37	40
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCCC[C@@H]2C=CCC2)C1	ZINC000875159596	GF	On-Demand	Anodyne	ADRA1A	36	40
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCCC[C@@H]2C=CCC2)C1	ZINC000875159596	GF	On-Demand	Anodyne	ADRA1B	29	40
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCCC[C@@H]2C=CCC2)C1	ZINC000875159596	GF	On-Demand	Anodyne	DRD3	59	42
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCCC[C@@H]2C=CCC2)C1	ZINC000875159596	GF	On-Demand	Anodyne	HTR7	42	38
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCCC[C@H]2C=CCC2)C1	ZINC000875159597	GF	On-Demand	Anodyne	HTR1A	63	44
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCCC[C@H]2C=CCC2)C1	ZINC000875159597	GF	On-Demand	Anodyne	DRD2	47	42
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCCC[C@H]2C=CCC2)C1	ZINC000875159597	GF	On-Demand	Anodyne	DRD4	29	41
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCCC[C@H]2C=CCC2)C1	ZINC000875159597	GF	On-Demand	Anodyne	ADRA1D	37	40
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCCC[C@H]2C=CCC2)C1	ZINC000875159597	GF	On-Demand	Anodyne	ADRA1A	36	40
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCCC[C@H]2C=CCC2)C1	ZINC000875159597	GF	On-Demand	Anodyne	ADRA1B	29	40
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCCC[C@H]2C=CCC2)C1	ZINC000875159597	GF	On-Demand	Anodyne	DRD3	59	42
COc1ccccc1N1CC[C@@H](CNC(=O)C(=O)NCCC[C@H]2C=CCC2)C1	ZINC000875159597	GF	On-Demand	Anodyne	HTR7	42	38
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCCC[C@H]2C=CCC2)C1	ZINC000875159598	GF	On-Demand	Anodyne	HTR1A	63	44
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCCC[C@H]2C=CCC2)C1	ZINC000875159598	GF	On-Demand	Anodyne	DRD2	47	42
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCCC[C@H]2C=CCC2)C1	ZINC000875159598	GF	On-Demand	Anodyne	DRD4	29	41
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCCC[C@H]2C=CCC2)C1	ZINC000875159598	GF	On-Demand	Anodyne	ADRA1D	37	40
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCCC[C@H]2C=CCC2)C1	ZINC000875159598	GF	On-Demand	Anodyne	ADRA1A	36	40
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCCC[C@H]2C=CCC2)C1	ZINC000875159598	GF	On-Demand	Anodyne	ADRA1B	29	40
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCCC[C@H]2C=CCC2)C1	ZINC000875159598	GF	On-Demand	Anodyne	DRD3	59	42
COc1ccccc1N1CC[C@H](CNC(=O)C(=O)NCCC[C@H]2C=CCC2)C1	ZINC000875159598	GF	On-Demand	Anodyne	HTR7	42	38
CO[C@H]1CCC[C@@H]1CNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875159652	GD	On-Demand	Anodyne	SMO	34	41
CO[C@H]1CCC[C@@H]1CNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875159652	GD	On-Demand	Anodyne	ETHR	58	46
CC(=O)[C@H]1CCCN(C(=O)NCc2nc(Cc3ccccc3)no2)C1	ZINC000875159716	EE	On-Demand	Anodyne	CCR5	18	40
CC(=O)[C@@H]1CCCN(C(=O)NCc2nc(Cc3ccccc3)no2)C1	ZINC000875159717	EE	On-Demand	Anodyne	CCR5	18	40
Cc1cncc([C@H]2CCCN2C(=O)NCc2nc(Cc3ccccc3)no2)c1	ZINC000875159801	GG	On-Demand	Anodyne	CPT1A	52	38
Cc1cncc([C@@H]2CCCN2C(=O)NCc2nc(Cc3ccccc3)no2)c1	ZINC000875159802	GG	On-Demand	Anodyne	CPT1A	52	38
O=C(NCCc1cc(Cl)cc(Cl)c1)NC[C@H]1C[C@H](O)C1	ZINC000875159818	DF	On-Demand	Anodyne	CACNA1I	47	34
O=C(NCc1nc(Cc2ccccc2)no1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875159862	GG	On-Demand	Anodyne	EPHX2	26	40
O=C(NCc1nc(Cc2ccccc2)no1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875159863	GG	On-Demand	Anodyne	EPHX2	26	40
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)c2ccc(OCCC(C)C)cc2)CC1	ZINC000875159894	GG	On-Demand	Anodyne	ACACA	22	44
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)c2ccc(OCCC(C)C)cc2)CC1	ZINC000875159894	GG	On-Demand	Anodyne	ACACB	23	44
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)c2ccc(OCCC(C)C)cc2)CC1	ZINC000875159895	GG	On-Demand	Anodyne	ACACA	22	44
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)c2ccc(OCCC(C)C)cc2)CC1	ZINC000875159895	GG	On-Demand	Anodyne	ACACB	23	44
O=C(Nc1ccccc1C(=O)Nc1cccc(-c2nn[nH]n2)c1)c1ccc([N+](=O)[O-])cc1Cl	ZINC000875159904	JH	On-Demand	Bother	NR2E3	62	34
O=C(Nc1ccccc1C(=O)Nc1cccc(-c2nn[nH]n2)c1)c1ccc([N+](=O)[O-])cc1Cl	ZINC000875159904	JH	On-Demand	Bother	ABCG2	15	40
O=C(Nc1ccccc1C(=O)Nc1cccc(-c2nn[nH]n2)c1)c1ccc([N+](=O)[O-])cc1Cl	ZINC000875159904	JH	On-Demand	Bother	SMO	22	42
O=C(Nc1ccccc1C(=O)Nc1cccc(-c2nn[nH]n2)c1)c1ccc([N+](=O)[O-])cc1Cl	ZINC000875159904	JH	On-Demand	Bother	KCNK3	41	41
O=C(C[C@@H]1OC(=O)c2ccccc21)Nc1cccc(-c2nn[nH]n2)c1	ZINC000875159937	EE	On-Demand	Anodyne	CCKBR	19	40
O=C(C[C@H]1OC(=O)c2ccccc21)Nc1cccc(-c2nn[nH]n2)c1	ZINC000875159938	EE	On-Demand	Anodyne	CCKBR	19	40
O=C(NCCCN1CCN(c2ccncc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875159943	GD	On-Demand	Anodyne	HTR1A	42	44
O=C(NCCCN1CCN(c2ccncc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875159943	GD	On-Demand	Anodyne	DRD2	33	43
O=C(NCCCN1CCN(c2ccncc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875159943	GD	On-Demand	Anodyne	HTR2A	37	44
O=C(NCCCN1CCN(c2ccncc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875159943	GD	On-Demand	Anodyne	HTR2C	26	41
O=C(NCCCN1CCN(c2ccncc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875159943	GD	On-Demand	Anodyne	ADRA1A	18	40
O=C(NCCCN1CCN(c2ccncc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875159943	GD	On-Demand	Anodyne	DRD3	49	44
C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)NCc1nc(Cc2ccccc2)no1	ZINC000875160080	GI	On-Demand	Anodyne	TPSAB1	53	34
C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)NCc1nc(Cc2ccccc2)no1	ZINC000875160080	GI	On-Demand	Anodyne	UTS2	42	33
C[C@H](c1ccc(Cl)cc1)N(C)C(=O)NCc1nc(Cc2ccccc2)no1	ZINC000875160081	GI	On-Demand	Anodyne	TPSAB1	53	34
C[C@H](c1ccc(Cl)cc1)N(C)C(=O)NCc1nc(Cc2ccccc2)no1	ZINC000875160081	GI	On-Demand	Anodyne	UTS2	42	33
C=CC(C)(C)CCCNC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875160120	GF	On-Demand	Mild	HTR1A	64	48
C=CC(C)(C)CCCNC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875160120	GF	On-Demand	Mild	DRD2	48	46
C=CC(C)(C)CCCNC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875160120	GF	On-Demand	Mild	DRD4	29	41
C=CC(C)(C)CCCNC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875160120	GF	On-Demand	Mild	ADRA1D	43	42
C=CC(C)(C)CCCNC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875160120	GF	On-Demand	Mild	HTR2A	15	41
C=CC(C)(C)CCCNC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875160120	GF	On-Demand	Mild	ADRA1A	40	42
C=CC(C)(C)CCCNC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875160120	GF	On-Demand	Mild	DRD3	62	43
C=CC(C)(C)CCCNC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875160120	GF	On-Demand	Mild	HTR7	45	40
C=CC(C)(C)CCCNC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875160121	GF	On-Demand	Mild	HTR1A	64	48
C=CC(C)(C)CCCNC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875160121	GF	On-Demand	Mild	DRD2	48	46
C=CC(C)(C)CCCNC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875160121	GF	On-Demand	Mild	DRD4	29	41
C=CC(C)(C)CCCNC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875160121	GF	On-Demand	Mild	ADRA1D	43	42
C=CC(C)(C)CCCNC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875160121	GF	On-Demand	Mild	HTR2A	15	41
C=CC(C)(C)CCCNC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875160121	GF	On-Demand	Mild	ADRA1A	40	42
C=CC(C)(C)CCCNC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875160121	GF	On-Demand	Mild	DRD3	62	43
C=CC(C)(C)CCCNC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875160121	GF	On-Demand	Mild	HTR7	45	40
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1cccc(N2CCCC2=O)c1	ZINC000875160129	GD	On-Demand	Anodyne	CACNA1H	32	43
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1cccc(N2CCCC2=O)c1	ZINC000875160130	GG	On-Demand	Anodyne	CACNA1H	27	41
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875160144	GD	On-Demand	Anodyne	DRD4	47	36
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875160144	GD	On-Demand	Anodyne	MTNR1A	18	47
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875160144	GD	On-Demand	Anodyne	MTNR1B	17	47
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875160144	GD	On-Demand	Anodyne	CACNA1I	55	38
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875160145	GD	On-Demand	Anodyne	DRD4	47	36
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875160145	GD	On-Demand	Anodyne	MTNR1A	18	47
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875160145	GD	On-Demand	Anodyne	MTNR1B	17	47
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875160145	GD	On-Demand	Anodyne	CACNA1I	55	38
NC(=O)CCOC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000875160146	ED	On-Demand	Anodyne	PSEN2	50	34
NC(=O)CCOC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000875160146	ED	On-Demand	Anodyne	MMP13	25	42
NC(=O)CCOC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000875160146	ED	On-Demand	Anodyne	MMP2	25	42
NC(=O)CCOC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000875160146	ED	On-Demand	Anodyne	MMP14	17	42
NC(=O)CCOC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000875160146	ED	On-Demand	Anodyne	MMP9	15	43
NC(=O)CCOC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000875160146	ED	On-Demand	Anodyne	PSEN1	40	34
NC(=O)CCOC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000875160146	ED	On-Demand	Anodyne	MMP10	53	33
CN(C)C(=O)c1ccc(OC(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)cc1	ZINC000875160168	FG	On-Demand	Bother	SLC27A4	43	33
C=C(Br)CNC(=O)N1CC(c2ccccc2)C1	ZINC000875160190	CF	On-Demand	Mild	RBP4	28	42
C=CC(C)(C)CCCNC(=O)C(=O)NC[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875160319	GF	On-Demand	Mild	DRD4	45	36
C=CC(C)(C)CCCNC(=O)C(=O)NC[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875160319	GF	On-Demand	Mild	DRD3	15	40
C=CC(C)(C)CCCNC(=O)C(=O)NC[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875160319	GF	On-Demand	Mild	MTNR1A	15	45
C=CC(C)(C)CCCNC(=O)C(=O)NC[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875160319	GF	On-Demand	Mild	MTNR1B	15	45
C=CC(C)(C)CCCNC(=O)C(=O)NC[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875160321	GF	On-Demand	Mild	DRD4	45	36
C=CC(C)(C)CCCNC(=O)C(=O)NC[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875160321	GF	On-Demand	Mild	DRD3	15	40
C=CC(C)(C)CCCNC(=O)C(=O)NC[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875160321	GF	On-Demand	Mild	MTNR1A	15	45
C=CC(C)(C)CCCNC(=O)C(=O)NC[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875160321	GF	On-Demand	Mild	MTNR1B	15	45
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875160345	GD	On-Demand	Anodyne	HTR1A	64	45
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875160345	GD	On-Demand	Anodyne	DRD2	52	45
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875160345	GD	On-Demand	Anodyne	DRD4	33	41
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875160345	GD	On-Demand	Anodyne	ADRA1D	50	38
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875160345	GD	On-Demand	Anodyne	ADRA1A	44	38
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875160345	GD	On-Demand	Anodyne	DRD3	59	41
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875160345	GD	On-Demand	Anodyne	HTR7	42	41
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875160345	GD	On-Demand	Anodyne	CACNA1I	50	34
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875160347	GD	On-Demand	Anodyne	HTR1A	64	45
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875160347	GD	On-Demand	Anodyne	DRD2	52	45
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875160347	GD	On-Demand	Anodyne	DRD4	33	41
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875160347	GD	On-Demand	Anodyne	ADRA1D	50	38
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875160347	GD	On-Demand	Anodyne	ADRA1A	44	38
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875160347	GD	On-Demand	Anodyne	DRD3	59	41
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875160347	GD	On-Demand	Anodyne	HTR7	42	41
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875160347	GD	On-Demand	Anodyne	CACNA1I	50	34
O=C(CCCOC1CCOCC1)Nc1ccc2nc3n(c(=O)c2c1)CCC3	ZINC000875160386	FE	On-Demand	Anodyne	ACHE	15	45
CON=Cc1ccc(C(=O)Nc2cccc(-c3nn[nH]n3)c2)cc1	ZINC000875160395	DE	On-Demand	Mild	KCNK3	106	38
CON=Cc1ccc(C(=O)Nc2cccc(-c3nn[nH]n3)c2)cc1	ZINC000875160395	DE	On-Demand	Mild	KCNK9	67	34
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1	ZINC000875160401	ED	On-Demand	Anodyne	CACNA1I	44	31
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1CCN(c2ccc(F)c(F)c2)C1	ZINC000875160404	ED	On-Demand	Anodyne	CACNA1I	44	31
O=C(NCc1nc(Cc2ccccc2)no1)N1CCC(Cc2nccs2)CC1	ZINC000875160435	GG	On-Demand	Anodyne	GRIN2B	41	41
O=C(NCCc1cc(Cl)cc(Cl)c1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875160443	GF	On-Demand	Anodyne	CACNA1I	53	36
CN1CCN(C2CCN(C(=O)NCc3nc(Cc4ccccc4)no3)CC2)CC1	ZINC000875160550	GD	On-Demand	Anodyne	L3MBTL3	43	38
O=C(NCc1nc(Cc2ccccc2)no1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875160565	GG	On-Demand	Anodyne	TRY1_BOVIN	45	35
O=C(NCc1nc(Cc2ccccc2)no1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875160565	GG	On-Demand	Anodyne	PREP	34	40
O=C(NCc1nc(Cc2ccccc2)no1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875160565	GG	On-Demand	Anodyne	TMPRSS11D	50	32
O=C(NCc1nc(Cc2ccccc2)no1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875160566	GG	On-Demand	Anodyne	TRY1_BOVIN	45	35
O=C(NCc1nc(Cc2ccccc2)no1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875160566	GG	On-Demand	Anodyne	PREP	34	40
O=C(NCc1nc(Cc2ccccc2)no1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875160566	GG	On-Demand	Anodyne	TMPRSS11D	50	32
O=C(NCc1nc(Cc2ccccc2)no1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875160567	GG	On-Demand	Anodyne	TRY1_BOVIN	45	35
O=C(NCc1nc(Cc2ccccc2)no1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875160567	GG	On-Demand	Anodyne	PREP	34	40
O=C(NCc1nc(Cc2ccccc2)no1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875160567	GG	On-Demand	Anodyne	TMPRSS11D	50	32
O=C(NCc1nc(Cc2ccccc2)no1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875160568	GG	On-Demand	Anodyne	TRY1_BOVIN	45	35
O=C(NCc1nc(Cc2ccccc2)no1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875160568	GG	On-Demand	Anodyne	PREP	34	40
O=C(NCc1nc(Cc2ccccc2)no1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875160568	GG	On-Demand	Anodyne	TMPRSS11D	50	32
C[C@H](NC(=O)NC1CC(Nc2ccccc2)C1)c1cccc(N2CCOC2=O)c1	ZINC000875160596	GH	On-Demand	Anodyne	KCNQ2	16	40
C[C@@H](NC(=O)NC1CC(Nc2ccccc2)C1)c1cccc(N2CCOC2=O)c1	ZINC000875160597	GH	On-Demand	Anodyne	KCNQ2	16	40
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCCCCOCc2ccccc2)c1	ZINC000875160656	GG	On-Demand	Anodyne	FKBP1A	49	42
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCCCCOCc2ccccc2)c1	ZINC000875160656	GG	On-Demand	Anodyne	PREP	76	39
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCCCCOCc2ccccc2)c1	ZINC000875160657	GG	On-Demand	Anodyne	FKBP1A	49	42
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCCCCOCc2ccccc2)c1	ZINC000875160657	GG	On-Demand	Anodyne	PREP	76	39
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCCOCc2ccccc2)C1	ZINC000875160664	FE	On-Demand	Anodyne	UGCG	41	41
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCCOCc2ccccc2)C1	ZINC000875160664	FE	On-Demand	Anodyne	GBA	25	41
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCCOCc2ccccc2)C1	ZINC000875160664	FE	On-Demand	Anodyne	CAPN2	54	36
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCCOCc2ccccc2)C1	ZINC000875160664	FE	On-Demand	Anodyne	GBA2	61	41
CCOC(=O)C1CCC(NC(=O)N2CCC[C@H]2c2cncc(C)c2)CC1	ZINC000875160675	FG	On-Demand	Anodyne	SSTR5	31	42
CCOC(=O)C1CCC(NC(=O)N2CCC[C@@H]2c2cncc(C)c2)CC1	ZINC000875160676	FG	On-Demand	Anodyne	SSTR5	31	42
O=C(NCc1nc(Cc2ccccc2)no1)N1CCCC[C@@H]1[C@H]1CCCC[C@H]1O	ZINC000875160715	GG	On-Demand	Anodyne	CPT1A	58	35
O=C(NCc1nc(Cc2ccccc2)no1)N1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O	ZINC000875160717	GG	On-Demand	Anodyne	CPT1A	58	35
O=C(NCc1nc(Cc2ccccc2)no1)N1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O	ZINC000875160720	GG	On-Demand	Anodyne	CPT1A	58	35
O=C(NCc1nc(Cc2ccccc2)no1)N1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O	ZINC000875160722	GG	On-Demand	Anodyne	CPT1A	58	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(Oc3ccccc3)nc2)C1	ZINC000875160818	GE	On-Demand	Anodyne	CPT1A	47	36
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(Oc3ccccc3)nc2)C1	ZINC000875160819	GE	On-Demand	Anodyne	CPT1A	47	36
CC(=O)C1CCN(C(=O)C(=O)NCCCCOCc2ccccc2)CC1	ZINC000875160892	FD	On-Demand	Anodyne	CAPN2	44	34
CC(=O)C1CCN(C(=O)C(=O)NCCCCOCc2ccccc2)CC1	ZINC000875160892	FD	On-Demand	Anodyne	GBA2	43	39
COCCN(CC1CCN(C)CC1)C(=O)NC[C@H]1CC=CCC1	ZINC000875160938	DE	On-Demand	Anodyne	CACNA1I	40	32
COCCN(CC1CCN(C)CC1)C(=O)NC[C@@H]1CC=CCC1	ZINC000875160940	DE	On-Demand	Anodyne	CACNA1I	40	32
CCOC(=O)C1CCC(NC(=O)NCc2ccc(O)c(Cl)c2)CC1	ZINC000875161042	FF	On-Demand	Anodyne	EPHX2	19	45
CCOC(=O)C1CCC(NC(=O)NCc2ccc(O)c(Cl)c2)CC1	ZINC000875161042	FF	On-Demand	Anodyne	NCE103	15	40
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1ccc(Oc2ccccc2)nc1	ZINC000875161077	GE	On-Demand	Mild	ACACA	17	40
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1ccc(Oc2ccccc2)nc1	ZINC000875161077	GE	On-Demand	Mild	ACACB	23	40
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1ccc(Oc2ccccc2)nc1	ZINC000875161080	GE	On-Demand	Mild	ACACA	17	40
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1ccc(Oc2ccccc2)nc1	ZINC000875161080	GE	On-Demand	Mild	ACACB	23	40
O=C(NCCCCOCc1ccccc1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875161084	GC	On-Demand	Anodyne	GBA	21	40
O=C(NCCCCOCc1ccccc1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875161084	GC	On-Demand	Anodyne	GBA2	50	40
COC(=O)N(C)NC(=O)NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1	ZINC000875161087	ED	On-Demand	Reactive	CACNA1I	56	32
COC(=O)N(C)NC(=O)NC[C@H]1CCN(c2ccc(F)c(F)c2)C1	ZINC000875161089	ED	On-Demand	Reactive	CACNA1I	56	32
CC(=O)N1CCC[C@@H]1C(=O)Oc1cccc2ncccc12	ZINC000875161092	CE	On-Demand	Anodyne	PREP	48	42
Cc1cc(C(F)(F)F)nc(C(=O)Nc2nc(C(F)(F)F)cs2)n1	ZINC000875161100	FH	On-Demand	Anodyne	MPL	58	37
Cc1cc(C(F)(F)F)nc(C(=O)Nc2nc(C(F)(F)F)cs2)n1	ZINC000875161100	FH	On-Demand	Anodyne	GCK	17	44
CN1CC[C@H]2CN(C(=O)NCc3nc(Cc4ccccc4)no3)CC[C@@H]21	ZINC000875161137	FD	On-Demand	Anodyne	BIRC2	43	36
CN1CC[C@H]2CN(C(=O)NCc3nc(Cc4ccccc4)no3)CC[C@H]21	ZINC000875161139	FD	On-Demand	Anodyne	BIRC2	43	36
CC[C@H](NC(=O)c1c(Cl)nn(C)c1Cl)c1ccccc1OC(F)F	ZINC000875161149	GI	On-Demand	Anodyne	TACR3	40	35
CCOC1CC2(C1)C[C@@H]2NC(=O)NCc1nc(Cc2ccccc2)no1	ZINC000875161158	FE	On-Demand	Anodyne	TIMP3	44	34
CCOC1CC2(C1)C[C@H]2NC(=O)NCc1nc(Cc2ccccc2)no1	ZINC000875161159	FE	On-Demand	Anodyne	TIMP3	44	34
CO[C@H]1CCC[C@@H]1CNC(=O)C(=O)N1CCN(c2ccc(C#N)cc2)CC1	ZINC000875161177	FD	On-Demand	Mild	CTSK	18	54
CC(C)(C)NS(=O)(=O)c1cc(C(=O)Nc2cccc(-c3nn[nH]n3)c2)ccc1Cl	ZINC000875161181	IF	On-Demand	Anodyne	CPT1A	54	31
CC(C)(C)NS(=O)(=O)c1cc(C(=O)Nc2cccc(-c3nn[nH]n3)c2)ccc1Cl	ZINC000875161181	IF	On-Demand	Anodyne	CPT1B	15	52
CC(C)(C)NS(=O)(=O)c1cc(C(=O)Nc2cccc(-c3nn[nH]n3)c2)ccc1Cl	ZINC000875161181	IF	On-Demand	Anodyne	BRAF	34	41
CC(C)(C)NS(=O)(=O)c1cc(C(=O)Nc2cccc(-c3nn[nH]n3)c2)ccc1Cl	ZINC000875161181	IF	On-Demand	Anodyne	TAAR1	26	42
CC(C)(C)NS(=O)(=O)c1cc(C(=O)Nc2cccc(-c3nn[nH]n3)c2)ccc1Cl	ZINC000875161181	IF	On-Demand	Anodyne	KCNK3	78	37
CC(C)(C)NS(=O)(=O)c1cc(C(=O)Nc2cccc(-c3nn[nH]n3)c2)ccc1Cl	ZINC000875161181	IF	On-Demand	Anodyne	KCNK9	40	34
C#CC[C@@H](CCOC)NC(=O)NCc1nc(Cc2ccccc2)no1	ZINC000875161220	ED	On-Demand	Mild	TPSAB1	43	34
C#CC[C@H](CCOC)NC(=O)NCc1nc(Cc2ccccc2)no1	ZINC000875161223	ED	On-Demand	Mild	TPSAB1	43	34
CCC1(N2CCCC2)CCN(C(=O)NCc2nc(Cc3ccccc3)no2)CC1	ZINC000875161267	GG	On-Demand	Anodyne	HCN1	42	32
O=C(NCc1nc(Cc2ccccc2)no1)N1CCC[C@@H]1Cn1ccnc1	ZINC000875161293	FE	On-Demand	Anodyne	NOS2	55	34
O=C(CC(F)(F)C(F)(F)F)Nc1ccc2nc3n(c(=O)c2c1)CCC3	ZINC000875161338	FF	On-Demand	Anodyne	ACHE	15	45
O=C(NCc1ccc(O)c(Cl)c1)NC[C@@H]1CC=CCC1	ZINC000875161354	CG	On-Demand	Anodyne	NCE103	15	43
O=C(NCc1ccc(O)c(Cl)c1)NC[C@H]1CC=CCC1	ZINC000875161356	CG	On-Demand	Anodyne	NCE103	15	43
CCOC(=O)C1CCC(NC(=O)NCc2cc(C)ccc2O)CC1	ZINC000875161431	EF	On-Demand	Clean	EPHX2	19	42
O=C(NCc1nc(Cc2ccccc2)no1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875161440	GG	On-Demand	Anodyne	GRIN2B	20	41
O=C(NCc1nc(Cc2ccccc2)no1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875161440	GG	On-Demand	Anodyne	EPHX2	28	48
O=C(NCc1nc(Cc2ccccc2)no1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875161440	GG	On-Demand	Anodyne	SCD1	19	43
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCCC(F)(F)CC1	ZINC000875161480	EG	On-Demand	Anodyne	NOS2	83	36
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCCC(F)(F)CC1	ZINC000875161480	EG	On-Demand	Anodyne	NAMPT	29	41
O=C(NCc1ccc(-n2ccnc2)cc1)N1C[C@@H](O)C[C@@H]1C1CC1	ZINC000875161481	ED	On-Demand	Anodyne	NOS2	88	35
O=C(NCc1ccc(-n2ccnc2)cc1)N1C[C@H](O)C[C@@H]1C1CC1	ZINC000875161482	ED	On-Demand	Anodyne	NOS2	88	35
O=C(NCc1ccc(-n2ccnc2)cc1)N1C[C@@H](O)C[C@H]1C1CC1	ZINC000875161483	ED	On-Demand	Anodyne	NOS2	88	35
O=C(NCc1ccc(-n2ccnc2)cc1)N1C[C@H](O)C[C@H]1C1CC1	ZINC000875161484	ED	On-Demand	Anodyne	NOS2	88	35
COC(=O)CCCCNC(=O)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875161486	CD	On-Demand	Anodyne	EPHX2	24	53
COC(=O)CCCCNC(=O)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875161487	CD	On-Demand	Anodyne	EPHX2	24	53
COC(=O)CCCCNC(=O)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875161488	CD	On-Demand	Anodyne	EPHX2	24	53
COC(=O)CCCCNC(=O)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875161489	CD	On-Demand	Anodyne	EPHX2	24	53
O=C(NCc1ccc(-n2ccnc2)cc1)N1CC(Cc2ccco2)C1	ZINC000875161493	EF	On-Demand	Anodyne	NOS2	99	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(-n3ccnc3)cc2)C1	ZINC000875161509	FE	On-Demand	Anodyne	NOS2	86	37
O=C(NCc1ccc(-n2ccnc2)cc1)N1C[C@@H]2CCC[C@]2(CO)C1	ZINC000875161511	EE	On-Demand	Anodyne	NOS2	103	41
O=C(NCC[C@@H](O)C1CCCC1)NCc1ccc(-n2ccnc2)cc1	ZINC000875161515	EF	On-Demand	Anodyne	NOS2	87	38
O=C(NCC[C@H](O)C1CCCC1)NCc1ccc(-n2ccnc2)cc1	ZINC000875161516	EF	On-Demand	Anodyne	NOS2	87	38
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCO[C@H](C(F)F)CC1	ZINC000875161517	FE	On-Demand	Anodyne	NOS2	102	40
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCO[C@@H](C(F)F)CC1	ZINC000875161518	FE	On-Demand	Anodyne	NOS2	102	40
O=C(NCc1ccc(-n2ccnc2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875161526	DD	On-Demand	Anodyne	NOS2	89	36
O=C(NCc1ccc(-n2ccnc2)cc1)NC[C@@H]1C[C@H](O)C1	ZINC000875161527	DD	On-Demand	Anodyne	NOS2	89	36
O=C(NCc1ccc(-n2ccnc2)cc1)NCC1CC(O)C1	ZINC000875161528	DD	On-Demand	Anodyne	NOS2	89	36
COC(=O)CCCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875161535	FG	On-Demand	Anodyne	HTR1A	31	43
COC(=O)CCCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875161535	FG	On-Demand	Anodyne	DRD2	33	44
COC(=O)CCCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875161535	FG	On-Demand	Anodyne	DRD4	17	44
COC(=O)CCCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875161535	FG	On-Demand	Anodyne	RBP4	34	40
COC(=O)CCCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875161536	FG	On-Demand	Anodyne	HTR1A	31	43
COC(=O)CCCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875161536	FG	On-Demand	Anodyne	DRD2	33	44
COC(=O)CCCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875161536	FG	On-Demand	Anodyne	DRD4	17	44
COC(=O)CCCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875161536	FG	On-Demand	Anodyne	RBP4	34	40
CC[C@@H]1COCCN1CCNC(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000875161538	FD	On-Demand	Anodyne	NOS2	96	41
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O	ZINC000875161544	GG	On-Demand	Anodyne	NOS2	89	42
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCCC[C@@H]1[C@H]1CCCC[C@H]1O	ZINC000875161545	GG	On-Demand	Anodyne	NOS2	89	42
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O	ZINC000875161546	GG	On-Demand	Anodyne	NOS2	89	42
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O	ZINC000875161547	GG	On-Demand	Anodyne	NOS2	89	42
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCO[C@@H]2CCC[C@@H]21	ZINC000875161548	EE	On-Demand	Anodyne	NOS2	97	38
O=C(NCCO)C1CCN(C(=O)NCc2ccc(-n3ccnc3)cc2)CC1	ZINC000875161560	FC	On-Demand	Anodyne	NOS2	86	38
C[C@@H](NC(=O)N1CC=CC1)c1cccc(N2CCOC2=O)c1	ZINC000875161614	DE	On-Demand	Anodyne	KCNQ2	20	41
CCOC(=O)C1CCC(NC(=O)NCc2ccc(N(C)C(C)=O)cc2)CC1	ZINC000875161631	GF	On-Demand	Anodyne	EPHX2	18	45
C=C(Br)CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875161651	EF	On-Demand	Mild	PREP	47	39
C=C(Br)CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875161653	EF	On-Demand	Mild	PREP	47	39
C=C(Br)CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875161655	EF	On-Demand	Mild	PREP	47	39
C=C(Br)CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875161656	EF	On-Demand	Mild	PREP	47	39
O=C(NCCO)C1CCN(C(=O)NCCc2cc(Cl)cc(Cl)c2)CC1	ZINC000875161750	GE	On-Demand	Anodyne	EPHX2	21	48
O=C(NCCO)C1CCN(C(=O)NCCc2cc(Cl)cc(Cl)c2)CC1	ZINC000875161750	GE	On-Demand	Anodyne	CACNA1I	40	31
O=C(NCCO)C1CCN(C(=O)NCCc2cc(Cl)cc(Cl)c2)CC1	ZINC000875161750	GE	On-Demand	Anodyne	GPBAR1	17	40
C[C@@H](NC(=O)N(C1CC1)C1CC1)c1cccc(N2CCOC2=O)c1	ZINC000875161782	EG	On-Demand	Anodyne	KCNQ2	20	40
N#Cc1ccc(Cn2cc(NC(=O)NC[C@H]3CC=CCC3)cn2)cc1	ZINC000875161807	EG	On-Demand	Mild	CCR3	15	41
N#Cc1ccc(Cn2cc(NC(=O)NC[C@H]3CC=CCC3)cn2)cc1	ZINC000875161807	EG	On-Demand	Mild	ITK	15	49
N#Cc1ccc(Cn2cc(NC(=O)NC[C@H]3CC=CCC3)cn2)cc1	ZINC000875161807	EG	On-Demand	Mild	PANC	49	35
N#Cc1ccc(Cn2cc(NC(=O)NC[C@@H]3CC=CCC3)cn2)cc1	ZINC000875161810	EG	On-Demand	Mild	CCR3	15	41
N#Cc1ccc(Cn2cc(NC(=O)NC[C@@H]3CC=CCC3)cn2)cc1	ZINC000875161810	EG	On-Demand	Mild	ITK	15	49
N#Cc1ccc(Cn2cc(NC(=O)NC[C@@H]3CC=CCC3)cn2)cc1	ZINC000875161810	EG	On-Demand	Mild	PANC	49	35
O=C(NC[C@H]1CC=CCC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875161823	EE	On-Demand	Anodyne	SMO	29	41
O=C(NC[C@H]1CC=CCC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875161823	EE	On-Demand	Anodyne	ETHR	46	35
O=C(NC[C@H]1CC=CCC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875161824	EE	On-Demand	Anodyne	SMO	29	41
O=C(NC[C@H]1CC=CCC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875161824	EE	On-Demand	Anodyne	ETHR	46	35
O=C(NC[C@@H]1CC=CCC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875161825	EE	On-Demand	Anodyne	SMO	29	41
O=C(NC[C@@H]1CC=CCC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875161825	EE	On-Demand	Anodyne	ETHR	46	35
O=C(NC[C@@H]1CC=CCC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875161826	EE	On-Demand	Anodyne	SMO	29	41
O=C(NC[C@@H]1CC=CCC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875161826	EE	On-Demand	Anodyne	ETHR	46	35
CN1CCN(c2ncccc2CNC(=O)NNc2cccc(F)c2Cl)CC1	ZINC000875161837	GE	On-Demand	Reactive	TRPV1	22	40
CN1CCN(c2ncccc2CNC(=O)NNc2cccc(F)c2Cl)CC1	ZINC000875161837	GE	On-Demand	Reactive	P2RX7	45	41
CN1CCN(c2ncccc2CNC(=O)NNc2cccc(F)c2Cl)CC1	ZINC000875161837	GE	On-Demand	Reactive	SCN10A	19	40
CC(=O)NC[C@@H]1CCCCN1C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000875161846	FE	On-Demand	Anodyne	NOS2	95	45
O=C(NCc1ccc(-n2ccnc2)cc1)N[C@@H]1C[C@H](CO)C1	ZINC000875161856	DD	On-Demand	Anodyne	NOS2	79	35
COC(=O)CCCCNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875161864	FF	On-Demand	Anodyne	EPHX2	20	41
C=C(Br)CNC(=O)NCCc1ccc(OC)c(O)c1	ZINC000875161877	EE	On-Demand	Mild	INHA	72	34
C=C(Br)CNC(=O)NCCc1ccc(OC)c(O)c1	ZINC000875161877	EE	On-Demand	Mild	MTNR1A	16	43
COC(=O)CCCCNC(=O)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875161883	DF	On-Demand	Anodyne	EPHX2	15	51
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cccc2ncccc12	ZINC000875161891	DF	On-Demand	Anodyne	CAPN1	48	41
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cccc2ncccc12	ZINC000875161891	DF	On-Demand	Anodyne	CAPN2	50	33
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cccc2ncccc12	ZINC000875161891	DF	On-Demand	Anodyne	CASP6	25	40
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cccc2ncccc12	ZINC000875161891	DF	On-Demand	Anodyne	PSMB5	19	47
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cccc2ncccc12	ZINC000875161891	DF	On-Demand	Anodyne	PSMB1	15	43
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cccc2ncccc12	ZINC000875161891	DF	On-Demand	Anodyne	HPN	72	37
O=C(NCc1ccc(-n2ccnc2)cc1)N1O[C@H]2C=C[C@H]1CC2	ZINC000875161903	DE	On-Demand	Anodyne	NOS2	90	35
CCC[C@@H](CCO)NC(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000875161905	DE	On-Demand	Anodyne	NOS2	50	32
CCC[C@H](CCO)NC(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000875161907	DE	On-Demand	Anodyne	NOS2	50	32
COc1cccc(C(C)(C)C(=O)N(CC2CC2)C(C)C)c1	ZINC000875161912	CH	On-Demand	Anodyne	MTNR1A	23	40
COc1cccc(C(C)(C)C(=O)N(CC2CC2)C(C)C)c1	ZINC000875161912	CH	On-Demand	Anodyne	MTNR1B	25	40
COC(=O)CCCCNC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875161920	EE	On-Demand	Anodyne	EPHX2	20	53
COC(=O)CCCCNC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875161921	EE	On-Demand	Anodyne	EPHX2	20	53
O=C(NCc1ccc(-n2ccnc2)cc1)N[C@@H]1CCOC[C@@H]1O	ZINC000875161923	DC	On-Demand	Anodyne	NOS2	93	38
O=C(NCc1ccc(-n2ccnc2)cc1)N[C@H]1CCOC[C@@H]1O	ZINC000875161924	DC	On-Demand	Anodyne	NOS2	93	38
O=C(NCc1ccc(-n2ccnc2)cc1)N[C@@H]1CCOC[C@H]1O	ZINC000875161925	DC	On-Demand	Anodyne	NOS2	93	38
O=C(NCc1ccc(-n2ccnc2)cc1)N[C@H]1CCOC[C@H]1O	ZINC000875161926	DC	On-Demand	Anodyne	NOS2	93	38
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC(CCO)(CCO)CC1	ZINC000875161934	FD	On-Demand	Anodyne	NOS2	82	36
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875161939	GG	On-Demand	Anodyne	PREP	27	41
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875161939	GG	On-Demand	Anodyne	NOS2	92	37
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875161939	GG	On-Demand	Anodyne	TMPRSS11D	57	34
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875161940	GG	On-Demand	Anodyne	PREP	27	41
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875161940	GG	On-Demand	Anodyne	NOS2	92	37
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875161940	GG	On-Demand	Anodyne	TMPRSS11D	57	34
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875161941	GG	On-Demand	Anodyne	PREP	27	41
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875161941	GG	On-Demand	Anodyne	NOS2	92	37
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875161941	GG	On-Demand	Anodyne	TMPRSS11D	57	34
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875161942	GG	On-Demand	Anodyne	PREP	27	41
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875161942	GG	On-Demand	Anodyne	NOS2	92	37
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875161942	GG	On-Demand	Anodyne	TMPRSS11D	57	34
COC(=O)CCCCNC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875161943	CC	On-Demand	Anodyne	EPHX2	33	55
COC(=O)CCCCNC(=O)NC1CC(Nc2ccccc2)C1	ZINC000875161944	DE	On-Demand	Anodyne	EPHX2	42	55
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875161949	ED	On-Demand	Anodyne	NOS2	93	39
CCOC(=O)N1CCC(OC(=O)c2ccnc(OCCN(C)C)c2)CC1	ZINC000875161955	FD	On-Demand	Anodyne	P2RY12	45	33
CC[C@@H]1COCCN1CCNC(=O)NCCCCC(=O)OC	ZINC000875161968	DC	On-Demand	Anodyne	EPHX2	20	44
O=C(NCc1ccc(-n2ccnc2)cc1)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875161974	ED	On-Demand	Anodyne	NOS2	79	34
O=C(NCc1ccc(-n2ccnc2)cc1)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875161975	ED	On-Demand	Anodyne	NOS2	79	34
C[C@@H](NC(=O)N1CCCC(F)(F)CC1)c1cccc(N2CCOC2=O)c1	ZINC000875162004	FH	On-Demand	Anodyne	CACNA1H	24	42
CCC1(CC)CCCN1C(=O)NCc1nc(Cc2ccccc2)no1	ZINC000875162034	EH	On-Demand	Anodyne	SLC12A5	48	34
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCCCOCc1ccccc1	ZINC000875162053	GE	On-Demand	Anodyne	GBA2	45	38
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCCCOCc1ccccc1	ZINC000875162073	GE	On-Demand	Anodyne	GBA2	45	38
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCCC2(CC1)CC2	ZINC000875162101	DG	On-Demand	Anodyne	NOS2	95	38
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCC(=O)OC)C1	ZINC000875162112	DD	On-Demand	Anodyne	EPHX2	18	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nc(Cc2ccccc2)no1	ZINC000875162114	FD	On-Demand	Anodyne	SLC6A4	19	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nc(Cc2ccccc2)no1	ZINC000875162114	FD	On-Demand	Anodyne	SLC6A3	40	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nc(Cc2ccccc2)no1	ZINC000875162118	FD	On-Demand	Anodyne	SLC6A4	19	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nc(Cc2ccccc2)no1	ZINC000875162118	FD	On-Demand	Anodyne	SLC6A3	40	39
C[C@@H](NC(=O)N1CC[C@@H](c2ccc(O)cc2)C1)c1ccc(N2CCOC2=O)cc1	ZINC000875162130	GH	On-Demand	Anodyne	DGAT1	16	42
C[C@@H](NC(=O)N1CC[C@H](c2ccc(O)cc2)C1)c1ccc(N2CCOC2=O)cc1	ZINC000875162136	GH	On-Demand	Anodyne	DGAT1	16	42
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	PLG	22	44
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	ACE	38	50
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	CELA1	29	40
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	ELANE	36	42
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	TACR1	21	47
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	CTSD	16	40
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	CTRA_BOVIN	62	34
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	CASP3	22	43
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	BMP1	18	40
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	KLK3	107	51
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	CTSB	76	52
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	PAPA1_CARPA	84	48
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	TRY1_BOVIN	41	34
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	CYSP_TRYCR	62	45
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	CTSG	43	34
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	CTSK	68	52
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	CTSL	55	52
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	PREP	17	43
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	CAPNS1	76	42
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	HLA-DRB1	54	33
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	CELA2A	51	34
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	LGMN	47	37
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	MMP11	60	33
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	TGM1	25	42
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	CTSS	35	52
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	CAPN1	104	54
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	CASP1	28	42
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	CAPN2	157	48
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	PLAU	18	44
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	CASP9	31	41
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	TGM2	31	42
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	NPR	80	41
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	CASP10	37	41
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	PSMB5	47	43
C[C@@H](C1CC1)N(C)C(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000875162158	FD	On-Demand	Anodyne	Q6PRC7_IXORI	43	35
O=C(NCCCS(=O)(=O)c1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875162176	GF	On-Demand	Anodyne	EPHX2	26	41
O=C(NCCCS(=O)(=O)c1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875162176	GF	On-Demand	Anodyne	SFRP1	51	32
O=C(NCCCS(=O)(=O)c1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875162176	GF	On-Demand	Anodyne	WNT3	50	32
O=C(NCCCS(=O)(=O)c1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875162180	GF	On-Demand	Anodyne	EPHX2	26	41
O=C(NCCCS(=O)(=O)c1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875162180	GF	On-Demand	Anodyne	SFRP1	51	32
O=C(NCCCS(=O)(=O)c1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875162180	GF	On-Demand	Anodyne	WNT3	50	32
CC[C@@H](NC(=O)NCCCCC(=O)OC)[C@H](O)c1ccccc1	ZINC000875162185	DE	On-Demand	Anodyne	EPHX2	17	42
CC[C@@H](NC(=O)NCCCCC(=O)OC)[C@@H](O)c1ccccc1	ZINC000875162192	DE	On-Demand	Anodyne	EPHX2	17	42
C[C@@H](C1CC1)N(C)C(=O)c1ccc(N2CCOCC2)nc1	ZINC000875162208	CD	On-Demand	Anodyne	HPGDS	15	45
O=C(NCc1ccc(-n2ccnc2)cc1)N1OC2CCC1CC2	ZINC000875162254	DF	On-Demand	Anodyne	NOS2	103	39
O=C(Nc1ccc2nc3n(c(=O)c2c1)CCC3)c1cccn(C2CC2)c1=O	ZINC000875162258	FE	On-Demand	Anodyne	POLR1A	64	35
C[C@@H](NC(=O)NC1(C)COC1)c1cccc(N2CCOC2=O)c1	ZINC000875162265	DD	On-Demand	Anodyne	KCNQ2	16	41
C[C@H](NC(=O)NC1(C)COC1)c1cccc(N2CCOC2=O)c1	ZINC000875162267	DD	On-Demand	Anodyne	KCNQ2	16	41
COC(=O)C1=NO[C@@]2(CCN(C(=O)NCc3ccc(-n4ccnc4)cc3)C2)C1	ZINC000875162281	GD	On-Demand	Anodyne	NOS2	67	35
COC(=O)C1=NO[C@]2(CCN(C(=O)NCc3ccc(-n4ccnc4)cc3)C2)C1	ZINC000875162284	GD	On-Demand	Anodyne	NOS2	67	35
CN1CCN(c2ncccc2CNC(=O)N2CCC(CO)(CO)CC2)CC1	ZINC000875162287	GC	On-Demand	Anodyne	TRPV1	15	44
COc1cccc([C@H](O)C2CCN(C(=O)NC[C@H]3CC=CCC3)CC2)c1	ZINC000875162289	FH	On-Demand	Anodyne	DRD4	40	31
COc1cccc([C@H](O)C2CCN(C(=O)NC[C@@H]3CC=CCC3)CC2)c1	ZINC000875162292	FH	On-Demand	Anodyne	DRD4	40	31
COC(=O)CCCCNC(=O)N[C@@H]1C[C@H]2C[C@@]2(C(=O)OC)C1	ZINC000875162310	DC	On-Demand	Anodyne	EPHX2	33	56
O=C(NCc1ccc(-n2ccnc2)cc1)N1CC(Cc2cccs2)C1	ZINC000875162322	FG	On-Demand	Anodyne	NOS2	97	40
CN1CCN(c2ncccc2CNC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875162323	GE	On-Demand	Anodyne	EPHX2	16	40
CCOC(=O)[C@@]1(C)CN(C(=O)NCc2ccc(-n3ccnc3)cc2)CCO1	ZINC000875162328	FD	On-Demand	Anodyne	NOS2	85	35
COC(=O)[C@@]1(OC)CCN(C(=O)NCc2ccc(-n3ccnc3)cc2)C1	ZINC000875162332	FD	On-Demand	Anodyne	NOS2	78	38
CCOC(=O)N1CCC(OC(=O)COCc2ccnc(OC)c2)CC1	ZINC000875162336	FD	On-Demand	Anodyne	GRIN2B	22	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccnc1N1CCN(C)CC1	ZINC000875162355	GD	On-Demand	Anodyne	SLC6A3	45	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccnc1N1CCN(C)CC1	ZINC000875162357	GD	On-Demand	Anodyne	SLC6A3	45	38
O=C(Nc1ccc2nc3n(c(=O)c2c1)CCC3)C1(c2ccnc3ccccc23)CC1	ZINC000875162369	GH	On-Demand	Anodyne	ACHE	17	42
CCOC(=O)C1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875162402	GF	On-Demand	Anodyne	EPHX2	19	42
CCOC(=O)C1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875162403	GF	On-Demand	Anodyne	EPHX2	19	42
C[C@@H](C1CC1)N(C)C(=O)c1ccccc1NC(=O)c1ccsc1	ZINC000875162428	EH	On-Demand	Anodyne	KCNK3	15	43
O=C(NCCCCOCc1ccccc1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875162487	FF	On-Demand	Anodyne	UGCG	44	42
O=C(NCCCCOCc1ccccc1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875162487	FF	On-Demand	Anodyne	GBA	27	42
O=C(NCCCCOCc1ccccc1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875162487	FF	On-Demand	Anodyne	GBA2	65	42
CN1CC[C@H]2CN(C(=O)C(=O)NCCCCOCc3ccccc3)CC[C@@H]21	ZINC000875162532	FD	On-Demand	Anodyne	DRD3	25	40
CN1CC[C@H]2CN(C(=O)C(=O)NCCCCOCc3ccccc3)CC[C@@H]21	ZINC000875162532	FD	On-Demand	Anodyne	UGCG	49	35
CN1CC[C@H]2CN(C(=O)C(=O)NCCCCOCc3ccccc3)CC[C@@H]21	ZINC000875162532	FD	On-Demand	Anodyne	GBA2	50	39
CN1CC[C@H]2CN(C(=O)C(=O)NCCCCOCc3ccccc3)CC[C@H]21	ZINC000875162533	FD	On-Demand	Anodyne	DRD3	25	40
CN1CC[C@H]2CN(C(=O)C(=O)NCCCCOCc3ccccc3)CC[C@H]21	ZINC000875162533	FD	On-Demand	Anodyne	UGCG	49	35
CN1CC[C@H]2CN(C(=O)C(=O)NCCCCOCc3ccccc3)CC[C@H]21	ZINC000875162533	FD	On-Demand	Anodyne	GBA2	50	39
O=C(NCc1ccc(-n2ccnc2)cc1)N[C@@]12CCCC[C@@H]1C2	ZINC000875162549	DG	On-Demand	Anodyne	NOS2	88	42
O=C(NCc1ccc(-n2ccnc2)cc1)N[C@@]12CCCC[C@H]1C2	ZINC000875162557	DG	On-Demand	Anodyne	NOS2	88	42
O=C(NCc1ccc(-n2ccnc2)cc1)N[C@]12CCCC[C@@H]1C2	ZINC000875162560	DG	On-Demand	Anodyne	NOS2	88	42
O=C(NCc1ccc(-n2ccnc2)cc1)N[C@]12CCCC[C@H]1C2	ZINC000875162563	DG	On-Demand	Anodyne	NOS2	88	42
COc1ccc([C@@H](Cc2ccc(F)cc2)NC(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875162573	GI	On-Demand	Anodyne	CCR3	47	41
COc1ccc([C@@H](Cc2ccc(F)cc2)NC(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875162573	GI	On-Demand	Anodyne	SLC18A3	17	40
COc1ccc([C@@H](Cc2ccc(F)cc2)NC(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875162573	GI	On-Demand	Anodyne	CACNA1G	29	42
COc1ccc([C@H](Cc2ccc(F)cc2)NC(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875162574	GI	On-Demand	Anodyne	CCR3	47	41
COc1ccc([C@H](Cc2ccc(F)cc2)NC(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875162574	GI	On-Demand	Anodyne	SLC18A3	17	40
COc1ccc([C@H](Cc2ccc(F)cc2)NC(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875162574	GI	On-Demand	Anodyne	CACNA1G	29	42
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(OC3CCCCC3)cc2)CC1	ZINC000875162586	GF	On-Demand	Anodyne	PRSS2	61	33
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(OC3CCCCC3)cc2)CC1	ZINC000875162586	GF	On-Demand	Anodyne	HRH3	19	48
CCOC(=O)N1CCC(OC(=O)c2c(OC)ccnc2OC)CC1	ZINC000875162587	ED	On-Demand	Anodyne	GPR119	41	40
O=C(NCc1ccc(-n2ccnc2)cc1)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875162611	FE	On-Demand	Anodyne	NOS2	98	40
O=C(NCc1ccc(-n2ccnc2)cc1)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875162615	FE	On-Demand	Anodyne	NOS2	98	40
CN1CCN(c2ncccc2CNC(=O)N2CCC[C@H](C(C)(C)O)C2)CC1	ZINC000875162637	GD	On-Demand	Anodyne	TRPV1	17	45
CN1CCN(c2ncccc2CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)CC1	ZINC000875162640	GD	On-Demand	Anodyne	TRPV1	17	45
O=C(NCc1ccc(-n2ccnc2)cc1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875162701	GF	On-Demand	Anodyne	NOS2	98	39
O=C(NCc1ccc(-n2ccnc2)cc1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875162701	GF	On-Demand	Anodyne	NAMPT	28	43
COC(=O)CCCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875162706	EE	On-Demand	Anodyne	TRY1_BOVIN	45	34
COC(=O)CCCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875162706	EE	On-Demand	Anodyne	PREP	43	37
COC(=O)CCCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875162707	EE	On-Demand	Anodyne	TRY1_BOVIN	45	34
COC(=O)CCCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875162707	EE	On-Demand	Anodyne	PREP	43	37
COC(=O)CCCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875162708	EE	On-Demand	Anodyne	TRY1_BOVIN	45	34
COC(=O)CCCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875162708	EE	On-Demand	Anodyne	PREP	43	37
COC(=O)CCCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875162709	EE	On-Demand	Anodyne	TRY1_BOVIN	45	34
COC(=O)CCCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875162709	EE	On-Demand	Anodyne	PREP	43	37
COC(=O)CCCCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875162712	ED	On-Demand	Anodyne	ADRB2	15	43
COC(=O)CCCCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875162712	ED	On-Demand	Anodyne	ADRB3	24	40
COC(=O)CCCCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875162712	ED	On-Demand	Anodyne	CTSV	28	40
COC(=O)CCCCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875162713	ED	On-Demand	Anodyne	ADRB2	15	43
COC(=O)CCCCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875162713	ED	On-Demand	Anodyne	ADRB3	24	40
COC(=O)CCCCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875162713	ED	On-Demand	Anodyne	CTSV	28	40
CN(CCNC(=O)NCc1ccc(-n2ccnc2)cc1)CC(F)F	ZINC000875162714	ED	On-Demand	Anodyne	NOS2	66	33
COC(=O)[C@@H]1CN(C(=O)NCc2ccc(-n3ccnc3)cc2)C[C@@H](C)O1	ZINC000875162719	FD	On-Demand	Anodyne	NOS2	99	40
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875162728	FF	On-Demand	Anodyne	NOS2	99	38
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875162729	FF	On-Demand	Anodyne	NOS2	99	38
COC(=O)CCCCNC(=O)NNc1ccc(OC)cc1Br	ZINC000875162732	FE	On-Demand	Reactive	MTNR1A	46	40
COC(=O)CCCCNC(=O)NNc1ccc(OC)cc1Br	ZINC000875162732	FE	On-Demand	Reactive	MTNR1B	35	40
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCc2nc(C3CC3)ncc2C1	ZINC000875162733	FF	On-Demand	Anodyne	NOS2	96	38
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCc2nc(C3CC3)ncc2C1	ZINC000875162733	FF	On-Demand	Anodyne	NAMPT	26	42
O=CN1CCCN(C(=O)NCc2ccc(-n3ccnc3)cc2)CC1	ZINC000875162737	ED	On-Demand	Anodyne	NOS2	98	41
C[C@@H](NC(=O)N1CC(c2ccccc2)C1)c1cccc(N2CCOC2=O)c1	ZINC000875162745	FH	On-Demand	Anodyne	KCNQ2	20	41
C[C@@H](NC(=O)N1CC(c2ccccc2)C1)c1cccc(N2CCOC2=O)c1	ZINC000875162745	FH	On-Demand	Anodyne	BIRC8	46	33
O=C(NCCCCOCc1ccccc1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875162753	GE	On-Demand	Anodyne	GBA2	41	38
O=C(NCCCCOCc1ccccc1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875162754	GE	On-Demand	Anodyne	GBA2	41	38
O=C(NCCCCOCc1ccccc1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875162755	GE	On-Demand	Anodyne	GBA2	41	38
O=C(NCCCCOCc1ccccc1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875162756	GE	On-Demand	Anodyne	GBA2	41	38
C[C@@H](NC(=O)N1CCCC2(CC1)CC2)c1cccc(N2CCOC2=O)c1	ZINC000875162759	FH	On-Demand	Anodyne	CACNA1H	25	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCOCc2ccccc2)C1	ZINC000875162783	FD	On-Demand	Anodyne	ACE	25	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCOCc2ccccc2)C1	ZINC000875162783	FD	On-Demand	Anodyne	FKBP1A	40	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCOCc2ccccc2)C1	ZINC000875162783	FD	On-Demand	Anodyne	SLC6A1	48	36
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCOCc2ccccc2)C1	ZINC000875162783	FD	On-Demand	Anodyne	PREP	54	39
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCOCc2ccccc2)C1	ZINC000875162783	FD	On-Demand	Anodyne	GBA2	45	38
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCOCc2ccccc2)C1	ZINC000875162783	FD	On-Demand	Anodyne	TGM2	28	44
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCOCc2ccccc2)C1	ZINC000875162784	FD	On-Demand	Anodyne	ACE	25	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCOCc2ccccc2)C1	ZINC000875162784	FD	On-Demand	Anodyne	FKBP1A	40	37
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCOCc2ccccc2)C1	ZINC000875162784	FD	On-Demand	Anodyne	SLC6A1	48	36
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCOCc2ccccc2)C1	ZINC000875162784	FD	On-Demand	Anodyne	PREP	54	39
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCOCc2ccccc2)C1	ZINC000875162784	FD	On-Demand	Anodyne	GBA2	45	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCOCc2ccccc2)C1	ZINC000875162784	FD	On-Demand	Anodyne	TGM2	28	44
O=C(NCCOc1ccccc1-c1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875162800	GF	On-Demand	Anodyne	HCN1	42	31
C[C@H](NC(=O)C(=O)NCCCCOCc1ccccc1)c1ccnn1C	ZINC000875162806	FD	On-Demand	Anodyne	CTSB	43	36
C[C@H](NC(=O)C(=O)NCCCCOCc1ccccc1)c1ccnn1C	ZINC000875162806	FD	On-Demand	Anodyne	CAPNS1	48	34
C[C@H](NC(=O)C(=O)NCCCCOCc1ccccc1)c1ccnn1C	ZINC000875162806	FD	On-Demand	Anodyne	GHSR	33	40
C[C@H](NC(=O)C(=O)NCCCCOCc1ccccc1)c1ccnn1C	ZINC000875162806	FD	On-Demand	Anodyne	CAPN1	69	38
C[C@H](NC(=O)C(=O)NCCCCOCc1ccccc1)c1ccnn1C	ZINC000875162806	FD	On-Demand	Anodyne	CAPN2	113	38
CC[C@@H](NC(=O)c1nn(C)cc1I)c1ccccc1OC	ZINC000875162819	GF	On-Demand	Anodyne	CTSA	28	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1	ZINC000875162869	GF	On-Demand	Anodyne	SLC6A4	20	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2ccc(F)c(F)c2)C1	ZINC000875162870	GF	On-Demand	Anodyne	SLC6A4	20	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2ccc(F)c(F)c2)C1	ZINC000875162871	GF	On-Demand	Anodyne	SLC6A4	20	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1	ZINC000875162872	GF	On-Demand	Anodyne	SLC6A4	20	40
C[C@@H](NC(=O)NC1(C)CC(F)(F)C1)c1cccc(N2CCOC2=O)c1	ZINC000875162879	FG	On-Demand	Anodyne	KCNQ2	20	40
C[C@H](NC(=O)NC1(C)CC(F)(F)C1)c1cccc(N2CCOC2=O)c1	ZINC000875162881	FG	On-Demand	Anodyne	KCNQ2	20	40
C[C@@]1(CO)CN(C(=O)NCc2ccc(-n3ccnc3)cc2)C[C@]1(C)CO	ZINC000875162941	FD	On-Demand	Anodyne	NOS2	91	37
C[C@@]1(CO)CN(C(=O)NCc2ccc(-n3ccnc3)cc2)C[C@]1(C)CO	ZINC000875162941	FD	On-Demand	Anodyne	NAMPT	39	40
CN1CCO[C@H](CN(C)C(=O)NCc2ccc(-n3ccnc3)cc2)C1	ZINC000875162944	ED	On-Demand	Anodyne	NOS2	100	40
O=C(NCc1ccc(-n2ccnc2)cc1)N[C@@H]1COCC[C@H]1O	ZINC000875162946	DC	On-Demand	Anodyne	NOS2	94	38
C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000875162949	EE	On-Demand	Anodyne	NOS2	77	37
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000875162950	EE	On-Demand	Anodyne	NOS2	77	37
C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000875162952	EE	On-Demand	Anodyne	NOS2	77	37
COC(=O)CCCCNC(=O)NC1(C)CC(F)(F)C1	ZINC000875162960	CD	On-Demand	Anodyne	EPHX2	29	56
COC(=O)CCCCNC(=O)NCC[C@@H](O)C1CCCC1	ZINC000875162962	DD	On-Demand	Anodyne	EPHX2	28	61
COC(=O)CCCCNC(=O)NCC[C@H](O)C1CCCC1	ZINC000875162963	DD	On-Demand	Anodyne	EPHX2	28	61
C[C@@H]1CN(C(=O)NCc2ccc(-n3ccnc3)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000875162971	GG	On-Demand	Anodyne	NOS2	96	37
C[C@@H]1CN(C(=O)NCc2ccc(-n3ccnc3)cc2)CC[C@H](C(F)(F)F)O1	ZINC000875162972	GG	On-Demand	Anodyne	NOS2	96	37
COC(=O)CCCCNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875162978	DC	On-Demand	Anodyne	EPHX2	17	56
CN(C[C@@H]1C[C@H](O)C1)C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000875162987	DD	On-Demand	Anodyne	NOS2	91	35
O=C(NCc1ccc(-n2ccnc2)cc1)NC[C@@H](O)[C@@H]1CCCO1	ZINC000875162988	ED	On-Demand	Anodyne	NOS2	75	35
O=C(NCc1ccc(-n2ccnc2)cc1)NC[C@H](O)[C@@H]1CCCO1	ZINC000875162989	ED	On-Demand	Anodyne	NOS2	75	35
O=C(NCc1ccc(-n2ccnc2)cc1)NC[C@@H](O)[C@H]1CCCO1	ZINC000875162990	ED	On-Demand	Anodyne	NOS2	75	35
O=C(NCc1ccc(-n2ccnc2)cc1)NC[C@H](O)[C@H]1CCCO1	ZINC000875162991	ED	On-Demand	Anodyne	NOS2	75	35
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccnc2N2CCN(C)CC2)C1	ZINC000875162994	GD	On-Demand	Anodyne	P2RY12	16	44
O=C(NCc1ccc(-n2ccnc2)cc1)N[C@@H]1CCO[C@H]1c1cc[nH]n1	ZINC000875163003	FD	On-Demand	Anodyne	NOS2	69	34
COC(=O)CCCCNC(=O)NC1([C@H]2CCCCO2)CCC1	ZINC000875163014	DE	On-Demand	Anodyne	EPHX2	25	50
COC(=O)CCCCNC(=O)NC1([C@@H]2CCCCO2)CCC1	ZINC000875163015	DE	On-Demand	Anodyne	EPHX2	25	50
CCOC(=O)N1CCC(OC(=O)COCc2ccnc(O)c2)CC1	ZINC000875163016	ED	On-Demand	Anodyne	GRIN2B	24	41
C[C@@H](CC(=O)N=c1cc[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000875163020	EF	On-Demand	Anodyne	SSTR2	44	33
C[C@@H](CC(=O)N=c1cc[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000875163020	EF	On-Demand	Anodyne	CCKAR	70	38
C[C@@H](CC(=O)N=c1cc[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000875163020	EF	On-Demand	Anodyne	CTSL	15	44
C[C@@H](CC(=O)N=c1cc[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000875163020	EF	On-Demand	Anodyne	ECE1	20	41
C[C@@H](CC(=O)N=c1cc[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000875163020	EF	On-Demand	Anodyne	REN	15	42
C[C@@H](CC(=O)N=c1cc[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000875163020	EF	On-Demand	Anodyne	CCKBR	37	44
C[C@@H](CC(=O)N=c1cc[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000875163020	EF	On-Demand	Anodyne	FPR1	45	44
O=C(NCc1ccc(-n2ccnc2)cc1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875163033	GD	On-Demand	Anodyne	NOS2	91	38
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3ccc(-n4ccnc4)cc3)C[C@@H]1C2	ZINC000875163034	FE	On-Demand	Anodyne	NOS2	94	41
O=C(NC[C@@H]1CC=CCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875163199	DG	On-Demand	Anodyne	F2	20	40
O=C(NC[C@@H]1CC=CCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875163202	DG	On-Demand	Anodyne	F2	20	40
O=C(NC[C@@H]1CC=CCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875163204	DG	On-Demand	Anodyne	F2	20	40
O=C(NCc1ccc(-n2ccnc2)cc1)N(CCO)CCOCCO	ZINC000875163205	EC	On-Demand	Anodyne	NOS2	43	32
O=C(NC[C@@H]1CC=CCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875163206	DG	On-Demand	Anodyne	F2	20	40
C[C@@H](NC(=O)N1CCN(C)C(C)(C)CC1)c1cccc(N2CCOC2=O)c1	ZINC000875163228	FF	On-Demand	Anodyne	CACNA1H	24	40
CN1CCN(C(=O)NCc2ccc(-n3ccnc3)cc2)CCC1(C)C	ZINC000875163229	EE	On-Demand	Anodyne	NOS2	84	37
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000875163242	EF	On-Demand	Anodyne	NOS2	80	37
O=C(NCc1ccc(-n2ccnc2)cc1)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875163243	ED	On-Demand	Anodyne	NOS2	95	38
C[C@@H](NC(=O)NCc1ccc(-n2ccnc2)cc1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875163265	GF	On-Demand	Anodyne	NOS2	77	36
C[C@@H](NC(=O)NCc1ccc(-n2ccnc2)cc1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875163265	GF	On-Demand	Anodyne	GPR119	15	40
COC(=O)C1(O)CN(C(=O)NCc2ccc(-n3ccnc3)cc2)C1	ZINC000875163271	EC	On-Demand	Anodyne	NOS2	64	37
COC(=O)CCCCNC(=O)N[C@@H]1CC(C)(C)CC[C@H]1O	ZINC000875163279	DD	On-Demand	Anodyne	EPHX2	30	53
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(Oc3ccccc3)nc2)CC1	ZINC000875163317	GE	On-Demand	Anodyne	CPT1A	40	36
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(Oc3ccccc3)nc2)CC1	ZINC000875163317	GE	On-Demand	Anodyne	NAMPT	31	41
CN1CCN(c2ncccc2CNC(=O)N(C)OCC(F)(F)F)CC1	ZINC000875163323	FD	On-Demand	Anodyne	TRPV1	31	41
CN1CCN(c2ncccc2CNC(=O)N(C)OCC(F)(F)F)CC1	ZINC000875163323	FD	On-Demand	Anodyne	P2RX7	38	40
CN1CCN(c2ncccc2CNC(=O)N2Cc3cccc(O)c3C2)CC1	ZINC000875163326	FD	On-Demand	Clean	NAMPT	24	43
COC(=O)CCCCNC(=O)N[C@@]12CCC[C@H]1N(C(=O)OC(C)(C)C)CC2	ZINC000875163330	GF	On-Demand	Anodyne	EPHX2	21	45
COC(=O)CCCCNC(=O)N[C@@]12CCC[C@@H]1N(C(=O)OC(C)(C)C)CC2	ZINC000875163331	GF	On-Demand	Anodyne	EPHX2	21	45
COC(=O)CCCCNC(=O)N[C@]12CCC[C@H]1N(C(=O)OC(C)(C)C)CC2	ZINC000875163333	GF	On-Demand	Anodyne	EPHX2	21	45
COC(=O)CCCCNC(=O)N[C@]12CCC[C@@H]1N(C(=O)OC(C)(C)C)CC2	ZINC000875163334	GF	On-Demand	Anodyne	EPHX2	21	45
O=C(NCCN1CC[C@H](O)C1)NCc1ccc(-n2ccnc2)cc1	ZINC000875163337	EC	On-Demand	Anodyne	NOS2	96	37
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc(-n2ccnc2)cc1	ZINC000875163338	EC	On-Demand	Anodyne	NOS2	96	37
COC(=O)[C@@]1(C)CN(C(=O)NCc2ccc(-n3ccnc3)cc2)C[C@@H]1C	ZINC000875163353	FE	On-Demand	Anodyne	NOS2	74	36
CO[C@H]1CCN([C@@H]2CCC[C@@H]2N(C)C(=O)NCc2ccc(-n3ccnc3)cc2)C1	ZINC000875163356	GF	On-Demand	Anodyne	NOS2	95	40
O=C(NCc1ccc(-n2ccnc2)cc1)N[C@H]1COC[C@H]1O	ZINC000875163385	DC	On-Demand	Anodyne	NOS2	95	36
CCOC(=O)N1CCC(OC(=O)c2cccc3scnc23)CC1	ZINC000875163393	EG	On-Demand	Anodyne	P2RY12	40	33
CS(=O)(=O)NC1CN(C(=O)NCc2ccc(-n3ccnc3)cc2)C1	ZINC000875163446	EC	On-Demand	Anodyne	NOS2	95	38
CS(=O)(=O)NC1CN(C(=O)NCc2ccc(-n3ccnc3)cc2)C1	ZINC000875163446	EC	On-Demand	Anodyne	NAMPT	36	40
COC(=O)CCCCNC(=O)NC1CC(C(=O)OC)C1	ZINC000875163451	CC	On-Demand	Anodyne	EPHX2	36	66
CCOC(=O)N1CCC(OC(=O)c2c(F)cccc2[N+](=O)[O-])CC1	ZINC000875163452	EF	On-Demand	Bother	CACNA1D	50	34
O=C(Cc1cnn2c1CCCC2)Oc1cccc2ncccc12	ZINC000875163458	DF	On-Demand	Anodyne	HNMT	44	31
CN1CCN(c2ncccc2CNC(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875163473	FD	On-Demand	Anodyne	TRPV1	19	46
CN1CCN(c2ncccc2CNC(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875163473	FD	On-Demand	Anodyne	EPHX2	17	44
CN1CCN(c2ncccc2CNC(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875163475	FD	On-Demand	Anodyne	TRPV1	19	46
CN1CCN(c2ncccc2CNC(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875163475	FD	On-Demand	Anodyne	EPHX2	17	44
O=CN1CCCN(C(=O)NCc2cccc(NC(=O)C3CCCCC3)c2)CC1	ZINC000875163476	GF	On-Demand	Anodyne	EPHX2	17	41
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000875163479	GE	On-Demand	Anodyne	NOS2	95	39
CN1CCN(C2CCN(C(=O)NC[C@H]3CC=CCC3)CC2)CC1	ZINC000875163482	DD	On-Demand	Anodyne	L3MBTL3	44	40
CN1CCN(C2CCN(C(=O)NC[C@@H]3CC=CCC3)CC2)CC1	ZINC000875163483	DD	On-Demand	Anodyne	L3MBTL3	44	40
O=C(NCc1ccc(-n2ccnc2)cc1)N1CC(OCC(F)F)C1	ZINC000875163495	EE	On-Demand	Anodyne	NOS2	84	37
COC(=O)CCCCNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875163523	ED	On-Demand	Anodyne	FAAH	21	41
COC(=O)CCCCNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875163523	ED	On-Demand	Anodyne	EPHX2	15	41
CCOC(=O)N1CCC(OC(=O)Cc2ccc(C(=O)OC)nc2)CC1	ZINC000875163528	FD	On-Demand	Anodyne	P2RY12	48	34
CCOC(=O)N1CCC(OC(=O)Cc2ccc(C(=O)OC)nc2)CC1	ZINC000875163528	FD	On-Demand	Anodyne	GRIN2B	19	41
C=C(Br)CNC(=O)N1CC2(CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000875163531	GF	On-Demand	Mild	GPR119	16	41
O=C(NC[C@H]1CC=CCC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875163539	EH	On-Demand	Anodyne	SMO	38	51
O=C(NC[C@H]1CC=CCC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875163539	EH	On-Demand	Anodyne	ETHR	56	48
O=C(NC[C@@H]1CC=CCC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875163542	EH	On-Demand	Anodyne	SMO	38	51
O=C(NC[C@@H]1CC=CCC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875163542	EH	On-Demand	Anodyne	ETHR	56	48
CCOC(=O)C1CCC(NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)CC1	ZINC000875163555	FF	On-Demand	Anodyne	EPHX2	25	42
CCOC(=O)C1CCC(NC(=O)N2CCC[C@](O)(c3ccccc3)C2)CC1	ZINC000875163558	FF	On-Demand	Anodyne	EPHX2	25	42
O=C(C[C@@H]1Cc2ccccc2O1)Nc1ccc2nc3n(c(=O)c2c1)CCC3	ZINC000875163560	FF	On-Demand	Anodyne	ACHE	15	45
O=C(C[C@H]1Cc2ccccc2O1)Nc1ccc2nc3n(c(=O)c2c1)CCC3	ZINC000875163563	FF	On-Demand	Anodyne	ACHE	15	45
O=C(NCC[C@@H](O)C(F)F)NCc1ccc(-n2ccnc2)cc1	ZINC000875163568	DD	On-Demand	Anodyne	NOS2	43	31
O=C(NCC[C@H](O)C(F)F)NCc1ccc(-n2ccnc2)cc1	ZINC000875163571	DD	On-Demand	Anodyne	NOS2	43	31
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCS(=O)(=O)c1ccccc1	ZINC000875163598	GD	On-Demand	Anodyne	SLC6A4	19	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCS(=O)(=O)c1ccccc1	ZINC000875163598	GD	On-Demand	Anodyne	SLC6A3	42	40
O=C(NCc1ccc(-n2ccnc2)cc1)N(C1CC1)C1CC1	ZINC000875163648	CF	On-Demand	Anodyne	NOS2	100	39
O=C(NCc1ccc(-n2ccnc2)cc1)N1CC2(CCCO2)C1	ZINC000875163650	DD	On-Demand	Anodyne	NOS2	70	35
CCO[C@@H](C(=O)Nc1nc(C(F)(F)F)cs1)C1CCOCC1	ZINC000875163656	EF	On-Demand	Anodyne	GCK	18	45
CN(C)C[C@@H]1CN(C(=O)NCc2ccc(-n3ccnc3)cc2)C[C@H]1CN(C)C	ZINC000875163659	GD	On-Demand	Anodyne	NOS2	99	39
C[C@H](NC(=O)C(=O)NCCCCOCc1ccccc1)c1cc2cnccc2o1	ZINC000875163665	GG	On-Demand	Anodyne	CAPN2	52	33
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000875163667	FE	On-Demand	Anodyne	NOS2	72	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000875163670	FE	On-Demand	Anodyne	NOS2	72	38
O=C(NCCCS(=O)(=O)c1ccccc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875163678	GE	On-Demand	Anodyne	SFRP1	95	34
O=C(NCCCS(=O)(=O)c1ccccc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875163678	GE	On-Demand	Anodyne	WNT3	60	34
O=C(NCCCS(=O)(=O)c1ccccc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875163679	GE	On-Demand	Anodyne	SFRP1	95	34
O=C(NCCCS(=O)(=O)c1ccccc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875163679	GE	On-Demand	Anodyne	WNT3	60	34
CCCCCCCNC(=O)C(=O)N[C@H](c1nnc2ccccn12)C(C)C	ZINC000875163702	FF	On-Demand	Mild	ASAH1	65	36
CCCCCCCNC(=O)C(=O)N[C@@H](c1nnc2ccccn12)C(C)C	ZINC000875163703	FF	On-Demand	Mild	ASAH1	65	36
CC(=O)C1CCN(C(=O)NCCOc2ccccc2-c2ccccc2)CC1	ZINC000875163715	FH	On-Demand	Anodyne	EPHX2	20	43
O=C(NCCCCOCc1ccccc1)C(=O)NCc1cccc2ncccc12	ZINC000875163797	GF	On-Demand	Anodyne	AMP1_PLAFQ	40	38
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCN(c3ccc(Cl)cc3)C2)C1	ZINC000875163805	GG	On-Demand	Anodyne	CACNA1I	47	36
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCN(c3ccc(Cl)cc3)C2)C1	ZINC000875163807	GG	On-Demand	Anodyne	CACNA1I	47	36
CO[C@H]1CN(C(=O)NCc2ccc(-n3ccnc3)cc2)[C@](C)(CO)C1	ZINC000875163811	ED	On-Demand	Anodyne	NOS2	78	37
CO[C@H]1CN(C(=O)NCc2ccc(-n3ccnc3)cc2)[C@@](C)(CO)C1	ZINC000875163814	ED	On-Demand	Anodyne	NOS2	78	37
O=C(NCc1ccc(-n2ccnc2)cc1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875163830	FH	On-Demand	Anodyne	NOS2	56	33
CO[C@H]1CCN([C@@H]2CCC[C@@H]2NC(=O)NCc2ccc(-n3ccnc3)cc2)C1	ZINC000875163833	GE	On-Demand	Anodyne	NOS2	67	39
COC(=O)CCCCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875163836	EF	On-Demand	Anodyne	FKBP1A	47	41
COC(=O)CCCCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875163837	EF	On-Demand	Anodyne	FKBP1A	47	41
COC(=O)CCCCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875163838	EF	On-Demand	Anodyne	FKBP1A	47	41
COC(=O)CCCCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875163840	EF	On-Demand	Anodyne	FKBP1A	47	41
O=C(NCc1ccc(-n2ccnc2)cc1)N1CC[C@H]2CC[C@@H](C1)S2(=O)=O	ZINC000875163841	FD	On-Demand	Anodyne	NOS2	99	39
O=C(NCc1ccc(-n2ccnc2)cc1)N1CC[C@H]2CC[C@@H](C1)S2(=O)=O	ZINC000875163841	FD	On-Demand	Anodyne	NAMPT	28	40
CN1CCCC[C@H](N(C)C(=O)NCc2ccc(-n3ccnc3)cc2)C1=O	ZINC000875163842	FE	On-Demand	Anodyne	NOS2	100	45
CN1CCCC[C@@H](N(C)C(=O)NCc2ccc(-n3ccnc3)cc2)C1=O	ZINC000875163843	FE	On-Demand	Anodyne	NOS2	100	45
CN1CCN(c2ncccc2CNC(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)CC1	ZINC000875163846	GF	On-Demand	Anodyne	TRPV1	22	42
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875163847	FH	On-Demand	Anodyne	NOS2	90	39
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875163847	FH	On-Demand	Anodyne	EPHX2	16	40
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875163849	FH	On-Demand	Anodyne	NOS2	90	39
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875163849	FH	On-Demand	Anodyne	EPHX2	16	40
O=C1CCN(C(=O)NCc2ccc(-n3ccnc3)cc2)CCCCCCN1	ZINC000875163851	FE	On-Demand	Anodyne	NOS2	81	36
O=C(NCc1ccc(-n2ccnc2)cc1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875163877	FF	On-Demand	Anodyne	NOS2	60	35
O=C(NCc1ccc(-n2ccnc2)cc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875163880	DF	On-Demand	Anodyne	NOS2	56	33
O=C(NCc1ccc(-n2ccnc2)cc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875163881	DF	On-Demand	Anodyne	NOS2	56	33
O=C(NCc1ccc(-n2ccnc2)cc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875163882	DF	On-Demand	Anodyne	NOS2	56	33
O=C(NCc1ccc(-n2ccnc2)cc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875163883	DF	On-Demand	Anodyne	NOS2	56	33
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1(c2ccccc2OC)CC1	ZINC000875163959	FD	On-Demand	Mild	KCNA3	43	37
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1(c2ccccc2OC)CC1	ZINC000875163960	FD	On-Demand	Mild	KCNA3	43	37
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)C(C)(C)c2ccccc2)CC1	ZINC000875163972	EE	On-Demand	Anodyne	AMY2	45	31
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)C(C)(C)c2ccccc2)CC1	ZINC000875163973	EE	On-Demand	Anodyne	AMY2	45	31
O=CN1CCCN(C(=O)NCc2ccc(Br)cc2Cl)CC1	ZINC000875163976	FE	On-Demand	Anodyne	EPHX2	17	48
COC(=O)N(C)NC(=O)NC[C@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000875163997	EE	On-Demand	Reactive	CACNA1I	66	35
COC(=O)N(C)NC(=O)NC[C@@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000875163998	EE	On-Demand	Reactive	CACNA1I	66	35
CS(=O)(=O)c1ccc2c(c1)CCCN2C(=O)CCCOC1CCOCC1	ZINC000875164004	GE	On-Demand	Anodyne	GPR119	26	54
CCO[C@@H](C(=O)N1CCCc2cc(S(C)(=O)=O)ccc21)C1CCCC1	ZINC000875164006	FF	On-Demand	Anodyne	GPR119	37	50
CCO[C@H](C(=O)N1CCCc2cc(S(C)(=O)=O)ccc21)C1CCCC1	ZINC000875164007	FF	On-Demand	Anodyne	GPR119	37	50
COCC[C@@H](C)NC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875164022	FD	On-Demand	Anodyne	NPY2R	66	37
COCC[C@H](C)NC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875164023	FD	On-Demand	Anodyne	NPY2R	66	37
CS(=O)(=O)c1ccc2c(c1)CCCN2C(=O)Cc1csc(C2CC2)n1	ZINC000875164024	GF	On-Demand	Anodyne	GPR119	21	43
Cc1nnc(NNC(=O)NCc2ccc(Br)cc2Cl)n1C	ZINC000875164031	FE	On-Demand	Reactive	P2RX7	59	39
Cn1nc(Cl)c(C(=O)N2CCCCc3ccccc32)c1Cl	ZINC000875164037	DH	On-Demand	Anodyne	AVPR2	69	53
Cn1nc(Cl)c(C(=O)N2CCCCc3ccccc32)c1Cl	ZINC000875164037	DH	On-Demand	Anodyne	AVPR1A	17	50
CCNC(=O)c1ccccc1NC(=O)c1ccnc(OCCN(C)C)c1	ZINC000875164038	FE	On-Demand	Anodyne	KIT	16	40
CCNC(=O)c1ccccc1NC(=O)c1ccnc(OCCN(C)C)c1	ZINC000875164038	FE	On-Demand	Anodyne	BRAF	16	40
CC[C@@H](NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1)C1CCCCC1	ZINC000875164051	GG	On-Demand	Anodyne	ROCK1	24	40
CC[C@@H](NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1)C1CCCCC1	ZINC000875164051	GG	On-Demand	Anodyne	ROCK2	16	40
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875164061	FC	On-Demand	Mild	DRD4	44	34
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875164061	FC	On-Demand	Mild	DRD3	15	44
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875164061	FC	On-Demand	Mild	MTNR1A	20	56
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875164061	FC	On-Demand	Mild	MTNR1B	24	56
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875164062	FC	On-Demand	Mild	DRD4	44	34
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875164062	FC	On-Demand	Mild	DRD3	15	44
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875164062	FC	On-Demand	Mild	MTNR1A	20	56
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875164062	FC	On-Demand	Mild	MTNR1B	24	56
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875164063	FC	On-Demand	Mild	DRD4	44	34
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875164063	FC	On-Demand	Mild	DRD3	15	44
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875164063	FC	On-Demand	Mild	MTNR1A	20	56
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875164063	FC	On-Demand	Mild	MTNR1B	24	56
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875164064	FC	On-Demand	Mild	DRD4	44	34
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875164064	FC	On-Demand	Mild	DRD3	15	44
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875164064	FC	On-Demand	Mild	MTNR1A	20	56
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875164064	FC	On-Demand	Mild	MTNR1B	24	56
COCC[C@@H](C)NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875164066	ED	On-Demand	Anodyne	OXTR	50	36
COCC[C@@H](C)NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875164066	ED	On-Demand	Anodyne	GHRHR	59	42
COCC[C@H](C)NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875164067	ED	On-Demand	Anodyne	OXTR	50	36
COCC[C@H](C)NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875164067	ED	On-Demand	Anodyne	GHRHR	59	42
COCC[C@@H](C)NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875164068	ED	On-Demand	Anodyne	OXTR	50	36
COCC[C@@H](C)NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875164068	ED	On-Demand	Anodyne	GHRHR	59	42
COCC[C@H](C)NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875164069	ED	On-Demand	Anodyne	OXTR	50	36
COCC[C@H](C)NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875164069	ED	On-Demand	Anodyne	GHRHR	59	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000875164078	GF	On-Demand	Anodyne	SLC6A4	31	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000875164078	GF	On-Demand	Anodyne	SLC6A3	55	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000875164078	GF	On-Demand	Anodyne	CACNA1I	48	32
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000875164079	GF	On-Demand	Anodyne	SLC6A4	31	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000875164079	GF	On-Demand	Anodyne	SLC6A3	55	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000875164079	GF	On-Demand	Anodyne	CACNA1I	48	32
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000875164080	GF	On-Demand	Anodyne	SLC6A4	31	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000875164080	GF	On-Demand	Anodyne	SLC6A3	55	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000875164080	GF	On-Demand	Anodyne	CACNA1I	48	32
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000875164081	GF	On-Demand	Anodyne	SLC6A4	31	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000875164081	GF	On-Demand	Anodyne	SLC6A3	55	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000875164081	GF	On-Demand	Anodyne	CACNA1I	48	32
COCC[C@@H](C)NC(=O)C(=O)NC[C@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000875164088	GC	On-Demand	Anodyne	DRD4	23	45
COCC[C@H](C)NC(=O)C(=O)NC[C@@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000875164089	GC	On-Demand	Anodyne	DRD4	23	45
COCC[C@@H](C)NC(=O)C(=O)NC[C@@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000875164090	GC	On-Demand	Anodyne	DRD4	23	45
COCC[C@H](C)NC(=O)C(=O)NC[C@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000875164091	GC	On-Demand	Anodyne	DRD4	23	45
O=C(Nc1nc(-c2c(F)cccc2F)cs1)C1(F)CCOCC1	ZINC000875164116	EH	On-Demand	Anodyne	ROCK1	18	40
Cc1ccnn1CC(=O)N1CCCc2cc(S(C)(=O)=O)ccc21	ZINC000875164119	ED	On-Demand	Anodyne	EIF2AK3	19	48
CO[C@H](C(=O)OC(C)(C)C)C(=O)N1CCCc2cc(S(C)(=O)=O)ccc21	ZINC000875164135	GD	On-Demand	Anodyne	GPR119	36	51
COCC(C)(C)CCNC(=O)C(=O)NCC1(c2ccccc2OC)CC1	ZINC000875164141	FE	On-Demand	Anodyne	KCNA3	44	38
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(S(=O)(=O)N2CCCC2)ccc1Br	ZINC000875164143	JF	On-Demand	Anodyne	AKR1C3	25	46
Cn1nc(Cl)c(C(=O)N2CCCc3c(C(N)=O)cccc32)c1Cl	ZINC000875164147	FE	On-Demand	Anodyne	AVPR2	55	39
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)c2nc3ccccc3s2)C1	ZINC000875164192	FE	On-Demand	Anodyne	TRY1_BOVIN	43	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)c2nc3ccccc3s2)C1	ZINC000875164192	FE	On-Demand	Anodyne	TPSAB1	16	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)c2nc3ccccc3s2)C1	ZINC000875164192	FE	On-Demand	Anodyne	TMPRSS6	50	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)c2nc3ccccc3s2)C1	ZINC000875164193	FE	On-Demand	Anodyne	TRY1_BOVIN	43	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)c2nc3ccccc3s2)C1	ZINC000875164193	FE	On-Demand	Anodyne	TPSAB1	16	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)c2nc3ccccc3s2)C1	ZINC000875164193	FE	On-Demand	Anodyne	TMPRSS6	50	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)c2nc3ccccc3s2)C1	ZINC000875164194	FE	On-Demand	Anodyne	TRY1_BOVIN	43	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)c2nc3ccccc3s2)C1	ZINC000875164194	FE	On-Demand	Anodyne	TPSAB1	16	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)c2nc3ccccc3s2)C1	ZINC000875164194	FE	On-Demand	Anodyne	TMPRSS6	50	32
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)c2nc3ccccc3s2)C1	ZINC000875164195	FE	On-Demand	Anodyne	TRY1_BOVIN	43	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)c2nc3ccccc3s2)C1	ZINC000875164195	FE	On-Demand	Anodyne	TPSAB1	16	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)c2nc3ccccc3s2)C1	ZINC000875164195	FE	On-Demand	Anodyne	TMPRSS6	50	32
O=C(Nc1cccc(-c2nn[nH]n2)c1)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1	ZINC000875164245	IF	On-Demand	Anodyne	EPHX2	16	40
O=C(Nc1cccc(-c2nn[nH]n2)c1)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1	ZINC000875164247	IF	On-Demand	Anodyne	EPHX2	16	40
COC(=O)c1cc(C(=O)N2CCCc3cc(S(C)(=O)=O)ccc32)ccc1C	ZINC000875164266	GF	On-Demand	Anodyne	AVPR2	77	45
COC(=O)c1cc(C(=O)N2CCCc3cc(S(C)(=O)=O)ccc32)ccc1C	ZINC000875164266	GF	On-Demand	Anodyne	AVPR1A	24	42
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCN(c3ccc(Cl)cc3)C2)C1	ZINC000875164279	FD	On-Demand	Anodyne	CACNA1I	54	33
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCN(c3ccc(Cl)cc3)C2)C1	ZINC000875164280	FD	On-Demand	Anodyne	CACNA1I	54	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)C(C)(C)c2ccccc2)C1	ZINC000875164286	EE	On-Demand	Anodyne	AMY2	47	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)C(C)(C)c2ccccc2)C1	ZINC000875164287	EE	On-Demand	Anodyne	AMY2	47	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)C(C)(C)c2ccccc2)C1	ZINC000875164288	EE	On-Demand	Anodyne	AMY2	47	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)C(C)(C)c2ccccc2)C1	ZINC000875164289	EE	On-Demand	Anodyne	AMY2	47	33
CS(=O)(=O)c1ccc2c(c1)CCCN2C(=O)Cc1ccc(Cl)cn1	ZINC000875164290	FF	On-Demand	Anodyne	GPR119	28	42
CS(=O)(=O)c1ccc2c(c1)CCCN2C(=O)Cc1ccc(Cl)cn1	ZINC000875164290	FF	On-Demand	Anodyne	EIF2AK3	70	34
C[C@H](NC(=O)C(=O)NCC[C@H]1CCSC1)C(C)(C)c1ccccc1	ZINC000875164317	EF	On-Demand	Anodyne	AMY2	43	31
C[C@H](NC(=O)C(=O)NCC[C@@H]1CCSC1)C(C)(C)c1ccccc1	ZINC000875164319	EF	On-Demand	Anodyne	AMY2	43	31
COCC[C@H](C)NC(=O)C(=O)N[C@@H](c1nc2ccccc2[nH]1)C1CCCCC1	ZINC000875164323	GF	On-Demand	Anodyne	MMP7	15	40
COCC[C@@H](C)NC(=O)C(=O)N[C@H](c1nc2ccccc2[nH]1)C1CCCCC1	ZINC000875164324	GF	On-Demand	Anodyne	MMP7	15	40
COCC[C@H](C)NC(=O)C(=O)N[C@H](c1nc2ccccc2[nH]1)C1CCCCC1	ZINC000875164325	GF	On-Demand	Anodyne	MMP7	15	40
COCC[C@@H](C)NC(=O)C(=O)N[C@@H](c1nc2ccccc2[nH]1)C1CCCCC1	ZINC000875164326	GF	On-Demand	Anodyne	MMP7	15	40
CC(C)[C@H]1CC[C@@H](C)C[C@H]1NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875164327	EH	On-Demand	Anodyne	TRPM8	18	59
CC(C)[C@H]1CC[C@@H](C)C[C@@H]1NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875164328	EH	On-Demand	Anodyne	TRPM8	18	59
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCc2c(C)[nH]c3ccccc23)C1	ZINC000875164384	FE	On-Demand	Anodyne	MTNR1A	21	42
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCc2c(C)[nH]c3ccccc23)C1	ZINC000875164384	FE	On-Demand	Anodyne	MTNR1B	23	42
CN(C)S(=O)(=O)c1cc(C(=O)Nc2cccc(-c3nn[nH]n3)c2)ccc1Br	ZINC000875164395	JE	On-Demand	Anodyne	KCNK3	81	36
CN(C)S(=O)(=O)c1cc(C(=O)Nc2cccc(-c3nn[nH]n3)c2)ccc1Br	ZINC000875164395	JE	On-Demand	Anodyne	KCNK9	44	34
CCCCCCCNC(=O)C(=O)N[C@H](C)c1nc2ccccc2s1	ZINC000875164404	EH	On-Demand	Mild	ST14	53	40
CCCCCCCNC(=O)C(=O)N[C@H](C)c1nc2ccccc2s1	ZINC000875164404	EH	On-Demand	Mild	ASAH1	48	36
CCCCCCCNC(=O)C(=O)N[C@H](C)c1nc2ccccc2s1	ZINC000875164404	EH	On-Demand	Mild	TMPRSS6	82	40
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1nc2ccccc2s1	ZINC000875164405	EH	On-Demand	Mild	ST14	53	40
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1nc2ccccc2s1	ZINC000875164405	EH	On-Demand	Mild	ASAH1	48	36
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1nc2ccccc2s1	ZINC000875164405	EH	On-Demand	Mild	TMPRSS6	82	40
O=C(Nc1cccc(-c2nn[nH]n2)c1)[C@H]1CC(=O)N(Cc2ccccc2Cl)C1	ZINC000875164460	GF	On-Demand	Anodyne	CCKBR	16	40
O=C(Nc1cccc(-c2nn[nH]n2)c1)[C@@H]1CC(=O)N(Cc2ccccc2Cl)C1	ZINC000875164461	GF	On-Demand	Anodyne	CCKBR	16	40
COC(=O)C1(O)CN(C(=O)NCc2ccc(Br)cc2Cl)C1	ZINC000875164508	GD	On-Demand	Anodyne	P2RX7	52	37
COC(=O)C1(O)CN(C(=O)NCc2ccc(Br)cc2Cl)C1	ZINC000875164508	GD	On-Demand	Anodyne	EPHX2	15	45
O=C(NCc1ccc(Br)cc1Cl)NC[C@H]1C[C@H](O)C1	ZINC000875164512	EF	On-Demand	Anodyne	P2RX7	44	37
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)C(C)(C)c1ccccc1	ZINC000875164529	ED	On-Demand	Mild	AMY2	54	33
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)C(C)(C)c1ccccc1	ZINC000875164530	ED	On-Demand	Mild	AMY2	54	33
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](C)C(C)(C)c1ccccc1	ZINC000875164531	ED	On-Demand	Mild	AMY2	54	33
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](C)C(C)(C)c1ccccc1	ZINC000875164532	ED	On-Demand	Mild	AMY2	54	33
COCC[C@H](C)NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875164537	ED	On-Demand	Anodyne	ACE	41	42
COCC[C@H](C)NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875164538	ED	On-Demand	Anodyne	ACE	41	42
COCC[C@H](C)NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875164539	ED	On-Demand	Anodyne	ACE	41	42
COCC[C@H](C)NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875164540	ED	On-Demand	Anodyne	ACE	41	42
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)Nc3cccc(-c4nn[nH]n4)c3)ccc2Cl)C[C@@H](C)O1	ZINC000875164541	JF	On-Demand	Anodyne	CPT1A	52	30
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)Nc3cccc(-c4nn[nH]n4)c3)ccc2Cl)C[C@@H](C)O1	ZINC000875164541	JF	On-Demand	Anodyne	CPT1B	24	44
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)Nc3cccc(-c4nn[nH]n4)c3)ccc2Cl)C[C@@H](C)O1	ZINC000875164541	JF	On-Demand	Anodyne	BRAF	28	41
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)Nc3cccc(-c4nn[nH]n4)c3)ccc2Cl)C[C@@H](C)O1	ZINC000875164541	JF	On-Demand	Anodyne	TAAR1	25	42
C[C@@H]1CN(S(=O)(=O)c2cc(C(=O)Nc3cccc(-c4nn[nH]n4)c3)ccc2Cl)C[C@@H](C)O1	ZINC000875164542	JF	On-Demand	Anodyne	CPT1A	52	30
C[C@@H]1CN(S(=O)(=O)c2cc(C(=O)Nc3cccc(-c4nn[nH]n4)c3)ccc2Cl)C[C@@H](C)O1	ZINC000875164542	JF	On-Demand	Anodyne	CPT1B	24	44
C[C@@H]1CN(S(=O)(=O)c2cc(C(=O)Nc3cccc(-c4nn[nH]n4)c3)ccc2Cl)C[C@@H](C)O1	ZINC000875164542	JF	On-Demand	Anodyne	BRAF	28	41
C[C@@H]1CN(S(=O)(=O)c2cc(C(=O)Nc3cccc(-c4nn[nH]n4)c3)ccc2Cl)C[C@@H](C)O1	ZINC000875164542	JF	On-Demand	Anodyne	TAAR1	25	42
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)Nc3cccc(-c4nn[nH]n4)c3)ccc2Cl)C[C@H](C)O1	ZINC000875164543	JF	On-Demand	Anodyne	CPT1A	52	30
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)Nc3cccc(-c4nn[nH]n4)c3)ccc2Cl)C[C@H](C)O1	ZINC000875164543	JF	On-Demand	Anodyne	CPT1B	24	44
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)Nc3cccc(-c4nn[nH]n4)c3)ccc2Cl)C[C@H](C)O1	ZINC000875164543	JF	On-Demand	Anodyne	BRAF	28	41
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)Nc3cccc(-c4nn[nH]n4)c3)ccc2Cl)C[C@H](C)O1	ZINC000875164543	JF	On-Demand	Anodyne	TAAR1	25	42
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)Nc2cccc(-c3nn[nH]n3)c2)c1	ZINC000875164561	GD	On-Demand	Anodyne	KCNK3	65	33
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)Nc2cccc(-c3nn[nH]n3)c2)c1	ZINC000875164561	GD	On-Demand	Anodyne	KCNK9	54	31
O=C(Nc1cccc(-c2nn[nH]n2)c1)C1CCN(C(=O)/C=C\c2ccccc2)CC1	ZINC000875164577	HF	On-Demand	Anodyne	CCKBR	21	42
O=C(Nc1cccc(-c2nn[nH]n2)c1)C1CCN(C(=O)/C=C/c2ccccc2)CC1	ZINC000875164578	HF	On-Demand	Anodyne	CCKBR	21	42
C[C@H](NC(=O)C(=O)NC[C@@H]1COCCN1C)c1nc2ccccc2s1	ZINC000875164590	FC	On-Demand	Anodyne	CASR	21	40
C[C@H](NC(=O)C(=O)NC[C@H]1COCCN1C)c1nc2ccccc2s1	ZINC000875164591	FC	On-Demand	Anodyne	CASR	21	40
C[C@H](NC(=O)C(=O)NCC[C@@H]1CCSC1)c1nc2ccccc2s1	ZINC000875164601	FF	On-Demand	Anodyne	TMPRSS6	40	33
C[C@H](NC(=O)C(=O)NCC[C@H]1CCSC1)c1nc2ccccc2s1	ZINC000875164602	FF	On-Demand	Anodyne	TMPRSS6	40	33
C[C@H](NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)c1nc2ccccc2s1	ZINC000875164632	FE	On-Demand	Anodyne	TMPRSS6	53	32
C[C@H](NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)c1nc2ccccc2s1	ZINC000875164633	FE	On-Demand	Anodyne	TMPRSS6	53	32
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(S(=O)(=O)N2CCOCC2)ccc1Br	ZINC000875164656	JD	On-Demand	Anodyne	AKR1C3	20	44
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(S(=O)(=O)N2CCOCC2)ccc1Br	ZINC000875164656	JD	On-Demand	Anodyne	MERTK	30	40
CCO[C@H]1COCC[C@@H]1CC(=O)N1CCCc2cc(S(C)(=O)=O)ccc21	ZINC000875164664	GE	On-Demand	Anodyne	GPR119	16	44
CCO[C@H]1COCC[C@H]1CC(=O)N1CCCc2cc(S(C)(=O)=O)ccc21	ZINC000875164665	GE	On-Demand	Anodyne	GPR119	16	44
COCC[C@@H](C)NC(=O)C(=O)NCC1(c2ccc(Br)cc2)CC1	ZINC000875164675	GE	On-Demand	Anodyne	KCNA3	44	38
COCC[C@H](C)NC(=O)C(=O)NCC1(c2ccc(Br)cc2)CC1	ZINC000875164676	GE	On-Demand	Anodyne	KCNA3	44	38
COCC[C@@H](C)NC(=O)C(=O)NC[C@H]1CN(Cc2ccccc2C)CCO1	ZINC000875164696	GC	On-Demand	Anodyne	DRD4	15	41
COCC[C@H](C)NC(=O)C(=O)NC[C@@H]1CN(Cc2ccccc2C)CCO1	ZINC000875164697	GC	On-Demand	Anodyne	DRD4	15	41
COCC[C@@H](C)NC(=O)C(=O)NC[C@@H]1CN(Cc2ccccc2C)CCO1	ZINC000875164698	GC	On-Demand	Anodyne	DRD4	15	41
COCC[C@H](C)NC(=O)C(=O)NC[C@H]1CN(Cc2ccccc2C)CCO1	ZINC000875164699	GC	On-Demand	Anodyne	DRD4	15	41
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](CC)Cc1ccccc1	ZINC000875164756	ED	On-Demand	Mild	MME	77	40
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](CC)Cc1ccccc1	ZINC000875164756	ED	On-Demand	Mild	ANPEP	52	34
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](CC)Cc1ccccc1	ZINC000875164756	ED	On-Demand	Mild	PAPA1_CARPA	44	36
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](CC)Cc1ccccc1	ZINC000875164756	ED	On-Demand	Mild	CTRB_BOVIN	54	31
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](CC)Cc1ccccc1	ZINC000875164757	ED	On-Demand	Mild	MME	77	40
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](CC)Cc1ccccc1	ZINC000875164757	ED	On-Demand	Mild	ANPEP	52	34
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](CC)Cc1ccccc1	ZINC000875164757	ED	On-Demand	Mild	PAPA1_CARPA	44	36
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](CC)Cc1ccccc1	ZINC000875164757	ED	On-Demand	Mild	CTRB_BOVIN	54	31
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H](CC)Cc1ccccc1	ZINC000875164758	ED	On-Demand	Mild	MME	77	40
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H](CC)Cc1ccccc1	ZINC000875164758	ED	On-Demand	Mild	ANPEP	52	34
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H](CC)Cc1ccccc1	ZINC000875164758	ED	On-Demand	Mild	PAPA1_CARPA	44	36
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H](CC)Cc1ccccc1	ZINC000875164758	ED	On-Demand	Mild	CTRB_BOVIN	54	31
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H](CC)Cc1ccccc1	ZINC000875164759	ED	On-Demand	Mild	MME	77	40
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H](CC)Cc1ccccc1	ZINC000875164759	ED	On-Demand	Mild	ANPEP	52	34
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H](CC)Cc1ccccc1	ZINC000875164759	ED	On-Demand	Mild	PAPA1_CARPA	44	36
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H](CC)Cc1ccccc1	ZINC000875164759	ED	On-Demand	Mild	CTRB_BOVIN	54	31
COCC(C)(C)CCNC(=O)C(=O)NCCc1c(C)[nH]c2ccccc12	ZINC000875164764	FE	On-Demand	Anodyne	MTNR1A	15	42
COCC(C)(C)CCNC(=O)C(=O)NCCc1c(C)[nH]c2ccccc12	ZINC000875164764	FE	On-Demand	Anodyne	MTNR1B	16	42
N#Cc1ccc(CNC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)c(F)c1	ZINC000875164788	ED	On-Demand	Mild	P2RX7	15	40
CCC[C@H](CNC(=O)C(=O)N[C@H](C)c1nc2ccccc2s1)OCC	ZINC000875164817	FF	On-Demand	Anodyne	ST14	40	35
CCC[C@H](CNC(=O)C(=O)N[C@H](C)c1nc2ccccc2s1)OCC	ZINC000875164817	FF	On-Demand	Anodyne	TMPRSS6	56	35
CCC[C@@H](CNC(=O)C(=O)N[C@H](C)c1nc2ccccc2s1)OCC	ZINC000875164818	FF	On-Demand	Anodyne	ST14	40	35
CCC[C@@H](CNC(=O)C(=O)N[C@H](C)c1nc2ccccc2s1)OCC	ZINC000875164818	FF	On-Demand	Anodyne	TMPRSS6	56	35
CCC[C@H](CNC(=O)C(=O)N[C@@H](C)c1nc2ccccc2s1)OCC	ZINC000875164819	FF	On-Demand	Anodyne	ST14	40	35
CCC[C@H](CNC(=O)C(=O)N[C@@H](C)c1nc2ccccc2s1)OCC	ZINC000875164819	FF	On-Demand	Anodyne	TMPRSS6	56	35
CCC[C@@H](CNC(=O)C(=O)N[C@@H](C)c1nc2ccccc2s1)OCC	ZINC000875164820	FF	On-Demand	Anodyne	ST14	40	35
CCC[C@@H](CNC(=O)C(=O)N[C@@H](C)c1nc2ccccc2s1)OCC	ZINC000875164820	FF	On-Demand	Anodyne	TMPRSS6	56	35
C[C@H](NC(=O)C(=O)NCC[C@H]1CC=CCC1)c1nc2ccccc2s1	ZINC000875164831	FG	On-Demand	Anodyne	TMPRSS6	44	33
C[C@H](NC(=O)C(=O)NCC[C@@H]1CC=CCC1)c1nc2ccccc2s1	ZINC000875164833	FG	On-Demand	Anodyne	TMPRSS6	44	33
N#CCc1ccsc1C(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F	ZINC000875164837	GH	On-Demand	Mild	COLA	108	38
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](CC)Cc1ccccc1	ZINC000875164840	DD	On-Demand	Mild	MME	66	41
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](CC)Cc1ccccc1	ZINC000875164840	DD	On-Demand	Mild	PAPA1_CARPA	52	37
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](CC)Cc1ccccc1	ZINC000875164840	DD	On-Demand	Mild	CAPNS1	48	33
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](CC)Cc1ccccc1	ZINC000875164840	DD	On-Demand	Mild	CAPN2	46	33
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](CC)Cc1ccccc1	ZINC000875164840	DD	On-Demand	Mild	ACE2	48	38
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](CC)Cc1ccccc1	ZINC000875164840	DD	On-Demand	Mild	CTSC	26	40
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](CC)Cc1ccccc1	ZINC000875164841	DD	On-Demand	Mild	MME	66	41
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](CC)Cc1ccccc1	ZINC000875164841	DD	On-Demand	Mild	PAPA1_CARPA	52	37
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](CC)Cc1ccccc1	ZINC000875164841	DD	On-Demand	Mild	CAPNS1	48	33
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](CC)Cc1ccccc1	ZINC000875164841	DD	On-Demand	Mild	CAPN2	46	33
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](CC)Cc1ccccc1	ZINC000875164841	DD	On-Demand	Mild	ACE2	48	38
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](CC)Cc1ccccc1	ZINC000875164841	DD	On-Demand	Mild	CTSC	26	40
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](CC)Cc1ccccc1	ZINC000875164842	DD	On-Demand	Mild	MME	66	41
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](CC)Cc1ccccc1	ZINC000875164842	DD	On-Demand	Mild	PAPA1_CARPA	52	37
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](CC)Cc1ccccc1	ZINC000875164842	DD	On-Demand	Mild	CAPNS1	48	33
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](CC)Cc1ccccc1	ZINC000875164842	DD	On-Demand	Mild	CAPN2	46	33
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](CC)Cc1ccccc1	ZINC000875164842	DD	On-Demand	Mild	ACE2	48	38
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](CC)Cc1ccccc1	ZINC000875164842	DD	On-Demand	Mild	CTSC	26	40
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](CC)Cc1ccccc1	ZINC000875164843	DD	On-Demand	Mild	MME	66	41
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](CC)Cc1ccccc1	ZINC000875164843	DD	On-Demand	Mild	PAPA1_CARPA	52	37
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](CC)Cc1ccccc1	ZINC000875164843	DD	On-Demand	Mild	CAPNS1	48	33
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](CC)Cc1ccccc1	ZINC000875164843	DD	On-Demand	Mild	CAPN2	46	33
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](CC)Cc1ccccc1	ZINC000875164843	DD	On-Demand	Mild	ACE2	48	38
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](CC)Cc1ccccc1	ZINC000875164843	DD	On-Demand	Mild	CTSC	26	40
COCC[C@H](C)NC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875164873	GC	On-Demand	Clean	DRD2	33	43
COCC[C@H](C)NC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875164873	GC	On-Demand	Clean	DRD4	42	33
COCC[C@H](C)NC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875164873	GC	On-Demand	Clean	DRD3	49	38
COCC[C@@H](C)NC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875164874	GC	On-Demand	Clean	DRD2	33	43
COCC[C@@H](C)NC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875164874	GC	On-Demand	Clean	DRD4	42	33
COCC[C@@H](C)NC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875164874	GC	On-Demand	Clean	DRD3	49	38
CCOC(=O)[C@@H]1CC[C@H](C(=O)N2CCCc3cc(S(C)(=O)=O)ccc32)C1	ZINC000875164875	GE	On-Demand	Anodyne	GPR119	35	49
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(CS(=O)(=O)c2ccccc2)o1	ZINC000875164891	HF	On-Demand	Anodyne	KCNK3	40	34
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](C)C(C)(C)c1ccccc1	ZINC000875164900	EE	On-Demand	Mild	AMY2	56	34
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](C)C(C)(C)c1ccccc1	ZINC000875164901	EE	On-Demand	Mild	AMY2	56	34
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H](C)C(C)(C)c1ccccc1	ZINC000875164902	EE	On-Demand	Mild	AMY2	56	34
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H](C)C(C)(C)c1ccccc1	ZINC000875164903	EE	On-Demand	Mild	AMY2	56	34
O=C(NCc1ccc(Br)cc1Cl)N1CCC(CO)(CO)CC1	ZINC000875164907	GE	On-Demand	Anodyne	P2RX7	40	37
O=C(NCc1ccc(Br)cc1Cl)N1CCC(CO)(CO)CC1	ZINC000875164907	GE	On-Demand	Anodyne	EPHX2	17	56
CC[C@]1(C(=O)Nc2nc(-c3c(F)cccc3F)cs2)CCNC1=O	ZINC000875164910	FF	On-Demand	Anodyne	ROCK1	19	40
C#CC[C@@H](COC)NC(=O)C(=O)NCC1(c2ccccc2OC)CC1	ZINC000875164912	EC	On-Demand	Mild	KCNA3	40	35
C#CC[C@H](COC)NC(=O)C(=O)NCC1(c2ccccc2OC)CC1	ZINC000875164913	EC	On-Demand	Mild	KCNA3	40	35
C[C@@H](CC(=O)N1CCCc2cc(S(C)(=O)=O)ccc21)NC(=O)OC(C)(C)C	ZINC000875164934	GF	On-Demand	Anodyne	GPR119	33	51
CC(=O)C1CCN(C(=O)C(=O)NCCc2c(C)[nH]c3ccccc23)CC1	ZINC000875164986	FD	On-Demand	Anodyne	MTNR1A	21	42
CC(=O)C1CCN(C(=O)C(=O)NCCc2c(C)[nH]c3ccccc23)CC1	ZINC000875164986	FD	On-Demand	Anodyne	MTNR1B	22	42
CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2cccc(-c3nn[nH]n3)c2)CC1	ZINC000875165016	HG	On-Demand	Bother	TAAR1	35	49
CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2cccc(-c3nn[nH]n3)c2)CC1	ZINC000875165016	HG	On-Demand	Bother	WDR5	33	41
Cc1ccc([C@]2(C)NC(=O)N(CC(=O)Nc3cccc(-c4nn[nH]n4)c3)C2=O)cc1	ZINC000875165053	HD	On-Demand	Anodyne	CCKBR	17	49
Cc1nc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)nc2ccccc12	ZINC000875165065	GE	On-Demand	Anodyne	ACHE	15	41
Cc1nc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)nc2ccccc12	ZINC000875165065	GE	On-Demand	Anodyne	SIRT3	43	32
Cc1nc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)nc2ccccc12	ZINC000875165065	GE	On-Demand	Anodyne	SIRT2	45	32
Cc1nc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)nc2ccccc12	ZINC000875165065	GE	On-Demand	Anodyne	SIRT1	45	33
COCC[C@@H](C)NC(=O)C(=O)NC[C@H]1CN(Cc2cccc(C)c2)CCO1	ZINC000875165092	GC	On-Demand	Anodyne	DRD4	31	41
COCC[C@H](C)NC(=O)C(=O)NC[C@@H]1CN(Cc2cccc(C)c2)CCO1	ZINC000875165094	GC	On-Demand	Anodyne	DRD4	31	41
COCC[C@@H](C)NC(=O)C(=O)NC[C@@H]1CN(Cc2cccc(C)c2)CCO1	ZINC000875165095	GC	On-Demand	Anodyne	DRD4	31	41
COCC[C@H](C)NC(=O)C(=O)NC[C@H]1CN(Cc2cccc(C)c2)CCO1	ZINC000875165097	GC	On-Demand	Anodyne	DRD4	31	41
CS(=O)(=O)c1ccc2c(c1)CCCN2C(=O)[C@H]1CCC(=O)O1	ZINC000875165115	DD	On-Demand	Anodyne	GPR119	22	43
C[C@H](NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1)C(C)(C)c1ccccc1	ZINC000875165119	FF	On-Demand	Anodyne	AMY2	47	34
COCC[C@@H](C)NC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1C	ZINC000875165128	FD	On-Demand	Anodyne	SLC18A2	56	40
COCC[C@@H](C)NC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1C	ZINC000875165129	FD	On-Demand	Anodyne	SLC18A2	56	40
COCC[C@H](C)NC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1C	ZINC000875165130	FD	On-Demand	Anodyne	SLC18A2	56	40
COCC[C@H](C)NC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1C	ZINC000875165131	FD	On-Demand	Anodyne	SLC18A2	56	40
CCO[C@H](C(=O)N1CCCc2cc(S(C)(=O)=O)ccc21)[C@@H]1CCOC1	ZINC000875165139	FD	On-Demand	Anodyne	GPR119	31	48
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)C(=O)NCC[C@@H]2CC=CCC2)C1	ZINC000875165141	GE	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)C(=O)NCC[C@H]2CC=CCC2)C1	ZINC000875165142	GE	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)C(=O)NCC[C@@H]2CC=CCC2)C1	ZINC000875165143	GE	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)C(=O)NCC[C@H]2CC=CCC2)C1	ZINC000875165144	GE	On-Demand	Anodyne	CACNA1I	41	32
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	ZINC000875165145	IF	On-Demand	Anodyne	CPT1A	18	47
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	ZINC000875165145	IF	On-Demand	Anodyne	AKR1C3	32	46
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	ZINC000875165145	IF	On-Demand	Anodyne	NR2E3	61	33
CCO[C@@H](C(=O)N1CCCc2cc(S(C)(=O)=O)ccc21)[C@@H]1CCOC1	ZINC000875165150	FD	On-Demand	Anodyne	GPR119	31	48
CCO[C@@H](C(=O)N1CCCc2cc(S(C)(=O)=O)ccc21)[C@H]1CCOC1	ZINC000875165151	FD	On-Demand	Anodyne	GPR119	31	48
CCO[C@H](C(=O)N1CCCc2cc(S(C)(=O)=O)ccc21)[C@H]1CCOC1	ZINC000875165153	FD	On-Demand	Anodyne	GPR119	31	48
CC(C)n1ncc(C(=O)N2CCCc3cc(S(C)(=O)=O)ccc32)c1Cl	ZINC000875165161	GG	On-Demand	Anodyne	AVPR2	17	40
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875165173	FD	On-Demand	Anodyne	DRD2	17	50
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875165173	FD	On-Demand	Anodyne	DRD4	45	50
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875165173	FD	On-Demand	Anodyne	ACHE	46	47
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875165173	FD	On-Demand	Anodyne	DRD3	15	50
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875165173	FD	On-Demand	Anodyne	HTR4	51	47
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875165173	FD	On-Demand	Anodyne	GRIN2B	51	35
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875165173	FD	On-Demand	Anodyne	SIGMAR1	48	50
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875165173	FD	On-Demand	Anodyne	CCR3	42	42
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875165173	FD	On-Demand	Anodyne	CCR5	23	42
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875165173	FD	On-Demand	Anodyne	CACNA1G	29	42
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875165173	FD	On-Demand	Anodyne	CACNA1I	63	38
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875165175	FD	On-Demand	Anodyne	DRD2	17	50
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875165175	FD	On-Demand	Anodyne	DRD4	45	50
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875165175	FD	On-Demand	Anodyne	ACHE	46	47
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875165175	FD	On-Demand	Anodyne	DRD3	15	50
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875165175	FD	On-Demand	Anodyne	HTR4	51	47
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875165175	FD	On-Demand	Anodyne	GRIN2B	51	35
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875165175	FD	On-Demand	Anodyne	SIGMAR1	48	50
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875165175	FD	On-Demand	Anodyne	CCR3	42	42
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875165175	FD	On-Demand	Anodyne	CCR5	23	42
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875165175	FD	On-Demand	Anodyne	CACNA1G	29	42
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875165175	FD	On-Demand	Anodyne	CACNA1I	63	38
COC(=O)c1ccc(CC(=O)N2CCCc3cc(S(C)(=O)=O)ccc32)cn1	ZINC000875165178	GD	On-Demand	Anodyne	GPR119	23	42
COC(=O)c1ccc(CC(=O)N2CCCc3cc(S(C)(=O)=O)ccc32)cn1	ZINC000875165178	GD	On-Demand	Anodyne	EIF2AK3	66	35
CS(=O)(=O)c1ccc2c(c1)CCCN2C(=O)COCc1ccnc(O)c1	ZINC000875165192	GD	On-Demand	Anodyne	GPR119	18	43
CC(=O)C1CCN(C(=O)C(=O)NCc2ccccc2-c2ccc(Cl)cc2)CC1	ZINC000875165207	GG	On-Demand	Anodyne	EPHX2	22	40
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(S(=O)(=O)N2CCc3ccccc3C2)ccc1Cl	ZINC000875165208	JH	On-Demand	Anodyne	AVPR2	43	34
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(S(=O)(=O)N2CCc3ccccc3C2)ccc1Cl	ZINC000875165208	JH	On-Demand	Anodyne	CPT1A	15	42
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(S(=O)(=O)N2CCc3ccccc3C2)ccc1Cl	ZINC000875165208	JH	On-Demand	Anodyne	AKR1C3	72	57
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(S(=O)(=O)N2CCc3ccccc3C2)ccc1Cl	ZINC000875165208	JH	On-Demand	Anodyne	NR2E3	43	30
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(Br)c(S(=O)(=O)N2CCOCC2)c1	ZINC000875165209	JD	On-Demand	Anodyne	NR1H4	25	41
COc1ccc(N2CCC(NC(=O)C(=O)NCc3cccnc3C)CC2)cc1	ZINC000875165217	GD	On-Demand	Clean	F10	16	45
O=C(CCN1c2ccccc2Sc2ccccc21)Nc1cccc(-c2nn[nH]n2)c1	ZINC000875165218	HI	On-Demand	Anodyne	CCKBR	27	40
O=C(NC[C@H]1CCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875165232	GC	On-Demand	Anodyne	CHRM2	15	40
O=C(NC[C@H]1CCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875165232	GC	On-Demand	Anodyne	DRD4	40	49
O=C(NC[C@H]1CCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875165232	GC	On-Demand	Anodyne	ACHE	46	47
O=C(NC[C@H]1CCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875165232	GC	On-Demand	Anodyne	HTR4	40	43
O=C(NC[C@H]1CCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875165232	GC	On-Demand	Anodyne	CHRM3	16	40
O=C(NC[C@H]1CCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875165232	GC	On-Demand	Anodyne	SIGMAR1	59	44
O=C(NC[C@H]1CCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875165232	GC	On-Demand	Anodyne	CCR3	32	42
O=C(NC[C@H]1CCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875165232	GC	On-Demand	Anodyne	CACNA1I	58	37
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875165233	GC	On-Demand	Anodyne	CHRM2	15	40
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875165233	GC	On-Demand	Anodyne	DRD4	40	49
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875165233	GC	On-Demand	Anodyne	ACHE	46	47
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875165233	GC	On-Demand	Anodyne	HTR4	40	43
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875165233	GC	On-Demand	Anodyne	CHRM3	16	40
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875165233	GC	On-Demand	Anodyne	SIGMAR1	59	44
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875165233	GC	On-Demand	Anodyne	CCR3	32	42
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875165233	GC	On-Demand	Anodyne	CACNA1I	58	37
COCC(C)(C)CCNC(=O)C(=O)N[C@H](C)c1nc2ccccc2s1	ZINC000875165254	FF	On-Demand	Anodyne	TMPRSS6	45	34
COCC(C)(C)CCNC(=O)C(=O)N[C@@H](C)c1nc2ccccc2s1	ZINC000875165255	FF	On-Demand	Anodyne	TMPRSS6	45	34
COc1ccccc1[C@@H]1[C@H](C(=O)Nc2cccc(-c3nn[nH]n3)c2)CCC(=O)N1c1ccc(C)cc1	ZINC000875165305	JI	On-Demand	Anodyne	CCKBR	15	41
COc1ccccc1[C@@H]1[C@@H](C(=O)Nc2cccc(-c3nn[nH]n3)c2)CCC(=O)N1c1ccc(C)cc1	ZINC000875165307	JI	On-Demand	Anodyne	CCKBR	15	41
C[C@H](NC(=O)C(=O)NCCC[C@H]1C=CCC1)c1nc2ccccc2s1	ZINC000875165308	FG	On-Demand	Anodyne	ST14	48	36
C[C@H](NC(=O)C(=O)NCCC[C@H]1C=CCC1)c1nc2ccccc2s1	ZINC000875165308	FG	On-Demand	Anodyne	TMPRSS6	66	36
C[C@H](NC(=O)C(=O)NCCC[C@@H]1C=CCC1)c1nc2ccccc2s1	ZINC000875165310	FG	On-Demand	Anodyne	ST14	48	36
C[C@H](NC(=O)C(=O)NCCC[C@@H]1C=CCC1)c1nc2ccccc2s1	ZINC000875165310	FG	On-Demand	Anodyne	TMPRSS6	66	36
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(C#N)cc2F)CC1	ZINC000875165343	ED	On-Demand	Mild	EPHX2	19	41
COc1ccc(N2CCC(NC(=O)C(=O)NCc3ccc(C)o3)CC2)cc1	ZINC000875165358	FD	On-Demand	Clean	PDK1	41	35
CCOC1CC2(C1)C[C@H]2C(=O)N1CCCc2cc(S(C)(=O)=O)ccc21	ZINC000875165363	FF	On-Demand	Anodyne	GPR119	25	42
C=C1c2ccccc2C(=O)N1[C@@H](C)C(=O)Nc1ncc(Cc2ccc(C)c(Cl)c2)s1	ZINC000875165367	IK	On-Demand	Anodyne	SCD1	34	40
C=C1c2ccccc2C(=O)N1[C@@H](C)C(=O)Nc1ncc(Cc2ccc(C)c(Cl)c2)s1	ZINC000875165367	IK	On-Demand	Anodyne	SCD	29	40
C=C1c2ccccc2C(=O)N1[C@H](C)C(=O)Nc1ncc(Cc2ccc(C)c(Cl)c2)s1	ZINC000875165368	IK	On-Demand	Anodyne	SCD1	34	40
C=C1c2ccccc2C(=O)N1[C@H](C)C(=O)Nc1ncc(Cc2ccc(C)c(Cl)c2)s1	ZINC000875165368	IK	On-Demand	Anodyne	SCD	29	40
NC(=O)CCOC(=O)CNC(=O)Nc1ccccc1	ZINC000875165370	CC	On-Demand	Anodyne	F7	25	43
NC(=O)c1cccc(CCNC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)c1	ZINC000875165377	EC	On-Demand	Anodyne	TRY2_BOVIN	49	30
CCC[C@H](CC)C(=O)N1CCCc2cc(S(C)(=O)=O)ccc21	ZINC000875165433	DG	On-Demand	Anodyne	GPR119	15	44
COC(=O)[C@@]12C[C@@H](NC(=O)NC[C@@H]3CCN(c4ccc(Cl)cc4)C3)C[C@@H]1C2	ZINC000875165443	GF	On-Demand	Anodyne	CACNA1I	44	32
COC(=O)[C@@]12C[C@@H](NC(=O)NC[C@H]3CCN(c4ccc(Cl)cc4)C3)C[C@@H]1C2	ZINC000875165445	GF	On-Demand	Anodyne	CACNA1I	44	32
COCC[C@@H](C)NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875165471	FD	On-Demand	Anodyne	ETHR	61	48
COCC[C@H](C)NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875165483	FD	On-Demand	Anodyne	ETHR	61	48
O=C(NC[C@@H]1CCN(c2ccc(Cl)cc2)C1)N1CCC(CO)(CO)CC1	ZINC000875165541	GD	On-Demand	Anodyne	CACNA1I	44	33
O=C(NC[C@H]1CCN(c2ccc(Cl)cc2)C1)N1CCC(CO)(CO)CC1	ZINC000875165542	GD	On-Demand	Anodyne	CACNA1I	44	33
CN1CCN(C2CCN(C(=O)C(=O)NCc3ccc(C#N)cc3F)CC2)CC1	ZINC000875165564	GC	On-Demand	Mild	L3MBTL3	41	37
C[C@H](NC(=O)C(=O)NCC[C@H]1CCCOC1)c1nc2ccccc2s1	ZINC000875165579	FE	On-Demand	Anodyne	TMPRSS6	45	32
C[C@H](NC(=O)C(=O)NCC[C@@H]1CCCOC1)c1nc2ccccc2s1	ZINC000875165580	FE	On-Demand	Anodyne	TMPRSS6	45	32
Cn1nc(Cl)c(C(=O)N2C[C@@H]3CCCN3c3ccccc32)c1Cl	ZINC000875165598	FG	On-Demand	Anodyne	GPBAR1	43	38
Cn1nc(Cl)c(C(=O)N2C[C@H]3CCCN3c3ccccc32)c1Cl	ZINC000875165599	FG	On-Demand	Anodyne	GPBAR1	43	38
O=C(/C=C\c1cc(C(F)(F)F)ccc1Cl)Nc1cccc(-c2nn[nH]n2)c1	ZINC000875165600	GI	On-Demand	Anodyne	RIPK1	43	37
O=C(/C=C/c1cc(C(F)(F)F)ccc1Cl)Nc1cccc(-c2nn[nH]n2)c1	ZINC000875165601	GI	On-Demand	Anodyne	RIPK1	43	37
C[C@H](NC(=O)C(=O)NCCCCC1CC1)c1nc2ccccc2s1	ZINC000875165615	EG	On-Demand	Anodyne	TPSAB1	15	40
C[C@H](NC(=O)C(=O)NCCCCC1CC1)c1nc2ccccc2s1	ZINC000875165615	EG	On-Demand	Anodyne	ST14	51	38
C[C@H](NC(=O)C(=O)NCCCCC1CC1)c1nc2ccccc2s1	ZINC000875165615	EG	On-Demand	Anodyne	TMPRSS6	71	38
N#CCSc1ccccc1C(=O)Nc1cccc(-c2nn[nH]n2)c1	ZINC000875165639	EF	On-Demand	Mild	NR2E3	44	32
N#CCSc1ccccc1C(=O)Nc1cccc(-c2nn[nH]n2)c1	ZINC000875165639	EF	On-Demand	Mild	KCNK3	82	36
N#CCSc1ccccc1C(=O)Nc1cccc(-c2nn[nH]n2)c1	ZINC000875165639	EF	On-Demand	Mild	KCNK9	64	34
C=CC(C)(C)CCNC(=O)C(=O)N[C@H](C)c1nc2ccccc2s1	ZINC000875165644	EG	On-Demand	Mild	ST14	40	37
C=CC(C)(C)CCNC(=O)C(=O)N[C@H](C)c1nc2ccccc2s1	ZINC000875165644	EG	On-Demand	Mild	TMPRSS6	57	37
C=CC(C)(C)CCNC(=O)C(=O)N[C@@H](C)c1nc2ccccc2s1	ZINC000875165645	EG	On-Demand	Mild	ST14	40	37
C=CC(C)(C)CCNC(=O)C(=O)N[C@@H](C)c1nc2ccccc2s1	ZINC000875165645	EG	On-Demand	Mild	TMPRSS6	57	37
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)C(=O)N2CCO[C@@H](CCF)C2)C1	ZINC000875165669	GC	On-Demand	Anodyne	CACNA1I	40	32
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)C(=O)N2CCO[C@@H](CCF)C2)C1	ZINC000875165670	GC	On-Demand	Anodyne	CACNA1I	40	32
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)C(=O)N2CCO[C@H](CCF)C2)C1	ZINC000875165671	GC	On-Demand	Anodyne	CACNA1I	40	32
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)C(=O)N2CCO[C@H](CCF)C2)C1	ZINC000875165672	GC	On-Demand	Anodyne	CACNA1I	40	32
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cccc(-c3nn[nH]n3)c2)ccc1F	ZINC000875165679	HE	On-Demand	Anodyne	CPT1A	45	32
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cccc(-c3nn[nH]n3)c2)ccc1F	ZINC000875165679	HE	On-Demand	Anodyne	TAAR1	25	41
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cccc(-c3nn[nH]n3)c2)ccc1F	ZINC000875165679	HE	On-Demand	Anodyne	KCNK3	77	36
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cccc(-c3nn[nH]n3)c2)ccc1F	ZINC000875165679	HE	On-Demand	Anodyne	KCNK9	44	34
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875165706	ED	On-Demand	Anodyne	DRD2	15	47
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875165706	ED	On-Demand	Anodyne	DRD4	36	47
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875165706	ED	On-Demand	Anodyne	ACHE	44	43
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875165706	ED	On-Demand	Anodyne	HTR4	39	41
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875165706	ED	On-Demand	Anodyne	SIGMAR1	52	43
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875165706	ED	On-Demand	Anodyne	CCR3	32	42
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875165706	ED	On-Demand	Anodyne	CACNA1G	15	43
O=C(NC[C@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875165707	ED	On-Demand	Anodyne	DRD2	15	47
O=C(NC[C@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875165707	ED	On-Demand	Anodyne	DRD4	36	47
O=C(NC[C@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875165707	ED	On-Demand	Anodyne	ACHE	44	43
O=C(NC[C@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875165707	ED	On-Demand	Anodyne	HTR4	39	41
O=C(NC[C@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875165707	ED	On-Demand	Anodyne	SIGMAR1	52	43
O=C(NC[C@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875165707	ED	On-Demand	Anodyne	CCR3	32	42
O=C(NC[C@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875165707	ED	On-Demand	Anodyne	CACNA1G	15	43
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875165708	ED	On-Demand	Anodyne	DRD2	15	47
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875165708	ED	On-Demand	Anodyne	DRD4	36	47
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875165708	ED	On-Demand	Anodyne	ACHE	44	43
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875165708	ED	On-Demand	Anodyne	HTR4	39	41
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875165708	ED	On-Demand	Anodyne	SIGMAR1	52	43
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875165708	ED	On-Demand	Anodyne	CCR3	32	42
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875165708	ED	On-Demand	Anodyne	CACNA1G	15	43
O=C(NC[C@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875165709	ED	On-Demand	Anodyne	DRD2	15	47
O=C(NC[C@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875165709	ED	On-Demand	Anodyne	DRD4	36	47
O=C(NC[C@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875165709	ED	On-Demand	Anodyne	ACHE	44	43
O=C(NC[C@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875165709	ED	On-Demand	Anodyne	HTR4	39	41
O=C(NC[C@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875165709	ED	On-Demand	Anodyne	SIGMAR1	52	43
O=C(NC[C@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875165709	ED	On-Demand	Anodyne	CCR3	32	42
O=C(NC[C@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@H]1CC12CCC2	ZINC000875165709	ED	On-Demand	Anodyne	CACNA1G	15	43
N#CCc1ccsc1C(=O)N1CCCCc2ccccc21	ZINC000875165723	CH	On-Demand	Mild	AVPR2	65	48
C[C@H](NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)C(C)(C)c1ccccc1	ZINC000875165733	EE	On-Demand	Anodyne	AMY2	47	33
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875165734	GC	On-Demand	Anodyne	CACNA1I	47	35
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875165735	GC	On-Demand	Anodyne	CACNA1I	47	35
C[C@H](NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)C(C)(C)c1ccccc1	ZINC000875165736	EE	On-Demand	Anodyne	AMY2	47	33
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875165737	GC	On-Demand	Anodyne	CACNA1I	47	35
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875165738	GC	On-Demand	Anodyne	CACNA1I	47	35
Cc1csc2nc(CC(=O)N3CCCc4cc(S(C)(=O)=O)ccc43)cn12	ZINC000875165743	GF	On-Demand	Anodyne	EIF2AK3	48	34
O=C(CCCOC1CCOCC1)Nc1nc(-c2c(F)cccc2F)cs1	ZINC000875165759	GI	On-Demand	Anodyne	HDAC9	15	46
COCC[C@@H](C)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875165760	ED	On-Demand	Anodyne	ROCK1	26	45
COCC[C@@H](C)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875165760	ED	On-Demand	Anodyne	ROCK2	19	45
COCC[C@H](C)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875165761	ED	On-Demand	Anodyne	ROCK1	26	45
COCC[C@H](C)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875165761	ED	On-Demand	Anodyne	ROCK2	19	45
CS(=O)(=O)c1ccc2c(c1)CCCN2C(=O)Cc1cn2cc(F)ccc2n1	ZINC000875165787	GE	On-Demand	Anodyne	GPR119	17	43
CS(=O)(=O)c1ccc2c(c1)CCCN2C(=O)Cc1cn2cc(F)ccc2n1	ZINC000875165787	GE	On-Demand	Anodyne	EIF2AK3	63	35
CS(=O)(=O)c1ccc2c(c1)CCCN2C(=O)CC(F)(F)C(F)(F)F	ZINC000875165791	FF	On-Demand	Anodyne	GPR119	17	46
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875165796	FC	On-Demand	Mild	DRD4	42	32
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875165796	FC	On-Demand	Mild	MTNR1A	20	56
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875165796	FC	On-Demand	Mild	MTNR1B	24	56
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875165797	FC	On-Demand	Mild	DRD4	42	32
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875165797	FC	On-Demand	Mild	MTNR1A	20	56
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875165797	FC	On-Demand	Mild	MTNR1B	24	56
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875165798	FC	On-Demand	Mild	DRD4	42	32
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875165798	FC	On-Demand	Mild	MTNR1A	20	56
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875165798	FC	On-Demand	Mild	MTNR1B	24	56
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875165799	FC	On-Demand	Mild	DRD4	42	32
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875165799	FC	On-Demand	Mild	MTNR1A	20	56
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875165799	FC	On-Demand	Mild	MTNR1B	24	56
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000875165800	EE	On-Demand	Anodyne	CACNA1I	56	36
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000875165802	EE	On-Demand	Anodyne	CACNA1I	56	36
CCO[C@@H](C(=O)N1CCCc2cc(S(C)(=O)=O)ccc21)C1CCOCC1	ZINC000875165816	GE	On-Demand	Anodyne	GPR119	34	47
CCO[C@H](C(=O)N1CCCc2cc(S(C)(=O)=O)ccc21)C1CCOCC1	ZINC000875165818	GE	On-Demand	Anodyne	GPR119	34	47
COCC[C@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875165826	GD	On-Demand	Anodyne	CHRM2	23	40
COCC[C@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875165826	GD	On-Demand	Anodyne	DRD2	35	52
COCC[C@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875165826	GD	On-Demand	Anodyne	DRD4	56	52
COCC[C@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875165826	GD	On-Demand	Anodyne	ACHE	67	60
COCC[C@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875165826	GD	On-Demand	Anodyne	HRH1	16	42
COCC[C@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875165826	GD	On-Demand	Anodyne	DRD3	31	52
COCC[C@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875165826	GD	On-Demand	Anodyne	SLC6A3	30	48
COCC[C@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875165826	GD	On-Demand	Anodyne	HTR4	75	52
COCC[C@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875165826	GD	On-Demand	Anodyne	LTA4H	19	41
COCC[C@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875165826	GD	On-Demand	Anodyne	SIGMAR1	60	48
COCC[C@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875165826	GD	On-Demand	Anodyne	BCHE	20	53
COCC[C@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875165826	GD	On-Demand	Anodyne	CCR3	40	39
COCC[C@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875165826	GD	On-Demand	Anodyne	CAPN2	43	36
COCC[C@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875165826	GD	On-Demand	Anodyne	MCHR1	39	45
COCC[C@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875165826	GD	On-Demand	Anodyne	CACNA1G	35	40
COCC[C@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875165826	GD	On-Demand	Anodyne	CACNA1I	64	41
COCC[C@@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875165827	GD	On-Demand	Anodyne	CHRM2	23	40
COCC[C@@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875165827	GD	On-Demand	Anodyne	DRD2	35	52
COCC[C@@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875165827	GD	On-Demand	Anodyne	DRD4	56	52
COCC[C@@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875165827	GD	On-Demand	Anodyne	ACHE	67	60
COCC[C@@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875165827	GD	On-Demand	Anodyne	HRH1	16	42
COCC[C@@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875165827	GD	On-Demand	Anodyne	DRD3	31	52
COCC[C@@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875165827	GD	On-Demand	Anodyne	SLC6A3	30	48
COCC[C@@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875165827	GD	On-Demand	Anodyne	HTR4	75	52
COCC[C@@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875165827	GD	On-Demand	Anodyne	LTA4H	19	41
COCC[C@@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875165827	GD	On-Demand	Anodyne	SIGMAR1	60	48
COCC[C@@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875165827	GD	On-Demand	Anodyne	BCHE	20	53
COCC[C@@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875165827	GD	On-Demand	Anodyne	CCR3	40	39
COCC[C@@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875165827	GD	On-Demand	Anodyne	CAPN2	43	36
COCC[C@@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875165827	GD	On-Demand	Anodyne	MCHR1	39	45
COCC[C@@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875165827	GD	On-Demand	Anodyne	CACNA1G	35	40
COCC[C@@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875165827	GD	On-Demand	Anodyne	CACNA1I	64	41
CS(=O)(=O)c1ccc2c(c1)CCCN2C(=O)c1coc(C#N)c1	ZINC000875165828	EE	On-Demand	Mild	AVPR2	24	42
C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C(=O)N1CCCc2cc(S(C)(=O)=O)ccc21	ZINC000875165843	EF	On-Demand	Anodyne	GPR119	20	44
C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C(=O)N1CCCc2cc(S(C)(=O)=O)ccc21	ZINC000875165845	EF	On-Demand	Anodyne	GPR119	20	44
C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C(=O)N1CCCc2cc(S(C)(=O)=O)ccc21	ZINC000875165848	EF	On-Demand	Anodyne	GPR119	20	44
COC(=O)c1c(NC(=O)COCc2ccnc(O)c2)sc2c1CCCCC2	ZINC000875165958	GG	On-Demand	Anodyne	VIPR1	25	40
COCC(C)(C)CCNC(=O)C(=O)NC1CCN(c2ccc(OC)cc2)CC1	ZINC000875165999	GD	On-Demand	Clean	DRD4	44	37
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000875166004	IE	On-Demand	Anodyne	CPT1A	61	46
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000875166004	IE	On-Demand	Anodyne	CPT1B	25	46
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000875166004	IE	On-Demand	Anodyne	RPS6KA3	38	40
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000875166004	IE	On-Demand	Anodyne	TAAR1	37	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(C(=O)OC(C)(C)C)C2)C1	ZINC000875166011	GD	On-Demand	Anodyne	CACNA1I	41	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)C1	ZINC000875166012	GD	On-Demand	Anodyne	CACNA1I	41	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(C(=O)OC(C)(C)C)C2)C1	ZINC000875166013	GD	On-Demand	Anodyne	CACNA1I	41	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)C1	ZINC000875166014	GD	On-Demand	Anodyne	CACNA1I	41	33
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166021	FD	On-Demand	Anodyne	DRD4	36	51
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166021	FD	On-Demand	Anodyne	ACHE	46	46
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166021	FD	On-Demand	Anodyne	HTR4	61	44
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166021	FD	On-Demand	Anodyne	SIGMAR1	45	43
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166021	FD	On-Demand	Anodyne	CACNA1I	60	38
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166022	FD	On-Demand	Anodyne	DRD4	36	51
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166022	FD	On-Demand	Anodyne	ACHE	46	46
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166022	FD	On-Demand	Anodyne	HTR4	61	44
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166022	FD	On-Demand	Anodyne	SIGMAR1	45	43
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166022	FD	On-Demand	Anodyne	CACNA1I	60	38
Cc1nc(CNC(=O)C(=O)NC2CCC(C)(N(C)C)CC2)nc2ccccc12	ZINC000875166027	GD	On-Demand	Anodyne	TNKS	50	31
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2nc(C)c3ccccc3n2)C1	ZINC000875166038	FD	On-Demand	Anodyne	TNKS	40	31
Cc1nn(-c2cccnc2)nc1C(=O)N1CCCc2cc(S(C)(=O)=O)ccc21	ZINC000875166096	GD	On-Demand	Anodyne	CYP11B1	15	42
Cc1nn(-c2cccnc2)nc1C(=O)N1CCCc2cc(S(C)(=O)=O)ccc21	ZINC000875166096	GD	On-Demand	Anodyne	CYP11B2	36	42
C[C@H]1CC(=O)N[C@@H](C(=O)N2CCCc3cc(S(C)(=O)=O)ccc32)C1	ZINC000875166100	FD	On-Demand	Anodyne	GPR119	21	44
CC[C@@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)C1CCCCC1	ZINC000875166120	GD	On-Demand	Anodyne	L3MBTL3	38	40
CC(=O)C1CCN(C(=O)C(=O)NCC(C)(C)c2ccccc2F)CC1	ZINC000875166178	EE	On-Demand	Anodyne	SFRP1	68	34
CC(=O)C1CCN(C(=O)C(=O)NCC(C)(C)c2ccccc2F)CC1	ZINC000875166178	EE	On-Demand	Anodyne	WNT3	52	34
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875166196	GD	On-Demand	Anodyne	DRD2	16	45
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875166196	GD	On-Demand	Anodyne	DRD4	49	38
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875166196	GD	On-Demand	Anodyne	DRD3	25	45
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875166196	GD	On-Demand	Anodyne	MTNR1A	27	59
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875166196	GD	On-Demand	Anodyne	MTNR1B	27	59
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875166200	GD	On-Demand	Anodyne	DRD2	16	45
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875166200	GD	On-Demand	Anodyne	DRD4	49	38
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875166200	GD	On-Demand	Anodyne	DRD3	25	45
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875166200	GD	On-Demand	Anodyne	MTNR1A	27	59
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875166200	GD	On-Demand	Anodyne	MTNR1B	27	59
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)C(=O)NC[C@@H]2CC[C@@H]3C[C@@H]3C2)C1	ZINC000875166202	GD	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)C(=O)NC[C@@H]2CC[C@@H]3C[C@H]3C2)C1	ZINC000875166207	GD	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)C(=O)NC[C@@H]2CC[C@H]3C[C@H]3C2)C1	ZINC000875166210	GD	On-Demand	Anodyne	CACNA1I	42	33
CS(=O)(=O)c1ccc2c(c1)CCCN2C(=O)c1cccn(C2CC2)c1=O	ZINC000875166221	FE	On-Demand	Anodyne	GPR119	15	41
COCC[C@@H](C)NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875166225	ED	On-Demand	Anodyne	PTAFR	26	42
COCC[C@@H](C)NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875166225	ED	On-Demand	Anodyne	C3AR1	41	43
COCC[C@@H](C)NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875166226	ED	On-Demand	Anodyne	PTAFR	26	42
COCC[C@@H](C)NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875166226	ED	On-Demand	Anodyne	C3AR1	41	43
COCC[C@H](C)NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875166227	ED	On-Demand	Anodyne	PTAFR	26	42
COCC[C@H](C)NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875166227	ED	On-Demand	Anodyne	C3AR1	41	43
COCC[C@H](C)NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875166229	ED	On-Demand	Anodyne	PTAFR	26	42
COCC[C@H](C)NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875166229	ED	On-Demand	Anodyne	C3AR1	41	43
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000875166280	GC	On-Demand	Mild	L3MBTL3	51	34
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000875166284	GC	On-Demand	Mild	L3MBTL3	51	34
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(c2cc(Cl)ccc2C)C1	ZINC000875166343	GD	On-Demand	Mild	CACNA1I	49	34
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCN(c2cc(Cl)ccc2C)C1	ZINC000875166348	GD	On-Demand	Mild	CACNA1I	49	34
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(c2cc(Cl)ccc2C)C1	ZINC000875166349	GD	On-Demand	Mild	CACNA1I	49	34
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCN(c2cc(Cl)ccc2C)C1	ZINC000875166350	GD	On-Demand	Mild	CACNA1I	49	34
CCc1nnc2n1C[C@@H](NC(=O)C(=O)N1CC[C@@]3(CCc4ccccc43)C1)CC2	ZINC000875166387	GD	On-Demand	Anodyne	OXTR	45	36
CCc1nnc2n1C[C@@H](NC(=O)C(=O)N1CC[C@]3(CCc4ccccc43)C1)CC2	ZINC000875166388	GD	On-Demand	Anodyne	OXTR	45	36
CCc1nnc2n1C[C@H](NC(=O)C(=O)N1CC[C@]3(CCc4ccccc43)C1)CC2	ZINC000875166389	GD	On-Demand	Anodyne	OXTR	45	36
CCc1nnc2n1C[C@H](NC(=O)C(=O)N1CC[C@@]3(CCc4ccccc43)C1)CC2	ZINC000875166390	GD	On-Demand	Anodyne	OXTR	45	36
CCc1nc2ccccc2n1CCNC(=O)C(=O)NCC[C@H]1CCSC1	ZINC000875166397	FD	On-Demand	Anodyne	PDE6D	52	36
CCc1nc2ccccc2n1CCNC(=O)C(=O)NCC[C@@H]1CCSC1	ZINC000875166398	FD	On-Demand	Anodyne	PDE6D	52	36
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)C(=O)NC[C@@H]2CC[C@H]3C[C@@H]3C2)C1	ZINC000875166455	GD	On-Demand	Anodyne	CACNA1I	42	33
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875166472	GD	On-Demand	Anodyne	DRD4	36	49
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875166472	GD	On-Demand	Anodyne	ACHE	48	53
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875166472	GD	On-Demand	Anodyne	HTR4	29	41
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875166472	GD	On-Demand	Anodyne	SIGMAR1	39	43
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875166472	GD	On-Demand	Anodyne	CCR3	23	42
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875166473	GD	On-Demand	Anodyne	DRD4	36	49
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875166473	GD	On-Demand	Anodyne	ACHE	48	53
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875166473	GD	On-Demand	Anodyne	HTR4	29	41
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875166473	GD	On-Demand	Anodyne	SIGMAR1	39	43
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875166473	GD	On-Demand	Anodyne	CCR3	23	42
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875166474	GD	On-Demand	Anodyne	DRD4	36	49
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875166474	GD	On-Demand	Anodyne	ACHE	48	53
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875166474	GD	On-Demand	Anodyne	HTR4	29	41
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875166474	GD	On-Demand	Anodyne	SIGMAR1	39	43
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875166474	GD	On-Demand	Anodyne	CCR3	23	42
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875166475	GD	On-Demand	Anodyne	DRD4	36	49
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875166475	GD	On-Demand	Anodyne	ACHE	48	53
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875166475	GD	On-Demand	Anodyne	HTR4	29	41
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875166475	GD	On-Demand	Anodyne	SIGMAR1	39	43
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875166475	GD	On-Demand	Anodyne	CCR3	23	42
NC(=O)c1cccc(CCNC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)c1	ZINC000875166499	GD	On-Demand	Anodyne	GHRHR	23	40
NC(=O)c1cccc(CCNC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)c1	ZINC000875166500	GD	On-Demand	Anodyne	GHRHR	23	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)C(=O)NCC2CC=CC2)C1	ZINC000875166502	FD	On-Demand	Anodyne	CACNA1I	58	37
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)C(=O)NCC2CC=CC2)C1	ZINC000875166502	FD	On-Demand	Anodyne	GPR119	40	41
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)C(=O)NCC2CC=CC2)C1	ZINC000875166504	FD	On-Demand	Anodyne	CACNA1I	58	37
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)C(=O)NCC2CC=CC2)C1	ZINC000875166504	FD	On-Demand	Anodyne	GPR119	40	41
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(S(=O)(=O)N2CCOCC2)c(Cl)cc1Cl	ZINC000875166534	JE	On-Demand	Anodyne	CPT1A	16	42
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(S(=O)(=O)N2CCOCC2)c(Cl)cc1Cl	ZINC000875166534	JE	On-Demand	Anodyne	NR1H4	24	45
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(S(=O)(=O)N2CCOCC2)c(Cl)cc1Cl	ZINC000875166534	JE	On-Demand	Anodyne	NR2E3	42	30
CCCCCCCNC(=O)C(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000875166552	GF	On-Demand	Mild	EPHX2	33	50
CCCCCCCNC(=O)C(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000875166552	GF	On-Demand	Mild	ASAH1	79	34
CCCCCCCNC(=O)C(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000875166552	GF	On-Demand	Mild	L3MBTL3	65	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166559	FD	On-Demand	Anodyne	DRD2	17	49
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166559	FD	On-Demand	Anodyne	DRD4	36	49
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166559	FD	On-Demand	Anodyne	ACHE	42	44
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166559	FD	On-Demand	Anodyne	SLC6A1	73	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166559	FD	On-Demand	Anodyne	HTR4	45	45
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166559	FD	On-Demand	Anodyne	SIGMAR1	43	45
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166559	FD	On-Demand	Anodyne	CCR3	36	44
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166559	FD	On-Demand	Anodyne	CACNA1I	57	37
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166560	FD	On-Demand	Anodyne	DRD2	17	49
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166560	FD	On-Demand	Anodyne	DRD4	36	49
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166560	FD	On-Demand	Anodyne	ACHE	42	44
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166560	FD	On-Demand	Anodyne	SLC6A1	73	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166560	FD	On-Demand	Anodyne	HTR4	45	45
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166560	FD	On-Demand	Anodyne	SIGMAR1	43	45
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166560	FD	On-Demand	Anodyne	CCR3	36	44
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166560	FD	On-Demand	Anodyne	CACNA1I	57	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166561	FD	On-Demand	Anodyne	DRD2	17	49
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166561	FD	On-Demand	Anodyne	DRD4	36	49
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166561	FD	On-Demand	Anodyne	ACHE	42	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166561	FD	On-Demand	Anodyne	SLC6A1	73	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166561	FD	On-Demand	Anodyne	HTR4	45	45
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166561	FD	On-Demand	Anodyne	SIGMAR1	43	45
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166561	FD	On-Demand	Anodyne	CCR3	36	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166561	FD	On-Demand	Anodyne	CACNA1I	57	37
CN(C)S(=O)(=O)c1cc(C(=O)Nc2cccc(-c3nn[nH]n3)c2)ccc1Cl	ZINC000875166562	HE	On-Demand	Anodyne	CPT1A	46	31
CN(C)S(=O)(=O)c1cc(C(=O)Nc2cccc(-c3nn[nH]n3)c2)ccc1Cl	ZINC000875166562	HE	On-Demand	Anodyne	CPT1B	18	49
CN(C)S(=O)(=O)c1cc(C(=O)Nc2cccc(-c3nn[nH]n3)c2)ccc1Cl	ZINC000875166562	HE	On-Demand	Anodyne	BRAF	34	44
CN(C)S(=O)(=O)c1cc(C(=O)Nc2cccc(-c3nn[nH]n3)c2)ccc1Cl	ZINC000875166562	HE	On-Demand	Anodyne	TAAR1	22	43
CN(C)S(=O)(=O)c1cc(C(=O)Nc2cccc(-c3nn[nH]n3)c2)ccc1Cl	ZINC000875166562	HE	On-Demand	Anodyne	KCNK3	79	38
CN(C)S(=O)(=O)c1cc(C(=O)Nc2cccc(-c3nn[nH]n3)c2)ccc1Cl	ZINC000875166562	HE	On-Demand	Anodyne	KCNK9	44	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166563	FD	On-Demand	Anodyne	DRD2	17	49
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166563	FD	On-Demand	Anodyne	DRD4	36	49
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166563	FD	On-Demand	Anodyne	ACHE	42	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166563	FD	On-Demand	Anodyne	SLC6A1	73	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166563	FD	On-Demand	Anodyne	HTR4	45	45
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166563	FD	On-Demand	Anodyne	SIGMAR1	43	45
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166563	FD	On-Demand	Anodyne	CCR3	36	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875166563	FD	On-Demand	Anodyne	CACNA1I	57	37
O=C(NC[C@H]1CCN(Cc2ccccc2)C1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875166636	FE	On-Demand	Anodyne	DRD4	39	49
O=C(NC[C@H]1CCN(Cc2ccccc2)C1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875166636	FE	On-Demand	Anodyne	ACHE	44	45
O=C(NC[C@H]1CCN(Cc2ccccc2)C1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875166636	FE	On-Demand	Anodyne	HTR4	44	43
O=C(NC[C@H]1CCN(Cc2ccccc2)C1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875166636	FE	On-Demand	Anodyne	SIGMAR1	48	45
O=C(NC[C@H]1CCN(Cc2ccccc2)C1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875166636	FE	On-Demand	Anodyne	CCR3	33	42
O=C(NC[C@H]1CCN(Cc2ccccc2)C1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875166636	FE	On-Demand	Anodyne	CACNA1I	54	37
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875166638	FE	On-Demand	Anodyne	DRD4	39	49
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875166638	FE	On-Demand	Anodyne	ACHE	44	45
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875166638	FE	On-Demand	Anodyne	HTR4	44	43
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875166638	FE	On-Demand	Anodyne	SIGMAR1	48	45
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875166638	FE	On-Demand	Anodyne	CCR3	33	42
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875166638	FE	On-Demand	Anodyne	CACNA1I	54	37
N#Cc1ccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c(F)c1	ZINC000875166687	GE	On-Demand	Mild	F2	28	42
N#Cc1ccc(CNC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c(F)c1	ZINC000875166690	GE	On-Demand	Mild	F2	28	42
N#Cc1ccc(CNC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c(F)c1	ZINC000875166692	GE	On-Demand	Mild	F2	28	42
N#Cc1ccc(CNC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c(F)c1	ZINC000875166694	GE	On-Demand	Mild	F2	28	42
C[C@H](NC(=O)C(=O)NCC1CC=CC1)c1nc2ccccc2s1	ZINC000875166701	EF	On-Demand	Anodyne	TMPRSS6	48	32
CCCCCCCNC(=O)C(=O)NCc1ccc(C#N)cc1F	ZINC000875166709	DE	On-Demand	Mild	ASAH1	87	36
CCC[C@H](NC(=O)C(=O)NCc1cnn(CC)n1)c1cccc(C(F)(F)F)c1	ZINC000875166744	GF	On-Demand	Anodyne	PDS	41	33
CCC[C@@H](NC(=O)C(=O)NCc1cnn(CC)n1)c1cccc(C(F)(F)F)c1	ZINC000875166745	GF	On-Demand	Anodyne	PDS	41	33
O=C(NCCOCc1ccccc1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875166751	FB	On-Demand	Anodyne	SLC12A5	48	34
CC(=O)C1CCN(C(=O)C(=O)NCCOCc2ccccc2)CC1	ZINC000875166754	ED	On-Demand	Anodyne	CAPN2	53	32
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(-c2ccccc2)nn1-c1ccccc1	ZINC000875166788	HH	On-Demand	Anodyne	F9	38	47
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(-c2ccccc2)nn1-c1ccccc1	ZINC000875166788	HH	On-Demand	Anodyne	F10	22	41
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(-c2ccccc2)nn1-c1ccccc1	ZINC000875166788	HH	On-Demand	Anodyne	KCNK3	60	36
O=C(Nc1cccc(-c2nn[nH]n2)c1)C1=NN(c2ccccc2)C(=O)CC1	ZINC000875166820	FD	On-Demand	Anodyne	KCNK3	52	34
CCc1nc2ccccc2n1CCNC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875166823	FD	On-Demand	Anodyne	PIK3CD	24	40
CCc1nc2ccccc2n1CCNC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875166824	FD	On-Demand	Anodyne	PIK3CD	24	40
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(-c3cccc(C)c3)c2)CC1	ZINC000875166825	GG	On-Demand	Anodyne	CHRM3	16	48
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)c2c(Cl)nn(C)c2Cl)cc1	ZINC000875166826	GF	On-Demand	Anodyne	CFTR	48	42
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2c(Cl)nn(C)c2Cl)cc1	ZINC000875166827	GF	On-Demand	Anodyne	CFTR	48	42
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000875166885	GD	On-Demand	Anodyne	CACNA1I	43	35
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000875166887	GD	On-Demand	Anodyne	CACNA1I	43	35
CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cccc(-c3nn[nH]n3)c2)c1	ZINC000875166896	JH	On-Demand	Anodyne	GRM4	20	42
CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cccc(-c3nn[nH]n3)c2)c1	ZINC000875166896	JH	On-Demand	Anodyne	NR2E3	53	34
CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cccc(-c3nn[nH]n3)c2)c1	ZINC000875166896	JH	On-Demand	Anodyne	SHH	40	39
CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cccc(-c3nn[nH]n3)c2)c1	ZINC000875166896	JH	On-Demand	Anodyne	KCNK3	59	38
O=C(/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1cccc(-c2nn[nH]n2)c1	ZINC000875166897	IJ	On-Demand	Anodyne	RIPK1	41	34
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875166899	FD	On-Demand	Mild	DRD2	15	51
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875166899	FD	On-Demand	Mild	DRD4	36	51
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875166899	FD	On-Demand	Mild	ACHE	43	49
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875166899	FD	On-Demand	Mild	DRD3	15	51
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875166899	FD	On-Demand	Mild	SLC6A3	15	42
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875166899	FD	On-Demand	Mild	HTR4	51	49
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875166899	FD	On-Demand	Mild	SIGMAR1	35	42
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875166899	FD	On-Demand	Mild	CACNA1I	60	39
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875166900	FD	On-Demand	Mild	DRD2	15	51
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875166900	FD	On-Demand	Mild	DRD4	36	51
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875166900	FD	On-Demand	Mild	ACHE	43	49
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875166900	FD	On-Demand	Mild	DRD3	15	51
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875166900	FD	On-Demand	Mild	SLC6A3	15	42
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875166900	FD	On-Demand	Mild	HTR4	51	49
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875166900	FD	On-Demand	Mild	SIGMAR1	35	42
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875166900	FD	On-Demand	Mild	CACNA1I	60	39
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875166901	FD	On-Demand	Mild	DRD2	15	51
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875166901	FD	On-Demand	Mild	DRD4	36	51
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875166901	FD	On-Demand	Mild	ACHE	43	49
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875166901	FD	On-Demand	Mild	DRD3	15	51
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875166901	FD	On-Demand	Mild	SLC6A3	15	42
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875166901	FD	On-Demand	Mild	HTR4	51	49
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875166901	FD	On-Demand	Mild	SIGMAR1	35	42
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875166901	FD	On-Demand	Mild	CACNA1I	60	39
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875166902	FD	On-Demand	Mild	DRD2	15	51
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875166902	FD	On-Demand	Mild	DRD4	36	51
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875166902	FD	On-Demand	Mild	ACHE	43	49
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875166902	FD	On-Demand	Mild	DRD3	15	51
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875166902	FD	On-Demand	Mild	SLC6A3	15	42
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875166902	FD	On-Demand	Mild	HTR4	51	49
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875166902	FD	On-Demand	Mild	SIGMAR1	35	42
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875166902	FD	On-Demand	Mild	CACNA1I	60	39
O=C(/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1cccc(-c2nn[nH]n2)c1	ZINC000875166903	IJ	On-Demand	Anodyne	RIPK1	41	34
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000875166912	IF	On-Demand	Anodyne	CPT1A	22	48
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000875166912	IF	On-Demand	Anodyne	AKR1C3	43	47
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000875166912	IF	On-Demand	Anodyne	NR2E3	62	33
CC(C)(C)OC(=O)N1CCC[C@H]1CNC(=O)C(=O)NCC1CC=CC1	ZINC000875166925	FD	On-Demand	Anodyne	CACNA1I	42	34
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)C(=O)NCC1CC=CC1	ZINC000875166926	FD	On-Demand	Anodyne	CACNA1I	42	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)C(=O)NCCC[C@@H]2C=CCC2)C1	ZINC000875166928	GE	On-Demand	Anodyne	GPR119	24	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)C(=O)NCCC[C@H]2C=CCC2)C1	ZINC000875166930	GE	On-Demand	Anodyne	GPR119	24	41
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)C(=O)NCCC[C@@H]2C=CCC2)C1	ZINC000875166933	GE	On-Demand	Anodyne	GPR119	24	41
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)C(=O)NCCC[C@H]2C=CCC2)C1	ZINC000875166935	GE	On-Demand	Anodyne	GPR119	24	41
CCCCCCCNC(=O)C(=O)NCc1nc(C)c2ccccc2n1	ZINC000875166957	EF	On-Demand	Mild	TSPO	43	44
CCCCCCCNC(=O)C(=O)NCc1nc(C)c2ccccc2n1	ZINC000875166957	EF	On-Demand	Mild	BCHE	44	37
CCCCCCCNC(=O)C(=O)NCc1nc(C)c2ccccc2n1	ZINC000875166957	EF	On-Demand	Mild	ASAH1	67	35
C[C@H](NC(=O)C(=O)N1CCC(CCF)CC1)c1nc2ccccc2s1	ZINC000875166964	FG	On-Demand	Anodyne	F2	15	45
CCCCCCCNC(=O)C(=O)NCc1cn2c(n1)CCCC2	ZINC000875167001	DD	On-Demand	Mild	ASAH1	92	38
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccc(-n2nccn2)cc1C(F)(F)F	ZINC000875167010	FE	On-Demand	Anodyne	SFRP1	40	33
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccc(-n2nccn2)cc1C(F)(F)F	ZINC000875167010	FE	On-Demand	Anodyne	WNT3	48	38
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(Cl)c(S(=O)(=O)N2CCc3ccccc32)c1	ZINC000875167059	JH	On-Demand	Anodyne	AVPR2	65	36
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(Cl)c(S(=O)(=O)N2CCc3ccccc32)c1	ZINC000875167059	JH	On-Demand	Anodyne	CPT1A	76	44
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(Cl)c(S(=O)(=O)N2CCc3ccccc32)c1	ZINC000875167059	JH	On-Demand	Anodyne	CPT2	40	42
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(Cl)c(S(=O)(=O)N2CCc3ccccc32)c1	ZINC000875167059	JH	On-Demand	Anodyne	CPT1B	53	43
C=CCN(c1ccccc1)S(=O)(=O)c1cc(C(=O)Nc2cccc(-c3nn[nH]n3)c2)ccc1Cl	ZINC000875167063	JI	On-Demand	Mild	CPT1A	44	32
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCCOCc2ccccc2)c1	ZINC000875167074	FE	On-Demand	Anodyne	FKBP1A	46	39
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCCOCc2ccccc2)c1	ZINC000875167074	FE	On-Demand	Anodyne	PREP	71	40
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCCOCc2ccccc2)c1	ZINC000875167075	FE	On-Demand	Anodyne	FKBP1A	46	39
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCCOCc2ccccc2)c1	ZINC000875167075	FE	On-Demand	Anodyne	PREP	71	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCOCc2ccccc2)C1	ZINC000875167076	ED	On-Demand	Anodyne	SLC6A1	66	36
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCOCc2ccccc2)C1	ZINC000875167076	ED	On-Demand	Anodyne	PREP	55	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCOCc2ccccc2)C1	ZINC000875167076	ED	On-Demand	Anodyne	DPP7	47	37
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCOCc2ccccc2)C1	ZINC000875167076	ED	On-Demand	Anodyne	SLC12A5	42	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCOCc2ccccc2)C1	ZINC000875167077	ED	On-Demand	Anodyne	SLC6A1	66	36
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCOCc2ccccc2)C1	ZINC000875167077	ED	On-Demand	Anodyne	PREP	55	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCOCc2ccccc2)C1	ZINC000875167077	ED	On-Demand	Anodyne	DPP7	47	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCOCc2ccccc2)C1	ZINC000875167077	ED	On-Demand	Anodyne	SLC12A5	42	35
O=C(NCCOCc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875167090	FE	On-Demand	Anodyne	PREP	42	39
O=C(NCCOCc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875167091	FE	On-Demand	Anodyne	PREP	42	39
CC(=O)C1CCN(C(=O)C(=O)N[C@H](c2cccc(C(F)(F)F)c2)C(C)C)CC1	ZINC000875167096	GG	On-Demand	Anodyne	CCR2	43	37
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](c2cccc(C(F)(F)F)c2)C(C)C)CC1	ZINC000875167097	GG	On-Demand	Anodyne	CCR2	43	37
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(CCCOC)CC1	ZINC000875167131	EB	On-Demand	Mild	HTR4	15	40
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(CCCOC)CC1	ZINC000875167132	EB	On-Demand	Mild	HTR4	15	40
CN(C)CC1CCC(NC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000875167159	GE	On-Demand	Anodyne	OXTR	51	37
CN(C)CC1CCC(NC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000875167160	GE	On-Demand	Anodyne	OXTR	51	37
CCc1nc2ccccc2n1CCNC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875167180	FD	On-Demand	Anodyne	PDE6D	56	37
COc1ccc(N2CCC(NC(=O)C(=O)NCCCCC3CC3)CC2)cc1	ZINC000875167210	FE	On-Demand	Clean	HTR1A	18	41
COc1ccc(N2CCC(NC(=O)C(=O)NCCCCC3CC3)CC2)cc1	ZINC000875167210	FE	On-Demand	Clean	DRD2	26	44
COc1ccc(N2CCC(NC(=O)C(=O)NCCCCC3CC3)CC2)cc1	ZINC000875167210	FE	On-Demand	Clean	DRD3	51	44
COc1ccc(N2CCC(NC(=O)C(=O)NCCCCC3CC3)CC2)cc1	ZINC000875167210	FE	On-Demand	Clean	PDK1	41	36
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCCN2C(=O)OC(C)(C)C)C1	ZINC000875167212	GD	On-Demand	Anodyne	PREP	15	46
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCCN2C(=O)OC(C)(C)C)C1	ZINC000875167214	GD	On-Demand	Anodyne	PREP	15	46
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCCN2C(=O)OC(C)(C)C)C1	ZINC000875167216	GD	On-Demand	Anodyne	PREP	15	46
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCCN2C(=O)OC(C)(C)C)C1	ZINC000875167218	GD	On-Demand	Anodyne	PREP	15	46
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875167220	GD	On-Demand	Anodyne	DRD4	21	43
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875167220	GD	On-Demand	Anodyne	ACHE	33	40
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875167220	GD	On-Demand	Anodyne	HTR4	43	40
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875167222	GD	On-Demand	Anodyne	DRD4	21	43
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875167222	GD	On-Demand	Anodyne	ACHE	33	40
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875167222	GD	On-Demand	Anodyne	HTR4	43	40
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875167224	GD	On-Demand	Anodyne	DRD4	21	43
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875167224	GD	On-Demand	Anodyne	ACHE	33	40
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875167224	GD	On-Demand	Anodyne	HTR4	43	40
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875167226	GD	On-Demand	Anodyne	DRD4	21	43
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875167226	GD	On-Demand	Anodyne	ACHE	33	40
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875167226	GD	On-Demand	Anodyne	HTR4	43	40
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	ZINC000875167245	IF	On-Demand	Anodyne	CPT1A	63	49
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	ZINC000875167245	IF	On-Demand	Anodyne	CPT1B	29	49
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	ZINC000875167245	IF	On-Demand	Anodyne	RPS6KA3	46	40
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	ZINC000875167245	IF	On-Demand	Anodyne	BRAF	36	44
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	ZINC000875167245	IF	On-Demand	Anodyne	TAAR1	34	41
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	ZINC000875167245	IF	On-Demand	Anodyne	NR2E3	51	32
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	ZINC000875167245	IF	On-Demand	Anodyne	KCNK3	41	37
CCCCCCCNC(=O)C(=O)N[C@@H]1CCc2nnc(C)n2C1	ZINC000875167274	DD	On-Demand	Mild	ASAH1	76	34
CCCCCCCNC(=O)C(=O)N[C@H]1CCc2nnc(C)n2C1	ZINC000875167278	DD	On-Demand	Mild	ASAH1	76	34
COc1ccc(N2CCC(NC(=O)C(=O)NCC3CC=CC3)CC2)cc1	ZINC000875167288	FD	On-Demand	Clean	MTNR1A	15	40
COc1ccc(N2CCC(NC(=O)C(=O)NCC3CC=CC3)CC2)cc1	ZINC000875167288	FD	On-Demand	Clean	EPHX2	15	42
COc1ccc(N2CCC(NC(=O)C(=O)NCC3CC=CC3)CC2)cc1	ZINC000875167288	FD	On-Demand	Clean	PDK1	40	34
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2ncc(Cc3ccc(C)c(Cl)c3)s2)n(C)c1	ZINC000875167313	JI	On-Demand	Anodyne	SCD1	37	43
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2ncc(Cc3ccc(C)c(Cl)c3)s2)n(C)c1	ZINC000875167313	JI	On-Demand	Anodyne	SCD	31	43
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167318	FC	On-Demand	Mild	DRD4	32	49
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167318	FC	On-Demand	Mild	ACHE	42	46
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167318	FC	On-Demand	Mild	SLC6A3	19	44
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167318	FC	On-Demand	Mild	HTR4	46	46
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167318	FC	On-Demand	Mild	SIGMAR1	34	42
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167318	FC	On-Demand	Mild	CACNA1I	50	37
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167319	FC	On-Demand	Mild	DRD4	32	49
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167319	FC	On-Demand	Mild	ACHE	42	46
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167319	FC	On-Demand	Mild	SLC6A3	19	44
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167319	FC	On-Demand	Mild	HTR4	46	46
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167319	FC	On-Demand	Mild	SIGMAR1	34	42
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167319	FC	On-Demand	Mild	CACNA1I	50	37
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167320	FC	On-Demand	Mild	DRD4	32	49
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167320	FC	On-Demand	Mild	ACHE	42	46
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167320	FC	On-Demand	Mild	SLC6A3	19	44
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167320	FC	On-Demand	Mild	HTR4	46	46
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167320	FC	On-Demand	Mild	SIGMAR1	34	42
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167320	FC	On-Demand	Mild	CACNA1I	50	37
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167321	FC	On-Demand	Mild	DRD4	32	49
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167321	FC	On-Demand	Mild	ACHE	42	46
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167321	FC	On-Demand	Mild	SLC6A3	19	44
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167321	FC	On-Demand	Mild	HTR4	46	46
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167321	FC	On-Demand	Mild	SIGMAR1	34	42
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167321	FC	On-Demand	Mild	CACNA1I	50	37
O=C(NCCCCCCc1ccccc1)C(=O)NCc1cn2c(n1)CCCC2	ZINC000875167343	GF	On-Demand	Anodyne	FKBP1A	17	42
O=C(NCCCCCCc1ccccc1)C(=O)NCc1cn2c(n1)CCCC2	ZINC000875167343	GF	On-Demand	Anodyne	BCHE	47	32
O=C(NCCCCCCc1ccccc1)C(=O)NCc1cn2c(n1)CCCC2	ZINC000875167343	GF	On-Demand	Anodyne	FAAH	40	37
O=C(NCCCCCCc1ccccc1)C(=O)NCc1cn2c(n1)CCCC2	ZINC000875167343	GF	On-Demand	Anodyne	CES1	43	35
O=C(NCCCCCCc1ccccc1)C(=O)NCc1cn2c(n1)CCCC2	ZINC000875167343	GF	On-Demand	Anodyne	AMP1_PLAFQ	18	40
O=C(NCCOCc1ccccc1)C(=O)N[C@H]1CC12CCC2	ZINC000875167349	DD	On-Demand	Anodyne	SLC12A5	45	32
O=C(NCCOCc1ccccc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875167350	DD	On-Demand	Anodyne	SLC12A5	45	32
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000875167384	GD	On-Demand	Mild	L3MBTL3	51	33
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000875167385	GD	On-Demand	Mild	L3MBTL3	51	33
CN1CCN(C2CCN(C(=O)C(=O)NCCOCc3ccccc3)CC2)CC1	ZINC000875167426	GC	On-Demand	Anodyne	CHRM2	17	41
CN1CCN(C2CCN(C(=O)C(=O)NCCOCc3ccccc3)CC2)CC1	ZINC000875167426	GC	On-Demand	Anodyne	SLC6A5	21	42
CN1CCN(C2CCN(C(=O)C(=O)NCCOCc3ccccc3)CC2)CC1	ZINC000875167426	GC	On-Demand	Anodyne	L3MBTL3	60	39
CC[C@]1(C(=O)Nc2nc3c(s2)CCN(Cc2ccccc2)C3)CCNC1=O	ZINC000875167434	GF	On-Demand	Anodyne	NOD2	40	34
Cc1cc(OCC(=O)Nc2ncc(Cc3ccc(C)c(Cl)c3)s2)no1	ZINC000875167453	GI	On-Demand	Anodyne	SCD1	38	45
Cc1cc(OCC(=O)Nc2ncc(Cc3ccc(C)c(Cl)c3)s2)no1	ZINC000875167453	GI	On-Demand	Anodyne	SCD	32	45
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2sccc2CC#N)cc1	ZINC000875167491	FG	On-Demand	Mild	DPP4	15	48
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2sccc2CC#N)cc1	ZINC000875167491	FG	On-Demand	Mild	LGMN	72	43
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2sccc2CC#N)cc1	ZINC000875167491	FG	On-Demand	Mild	PFKFB3	53	32
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)c2sccc2CC#N)cc1	ZINC000875167492	FG	On-Demand	Mild	DPP4	15	48
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)c2sccc2CC#N)cc1	ZINC000875167492	FG	On-Demand	Mild	LGMN	72	43
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)c2sccc2CC#N)cc1	ZINC000875167492	FG	On-Demand	Mild	PFKFB3	53	32
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	ZINC000875167520	IF	On-Demand	Anodyne	CPT1A	65	49
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	ZINC000875167520	IF	On-Demand	Anodyne	CPT1B	31	49
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	ZINC000875167520	IF	On-Demand	Anodyne	RPS6KA3	43	41
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	ZINC000875167520	IF	On-Demand	Anodyne	BRAF	38	44
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	ZINC000875167520	IF	On-Demand	Anodyne	TAAR1	35	42
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	ZINC000875167520	IF	On-Demand	Anodyne	NR2E3	58	33
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	ZINC000875167520	IF	On-Demand	Anodyne	KCNK3	50	37
O=C(/C=C\c1ccc(Cl)cc1)Nc1cccc(-c2nn[nH]n2)c1	ZINC000875167531	EG	On-Demand	Anodyne	HDAC8	35	41
O=C(/C=C\c1ccc(Cl)cc1)Nc1cccc(-c2nn[nH]n2)c1	ZINC000875167531	EG	On-Demand	Anodyne	HDAC1	27	42
O=C(/C=C\c1ccc(Cl)cc1)Nc1cccc(-c2nn[nH]n2)c1	ZINC000875167531	EG	On-Demand	Anodyne	HDAC6	30	42
O=C(/C=C\c1ccc(Cl)cc1)Nc1cccc(-c2nn[nH]n2)c1	ZINC000875167531	EG	On-Demand	Anodyne	HPSE	44	37
O=C(/C=C\c1ccc(Cl)cc1)Nc1cccc(-c2nn[nH]n2)c1	ZINC000875167531	EG	On-Demand	Anodyne	MCHR1	15	48
O=C(NCc1cn2c(n1)CCCC2)C(=O)NCc1cccc2ncccc12	ZINC000875167544	FD	On-Demand	Anodyne	HNMT	46	34
NC(=O)c1cccc(CCNC(=O)C(=O)N2CC[C@@H]3CSC[C@@H]3C2)c1	ZINC000875167585	FC	On-Demand	Anodyne	ST14	50	33
NC(=O)c1cccc(CCNC(=O)C(=O)N2CC[C@H]3CSC[C@@H]3C2)c1	ZINC000875167586	FC	On-Demand	Anodyne	ST14	50	33
NC(=O)c1cccc(CCNC(=O)C(=O)N2CC[C@@H]3CSC[C@H]3C2)c1	ZINC000875167587	FC	On-Demand	Anodyne	ST14	50	33
NC(=O)c1cccc(CCNC(=O)C(=O)N2CC[C@H]3CSC[C@H]3C2)c1	ZINC000875167588	FC	On-Demand	Anodyne	ST14	50	33
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875167593	GD	On-Demand	Anodyne	DRD4	28	46
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875167593	GD	On-Demand	Anodyne	ACHE	38	45
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875167593	GD	On-Demand	Anodyne	HTR4	28	41
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875167593	GD	On-Demand	Anodyne	SIGMAR1	39	42
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875167593	GD	On-Demand	Anodyne	CCR3	26	42
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875167594	GD	On-Demand	Anodyne	DRD4	28	46
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875167594	GD	On-Demand	Anodyne	ACHE	38	45
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875167594	GD	On-Demand	Anodyne	HTR4	28	41
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875167594	GD	On-Demand	Anodyne	SIGMAR1	39	42
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875167594	GD	On-Demand	Anodyne	CCR3	26	42
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875167595	GD	On-Demand	Anodyne	DRD4	28	46
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875167595	GD	On-Demand	Anodyne	ACHE	38	45
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875167595	GD	On-Demand	Anodyne	HTR4	28	41
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875167595	GD	On-Demand	Anodyne	SIGMAR1	39	42
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875167595	GD	On-Demand	Anodyne	CCR3	26	42
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875167596	GD	On-Demand	Anodyne	DRD4	28	46
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875167596	GD	On-Demand	Anodyne	ACHE	38	45
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875167596	GD	On-Demand	Anodyne	HTR4	28	41
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875167596	GD	On-Demand	Anodyne	SIGMAR1	39	42
O=C(NC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875167596	GD	On-Demand	Anodyne	CCR3	26	42
COc1ccc(N2CCC(NC(=O)C(=O)N3CCN(CCC#N)CC3)CC2)cc1	ZINC000875167597	GC	On-Demand	Mild	DRD4	45	38
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	ZINC000875167600	ID	On-Demand	Anodyne	NR1H4	20	41
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	ZINC000875167600	ID	On-Demand	Anodyne	AKR1C3	20	44
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	ZINC000875167600	ID	On-Demand	Anodyne	MERTK	27	40
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167603	GD	On-Demand	Anodyne	CHRM2	15	40
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167603	GD	On-Demand	Anodyne	DRD2	22	52
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167603	GD	On-Demand	Anodyne	DRD4	46	55
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167603	GD	On-Demand	Anodyne	ACHE	55	48
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167603	GD	On-Demand	Anodyne	DRD3	19	52
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167603	GD	On-Demand	Anodyne	HTR4	50	47
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167603	GD	On-Demand	Anodyne	SIGMAR1	47	45
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167603	GD	On-Demand	Anodyne	BCHE	15	43
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167603	GD	On-Demand	Anodyne	CCR3	34	40
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167603	GD	On-Demand	Anodyne	MCHR1	19	41
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167603	GD	On-Demand	Anodyne	CACNA1G	28	40
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167603	GD	On-Demand	Anodyne	CACNA1I	76	40
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167604	GD	On-Demand	Anodyne	CHRM2	15	40
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167604	GD	On-Demand	Anodyne	DRD2	22	52
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167604	GD	On-Demand	Anodyne	DRD4	46	55
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167604	GD	On-Demand	Anodyne	ACHE	55	48
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167604	GD	On-Demand	Anodyne	DRD3	19	52
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167604	GD	On-Demand	Anodyne	HTR4	50	47
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167604	GD	On-Demand	Anodyne	SIGMAR1	47	45
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167604	GD	On-Demand	Anodyne	BCHE	15	43
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167604	GD	On-Demand	Anodyne	CCR3	34	40
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167604	GD	On-Demand	Anodyne	MCHR1	19	41
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167604	GD	On-Demand	Anodyne	CACNA1G	28	40
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167604	GD	On-Demand	Anodyne	CACNA1I	76	40
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(-c2ccccn2)nc2ccccc12	ZINC000875167610	GH	On-Demand	Anodyne	METAP1	43	37
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(-c2ccccn2)nc2ccccc12	ZINC000875167610	GH	On-Demand	Anodyne	PRNP	45	34
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(-c2ccccn2)nc2ccccc12	ZINC000875167610	GH	On-Demand	Anodyne	TACR3	19	46
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(-c2ccccn2)nc2ccccc12	ZINC000875167610	GH	On-Demand	Anodyne	MT-CO2	50	37
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(-c2ccccn2)nc2ccccc12	ZINC000875167610	GH	On-Demand	Anodyne	KCNK3	91	42
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(-c2ccccn2)nc2ccccc12	ZINC000875167610	GH	On-Demand	Anodyne	KCNK9	54	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)C(=O)N2CCC(CCF)CC2)C1	ZINC000875167630	GD	On-Demand	Anodyne	CACNA1I	55	35
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)C(=O)N2CCC(CCF)CC2)C1	ZINC000875167630	GD	On-Demand	Anodyne	GPR119	27	40
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)C(=O)N2CCC(CCF)CC2)C1	ZINC000875167631	GD	On-Demand	Anodyne	CACNA1I	55	35
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)C(=O)N2CCC(CCF)CC2)C1	ZINC000875167631	GD	On-Demand	Anodyne	GPR119	27	40
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(-c2cccs2)nc2ccccc12	ZINC000875167643	GI	On-Demand	Anodyne	TACR3	19	49
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(-c2cccs2)nc2ccccc12	ZINC000875167643	GI	On-Demand	Anodyne	KCNK3	59	38
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(-c2cccs2)nc2ccccc12	ZINC000875167643	GI	On-Demand	Anodyne	KCNK9	40	38
O=C(COc1ccccc1C(=O)Nc1cccc(-c2nn[nH]n2)c1)Nc1ccc(SC(F)F)cc1	ZINC000875167667	JI	On-Demand	Anodyne	KCNK3	55	39
O=C(COc1ccccc1C(=O)Nc1cccc(-c2nn[nH]n2)c1)Nc1ccc(SC(F)F)cc1	ZINC000875167667	JI	On-Demand	Anodyne	KCNK9	56	39
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)C(=O)N2CCCC3(CC2)CC3)C1	ZINC000875167682	GE	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)C(=O)N2CCCC3(CC2)CC3)C1	ZINC000875167683	GE	On-Demand	Anodyne	CACNA1I	41	32
C=C1c2ccccc2C(=O)N1CC(=O)Nc1ncc(Cc2ccc(C)c(Cl)c2)s1	ZINC000875167701	HJ	On-Demand	Anodyne	SCD1	35	40
C=C1c2ccccc2C(=O)N1CC(=O)Nc1ncc(Cc2ccc(C)c(Cl)c2)s1	ZINC000875167701	HJ	On-Demand	Anodyne	SCD	29	40
CCO[C@@H](C(=O)Nc1ccccc1-n1cc(Br)cn1)[C@H]1CCOC1	ZINC000875167772	GG	On-Demand	Anodyne	KCNQ2	41	34
CCO[C@@H](C(=O)Nc1ccccc1-n1cc(Br)cn1)[C@@H]1CCOC1	ZINC000875167774	GG	On-Demand	Anodyne	KCNQ2	41	34
C[C@H](NC(=O)C(=O)NCCOCc1ccccc1)c1cc2cnccc2o1	ZINC000875167776	FE	On-Demand	Anodyne	CAPN2	55	35
C#CC[C@@H](COC)NC(=O)C(=O)NCCOCc1ccccc1	ZINC000875167781	DC	On-Demand	Mild	CAPN2	65	32
C#CC[C@H](COC)NC(=O)C(=O)NCCOCc1ccccc1	ZINC000875167787	DC	On-Demand	Mild	CAPN2	65	32
CC(=O)Nc1cccc(CNC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)c1	ZINC000875167809	GH	On-Demand	Anodyne	KCNK3	69	35
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)C(=O)NCCCCC2CC2)C1	ZINC000875167841	FE	On-Demand	Anodyne	CACNA1I	43	33
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)C(=O)NCCCCC2CC2)C1	ZINC000875167841	FE	On-Demand	Anodyne	GPR119	27	45
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)C(=O)NCCCCC2CC2)C1	ZINC000875167842	FE	On-Demand	Anodyne	CACNA1I	43	33
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)C(=O)NCCCCC2CC2)C1	ZINC000875167842	FE	On-Demand	Anodyne	GPR119	27	45
Cc1nc(CNC(=O)C(=O)NCCCCC2CC2)nc2ccccc12	ZINC000875167844	EE	On-Demand	Anodyne	ACHE	39	44
Cc1nc(CNC(=O)C(=O)NCCCCC2CC2)nc2ccccc12	ZINC000875167844	EE	On-Demand	Anodyne	BCHE	63	35
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1	ZINC000875167846	JG	On-Demand	Anodyne	CPT1A	63	49
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1	ZINC000875167846	JG	On-Demand	Anodyne	CPT1B	29	49
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1	ZINC000875167846	JG	On-Demand	Anodyne	RPS6KA3	46	40
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1	ZINC000875167846	JG	On-Demand	Anodyne	BRAF	36	44
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1	ZINC000875167846	JG	On-Demand	Anodyne	TAAR1	34	41
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1	ZINC000875167846	JG	On-Demand	Anodyne	NR2E3	51	32
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1	ZINC000875167846	JG	On-Demand	Anodyne	KCNK3	41	37
C[C@H](NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1)c1ccnn1C	ZINC000875167848	FD	On-Demand	Anodyne	DRD4	35	46
C[C@H](NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1)c1ccnn1C	ZINC000875167848	FD	On-Demand	Anodyne	ACHE	45	44
C[C@H](NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1)c1ccnn1C	ZINC000875167848	FD	On-Demand	Anodyne	HTR4	61	47
C[C@H](NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1)c1ccnn1C	ZINC000875167848	FD	On-Demand	Anodyne	SIGMAR1	37	41
C[C@H](NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1)c1ccnn1C	ZINC000875167848	FD	On-Demand	Anodyne	CCR3	42	40
C[C@H](NC(=O)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1)c1ccnn1C	ZINC000875167848	FD	On-Demand	Anodyne	CACNA1I	50	35
C[C@H](NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1)c1ccnn1C	ZINC000875167852	FD	On-Demand	Anodyne	DRD4	35	46
C[C@H](NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1)c1ccnn1C	ZINC000875167852	FD	On-Demand	Anodyne	ACHE	45	44
C[C@H](NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1)c1ccnn1C	ZINC000875167852	FD	On-Demand	Anodyne	HTR4	61	47
C[C@H](NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1)c1ccnn1C	ZINC000875167852	FD	On-Demand	Anodyne	SIGMAR1	37	41
C[C@H](NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1)c1ccnn1C	ZINC000875167852	FD	On-Demand	Anodyne	CCR3	42	40
C[C@H](NC(=O)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1)c1ccnn1C	ZINC000875167852	FD	On-Demand	Anodyne	CACNA1I	50	35
O=C(NCCC[C@H]1C=CCC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167889	FE	On-Demand	Anodyne	DRD4	32	45
O=C(NCCC[C@H]1C=CCC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167889	FE	On-Demand	Anodyne	ACHE	45	46
O=C(NCCC[C@H]1C=CCC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167889	FE	On-Demand	Anodyne	HTR4	41	40
O=C(NCCC[C@H]1C=CCC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167889	FE	On-Demand	Anodyne	SIGMAR1	35	42
O=C(NCCC[C@H]1C=CCC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167889	FE	On-Demand	Anodyne	CCR3	25	41
O=C(NCCC[C@H]1C=CCC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167890	FE	On-Demand	Anodyne	DRD4	32	45
O=C(NCCC[C@H]1C=CCC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167890	FE	On-Demand	Anodyne	ACHE	45	46
O=C(NCCC[C@H]1C=CCC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167890	FE	On-Demand	Anodyne	HTR4	41	40
O=C(NCCC[C@H]1C=CCC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167890	FE	On-Demand	Anodyne	SIGMAR1	35	42
O=C(NCCC[C@H]1C=CCC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167890	FE	On-Demand	Anodyne	CCR3	25	41
O=C(NCCC[C@@H]1C=CCC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167891	FE	On-Demand	Anodyne	DRD4	32	45
O=C(NCCC[C@@H]1C=CCC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167891	FE	On-Demand	Anodyne	ACHE	45	46
O=C(NCCC[C@@H]1C=CCC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167891	FE	On-Demand	Anodyne	HTR4	41	40
O=C(NCCC[C@@H]1C=CCC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167891	FE	On-Demand	Anodyne	SIGMAR1	35	42
O=C(NCCC[C@@H]1C=CCC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167891	FE	On-Demand	Anodyne	CCR3	25	41
O=C(NCCC[C@@H]1C=CCC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167892	FE	On-Demand	Anodyne	DRD4	32	45
O=C(NCCC[C@@H]1C=CCC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167892	FE	On-Demand	Anodyne	ACHE	45	46
O=C(NCCC[C@@H]1C=CCC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167892	FE	On-Demand	Anodyne	HTR4	41	40
O=C(NCCC[C@@H]1C=CCC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167892	FE	On-Demand	Anodyne	SIGMAR1	35	42
O=C(NCCC[C@@H]1C=CCC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167892	FE	On-Demand	Anodyne	CCR3	25	41
O=C(NCCCCC1CC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167893	FE	On-Demand	Anodyne	CHRM2	20	41
O=C(NCCCCC1CC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167893	FE	On-Demand	Anodyne	DRD2	30	49
O=C(NCCCCC1CC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167893	FE	On-Demand	Anodyne	DRD4	47	49
O=C(NCCCCC1CC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167893	FE	On-Demand	Anodyne	ACHE	60	54
O=C(NCCCCC1CC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167893	FE	On-Demand	Anodyne	DRD3	34	49
O=C(NCCCCC1CC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167893	FE	On-Demand	Anodyne	SLC6A3	15	45
O=C(NCCCCC1CC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167893	FE	On-Demand	Anodyne	HTR4	48	46
O=C(NCCCCC1CC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167893	FE	On-Demand	Anodyne	CHRM3	22	41
O=C(NCCCCC1CC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167893	FE	On-Demand	Anodyne	SIGMAR1	54	46
O=C(NCCCCC1CC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167893	FE	On-Demand	Anodyne	BCHE	18	46
O=C(NCCCCC1CC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167893	FE	On-Demand	Anodyne	CCR3	51	47
O=C(NCCCCC1CC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167893	FE	On-Demand	Anodyne	SLC18A3	17	41
O=C(NCCCCC1CC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167893	FE	On-Demand	Anodyne	MCHR1	18	40
O=C(NCCCCC1CC1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167893	FE	On-Demand	Anodyne	CACNA1I	61	40
O=C(NCCCCC1CC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167895	FE	On-Demand	Anodyne	CHRM2	20	41
O=C(NCCCCC1CC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167895	FE	On-Demand	Anodyne	DRD2	30	49
O=C(NCCCCC1CC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167895	FE	On-Demand	Anodyne	DRD4	47	49
O=C(NCCCCC1CC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167895	FE	On-Demand	Anodyne	ACHE	60	54
O=C(NCCCCC1CC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167895	FE	On-Demand	Anodyne	DRD3	34	49
O=C(NCCCCC1CC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167895	FE	On-Demand	Anodyne	SLC6A3	15	45
O=C(NCCCCC1CC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167895	FE	On-Demand	Anodyne	HTR4	48	46
O=C(NCCCCC1CC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167895	FE	On-Demand	Anodyne	CHRM3	22	41
O=C(NCCCCC1CC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167895	FE	On-Demand	Anodyne	SIGMAR1	54	46
O=C(NCCCCC1CC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167895	FE	On-Demand	Anodyne	BCHE	18	46
O=C(NCCCCC1CC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167895	FE	On-Demand	Anodyne	CCR3	51	47
O=C(NCCCCC1CC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167895	FE	On-Demand	Anodyne	SLC18A3	17	41
O=C(NCCCCC1CC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167895	FE	On-Demand	Anodyne	MCHR1	18	40
O=C(NCCCCC1CC1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167895	FE	On-Demand	Anodyne	CACNA1I	61	40
Cc1scc(CNC(=O)C(=O)NC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1C	ZINC000875167967	GE	On-Demand	Anodyne	CACNA1I	46	33
Cc1scc(CNC(=O)C(=O)NC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1C	ZINC000875167980	GE	On-Demand	Anodyne	CACNA1I	46	33
O=C(NCc1ncc(Cl)s1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167985	GE	On-Demand	Anodyne	DRD2	15	46
O=C(NCc1ncc(Cl)s1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167985	GE	On-Demand	Anodyne	DRD4	42	48
O=C(NCc1ncc(Cl)s1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167985	GE	On-Demand	Anodyne	ACHE	46	43
O=C(NCc1ncc(Cl)s1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167985	GE	On-Demand	Anodyne	HTR4	35	45
O=C(NCc1ncc(Cl)s1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167985	GE	On-Demand	Anodyne	SIGMAR1	44	40
O=C(NCc1ncc(Cl)s1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167985	GE	On-Demand	Anodyne	CCR3	29	46
O=C(NCc1ncc(Cl)s1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167985	GE	On-Demand	Anodyne	CXCR3	20	40
O=C(NCc1ncc(Cl)s1)C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875167985	GE	On-Demand	Anodyne	CACNA1I	51	39
O=C(NCc1ncc(Cl)s1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167987	GE	On-Demand	Anodyne	DRD2	15	46
O=C(NCc1ncc(Cl)s1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167987	GE	On-Demand	Anodyne	DRD4	42	48
O=C(NCc1ncc(Cl)s1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167987	GE	On-Demand	Anodyne	ACHE	46	43
O=C(NCc1ncc(Cl)s1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167987	GE	On-Demand	Anodyne	HTR4	35	45
O=C(NCc1ncc(Cl)s1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167987	GE	On-Demand	Anodyne	SIGMAR1	44	40
O=C(NCc1ncc(Cl)s1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167987	GE	On-Demand	Anodyne	CCR3	29	46
O=C(NCc1ncc(Cl)s1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167987	GE	On-Demand	Anodyne	CXCR3	20	40
O=C(NCc1ncc(Cl)s1)C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000875167987	GE	On-Demand	Anodyne	CACNA1I	51	39
COc1cccc(/C=C(\C(=O)Nc2ncc(Cc3ccc(C)c(Cl)c3)s2)n2nnnc2C)c1	ZINC000875168007	JJ	On-Demand	Anodyne	SCD1	38	44
COc1cccc(/C=C(\C(=O)Nc2ncc(Cc3ccc(C)c(Cl)c3)s2)n2nnnc2C)c1	ZINC000875168007	JJ	On-Demand	Anodyne	SCD	33	44
COc1cccc(/C=C(/C(=O)Nc2ncc(Cc3ccc(C)c(Cl)c3)s2)n2nnnc2C)c1	ZINC000875168011	JJ	On-Demand	Anodyne	SCD1	38	44
COc1cccc(/C=C(/C(=O)Nc2ncc(Cc3ccc(C)c(Cl)c3)s2)n2nnnc2C)c1	ZINC000875168011	JJ	On-Demand	Anodyne	SCD	33	44
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000875168019	ID	On-Demand	Anodyne	CPT1A	54	43
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000875168019	ID	On-Demand	Anodyne	NR1H4	26	43
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000875168019	ID	On-Demand	Anodyne	CPT1B	28	43
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000875168028	GD	On-Demand	Anodyne	CACNA1I	47	35
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000875168029	GD	On-Demand	Anodyne	CACNA1I	47	35
O=C(CSc1ccccc1C(=O)Nc1cccc(-c2nn[nH]n2)c1)NC1CCCCCCC1	ZINC000875168052	JI	On-Demand	Anodyne	CCKBR	30	42
O=C(CSc1ccccc1C(=O)Nc1cccc(-c2nn[nH]n2)c1)NC1CCCCCCC1	ZINC000875168052	JI	On-Demand	Anodyne	KCNK3	44	36
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)C(=O)NCc2cccc(F)c2F)C1	ZINC000875168059	GD	On-Demand	Anodyne	GRIN2B	18	40
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)C(=O)NCc2cccc(F)c2F)C1	ZINC000875168059	GD	On-Demand	Anodyne	CACNA1I	62	37
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)C(=O)NCc2cccc(F)c2F)C1	ZINC000875168059	GD	On-Demand	Anodyne	GPR119	45	61
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)C(=O)NCc2cccc(F)c2F)C1	ZINC000875168062	GD	On-Demand	Anodyne	GRIN2B	18	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)C(=O)NCc2cccc(F)c2F)C1	ZINC000875168062	GD	On-Demand	Anodyne	CACNA1I	62	37
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)C(=O)NCc2cccc(F)c2F)C1	ZINC000875168062	GD	On-Demand	Anodyne	GPR119	45	61
CN1CC[C@H]2CN(C(=O)C(=O)NCCc3cccc(C(N)=O)c3)CC[C@@H]21	ZINC000875168071	FB	On-Demand	Anodyne	ST14	50	32
CN1CC[C@H]2CN(C(=O)C(=O)NCCc3cccc(C(N)=O)c3)CC[C@H]21	ZINC000875168078	FB	On-Demand	Anodyne	ST14	50	32
COc1ccc(N2CCC(NC(=O)C(=O)N3CCC(C(C)=O)CC3)CC2)cc1	ZINC000875168084	GD	On-Demand	Clean	EPHX2	20	44
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875168086	GD	On-Demand	Anodyne	CACNA1I	48	36
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875168088	GD	On-Demand	Anodyne	CACNA1I	48	36
CCN(CCNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1)C1CC1	ZINC000875168099	GD	On-Demand	Anodyne	ETHR	53	45
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(C(=O)c3ccc(C)cc3)CC2)CC1	ZINC000875168127	GD	On-Demand	Anodyne	EPHX2	33	61
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(C(=O)c3ccc(C)cc3)CC2)CC1	ZINC000875168127	GD	On-Demand	Anodyne	L3MBTL3	89	42
N#C[C@@]1(C(=O)Nc2nc3c(s2)CCN(Cc2ccccc2)C3)CCCOC1	ZINC000875168131	GF	On-Demand	Mild	SLC27A1	28	40
N#C[C@]1(C(=O)Nc2nc3c(s2)CCN(Cc2ccccc2)C3)CCCOC1	ZINC000875168132	GF	On-Demand	Mild	SLC27A1	28	40
C[C@H](NC(=O)C(=O)NCC1(c2ccc(Cl)cc2)CCC1)c1ccnn1C	ZINC000875168137	FE	On-Demand	Anodyne	CCR1	45	33
CCCCCCCNC(=O)C(=O)N[C@@H]1CCc2nc(C)nn2C1	ZINC000875168158	DD	On-Demand	Mild	ASAH1	49	32
CCCCCCCNC(=O)C(=O)N[C@H]1CCc2nc(C)nn2C1	ZINC000875168159	DD	On-Demand	Mild	ASAH1	49	32
Cc1ccccc1C1(CNC(=O)C(=O)N2CCC(N3CCN(C)CC3)CC2)CC1	ZINC000875168160	GD	On-Demand	Anodyne	L3MBTL3	59	39
CCC[C@H](NC(=O)C(=O)N[C@H](C)c1ccnn1C)c1cccc(C(F)(F)F)c1	ZINC000875168189	GG	On-Demand	Anodyne	PDS	40	32
CCC[C@@H](NC(=O)C(=O)N[C@H](C)c1ccnn1C)c1cccc(C(F)(F)F)c1	ZINC000875168190	GG	On-Demand	Anodyne	PDS	40	32
CCC[C@@H](NC(=O)C(=O)N[C@@H](C)c1ccnn1C)c1cccc(C(F)(F)F)c1	ZINC000875168191	GG	On-Demand	Anodyne	PDS	40	32
CCC[C@H](NC(=O)C(=O)N[C@@H](C)c1ccnn1C)c1cccc(C(F)(F)F)c1	ZINC000875168192	GG	On-Demand	Anodyne	PDS	40	32
CC(=O)N1CCC[C@@H]1C(=O)Oc1ccccc1I	ZINC000875168228	FE	On-Demand	Anodyne	FKBP1A	58	38
CC(=O)N1CCC[C@@H]1C(=O)Oc1ccccc1I	ZINC000875168228	FE	On-Demand	Anodyne	PREP	83	38
CCC[C@H](NC(=O)C(=O)N1CCC(C(C)=O)CC1)c1cccc(C(F)(F)F)c1	ZINC000875168267	GG	On-Demand	Anodyne	CCR2	62	37
CCN(CCNC(=O)C(=O)N[C@H](C)c1ccc(C(F)(F)F)nc1)C1CC1	ZINC000875168268	FD	On-Demand	Anodyne	TRPV1	58	34
CCC[C@@H](NC(=O)C(=O)N1CCC(C(C)=O)CC1)c1cccc(C(F)(F)F)c1	ZINC000875168269	GG	On-Demand	Anodyne	CCR2	62	37
CCN(CCNC(=O)C(=O)N[C@@H](C)c1ccc(C(F)(F)F)nc1)C1CC1	ZINC000875168270	FD	On-Demand	Anodyne	TRPV1	58	34
C[C@H](NC(=O)C(=O)NCCOCc1ccccc1)c1ccnn1C	ZINC000875168282	EC	On-Demand	Anodyne	CTSB	42	36
C[C@H](NC(=O)C(=O)NCCOCc1ccccc1)c1ccnn1C	ZINC000875168282	EC	On-Demand	Anodyne	CAPNS1	54	36
C[C@H](NC(=O)C(=O)NCCOCc1ccccc1)c1ccnn1C	ZINC000875168282	EC	On-Demand	Anodyne	CAPN1	75	39
C[C@H](NC(=O)C(=O)NCCOCc1ccccc1)c1ccnn1C	ZINC000875168282	EC	On-Demand	Anodyne	CAPN2	119	39
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(C(=O)c3ccc(C)cc3)CC2)C1	ZINC000875168382	GD	On-Demand	Anodyne	EPHX2	22	58
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(C(=O)c3ccc(C)cc3)CC2)C1	ZINC000875168382	GD	On-Demand	Anodyne	L3MBTL3	89	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(C(=O)c3ccc(C)cc3)CC2)C1	ZINC000875168383	GD	On-Demand	Anodyne	EPHX2	22	58
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(C(=O)c3ccc(C)cc3)CC2)C1	ZINC000875168383	GD	On-Demand	Anodyne	L3MBTL3	89	43
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCOCc2ccccc2)C1	ZINC000875168395	ED	On-Demand	Anodyne	CAPN2	57	32
COc1ccccc1N(C)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cccc(-c3nn[nH]n3)c2)c1	ZINC000875168405	JH	On-Demand	Anodyne	CPT1A	46	31
COc1ccccc1N(C)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cccc(-c3nn[nH]n3)c2)c1	ZINC000875168405	JH	On-Demand	Anodyne	GRM4	24	43
COc1ccccc1N(C)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cccc(-c3nn[nH]n3)c2)c1	ZINC000875168405	JH	On-Demand	Anodyne	KCNK3	53	40
COc1ccccc1N(C)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cccc(-c3nn[nH]n3)c2)c1	ZINC000875168405	JH	On-Demand	Anodyne	KCNK9	48	40
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cccc(-c3nn[nH]n3)c2)ccc1Cl	ZINC000875168439	IF	On-Demand	Anodyne	CPT1A	45	32
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cccc(-c3nn[nH]n3)c2)ccc1Cl	ZINC000875168439	IF	On-Demand	Anodyne	MTNN	47	33
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cccc(-c3nn[nH]n3)c2)ccc1Cl	ZINC000875168439	IF	On-Demand	Anodyne	BRAF	28	42
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cccc(-c3nn[nH]n3)c2)ccc1Cl	ZINC000875168439	IF	On-Demand	Anodyne	TAAR1	20	42
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cccc(-c3nn[nH]n3)c2)ccc1Cl	ZINC000875168439	IF	On-Demand	Anodyne	KCNK3	71	36
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cccc(-c3nn[nH]n3)c2)ccc1Cl	ZINC000875168439	IF	On-Demand	Anodyne	KCNK9	40	34
C[C@H](NC(=O)C(=O)NCCOCc1ccccc1)c1ccc(C(F)(F)F)nc1	ZINC000875168497	GF	On-Demand	Anodyne	CAPNS1	43	33
C[C@H](NC(=O)C(=O)NCCOCc1ccccc1)c1ccc(C(F)(F)F)nc1	ZINC000875168497	GF	On-Demand	Anodyne	CAPN1	57	38
C[C@H](NC(=O)C(=O)NCCOCc1ccccc1)c1ccc(C(F)(F)F)nc1	ZINC000875168497	GF	On-Demand	Anodyne	CAPN2	101	38
O=C(Nc1nc2c(s1)CCN(Cc1ccccc1)C2)C1(F)CCOCC1	ZINC000875168506	GG	On-Demand	Anodyne	NOD2	40	36
O=C(Nc1nc2c(s1)CCN(Cc1ccccc1)C2)C1(F)CCOCC1	ZINC000875168506	GG	On-Demand	Anodyne	SLC27A1	39	43
COc1ccc(CN(C)C(=O)COC(=O)c2sc(NC(=O)C(C)(C)C)cc2C)cc1OC	ZINC000875168606	JH	On-Demand	Anodyne	MT-ND1	17	40
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(S(=O)(=O)N2CCCc3ccccc32)ccc1Cl	ZINC000875168614	JH	On-Demand	Anodyne	AVPR2	67	39
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(S(=O)(=O)N2CCCc3ccccc32)ccc1Cl	ZINC000875168614	JH	On-Demand	Anodyne	CYP11B2	24	40
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(S(=O)(=O)N2CCCc3ccccc32)ccc1Cl	ZINC000875168614	JH	On-Demand	Anodyne	CPT1A	32	43
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(S(=O)(=O)N2CCCc3ccccc32)ccc1Cl	ZINC000875168614	JH	On-Demand	Anodyne	CPT1B	22	42
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(S(=O)(=O)N2CCCc3ccccc32)ccc1Cl	ZINC000875168614	JH	On-Demand	Anodyne	AKR1C3	30	43
CC(=O)C1CCN(C(=O)C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CC1	ZINC000875168634	GF	On-Demand	Anodyne	CCR1	54	36
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(-c2ccccc2)nc2ccccc12	ZINC000875168648	GI	On-Demand	Anodyne	PRS	51	44
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(-c2ccccc2)nc2ccccc12	ZINC000875168648	GI	On-Demand	Anodyne	TACR3	34	55
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(-c2ccccc2)nc2ccccc12	ZINC000875168648	GI	On-Demand	Anodyne	CCKBR	18	40
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(-c2ccccc2)nc2ccccc12	ZINC000875168648	GI	On-Demand	Anodyne	CYP2C9	15	65
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(-c2ccccc2)nc2ccccc12	ZINC000875168648	GI	On-Demand	Anodyne	NR2E3	59	35
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(-c2ccccc2)nc2ccccc12	ZINC000875168648	GI	On-Demand	Anodyne	SMO	16	40
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(-c2ccccc2)nc2ccccc12	ZINC000875168648	GI	On-Demand	Anodyne	MT-CO2	57	43
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(-c2ccccc2)nc2ccccc12	ZINC000875168648	GI	On-Demand	Anodyne	KCNK3	106	38
O=C(Nc1cccc(-c2nn[nH]n2)c1)c1cc(-c2ccccc2)nc2ccccc12	ZINC000875168648	GI	On-Demand	Anodyne	KCNK9	72	36
CCN(CCNC(=O)C(=O)NCc1ccc(OC(F)F)cc1F)C1CC1	ZINC000875168661	FD	On-Demand	Anodyne	TRPV1	45	33
CN(C)CC1CCC(NC(=O)C(=O)N2CCC(N3CCN(C)CC3)CC2)CC1	ZINC000875168673	GC	On-Demand	Anodyne	L3MBTL3	43	39
COc1cccc(C(C)(C)C(=O)Nc2cc(NC(=O)C3CC3)ccc2C)c1	ZINC000875168760	FI	On-Demand	Anodyne	MTNR1A	24	54
COc1cccc(C(C)(C)C(=O)Nc2cc(NC(=O)C3CC3)ccc2C)c1	ZINC000875168760	FI	On-Demand	Anodyne	MTNR1B	27	54
CCCCCCCNC(=O)C(=O)N[C@H]1CCc2c(O)cccc21	ZINC000875168769	DF	On-Demand	Mild	ASAH1	74	36
CCCCCCCNC(=O)C(=O)N[C@@H]1CCc2c(O)cccc21	ZINC000875168770	DF	On-Demand	Mild	ASAH1	74	36
CC[C@@H](NC(=O)C(=O)NC[C@@H]1CCCCN1CC)c1cccc(OC)c1OC	ZINC000875168778	GE	On-Demand	Anodyne	DRD2	49	48
CC[C@@H](NC(=O)C(=O)NC[C@H]1CCCCN1CC)c1cccc(OC)c1OC	ZINC000875168779	GE	On-Demand	Anodyne	DRD2	49	48
N#Cc1ccc(N2CCC(NC(=O)C(=O)NCC[C@H]3CCSC3)CC2)nc1	ZINC000875168802	GD	On-Demand	Mild	SIRT3	40	30
N#Cc1ccc(N2CCC(NC(=O)C(=O)NCC[C@H]3CCSC3)CC2)nc1	ZINC000875168802	GD	On-Demand	Mild	SIRT2	45	31
N#Cc1ccc(N2CCC(NC(=O)C(=O)NCC[C@H]3CCSC3)CC2)nc1	ZINC000875168802	GD	On-Demand	Mild	SIRT1	40	31
N#Cc1ccc(N2CCC(NC(=O)C(=O)NCC[C@@H]3CCSC3)CC2)nc1	ZINC000875168803	GD	On-Demand	Mild	SIRT3	40	30
N#Cc1ccc(N2CCC(NC(=O)C(=O)NCC[C@@H]3CCSC3)CC2)nc1	ZINC000875168803	GD	On-Demand	Mild	SIRT2	45	31
N#Cc1ccc(N2CCC(NC(=O)C(=O)NCC[C@@H]3CCSC3)CC2)nc1	ZINC000875168803	GD	On-Demand	Mild	SIRT1	40	31
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	ACE	40	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	OPRM1	49	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	OPRD1	47	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	CELA1	17	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	MME	106	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	ANPEP	79	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	CMA1	42	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	CTRA_BOVIN	31	48
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	FCER2	98	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	KLK3	77	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	CTSB	85	48
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	PAPA1_CARPA	85	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	CYSP_TRYCR	65	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	CCKAR	52	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	CTSK	39	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	CTSL	71	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	TIMP3	92	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	CAPNS1	70	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	MMP2	25	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	MMP3	45	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	MMP8	30	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	GRIA1	48	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	HLA-DRB1	107	50
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	REN	48	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	CTSS	29	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	CAPN1	101	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	MMP9	29	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	CTRC	46	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	CAPN2	132	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	ACE2	53	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	MC1R	43	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	PLAU	32	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	SLC1A2	40	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	MMP7	19	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	MMP1	38	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	FPR1	70	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	CTRB_BOVIN	48	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	NPR	52	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	BLA1_STEMA	41	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	QRFPR	44	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	PSMB8	41	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	NPFFR1	48	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1C	ZINC000875168826	GH	On-Demand	Anodyne	GPR142	83	41
Cn1nc(Cl)c(C(=O)Nc2cccnc2N2CCCC2)c1Cl	ZINC000875168849	EF	On-Demand	Anodyne	G2YM83_BOTF4	75	40
CCN1CCCC[C@@H]1CNC(=O)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875168864	FD	On-Demand	Anodyne	DRD2	31	40
CCN1CCCC[C@H]1CNC(=O)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875168865	FD	On-Demand	Anodyne	DRD2	31	40
CCN1CCCC[C@@H]1CNC(=O)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875168866	FD	On-Demand	Anodyne	DRD2	31	40
CCN1CCCC[C@H]1CNC(=O)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875168867	FD	On-Demand	Anodyne	DRD2	31	40
CCN1CCCC[C@H]1CNC(=O)C(=O)NCc1ccc(Br)cn1	ZINC000875168923	GD	On-Demand	Anodyne	DRD2	29	44
CCN1CCCC[C@@H]1CNC(=O)C(=O)NCc1ccc(Br)cn1	ZINC000875168924	GD	On-Demand	Anodyne	DRD2	29	44
CCN1CCCC[C@H]1CNC(=O)C(=O)NCc1ncc(Cl)s1	ZINC000875169021	ED	On-Demand	Anodyne	DRD2	31	41
CCN1CCCC[C@@H]1CNC(=O)C(=O)NCc1ncc(Cl)s1	ZINC000875169022	ED	On-Demand	Anodyne	DRD2	31	41
COCc1ccccc1NC(=O)C(C)(C)c1cccc(OC)c1	ZINC000875169051	DH	On-Demand	Anodyne	MTNR1B	35	40
CCN1CCCC[C@@H]1CNC(=O)C(=O)NC[C@H]1c2ccccc2CN1C	ZINC000875169066	FD	On-Demand	Anodyne	DRD2	33	42
CCN1CCCC[C@H]1CNC(=O)C(=O)NC[C@@H]1c2ccccc2CN1C	ZINC000875169067	FD	On-Demand	Anodyne	DRD2	33	42
CCN1CCCC[C@@H]1CNC(=O)C(=O)NC[C@@H]1c2ccccc2CN1C	ZINC000875169068	FD	On-Demand	Anodyne	DRD2	33	42
CCN1CCCC[C@H]1CNC(=O)C(=O)NC[C@H]1c2ccccc2CN1C	ZINC000875169069	FD	On-Demand	Anodyne	DRD2	33	42
CCC(=O)Nc1ccc(C)c(NC(=O)C2(NC(=O)OCc3ccccc3)CC2)c1	ZINC000875169184	GH	On-Demand	Anodyne	CTSK	24	47
CCC(=O)Nc1ccc(C)c(NC(=O)C2(NC(=O)OCc3ccccc3)CC2)c1	ZINC000875169184	GH	On-Demand	Anodyne	CAPNS1	52	35
CCC(=O)Nc1ccc(C)c(NC(=O)C2(NC(=O)OCc3ccccc3)CC2)c1	ZINC000875169184	GH	On-Demand	Anodyne	CAPN1	44	35
CCC(=O)Nc1ccc(C)c(NC(=O)C2(NC(=O)OCc3ccccc3)CC2)c1	ZINC000875169184	GH	On-Demand	Anodyne	CAPN2	74	33
CCC(=O)Nc1ccc(C)c(NC(=O)C2(NC(=O)OCc3ccccc3)CC2)c1	ZINC000875169184	GH	On-Demand	Anodyne	NPR	42	31
CCC(=O)Nc1ccc(C)c(NC(=O)C2(NC(=O)OCc3ccccc3)CC2)c1	ZINC000875169184	GH	On-Demand	Anodyne	SLC12A5	44	35
C[C@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)c1cccc(C#N)c1	ZINC000875169186	GC	On-Demand	Mild	L3MBTL3	44	39
N#Cc1ccc(N2CCC(NC(=O)C(=O)NCCCCC3CC3)CC2)nc1	ZINC000875169205	FD	On-Demand	Mild	HPGDS	16	41
CCN1CCCC[C@H]1CNC(=O)C(=O)NCCC(C)(C)COC	ZINC000875169249	ED	On-Demand	Anodyne	DRD2	32	40
CCN1CCCC[C@@H]1CNC(=O)C(=O)NCCC(C)(C)COC	ZINC000875169250	ED	On-Demand	Anodyne	DRD2	32	40
CCN1CCCC[C@H]1CNC(=O)C(=O)NCc1ccc(C(C)(C)C)o1	ZINC000875169252	EE	On-Demand	Anodyne	DRD2	31	40
CCN1CCCC[C@@H]1CNC(=O)C(=O)NCc1ccc(C(C)(C)C)o1	ZINC000875169253	EE	On-Demand	Anodyne	DRD2	31	40
N#CCc1ccsc1C(=O)Nc1cccnc1N1CCCC1	ZINC000875169280	DG	On-Demand	Mild	MAP1	42	35
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCCCN1CC	ZINC000875169316	DC	On-Demand	Mild	DRD2	31	40
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCCCN1CC	ZINC000875169317	DC	On-Demand	Mild	DRD2	31	40
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCCCN1CC	ZINC000875169318	DC	On-Demand	Mild	DRD2	31	40
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCCCN1CC	ZINC000875169319	DC	On-Demand	Mild	DRD2	31	40
CCC(=O)Nc1ccc(C)c(NC(=O)C(C)(C)c2cccc(OC)c2)c1	ZINC000875169330	FI	On-Demand	Anodyne	MTNR1A	41	52
CCC(=O)Nc1ccc(C)c(NC(=O)C(C)(C)c2cccc(OC)c2)c1	ZINC000875169330	FI	On-Demand	Anodyne	MTNR1B	42	52
CC(=O)C1CCN(C(=O)C(=O)NCC(C)(C)c2cccc(C(F)(F)F)c2)CC1	ZINC000875169351	GF	On-Demand	Anodyne	CACNA1B	49	36
CC(=O)C1CCN(C(=O)C(=O)NCC(C)(C)c2cccc(C(F)(F)F)c2)CC1	ZINC000875169351	GF	On-Demand	Anodyne	CCR2	83	39
CC(=O)C1CCN(C(=O)C(=O)NCC(C)(C)c2cccc(C(F)(F)F)c2)CC1	ZINC000875169351	GF	On-Demand	Anodyne	EPHX2	18	44
CC(=O)C1CCN(C(=O)C(=O)NCC(C)(C)c2cccc(C(F)(F)F)c2)CC1	ZINC000875169351	GF	On-Demand	Anodyne	LIPG	45	34
CC(=O)C1CCN(C(=O)C(=O)NCC(C)(C)c2cccc(C(F)(F)F)c2)CC1	ZINC000875169351	GF	On-Demand	Anodyne	SFRP1	92	36
CC(=O)C1CCN(C(=O)C(=O)NCC(C)(C)c2cccc(C(F)(F)F)c2)CC1	ZINC000875169351	GF	On-Demand	Anodyne	WNT3	65	36
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(c4ccc(C#N)cn4)CC3)CC[C@H]21	ZINC000875169370	GC	On-Demand	Mild	FASN	29	40
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCN(c4ccc(C#N)cn4)CC3)CC[C@@H]21	ZINC000875169372	GC	On-Demand	Mild	FASN	29	40
COc1cccc(C(C)(C)C(=O)Nc2ccc(N(C)C)cc2C)c1	ZINC000875169396	EH	On-Demand	Anodyne	MTNR1A	16	42
COc1cccc(C(C)(C)C(=O)Nc2ccc(N(C)C)cc2C)c1	ZINC000875169396	EH	On-Demand	Anodyne	MTNR1B	22	42
COCc1ccccc1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875169405	FG	On-Demand	Anodyne	CTSB	42	33
COCc1ccccc1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875169405	FG	On-Demand	Anodyne	PAPA1_CARPA	59	36
COCc1ccccc1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875169405	FG	On-Demand	Anodyne	CTSK	30	55
COCc1ccccc1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875169405	FG	On-Demand	Anodyne	TIMP3	42	32
COCc1ccccc1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875169405	FG	On-Demand	Anodyne	CAPNS1	60	36
COCc1ccccc1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875169405	FG	On-Demand	Anodyne	CAPN1	54	38
COCc1ccccc1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875169405	FG	On-Demand	Anodyne	CAPN2	86	38
COCc1ccccc1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875169405	FG	On-Demand	Anodyne	NPR	62	34
COCc1ccccc1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875169405	FG	On-Demand	Anodyne	NAAA	54	40
COCc1ccccc1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875169405	FG	On-Demand	Anodyne	SLC12A5	70	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	OPRM1	47	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	OPRD1	44	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	MME	101	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	ANPEP	73	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	TACR1	19	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	CMA1	46	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	CTRA_BOVIN	43	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	FCER2	99	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	KLK3	82	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	CTSB	86	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	PAPA1_CARPA	93	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	CYSP_TRYCR	73	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	CCKAR	56	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	CTSK	36	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	CTSL	75	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	NPFFR2	43	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	TIMP3	86	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	TACR3	25	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	CAPNS1	76	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	GRIA1	52	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	HLA-DRB1	110	48
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	REN	42	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	FURIN	48	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	CTSS	34	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	CAPN1	117	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	CTRC	32	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	CAPN2	140	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	ACE2	48	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	FPR1	70	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	CTRB_BOVIN	51	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	NPR	75	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	POLG_WNV	42	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	ERAP2	46	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	QRFPR	46	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	NPFFR1	61	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C)ccc1C	ZINC000875169485	GF	On-Demand	Anodyne	GPR142	54	38
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875169499	EE	On-Demand	Anodyne	ACE	48	39
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875169499	EE	On-Demand	Anodyne	OPRM1	26	43
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875169499	EE	On-Demand	Anodyne	MME	61	39
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875169499	EE	On-Demand	Anodyne	TACR2	45	33
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875169499	EE	On-Demand	Anodyne	SIGMAR1	19	44
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875169499	EE	On-Demand	Anodyne	CAPNS1	67	35
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875169499	EE	On-Demand	Anodyne	CAPN1	59	41
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875169499	EE	On-Demand	Anodyne	CAPN2	43	33
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875169499	EE	On-Demand	Anodyne	ACE2	40	35
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875169499	EE	On-Demand	Anodyne	AMP1_PLAFQ	17	40
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875169501	EE	On-Demand	Anodyne	ACE	48	39
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875169501	EE	On-Demand	Anodyne	OPRM1	26	43
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875169501	EE	On-Demand	Anodyne	MME	61	39
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875169501	EE	On-Demand	Anodyne	TACR2	45	33
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875169501	EE	On-Demand	Anodyne	SIGMAR1	19	44
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875169501	EE	On-Demand	Anodyne	CAPNS1	67	35
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875169501	EE	On-Demand	Anodyne	CAPN1	59	41
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875169501	EE	On-Demand	Anodyne	CAPN2	43	33
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875169501	EE	On-Demand	Anodyne	ACE2	40	35
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875169501	EE	On-Demand	Anodyne	AMP1_PLAFQ	17	40
COC(=O)N(C)NC(=O)N[C@H](C)CCc1ccc(OC)cc1	ZINC000875169526	DD	On-Demand	Reactive	BMP1	64	38
COC(=O)N(C)NC(=O)N[C@H](C)CCc1ccc(OC)cc1	ZINC000875169526	DD	On-Demand	Reactive	MTNR1A	33	41
COC(=O)N(C)NC(=O)N[C@H](C)CCc1ccc(OC)cc1	ZINC000875169526	DD	On-Demand	Reactive	MMP3	23	40
COC(=O)N(C)NC(=O)N[C@H](C)CCc1ccc(OC)cc1	ZINC000875169526	DD	On-Demand	Reactive	PSMB8	40	31
COC(=O)N(C)NC(=O)N[C@@H](C)CCc1ccc(OC)cc1	ZINC000875169528	DD	On-Demand	Reactive	BMP1	64	38
COC(=O)N(C)NC(=O)N[C@@H](C)CCc1ccc(OC)cc1	ZINC000875169528	DD	On-Demand	Reactive	MTNR1A	33	41
COC(=O)N(C)NC(=O)N[C@@H](C)CCc1ccc(OC)cc1	ZINC000875169528	DD	On-Demand	Reactive	MMP3	23	40
COC(=O)N(C)NC(=O)N[C@@H](C)CCc1ccc(OC)cc1	ZINC000875169528	DD	On-Demand	Reactive	PSMB8	40	31
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NCCCCCc2ccccc2)CC1	ZINC000875169529	GD	On-Demand	Anodyne	FKBP1A	21	43
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NCCCCCc2ccccc2)CC1	ZINC000875169529	GD	On-Demand	Anodyne	AMP1_PLAFQ	21	44
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCN([S@@](C)(=N)=O)CC1	ZINC000875169575	GD	On-Demand	Anodyne	TRY2_BOVIN	44	38
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCN([S@@](C)(=N)=O)CC1	ZINC000875169575	GD	On-Demand	Anodyne	CAPNS1	72	34
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCN([S@@](C)(=N)=O)CC1	ZINC000875169575	GD	On-Demand	Anodyne	CAPN1	61	38
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCN([S@@](C)(=N)=O)CC1	ZINC000875169575	GD	On-Demand	Anodyne	CAPN2	61	35
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCN([S@](C)(=N)=O)CC1	ZINC000875169577	GD	On-Demand	Anodyne	TRY2_BOVIN	44	38
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCN([S@](C)(=N)=O)CC1	ZINC000875169577	GD	On-Demand	Anodyne	CAPNS1	72	34
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCN([S@](C)(=N)=O)CC1	ZINC000875169577	GD	On-Demand	Anodyne	CAPN1	61	38
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCN([S@](C)(=N)=O)CC1	ZINC000875169577	GD	On-Demand	Anodyne	CAPN2	61	35
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCN([S@](C)(=N)=O)CC1	ZINC000875169579	GD	On-Demand	Anodyne	TRY2_BOVIN	44	38
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCN([S@](C)(=N)=O)CC1	ZINC000875169579	GD	On-Demand	Anodyne	CAPNS1	72	34
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCN([S@](C)(=N)=O)CC1	ZINC000875169579	GD	On-Demand	Anodyne	CAPN1	61	38
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCN([S@](C)(=N)=O)CC1	ZINC000875169579	GD	On-Demand	Anodyne	CAPN2	61	35
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCN([S@@](C)(=N)=O)CC1	ZINC000875169580	GD	On-Demand	Anodyne	TRY2_BOVIN	44	38
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCN([S@@](C)(=N)=O)CC1	ZINC000875169580	GD	On-Demand	Anodyne	CAPNS1	72	34
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCN([S@@](C)(=N)=O)CC1	ZINC000875169580	GD	On-Demand	Anodyne	CAPN1	61	38
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCN([S@@](C)(=N)=O)CC1	ZINC000875169580	GD	On-Demand	Anodyne	CAPN2	61	35
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C1(OC(C)C)CCC1	ZINC000875169685	DF	On-Demand	Anodyne	MAPK11	17	40
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875169695	EE	On-Demand	Anodyne	MME	46	38
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875169695	EE	On-Demand	Anodyne	CAPNS1	58	34
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875169695	EE	On-Demand	Anodyne	CAPN1	51	38
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875169697	EE	On-Demand	Anodyne	MME	46	38
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875169697	EE	On-Demand	Anodyne	CAPNS1	58	34
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875169697	EE	On-Demand	Anodyne	CAPN1	51	38
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875169699	EE	On-Demand	Anodyne	MME	46	38
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875169699	EE	On-Demand	Anodyne	CAPNS1	58	34
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875169699	EE	On-Demand	Anodyne	CAPN1	51	38
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875169701	EE	On-Demand	Anodyne	MME	46	38
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875169701	EE	On-Demand	Anodyne	CAPNS1	58	34
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875169701	EE	On-Demand	Anodyne	CAPN1	51	38
CCN1CCCC[C@H]1CNC(=O)C(=O)NCc1ncc(Br)s1	ZINC000875169774	GD	On-Demand	Anodyne	DRD2	31	42
CCN1CCCC[C@@H]1CNC(=O)C(=O)NCc1ncc(Br)s1	ZINC000875169775	GD	On-Demand	Anodyne	DRD2	31	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	ACE	60	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	TYR	35	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	OPRM1	56	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	OPRD1	53	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	CELA1	24	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	MME	126	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	ANPEP	82	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	TACR1	25	53
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	CMA1	54	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	CTRA_BOVIN	50	55
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	FCER2	107	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	CASP3	24	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	BMP1	21	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	KLK3	85	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	CTSB	100	52
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	PAPA1_CARPA	111	54
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	CYSP_TRYCR	74	53
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	CCKAR	59	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	CTSK	49	54
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	CTSL	82	54
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	CPA1	32	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	PGA	37	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	TIMP3	97	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	TACR3	22	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	CAPNS1	83	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	MMP2	24	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	MMP3	41	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	MMP8	29	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	GRIA1	48	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	HLA-DRB1	118	53
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	CELA2A	41	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	REN	47	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	REN1	27	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	MMP11	75	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	CTSS	38	54
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	CAPN1	127	49
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	MMP9	29	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	CASP1	30	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	CTRC	44	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	CAPN2	152	52
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	ACE2	80	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	MC1R	21	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	PLAU	28	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	LAP3	43	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	MMP1	43	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	FPR1	77	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	CTRB_BOVIN	51	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	NPR	78	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	BLA1_STEMA	41	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	ERAP2	45	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	PSMB8	53	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	NPFFR1	44	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COC	ZINC000875169812	FG	On-Demand	Anodyne	GPR142	75	39
N#CCc1ccsc1C(=O)Nc1ccc(Cl)cc1C(=O)N1CCCC1	ZINC000875169830	FH	On-Demand	Mild	F10	35	43
O=C(NCc1cccc([N+](=O)[O-])c1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875169841	GG	On-Demand	Bother	CACNA1C	58	39
O=C(NCc1cccc([N+](=O)[O-])c1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875169841	GG	On-Demand	Bother	CACNA1D	86	39
CCn1nc(C)c(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)c1C	ZINC000875169842	GD	On-Demand	Anodyne	SLC5A7	16	52
NC(=O)CCOC(=O)c1csc(S(=O)(=O)N2CCc3ccccc3C2)c1	ZINC000875169847	GD	On-Demand	Anodyne	AKR1C3	69	48
C=CC(C)(C)CCCNC(=O)NCc1cc(OC)c(O)c(OC)c1	ZINC000875169866	EG	On-Demand	Mild	TRPV1	16	46
Cc1ccc(OC[C@H](C)NC(=O)NCCCN2CCC[C@H]2C(N)=O)cc1	ZINC000875169921	FD	On-Demand	Anodyne	NTSR1	44	30
Cc1ccc(OC[C@H](C)NC(=O)NCCCN2CCC[C@H]2C(N)=O)cc1	ZINC000875169921	FD	On-Demand	Anodyne	NTSR2	44	31
Cc1ccc(OC[C@@H](C)NC(=O)NCCCN2CCC[C@H]2C(N)=O)cc1	ZINC000875169922	FD	On-Demand	Anodyne	NTSR1	44	30
Cc1ccc(OC[C@@H](C)NC(=O)NCCCN2CCC[C@H]2C(N)=O)cc1	ZINC000875169922	FD	On-Demand	Anodyne	NTSR2	44	31
O=C(NCc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875169947	DE	On-Demand	Bother	CACNA1C	58	38
O=C(NCc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875169947	DE	On-Demand	Bother	CACNA1D	92	38
O=C(NCc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875169952	DE	On-Demand	Bother	CACNA1C	58	38
O=C(NCc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875169952	DE	On-Demand	Bother	CACNA1D	92	38
O=C(NCc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875169955	DE	On-Demand	Bother	CACNA1C	58	38
O=C(NCc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875169955	DE	On-Demand	Bother	CACNA1D	92	38
O=C(NCc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875169958	DE	On-Demand	Bother	CACNA1C	58	38
O=C(NCc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875169958	DE	On-Demand	Bother	CACNA1D	92	38
Cc1ccc(C(=O)N(C)C)cc1NC(=O)[C@@H]1OCC[C@@H]1NC(=O)OC(C)(C)C	ZINC000875169993	GE	On-Demand	Anodyne	MAPK11	23	41
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1cccc(C#N)c1	ZINC000875169995	DF	On-Demand	Mild	ASAH1	60	36
CCCCCCCNC(=O)C(=O)N[C@H](C)c1cccc(C#N)c1	ZINC000875169997	DF	On-Demand	Mild	ASAH1	60	36
O=C(OCC(=O)N1CCN(Cc2cccc3ccccc23)CC1)c1ccc(N2CCOCC2)nc1	ZINC000875170010	JF	On-Demand	Anodyne	PIK3CA	18	41
O=C(OCC(=O)N1CCN(Cc2cccc3ccccc23)CC1)c1ccc(N2CCOCC2)nc1	ZINC000875170010	JF	On-Demand	Anodyne	PIK3CD	31	41
O=C(OCC(=O)N1CCN(Cc2cccc3ccccc23)CC1)c1ccc(N2CCOCC2)nc1	ZINC000875170010	JF	On-Demand	Anodyne	PIK3CB	51	41
CCN(CC)C(=O)CCCNC(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875170013	GG	On-Demand	Anodyne	DRD4	40	30
Cc1csc([C@H](C)NC(=O)C(=O)N2CCN(c3ccc(F)cc3F)CC2)n1	ZINC000875170018	GE	On-Demand	Anodyne	NPY2R	47	35
COCc1ccccc1NC(=O)c1c(C(F)F)nc2n1CCCC2	ZINC000875170028	EH	On-Demand	Anodyne	KCNQ2	52	33
CCC(=O)Nc1ccc(C)c(NC(=O)c2c(OC)ccc(F)c2OC)c1	ZINC000875170051	FH	On-Demand	Anodyne	ENPP1	67	35
CCC(=O)Nc1ccc(C)c(NC(=O)c2c(OC)ccc(F)c2OC)c1	ZINC000875170051	FH	On-Demand	Anodyne	SMO	15	46
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3CCc4c(O)cccc43)CC2)CC1	ZINC000875170079	GC	On-Demand	Anodyne	L3MBTL3	72	42
CN1CCN(C2CCN(C(=O)C(=O)N[C@H]3CCc4c(O)cccc43)CC2)CC1	ZINC000875170080	GC	On-Demand	Anodyne	L3MBTL3	72	42
Cc1nc(SCCC(=O)Nc2ccc3nc(O)[nH]c3c2)n[nH]1	ZINC000875170155	DD	On-Demand	Anodyne	ENPP1	62	33
CCN1CCCC[C@@H]1CNC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875170163	GC	On-Demand	Anodyne	L3MBTL3	56	39
CCN1CCCC[C@H]1CNC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875170164	GC	On-Demand	Anodyne	L3MBTL3	56	39
COc1ccc(CC[C@H](C)NC(=O)N2CCO[C@H](C(F)(F)F)CC2)cc1	ZINC000875170170	FG	On-Demand	Anodyne	CTSL	20	40
COc1ccc(CC[C@H](C)NC(=O)N2CCO[C@H](C(F)(F)F)CC2)cc1	ZINC000875170170	FG	On-Demand	Anodyne	CTSS	38	41
COc1ccc(CC[C@H](C)NC(=O)N2CCO[C@H](C(F)(F)F)CC2)cc1	ZINC000875170170	FG	On-Demand	Anodyne	BIRC2	22	42
COc1ccc(CC[C@@H](C)NC(=O)N2CCO[C@H](C(F)(F)F)CC2)cc1	ZINC000875170172	FG	On-Demand	Anodyne	CTSL	20	40
COc1ccc(CC[C@@H](C)NC(=O)N2CCO[C@H](C(F)(F)F)CC2)cc1	ZINC000875170172	FG	On-Demand	Anodyne	CTSS	38	41
COc1ccc(CC[C@@H](C)NC(=O)N2CCO[C@H](C(F)(F)F)CC2)cc1	ZINC000875170172	FG	On-Demand	Anodyne	BIRC2	22	42
COc1ccc(CC[C@@H](C)NC(=O)N2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000875170173	FG	On-Demand	Anodyne	CTSL	20	40
COc1ccc(CC[C@@H](C)NC(=O)N2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000875170173	FG	On-Demand	Anodyne	CTSS	38	41
COc1ccc(CC[C@@H](C)NC(=O)N2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000875170173	FG	On-Demand	Anodyne	BIRC2	22	42
COc1ccc(CC[C@H](C)NC(=O)N2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000875170175	FG	On-Demand	Anodyne	CTSL	20	40
COc1ccc(CC[C@H](C)NC(=O)N2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000875170175	FG	On-Demand	Anodyne	CTSS	38	41
COc1ccc(CC[C@H](C)NC(=O)N2CCO[C@@H](C(F)(F)F)CC2)cc1	ZINC000875170175	FG	On-Demand	Anodyne	BIRC2	22	42
Cc1c(NC(=O)C2(F)CCOCC2)cccc1-c1nnc2n1CCCCC2	ZINC000875170189	FG	On-Demand	Anodyne	BTK	27	41
COC(=O)N(C)NC(=O)NCCc1ccccc1Cl	ZINC000875170197	CD	On-Demand	Reactive	MTNR1A	54	44
C[C@H](NC(=O)C(=O)NCCCCCc1ccccc1)c1cc2cnccc2o1	ZINC000875170224	GH	On-Demand	Anodyne	PTAFR	27	44
C[C@H](NC(=O)C(=O)NCCCCCc1ccccc1)c1cc2cnccc2o1	ZINC000875170224	GH	On-Demand	Anodyne	MTNR1A	27	43
C[C@H](NC(=O)C(=O)NCCCCCc1ccccc1)c1cc2cnccc2o1	ZINC000875170224	GH	On-Demand	Anodyne	MTNR1B	30	43
C[C@H](NC(=O)C(=O)NCCCCCc1ccccc1)c1cc2cnccc2o1	ZINC000875170224	GH	On-Demand	Anodyne	FAAH	71	40
C[C@H](NC(=O)C(=O)NCCCCCc1ccccc1)c1cc2cnccc2o1	ZINC000875170224	GH	On-Demand	Anodyne	CES1	65	36
C[C@H](NC(=O)C(=O)NCCCCCc1ccccc1)c1cc2cnccc2o1	ZINC000875170224	GH	On-Demand	Anodyne	AMP1_PLAFQ	21	40
C[C@H](NC(=O)C(=O)NCCCCCc1ccccc1)c1cc2cnccc2o1	ZINC000875170224	GH	On-Demand	Anodyne	CES1D	54	34
CN1CCN(C2CCN(C(=O)C(=O)N[C@H]3CCCc4sccc43)CC2)CC1	ZINC000875170237	GD	On-Demand	Anodyne	L3MBTL3	74	42
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3CCCc4sccc43)CC2)CC1	ZINC000875170240	GD	On-Demand	Anodyne	L3MBTL3	74	42
Cc1csc([C@H](C)NC(=O)C(=O)N[C@H](C)c2cc3cnccc3o2)n1	ZINC000875170257	FF	On-Demand	Anodyne	UL26	70	32
Cc1csc([C@H](C)NC(=O)C(=O)N[C@H](C)c2cc3cnccc3o2)n1	ZINC000875170257	FF	On-Demand	Anodyne	SCAF_EBVB9	56	30
Cc1csc([C@H](C)NC(=O)C(=O)N[C@@H](C)c2cc3cnccc3o2)n1	ZINC000875170260	FF	On-Demand	Anodyne	UL26	70	32
Cc1csc([C@H](C)NC(=O)C(=O)N[C@@H](C)c2cc3cnccc3o2)n1	ZINC000875170260	FF	On-Demand	Anodyne	SCAF_EBVB9	56	30
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875170267	EE	On-Demand	Anodyne	ACE	52	41
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875170267	EE	On-Demand	Anodyne	OPRM1	30	46
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875170267	EE	On-Demand	Anodyne	OPRD1	15	42
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875170267	EE	On-Demand	Anodyne	MME	45	41
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875170267	EE	On-Demand	Anodyne	TACR2	54	32
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875170267	EE	On-Demand	Anodyne	CAPNS1	53	36
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875170267	EE	On-Demand	Anodyne	REN	47	37
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875170267	EE	On-Demand	Anodyne	CAPN1	47	39
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875170267	EE	On-Demand	Anodyne	ACE2	41	37
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875170267	EE	On-Demand	Anodyne	DPP7	47	38
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875170270	EE	On-Demand	Anodyne	ACE	52	41
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875170270	EE	On-Demand	Anodyne	OPRM1	30	46
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875170270	EE	On-Demand	Anodyne	OPRD1	15	42
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875170270	EE	On-Demand	Anodyne	MME	45	41
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875170270	EE	On-Demand	Anodyne	TACR2	54	32
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875170270	EE	On-Demand	Anodyne	CAPNS1	53	36
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875170270	EE	On-Demand	Anodyne	REN	47	37
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875170270	EE	On-Demand	Anodyne	CAPN1	47	39
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875170270	EE	On-Demand	Anodyne	ACE2	41	37
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875170270	EE	On-Demand	Anodyne	DPP7	47	38
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875170273	EE	On-Demand	Anodyne	ACE	52	41
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875170273	EE	On-Demand	Anodyne	OPRM1	30	46
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875170273	EE	On-Demand	Anodyne	OPRD1	15	42
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875170273	EE	On-Demand	Anodyne	MME	45	41
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875170273	EE	On-Demand	Anodyne	TACR2	54	32
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875170273	EE	On-Demand	Anodyne	CAPNS1	53	36
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875170273	EE	On-Demand	Anodyne	REN	47	37
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875170273	EE	On-Demand	Anodyne	CAPN1	47	39
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875170273	EE	On-Demand	Anodyne	ACE2	41	37
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875170273	EE	On-Demand	Anodyne	DPP7	47	38
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875170276	EE	On-Demand	Anodyne	ACE	52	41
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875170276	EE	On-Demand	Anodyne	OPRM1	30	46
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875170276	EE	On-Demand	Anodyne	OPRD1	15	42
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875170276	EE	On-Demand	Anodyne	MME	45	41
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875170276	EE	On-Demand	Anodyne	TACR2	54	32
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875170276	EE	On-Demand	Anodyne	CAPNS1	53	36
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875170276	EE	On-Demand	Anodyne	REN	47	37
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875170276	EE	On-Demand	Anodyne	CAPN1	47	39
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875170276	EE	On-Demand	Anodyne	ACE2	41	37
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875170276	EE	On-Demand	Anodyne	DPP7	47	38
COc1ccc(CC[C@H](C)NC(=O)N2CCCCCCNC(=O)CC2)cc1	ZINC000875170278	GG	On-Demand	Anodyne	DPP7	42	45
COc1ccc(CC[C@H](C)NC(=O)N2CCCCCCNC(=O)CC2)cc1	ZINC000875170278	GG	On-Demand	Anodyne	MMP1	27	40
COc1ccc(CC[C@@H](C)NC(=O)N2CCCCCCNC(=O)CC2)cc1	ZINC000875170281	GG	On-Demand	Anodyne	DPP7	42	45
COc1ccc(CC[C@@H](C)NC(=O)N2CCCCCCNC(=O)CC2)cc1	ZINC000875170281	GG	On-Demand	Anodyne	MMP1	27	40
O=C(NCCCCCc1ccccc1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875170296	FD	On-Demand	Anodyne	FKBP1A	18	42
O=C(NCCCCCc1ccccc1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875170296	FD	On-Demand	Anodyne	GHRHR	41	34
O=C(NCCCCCc1ccccc1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875170296	FD	On-Demand	Anodyne	SIGMAR1	24	42
O=C(NCCCCCc1ccccc1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875170296	FD	On-Demand	Anodyne	FAAH	43	41
O=C(NCCCCCc1ccccc1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875170296	FD	On-Demand	Anodyne	CES1	52	36
O=C(NCCCCCc1ccccc1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875170296	FD	On-Demand	Anodyne	AMP1_PLAFQ	22	48
O=C(NCCc1ccccc1Cl)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875170297	FG	On-Demand	Anodyne	EPHX2	21	40
O=C(NCCc1ccccc1Cl)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875170306	FG	On-Demand	Anodyne	EPHX2	21	40
COc1ccc(CC[C@H](C)NC(=O)N2CCN(C)C(C)(C)CC2)cc1	ZINC000875170307	EG	On-Demand	Anodyne	MMP13	27	42
COc1ccc(CC[C@H](C)NC(=O)N2CCN(C)C(C)(C)CC2)cc1	ZINC000875170307	EG	On-Demand	Anodyne	MMP9	28	42
COc1ccc(CC[C@H](C)NC(=O)N2CCN(C)C(C)(C)CC2)cc1	ZINC000875170307	EG	On-Demand	Anodyne	MMP1	36	42
COc1ccc(CC[C@H](C)NC(=O)N2CCN(C)C(C)(C)CC2)cc1	ZINC000875170307	EG	On-Demand	Anodyne	BIRC2	21	41
COc1ccc(CC[C@H](C)NC(=O)N2CCN(C)C(C)(C)CC2)cc1	ZINC000875170307	EG	On-Demand	Anodyne	PSMB8	47	33
COc1ccc(CC[C@@H](C)NC(=O)N2CCN(C)C(C)(C)CC2)cc1	ZINC000875170308	EG	On-Demand	Anodyne	MMP13	27	42
COc1ccc(CC[C@@H](C)NC(=O)N2CCN(C)C(C)(C)CC2)cc1	ZINC000875170308	EG	On-Demand	Anodyne	MMP9	28	42
COc1ccc(CC[C@@H](C)NC(=O)N2CCN(C)C(C)(C)CC2)cc1	ZINC000875170308	EG	On-Demand	Anodyne	MMP1	36	42
COc1ccc(CC[C@@H](C)NC(=O)N2CCN(C)C(C)(C)CC2)cc1	ZINC000875170308	EG	On-Demand	Anodyne	BIRC2	21	41
COc1ccc(CC[C@@H](C)NC(=O)N2CCN(C)C(C)(C)CC2)cc1	ZINC000875170308	EG	On-Demand	Anodyne	PSMB8	47	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)CCc1ccc(OC)cc1	ZINC000875170311	FF	On-Demand	Anodyne	SLC6A4	28	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)CCc1ccc(OC)cc1	ZINC000875170311	FF	On-Demand	Anodyne	SLC6A3	58	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)CCc1ccc(OC)cc1	ZINC000875170311	FF	On-Demand	Anodyne	MMP3	43	36
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)CCc1ccc(OC)cc1	ZINC000875170311	FF	On-Demand	Anodyne	MMP1	44	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)CCc1ccc(OC)cc1	ZINC000875170311	FF	On-Demand	Anodyne	BIRC2	36	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)CCc1ccc(OC)cc1	ZINC000875170312	FF	On-Demand	Anodyne	SLC6A4	28	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)CCc1ccc(OC)cc1	ZINC000875170312	FF	On-Demand	Anodyne	SLC6A3	58	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)CCc1ccc(OC)cc1	ZINC000875170312	FF	On-Demand	Anodyne	MMP3	43	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)CCc1ccc(OC)cc1	ZINC000875170312	FF	On-Demand	Anodyne	MMP1	44	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)CCc1ccc(OC)cc1	ZINC000875170312	FF	On-Demand	Anodyne	BIRC2	36	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)CCc1ccc(OC)cc1	ZINC000875170314	FF	On-Demand	Anodyne	SLC6A4	28	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)CCc1ccc(OC)cc1	ZINC000875170314	FF	On-Demand	Anodyne	SLC6A3	58	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)CCc1ccc(OC)cc1	ZINC000875170314	FF	On-Demand	Anodyne	MMP3	43	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)CCc1ccc(OC)cc1	ZINC000875170314	FF	On-Demand	Anodyne	MMP1	44	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)CCc1ccc(OC)cc1	ZINC000875170314	FF	On-Demand	Anodyne	BIRC2	36	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)CCc1ccc(OC)cc1	ZINC000875170315	FF	On-Demand	Anodyne	SLC6A4	28	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)CCc1ccc(OC)cc1	ZINC000875170315	FF	On-Demand	Anodyne	SLC6A3	58	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)CCc1ccc(OC)cc1	ZINC000875170315	FF	On-Demand	Anodyne	MMP3	43	36
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)CCc1ccc(OC)cc1	ZINC000875170315	FF	On-Demand	Anodyne	MMP1	44	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)CCc1ccc(OC)cc1	ZINC000875170315	FF	On-Demand	Anodyne	BIRC2	36	40
COCC(C)(C)CCNC(=O)NCc1cc(OC)c(O)c(OC)c1	ZINC000875170323	EE	On-Demand	Anodyne	TRPV1	18	44
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCOc2ccccc2C)C1	ZINC000875170333	ED	On-Demand	Anodyne	SLC6A1	65	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCOc2ccccc2C)C1	ZINC000875170334	ED	On-Demand	Anodyne	SLC6A1	65	35
COCCN(CC1CCN(C)CC1)C(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000875170340	FE	On-Demand	Bother	CACNA1C	61	39
COCCN(CC1CCN(C)CC1)C(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000875170340	FE	On-Demand	Bother	CACNA1D	91	39
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)NCc1cnn(CC)n1	ZINC000875170351	ED	On-Demand	Anodyne	MME	59	35
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)NCc1cnn(CC)n1	ZINC000875170351	ED	On-Demand	Anodyne	FCER2	45	31
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)NCc1cnn(CC)n1	ZINC000875170351	ED	On-Demand	Anodyne	CAPNS1	43	33
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)NCc1cnn(CC)n1	ZINC000875170351	ED	On-Demand	Anodyne	CAPN2	41	35
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)NCc1cnn(CC)n1	ZINC000875170352	ED	On-Demand	Anodyne	MME	59	35
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)NCc1cnn(CC)n1	ZINC000875170352	ED	On-Demand	Anodyne	FCER2	45	31
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)NCc1cnn(CC)n1	ZINC000875170352	ED	On-Demand	Anodyne	CAPNS1	43	33
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)NCc1cnn(CC)n1	ZINC000875170352	ED	On-Demand	Anodyne	CAPN2	41	35
CC[C@H](C[C@H](C)O)NC(=O)NCCc1ccccc1Cl	ZINC000875170362	CF	On-Demand	Anodyne	ANPEP	23	47
COc1ccc(CC[C@H](C)NC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)cc1	ZINC000875170389	GE	On-Demand	Anodyne	SLC18A2	17	40
COc1ccc(CC[C@H](C)NC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)cc1	ZINC000875170389	GE	On-Demand	Anodyne	MMP3	40	37
COc1ccc(CC[C@H](C)NC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)cc1	ZINC000875170389	GE	On-Demand	Anodyne	MMP1	46	38
COc1ccc(CC[C@H](C)NC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)cc1	ZINC000875170389	GE	On-Demand	Anodyne	BIRC2	16	41
COc1ccc(CC[C@H](C)NC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)cc1	ZINC000875170389	GE	On-Demand	Anodyne	PSMB8	45	31
COc1ccc(CC[C@@H](C)NC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)cc1	ZINC000875170391	GE	On-Demand	Anodyne	SLC18A2	17	40
COc1ccc(CC[C@@H](C)NC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)cc1	ZINC000875170391	GE	On-Demand	Anodyne	MMP3	40	37
COc1ccc(CC[C@@H](C)NC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)cc1	ZINC000875170391	GE	On-Demand	Anodyne	MMP1	46	38
COc1ccc(CC[C@@H](C)NC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)cc1	ZINC000875170391	GE	On-Demand	Anodyne	BIRC2	16	41
COc1ccc(CC[C@@H](C)NC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)cc1	ZINC000875170391	GE	On-Demand	Anodyne	PSMB8	45	31
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C1(C)CC(F)(F)C1	ZINC000875170395	DG	On-Demand	Anodyne	MAPK11	17	43
NC(=O)CCOC(=O)c1sccc1S(=O)(=O)N1CCc2ccccc2C1	ZINC000875170441	GD	On-Demand	Anodyne	AKR1C3	58	42
O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875170474	FF	On-Demand	Bother	ADRA1A	20	40
O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875170474	FF	On-Demand	Bother	CACNA1C	44	40
O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875170474	FF	On-Demand	Bother	CACNA1D	65	37
O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875170475	FF	On-Demand	Bother	ADRA1A	20	40
O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875170475	FF	On-Demand	Bother	CACNA1C	44	40
O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875170475	FF	On-Demand	Bother	CACNA1D	65	37
O=C(NCCC[C@@H]1C=CCC1)C(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000875170524	GE	On-Demand	Anodyne	SIGMAR1	15	41
O=C(NCCC[C@H]1C=CCC1)C(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000875170525	GE	On-Demand	Anodyne	SIGMAR1	15	41
Cc1ccc(C(=O)N(C)C)cc1NC(=O)[C@@]12CCCC[C@H]1C2	ZINC000875170526	DG	On-Demand	Anodyne	MAPK11	20	42
Cc1ccc(C(=O)N(C)C)cc1NC(=O)[C@]12CCCC[C@@H]1C2	ZINC000875170528	DG	On-Demand	Anodyne	MAPK11	20	42
Cc1ccc(C(=O)N(C)C)cc1NC(=O)[C@]12CCCC[C@H]1C2	ZINC000875170529	DG	On-Demand	Anodyne	MAPK11	20	42
Cc1ccc(C(=O)N(C)C)cc1NC(=O)[C@@]12CCCC[C@@H]1C2	ZINC000875170530	DG	On-Demand	Anodyne	MAPK11	20	42
CN1CC[C@H]2CN(C(=O)C(=O)NCCCCCc3ccccc3)CC[C@@H]21	ZINC000875170556	FE	On-Demand	Anodyne	FKBP1A	28	42
CN1CC[C@H]2CN(C(=O)C(=O)NCCCCCc3ccccc3)CC[C@@H]21	ZINC000875170556	FE	On-Demand	Anodyne	CYSLTR2	45	33
CN1CC[C@H]2CN(C(=O)C(=O)NCCCCCc3ccccc3)CC[C@@H]21	ZINC000875170556	FE	On-Demand	Anodyne	SIGMAR1	18	40
CN1CC[C@H]2CN(C(=O)C(=O)NCCCCCc3ccccc3)CC[C@@H]21	ZINC000875170556	FE	On-Demand	Anodyne	AMP1_PLAFQ	26	41
CN1CC[C@H]2CN(C(=O)C(=O)NCCCCCc3ccccc3)CC[C@H]21	ZINC000875170558	FE	On-Demand	Anodyne	FKBP1A	28	42
CN1CC[C@H]2CN(C(=O)C(=O)NCCCCCc3ccccc3)CC[C@H]21	ZINC000875170558	FE	On-Demand	Anodyne	CYSLTR2	45	33
CN1CC[C@H]2CN(C(=O)C(=O)NCCCCCc3ccccc3)CC[C@H]21	ZINC000875170558	FE	On-Demand	Anodyne	SIGMAR1	18	40
CN1CC[C@H]2CN(C(=O)C(=O)NCCCCCc3ccccc3)CC[C@H]21	ZINC000875170558	FE	On-Demand	Anodyne	AMP1_PLAFQ	26	41
C[C@@H]1CN(C(=O)NCc2cccc([N+](=O)[O-])c2)CC[C@@H](C(F)(F)F)O1	ZINC000875170572	FF	On-Demand	Bother	CACNA1C	49	36
C[C@@H]1CN(C(=O)NCc2cccc([N+](=O)[O-])c2)CC[C@@H](C(F)(F)F)O1	ZINC000875170572	FF	On-Demand	Bother	CACNA1D	70	36
C[C@@H]1CN(C(=O)NCc2cccc([N+](=O)[O-])c2)CC[C@@H](C(F)(F)F)O1	ZINC000875170572	FF	On-Demand	Bother	MET	15	40
C[C@@H]1CN(C(=O)NCc2cccc([N+](=O)[O-])c2)CC[C@H](C(F)(F)F)O1	ZINC000875170573	FF	On-Demand	Bother	CACNA1C	49	36
C[C@@H]1CN(C(=O)NCc2cccc([N+](=O)[O-])c2)CC[C@H](C(F)(F)F)O1	ZINC000875170573	FF	On-Demand	Bother	CACNA1D	70	36
C[C@@H]1CN(C(=O)NCc2cccc([N+](=O)[O-])c2)CC[C@H](C(F)(F)F)O1	ZINC000875170573	FF	On-Demand	Bother	MET	15	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccccc1Cl	ZINC000875170581	EF	On-Demand	Anodyne	SLC6A3	54	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccccc1Cl	ZINC000875170583	EF	On-Demand	Anodyne	SLC6A3	54	39
CC(=O)C1CCN(C(=O)C(=O)NCC2(c3ccc(Cl)cc3)CC2)CC1	ZINC000875170585	FE	On-Demand	Anodyne	CCR1	64	36
COc1ccc(CC[C@@H](C)NC(=O)NC[C@H]2C[C@H](O)C2)cc1	ZINC000875170592	DE	On-Demand	Anodyne	PSMB8	43	30
COc1ccc(CC[C@H](C)NC(=O)NC[C@H]2C[C@H](O)C2)cc1	ZINC000875170593	DE	On-Demand	Anodyne	PSMB8	43	30
O=C(NCCO)C1CCN(C(=O)NCCc2ccccc2Cl)CC1	ZINC000875170596	FD	On-Demand	Anodyne	MTNR1A	17	41
O=C(NCCO)C1CCN(C(=O)NCCc2ccccc2Cl)CC1	ZINC000875170596	FD	On-Demand	Anodyne	EPHX2	34	49
CC[C@@H]1COCCN1CCNC(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000875170606	ED	On-Demand	Bother	CACNA1C	58	36
CC[C@@H]1COCCN1CCNC(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000875170606	ED	On-Demand	Bother	CACNA1D	89	36
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875170631	ED	On-Demand	Anodyne	CHRM2	17	42
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875170631	ED	On-Demand	Anodyne	DRD2	21	52
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875170631	ED	On-Demand	Anodyne	DRD4	36	46
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875170631	ED	On-Demand	Anodyne	ACHE	35	44
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875170631	ED	On-Demand	Anodyne	SLC6A1	77	34
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875170631	ED	On-Demand	Anodyne	DRD3	16	46
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875170631	ED	On-Demand	Anodyne	HTR4	29	41
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875170631	ED	On-Demand	Anodyne	CHRM4	18	42
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875170631	ED	On-Demand	Anodyne	CHRM3	21	42
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875170631	ED	On-Demand	Anodyne	SIGMAR1	54	52
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875170631	ED	On-Demand	Anodyne	CCR3	55	53
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875170631	ED	On-Demand	Anodyne	SLC18A3	20	40
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875170632	ED	On-Demand	Anodyne	CHRM2	17	42
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875170632	ED	On-Demand	Anodyne	DRD2	21	52
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875170632	ED	On-Demand	Anodyne	DRD4	36	46
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875170632	ED	On-Demand	Anodyne	ACHE	35	44
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875170632	ED	On-Demand	Anodyne	SLC6A1	77	34
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875170632	ED	On-Demand	Anodyne	DRD3	16	46
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875170632	ED	On-Demand	Anodyne	HTR4	29	41
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875170632	ED	On-Demand	Anodyne	CHRM4	18	42
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875170632	ED	On-Demand	Anodyne	CHRM3	21	42
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875170632	ED	On-Demand	Anodyne	SIGMAR1	54	52
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875170632	ED	On-Demand	Anodyne	CCR3	55	53
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875170632	ED	On-Demand	Anodyne	SLC18A3	20	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCCc2ccccc2)C1	ZINC000875170649	EE	On-Demand	Anodyne	ACE	37	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCCc2ccccc2)C1	ZINC000875170649	EE	On-Demand	Anodyne	FKBP1A	55	46
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCCc2ccccc2)C1	ZINC000875170649	EE	On-Demand	Anodyne	SIGMAR1	20	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCCc2ccccc2)C1	ZINC000875170649	EE	On-Demand	Anodyne	PREP	72	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCCc2ccccc2)C1	ZINC000875170649	EE	On-Demand	Anodyne	MMP3	19	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCCc2ccccc2)C1	ZINC000875170649	EE	On-Demand	Anodyne	FAAH	21	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCCc2ccccc2)C1	ZINC000875170649	EE	On-Demand	Anodyne	DPP7	45	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCCc2ccccc2)C1	ZINC000875170649	EE	On-Demand	Anodyne	AMP1_PLAFQ	25	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCCc2ccccc2)C1	ZINC000875170650	EE	On-Demand	Anodyne	ACE	37	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCCc2ccccc2)C1	ZINC000875170650	EE	On-Demand	Anodyne	FKBP1A	55	46
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCCc2ccccc2)C1	ZINC000875170650	EE	On-Demand	Anodyne	SIGMAR1	20	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCCc2ccccc2)C1	ZINC000875170650	EE	On-Demand	Anodyne	PREP	72	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCCc2ccccc2)C1	ZINC000875170650	EE	On-Demand	Anodyne	MMP3	19	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCCc2ccccc2)C1	ZINC000875170650	EE	On-Demand	Anodyne	FAAH	21	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCCc2ccccc2)C1	ZINC000875170650	EE	On-Demand	Anodyne	DPP7	45	44
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCCc2ccccc2)C1	ZINC000875170650	EE	On-Demand	Anodyne	AMP1_PLAFQ	25	42
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C1([C@H]2CCCCO2)CCOCC1	ZINC000875170656	FG	On-Demand	Anodyne	MAPK11	23	41
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C1([C@@H]2CCCCO2)CCOCC1	ZINC000875170657	FG	On-Demand	Anodyne	MAPK11	23	41
O=C(N[C@H]1C[C@@H]1c1cccc(F)c1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875170664	FE	On-Demand	Anodyne	EPHX2	18	41
O=C(N[C@@H]1C[C@H]1c1cccc(F)c1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875170665	FE	On-Demand	Anodyne	EPHX2	18	41
O=C(N[C@H]1C[C@H]1c1cccc(F)c1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875170667	FE	On-Demand	Anodyne	EPHX2	18	41
CN(C)C[C@@H]1CN(C(=O)N[C@H]2C[C@H]2c2cccc(F)c2)C[C@H]1CN(C)C	ZINC000875170690	FE	On-Demand	Anodyne	CCR5	78	34
CN(C)C[C@@H]1CN(C(=O)N[C@H]2C[C@H]2c2cccc(F)c2)C[C@H]1CN(C)C	ZINC000875170690	FE	On-Demand	Anodyne	EPHX2	22	45
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2C[C@@H]2c2cccc(F)c2)C[C@H]1CN(C)C	ZINC000875170692	FE	On-Demand	Anodyne	CCR5	78	34
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2C[C@@H]2c2cccc(F)c2)C[C@H]1CN(C)C	ZINC000875170692	FE	On-Demand	Anodyne	EPHX2	22	45
CN(C)C[C@@H]1CN(C(=O)N[C@H]2C[C@@H]2c2cccc(F)c2)C[C@H]1CN(C)C	ZINC000875170694	FE	On-Demand	Anodyne	CCR5	78	34
CN(C)C[C@@H]1CN(C(=O)N[C@H]2C[C@@H]2c2cccc(F)c2)C[C@H]1CN(C)C	ZINC000875170694	FE	On-Demand	Anodyne	EPHX2	22	45
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2C[C@H]2c2cccc(F)c2)C[C@H]1CN(C)C	ZINC000875170696	FE	On-Demand	Anodyne	CCR5	78	34
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2C[C@H]2c2cccc(F)c2)C[C@H]1CN(C)C	ZINC000875170696	FE	On-Demand	Anodyne	EPHX2	22	45
O=C(NCC[C@H](O)C1CCCC1)NC1CCN(CC(F)(F)F)CC1	ZINC000875170699	FE	On-Demand	Anodyne	HPGDS	38	42
O=C(NCC[C@@H](O)C1CCCC1)NC1CCN(CC(F)(F)F)CC1	ZINC000875170701	FE	On-Demand	Anodyne	HPGDS	38	42
COCCCCNC(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875170719	EG	On-Demand	Anodyne	DRD4	44	33
O=C(N[C@@H]1C[C@H]1c1cccc(F)c1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875170753	EG	On-Demand	Anodyne	EPHX2	25	49
O=C(N[C@@H]1C[C@H]1c1cccc(F)c1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875170761	EG	On-Demand	Anodyne	EPHX2	25	49
CO[C@@H]1C[C@@H]2CN(C(=O)N[C@@H]3C[C@@H]3c3cccc(F)c3)Cc3cccnc3N2C1	ZINC000875170808	GF	On-Demand	Anodyne	EPHX2	18	41
CO[C@@H]1C[C@@H]2CN(C(=O)N[C@H]3C[C@@H]3c3cccc(F)c3)Cc3cccnc3N2C1	ZINC000875170811	GF	On-Demand	Anodyne	EPHX2	18	41
CO[C@@H]1C[C@@H]2CN(C(=O)N[C@@H]3C[C@H]3c3cccc(F)c3)Cc3cccnc3N2C1	ZINC000875170812	GF	On-Demand	Anodyne	EPHX2	18	41
CO[C@@H]1C[C@@H]2CN(C(=O)N[C@H]3C[C@H]3c3cccc(F)c3)Cc3cccnc3N2C1	ZINC000875170814	GF	On-Demand	Anodyne	EPHX2	18	41
Cc1ccc(C(=O)N(C)C)cc1NC(=O)[C@@H](NC=O)C(C)C	ZINC000875170832	DD	On-Demand	Anodyne	MAPK11	18	41
Cc1ccc(C(=O)N(C)C)cc1NC(=O)[C@@H](NC=O)C(C)C	ZINC000875170832	DD	On-Demand	Anodyne	MAPK14	15	41
CCCCCCCNC(=O)C(=O)NCc1c(C)nn(CC)c1C	ZINC000875170858	DE	On-Demand	Mild	ASAH1	84	37
COc1ccc(CC[C@@H](C)NC(=O)NC2(C)CC(F)(F)C2)cc1	ZINC000875170861	EH	On-Demand	Anodyne	MMP3	16	40
COc1ccc(CC[C@@H](C)NC(=O)NC2(C)CC(F)(F)C2)cc1	ZINC000875170861	EH	On-Demand	Anodyne	PSMB8	45	32
COc1ccc(CC[C@H](C)NC(=O)NC2(C)CC(F)(F)C2)cc1	ZINC000875170862	EH	On-Demand	Anodyne	MMP3	16	40
COc1ccc(CC[C@H](C)NC(=O)NC2(C)CC(F)(F)C2)cc1	ZINC000875170862	EH	On-Demand	Anodyne	PSMB8	45	32
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NCC2(c3ccc(Cl)cc3)CC2)CC1	ZINC000875170865	GD	On-Demand	Anodyne	SLC6A9	45	34
CCn1nc(C)c(CNC(=O)C(=O)NCc2cccc3ncccc23)c1C	ZINC000875170869	FE	On-Demand	Anodyne	P2RX7	40	45
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875170871	EE	On-Demand	Anodyne	MME	74	38
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875170871	EE	On-Demand	Anodyne	FCER2	49	34
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875170871	EE	On-Demand	Anodyne	CAPNS1	51	36
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875170871	EE	On-Demand	Anodyne	CAPN1	68	35
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875170871	EE	On-Demand	Anodyne	CAPN2	65	35
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875170871	EE	On-Demand	Anodyne	ACE2	60	38
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875170872	EE	On-Demand	Anodyne	MME	74	38
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875170872	EE	On-Demand	Anodyne	FCER2	49	34
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875170872	EE	On-Demand	Anodyne	CAPNS1	51	36
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875170872	EE	On-Demand	Anodyne	CAPN1	68	35
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875170872	EE	On-Demand	Anodyne	CAPN2	65	35
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875170872	EE	On-Demand	Anodyne	ACE2	60	38
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875170873	EE	On-Demand	Anodyne	MME	74	38
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875170873	EE	On-Demand	Anodyne	FCER2	49	34
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875170873	EE	On-Demand	Anodyne	CAPNS1	51	36
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875170873	EE	On-Demand	Anodyne	CAPN1	68	35
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875170873	EE	On-Demand	Anodyne	CAPN2	65	35
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875170873	EE	On-Demand	Anodyne	ACE2	60	38
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875170874	EE	On-Demand	Anodyne	MME	74	38
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875170874	EE	On-Demand	Anodyne	FCER2	49	34
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875170874	EE	On-Demand	Anodyne	CAPNS1	51	36
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875170874	EE	On-Demand	Anodyne	CAPN1	68	35
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875170874	EE	On-Demand	Anodyne	CAPN2	65	35
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875170874	EE	On-Demand	Anodyne	ACE2	60	38
O=C(NCc1cccc([N+](=O)[O-])c1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875170893	EE	On-Demand	Bother	CACNA1D	60	35
O=C(NCc1cccc([N+](=O)[O-])c1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875170893	EE	On-Demand	Bother	LUXR	16	42
O=C(NCc1cccc([N+](=O)[O-])c1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875170894	EE	On-Demand	Bother	CACNA1D	60	35
O=C(NCc1cccc([N+](=O)[O-])c1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875170894	EE	On-Demand	Bother	LUXR	16	42
O=C(NCc1cccc([N+](=O)[O-])c1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875170899	EG	On-Demand	Bother	CACNA1C	57	39
O=C(NCc1cccc([N+](=O)[O-])c1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875170899	EG	On-Demand	Bother	CACNA1D	89	39
COc1ccc(CC[C@H](C)NC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875170909	FD	On-Demand	Anodyne	GHRHR	40	36
COc1ccc(CC[C@H](C)NC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875170909	FD	On-Demand	Anodyne	MMP13	34	41
COc1ccc(CC[C@H](C)NC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875170909	FD	On-Demand	Anodyne	MMP3	40	39
COc1ccc(CC[C@H](C)NC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875170909	FD	On-Demand	Anodyne	MMP9	36	41
COc1ccc(CC[C@H](C)NC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875170909	FD	On-Demand	Anodyne	MMP1	46	41
COc1ccc(CC[C@H](C)NC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875170909	FD	On-Demand	Anodyne	BIRC2	19	41
COc1ccc(CC[C@H](C)NC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875170909	FD	On-Demand	Anodyne	PSMB8	47	34
COc1ccc(CC[C@@H](C)NC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875170910	FD	On-Demand	Anodyne	GHRHR	40	36
COc1ccc(CC[C@@H](C)NC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875170910	FD	On-Demand	Anodyne	MMP13	34	41
COc1ccc(CC[C@@H](C)NC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875170910	FD	On-Demand	Anodyne	MMP3	40	39
COc1ccc(CC[C@@H](C)NC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875170910	FD	On-Demand	Anodyne	MMP9	36	41
COc1ccc(CC[C@@H](C)NC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875170910	FD	On-Demand	Anodyne	MMP1	46	41
COc1ccc(CC[C@@H](C)NC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875170910	FD	On-Demand	Anodyne	BIRC2	19	41
COc1ccc(CC[C@@H](C)NC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875170910	FD	On-Demand	Anodyne	PSMB8	47	34
COCCNS(=O)(=O)c1ccc(C(=O)OCc2coc(-c3ccc(OC)cc3)n2)cc1	ZINC000875170921	IF	On-Demand	Anodyne	MMP13	19	41
COCCNS(=O)(=O)c1ccc(C(=O)OCc2coc(-c3ccc(OC)cc3)n2)cc1	ZINC000875170921	IF	On-Demand	Anodyne	MMP2	18	41
COCCNS(=O)(=O)c1ccc(C(=O)OCc2coc(-c3ccc(OC)cc3)n2)cc1	ZINC000875170921	IF	On-Demand	Anodyne	MMP8	15	41
CCO[C@@H](C(=O)Nc1ccccc1-n1cnnn1)C1CCOCC1	ZINC000875170937	ED	On-Demand	Anodyne	KCNQ2	46	36
COC(=O)N(C)NC(=O)NCCOc1ccc(Br)cc1	ZINC000875170945	ED	On-Demand	Reactive	SHC	40	38
COC(=O)N(C)NC(=O)NCCOc1ccc(Br)cc1	ZINC000875170945	ED	On-Demand	Reactive	LSS	25	42
C[C@@H](CCN(C)C)NC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875170950	ED	On-Demand	Anodyne	CTSV	29	40
C[C@@H](CCN(C)C)NC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875170950	ED	On-Demand	Anodyne	UTS2	61	37
C[C@@H](CCN(C)C)NC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875170951	ED	On-Demand	Anodyne	CTSV	29	40
C[C@@H](CCN(C)C)NC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875170951	ED	On-Demand	Anodyne	UTS2	61	37
C[C@@H](CCN(C)C)NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875170990	ED	On-Demand	Anodyne	SIGMAR1	21	40
C[C@@H](CCN(C)C)NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875170990	ED	On-Demand	Anodyne	UTS2	55	34
Cc1ccc(C(=O)N(C)C)cc1NC(=O)c1scnc1C(F)F	ZINC000875171023	EG	On-Demand	Anodyne	MAPK11	25	41
Cc1ccc(C(=O)N(C)C)cc1NC(=O)c1scnc1C(F)F	ZINC000875171023	EG	On-Demand	Anodyne	MAPK14	27	41
C[C@H](NC(=O)C(=O)NCCCCCc1ccccc1)c1ccnn1C	ZINC000875171026	EE	On-Demand	Anodyne	SCNN1A	47	39
C[C@H](NC(=O)C(=O)NCCCCCc1ccccc1)c1ccnn1C	ZINC000875171026	EE	On-Demand	Anodyne	SIGMAR1	16	40
C[C@H](NC(=O)C(=O)NCCCCCc1ccccc1)c1ccnn1C	ZINC000875171026	EE	On-Demand	Anodyne	SCN2A	17	41
C[C@H](NC(=O)C(=O)NCCCCCc1ccccc1)c1ccnn1C	ZINC000875171026	EE	On-Demand	Anodyne	MTNR1A	21	42
C[C@H](NC(=O)C(=O)NCCCCCc1ccccc1)c1ccnn1C	ZINC000875171026	EE	On-Demand	Anodyne	MTNR1B	24	42
C[C@H](NC(=O)C(=O)NCCCCCc1ccccc1)c1ccnn1C	ZINC000875171026	EE	On-Demand	Anodyne	FAAH	78	42
C[C@H](NC(=O)C(=O)NCCCCCc1ccccc1)c1ccnn1C	ZINC000875171026	EE	On-Demand	Anodyne	CES1	70	36
C[C@H](NC(=O)C(=O)NCCCCCc1ccccc1)c1ccnn1C	ZINC000875171026	EE	On-Demand	Anodyne	CAPN2	45	37
C[C@H](NC(=O)C(=O)NCCCCCc1ccccc1)c1ccnn1C	ZINC000875171026	EE	On-Demand	Anodyne	AMP1_PLAFQ	23	45
C[C@H](NC(=O)C(=O)NCCCCCc1ccccc1)c1ccnn1C	ZINC000875171026	EE	On-Demand	Anodyne	DAGLA	19	42
C[C@H](NC(=O)C(=O)NCCCCCc1ccccc1)c1ccnn1C	ZINC000875171026	EE	On-Demand	Anodyne	NPFFR1	48	31
C[C@H](NC(=O)C(=O)NCCCCCc1ccccc1)c1ccnn1C	ZINC000875171026	EE	On-Demand	Anodyne	CES1D	56	35
O=C(NCCCCCc1ccccc1)C(=O)NCc1ncc(Cl)s1	ZINC000875171093	FF	On-Demand	Anodyne	SCNN1A	65	41
O=C(NCCCCCc1ccccc1)C(=O)NCc1ncc(Cl)s1	ZINC000875171093	FF	On-Demand	Anodyne	FAAH	68	40
O=C(NCCCCCc1ccccc1)C(=O)NCc1ncc(Cl)s1	ZINC000875171093	FF	On-Demand	Anodyne	CES1	68	37
O=C(NCCCCCc1ccccc1)C(=O)NCc1ncc(Cl)s1	ZINC000875171093	FF	On-Demand	Anodyne	AMP1_PLAFQ	26	43
O=C(NCCCCCc1ccccc1)C(=O)NCc1ncc(Cl)s1	ZINC000875171093	FF	On-Demand	Anodyne	CES1D	45	32
C[C@H](NC(=O)C(=O)NC[C@@H](C)N(C)C1CC1)c1ccc(C(F)(F)F)nc1	ZINC000875171117	FD	On-Demand	Anodyne	TRPV1	41	32
C[C@H](NC(=O)C(=O)NC[C@H](C)N(C)C1CC1)c1ccc(C(F)(F)F)nc1	ZINC000875171118	FD	On-Demand	Anodyne	TRPV1	41	32
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)COc1ccc(C)cc1	ZINC000875171124	EE	On-Demand	Anodyne	SLC6A4	26	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)COc1ccc(C)cc1	ZINC000875171124	EE	On-Demand	Anodyne	SLC6A3	58	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)COc1ccc(C)cc1	ZINC000875171126	EE	On-Demand	Anodyne	SLC6A4	26	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)COc1ccc(C)cc1	ZINC000875171126	EE	On-Demand	Anodyne	SLC6A3	58	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)COc1ccc(C)cc1	ZINC000875171128	EE	On-Demand	Anodyne	SLC6A4	26	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)COc1ccc(C)cc1	ZINC000875171128	EE	On-Demand	Anodyne	SLC6A3	58	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)COc1ccc(C)cc1	ZINC000875171130	EE	On-Demand	Anodyne	SLC6A4	26	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)COc1ccc(C)cc1	ZINC000875171130	EE	On-Demand	Anodyne	SLC6A3	58	43
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](CCC)Cc1ccccc1	ZINC000875171162	ED	On-Demand	Mild	MME	50	40
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](CCC)Cc1ccccc1	ZINC000875171162	ED	On-Demand	Mild	PAPA1_CARPA	42	36
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](CCC)Cc1ccccc1	ZINC000875171162	ED	On-Demand	Mild	CAPNS1	45	34
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](CCC)Cc1ccccc1	ZINC000875171162	ED	On-Demand	Mild	CAPN2	47	34
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](CCC)Cc1ccccc1	ZINC000875171162	ED	On-Demand	Mild	CTRB_BOVIN	45	33
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](CCC)Cc1ccccc1	ZINC000875171163	ED	On-Demand	Mild	MME	50	40
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](CCC)Cc1ccccc1	ZINC000875171163	ED	On-Demand	Mild	PAPA1_CARPA	42	36
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](CCC)Cc1ccccc1	ZINC000875171163	ED	On-Demand	Mild	CAPNS1	45	34
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](CCC)Cc1ccccc1	ZINC000875171163	ED	On-Demand	Mild	CAPN2	47	34
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](CCC)Cc1ccccc1	ZINC000875171163	ED	On-Demand	Mild	CTRB_BOVIN	45	33
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](CCC)Cc1ccccc1	ZINC000875171165	ED	On-Demand	Mild	MME	50	40
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](CCC)Cc1ccccc1	ZINC000875171165	ED	On-Demand	Mild	PAPA1_CARPA	42	36
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](CCC)Cc1ccccc1	ZINC000875171165	ED	On-Demand	Mild	CAPNS1	45	34
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](CCC)Cc1ccccc1	ZINC000875171165	ED	On-Demand	Mild	CAPN2	47	34
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](CCC)Cc1ccccc1	ZINC000875171165	ED	On-Demand	Mild	CTRB_BOVIN	45	33
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](CCC)Cc1ccccc1	ZINC000875171166	ED	On-Demand	Mild	MME	50	40
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](CCC)Cc1ccccc1	ZINC000875171166	ED	On-Demand	Mild	PAPA1_CARPA	42	36
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](CCC)Cc1ccccc1	ZINC000875171166	ED	On-Demand	Mild	CAPNS1	45	34
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](CCC)Cc1ccccc1	ZINC000875171166	ED	On-Demand	Mild	CAPN2	47	34
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](CCC)Cc1ccccc1	ZINC000875171166	ED	On-Demand	Mild	CTRB_BOVIN	45	33
COc1ccc(CC[C@@H](C)NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)cc1	ZINC000875171168	FG	On-Demand	Anodyne	SLC18A2	34	45
COc1ccc(CC[C@@H](C)NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)cc1	ZINC000875171168	FG	On-Demand	Anodyne	BIRC2	37	41
COc1ccc(CC[C@H](C)NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)cc1	ZINC000875171170	FG	On-Demand	Anodyne	SLC18A2	34	45
COc1ccc(CC[C@H](C)NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)cc1	ZINC000875171170	FG	On-Demand	Anodyne	BIRC2	37	41
COc1ccc(CC[C@@H](C)NC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171173	EF	On-Demand	Anodyne	MMP13	40	40
COc1ccc(CC[C@@H](C)NC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171173	EF	On-Demand	Anodyne	CACNA1B	44	37
COc1ccc(CC[C@@H](C)NC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171173	EF	On-Demand	Anodyne	MMP3	44	41
COc1ccc(CC[C@@H](C)NC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171173	EF	On-Demand	Anodyne	MMP8	24	40
COc1ccc(CC[C@@H](C)NC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171173	EF	On-Demand	Anodyne	MMP9	36	41
COc1ccc(CC[C@@H](C)NC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171173	EF	On-Demand	Anodyne	DPP7	18	40
COc1ccc(CC[C@@H](C)NC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171173	EF	On-Demand	Anodyne	MMP1	51	41
COc1ccc(CC[C@@H](C)NC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171173	EF	On-Demand	Anodyne	BIRC2	36	49
COc1ccc(CC[C@H](C)NC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171175	EF	On-Demand	Anodyne	MMP13	40	40
COc1ccc(CC[C@H](C)NC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171175	EF	On-Demand	Anodyne	CACNA1B	44	37
COc1ccc(CC[C@H](C)NC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171175	EF	On-Demand	Anodyne	MMP3	44	41
COc1ccc(CC[C@H](C)NC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171175	EF	On-Demand	Anodyne	MMP8	24	40
COc1ccc(CC[C@H](C)NC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171175	EF	On-Demand	Anodyne	MMP9	36	41
COc1ccc(CC[C@H](C)NC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171175	EF	On-Demand	Anodyne	DPP7	18	40
COc1ccc(CC[C@H](C)NC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171175	EF	On-Demand	Anodyne	MMP1	51	41
COc1ccc(CC[C@H](C)NC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171175	EF	On-Demand	Anodyne	BIRC2	36	49
COc1ccc(CC[C@H](C)NC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875171176	EF	On-Demand	Anodyne	MMP13	40	40
COc1ccc(CC[C@H](C)NC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875171176	EF	On-Demand	Anodyne	CACNA1B	44	37
COc1ccc(CC[C@H](C)NC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875171176	EF	On-Demand	Anodyne	MMP3	44	41
COc1ccc(CC[C@H](C)NC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875171176	EF	On-Demand	Anodyne	MMP8	24	40
COc1ccc(CC[C@H](C)NC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875171176	EF	On-Demand	Anodyne	MMP9	36	41
COc1ccc(CC[C@H](C)NC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875171176	EF	On-Demand	Anodyne	DPP7	18	40
COc1ccc(CC[C@H](C)NC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875171176	EF	On-Demand	Anodyne	MMP1	51	41
COc1ccc(CC[C@H](C)NC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875171176	EF	On-Demand	Anodyne	BIRC2	36	49
COc1ccc(CC[C@@H](C)NC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875171178	EF	On-Demand	Anodyne	MMP13	40	40
COc1ccc(CC[C@@H](C)NC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875171178	EF	On-Demand	Anodyne	CACNA1B	44	37
COc1ccc(CC[C@@H](C)NC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875171178	EF	On-Demand	Anodyne	MMP3	44	41
COc1ccc(CC[C@@H](C)NC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875171178	EF	On-Demand	Anodyne	MMP8	24	40
COc1ccc(CC[C@@H](C)NC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875171178	EF	On-Demand	Anodyne	MMP9	36	41
COc1ccc(CC[C@@H](C)NC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875171178	EF	On-Demand	Anodyne	DPP7	18	40
COc1ccc(CC[C@@H](C)NC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875171178	EF	On-Demand	Anodyne	MMP1	51	41
COc1ccc(CC[C@@H](C)NC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875171178	EF	On-Demand	Anodyne	BIRC2	36	49
O=C(NCCCCCc1ccccc1)C(=O)N[C@H]1CC12CCC2	ZINC000875171179	DF	On-Demand	Anodyne	SIGMAR1	21	43
O=C(NCCCCCc1ccccc1)C(=O)N[C@H]1CC12CCC2	ZINC000875171179	DF	On-Demand	Anodyne	FAAH	25	40
O=C(NCCCCCc1ccccc1)C(=O)N[C@H]1CC12CCC2	ZINC000875171179	DF	On-Demand	Anodyne	AMP1_PLAFQ	22	44
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875171199	FF	On-Demand	Anodyne	MME	46	39
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875171200	FF	On-Demand	Anodyne	MME	46	39
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875171201	FF	On-Demand	Anodyne	MME	46	39
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875171202	FF	On-Demand	Anodyne	MME	46	39
CCCCCCCNC(=O)C(=O)N[C@H](C)c1nc(C)cs1	ZINC000875171211	DF	On-Demand	Mild	ASAH1	74	34
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1nc(C)cs1	ZINC000875171212	DF	On-Demand	Mild	ASAH1	74	34
CN(C)C[C@@H]1CN(C(=O)NCc2cccc([N+](=O)[O-])c2)C[C@H]1CN(C)C	ZINC000875171226	FD	On-Demand	Bother	CACNA1C	59	38
CN(C)C[C@@H]1CN(C(=O)NCc2cccc([N+](=O)[O-])c2)C[C@H]1CN(C)C	ZINC000875171226	FD	On-Demand	Bother	CACNA1D	91	38
CC(=O)C1CCN(C(=O)C(=O)NCC2(c3cccc(C(F)(F)F)c3)CC2)CC1	ZINC000875171238	GF	On-Demand	Anodyne	TACR1	27	40
CC(=O)C1CCN(C(=O)C(=O)NCC2(c3cccc(C(F)(F)F)c3)CC2)CC1	ZINC000875171238	GF	On-Demand	Anodyne	CACNA1B	40	32
CC(=O)C1CCN(C(=O)C(=O)NCC2(c3cccc(C(F)(F)F)c3)CC2)CC1	ZINC000875171238	GF	On-Demand	Anodyne	CCR2	74	40
C[C@@H](NC(=O)NC1CCN(CC2CCCCC2)CC1)[C@H](O)C(F)(F)F	ZINC000875171285	FF	On-Demand	Anodyne	EPHX2	24	40
C[C@@H](NC(=O)NC1CCN(CC2CCCCC2)CC1)[C@@H](O)C(F)(F)F	ZINC000875171286	FF	On-Demand	Anodyne	EPHX2	24	40
C[C@H](NC(=O)NC1CCN(CC2CCCCC2)CC1)[C@@H](O)C(F)(F)F	ZINC000875171287	FF	On-Demand	Anodyne	EPHX2	24	40
C[C@H](NC(=O)NC1CCN(CC2CCCCC2)CC1)[C@H](O)C(F)(F)F	ZINC000875171288	FF	On-Demand	Anodyne	EPHX2	24	40
O=C(NCCCCCc1ccccc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875171290	DF	On-Demand	Anodyne	SIGMAR1	21	43
O=C(NCCCCCc1ccccc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875171290	DF	On-Demand	Anodyne	FAAH	25	40
O=C(NCCCCCc1ccccc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875171290	DF	On-Demand	Anodyne	AMP1_PLAFQ	22	44
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@@H]1C[C@H](CO)C1	ZINC000875171303	DE	On-Demand	Anodyne	EPHX2	18	49
C[C@@H](CCN(C)C)NC(=O)NNC(=O)COc1ccccc1Br	ZINC000875171307	GD	On-Demand	Reactive	UTS2	60	33
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C1([C@@H]2CCCCO2)CCC1	ZINC000875171329	EG	On-Demand	Anodyne	MAPK11	23	42
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C1([C@H]2CCCCO2)CCC1	ZINC000875171331	EG	On-Demand	Anodyne	MAPK11	23	42
Cc1ccc(C(=O)N(C)C)cc1NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875171365	FF	On-Demand	Anodyne	MAPK11	27	41
Cc1ccc(C(=O)N(C)C)cc1NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875171365	FF	On-Demand	Anodyne	MAPK14	35	41
Cc1ccc(C(=O)N(C)C)cc1NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875171369	FH	On-Demand	Anodyne	MAPK11	20	42
Cc1ccc(C(=O)N(C)C)cc1NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875171369	FH	On-Demand	Anodyne	MAPK14	16	42
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@H]1Cc2ccccc2NC1=O	ZINC000875171394	GF	On-Demand	Anodyne	SIGMAR1	25	41
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@@H]1Cc2ccccc2NC1=O	ZINC000875171396	GF	On-Demand	Anodyne	SIGMAR1	25	41
COc1cccc(C(C)(C)C(=O)Nc2cc(C(=O)N(C)C)ccc2C)c1	ZINC000875171446	FH	On-Demand	Anodyne	DRD4	40	31
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875171456	FD	On-Demand	Anodyne	SIGMAR1	22	43
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875171456	FD	On-Demand	Anodyne	CACNA1G	23	40
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)C(=O)N[C@H]1CC12CCC2	ZINC000875171457	FD	On-Demand	Anodyne	SIGMAR1	22	43
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)C(=O)N[C@H]1CC12CCC2	ZINC000875171457	FD	On-Demand	Anodyne	CACNA1G	23	40
O=C(NCc1cccc([N+](=O)[O-])c1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875171465	EF	On-Demand	Bother	CACNA1C	50	38
O=C(NCc1cccc([N+](=O)[O-])c1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875171465	EF	On-Demand	Bother	CACNA1D	76	38
O=C(NCc1cccc([N+](=O)[O-])c1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875171465	EF	On-Demand	Bother	LUXR	17	43
O=C(NCc1cccc([N+](=O)[O-])c1)NC1([C@H]2CCCCO2)CCC1	ZINC000875171466	EF	On-Demand	Bother	CACNA1C	50	38
O=C(NCc1cccc([N+](=O)[O-])c1)NC1([C@H]2CCCCO2)CCC1	ZINC000875171466	EF	On-Demand	Bother	CACNA1D	76	38
O=C(NCc1cccc([N+](=O)[O-])c1)NC1([C@H]2CCCCO2)CCC1	ZINC000875171466	EF	On-Demand	Bother	LUXR	17	43
C[C@H](NC(=O)C(=O)NCC1(c2ccc(Cl)cc2)CC1)c1ccnn1C	ZINC000875171474	FE	On-Demand	Anodyne	CCR1	41	34
O=C(NCc1cccc([N+](=O)[O-])c1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875171477	FF	On-Demand	Bother	CACNA1C	50	38
O=C(NCc1cccc([N+](=O)[O-])c1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875171477	FF	On-Demand	Bother	CACNA1D	73	38
O=C(NCCCCC1CC1)C(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000875171491	GD	On-Demand	Anodyne	ACHE	43	45
O=C(NCCCCC1CC1)C(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000875171491	GD	On-Demand	Anodyne	SIGMAR1	27	45
O=C(NCCCCC1CC1)C(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000875171491	GD	On-Demand	Anodyne	MCHR1	25	40
COc1ccc(CC[C@H](C)NC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171503	EG	On-Demand	Anodyne	MMP13	34	43
COc1ccc(CC[C@H](C)NC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171503	EG	On-Demand	Anodyne	CACNA1B	40	38
COc1ccc(CC[C@H](C)NC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171503	EG	On-Demand	Anodyne	MMP8	22	43
COc1ccc(CC[C@H](C)NC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171503	EG	On-Demand	Anodyne	REN	20	44
COc1ccc(CC[C@H](C)NC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171503	EG	On-Demand	Anodyne	MMP9	30	40
COc1ccc(CC[C@H](C)NC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171503	EG	On-Demand	Anodyne	DPP7	29	43
COc1ccc(CC[C@H](C)NC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171503	EG	On-Demand	Anodyne	MMP1	45	40
COc1ccc(CC[C@H](C)NC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171503	EG	On-Demand	Anodyne	BIRC2	51	51
COc1ccc(CC[C@H](C)NC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171503	EG	On-Demand	Anodyne	Q9N6S8_PLAFA	16	41
COc1ccc(CC[C@@H](C)NC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171504	EG	On-Demand	Anodyne	MMP13	34	43
COc1ccc(CC[C@@H](C)NC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171504	EG	On-Demand	Anodyne	CACNA1B	40	38
COc1ccc(CC[C@@H](C)NC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171504	EG	On-Demand	Anodyne	MMP8	22	43
COc1ccc(CC[C@@H](C)NC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171504	EG	On-Demand	Anodyne	REN	20	44
COc1ccc(CC[C@@H](C)NC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171504	EG	On-Demand	Anodyne	MMP9	30	40
COc1ccc(CC[C@@H](C)NC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171504	EG	On-Demand	Anodyne	DPP7	29	43
COc1ccc(CC[C@@H](C)NC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171504	EG	On-Demand	Anodyne	MMP1	45	40
COc1ccc(CC[C@@H](C)NC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171504	EG	On-Demand	Anodyne	BIRC2	51	51
COc1ccc(CC[C@@H](C)NC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875171504	EG	On-Demand	Anodyne	Q9N6S8_PLAFA	16	41
COc1ccc(CC[C@H](C)NC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875171505	EG	On-Demand	Anodyne	MMP13	34	43
COc1ccc(CC[C@H](C)NC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875171505	EG	On-Demand	Anodyne	CACNA1B	40	38
COc1ccc(CC[C@H](C)NC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875171505	EG	On-Demand	Anodyne	MMP8	22	43
COc1ccc(CC[C@H](C)NC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875171505	EG	On-Demand	Anodyne	REN	20	44
COc1ccc(CC[C@H](C)NC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875171505	EG	On-Demand	Anodyne	MMP9	30	40
COc1ccc(CC[C@H](C)NC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875171505	EG	On-Demand	Anodyne	DPP7	29	43
COc1ccc(CC[C@H](C)NC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875171505	EG	On-Demand	Anodyne	MMP1	45	40
COc1ccc(CC[C@H](C)NC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875171505	EG	On-Demand	Anodyne	BIRC2	51	51
COc1ccc(CC[C@H](C)NC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875171505	EG	On-Demand	Anodyne	Q9N6S8_PLAFA	16	41
COc1ccc(CC[C@@H](C)NC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875171506	EG	On-Demand	Anodyne	MMP13	34	43
COc1ccc(CC[C@@H](C)NC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875171506	EG	On-Demand	Anodyne	CACNA1B	40	38
COc1ccc(CC[C@@H](C)NC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875171506	EG	On-Demand	Anodyne	MMP8	22	43
COc1ccc(CC[C@@H](C)NC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875171506	EG	On-Demand	Anodyne	REN	20	44
COc1ccc(CC[C@@H](C)NC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875171506	EG	On-Demand	Anodyne	MMP9	30	40
COc1ccc(CC[C@@H](C)NC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875171506	EG	On-Demand	Anodyne	DPP7	29	43
COc1ccc(CC[C@@H](C)NC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875171506	EG	On-Demand	Anodyne	MMP1	45	40
COc1ccc(CC[C@@H](C)NC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875171506	EG	On-Demand	Anodyne	BIRC2	51	51
COc1ccc(CC[C@@H](C)NC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875171506	EG	On-Demand	Anodyne	Q9N6S8_PLAFA	16	41
O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875171507	FG	On-Demand	Bother	CACNA1C	50	36
O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875171507	FG	On-Demand	Bother	CACNA1D	71	36
O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875171507	FG	On-Demand	Bother	PREP	33	42
O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875171507	FG	On-Demand	Bother	TMPRSS11D	50	32
O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875171508	FG	On-Demand	Bother	CACNA1C	50	36
O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875171508	FG	On-Demand	Bother	CACNA1D	71	36
O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875171508	FG	On-Demand	Bother	PREP	33	42
O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875171508	FG	On-Demand	Bother	TMPRSS11D	50	32
O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875171509	FG	On-Demand	Bother	CACNA1C	50	36
O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875171509	FG	On-Demand	Bother	CACNA1D	71	36
O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875171509	FG	On-Demand	Bother	PREP	33	42
O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875171509	FG	On-Demand	Bother	TMPRSS11D	50	32
O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875171510	FG	On-Demand	Bother	CACNA1C	50	36
O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875171510	FG	On-Demand	Bother	CACNA1D	71	36
O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875171510	FG	On-Demand	Bother	PREP	33	42
O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875171510	FG	On-Demand	Bother	TMPRSS11D	50	32
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875171522	GD	On-Demand	Anodyne	SIGMAR1	23	44
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)NCC[C@H]1CCSC1	ZINC000875171523	EF	On-Demand	Anodyne	MME	49	37
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)NCC[C@H]1CCSC1	ZINC000875171523	EF	On-Demand	Anodyne	TIMP3	43	32
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)NCC[C@@H]1CCSC1	ZINC000875171524	EF	On-Demand	Anodyne	MME	49	37
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)NCC[C@@H]1CCSC1	ZINC000875171524	EF	On-Demand	Anodyne	TIMP3	43	32
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)NCC[C@H]1CCSC1	ZINC000875171525	EF	On-Demand	Anodyne	MME	49	37
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)NCC[C@H]1CCSC1	ZINC000875171525	EF	On-Demand	Anodyne	TIMP3	43	32
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)NCC[C@@H]1CCSC1	ZINC000875171526	EF	On-Demand	Anodyne	MME	49	37
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)NCC[C@@H]1CCSC1	ZINC000875171526	EF	On-Demand	Anodyne	TIMP3	43	32
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H](C)CCN(C)C)CC1	ZINC000875171549	EG	On-Demand	Anodyne	RBP4	34	40
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H](C)CCN(C)C)CC1	ZINC000875171550	EG	On-Demand	Anodyne	RBP4	34	40
COc1ccccc1[C@H]1CCCN(C(=O)N[C@@H](C)CCN(C)C)CC1	ZINC000875171551	EG	On-Demand	Anodyne	RBP4	34	40
COc1ccccc1[C@H]1CCCN(C(=O)N[C@H](C)CCN(C)C)CC1	ZINC000875171552	EG	On-Demand	Anodyne	RBP4	34	40
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875171574	GG	On-Demand	Anodyne	CTSK	16	49
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875171574	GG	On-Demand	Anodyne	CAPN2	54	31
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875171574	GG	On-Demand	Anodyne	NPR	58	33
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875171574	GG	On-Demand	Anodyne	SLC12A5	41	33
C[C@@H](CCN(C)C)NC(=O)NNc1cccc(F)c1Br	ZINC000875171575	EF	On-Demand	Reactive	UTS2	54	33
C[C@@H](CCN(C)C)NC(=O)N[C@](C)(CO)Cc1ccc(Cl)cc1	ZINC000875171630	EE	On-Demand	Anodyne	UTS2	49	40
C[C@@H](CCN(C)C)NC(=O)N[C@@](C)(CO)Cc1ccc(Cl)cc1	ZINC000875171632	EE	On-Demand	Anodyne	UTS2	49	40
O=C(NCc1ccccc1OCCN1CCOCC1)NC[C@H]1C[C@H](O)C1	ZINC000875171645	FC	On-Demand	Anodyne	EPHX2	31	42
COC1CC(C(=O)Nc2ccc(N3C(=O)c4ccccc4C3=O)c(Cl)c2)C1	ZINC000875171649	GH	On-Demand	Anodyne	NPY2R	55	42
COC1CC(C(=O)Nc2ccc(N3C(=O)c4ccccc4C3=O)c(Cl)c2)C1	ZINC000875171649	GH	On-Demand	Anodyne	GRM4	47	54
COCCNS(=O)(=O)c1ccc(C(=O)OCCC(N)=O)cc1	ZINC000875171660	EB	On-Demand	Anodyne	CA2	21	50
COCCNS(=O)(=O)c1ccc(C(=O)OCCC(N)=O)cc1	ZINC000875171660	EB	On-Demand	Anodyne	CA1	16	50
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875171694	DF	On-Demand	Anodyne	MME	55	45
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875171694	DF	On-Demand	Anodyne	TACR2	53	35
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875171694	DF	On-Demand	Anodyne	TIMP3	59	35
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875171694	DF	On-Demand	Anodyne	CAPNS1	56	32
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875171694	DF	On-Demand	Anodyne	CAPN1	40	35
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875171695	DF	On-Demand	Anodyne	MME	55	45
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875171695	DF	On-Demand	Anodyne	TACR2	53	35
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875171695	DF	On-Demand	Anodyne	TIMP3	59	35
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875171695	DF	On-Demand	Anodyne	CAPNS1	56	32
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875171695	DF	On-Demand	Anodyne	CAPN1	40	35
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875171696	DF	On-Demand	Anodyne	MME	55	45
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875171696	DF	On-Demand	Anodyne	TACR2	53	35
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875171696	DF	On-Demand	Anodyne	TIMP3	59	35
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875171696	DF	On-Demand	Anodyne	CAPNS1	56	32
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875171696	DF	On-Demand	Anodyne	CAPN1	40	35
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875171697	DF	On-Demand	Anodyne	MME	55	45
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875171697	DF	On-Demand	Anodyne	TACR2	53	35
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875171697	DF	On-Demand	Anodyne	TIMP3	59	35
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875171697	DF	On-Demand	Anodyne	CAPNS1	56	32
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875171697	DF	On-Demand	Anodyne	CAPN1	40	35
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875171766	FD	On-Demand	Anodyne	GHRHR	51	32
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875171766	FD	On-Demand	Anodyne	MME	68	47
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875171766	FD	On-Demand	Anodyne	TACR2	52	32
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875171766	FD	On-Demand	Anodyne	TIMP3	72	35
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875171766	FD	On-Demand	Anodyne	CAPNS1	68	34
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875171766	FD	On-Demand	Anodyne	CAPN1	52	37
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875171766	FD	On-Demand	Anodyne	CAPN2	51	33
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875171767	FD	On-Demand	Anodyne	GHRHR	51	32
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875171767	FD	On-Demand	Anodyne	MME	68	47
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875171767	FD	On-Demand	Anodyne	TACR2	52	32
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875171767	FD	On-Demand	Anodyne	TIMP3	72	35
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875171767	FD	On-Demand	Anodyne	CAPNS1	68	34
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875171767	FD	On-Demand	Anodyne	CAPN1	52	37
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875171767	FD	On-Demand	Anodyne	CAPN2	51	33
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)CCc1ccc(OC)cc1	ZINC000875171773	DF	On-Demand	Anodyne	ADRB1	16	46
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)CCc1ccc(OC)cc1	ZINC000875171773	DF	On-Demand	Anodyne	MMP2	15	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)CCc1ccc(OC)cc1	ZINC000875171773	DF	On-Demand	Anodyne	MMP3	25	43
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)CCc1ccc(OC)cc1	ZINC000875171773	DF	On-Demand	Anodyne	MMP1	24	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)CCc1ccc(OC)cc1	ZINC000875171774	DF	On-Demand	Anodyne	ADRB1	16	46
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)CCc1ccc(OC)cc1	ZINC000875171774	DF	On-Demand	Anodyne	MMP2	15	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)CCc1ccc(OC)cc1	ZINC000875171774	DF	On-Demand	Anodyne	MMP3	25	43
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)CCc1ccc(OC)cc1	ZINC000875171774	DF	On-Demand	Anodyne	MMP1	24	40
COc1ccc(CC[C@@H](C)NC(=O)N2CC(CNC(=O)C(F)(F)F)C2)cc1	ZINC000875171776	GE	On-Demand	Anodyne	NQO2	18	44
COc1ccc(CC[C@H](C)NC(=O)N2CC(CNC(=O)C(F)(F)F)C2)cc1	ZINC000875171777	GE	On-Demand	Anodyne	NQO2	18	44
COc1ccc(CC[C@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)cc1	ZINC000875171800	GD	On-Demand	Anodyne	NQO2	20	42
COc1ccc(CC[C@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)cc1	ZINC000875171800	GD	On-Demand	Anodyne	MTNR1A	36	44
COc1ccc(CC[C@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)cc1	ZINC000875171800	GD	On-Demand	Anodyne	MTNR1B	34	40
COc1ccc(CC[C@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)cc1	ZINC000875171800	GD	On-Demand	Anodyne	DPP7	27	41
COc1ccc(CC[C@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)cc1	ZINC000875171800	GD	On-Demand	Anodyne	CACNA1G	24	44
COc1ccc(CC[C@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)cc1	ZINC000875171800	GD	On-Demand	Anodyne	BIRC2	24	41
COc1ccc(CC[C@@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)cc1	ZINC000875171801	GD	On-Demand	Anodyne	NQO2	20	42
COc1ccc(CC[C@@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)cc1	ZINC000875171801	GD	On-Demand	Anodyne	MTNR1A	36	44
COc1ccc(CC[C@@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)cc1	ZINC000875171801	GD	On-Demand	Anodyne	MTNR1B	34	40
COc1ccc(CC[C@@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)cc1	ZINC000875171801	GD	On-Demand	Anodyne	DPP7	27	41
COc1ccc(CC[C@@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)cc1	ZINC000875171801	GD	On-Demand	Anodyne	CACNA1G	24	44
COc1ccc(CC[C@@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)cc1	ZINC000875171801	GD	On-Demand	Anodyne	BIRC2	24	41
COc1ccc(CC[C@H](C)NC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875171805	EG	On-Demand	Clean	BMP1	45	34
COc1ccc(CC[C@H](C)NC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875171805	EG	On-Demand	Clean	MMP3	47	38
COc1ccc(CC[C@H](C)NC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875171805	EG	On-Demand	Clean	MMP1	51	38
COc1ccc(CC[C@H](C)NC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875171805	EG	On-Demand	Clean	PSMB8	46	33
COc1ccc(CC[C@@H](C)NC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875171806	EG	On-Demand	Clean	BMP1	45	34
COc1ccc(CC[C@@H](C)NC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875171806	EG	On-Demand	Clean	MMP3	47	38
COc1ccc(CC[C@@H](C)NC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875171806	EG	On-Demand	Clean	MMP1	51	38
COc1ccc(CC[C@@H](C)NC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875171806	EG	On-Demand	Clean	PSMB8	46	33
Cc1ccc(OC[C@H](C)NC(=O)N2CCc3nc(C4CC4)ncc3C2)cc1	ZINC000875171816	FG	On-Demand	Anodyne	MAPK1	51	38
Cc1ccc(OC[C@@H](C)NC(=O)N2CCc3nc(C4CC4)ncc3C2)cc1	ZINC000875171817	FG	On-Demand	Anodyne	MAPK1	51	38
Cc1ccc(OC[C@H](C)NC(=O)N2CCC[C@@H]2Cn2ccnc2)cc1	ZINC000875171823	EF	On-Demand	Anodyne	CYP26A1	61	34
Cc1ccc(OC[C@@H](C)NC(=O)N2CCC[C@@H]2Cn2ccnc2)cc1	ZINC000875171824	EF	On-Demand	Anodyne	CYP26A1	61	34
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CC[C@@H]2[C@H](CCN2C)C1	ZINC000875171826	FE	On-Demand	Anodyne	TACR2	47	33
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CC[C@@H]2[C@@H](CCN2C)C1	ZINC000875171827	FE	On-Demand	Anodyne	TACR2	47	33
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CC[C@H]2[C@@H](CCN2C)C1	ZINC000875171828	FE	On-Demand	Anodyne	TACR2	47	33
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CC[C@H]2[C@H](CCN2C)C1	ZINC000875171829	FE	On-Demand	Anodyne	TACR2	47	33
O=CN1CCCN(C(=O)NCc2cccc([N+](=O)[O-])c2)CC1	ZINC000875171839	DC	On-Demand	Bother	CACNA1C	44	36
O=CN1CCCN(C(=O)NCc2cccc([N+](=O)[O-])c2)CC1	ZINC000875171839	DC	On-Demand	Bother	CACNA1D	65	36
Cc1ccc(OC[C@@H](C)NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875171846	ED	On-Demand	Anodyne	BIRC2	35	41
Cc1ccc(OC[C@H](C)NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875171847	ED	On-Demand	Anodyne	BIRC2	35	41
Cc1ccn(C[C@H](C)C(=O)Nc2ccccc2-n2cnnn2)n1	ZINC000875171862	DD	On-Demand	Anodyne	KCNQ2	40	33
CCO[C@@H](C(=O)Nc1ccccc1-n1cnnn1)[C@@H]1CCOC1	ZINC000875171886	DD	On-Demand	Anodyne	KCNQ2	45	35
CCO[C@@H](C(=O)Nc1ccccc1-n1cnnn1)[C@H]1CCOC1	ZINC000875171894	DD	On-Demand	Anodyne	KCNQ2	45	35
O=C(NC1CCN(CC2CCCCC2)CC1)NC1CN(c2ccncn2)C1	ZINC000875171901	FE	On-Demand	Anodyne	CCR3	15	41
O=C(NC1CCN(CC2CCCCC2)CC1)NC1CN(c2ccncn2)C1	ZINC000875171901	FE	On-Demand	Anodyne	EPHX2	21	41
CCC(CC)(CNC(=O)NCc1cc(OC)c(O)c(OC)c1)C(F)(F)F	ZINC000875171919	GH	On-Demand	Anodyne	TRPV1	15	44
CCO[C@@H](C(=O)Nc1ccccc1-n1cnnn1)C1CCCC1	ZINC000875171944	DE	On-Demand	Anodyne	KCNQ2	56	38
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1ccc2c(c1)CC(=O)N2C	ZINC000875171946	FE	On-Demand	Mild	ASAH1	89	38
CCCCCCCNC(=O)C(=O)N[C@H](C)c1ccc2c(c1)CC(=O)N2C	ZINC000875171949	FE	On-Demand	Mild	ASAH1	89	38
CC(=O)C1CCN(C(=O)C(=O)NCCCCCc2ccccc2)CC1	ZINC000875171965	EE	On-Demand	Anodyne	FKBP1A	45	47
CC(=O)C1CCN(C(=O)C(=O)NCCCCCc2ccccc2)CC1	ZINC000875171965	EE	On-Demand	Anodyne	OPRM1	15	40
CC(=O)C1CCN(C(=O)C(=O)NCCCCCc2ccccc2)CC1	ZINC000875171965	EE	On-Demand	Anodyne	SIGMAR1	31	42
CC(=O)C1CCN(C(=O)C(=O)NCCCCCc2ccccc2)CC1	ZINC000875171965	EE	On-Demand	Anodyne	SCN2A	20	40
CC(=O)C1CCN(C(=O)C(=O)NCCCCCc2ccccc2)CC1	ZINC000875171965	EE	On-Demand	Anodyne	PREP	47	39
CC(=O)C1CCN(C(=O)C(=O)NCCCCCc2ccccc2)CC1	ZINC000875171965	EE	On-Demand	Anodyne	FAAH	35	40
CC(=O)C1CCN(C(=O)C(=O)NCCCCCc2ccccc2)CC1	ZINC000875171965	EE	On-Demand	Anodyne	AMP1_PLAFQ	27	45
CC(=O)C1CCN(C(=O)C(=O)NCCCCCc2ccccc2)CC1	ZINC000875171965	EE	On-Demand	Anodyne	CACNA1G	16	40
C[C@@H](CCN(C)C)NC(=O)NC1CC(Nc2ccccc2)C1	ZINC000875171966	DE	On-Demand	Anodyne	UTS2	53	35
Cc1ccc(C(=O)N(C)C)cc1NC(=O)c1c(C)ccc([N+](=O)[O-])c1C	ZINC000875171977	FG	On-Demand	Bother	MAPK11	18	41
Cc1ccc(C(=O)N(C)C)cc1NC(=O)c1c(C)ccc([N+](=O)[O-])c1C	ZINC000875171977	FG	On-Demand	Bother	MAPK14	16	41
COC(=O)C1(O)CN(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000875171996	GB	On-Demand	Clean	HTR1A	51	49
COC(=O)C1(O)CN(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000875171996	GB	On-Demand	Clean	DRD2	40	43
COC(=O)C1(O)CN(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000875171996	GB	On-Demand	Clean	DRD4	59	49
COC(=O)C1(O)CN(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000875171996	GB	On-Demand	Clean	HTR2A	27	46
COC(=O)C1(O)CN(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000875171996	GB	On-Demand	Clean	HTR2C	15	41
COC(=O)C1(O)CN(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000875171996	GB	On-Demand	Clean	DRD3	63	48
COC(=O)C1(O)CN(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000875171996	GB	On-Demand	Clean	HTR7	42	46
O=C1c2ccccc2C(=O)N1c1ccc(NC(=O)C23CC(C2)C3)cc1Cl	ZINC000875172025	FH	On-Demand	Anodyne	NPY2R	46	43
O=C1c2ccccc2C(=O)N1c1ccc(NC(=O)C23CC(C2)C3)cc1Cl	ZINC000875172025	FH	On-Demand	Anodyne	GRM4	45	60
O=C1c2ccccc2C(=O)N1c1ccc(NC(=O)C23CC(C2)C3)cc1Cl	ZINC000875172025	FH	On-Demand	Anodyne	HEMY	44	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1ccc(C)cc1)N(C)C	ZINC000875172046	FE	On-Demand	Anodyne	SLC6A4	25	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1ccc(C)cc1)N(C)C	ZINC000875172046	FE	On-Demand	Anodyne	SLC6A3	56	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1ccc(C)cc1)N(C)C	ZINC000875172047	FE	On-Demand	Anodyne	SLC6A4	25	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1ccc(C)cc1)N(C)C	ZINC000875172047	FE	On-Demand	Anodyne	SLC6A3	56	44
Cc1nnc(NNC(=O)NCCc2ccccc2Cl)n1C	ZINC000875172082	DD	On-Demand	Reactive	P2RX7	19	44
CCn1nc(C)c(CNC(=O)C(=O)NCc2ccc(OC(F)F)cc2F)c1C	ZINC000875172104	GE	On-Demand	Anodyne	P2RX7	39	50
COc1ccc(CC[C@H](C)NC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875172120	ED	On-Demand	Anodyne	MMP13	29	43
COc1ccc(CC[C@H](C)NC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875172120	ED	On-Demand	Anodyne	MMP9	32	43
COc1ccc(CC[C@H](C)NC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875172120	ED	On-Demand	Anodyne	DPP7	37	44
COc1ccc(CC[C@H](C)NC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875172120	ED	On-Demand	Anodyne	MMP1	44	43
COc1ccc(CC[C@H](C)NC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875172120	ED	On-Demand	Anodyne	BIRC2	29	42
COc1ccc(CC[C@H](C)NC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875172120	ED	On-Demand	Anodyne	PSMB8	47	32
COc1ccc(CC[C@H](C)NC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875172120	ED	On-Demand	Anodyne	Q9N6S8_PLAFA	16	40
COc1ccc(CC[C@H](C)NC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875172120	ED	On-Demand	Anodyne	Q6PRC7_IXORI	44	35
COc1ccc(CC[C@@H](C)NC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875172121	ED	On-Demand	Anodyne	MMP13	29	43
COc1ccc(CC[C@@H](C)NC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875172121	ED	On-Demand	Anodyne	MMP9	32	43
COc1ccc(CC[C@@H](C)NC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875172121	ED	On-Demand	Anodyne	DPP7	37	44
COc1ccc(CC[C@@H](C)NC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875172121	ED	On-Demand	Anodyne	MMP1	44	43
COc1ccc(CC[C@@H](C)NC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875172121	ED	On-Demand	Anodyne	BIRC2	29	42
COc1ccc(CC[C@@H](C)NC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875172121	ED	On-Demand	Anodyne	PSMB8	47	32
COc1ccc(CC[C@@H](C)NC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875172121	ED	On-Demand	Anodyne	Q9N6S8_PLAFA	16	40
COc1ccc(CC[C@@H](C)NC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875172121	ED	On-Demand	Anodyne	Q6PRC7_IXORI	44	35
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1ccc(C)cc1)N(C)C	ZINC000875172148	FE	On-Demand	Anodyne	SLC6A4	25	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1ccc(C)cc1)N(C)C	ZINC000875172148	FE	On-Demand	Anodyne	SLC6A3	56	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1ccc(C)cc1)N(C)C	ZINC000875172149	FE	On-Demand	Anodyne	SLC6A4	25	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1ccc(C)cc1)N(C)C	ZINC000875172149	FE	On-Demand	Anodyne	SLC6A3	56	44
COCCN(CC1CCN(C)CC1)C(=O)N[C@H](C)CCc1ccc(OC)cc1	ZINC000875172156	GG	On-Demand	Anodyne	MMP13	24	43
COCCN(CC1CCN(C)CC1)C(=O)N[C@H](C)CCc1ccc(OC)cc1	ZINC000875172156	GG	On-Demand	Anodyne	MMP3	31	43
COCCN(CC1CCN(C)CC1)C(=O)N[C@H](C)CCc1ccc(OC)cc1	ZINC000875172156	GG	On-Demand	Anodyne	MMP1	30	43
COCCN(CC1CCN(C)CC1)C(=O)N[C@H](C)CCc1ccc(OC)cc1	ZINC000875172156	GG	On-Demand	Anodyne	MCHR1	16	46
COCCN(CC1CCN(C)CC1)C(=O)N[C@H](C)CCc1ccc(OC)cc1	ZINC000875172156	GG	On-Demand	Anodyne	BIRC2	21	42
COCCN(CC1CCN(C)CC1)C(=O)N[C@H](C)CCc1ccc(OC)cc1	ZINC000875172156	GG	On-Demand	Anodyne	PSMB8	40	32
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H](C)CCc1ccc(OC)cc1	ZINC000875172157	GG	On-Demand	Anodyne	MMP13	24	43
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H](C)CCc1ccc(OC)cc1	ZINC000875172157	GG	On-Demand	Anodyne	MMP3	31	43
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H](C)CCc1ccc(OC)cc1	ZINC000875172157	GG	On-Demand	Anodyne	MMP1	30	43
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H](C)CCc1ccc(OC)cc1	ZINC000875172157	GG	On-Demand	Anodyne	MCHR1	16	46
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H](C)CCc1ccc(OC)cc1	ZINC000875172157	GG	On-Demand	Anodyne	BIRC2	21	42
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H](C)CCc1ccc(OC)cc1	ZINC000875172157	GG	On-Demand	Anodyne	PSMB8	40	32
O=C(NCCCCCc1ccccc1)C(=O)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875172205	FF	On-Demand	Anodyne	AMP1_PLAFQ	19	42
O=C(NCCCCCc1ccccc1)C(=O)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875172207	FF	On-Demand	Anodyne	AMP1_PLAFQ	19	42
O=C(NCCCCCc1ccccc1)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875172209	FF	On-Demand	Anodyne	AMP1_PLAFQ	19	42
O=C(NCCCCCc1ccccc1)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875172211	FF	On-Demand	Anodyne	AMP1_PLAFQ	19	42
COc1ccc(CC[C@H](C)NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875172271	FE	On-Demand	Anodyne	DRD4	19	43
COc1ccc(CC[C@H](C)NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875172271	FE	On-Demand	Anodyne	CCR3	37	41
COc1ccc(CC[C@H](C)NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875172271	FE	On-Demand	Anodyne	PDK1	40	35
COc1ccc(CC[C@H](C)NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875172271	FE	On-Demand	Anodyne	MCHR1	26	43
COc1ccc(CC[C@H](C)NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875172271	FE	On-Demand	Anodyne	BIRC2	54	53
COc1ccc(CC[C@@H](C)NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875172274	FE	On-Demand	Anodyne	DRD4	19	43
COc1ccc(CC[C@@H](C)NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875172274	FE	On-Demand	Anodyne	CCR3	37	41
COc1ccc(CC[C@@H](C)NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875172274	FE	On-Demand	Anodyne	PDK1	40	35
COc1ccc(CC[C@@H](C)NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875172274	FE	On-Demand	Anodyne	MCHR1	26	43
COc1ccc(CC[C@@H](C)NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875172274	FE	On-Demand	Anodyne	BIRC2	54	53
C[C@@H](CCN(C)C)NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875172295	EE	On-Demand	Mild	ITK	19	50
O=C(NCCCCCc1ccccc1)C(=O)NCC[C@H]1CCSC1	ZINC000875172358	EF	On-Demand	Anodyne	FAAH	36	40
O=C(NCCCCCc1ccccc1)C(=O)NCC[C@H]1CCSC1	ZINC000875172358	EF	On-Demand	Anodyne	CES1	46	35
O=C(NCCCCCc1ccccc1)C(=O)NCC[C@H]1CCSC1	ZINC000875172358	EF	On-Demand	Anodyne	AMP1_PLAFQ	22	44
O=C(NCCCCCc1ccccc1)C(=O)NCC[C@@H]1CCSC1	ZINC000875172360	EF	On-Demand	Anodyne	FAAH	36	40
O=C(NCCCCCc1ccccc1)C(=O)NCC[C@@H]1CCSC1	ZINC000875172360	EF	On-Demand	Anodyne	CES1	46	35
O=C(NCCCCCc1ccccc1)C(=O)NCC[C@@H]1CCSC1	ZINC000875172360	EF	On-Demand	Anodyne	AMP1_PLAFQ	22	44
COc1ccc(CC[C@@H](C)NC(=O)N(C)CCN2CC3(CCOCC3)C2)cc1	ZINC000875172365	GF	On-Demand	Anodyne	PSMB8	45	38
COc1ccc(CC[C@H](C)NC(=O)N(C)CCN2CC3(CCOCC3)C2)cc1	ZINC000875172367	GF	On-Demand	Anodyne	PSMB8	45	38
O=C(NCCc1ccccc1Cl)N1CCC(CO)(CO)CC1	ZINC000875172447	ED	On-Demand	Anodyne	EPHX2	20	47
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)CCc2ccc(OC)cc2)C1	ZINC000875172460	FF	On-Demand	Anodyne	ACE	23	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)CCc2ccc(OC)cc2)C1	ZINC000875172460	FF	On-Demand	Anodyne	MMP3	45	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)CCc2ccc(OC)cc2)C1	ZINC000875172460	FF	On-Demand	Anodyne	MMP1	44	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)CCc2ccc(OC)cc2)C1	ZINC000875172460	FF	On-Demand	Anodyne	BIRC2	25	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)CCc2ccc(OC)cc2)C1	ZINC000875172460	FF	On-Demand	Anodyne	PSMB8	40	31
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)CCc2ccc(OC)cc2)C1	ZINC000875172461	FF	On-Demand	Anodyne	ACE	23	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)CCc2ccc(OC)cc2)C1	ZINC000875172461	FF	On-Demand	Anodyne	MMP3	45	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)CCc2ccc(OC)cc2)C1	ZINC000875172461	FF	On-Demand	Anodyne	MMP1	44	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)CCc2ccc(OC)cc2)C1	ZINC000875172461	FF	On-Demand	Anodyne	BIRC2	25	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)CCc2ccc(OC)cc2)C1	ZINC000875172461	FF	On-Demand	Anodyne	PSMB8	40	31
O=C(NCc1cccc([N+](=O)[O-])c1)NC1CC(Nc2ccccc2)C1	ZINC000875172480	EG	On-Demand	Bother	CACNA1C	60	44
O=C(NCc1cccc([N+](=O)[O-])c1)NC1CC(Nc2ccccc2)C1	ZINC000875172480	EG	On-Demand	Bother	CACNA1D	90	44
O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875172481	EG	On-Demand	Bother	CACNA1C	57	37
O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875172481	EG	On-Demand	Bother	CACNA1D	87	37
O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875172481	EG	On-Demand	Bother	EPHX2	22	40
O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875172482	EG	On-Demand	Bother	CACNA1C	57	37
O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875172482	EG	On-Demand	Bother	CACNA1D	87	37
O=C(NCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875172482	EG	On-Demand	Bother	EPHX2	22	40
COC(=O)C1(O)CN(C(=O)N[C@H](C)CCc2ccc(OC)cc2)C1	ZINC000875172495	EC	On-Demand	Anodyne	PSMB8	45	31
COC(=O)C1(O)CN(C(=O)N[C@@H](C)CCc2ccc(OC)cc2)C1	ZINC000875172496	EC	On-Demand	Anodyne	PSMB8	45	31
CC[C@H](C[C@H](C)O)NC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000875172518	GD	On-Demand	Clean	HTR1A	39	47
CC[C@H](C[C@H](C)O)NC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000875172518	GD	On-Demand	Clean	DRD2	29	40
CC[C@H](C[C@H](C)O)NC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000875172518	GD	On-Demand	Clean	DRD4	56	47
CC[C@H](C[C@H](C)O)NC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000875172518	GD	On-Demand	Clean	HTR2A	21	42
CC[C@H](C[C@H](C)O)NC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000875172518	GD	On-Demand	Clean	DRD3	50	46
CC[C@H](C[C@H](C)O)NC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000875172518	GD	On-Demand	Clean	HTR7	31	42
C[C@@H](CCN(C)C)NC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875172543	EF	On-Demand	Mild	UTS2	73	37
C[C@@H](CCN(C)C)NC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875172545	EF	On-Demand	Mild	UTS2	73	37
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@@H]1CCO[C@H]1c1cc[nH]n1	ZINC000875172546	GF	On-Demand	Anodyne	CCR3	44	36
C[C@@H](CCN(C)C)NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875172567	DD	On-Demand	Anodyne	UTS2	47	34
CCC[C@@H](CC)C(=O)Nc1ccccc1-n1cnnn1	ZINC000875172596	CE	On-Demand	Anodyne	KCNQ2	55	42
CCC[C@H](CC)C(=O)Nc1ccccc1-n1cnnn1	ZINC000875172597	CE	On-Demand	Anodyne	KCNQ2	55	42
CN1CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)CCC1(C)C	ZINC000875172600	DE	On-Demand	Bother	CACNA1C	59	37
CN1CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)CCC1(C)C	ZINC000875172600	DE	On-Demand	Bother	CACNA1D	90	37
O=C(NCc1cccc([N+](=O)[O-])c1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875172604	EE	On-Demand	Bother	CACNA1C	47	37
O=C(NCc1cccc([N+](=O)[O-])c1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875172604	EE	On-Demand	Bother	CACNA1D	70	37
NC(=O)CN(C(=O)c1cc2ncc(Br)cn2n1)C1CCCC1	ZINC000875172621	FD	On-Demand	Anodyne	ACE	40	33
Cc1csc([C@H](C)NC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)n1	ZINC000875172629	FF	On-Demand	Anodyne	GHRHR	41	40
C[C@@H](CCN(C)C)NC(=O)N1Cc2cccc(O)c2C1	ZINC000875172631	CD	On-Demand	Clean	UTS2	68	35
Cc1csc([C@H](C)NC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)n1	ZINC000875172632	FF	On-Demand	Anodyne	GHRHR	41	40
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1	ZINC000875172650	FF	On-Demand	Anodyne	MME	48	42
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1	ZINC000875172650	FF	On-Demand	Anodyne	TACR2	49	33
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1	ZINC000875172650	FF	On-Demand	Anodyne	TIMP3	75	38
CCC[C@H](Cc1ccccc1)NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1	ZINC000875172650	FF	On-Demand	Anodyne	CAPNS1	43	31
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1	ZINC000875172651	FF	On-Demand	Anodyne	MME	48	42
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1	ZINC000875172651	FF	On-Demand	Anodyne	TACR2	49	33
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1	ZINC000875172651	FF	On-Demand	Anodyne	TIMP3	75	38
CCC[C@@H](Cc1ccccc1)NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1	ZINC000875172651	FF	On-Demand	Anodyne	CAPNS1	43	31
C#CC[C@H](COC)NC(=O)C(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000875172661	GC	On-Demand	Mild	SIGMAR1	18	42
C#CC[C@@H](COC)NC(=O)C(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000875172662	GC	On-Demand	Mild	SIGMAR1	18	42
CN1CC[C@H]2CN(C(=O)C(=O)NCC3(c4ccc(Cl)cc4)CC3)CC[C@H]21	ZINC000875172671	GE	On-Demand	Anodyne	CCR1	41	34
CN1CC[C@H]2CN(C(=O)C(=O)NCC3(c4ccc(Cl)cc4)CC3)CC[C@@H]21	ZINC000875172672	GE	On-Demand	Anodyne	CCR1	41	34
Cc1csc([C@H](C)NC(=O)C(=O)NCCC2CCN(C(C)C)CC2)n1	ZINC000875172677	FE	On-Demand	Anodyne	SIRT3	51	38
Cc1csc([C@H](C)NC(=O)C(=O)NCCC2CCN(C(C)C)CC2)n1	ZINC000875172677	FE	On-Demand	Anodyne	SIRT2	53	35
Cc1csc([C@H](C)NC(=O)C(=O)NCCC2CCN(C(C)C)CC2)n1	ZINC000875172677	FE	On-Demand	Anodyne	SIRT1	52	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2(c3ccc(Cl)cc3)CC2)C1	ZINC000875172681	FE	On-Demand	Anodyne	CCR1	40	38
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2(c3ccc(Cl)cc3)CC2)C1	ZINC000875172682	FE	On-Demand	Anodyne	CCR1	40	38
COC(=O)N(C)NC(=O)NCc1ccccc1OCCN1CCOCC1	ZINC000875172751	FC	On-Demand	Reactive	EPHX2	23	42
C#CCNS(=O)(=O)c1ccc(C(=O)OCc2coc(-c3ccc(OC)cc3)n2)cc1	ZINC000875172752	IF	On-Demand	Mild	MMP13	18	41
C#CCNS(=O)(=O)c1ccc(C(=O)OCc2coc(-c3ccc(OC)cc3)n2)cc1	ZINC000875172752	IF	On-Demand	Mild	MMP2	17	41
C[C@@H](CCN(C)C)NC(=O)NNc1cccc(F)c1Cl	ZINC000875172763	DE	On-Demand	Reactive	UTS2	60	37
C[C@@H](CCN(C)C)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875172800	EF	On-Demand	Anodyne	OPRL1	18	46
C[C@@H](CCN(C)C)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875172800	EF	On-Demand	Anodyne	UTS2	41	33
O=C(NC1CCN(CC(F)(F)F)CC1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875172877	FF	On-Demand	Anodyne	HPGDS	36	42
O=C(NC1CCN(CC(F)(F)F)CC1)NC1([C@H]2CCCCO2)CCC1	ZINC000875172878	FF	On-Demand	Anodyne	HPGDS	36	42
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3C[C@H]3c3cccc(F)c3)C[C@@H]1C2	ZINC000875172895	EE	On-Demand	Anodyne	EPHX2	16	43
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3C[C@@H]3c3cccc(F)c3)C[C@@H]1C2	ZINC000875172896	EE	On-Demand	Anodyne	EPHX2	16	43
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3C[C@@H]3c3cccc(F)c3)C[C@@H]1C2	ZINC000875172897	EE	On-Demand	Anodyne	EPHX2	16	43
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3C[C@H]3c3cccc(F)c3)C[C@@H]1C2	ZINC000875172898	EE	On-Demand	Anodyne	EPHX2	16	43
O=C(NCC[C@H](O)C1CCCC1)N[C@@H]1C[C@H]1c1cccc(F)c1	ZINC000875172911	DF	On-Demand	Anodyne	CCR5	40	34
O=C(NCC[C@H](O)C1CCCC1)N[C@H]1C[C@@H]1c1cccc(F)c1	ZINC000875172912	DF	On-Demand	Anodyne	CCR5	40	34
O=C(NCC[C@H](O)C1CCCC1)N[C@H]1C[C@H]1c1cccc(F)c1	ZINC000875172913	DF	On-Demand	Anodyne	CCR5	40	34
O=C(NCC[C@H](O)C1CCCC1)N[C@@H]1C[C@@H]1c1cccc(F)c1	ZINC000875172914	DF	On-Demand	Anodyne	CCR5	40	34
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875172916	GG	On-Demand	Anodyne	DRD4	24	42
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875172916	GG	On-Demand	Anodyne	ACHE	30	40
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875172916	GG	On-Demand	Anodyne	SIGMAR1	34	46
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875172916	GG	On-Demand	Anodyne	CCR3	29	48
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875172916	GG	On-Demand	Anodyne	BIRC2	19	40
C=CC(C)(C)CCCNC(=O)C(=O)N[C@H]1CCc2c(OC)cccc21	ZINC000875172919	EF	On-Demand	Mild	HTR1A	29	47
C=CC(C)(C)CCCNC(=O)C(=O)N[C@H]1CCc2c(OC)cccc21	ZINC000875172919	EF	On-Demand	Mild	DRD2	25	46
C=CC(C)(C)CCCNC(=O)C(=O)N[C@H]1CCc2c(OC)cccc21	ZINC000875172919	EF	On-Demand	Mild	DRD3	32	40
C=CC(C)(C)CCCNC(=O)C(=O)N[C@@H]1CCc2c(OC)cccc21	ZINC000875172920	EF	On-Demand	Mild	HTR1A	29	47
C=CC(C)(C)CCCNC(=O)C(=O)N[C@@H]1CCc2c(OC)cccc21	ZINC000875172920	EF	On-Demand	Mild	DRD2	25	46
C=CC(C)(C)CCCNC(=O)C(=O)N[C@@H]1CCc2c(OC)cccc21	ZINC000875172920	EF	On-Demand	Mild	DRD3	32	40
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCCC[C@H]2Cc2ccccc2)CC1	ZINC000875172921	FF	On-Demand	Anodyne	CCR3	36	43
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCCC[C@@H]2Cc2ccccc2)CC1	ZINC000875172922	FF	On-Demand	Anodyne	CCR3	36	43
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCCC[C@H]2Cc2ccccc2)CC1	ZINC000875172923	FF	On-Demand	Anodyne	CCR3	36	43
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCCC[C@@H]2Cc2ccccc2)CC1	ZINC000875172924	FF	On-Demand	Anodyne	CCR3	36	43
O=C(NCCO)C1CCN(C(=O)N[C@H]2C[C@@H]2c2cccc(F)c2)CC1	ZINC000875172925	ED	On-Demand	Anodyne	EPHX2	42	46
O=C(NCCO)C1CCN(C(=O)N[C@H]2C[C@H]2c2cccc(F)c2)CC1	ZINC000875172926	ED	On-Demand	Anodyne	EPHX2	42	46
O=C(NCCO)C1CCN(C(=O)N[C@@H]2C[C@@H]2c2cccc(F)c2)CC1	ZINC000875172927	ED	On-Demand	Anodyne	EPHX2	42	46
O=C(NCCO)C1CCN(C(=O)N[C@@H]2C[C@H]2c2cccc(F)c2)CC1	ZINC000875172928	ED	On-Demand	Anodyne	EPHX2	42	46
O=CN1CCCN(C(=O)NC[C@@H]2CCCCN2Cc2ccccc2)CC1	ZINC000875172930	FD	On-Demand	Anodyne	DRD2	22	44
O=CN1CCCN(C(=O)NC[C@@H]2CCCCN2Cc2ccccc2)CC1	ZINC000875172930	FD	On-Demand	Anodyne	SIGMAR1	22	49
O=CN1CCCN(C(=O)NC[C@H]2CCCCN2Cc2ccccc2)CC1	ZINC000875172931	FD	On-Demand	Anodyne	DRD2	22	44
O=CN1CCCN(C(=O)NC[C@H]2CCCCN2Cc2ccccc2)CC1	ZINC000875172931	FD	On-Demand	Anodyne	SIGMAR1	22	49
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875172935	ED	On-Demand	Anodyne	DRD4	26	43
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875172935	ED	On-Demand	Anodyne	SIGMAR1	30	45
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875172935	ED	On-Demand	Anodyne	CCR3	55	38
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875172935	ED	On-Demand	Anodyne	PDE8B	16	42
O=C(N[C@H]1C[C@@H]1c1cccc(F)c1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875172938	EG	On-Demand	Anodyne	CCR5	76	39
O=C(N[C@H]1C[C@@H]1c1cccc(F)c1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875172938	EG	On-Demand	Anodyne	EPHX2	18	40
O=C(N[C@@H]1C[C@H]1c1cccc(F)c1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875172940	EG	On-Demand	Anodyne	CCR5	76	39
O=C(N[C@@H]1C[C@H]1c1cccc(F)c1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875172940	EG	On-Demand	Anodyne	EPHX2	18	40
O=C(N[C@H]1C[C@H]1c1cccc(F)c1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875172941	EG	On-Demand	Anodyne	CCR5	76	39
O=C(N[C@H]1C[C@H]1c1cccc(F)c1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875172941	EG	On-Demand	Anodyne	EPHX2	18	40
CC[C@]1(C(=O)Nc2cc(C(=O)Nc3ccccc3)ccc2C)CCNC1=O	ZINC000875172960	FG	On-Demand	Anodyne	MAPK14	28	40
CC[C@]1(C(=O)Nc2cc(C(=O)Nc3ccccc3)ccc2C)CCNC1=O	ZINC000875172960	FG	On-Demand	Anodyne	PLAU	16	41
CC[C@]1(C(=O)Nc2cc(C(=O)Nc3ccccc3)ccc2C)CCNC1=O	ZINC000875172960	FG	On-Demand	Anodyne	KCNK3	84	38
CC[C@]1(C(=O)Nc2cc(C(=O)Nc3ccccc3)ccc2C)CCNC1=O	ZINC000875172960	FG	On-Demand	Anodyne	KCNK9	47	38
COC(=O)C1(O)CN(C(=O)NC2CCN(CC(F)(F)F)CC2)C1	ZINC000875172965	EB	On-Demand	Anodyne	HPGDS	37	41
O=C(NC1CCN(CC(F)(F)F)CC1)N1Cc2cccc(O)c2C1	ZINC000875172996	EE	On-Demand	Clean	HPGDS	47	48
C[C@@H](O)C1CCN(C(=O)N[C@H]2C[C@H]2c2cccc(F)c2)CC1	ZINC000875173002	DE	On-Demand	Anodyne	CCR5	89	35
C[C@@H](O)C1CCN(C(=O)N[C@H]2C[C@H]2c2cccc(F)c2)CC1	ZINC000875173002	DE	On-Demand	Anodyne	EPHX2	29	49
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2C[C@@H]2c2cccc(F)c2)C1	ZINC000875173008	EF	On-Demand	Anodyne	CCR5	96	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2C[C@@H]2c2cccc(F)c2)C1	ZINC000875173008	EF	On-Demand	Anodyne	EPHX2	20	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2C[C@@H]2c2cccc(F)c2)C1	ZINC000875173009	EF	On-Demand	Anodyne	CCR5	96	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2C[C@@H]2c2cccc(F)c2)C1	ZINC000875173009	EF	On-Demand	Anodyne	EPHX2	20	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2C[C@H]2c2cccc(F)c2)C1	ZINC000875173010	EF	On-Demand	Anodyne	CCR5	96	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2C[C@H]2c2cccc(F)c2)C1	ZINC000875173010	EF	On-Demand	Anodyne	EPHX2	20	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2C[C@H]2c2cccc(F)c2)C1	ZINC000875173011	EF	On-Demand	Anodyne	CCR5	96	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2C[C@H]2c2cccc(F)c2)C1	ZINC000875173011	EF	On-Demand	Anodyne	EPHX2	20	41
O=CN1CCCN(C(=O)NC2CCN(CC(F)(F)F)CC2)CC1	ZINC000875173015	EC	On-Demand	Anodyne	HPGDS	36	40
O=C(NC1CCN(CC(F)(F)F)CC1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875173032	FG	On-Demand	Anodyne	HPGDS	37	41
COC(=O)N(C)NC(=O)NC1CCN(CC(F)(F)F)CC1	ZINC000875173033	DC	On-Demand	Reactive	HPGDS	37	44
COC(=O)C1=NO[C@]2(CCN(C(=O)N[C@@H]3C[C@@H]3c3cccc(F)c3)C2)C1	ZINC000875173034	FD	On-Demand	Anodyne	EPHX2	26	49
COC(=O)C1=NO[C@]2(CCN(C(=O)N[C@@H]3C[C@H]3c3cccc(F)c3)C2)C1	ZINC000875173035	FD	On-Demand	Anodyne	EPHX2	26	49
COC(=O)C1=NO[C@]2(CCN(C(=O)N[C@H]3C[C@@H]3c3cccc(F)c3)C2)C1	ZINC000875173036	FD	On-Demand	Anodyne	EPHX2	26	49
COC(=O)C1=NO[C@]2(CCN(C(=O)N[C@H]3C[C@H]3c3cccc(F)c3)C2)C1	ZINC000875173037	FD	On-Demand	Anodyne	EPHX2	26	49
O=C(NC1CCN(CC(F)(F)F)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875173099	FF	On-Demand	Anodyne	DRD4	19	53
O=C(NC1CCN(CC(F)(F)F)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875173099	FF	On-Demand	Anodyne	LTA4H	24	42
O=C(NC1CCN(CC(F)(F)F)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875173099	FF	On-Demand	Anodyne	SIGMAR1	22	46
O=C(NC1CCN(CC(F)(F)F)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875173099	FF	On-Demand	Anodyne	CCR3	33	41
O=C(NC1CCN(CC(F)(F)F)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875173099	FF	On-Demand	Anodyne	SLC6A5	28	41
O=C(NC1CCN(CC(F)(F)F)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875173099	FF	On-Demand	Anodyne	EPHX2	47	45
O=C(NC1CCN(CC(F)(F)F)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875173099	FF	On-Demand	Anodyne	HPGDS	43	51
O=C(NC1CCN(CC(F)(F)F)CC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875173105	GF	On-Demand	Anodyne	WNT3	42	31
O=C(NC1CCN(CC(F)(F)F)CC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875173105	GF	On-Demand	Anodyne	HPGDS	41	48
O=C(NC1CCN(CC(F)(F)F)CC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875173106	GF	On-Demand	Anodyne	WNT3	42	31
O=C(NC1CCN(CC(F)(F)F)CC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875173106	GF	On-Demand	Anodyne	HPGDS	41	48
O=C(NC1CCN(CC(F)(F)F)CC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875173107	GF	On-Demand	Anodyne	WNT3	42	31
O=C(NC1CCN(CC(F)(F)F)CC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875173107	GF	On-Demand	Anodyne	HPGDS	41	48
O=C(NC1CCN(CC(F)(F)F)CC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875173108	GF	On-Demand	Anodyne	WNT3	42	31
O=C(NC1CCN(CC(F)(F)F)CC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875173108	GF	On-Demand	Anodyne	HPGDS	41	48
CC[C@@H](NC(=O)NC1CCN(CC(F)(F)F)CC1)[C@@H](O)c1ccccc1	ZINC000875173109	FF	On-Demand	Anodyne	CCR5	25	42
CC[C@@H](NC(=O)NC1CCN(CC(F)(F)F)CC1)[C@@H](O)c1ccccc1	ZINC000875173109	FF	On-Demand	Anodyne	HPGDS	41	48
CC[C@@H](NC(=O)NC1CCN(CC(F)(F)F)CC1)[C@H](O)c1ccccc1	ZINC000875173111	FF	On-Demand	Anodyne	CCR5	25	42
CC[C@@H](NC(=O)NC1CCN(CC(F)(F)F)CC1)[C@H](O)c1ccccc1	ZINC000875173111	FF	On-Demand	Anodyne	HPGDS	41	48
O=C(N[C@@H]1C[C@H]1c1cccc(F)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875173116	EH	On-Demand	Anodyne	EPHX2	35	58
O=C(N[C@@H]1C[C@H]1c1cccc(F)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875173117	EH	On-Demand	Anodyne	EPHX2	35	58
O=C1CCN(C(=O)N[C@@H]2C[C@H]2c2cccc(F)c2)CCCCCCN1	ZINC000875173125	EF	On-Demand	Anodyne	EPHX2	22	46
O=C1CCN(C(=O)N[C@@H]2C[C@@H]2c2cccc(F)c2)CCCCCCN1	ZINC000875173126	EF	On-Demand	Anodyne	EPHX2	22	46
O=C1CCN(C(=O)N[C@H]2C[C@H]2c2cccc(F)c2)CCCCCCN1	ZINC000875173127	EF	On-Demand	Anodyne	EPHX2	22	46
O=C1CCN(C(=O)N[C@H]2C[C@@H]2c2cccc(F)c2)CCCCCCN1	ZINC000875173128	EF	On-Demand	Anodyne	EPHX2	22	46
O=C(NC[C@H]1CCCCN1Cc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875173131	GD	On-Demand	Anodyne	DRD2	26	45
O=C(NC[C@H]1CCCCN1Cc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875173131	GD	On-Demand	Anodyne	SIGMAR1	30	47
C[C@@H]1Oc2ccccc2N(CC(=O)OCCC(N)=O)C1=O	ZINC000875173144	CC	On-Demand	Anodyne	HEMY	26	43
O=C(NCc1ccccc1-n1cccn1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875173162	FH	On-Demand	Anodyne	EPHX2	26	47
O=C(NCc1ccccc1-n1cccn1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875173163	FH	On-Demand	Anodyne	EPHX2	26	47
Cc1nnc(NNC(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)n1C	ZINC000875173186	FD	On-Demand	Reactive	DRD4	26	44
Cc1nnc(NNC(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)n1C	ZINC000875173186	FD	On-Demand	Reactive	ACHE	30	41
Cc1nnc(NNC(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)n1C	ZINC000875173186	FD	On-Demand	Reactive	SLC6A1	90	35
Cc1nnc(NNC(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)n1C	ZINC000875173186	FD	On-Demand	Reactive	HTR4	27	41
Cc1nnc(NNC(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)n1C	ZINC000875173186	FD	On-Demand	Reactive	SIGMAR1	28	44
Cc1nnc(NNC(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)n1C	ZINC000875173186	FD	On-Demand	Reactive	CCR3	65	46
Cc1nnc(NNC(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)n1C	ZINC000875173187	FD	On-Demand	Reactive	DRD4	26	44
Cc1nnc(NNC(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)n1C	ZINC000875173187	FD	On-Demand	Reactive	ACHE	30	41
Cc1nnc(NNC(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)n1C	ZINC000875173187	FD	On-Demand	Reactive	SLC6A1	90	35
Cc1nnc(NNC(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)n1C	ZINC000875173187	FD	On-Demand	Reactive	HTR4	27	41
Cc1nnc(NNC(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)n1C	ZINC000875173187	FD	On-Demand	Reactive	SIGMAR1	28	44
Cc1nnc(NNC(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)n1C	ZINC000875173187	FD	On-Demand	Reactive	CCR3	65	46
O=CN1CCCN(C(=O)N[C@H]2C[C@@H]2c2cccc(F)c2)CC1	ZINC000875173205	DD	On-Demand	Anodyne	EPHX2	25	49
O=CN1CCCN(C(=O)N[C@H]2C[C@H]2c2cccc(F)c2)CC1	ZINC000875173206	DD	On-Demand	Anodyne	EPHX2	25	49
O=CN1CCCN(C(=O)N[C@@H]2C[C@@H]2c2cccc(F)c2)CC1	ZINC000875173207	DD	On-Demand	Anodyne	EPHX2	25	49
O=CN1CCCN(C(=O)N[C@@H]2C[C@H]2c2cccc(F)c2)CC1	ZINC000875173208	DD	On-Demand	Anodyne	EPHX2	25	49
COC(=O)N(C)NC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000875173220	FC	On-Demand	Reactive	HTR1A	60	51
COC(=O)N(C)NC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000875173220	FC	On-Demand	Reactive	DRD2	47	44
COC(=O)N(C)NC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000875173220	FC	On-Demand	Reactive	DRD4	61	51
COC(=O)N(C)NC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000875173220	FC	On-Demand	Reactive	HTR2A	34	45
COC(=O)N(C)NC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000875173220	FC	On-Demand	Reactive	HTR2C	24	42
COC(=O)N(C)NC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000875173220	FC	On-Demand	Reactive	DRD3	75	45
COC(=O)N(C)NC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000875173220	FC	On-Demand	Reactive	HTR7	57	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1-n1cccn1	ZINC000875173223	FE	On-Demand	Anodyne	SLC6A3	41	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1-n1cccn1	ZINC000875173224	FE	On-Demand	Anodyne	SLC6A3	41	37
O=C(NC1CCN(CC(F)(F)F)CC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875173225	GF	On-Demand	Anodyne	DRD4	17	40
O=C(NC1CCN(CC(F)(F)F)CC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875173225	GF	On-Demand	Anodyne	HPGDS	41	48
O=C(N[C@H]1C[C@@H]1c1cccc(F)c1)N1Cc2cccnc2N2C[C@H](O)C[C@H]2C1	ZINC000875173227	GE	On-Demand	Anodyne	EPHX2	18	40
O=C(N[C@H]1C[C@H]1c1cccc(F)c1)N1Cc2cccnc2N2C[C@H](O)C[C@H]2C1	ZINC000875173228	GE	On-Demand	Anodyne	EPHX2	18	40
O=C(N[C@@H]1C[C@H]1c1cccc(F)c1)N1Cc2cccnc2N2C[C@H](O)C[C@H]2C1	ZINC000875173230	GE	On-Demand	Anodyne	EPHX2	18	40
COC(=O)N(C)NC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875173239	ED	On-Demand	Reactive	DRD2	24	49
COC(=O)N(C)NC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875173239	ED	On-Demand	Reactive	DRD4	35	49
COC(=O)N(C)NC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875173239	ED	On-Demand	Reactive	ACHE	38	41
COC(=O)N(C)NC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875173239	ED	On-Demand	Reactive	SLC6A1	66	32
COC(=O)N(C)NC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875173239	ED	On-Demand	Reactive	DRD3	17	49
COC(=O)N(C)NC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875173239	ED	On-Demand	Reactive	HTR4	38	41
COC(=O)N(C)NC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875173239	ED	On-Demand	Reactive	LTA4H	18	41
COC(=O)N(C)NC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875173239	ED	On-Demand	Reactive	SIGMAR1	47	47
COC(=O)N(C)NC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875173239	ED	On-Demand	Reactive	CCR3	63	49
COC(=O)N(C)NC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875173239	ED	On-Demand	Reactive	CCR5	18	45
COC(=O)N(C)NC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875173240	ED	On-Demand	Reactive	DRD2	24	49
COC(=O)N(C)NC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875173240	ED	On-Demand	Reactive	DRD4	35	49
COC(=O)N(C)NC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875173240	ED	On-Demand	Reactive	ACHE	38	41
COC(=O)N(C)NC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875173240	ED	On-Demand	Reactive	SLC6A1	66	32
COC(=O)N(C)NC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875173240	ED	On-Demand	Reactive	DRD3	17	49
COC(=O)N(C)NC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875173240	ED	On-Demand	Reactive	HTR4	38	41
COC(=O)N(C)NC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875173240	ED	On-Demand	Reactive	LTA4H	18	41
COC(=O)N(C)NC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875173240	ED	On-Demand	Reactive	SIGMAR1	47	47
COC(=O)N(C)NC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875173240	ED	On-Demand	Reactive	CCR3	63	49
COC(=O)N(C)NC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875173240	ED	On-Demand	Reactive	CCR5	18	45
O=C(NC1CCN(CC(F)(F)F)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875173256	GE	On-Demand	Anodyne	HPGDS	36	40
O=C(NC1CCN(CC(F)(F)F)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875173257	GE	On-Demand	Anodyne	HPGDS	36	40
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2-n2cccn2)CC1	ZINC000875173261	FC	On-Demand	Anodyne	EPHX2	24	44
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875173263	GD	On-Demand	Anodyne	DRD4	26	43
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875173263	GD	On-Demand	Anodyne	ACHE	31	42
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875173263	GD	On-Demand	Anodyne	SLC6A1	54	32
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875173263	GD	On-Demand	Anodyne	CHRM3	17	40
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875173263	GD	On-Demand	Anodyne	SIGMAR1	50	48
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875173263	GD	On-Demand	Anodyne	CCR3	36	50
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875173263	GD	On-Demand	Anodyne	NPFFR2	32	40
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875173263	GD	On-Demand	Anodyne	NPFFR1	42	40
C[C@H](NC(=O)C(=O)NCCCC(C)(C)C)c1ccc(C(F)(F)F)nc1	ZINC000875173269	FG	On-Demand	Anodyne	TRPV1	65	36
O=C(NC1CCN(CC(F)(F)F)CC1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875173279	GG	On-Demand	Anodyne	HPGDS	41	48
O=C(NC1CCN(CC(F)(F)F)CC1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875173280	GG	On-Demand	Anodyne	HPGDS	41	48
O=C(NC1CCN(CC(F)(F)F)CC1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875173281	GG	On-Demand	Anodyne	HPGDS	41	48
O=C(NC1CCN(CC(F)(F)F)CC1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875173282	GG	On-Demand	Anodyne	HPGDS	41	48
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173290	GF	On-Demand	Anodyne	CHRM2	17	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173290	GF	On-Demand	Anodyne	CHRM1	17	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173290	GF	On-Demand	Anodyne	ACE	37	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173290	GF	On-Demand	Anodyne	DRD2	18	45
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173290	GF	On-Demand	Anodyne	DRD4	25	45
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173290	GF	On-Demand	Anodyne	ACHE	26	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173290	GF	On-Demand	Anodyne	SLC6A1	64	33
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173290	GF	On-Demand	Anodyne	HTR4	38	43
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173290	GF	On-Demand	Anodyne	CHRM3	15	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173290	GF	On-Demand	Anodyne	SIGMAR1	32	44
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173290	GF	On-Demand	Anodyne	CCR3	36	46
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173290	GF	On-Demand	Anodyne	REN	42	38
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173290	GF	On-Demand	Anodyne	BIRC2	39	42
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173291	GF	On-Demand	Anodyne	CHRM2	17	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173291	GF	On-Demand	Anodyne	CHRM1	17	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173291	GF	On-Demand	Anodyne	ACE	37	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173291	GF	On-Demand	Anodyne	DRD2	18	45
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173291	GF	On-Demand	Anodyne	DRD4	25	45
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173291	GF	On-Demand	Anodyne	ACHE	26	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173291	GF	On-Demand	Anodyne	SLC6A1	64	33
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173291	GF	On-Demand	Anodyne	HTR4	38	43
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173291	GF	On-Demand	Anodyne	CHRM3	15	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173291	GF	On-Demand	Anodyne	SIGMAR1	32	44
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173291	GF	On-Demand	Anodyne	CCR3	36	46
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173291	GF	On-Demand	Anodyne	REN	42	38
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173291	GF	On-Demand	Anodyne	BIRC2	39	42
CCC1(CC)CCCN1C(=O)NC1CCN(CC(F)(F)F)CC1	ZINC000875173302	EG	On-Demand	Anodyne	HPGDS	36	40
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875173314	GF	On-Demand	Anodyne	SIGMAR1	24	45
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875173314	GF	On-Demand	Anodyne	CCR3	35	47
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875173314	GF	On-Demand	Anodyne	CCR2	21	41
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875173316	GF	On-Demand	Anodyne	SIGMAR1	24	45
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875173316	GF	On-Demand	Anodyne	CCR3	35	47
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875173316	GF	On-Demand	Anodyne	CCR2	21	41
COC(=O)[C@@]12C[C@@H](NC(=O)NC[C@H]3CCCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875173345	GF	On-Demand	Anodyne	DRD2	20	46
COC(=O)[C@@]12C[C@@H](NC(=O)NC[C@H]3CCCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875173345	GF	On-Demand	Anodyne	DRD4	24	46
COC(=O)[C@@]12C[C@@H](NC(=O)NC[C@H]3CCCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875173345	GF	On-Demand	Anodyne	SIGMAR1	36	42
COC(=O)[C@@]12C[C@@H](NC(=O)NC[C@H]3CCCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875173345	GF	On-Demand	Anodyne	CCR3	37	44
COC(=O)[C@@]12C[C@@H](NC(=O)NC[C@@H]3CCCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875173346	GF	On-Demand	Anodyne	DRD2	20	46
COC(=O)[C@@]12C[C@@H](NC(=O)NC[C@@H]3CCCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875173346	GF	On-Demand	Anodyne	DRD4	24	46
COC(=O)[C@@]12C[C@@H](NC(=O)NC[C@@H]3CCCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875173346	GF	On-Demand	Anodyne	SIGMAR1	36	42
COC(=O)[C@@]12C[C@@H](NC(=O)NC[C@@H]3CCCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875173346	GF	On-Demand	Anodyne	CCR3	37	44
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1C[C@@H]1c1cccc(F)c1	ZINC000875173353	FF	On-Demand	Anodyne	CCR5	46	34
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1C[C@@H]1c1cccc(F)c1	ZINC000875173353	FF	On-Demand	Anodyne	ACKR3	44	33
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1C[C@H]1c1cccc(F)c1	ZINC000875173354	FF	On-Demand	Anodyne	CCR5	46	34
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1C[C@H]1c1cccc(F)c1	ZINC000875173354	FF	On-Demand	Anodyne	ACKR3	44	33
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1C[C@H]1c1cccc(F)c1	ZINC000875173355	FF	On-Demand	Anodyne	CCR5	46	34
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1C[C@H]1c1cccc(F)c1	ZINC000875173355	FF	On-Demand	Anodyne	ACKR3	44	33
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1C[C@@H]1c1cccc(F)c1	ZINC000875173356	FF	On-Demand	Anodyne	CCR5	46	34
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1C[C@@H]1c1cccc(F)c1	ZINC000875173356	FF	On-Demand	Anodyne	ACKR3	44	33
COC(=O)N(C)NC(=O)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000875173366	ED	On-Demand	Reactive	DRD2	44	50
COC(=O)N(C)NC(=O)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000875173366	ED	On-Demand	Reactive	LTA4H	22	44
COC(=O)N(C)NC(=O)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000875173366	ED	On-Demand	Reactive	HCRTR1	15	40
COC(=O)N(C)NC(=O)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000875173366	ED	On-Demand	Reactive	SIGMAR1	32	51
COC(=O)N(C)NC(=O)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000875173367	ED	On-Demand	Reactive	DRD2	44	50
COC(=O)N(C)NC(=O)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000875173367	ED	On-Demand	Reactive	LTA4H	22	44
COC(=O)N(C)NC(=O)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000875173367	ED	On-Demand	Reactive	HCRTR1	15	40
COC(=O)N(C)NC(=O)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000875173367	ED	On-Demand	Reactive	SIGMAR1	32	51
CN1CCN(C(=O)N[C@H]2C[C@@H]2c2cccc(F)c2)CCC1(C)C	ZINC000875173372	DF	On-Demand	Anodyne	CACNA1H	49	35
CN1CCN(C(=O)N[C@H]2C[C@@H]2c2cccc(F)c2)CCC1(C)C	ZINC000875173372	DF	On-Demand	Anodyne	EPHX2	24	52
CN1CCN(C(=O)N[C@H]2C[C@H]2c2cccc(F)c2)CCC1(C)C	ZINC000875173373	DF	On-Demand	Anodyne	CACNA1H	49	35
CN1CCN(C(=O)N[C@H]2C[C@H]2c2cccc(F)c2)CCC1(C)C	ZINC000875173373	DF	On-Demand	Anodyne	EPHX2	24	52
CN1CCN(C(=O)N[C@@H]2C[C@@H]2c2cccc(F)c2)CCC1(C)C	ZINC000875173374	DF	On-Demand	Anodyne	CACNA1H	49	35
CN1CCN(C(=O)N[C@@H]2C[C@@H]2c2cccc(F)c2)CCC1(C)C	ZINC000875173374	DF	On-Demand	Anodyne	EPHX2	24	52
CN1CCN(C(=O)N[C@@H]2C[C@H]2c2cccc(F)c2)CCC1(C)C	ZINC000875173375	DF	On-Demand	Anodyne	CACNA1H	49	35
CN1CCN(C(=O)N[C@@H]2C[C@H]2c2cccc(F)c2)CCC1(C)C	ZINC000875173375	DF	On-Demand	Anodyne	EPHX2	24	52
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875173404	GF	On-Demand	Anodyne	DRD2	17	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875173404	GF	On-Demand	Anodyne	DRD4	28	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875173404	GF	On-Demand	Anodyne	SLC6A1	51	34
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875173404	GF	On-Demand	Anodyne	SLC6A3	40	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875173404	GF	On-Demand	Anodyne	HTR4	31	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875173404	GF	On-Demand	Anodyne	SIGMAR1	36	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875173404	GF	On-Demand	Anodyne	CCR3	30	47
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875173404	GF	On-Demand	Anodyne	MBTPS1	40	33
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875173405	GF	On-Demand	Anodyne	DRD2	17	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875173405	GF	On-Demand	Anodyne	DRD4	28	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875173405	GF	On-Demand	Anodyne	SLC6A1	51	34
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875173405	GF	On-Demand	Anodyne	SLC6A3	40	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875173405	GF	On-Demand	Anodyne	HTR4	31	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875173405	GF	On-Demand	Anodyne	SIGMAR1	36	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875173405	GF	On-Demand	Anodyne	CCR3	30	47
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875173405	GF	On-Demand	Anodyne	MBTPS1	40	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875173406	GF	On-Demand	Anodyne	DRD2	17	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875173406	GF	On-Demand	Anodyne	DRD4	28	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875173406	GF	On-Demand	Anodyne	SLC6A1	51	34
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875173406	GF	On-Demand	Anodyne	SLC6A3	40	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875173406	GF	On-Demand	Anodyne	HTR4	31	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875173406	GF	On-Demand	Anodyne	SIGMAR1	36	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875173406	GF	On-Demand	Anodyne	CCR3	30	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875173406	GF	On-Demand	Anodyne	MBTPS1	40	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875173407	GF	On-Demand	Anodyne	DRD2	17	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875173407	GF	On-Demand	Anodyne	DRD4	28	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875173407	GF	On-Demand	Anodyne	SLC6A1	51	34
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875173407	GF	On-Demand	Anodyne	SLC6A3	40	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875173407	GF	On-Demand	Anodyne	HTR4	31	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875173407	GF	On-Demand	Anodyne	SIGMAR1	36	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875173407	GF	On-Demand	Anodyne	CCR3	30	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875173407	GF	On-Demand	Anodyne	MBTPS1	40	33
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173411	FC	On-Demand	Anodyne	DRD2	23	49
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173411	FC	On-Demand	Anodyne	DRD4	28	49
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173411	FC	On-Demand	Anodyne	ACHE	31	40
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173411	FC	On-Demand	Anodyne	SLC6A1	49	32
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173411	FC	On-Demand	Anodyne	DRD3	15	49
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173411	FC	On-Demand	Anodyne	HTR4	40	40
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173411	FC	On-Demand	Anodyne	SIGMAR1	44	48
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000875173411	FC	On-Demand	Anodyne	CCR3	38	47
O=C(NC[C@H]1CCCCN1Cc1ccccc1)N[C@@H]1CCOC[C@H]1O	ZINC000875173434	ED	On-Demand	Anodyne	DRD2	25	44
O=C(NC[C@H]1CCCCN1Cc1ccccc1)N[C@@H]1CCOC[C@H]1O	ZINC000875173434	ED	On-Demand	Anodyne	SIGMAR1	18	45
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875173435	GG	On-Demand	Anodyne	DRD4	25	41
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875173435	GG	On-Demand	Anodyne	SIGMAR1	25	45
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875173435	GG	On-Demand	Anodyne	CCR3	33	45
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875173435	GG	On-Demand	Anodyne	CCR2	19	45
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875173436	GG	On-Demand	Anodyne	DRD4	25	41
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875173436	GG	On-Demand	Anodyne	SIGMAR1	25	45
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875173436	GG	On-Demand	Anodyne	CCR3	33	45
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875173436	GG	On-Demand	Anodyne	CCR2	19	45
O=C(NC1CCN(CC(F)(F)F)CC1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875173444	GF	On-Demand	Anodyne	HPGDS	44	44
Cc1ncsc1CNC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875173478	FE	On-Demand	Anodyne	VHL	41	33
Cc1ncsc1CNC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875173479	FE	On-Demand	Anodyne	VHL	41	33
COC(=O)c1cc(F)ccc1NC(=O)[C@@H]1CCC(=O)N1C(C)C	ZINC000875173493	DD	On-Demand	Anodyne	P2RX7	21	54
CCOC(=O)[C@H](C)C1CN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000875173501	ED	On-Demand	Anodyne	ACE	26	45
CCOC(=O)[C@H](C)C1CN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000875173501	ED	On-Demand	Anodyne	HTR4	16	40
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1-n1cccn1	ZINC000875173517	DE	On-Demand	Anodyne	AMP1_PLAFQ	47	37
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(CC(F)(F)F)CC1	ZINC000875173526	GF	On-Demand	Anodyne	DRD4	20	45
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(CC(F)(F)F)CC1	ZINC000875173526	GF	On-Demand	Anodyne	SIGMAR1	19	50
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(CC(F)(F)F)CC1	ZINC000875173526	GF	On-Demand	Anodyne	EPHX2	33	42
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(CC(F)(F)F)CC1	ZINC000875173526	GF	On-Demand	Anodyne	CXCR3	18	42
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(CC(F)(F)F)CC1	ZINC000875173526	GF	On-Demand	Anodyne	MCHR1	25	41
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(CC(F)(F)F)CC1	ZINC000875173526	GF	On-Demand	Anodyne	HPGDS	39	43
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(CC(F)(F)F)CC1	ZINC000875173528	GF	On-Demand	Anodyne	DRD4	20	45
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(CC(F)(F)F)CC1	ZINC000875173528	GF	On-Demand	Anodyne	SIGMAR1	19	50
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(CC(F)(F)F)CC1	ZINC000875173528	GF	On-Demand	Anodyne	EPHX2	33	42
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(CC(F)(F)F)CC1	ZINC000875173528	GF	On-Demand	Anodyne	CXCR3	18	42
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(CC(F)(F)F)CC1	ZINC000875173528	GF	On-Demand	Anodyne	MCHR1	25	41
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(CC(F)(F)F)CC1	ZINC000875173528	GF	On-Demand	Anodyne	HPGDS	39	43
O=C1[C@H](NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CCN1Cc1ccccc1	ZINC000875173541	GF	On-Demand	Anodyne	F2	24	44
O=C1[C@H](NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CCN1Cc1ccccc1	ZINC000875173541	GF	On-Demand	Anodyne	PRSS1	26	44
O=C1[C@H](NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CCN1Cc1ccccc1	ZINC000875173541	GF	On-Demand	Anodyne	ACE	61	40
O=C1[C@H](NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CCN1Cc1ccccc1	ZINC000875173541	GF	On-Demand	Anodyne	MME	32	40
O=C1[C@H](NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CCN1Cc1ccccc1	ZINC000875173541	GF	On-Demand	Anodyne	BIRC8	40	31
O=C1[C@H](NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CCN1Cc1ccccc1	ZINC000875173541	GF	On-Demand	Anodyne	TMPRSS11D	40	31
O=C1[C@H](NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CCN1Cc1ccccc1	ZINC000875173542	GF	On-Demand	Anodyne	F2	24	44
O=C1[C@H](NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CCN1Cc1ccccc1	ZINC000875173542	GF	On-Demand	Anodyne	PRSS1	26	44
O=C1[C@H](NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CCN1Cc1ccccc1	ZINC000875173542	GF	On-Demand	Anodyne	ACE	61	40
O=C1[C@H](NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CCN1Cc1ccccc1	ZINC000875173542	GF	On-Demand	Anodyne	MME	32	40
O=C1[C@H](NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CCN1Cc1ccccc1	ZINC000875173542	GF	On-Demand	Anodyne	BIRC8	40	31
O=C1[C@H](NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CCN1Cc1ccccc1	ZINC000875173542	GF	On-Demand	Anodyne	TMPRSS11D	40	31
O=C1[C@H](NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CCN1Cc1ccccc1	ZINC000875173543	GF	On-Demand	Anodyne	F2	24	44
O=C1[C@H](NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CCN1Cc1ccccc1	ZINC000875173543	GF	On-Demand	Anodyne	PRSS1	26	44
O=C1[C@H](NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CCN1Cc1ccccc1	ZINC000875173543	GF	On-Demand	Anodyne	ACE	61	40
O=C1[C@H](NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CCN1Cc1ccccc1	ZINC000875173543	GF	On-Demand	Anodyne	MME	32	40
O=C1[C@H](NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CCN1Cc1ccccc1	ZINC000875173543	GF	On-Demand	Anodyne	BIRC8	40	31
O=C1[C@H](NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CCN1Cc1ccccc1	ZINC000875173543	GF	On-Demand	Anodyne	TMPRSS11D	40	31
O=C1[C@H](NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CCN1Cc1ccccc1	ZINC000875173544	GF	On-Demand	Anodyne	F2	24	44
O=C1[C@H](NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CCN1Cc1ccccc1	ZINC000875173544	GF	On-Demand	Anodyne	PRSS1	26	44
O=C1[C@H](NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CCN1Cc1ccccc1	ZINC000875173544	GF	On-Demand	Anodyne	ACE	61	40
O=C1[C@H](NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CCN1Cc1ccccc1	ZINC000875173544	GF	On-Demand	Anodyne	MME	32	40
O=C1[C@H](NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CCN1Cc1ccccc1	ZINC000875173544	GF	On-Demand	Anodyne	BIRC8	40	31
O=C1[C@H](NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CCN1Cc1ccccc1	ZINC000875173544	GF	On-Demand	Anodyne	TMPRSS11D	40	31
Cc1ncsc1CNC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875173570	GD	On-Demand	Anodyne	NPY2R	41	36
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCc2c(OC)cccc21	ZINC000875173590	ED	On-Demand	Anodyne	HTR1A	24	46
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCc2c(OC)cccc21	ZINC000875173590	ED	On-Demand	Anodyne	DRD2	18	46
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCc2c(OC)cccc21	ZINC000875173590	ED	On-Demand	Anodyne	DRD4	40	31
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCc2c(OC)cccc21	ZINC000875173590	ED	On-Demand	Anodyne	DRD3	21	40
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCc2c(OC)cccc21	ZINC000875173590	ED	On-Demand	Anodyne	MTNR1A	23	40
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCc2c(OC)cccc21	ZINC000875173590	ED	On-Demand	Anodyne	MTNR1B	20	40
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCc2c(OC)cccc21	ZINC000875173591	ED	On-Demand	Anodyne	HTR1A	24	46
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCc2c(OC)cccc21	ZINC000875173591	ED	On-Demand	Anodyne	DRD2	18	46
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCc2c(OC)cccc21	ZINC000875173591	ED	On-Demand	Anodyne	DRD4	40	31
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCc2c(OC)cccc21	ZINC000875173591	ED	On-Demand	Anodyne	DRD3	21	40
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCc2c(OC)cccc21	ZINC000875173591	ED	On-Demand	Anodyne	MTNR1A	23	40
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCc2c(OC)cccc21	ZINC000875173591	ED	On-Demand	Anodyne	MTNR1B	20	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCN1Cc2ccccc2C1	ZINC000875173595	ED	On-Demand	Anodyne	SLC6A4	32	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCN1Cc2ccccc2C1	ZINC000875173595	ED	On-Demand	Anodyne	SLC6A3	62	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCN1Cc2ccccc2C1	ZINC000875173595	ED	On-Demand	Anodyne	PLD1	41	34
CC(C)(C)CCCNC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875173605	FF	On-Demand	Anodyne	ROCK1	24	40
CC(C)(C)CCCNC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875173605	FF	On-Demand	Anodyne	ROCK2	16	40
O=C(N[C@H]1C[C@@H]1c1cccc(F)c1)N1CCC(CO)(CO)CC1	ZINC000875173611	DD	On-Demand	Anodyne	CACNA1H	55	36
O=C(N[C@H]1C[C@@H]1c1cccc(F)c1)N1CCC(CO)(CO)CC1	ZINC000875173611	DD	On-Demand	Anodyne	EPHX2	29	57
O=C(N[C@H]1C[C@H]1c1cccc(F)c1)N1CCC(CO)(CO)CC1	ZINC000875173612	DD	On-Demand	Anodyne	CACNA1H	55	36
O=C(N[C@H]1C[C@H]1c1cccc(F)c1)N1CCC(CO)(CO)CC1	ZINC000875173612	DD	On-Demand	Anodyne	EPHX2	29	57
O=C(N[C@@H]1C[C@H]1c1cccc(F)c1)N1CCC(CO)(CO)CC1	ZINC000875173614	DD	On-Demand	Anodyne	CACNA1H	55	36
O=C(N[C@@H]1C[C@H]1c1cccc(F)c1)N1CCC(CO)(CO)CC1	ZINC000875173614	DD	On-Demand	Anodyne	EPHX2	29	57
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000875173615	EE	On-Demand	Anodyne	DRD2	33	47
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000875173615	EE	On-Demand	Anodyne	SIGMAR1	32	50
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000875173616	EE	On-Demand	Anodyne	DRD2	33	47
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000875173616	EE	On-Demand	Anodyne	SIGMAR1	32	50
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCS(=O)(=O)CC	ZINC000875173621	FD	On-Demand	Anodyne	MME	64	45
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCS(=O)(=O)CC	ZINC000875173621	FD	On-Demand	Anodyne	MMP3	52	36
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCS(=O)(=O)CC	ZINC000875173621	FD	On-Demand	Anodyne	MMP8	17	40
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCS(=O)(=O)CC	ZINC000875173621	FD	On-Demand	Anodyne	CAPN1	53	45
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCS(=O)(=O)CC	ZINC000875173621	FD	On-Demand	Anodyne	CAPN2	87	39
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCS(=O)(=O)CC	ZINC000875173621	FD	On-Demand	Anodyne	CTSC	15	43
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCS(=O)(=O)CC	ZINC000875173621	FD	On-Demand	Anodyne	AMP1_PLAFQ	41	41
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCS(=O)(=O)CC	ZINC000875173622	FD	On-Demand	Anodyne	MME	64	45
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCS(=O)(=O)CC	ZINC000875173622	FD	On-Demand	Anodyne	MMP3	52	36
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCS(=O)(=O)CC	ZINC000875173622	FD	On-Demand	Anodyne	MMP8	17	40
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCS(=O)(=O)CC	ZINC000875173622	FD	On-Demand	Anodyne	CAPN1	53	45
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCS(=O)(=O)CC	ZINC000875173622	FD	On-Demand	Anodyne	CAPN2	87	39
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCS(=O)(=O)CC	ZINC000875173622	FD	On-Demand	Anodyne	CTSC	15	43
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCS(=O)(=O)CC	ZINC000875173622	FD	On-Demand	Anodyne	AMP1_PLAFQ	41	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1C[C@@H]1c1cccc(F)c1	ZINC000875173624	CF	On-Demand	Anodyne	CCR5	62	34
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1C[C@H]1c1cccc(F)c1	ZINC000875173625	CF	On-Demand	Anodyne	CCR5	62	34
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1C[C@H]1c1cccc(F)c1	ZINC000875173626	CF	On-Demand	Anodyne	CCR5	62	34
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1C[C@@H]1c1cccc(F)c1	ZINC000875173627	CF	On-Demand	Anodyne	CCR5	62	34
Cc1ncsc1CNC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875173636	FF	On-Demand	Anodyne	SCN2A	16	40
Cc1ncsc1CNC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875173636	FF	On-Demand	Anodyne	FAAH	67	41
Cc1ncsc1CNC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875173636	FF	On-Demand	Anodyne	CES1	66	39
Cc1ncsc1CNC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875173636	FF	On-Demand	Anodyne	AMP1_PLAFQ	27	44
Cc1ncsc1CNC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875173636	FF	On-Demand	Anodyne	CES1D	44	32
O=C(NCc1ccccn1)c1ccc(NC(=O)[C@@]23CCCC[C@H]2C3)cc1Cl	ZINC000875173643	GI	On-Demand	Anodyne	GRM4	54	41
CC(C)(C)CCCNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875173644	GF	On-Demand	Anodyne	ETHR	66	53
O=C(NCc1ccccn1)c1ccc(NC(=O)[C@]23CCCC[C@H]2C3)cc1Cl	ZINC000875173646	GI	On-Demand	Anodyne	GRM4	54	41
O=C(NCc1ccccn1)c1ccc(NC(=O)[C@@]23CCCC[C@@H]2C3)cc1Cl	ZINC000875173648	GI	On-Demand	Anodyne	GRM4	54	41
O=C(NCc1ccccn1)c1ccc(NC(=O)[C@]23CCCC[C@@H]2C3)cc1Cl	ZINC000875173649	GI	On-Demand	Anodyne	GRM4	54	41
CCCC[C@H](NC(=O)C(=O)N1CCC(C(C)=O)CC1)c1ccc(OC)cc1	ZINC000875173650	FF	On-Demand	Anodyne	CHRM2	45	41
CCCC[C@H](NC(=O)C(=O)N1CCC(C(C)=O)CC1)c1ccc(OC)cc1	ZINC000875173650	FF	On-Demand	Anodyne	P2RY12	56	32
CCCC[C@@H](NC(=O)C(=O)N1CCC(C(C)=O)CC1)c1ccc(OC)cc1	ZINC000875173651	FF	On-Demand	Anodyne	CHRM2	45	41
CCCC[C@@H](NC(=O)C(=O)N1CCC(C(C)=O)CC1)c1ccc(OC)cc1	ZINC000875173651	FF	On-Demand	Anodyne	P2RY12	56	32
CC(=O)C1CCN(C(=O)C(=O)NCC(C)(C)c2ccccc2Cl)CC1	ZINC000875173660	FF	On-Demand	Anodyne	SFRP1	42	33
O=CN1CCCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2=O)CC1	ZINC000875173691	EC	On-Demand	Anodyne	SAP2	32	40
O=CN1CCCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2=O)CC1	ZINC000875173692	EC	On-Demand	Anodyne	SAP2	32	40
CCCCCCCNC(=O)C(=O)NCc1nccn1C	ZINC000875173694	CD	On-Demand	Mild	ASAH1	96	41
COC(=O)c1cc(F)ccc1NC(=O)[C@H](CN(C)C)NC(=O)OC(C)(C)C	ZINC000875173695	GE	On-Demand	Anodyne	PAPA1_CARPA	37	44
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCc2scnc2C)c1	ZINC000875173701	EE	On-Demand	Anodyne	VHL	42	37
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCc2scnc2C)c1	ZINC000875173702	EE	On-Demand	Anodyne	VHL	42	37
O=C(N[C@H]1CCN(Cc2ccccc2)C1=O)N1Cc2cccc(O)c2C1	ZINC000875173703	FE	On-Demand	Clean	SIGMAR1	17	40
O=C(N[C@@H]1CCN(Cc2ccccc2)C1=O)N1Cc2cccc(O)c2C1	ZINC000875173704	FE	On-Demand	Clean	SIGMAR1	17	40
Cc1ncsc1CNC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875173707	FD	On-Demand	Anodyne	SIRT3	52	33
Cc1ncsc1CNC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875173707	FD	On-Demand	Anodyne	SIRT2	54	34
Cc1ncsc1CNC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875173707	FD	On-Demand	Anodyne	SIRT1	52	33
COC(=O)N(C)NC(=O)NC1CCN(c2nc3ccccc3s2)CC1	ZINC000875173710	FE	On-Demand	Reactive	LTA4H	24	44
O=C(NCc1ccccc1-n1cccn1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875173733	FF	On-Demand	Anodyne	EPHX2	18	44
O=C(NCc1ccccc1-n1cccn1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875173735	FF	On-Demand	Anodyne	EPHX2	18	44
COC(=O)[C@@]12C[C@@H](NC(=O)NCCN3Cc4ccccc4C3)C[C@@H]1C2	ZINC000875173787	ED	On-Demand	Anodyne	DRD4	40	32
COC(=O)[C@@]12C[C@@H](NC(=O)NCCN3Cc4ccccc4C3)C[C@@H]1C2	ZINC000875173787	ED	On-Demand	Anodyne	DRD3	16	40
C[C@@H]1Cc2ccccc2N1CCNC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875173797	GD	On-Demand	Anodyne	L3MBTL3	61	40
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2scnc2C)C1	ZINC000875173805	DD	On-Demand	Anodyne	VHL	55	31
O=C(N[C@@H]1C[C@H]1c1cccc(F)c1)N1Cc2cccc(O)c2C1	ZINC000875173816	DG	On-Demand	Clean	EPHX2	22	46
O=C(N[C@H]1C[C@H]1c1cccc(F)c1)N1Cc2cccc(O)c2C1	ZINC000875173817	DG	On-Demand	Clean	EPHX2	22	46
O=C(N[C@H]1C[C@@H]1c1cccc(F)c1)N1Cc2cccc(O)c2C1	ZINC000875173818	DG	On-Demand	Clean	EPHX2	22	46
O=C(NC1CCN(CC(F)(F)F)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875173820	GG	On-Demand	Anodyne	HPGDS	35	40
O=C(NC1CCN(CC(F)(F)F)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875173821	GG	On-Demand	Anodyne	HPGDS	35	40
Cc1ncsc1CNC(=O)C(=O)NCc1ccc(C2(C)OCCO2)cc1	ZINC000875173823	GD	On-Demand	Anodyne	VHL	58	33
CC[C@@H](NC(=O)N[C@@H](C)c1ccccn1)[C@@H](O)c1ccccc1	ZINC000875173824	DF	On-Demand	Anodyne	TACR3	31	40
CC[C@@H](NC(=O)N[C@@H](C)c1ccccn1)[C@H](O)c1ccccc1	ZINC000875173825	DF	On-Demand	Anodyne	TACR3	31	40
CN1CC[C@H]2CN(C(=O)NC3CCN(c4nc5ccccc5s4)CC3)CC[C@H]21	ZINC000875173830	GG	On-Demand	Anodyne	LTA4H	15	43
CN1CC[C@H]2CN(C(=O)NC3CCN(c4nc5ccccc5s4)CC3)CC[C@@H]21	ZINC000875173834	GG	On-Demand	Anodyne	LTA4H	15	43
Cc1nnc(NNC(=O)NC[C@@H]2CCCCN2Cc2ccccc2)n1C	ZINC000875173844	FD	On-Demand	Reactive	DRD2	33	45
Cc1nnc(NNC(=O)NC[C@H]2CCCCN2Cc2ccccc2)n1C	ZINC000875173845	FD	On-Demand	Reactive	DRD2	33	45
O=C(NC1CCN(CC(F)(F)F)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875173852	GF	On-Demand	Anodyne	EPHX2	31	42
O=C(NC1CCN(CC(F)(F)F)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875173852	GF	On-Demand	Anodyne	HPGDS	39	46
O=C(NC1CCN(CC(F)(F)F)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875173853	GF	On-Demand	Anodyne	EPHX2	31	42
O=C(NC1CCN(CC(F)(F)F)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875173853	GF	On-Demand	Anodyne	HPGDS	39	46
O=CN1CCCN(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875173855	FD	On-Demand	Anodyne	DRD4	24	43
O=CN1CCCN(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875173855	FD	On-Demand	Anodyne	SLC6A1	81	34
O=CN1CCCN(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875173855	FD	On-Demand	Anodyne	SIGMAR1	36	50
O=CN1CCCN(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875173855	FD	On-Demand	Anodyne	CCR3	35	49
O=CN1CCCN(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875173856	FD	On-Demand	Anodyne	DRD4	24	43
O=CN1CCCN(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875173856	FD	On-Demand	Anodyne	SLC6A1	81	34
O=CN1CCCN(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875173856	FD	On-Demand	Anodyne	SIGMAR1	36	50
O=CN1CCCN(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000875173856	FD	On-Demand	Anodyne	CCR3	35	49
O=C(NNc1cccc(F)c1Cl)NC1CCN(CC(F)(F)F)CC1	ZINC000875173857	FG	On-Demand	Reactive	SIGMAR1	16	43
O=C(NNc1cccc(F)c1Cl)NC1CCN(CC(F)(F)F)CC1	ZINC000875173857	FG	On-Demand	Reactive	HPGDS	39	43
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875173891	FG	On-Demand	Clean	DRD2	16	48
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875173891	FG	On-Demand	Clean	DRD4	28	42
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875173891	FG	On-Demand	Clean	SIGMAR1	32	48
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875173891	FG	On-Demand	Clean	CCR3	31	47
O=C(NC1CCN(CC(F)(F)F)CC1)N1CCC(CO)(CO)CC1	ZINC000875173928	FC	On-Demand	Anodyne	HPGDS	37	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1C[C@H]1c1cccc(F)c1	ZINC000875173964	EE	On-Demand	Anodyne	SLC6A4	43	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1C[C@H]1c1cccc(F)c1	ZINC000875173964	EE	On-Demand	Anodyne	SLC6A3	79	58
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1C[C@H]1c1cccc(F)c1	ZINC000875173964	EE	On-Demand	Anodyne	CCR5	79	34
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1C[C@H]1c1cccc(F)c1	ZINC000875173964	EE	On-Demand	Anodyne	EPHX2	19	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1C[C@@H]1c1cccc(F)c1	ZINC000875173965	EE	On-Demand	Anodyne	SLC6A4	43	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1C[C@@H]1c1cccc(F)c1	ZINC000875173965	EE	On-Demand	Anodyne	SLC6A3	79	58
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1C[C@@H]1c1cccc(F)c1	ZINC000875173965	EE	On-Demand	Anodyne	CCR5	79	34
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1C[C@@H]1c1cccc(F)c1	ZINC000875173965	EE	On-Demand	Anodyne	EPHX2	19	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1C[C@@H]1c1cccc(F)c1	ZINC000875173966	EE	On-Demand	Anodyne	SLC6A4	43	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1C[C@@H]1c1cccc(F)c1	ZINC000875173966	EE	On-Demand	Anodyne	SLC6A3	79	58
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1C[C@@H]1c1cccc(F)c1	ZINC000875173966	EE	On-Demand	Anodyne	CCR5	79	34
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1C[C@@H]1c1cccc(F)c1	ZINC000875173966	EE	On-Demand	Anodyne	EPHX2	19	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1C[C@H]1c1cccc(F)c1	ZINC000875173967	EE	On-Demand	Anodyne	SLC6A4	43	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1C[C@H]1c1cccc(F)c1	ZINC000875173967	EE	On-Demand	Anodyne	SLC6A3	79	58
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1C[C@H]1c1cccc(F)c1	ZINC000875173967	EE	On-Demand	Anodyne	CCR5	79	34
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1C[C@H]1c1cccc(F)c1	ZINC000875173967	EE	On-Demand	Anodyne	EPHX2	19	40
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875174009	EF	On-Demand	Anodyne	DRD4	21	42
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875174009	EF	On-Demand	Anodyne	HTR4	33	42
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875174009	EF	On-Demand	Anodyne	SIGMAR1	27	47
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875174009	EF	On-Demand	Anodyne	CCR3	46	47
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875174009	EF	On-Demand	Anodyne	BIRC2	36	41
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875174011	EF	On-Demand	Anodyne	DRD4	21	42
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875174011	EF	On-Demand	Anodyne	HTR4	33	42
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875174011	EF	On-Demand	Anodyne	SIGMAR1	27	47
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875174011	EF	On-Demand	Anodyne	CCR3	46	47
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875174011	EF	On-Demand	Anodyne	BIRC2	36	41
COC(=O)C1(O)CN(C(=O)NC2CCN(c3nc4ccccc4s3)CC2)C1	ZINC000875174061	GD	On-Demand	Anodyne	LTA4H	17	41
COC(=O)C1(O)CN(C(=O)N[C@H]2C[C@@H]2c2cccc(F)c2)C1	ZINC000875174070	DC	On-Demand	Anodyne	EPHX2	21	45
COC(=O)C1(O)CN(C(=O)N[C@@H]2C[C@H]2c2cccc(F)c2)C1	ZINC000875174072	DC	On-Demand	Anodyne	EPHX2	21	45
COC(=O)C1(O)CN(C(=O)N[C@H]2C[C@H]2c2cccc(F)c2)C1	ZINC000875174073	DC	On-Demand	Anodyne	EPHX2	21	45
COC(=O)C1(O)CN(C(=O)N[C@@H]2C[C@@H]2c2cccc(F)c2)C1	ZINC000875174074	DC	On-Demand	Anodyne	EPHX2	21	45
Cc1ncsc1CNC(=O)C(=O)NCc1ccc(OC(F)F)cc1F	ZINC000875174091	FE	On-Demand	Anodyne	P2RX7	23	40
Cc1ncsc1CNC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875174096	ED	On-Demand	Anodyne	VHL	58	37
CCCCCCCNC(=O)C(=O)NCc1scnc1C	ZINC000875174101	CE	On-Demand	Mild	ASAH1	81	34
O=C(NCCN1Cc2ccccc2C1)N1Cc2cccc(O)c2C1	ZINC000875174106	DE	On-Demand	Clean	DRD4	43	35
COC(=O)N(C)NC(=O)NCCN1Cc2ccccc2C1	ZINC000875174119	CC	On-Demand	Reactive	HTR1A	18	40
COC(=O)N(C)NC(=O)NCCN1Cc2ccccc2C1	ZINC000875174119	CC	On-Demand	Reactive	DRD2	17	41
COC(=O)N(C)NC(=O)NCCN1Cc2ccccc2C1	ZINC000875174119	CC	On-Demand	Reactive	DRD4	42	34
COC(=O)N(C)NC(=O)NCCN1Cc2ccccc2C1	ZINC000875174119	CC	On-Demand	Reactive	DRD3	31	42
O=C1CCN(C(=O)NC2CCN(CC(F)(F)F)CC2)CCCCCCN1	ZINC000875174137	GE	On-Demand	Anodyne	HPGDS	35	43
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(c3nc4ccccc4s3)CC2)C1	ZINC000875174150	GG	On-Demand	Anodyne	LTA4H	16	42
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(c3nc4ccccc4s3)CC2)C1	ZINC000875174150	GG	On-Demand	Anodyne	TPSAB1	16	41
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(c3nc4ccccc4s3)CC2)C1	ZINC000875174151	GG	On-Demand	Anodyne	LTA4H	16	42
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(c3nc4ccccc4s3)CC2)C1	ZINC000875174151	GG	On-Demand	Anodyne	TPSAB1	16	41
Cc1ncsc1CNC(=O)C(=O)N1C[C@@H]2C[C@H]1CN2C(=O)OC(C)(C)C	ZINC000875174164	GD	On-Demand	Anodyne	VHL	56	33
Cc1ncsc1CNC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875174173	FD	On-Demand	Anodyne	VHL	51	35
Cc1ncsc1CNC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875174174	FD	On-Demand	Anodyne	VHL	51	35
Cc1ncsc1CNC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875174175	FD	On-Demand	Anodyne	VHL	51	35
Cc1ncsc1CNC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875174176	FD	On-Demand	Anodyne	VHL	51	35
C[C@H](NC(=O)NCCN1Cc2ccccc2C1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875174180	GF	On-Demand	Anodyne	GPR119	20	40
C[C@@H](NC(=O)NCCN1Cc2ccccc2C1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875174181	GF	On-Demand	Anodyne	GPR119	20	40
O=C(NCC[C@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000875174182	FE	On-Demand	Anodyne	ACE	40	42
O=C(NCC[C@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000875174182	FE	On-Demand	Anodyne	MME	24	42
O=C(NCC[C@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000875174182	FE	On-Demand	Anodyne	SAP2	40	36
O=C(NCC[C@@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000875174183	FE	On-Demand	Anodyne	ACE	40	42
O=C(NCC[C@@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000875174183	FE	On-Demand	Anodyne	MME	24	42
O=C(NCC[C@@H](O)C1CCCC1)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000875174183	FE	On-Demand	Anodyne	SAP2	40	36
O=C(NCC[C@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000875174184	FE	On-Demand	Anodyne	ACE	40	42
O=C(NCC[C@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000875174184	FE	On-Demand	Anodyne	MME	24	42
O=C(NCC[C@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000875174184	FE	On-Demand	Anodyne	SAP2	40	36
O=C(NCC[C@@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000875174185	FE	On-Demand	Anodyne	ACE	40	42
O=C(NCC[C@@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000875174185	FE	On-Demand	Anodyne	MME	24	42
O=C(NCC[C@@H](O)C1CCCC1)N[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000875174185	FE	On-Demand	Anodyne	SAP2	40	36
COCC1CC(NC(=O)NC2CCN(c3nc4ccccc4s3)CC2)C1	ZINC000875174199	FF	On-Demand	Anodyne	LTA4H	35	48
CN1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2=O)CCC1(C)C	ZINC000875174208	FD	On-Demand	Anodyne	CALCRL	21	40
CN1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2=O)CCC1(C)C	ZINC000875174209	FD	On-Demand	Anodyne	CALCRL	21	40
O=C(NCCN1Cc2ccccc2C1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875174234	GG	On-Demand	Anodyne	OPRL1	15	45
COC(=O)C1(O)CN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000875174240	DB	On-Demand	Anodyne	DRD4	41	33
COC(=O)C1(O)CN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000875174240	DB	On-Demand	Anodyne	DRD3	21	42
O=C(NCC[C@H]1CCSC1)NC1CCN(c2nc3ccccc3s2)CC1	ZINC000875174276	GH	On-Demand	Anodyne	SIRT3	41	32
O=C(NCC[C@H]1CCSC1)NC1CCN(c2nc3ccccc3s2)CC1	ZINC000875174276	GH	On-Demand	Anodyne	SIRT2	45	32
O=C(NCC[C@H]1CCSC1)NC1CCN(c2nc3ccccc3s2)CC1	ZINC000875174276	GH	On-Demand	Anodyne	SIRT1	41	32
O=C(NCC[C@@H]1CCSC1)NC1CCN(c2nc3ccccc3s2)CC1	ZINC000875174277	GH	On-Demand	Anodyne	SIRT3	41	32
O=C(NCC[C@@H]1CCSC1)NC1CCN(c2nc3ccccc3s2)CC1	ZINC000875174277	GH	On-Demand	Anodyne	SIRT2	45	32
O=C(NCC[C@@H]1CCSC1)NC1CCN(c2nc3ccccc3s2)CC1	ZINC000875174277	GH	On-Demand	Anodyne	SIRT1	41	32
COCCN(CC1CCN(C)CC1)C(=O)NCCN1Cc2ccccc2C1	ZINC000875174280	FE	On-Demand	Anodyne	DRD4	41	33
COCCN(CC1CCN(C)CC1)C(=O)NCCN1Cc2ccccc2C1	ZINC000875174280	FE	On-Demand	Anodyne	DRD3	27	40
COCCN(CC1CCN(C)CC1)C(=O)NCCN1Cc2ccccc2C1	ZINC000875174280	FE	On-Demand	Anodyne	CACNA1I	43	34
Cc1ncsc1CNC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875174299	DC	On-Demand	Anodyne	VHL	40	30
Cc1ncsc1CNC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875174300	DC	On-Demand	Anodyne	VHL	40	30
O=C(NCCO)C1CCN(C(=O)NCCN2Cc3ccccc3C2)CC1	ZINC000875174361	FC	On-Demand	Anodyne	PLD2	24	42
O=C(NCc1ccccn1)c1ccc(NC(=O)C2(F)CCOCC2)cc1Cl	ZINC000875174369	GG	On-Demand	Anodyne	AVPR2	26	40
O=C(NCc1ccccn1)c1ccc(NC(=O)C2(F)CCOCC2)cc1Cl	ZINC000875174369	GG	On-Demand	Anodyne	GRM4	56	42
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@H]1CCC[C@@H]1O	ZINC000875174382	DE	On-Demand	Anodyne	EPHX2	17	43
CCCC[C@H](NC(=O)C(=O)N[C@H](C)c1ccnn1C)c1ccc(OC)cc1	ZINC000875174391	FF	On-Demand	Anodyne	CTSK	36	40
CCCC[C@@H](NC(=O)C(=O)N[C@H](C)c1ccnn1C)c1ccc(OC)cc1	ZINC000875174392	FF	On-Demand	Anodyne	CTSK	36	40
CCCC[C@@H](NC(=O)C(=O)N[C@@H](C)c1ccnn1C)c1ccc(OC)cc1	ZINC000875174393	FF	On-Demand	Anodyne	CTSK	36	40
CCCC[C@H](NC(=O)C(=O)N[C@@H](C)c1ccnn1C)c1ccc(OC)cc1	ZINC000875174394	FF	On-Demand	Anodyne	CTSK	36	40
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000875174400	DC	On-Demand	Anodyne	ACE	27	40
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000875174400	DC	On-Demand	Anodyne	MME	18	40
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000875174401	DC	On-Demand	Anodyne	ACE	27	40
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000875174401	DC	On-Demand	Anodyne	MME	18	40
C[C@@H]1Cc2ccccc2N1CCNC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875174415	GE	On-Demand	Anodyne	ETHR	42	33
C[C@@H]1Cc2ccccc2N1CCNC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875174417	GE	On-Demand	Anodyne	ETHR	42	33
COC(=O)N(C)NC(=O)NCCc1ccc2ccccc2n1	ZINC000875174431	DD	On-Demand	Reactive	ALOX5	18	42
COC(=O)N(C)NC(=O)NCCc1ccc2ccccc2n1	ZINC000875174431	DD	On-Demand	Reactive	CYSLTR1	43	45
COC(=O)N(C)NC(=O)NCCc1ccc2ccccc2n1	ZINC000875174431	DD	On-Demand	Reactive	MTNR1A	45	38
CC(=O)C1CCN(C(=O)NC2CCN(c3nc4ccccc4s3)CC2)CC1	ZINC000875174464	GG	On-Demand	Anodyne	LTA4H	17	44
CC(=O)C1CCN(C(=O)NC2CCN(c3nc4ccccc4s3)CC2)CC1	ZINC000875174464	GG	On-Demand	Anodyne	SMO	28	41
COCC(C)(C)CCNC(=O)NC1CCN(c2nc3ccccc3s2)CC1	ZINC000875174471	GH	On-Demand	Anodyne	LTA4H	15	42
O=C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2=O)CCCCCCN1	ZINC000875174483	GD	On-Demand	Anodyne	ACE	29	41
O=C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2=O)CCCCCCN1	ZINC000875174483	GD	On-Demand	Anodyne	MME	20	41
O=C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2=O)CCCCCCN1	ZINC000875174483	GD	On-Demand	Anodyne	SIGMAR1	20	40
O=C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2=O)CCCCCCN1	ZINC000875174483	GD	On-Demand	Anodyne	SAP2	24	41
O=C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2=O)CCCCCCN1	ZINC000875174484	GD	On-Demand	Anodyne	ACE	29	41
O=C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2=O)CCCCCCN1	ZINC000875174484	GD	On-Demand	Anodyne	MME	20	41
O=C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2=O)CCCCCCN1	ZINC000875174484	GD	On-Demand	Anodyne	SIGMAR1	20	40
O=C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2=O)CCCCCCN1	ZINC000875174484	GD	On-Demand	Anodyne	SAP2	24	41
C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)NCc2ccccn2)c(Cl)c1	ZINC000875174485	GH	On-Demand	Anodyne	GRM4	68	42
C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)NCc2ccccn2)c(Cl)c1	ZINC000875174485	GH	On-Demand	Anodyne	TYK2	51	40
C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)NCc2ccccn2)c(Cl)c1	ZINC000875174486	GH	On-Demand	Anodyne	GRM4	68	42
C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)NCc2ccccn2)c(Cl)c1	ZINC000875174486	GH	On-Demand	Anodyne	TYK2	51	40
C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)NCc2ccccn2)c(Cl)c1	ZINC000875174487	GH	On-Demand	Anodyne	GRM4	68	42
C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)NCc2ccccn2)c(Cl)c1	ZINC000875174487	GH	On-Demand	Anodyne	TYK2	51	40
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(CC4CCCCC4)CC3)C[C@@H]1C2	ZINC000875174489	GF	On-Demand	Anodyne	EPHX2	17	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000875174549	ED	On-Demand	Anodyne	ACE	40	38
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000875174549	ED	On-Demand	Anodyne	RIR1_HHV11	15	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000875174549	ED	On-Demand	Anodyne	XIAP	43	34
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000875174549	ED	On-Demand	Anodyne	BIRC8	45	32
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000875174550	ED	On-Demand	Anodyne	ACE	40	38
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000875174550	ED	On-Demand	Anodyne	RIR1_HHV11	15	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000875174550	ED	On-Demand	Anodyne	XIAP	43	34
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000875174550	ED	On-Demand	Anodyne	BIRC8	45	32
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000875174551	FD	On-Demand	Anodyne	SLC6A4	22	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000875174551	FD	On-Demand	Anodyne	SLC6A3	47	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000875174552	FD	On-Demand	Anodyne	SLC6A4	22	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000875174552	FD	On-Demand	Anodyne	SLC6A3	47	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000875174553	FD	On-Demand	Anodyne	SLC6A4	22	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000875174553	FD	On-Demand	Anodyne	SLC6A3	47	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000875174554	FD	On-Demand	Anodyne	SLC6A4	22	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000875174554	FD	On-Demand	Anodyne	SLC6A3	47	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2=O)C1	ZINC000875174561	FD	On-Demand	Anodyne	ACE	67	47
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2=O)C1	ZINC000875174561	FD	On-Demand	Anodyne	BIRC2	51	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C2=O)C1	ZINC000875174561	FD	On-Demand	Anodyne	SAP2	40	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2=O)C1	ZINC000875174562	FD	On-Demand	Anodyne	ACE	67	47
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2=O)C1	ZINC000875174562	FD	On-Demand	Anodyne	BIRC2	51	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2=O)C1	ZINC000875174562	FD	On-Demand	Anodyne	SAP2	40	35
COC(=O)c1cc(F)ccc1NC(=O)[C@@H]1COC(=O)N1C	ZINC000875174586	CD	On-Demand	Anodyne	P2RX7	15	42
COC(=O)c1cc(F)ccc1NC(=O)[C@H]1COC(=O)N1C	ZINC000875174587	CD	On-Demand	Anodyne	P2RX7	15	42
O=C(N[C@H]1CCN(Cc2ccccc2)C1=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875174602	GF	On-Demand	Anodyne	EPHX2	25	40
O=C(N[C@H]1CCN(Cc2ccccc2)C1=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875174603	GF	On-Demand	Anodyne	EPHX2	25	40
O=C(N[C@@H]1CCN(Cc2ccccc2)C1=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875174604	GF	On-Demand	Anodyne	EPHX2	25	40
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(c2nc3ccccc3s2)CC1	ZINC000875174618	FE	On-Demand	Anodyne	LTA4H	23	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc2cccnc12	ZINC000875174633	EE	On-Demand	Anodyne	SLC6A3	41	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc2cccnc12	ZINC000875174634	EE	On-Demand	Anodyne	SLC6A3	41	37
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)[C@]1(C#N)CCCOC1	ZINC000875174637	FH	On-Demand	Mild	MAPK14	28	46
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)[C@]1(C#N)CCCOC1	ZINC000875174637	FH	On-Demand	Mild	KCNK3	78	38
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)[C@@]1(C#N)CCCOC1	ZINC000875174638	FH	On-Demand	Mild	MAPK14	28	46
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)[C@@]1(C#N)CCCOC1	ZINC000875174638	FH	On-Demand	Mild	KCNK3	78	38
O=C(NCc1ccccc1N1CCOCC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875174639	GE	On-Demand	Anodyne	EPHX2	21	41
O=C(NCc1ccccc1N1CCOCC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875174639	GE	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1ccccc1N1CCOCC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875174640	GE	On-Demand	Anodyne	EPHX2	21	41
O=C(NCc1ccccc1N1CCOCC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875174640	GE	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1ccccc1N1CCOCC1)N1O[C@H]2C=C[C@H]1CC2	ZINC000875174641	EE	On-Demand	Anodyne	SCN10A	15	46
O=C(NCc1cccc2cccnc12)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875174645	FG	On-Demand	Anodyne	EPHX2	20	46
O=C(NCc1cccc2cccnc12)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875174646	FG	On-Demand	Anodyne	EPHX2	20	46
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)C1	ZINC000875174648	GD	On-Demand	Anodyne	SIGMAR1	20	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)C1	ZINC000875174649	GD	On-Demand	Anodyne	SIGMAR1	20	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)C1	ZINC000875174650	GD	On-Demand	Anodyne	SIGMAR1	20	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)C1	ZINC000875174651	GD	On-Demand	Anodyne	SIGMAR1	20	40
CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(Cl)c3cccnc23)c1	ZINC000875174652	JK	On-Demand	Anodyne	GRM4	40	38
CC(=O)C1CCN(C(=O)NCc2ccccc2N2CCOCC2)CC1	ZINC000875174653	EE	On-Demand	Anodyne	KCNQ2	57	35
CC(=O)C1CCN(C(=O)NCc2ccccc2N2CCOCC2)CC1	ZINC000875174653	EE	On-Demand	Anodyne	EPHX2	29	45
CC(=O)C1CCN(C(=O)NCc2ccccc2N2CCOCC2)CC1	ZINC000875174653	EE	On-Demand	Anodyne	SCN10A	16	48
CCOc1cccc([C@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)c1	ZINC000875174655	FD	On-Demand	Anodyne	MTNR1A	18	43
CCOc1cccc([C@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)c1	ZINC000875174655	FD	On-Demand	Anodyne	MTNR1B	18	40
CCOc1cccc([C@@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)c1	ZINC000875174656	FD	On-Demand	Anodyne	MTNR1A	18	43
CCOc1cccc([C@@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)c1	ZINC000875174656	FD	On-Demand	Anodyne	MTNR1B	18	40
CCOc1cccc([C@@H](C)NC(=O)NC[C@@H]2CCO[C@@H]2C(=O)OC)c1	ZINC000875174672	FE	On-Demand	Anodyne	PDS	54	39
CCOc1cccc([C@H](C)NC(=O)NC[C@@H]2CCO[C@@H]2C(=O)OC)c1	ZINC000875174673	FE	On-Demand	Anodyne	PDS	54	39
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)CC1	ZINC000875174688	GD	On-Demand	Anodyne	SIGMAR1	23	43
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)CC1	ZINC000875174690	GD	On-Demand	Anodyne	SIGMAR1	23	43
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)CC1	ZINC000875174691	GD	On-Demand	Anodyne	SIGMAR1	23	43
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)CC1	ZINC000875174692	GD	On-Demand	Anodyne	SIGMAR1	23	43
CC(=O)[C@H]1CCCN(C(=O)NCc2ccccc2N2CCOCC2)C1	ZINC000875174693	EE	On-Demand	Anodyne	KCNQ2	61	35
CC(=O)[C@H]1CCCN(C(=O)NCc2ccccc2N2CCOCC2)C1	ZINC000875174693	EE	On-Demand	Anodyne	EPHX2	15	40
CC(=O)[C@H]1CCCN(C(=O)NCc2ccccc2N2CCOCC2)C1	ZINC000875174693	EE	On-Demand	Anodyne	SCN10A	17	43
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccccc2N2CCOCC2)C1	ZINC000875174695	EE	On-Demand	Anodyne	KCNQ2	61	35
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccccc2N2CCOCC2)C1	ZINC000875174695	EE	On-Demand	Anodyne	EPHX2	15	40
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccccc2N2CCOCC2)C1	ZINC000875174695	EE	On-Demand	Anodyne	SCN10A	17	43
C[C@@H]1CN(C(=O)NCc2ccccc2N2CCOCC2)C[C@@H](C)C1(F)F	ZINC000875174709	FF	On-Demand	Anodyne	SCN10A	15	44
O=C(NCCCCC1CC1)NCc1ccccc1N1CCOCC1	ZINC000875174721	EF	On-Demand	Anodyne	SCN10A	15	45
CONC(=O)C1CCN(C(=O)NCc2ccccc2N2CCOCC2)CC1	ZINC000875174722	GD	On-Demand	Anodyne	EPHX2	28	46
CONC(=O)C1CCN(C(=O)NCc2ccccc2N2CCOCC2)CC1	ZINC000875174722	GD	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1ccccc1N1CCOCC1)NC[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875174723	GG	On-Demand	Anodyne	SCN10A	15	44
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)C1(C)CC(F)(F)C1	ZINC000875174724	FJ	On-Demand	Anodyne	FSHR	40	38
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)C1(C)CC(F)(F)C1	ZINC000875174724	FJ	On-Demand	Anodyne	MAPK14	39	50
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)C1(C)CC(F)(F)C1	ZINC000875174724	FJ	On-Demand	Anodyne	PRNP	52	42
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)C1(C)CC(F)(F)C1	ZINC000875174724	FJ	On-Demand	Anodyne	NR1H4	16	41
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)C1(C)CC(F)(F)C1	ZINC000875174724	FJ	On-Demand	Anodyne	CSF1R	15	45
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)C1(C)CC(F)(F)C1	ZINC000875174724	FJ	On-Demand	Anodyne	SMO	32	41
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)C1(C)CC(F)(F)C1	ZINC000875174724	FJ	On-Demand	Anodyne	KCNK3	124	47
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)C1(C)CC(F)(F)C1	ZINC000875174724	FJ	On-Demand	Anodyne	KCNK9	75	46
O=C(NCc1ccccc1N1CCOCC1)N[C@@H]1COCC[C@H]1O	ZINC000875174734	EC	On-Demand	Anodyne	SCN10A	15	45
O=C(NCc1ccccc1N1CCOCC1)NC[C@H]1C[C@H](O)C1	ZINC000875174740	DD	On-Demand	Anodyne	SCN10A	15	47
O=C(Nc1ccc(Cl)c2cccnc12)c1ccc[n+]([O-])c1	ZINC000875174746	CF	On-Demand	Anodyne	GRM4	44	41
O=C(NCc1ccccc1N1CCOCC1)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875174752	ED	On-Demand	Anodyne	SCN10A	15	45
O=C(NCc1ccccc1N1CCOCC1)NC1CN(c2ccncn2)C1	ZINC000875174757	FD	On-Demand	Anodyne	SCN10A	18	44
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)C1(F)CCOCC1	ZINC000875174767	FH	On-Demand	Anodyne	MAPK14	40	48
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)C1(F)CCOCC1	ZINC000875174767	FH	On-Demand	Anodyne	PRNP	42	38
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)C1(F)CCOCC1	ZINC000875174767	FH	On-Demand	Anodyne	NR1H4	26	40
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)C1(F)CCOCC1	ZINC000875174767	FH	On-Demand	Anodyne	BRAF	15	44
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)C1(F)CCOCC1	ZINC000875174767	FH	On-Demand	Anodyne	SMO	27	40
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)C1(F)CCOCC1	ZINC000875174767	FH	On-Demand	Anodyne	KCNK3	100	43
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)C1(F)CCOCC1	ZINC000875174767	FH	On-Demand	Anodyne	KCNK9	49	42
CC[C@@H](NC(=O)NCc1ccccc1N1CCOCC1)[C@@H](O)c1ccccc1	ZINC000875174769	GF	On-Demand	Anodyne	KCNQ2	59	40
O=C(NCc1ccccc1N1CCOCC1)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875174772	EF	On-Demand	Anodyne	SCN10A	15	46
CC[C@@H](NC(=O)NCc1ccccc1N1CCOCC1)[C@H](O)c1ccccc1	ZINC000875174775	GF	On-Demand	Anodyne	KCNQ2	59	40
O=C(NCc1ccnc(F)c1)NCc1ccccc1N1CCOCC1	ZINC000875174788	EE	On-Demand	Anodyne	SCN10A	22	48
O=C(NCc1ccnc(F)c1)NCc1ccccc1N1CCOCC1	ZINC000875174788	EE	On-Demand	Anodyne	STAT6	53	35
O=C(NCC[C@H](O)C(F)F)NCc1ccccc1N1CCOCC1	ZINC000875174789	ED	On-Demand	Anodyne	SCN10A	15	45
O=C(NCC[C@@H](O)C(F)F)NCc1ccccc1N1CCOCC1	ZINC000875174790	ED	On-Demand	Anodyne	SCN10A	15	45
O=C(NCc1ccc2cccnc2c1)NCc1ccccc1N1CCOCC1	ZINC000875174799	GG	On-Demand	Anodyne	SCN10A	23	46
O=C(NCc1ccccc1N1CCOCC1)NC[C@@H]1C[C@H](O)C1	ZINC000875174800	DD	On-Demand	Anodyne	SCN10A	15	47
O=C(NCc1ccccc1N1CCOCC1)NCC1CC(O)C1	ZINC000875174801	DD	On-Demand	Anodyne	SCN10A	15	47
CO[C@@H]1C[C@@H](NC(=O)NCc2ccccc2N2CCOCC2)C1	ZINC000875174805	DD	On-Demand	Anodyne	SCN10A	15	44
Cn1cc(CCNC(=O)NCc2ccccc2N2CCOCC2)c2cccnc21	ZINC000875174806	GE	On-Demand	Anodyne	SCN10A	26	41
O=C(NCc1ccccc1N1CCOCC1)N1CCN(c2nccnn2)CC1	ZINC000875174808	GC	On-Demand	Anodyne	SCN10A	19	46
O=C(NCc1ccccc1N1CCOCC1)N1CC(c2ccccc2)C1	ZINC000875174810	FF	On-Demand	Anodyne	KCNQ2	49	37
O=C(NCc1ccccc1N1CCOCC1)N1CC(c2ccccc2)C1	ZINC000875174810	FF	On-Demand	Anodyne	EPHX2	15	44
O=C(NCc1ccccc1N1CCOCC1)N1CC(c2ccccc2)C1	ZINC000875174810	FF	On-Demand	Anodyne	SCN10A	15	48
O=C(NCc1ccccc1N1CCOCC1)N[C@H]1CCCC12CC2	ZINC000875174811	EF	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1ccccc1N1CCOCC1)N[C@@H]1CCCC12CC2	ZINC000875174812	EF	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1ccccc1N1CCOCC1)N1CC(Cc2cccs2)C1	ZINC000875174814	FF	On-Demand	Anodyne	MC4R	16	42
COc1ccc(N2CCN(C(=O)C(=O)NCc3nccn3C)CC2)c(OC)c1	ZINC000875174822	GC	On-Demand	Clean	HTR1A	45	39
COc1ccc(N2CCN(C(=O)C(=O)NCc3nccn3C)CC2)c(OC)c1	ZINC000875174822	GC	On-Demand	Clean	DRD2	37	41
COc1ccc(N2CCN(C(=O)C(=O)NCc3nccn3C)CC2)c(OC)c1	ZINC000875174822	GC	On-Demand	Clean	DRD4	42	33
COc1ccc(N2CCN(C(=O)C(=O)NCc3nccn3C)CC2)c(OC)c1	ZINC000875174822	GC	On-Demand	Clean	ADRA1D	26	41
COc1ccc(N2CCN(C(=O)C(=O)NCc3nccn3C)CC2)c(OC)c1	ZINC000875174822	GC	On-Demand	Clean	ADRA1A	25	41
COc1ccc(N2CCN(C(=O)C(=O)NCc3nccn3C)CC2)c(OC)c1	ZINC000875174822	GC	On-Demand	Clean	DRD3	56	38
COc1ccc(N2CCN(C(=O)C(=O)NCc3nccn3C)CC2)c(OC)c1	ZINC000875174822	GC	On-Demand	Clean	PDGFRB	50	38
COc1ccc(N2CCN(C(=O)C(=O)NCc3nccn3C)CC2)c(OC)c1	ZINC000875174822	GC	On-Demand	Clean	HTR7	40	39
O=C(NCc1ccccc1N1CCOCC1)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875174824	GD	On-Demand	Anodyne	SCN10A	15	46
O=C(NCc1ccccc1N1CCOCC1)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875174825	GD	On-Demand	Anodyne	SCN10A	15	46
O=C(NCc1csc(C(F)(F)F)c1)NCc1ccccc1N1CCOCC1	ZINC000875174826	GH	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1ccccc1N1CCOCC1)N[C@H]1CCCC[C@H]1F	ZINC000875174827	EF	On-Demand	Anodyne	SCN10A	15	44
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)[C@]1(C)CCC(=O)N1	ZINC000875174836	FF	On-Demand	Anodyne	MAPK14	26	52
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)[C@]1(C)CCC(=O)N1	ZINC000875174836	FF	On-Demand	Anodyne	NR1H4	15	43
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)[C@]1(C)CCC(=O)N1	ZINC000875174836	FF	On-Demand	Anodyne	KCNK3	95	41
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)[C@]1(C)CCC(=O)N1	ZINC000875174836	FF	On-Demand	Anodyne	KCNK9	47	40
CCOc1cccc([C@@H](C)NC(=O)N(CC)OCC)c1	ZINC000875174837	CG	On-Demand	Anodyne	ACACA	21	42
CCOc1cccc([C@@H](C)NC(=O)N(CC)OCC)c1	ZINC000875174837	CG	On-Demand	Anodyne	ACACB	22	51
CCOc1cccc([C@@H](C)NC(=O)N(CC)OCC)c1	ZINC000875174837	CG	On-Demand	Anodyne	PDS	64	46
CCOc1cccc([C@H](C)NC(=O)N(CC)OCC)c1	ZINC000875174838	CG	On-Demand	Anodyne	ACACA	21	42
CCOc1cccc([C@H](C)NC(=O)N(CC)OCC)c1	ZINC000875174838	CG	On-Demand	Anodyne	ACACB	22	51
CCOc1cccc([C@H](C)NC(=O)N(CC)OCC)c1	ZINC000875174838	CG	On-Demand	Anodyne	PDS	64	46
CC(C)(C)OC(=O)N1CCN(CCNC(=O)N2Cc3cccc(O)c3C2)CC1	ZINC000875174849	GD	On-Demand	Clean	DRD2	18	42
CC(C)(C)OC(=O)N1CCN(CCNC(=O)N2Cc3cccc(O)c3C2)CC1	ZINC000875174849	GD	On-Demand	Clean	DRD4	48	37
CCOc1cccc([C@H](C)NC(=O)NC[C@@H]2CC(C(F)(F)F)=NO2)c1	ZINC000875174851	FG	On-Demand	Anodyne	PDS	45	36
CCOc1cccc([C@H](C)NC(=O)NC[C@H]2CC(C(F)(F)F)=NO2)c1	ZINC000875174852	FG	On-Demand	Anodyne	PDS	45	36
CCOc1cccc([C@@H](C)NC(=O)NC[C@@H]2CC(C(F)(F)F)=NO2)c1	ZINC000875174853	FG	On-Demand	Anodyne	PDS	45	36
CCOc1cccc([C@@H](C)NC(=O)NC[C@H]2CC(C(F)(F)F)=NO2)c1	ZINC000875174854	FG	On-Demand	Anodyne	PDS	45	36
CN(C)C[C@@H]1CN(C(=O)NCc2noc(-c3cccs3)n2)C[C@H]1CN(C)C	ZINC000875174855	GD	On-Demand	Anodyne	ETHR	36	41
CCOc1cccc([C@H](C)NC(=O)N(C)CCN2CC3(CCOCC3)C2)c1	ZINC000875174857	GF	On-Demand	Anodyne	CASR	41	41
CCOc1cccc([C@@H](C)NC(=O)N(C)CCN2CC3(CCOCC3)C2)c1	ZINC000875174858	GF	On-Demand	Anodyne	CASR	41	41
O=C(NCc1noc(-c2cccs2)n1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875174879	FG	On-Demand	Anodyne	ETHR	33	41
CN1CCN(C(=O)NCc2ccccc2N2CCOCC2)Cc2cccnc21	ZINC000875174892	GE	On-Demand	Anodyne	SCN10A	22	43
O=C(Nc1ccc(Cl)c2cccnc12)c1cc(-c2ccncc2)nc2ccccc12	ZINC000875174907	HK	On-Demand	Anodyne	PRS	47	42
O=C(Nc1ccc(Cl)c2cccnc12)c1cc(-c2ccncc2)nc2ccccc12	ZINC000875174907	HK	On-Demand	Anodyne	TACR3	18	48
O=C(Nc1ccc(Cl)c2cccnc12)c1cc(-c2ccncc2)nc2ccccc12	ZINC000875174907	HK	On-Demand	Anodyne	GRM4	50	43
O=C(Nc1ccc(Cl)c2cccnc12)c1cc(-c2ccncc2)nc2ccccc12	ZINC000875174907	HK	On-Demand	Anodyne	NR2E3	60	33
O=C(Nc1ccc(Cl)c2cccnc12)c1cc(-c2ccncc2)nc2ccccc12	ZINC000875174907	HK	On-Demand	Anodyne	MT-CO2	49	39
CN(CC1(C)COC1)C(=O)NCc1ccccc1N1CCOCC1	ZINC000875174915	ED	On-Demand	Anodyne	KCNQ2	41	34
CN(CC1(C)COC1)C(=O)NCc1ccccc1N1CCOCC1	ZINC000875174915	ED	On-Demand	Anodyne	SCN10A	15	45
O=C(NCc1ccccc1N1CCOCC1)N[C@@H]1C[C@H]1c1ccsc1	ZINC000875174929	FF	On-Demand	Anodyne	EPHX2	16	41
O=C(NCc1ccccc1N1CCOCC1)NC[C@@H]1CCO[C@H]1c1cn[nH]c1	ZINC000875174931	GD	On-Demand	Anodyne	SCN10A	15	43
NC(=O)[C@@H]1C[C@@H](NC(=O)NCc2ccccc2N2CCOCC2)C1	ZINC000875174933	EC	On-Demand	Anodyne	SCN10A	15	45
NC(=O)C1CC(NC(=O)NCc2ccccc2N2CCOCC2)C1	ZINC000875174935	EC	On-Demand	Anodyne	SCN10A	15	45
O=CN1CCCN(C(=O)NCc2ccccc2Oc2ccccc2)CC1	ZINC000875174938	FF	On-Demand	Anodyne	HRH3	23	43
Cc1ncc([C@@H](C)NC(=O)NCc2ccccc2N2CCOCC2)s1	ZINC000875174940	FF	On-Demand	Anodyne	SCN10A	15	44
Cc1ncc([C@H](C)NC(=O)NCc2ccccc2N2CCOCC2)s1	ZINC000875174941	FF	On-Demand	Anodyne	SCN10A	15	44
CCn1ncc(CNC(=O)NCc2ccccc2N2CCOCC2)n1	ZINC000875174942	ED	On-Demand	Anodyne	SCN10A	22	50
O=C(NCc1ccccc1N1CCOCC1)N[C@@H]1CCO[C@H]1c1ccncc1	ZINC000875174943	GE	On-Demand	Anodyne	SCN10A	15	46
O=C(NCc1ccccc1N1CCOCC1)N[C@H]1Cc2cncn2C1	ZINC000875174956	ED	On-Demand	Anodyne	SCN10A	15	47
O=C(NCc1ccccc1N1CCOCC1)N[C@@H]1Cc2cncn2C1	ZINC000875174957	ED	On-Demand	Anodyne	SCN10A	15	47
O=C(NCc1ccccc1N1CCOCC1)N1[C@H]2CC[C@H]1CC(F)(F)C2	ZINC000875174966	FF	On-Demand	Anodyne	SCN10A	15	44
CCC[C@H](CC)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875174992	DG	On-Demand	Anodyne	ACE	41	44
CCC[C@H](CC)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875174992	DG	On-Demand	Anodyne	MME	15	44
CCC[C@H](CC)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875174992	DG	On-Demand	Anodyne	KCNQ2	40	37
CCC[C@H](CC)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875174992	DG	On-Demand	Anodyne	XIAP	52	39
CCC[C@H](CC)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875174993	DG	On-Demand	Anodyne	ACE	41	44
CCC[C@H](CC)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875174993	DG	On-Demand	Anodyne	MME	15	44
CCC[C@H](CC)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875174993	DG	On-Demand	Anodyne	KCNQ2	40	37
CCC[C@H](CC)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875174993	DG	On-Demand	Anodyne	XIAP	52	39
CCC[C@H](CC)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875174994	DG	On-Demand	Anodyne	ACE	41	44
CCC[C@H](CC)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875174994	DG	On-Demand	Anodyne	MME	15	44
CCC[C@H](CC)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875174994	DG	On-Demand	Anodyne	KCNQ2	40	37
CCC[C@H](CC)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875174994	DG	On-Demand	Anodyne	XIAP	52	39
CCC[C@H](CC)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875174995	DG	On-Demand	Anodyne	ACE	41	44
CCC[C@H](CC)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875174995	DG	On-Demand	Anodyne	MME	15	44
CCC[C@H](CC)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875174995	DG	On-Demand	Anodyne	KCNQ2	40	37
CCC[C@H](CC)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875174995	DG	On-Demand	Anodyne	XIAP	52	39
CC(=O)C1CCN(C(=O)C(=O)NCCc2ccc(OCCN(C)C)cc2)CC1	ZINC000875175000	GD	On-Demand	Anodyne	HRH3	17	42
C[C@@]1(CNC(=O)NCc2ccccc2N2CCOCC2)C[C@@H]2C[C@@H]2C1	ZINC000875175008	EF	On-Demand	Anodyne	SCN10A	15	45
O=C(NCc1ccccc1N1CCOCC1)N[C@@H]1C[C@H]1C(F)(F)F	ZINC000875175009	EE	On-Demand	Anodyne	SCN10A	16	47
O=C(NCc1ccccc1N1CCOCC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875175020	GG	On-Demand	Anodyne	EPHX2	23	44
O=C(NCc1ccccc1N1CCOCC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875175021	GG	On-Demand	Anodyne	EPHX2	23	44
CC[C@@H](NC(=O)N(C)Cc1ccc2cc[nH]c2c1)c1ccccc1	ZINC000875175041	DI	On-Demand	Anodyne	TACR3	46	40
CC[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1ccccc1	ZINC000875175054	DE	On-Demand	Anodyne	CACNA1H	48	53
CC[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1ccccc1	ZINC000875175054	DE	On-Demand	Anodyne	GHRHR	77	35
CC[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1ccccc1	ZINC000875175054	DE	On-Demand	Anodyne	TACR3	40	38
CC[C@@H](NC(=O)N1CCC(C(C)=O)CC1)c1ccccc1	ZINC000875175069	CG	On-Demand	Anodyne	CACNA1H	16	44
CC[C@@H](NC(=O)N1CCC(C(C)=O)CC1)c1ccccc1	ZINC000875175069	CG	On-Demand	Anodyne	KCNQ2	51	37
CC[C@@H](NC(=O)N1CCC(C(C)=O)CC1)c1ccccc1	ZINC000875175069	CG	On-Demand	Anodyne	CCR5	41	45
CC[C@@H](NC(=O)N1CCC(C(C)=O)CC1)c1ccccc1	ZINC000875175069	CG	On-Demand	Anodyne	TACR3	50	40
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccccc1C(F)(F)F	ZINC000875175071	GG	On-Demand	Anodyne	P2RX7	42	39
CC[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875175090	DG	On-Demand	Anodyne	TACR3	44	38
CC[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875175090	DG	On-Demand	Anodyne	AMY2	48	34
CC[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875175090	DG	On-Demand	Anodyne	REN	15	44
CC[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875175090	DG	On-Demand	Anodyne	XIAP	44	38
CC[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875175091	DG	On-Demand	Anodyne	TACR3	44	38
CC[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875175091	DG	On-Demand	Anodyne	AMY2	48	34
CC[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875175091	DG	On-Demand	Anodyne	REN	15	44
CC[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875175091	DG	On-Demand	Anodyne	XIAP	44	38
O=C(Nc1ccc(Cl)c2cccnc12)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	ZINC000875175095	JJ	On-Demand	Anodyne	GRM4	37	40
O=C(Nc1ccc(Cl)c2cccnc12)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	ZINC000875175095	JJ	On-Demand	Anodyne	NAMPT	32	44
O=C(Nc1ccc(Cl)c2cccnc12)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	ZINC000875175095	JJ	On-Demand	Anodyne	G2YM83_BOTF4	45	32
O=C(NCCCOc1ccc(Cl)cc1Cl)N1CCC(CO)(CO)CC1	ZINC000875175096	GF	On-Demand	Anodyne	EPHX2	17	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1C(F)(F)F	ZINC000875175097	FF	On-Demand	Anodyne	SLC6A3	51	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1C(F)(F)F	ZINC000875175097	FF	On-Demand	Anodyne	P2RX7	45	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1C(F)(F)F	ZINC000875175097	FF	On-Demand	Anodyne	RBP4	52	33
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1C(F)(F)F	ZINC000875175098	FF	On-Demand	Anodyne	SLC6A3	51	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1C(F)(F)F	ZINC000875175098	FF	On-Demand	Anodyne	P2RX7	45	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1C(F)(F)F	ZINC000875175098	FF	On-Demand	Anodyne	RBP4	52	33
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccccc2C(F)(F)F)C1	ZINC000875175100	FG	On-Demand	Anodyne	P2RX7	44	43
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccccc2C(F)(F)F)C1	ZINC000875175100	FG	On-Demand	Anodyne	RBP4	73	42
CC[C@@H](NC(=O)N1CCN(C)C(C)(C)CC1)c1ccccc1	ZINC000875175103	DG	On-Demand	Anodyne	CACNA1H	25	46
CC[C@@H](NC(=O)N1CCN(C)C(C)(C)CC1)c1ccccc1	ZINC000875175103	DG	On-Demand	Anodyne	TACR3	43	38
CC[C@@H](NC(=O)N(C)CCS(N)(=O)=O)c1ccccc1	ZINC000875175118	CD	On-Demand	Anodyne	TACR3	48	40
CC[C@]1(C(=O)Nc2cc(NC(=O)c3ccccc3)ccc2C)CCNC1=O	ZINC000875175124	FG	On-Demand	Anodyne	MAPK14	29	47
CC[C@]1(C(=O)Nc2cc(NC(=O)c3ccccc3)ccc2C)CCNC1=O	ZINC000875175124	FG	On-Demand	Anodyne	PRNP	40	35
CC[C@]1(C(=O)Nc2cc(NC(=O)c3ccccc3)ccc2C)CCNC1=O	ZINC000875175124	FG	On-Demand	Anodyne	NR1H4	17	41
CC[C@]1(C(=O)Nc2cc(NC(=O)c3ccccc3)ccc2C)CCNC1=O	ZINC000875175124	FG	On-Demand	Anodyne	KCNK3	93	40
CC[C@]1(C(=O)Nc2cc(NC(=O)c3ccccc3)ccc2C)CCNC1=O	ZINC000875175124	FG	On-Demand	Anodyne	KCNK9	48	40
CCOc1cccc([C@H](C)NC(=O)NN(C)C(=O)OC)c1	ZINC000875175135	CE	On-Demand	Reactive	ACACA	18	40
CCOc1cccc([C@H](C)NC(=O)NN(C)C(=O)OC)c1	ZINC000875175135	CE	On-Demand	Reactive	ACACB	20	49
CCOc1cccc([C@H](C)NC(=O)NN(C)C(=O)OC)c1	ZINC000875175135	CE	On-Demand	Reactive	MTNR1A	25	40
CCOc1cccc([C@H](C)NC(=O)NN(C)C(=O)OC)c1	ZINC000875175135	CE	On-Demand	Reactive	MTNR1B	20	40
CCOc1cccc([C@H](C)NC(=O)NN(C)C(=O)OC)c1	ZINC000875175135	CE	On-Demand	Reactive	PDS	50	47
CCOc1cccc([C@@H](C)NC(=O)NN(C)C(=O)OC)c1	ZINC000875175136	CE	On-Demand	Reactive	ACACA	18	40
CCOc1cccc([C@@H](C)NC(=O)NN(C)C(=O)OC)c1	ZINC000875175136	CE	On-Demand	Reactive	ACACB	20	49
CCOc1cccc([C@@H](C)NC(=O)NN(C)C(=O)OC)c1	ZINC000875175136	CE	On-Demand	Reactive	MTNR1A	25	40
CCOc1cccc([C@@H](C)NC(=O)NN(C)C(=O)OC)c1	ZINC000875175136	CE	On-Demand	Reactive	MTNR1B	20	40
CCOc1cccc([C@@H](C)NC(=O)NN(C)C(=O)OC)c1	ZINC000875175136	CE	On-Demand	Reactive	PDS	50	47
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)[C@@]12CCCC[C@H]1C2	ZINC000875175167	EJ	On-Demand	Anodyne	MAPK14	30	48
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)[C@@]12CCCC[C@H]1C2	ZINC000875175167	EJ	On-Demand	Anodyne	KCNK3	90	43
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)[C@@]12CCCC[C@H]1C2	ZINC000875175167	EJ	On-Demand	Anodyne	KCNK9	46	39
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)[C@]12CCCC[C@H]1C2	ZINC000875175168	EJ	On-Demand	Anodyne	MAPK14	30	48
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)[C@]12CCCC[C@H]1C2	ZINC000875175168	EJ	On-Demand	Anodyne	KCNK3	90	43
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)[C@]12CCCC[C@H]1C2	ZINC000875175168	EJ	On-Demand	Anodyne	KCNK9	46	39
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)[C@@]12CCCC[C@@H]1C2	ZINC000875175169	EJ	On-Demand	Anodyne	MAPK14	30	48
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)[C@@]12CCCC[C@@H]1C2	ZINC000875175169	EJ	On-Demand	Anodyne	KCNK3	90	43
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)[C@@]12CCCC[C@@H]1C2	ZINC000875175169	EJ	On-Demand	Anodyne	KCNK9	46	39
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)[C@]12CCCC[C@@H]1C2	ZINC000875175170	EJ	On-Demand	Anodyne	MAPK14	30	48
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)[C@]12CCCC[C@@H]1C2	ZINC000875175170	EJ	On-Demand	Anodyne	KCNK3	90	43
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)[C@]12CCCC[C@@H]1C2	ZINC000875175170	EJ	On-Demand	Anodyne	KCNK9	46	39
CCOc1cccc([C@H](C)NC(=O)N2CCCN(C=O)CC2)c1	ZINC000875175183	DE	On-Demand	Anodyne	PDS	37	42
CCOc1cccc([C@@H](C)NC(=O)N2CCCN(C=O)CC2)c1	ZINC000875175184	DE	On-Demand	Anodyne	PDS	37	42
CS(=O)(=O)c1cccc(OC(=O)CC(F)(F)C(F)(F)F)c1	ZINC000875175189	EF	On-Demand	Anodyne	NR1H3	67	38
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc2cccnc12	ZINC000875175192	DF	On-Demand	Anodyne	ANPEP	15	46
CCOc1cccc([C@H](C)NC(=O)NNc2nnc(C)n2C)c1	ZINC000875175198	DD	On-Demand	Reactive	PDS	17	40
CCOc1cccc([C@@H](C)NC(=O)NNc2nnc(C)n2C)c1	ZINC000875175199	DD	On-Demand	Reactive	PDS	17	40
O=C(NCc1noc(-c2cccs2)n1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875175235	GF	On-Demand	Anodyne	ETHR	68	50
O=C(NCc1noc(-c2cccs2)n1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875175237	GF	On-Demand	Anodyne	ETHR	68	50
O=C(NCc1ccc2oc(O)nc2c1)NCc1ccccc1N1CCOCC1	ZINC000875175239	GE	On-Demand	Anodyne	SCN10A	15	45
CCn1nc(C)c(CN(C)C(=O)NCc2ccccc2N2CCOCC2)c1C	ZINC000875175249	GF	On-Demand	Anodyne	P2RX7	15	45
O=C(NCc1ccccc1N1CCOCC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875175254	GF	On-Demand	Anodyne	SCN10A	15	42
O=C(NCc1ccccc1N1CCOCC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875175255	GF	On-Demand	Anodyne	SCN10A	15	42
O=C(NCc1ccccc1N1CCOCC1)NC[C@@H]1CCCC12CC2	ZINC000875175262	EF	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1ccccc1N1CCOCC1)NC[C@H]1CCCC12CC2	ZINC000875175263	EF	On-Demand	Anodyne	SCN10A	15	44
C[C@@]1(CO)CN(C(=O)NCc2ccccc2N2CCOCC2)C[C@]1(C)CO	ZINC000875175266	GD	On-Demand	Anodyne	SCN10A	16	48
CCC[C@@H](CCO)NC(=O)NCc1ccccc1N1CCOCC1	ZINC000875175278	ED	On-Demand	Anodyne	KCNQ2	52	37
CCC[C@H](CCO)NC(=O)NCc1ccccc1N1CCOCC1	ZINC000875175279	ED	On-Demand	Anodyne	KCNQ2	52	37
Cn1ncc(C(F)(F)F)c1CNC(=O)NCc1ccccc1N1CCOCC1	ZINC000875175294	GE	On-Demand	Anodyne	P2RX7	38	46
Cn1ncc(C(F)(F)F)c1CNC(=O)NCc1ccccc1N1CCOCC1	ZINC000875175294	GE	On-Demand	Anodyne	SCN10A	15	45
CN1CC[C@H]2CN(C(=O)NCc3ccccc3N3CCOCC3)CC[C@@H]21	ZINC000875175299	FD	On-Demand	Anodyne	SCN10A	15	45
CN1CC[C@H]2CN(C(=O)NCc3ccccc3N3CCOCC3)CC[C@H]21	ZINC000875175300	FD	On-Demand	Anodyne	SCN10A	15	45
CN(Cc1ccc2cc[nH]c2c1)C(=O)NCc1ccccc1N1CCOCC1	ZINC000875175311	GG	On-Demand	Anodyne	SCN10A	15	43
CCC(F)(F)C(C)(C)CNC(=O)NCc1ccccc1N1CCOCC1	ZINC000875175314	FG	On-Demand	Anodyne	KCNQ2	50	33
CCC(F)(F)C(C)(C)CNC(=O)NCc1ccccc1N1CCOCC1	ZINC000875175314	FG	On-Demand	Anodyne	SCN10A	15	43
COC(=O)N(C)NC(=O)NCc1ccccc1N1CCOCC1	ZINC000875175315	DC	On-Demand	Reactive	SCN10A	15	45
O=C(NCc1ccccc1N1CCOCC1)NCc1cccnc1O	ZINC000875175323	ED	On-Demand	Anodyne	SCN10A	24	49
O=C(NCc1ccccc1N1CCOCC1)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875175325	GF	On-Demand	Anodyne	KCNQ2	42	35
O=C(NCc1ccccc1N1CCOCC1)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875175325	GF	On-Demand	Anodyne	EPHX2	15	47
O=C(NCc1ccccc1N1CCOCC1)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875175326	GF	On-Demand	Anodyne	KCNQ2	42	35
O=C(NCc1ccccc1N1CCOCC1)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875175326	GF	On-Demand	Anodyne	EPHX2	15	47
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000875175339	GF	On-Demand	Anodyne	DRD4	18	48
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000875175339	GF	On-Demand	Anodyne	ACHE	29	49
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000875175339	GF	On-Demand	Anodyne	HTR4	52	40
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000875175339	GF	On-Demand	Anodyne	SIGMAR1	36	48
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000875175339	GF	On-Demand	Anodyne	MMP13	21	40
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000875175339	GF	On-Demand	Anodyne	CCR3	37	41
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000875175339	GF	On-Demand	Anodyne	MMP9	19	40
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000875175339	GF	On-Demand	Anodyne	PDK1	40	36
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000875175339	GF	On-Demand	Anodyne	MMP1	23	40
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000875175339	GF	On-Demand	Anodyne	MCHR1	31	47
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000875175339	GF	On-Demand	Anodyne	CACNA1G	22	43
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000875175339	GF	On-Demand	Anodyne	CACNA1I	69	42
CC[C@@H](NC(=O)N(C)CCc1cccc(C#N)c1)c1ccccc1	ZINC000875175349	DH	On-Demand	Mild	TACR3	40	36
CC[C@@H](NC(=O)N(C)CCc1cccc(C#N)c1)c1ccccc1	ZINC000875175349	DH	On-Demand	Mild	PTGES	25	42
CC[C@@H](NC(=O)N(C)CCc1cccc(C#N)c1)c1ccccc1	ZINC000875175349	DH	On-Demand	Mild	PDS	56	45
O=C(Nc1ccc(Cl)c2cccnc12)c1nc(Cl)c(Cl)c(Cl)c1Cl	ZINC000875175352	HK	On-Demand	Anodyne	G2YM83_BOTF4	45	32
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCC1(C)CCOCC1)CC2	ZINC000875175359	GE	On-Demand	Anodyne	SLC18A2	46	35
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCC1(C)CCOCC1)CC2	ZINC000875175360	GE	On-Demand	Anodyne	SLC18A2	46	35
O=C(NCCO)C1CCN(C(=O)NCc2cccc(Br)c2)CC1	ZINC000875175364	GD	On-Demand	Anodyne	EPHX2	22	47
CC[C@@H](NC(=O)NN=c1cc[nH]cc1C)c1ccccc1	ZINC000875175402	CF	On-Demand	Reactive	TACR3	47	39
CC(C)(C(=O)Oc1cccc(S(C)(=O)=O)c1)c1cccc(C(F)(F)F)n1	ZINC000875175415	GG	On-Demand	Anodyne	PTGS2	28	40
CC(C)(C(=O)Oc1cccc(S(C)(=O)=O)c1)c1cccc(C(F)(F)F)n1	ZINC000875175415	GG	On-Demand	Anodyne	CACNA1B	40	33
CC(C)(C(=O)Oc1cccc(S(C)(=O)=O)c1)c1cccc(C(F)(F)F)n1	ZINC000875175415	GG	On-Demand	Anodyne	NR1H3	81	45
CC(C)(C(=O)Oc1cccc(S(C)(=O)=O)c1)c1cccc(C(F)(F)F)n1	ZINC000875175415	GG	On-Demand	Anodyne	NR1H2	53	45
O=CN1CCCN(C(=O)N[C@@H](Cc2ccccc2Cl)c2ccccc2)CC1	ZINC000875175427	GG	On-Demand	Anodyne	DPP7	26	41
O=CN1CCCN(C(=O)N[C@H](Cc2ccccc2Cl)c2ccccc2)CC1	ZINC000875175429	GG	On-Demand	Anodyne	DPP7	26	41
O=C(NCc1ccccc1N1CCOCC1)N[C@H]1CCN(C2CCC2)C1=O	ZINC000875175431	FD	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1ccccc1N1CCOCC1)N[C@@H]1CCN(C2CCC2)C1=O	ZINC000875175435	FD	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1ccccc1N1CCOCC1)NCc1noc2cc(F)ccc12	ZINC000875175438	GF	On-Demand	Anodyne	P2RX7	30	40
O=C(NCc1ccccc1N1CCOCC1)NCc1noc2cc(F)ccc12	ZINC000875175438	GF	On-Demand	Anodyne	SCN10A	15	44
CC[C@@H](NC(=O)NC1CCC(C(=O)NC)CC1)[C@@H](O)c1ccccc1	ZINC000875175461	EE	On-Demand	Anodyne	XIAP	60	40
CC[C@@H](NC(=O)NC1CCC(C(=O)NC)CC1)[C@@H](O)c1ccccc1	ZINC000875175461	EE	On-Demand	Anodyne	BIRC2	49	32
CC[C@@H](NC(=O)NC1CCC(C(=O)NC)CC1)[C@@H](O)c1ccccc1	ZINC000875175461	EE	On-Demand	Anodyne	BIRC8	44	31
CC[C@@H](NC(=O)NC1CCC(C(=O)NC)CC1)[C@H](O)c1ccccc1	ZINC000875175462	EE	On-Demand	Anodyne	XIAP	60	40
CC[C@@H](NC(=O)NC1CCC(C(=O)NC)CC1)[C@H](O)c1ccccc1	ZINC000875175462	EE	On-Demand	Anodyne	BIRC2	49	32
CC[C@@H](NC(=O)NC1CCC(C(=O)NC)CC1)[C@H](O)c1ccccc1	ZINC000875175462	EE	On-Demand	Anodyne	BIRC8	44	31
CCn1c(CCNC(=O)N2CCC[C@@H](OC3CCC3)CC2)nc2ccccc21	ZINC000875175463	GH	On-Demand	Anodyne	SMO	38	43
CCn1c(CCNC(=O)N2CCC[C@H](OC3CCC3)CC2)nc2ccccc21	ZINC000875175465	GH	On-Demand	Anodyne	SMO	38	43
O=C(NCCSCCC(F)(F)F)NCc1ccccc1N1CCOCC1	ZINC000875175467	GG	On-Demand	Anodyne	SCN10A	15	45
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)C1(OC(C)C)CCC1	ZINC000875175491	FJ	On-Demand	Anodyne	MAPK14	32	50
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)C1(OC(C)C)CCC1	ZINC000875175491	FJ	On-Demand	Anodyne	PRNP	42	38
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)C1(OC(C)C)CCC1	ZINC000875175491	FJ	On-Demand	Anodyne	SMO	27	41
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)C1(OC(C)C)CCC1	ZINC000875175491	FJ	On-Demand	Anodyne	KCNK3	109	42
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)C1(OC(C)C)CCC1	ZINC000875175491	FJ	On-Demand	Anodyne	KCNK9	65	41
O=C(NCc1ccccc1N1CCOCC1)N1CC[C@H]2CC[C@@H](C1)S2(=O)=O	ZINC000875175501	GD	On-Demand	Anodyne	SCN10A	15	44
Cc1cncc([C@@H]2CCCN2C(=O)NCc2ccccc2N2CCOCC2)c1	ZINC000875175505	GG	On-Demand	Anodyne	AVPR2	15	41
Cc1cncc([C@@H]2CCCN2C(=O)NCc2ccccc2N2CCOCC2)c1	ZINC000875175505	GG	On-Demand	Anodyne	SCN2A	17	41
Cc1cncc([C@@H]2CCCN2C(=O)NCc2ccccc2N2CCOCC2)c1	ZINC000875175505	GG	On-Demand	Anodyne	SCN10A	25	50
Cc1cncc([C@H]2CCCN2C(=O)NCc2ccccc2N2CCOCC2)c1	ZINC000875175507	GG	On-Demand	Anodyne	AVPR2	15	41
Cc1cncc([C@H]2CCCN2C(=O)NCc2ccccc2N2CCOCC2)c1	ZINC000875175507	GG	On-Demand	Anodyne	SCN2A	17	41
Cc1cncc([C@H]2CCCN2C(=O)NCc2ccccc2N2CCOCC2)c1	ZINC000875175507	GG	On-Demand	Anodyne	SCN10A	25	50
CCOc1cccc([C@H](C)NC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)c1	ZINC000875175514	EF	On-Demand	Anodyne	SLC6A4	24	43
CCOc1cccc([C@H](C)NC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)c1	ZINC000875175514	EF	On-Demand	Anodyne	SLC6A3	49	43
CCOc1cccc([C@H](C)NC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)c1	ZINC000875175514	EF	On-Demand	Anodyne	ACACB	16	40
CCOc1cccc([C@@H](C)NC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)c1	ZINC000875175516	EF	On-Demand	Anodyne	SLC6A4	24	43
CCOc1cccc([C@@H](C)NC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)c1	ZINC000875175516	EF	On-Demand	Anodyne	SLC6A3	49	43
CCOc1cccc([C@@H](C)NC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)c1	ZINC000875175516	EF	On-Demand	Anodyne	ACACB	16	40
CCOc1cccc([C@H](C)NC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)c1	ZINC000875175517	EF	On-Demand	Anodyne	SLC6A4	24	43
CCOc1cccc([C@H](C)NC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)c1	ZINC000875175517	EF	On-Demand	Anodyne	SLC6A3	49	43
CCOc1cccc([C@H](C)NC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)c1	ZINC000875175517	EF	On-Demand	Anodyne	ACACB	16	40
CCOc1cccc([C@@H](C)NC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)c1	ZINC000875175519	EF	On-Demand	Anodyne	SLC6A4	24	43
CCOc1cccc([C@@H](C)NC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)c1	ZINC000875175519	EF	On-Demand	Anodyne	SLC6A3	49	43
CCOc1cccc([C@@H](C)NC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)c1	ZINC000875175519	EF	On-Demand	Anodyne	ACACB	16	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1N1CCOCC1	ZINC000875175520	FD	On-Demand	Anodyne	SLC6A3	40	38
CN(C)CCCOc1ccc(CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875175521	GD	On-Demand	Anodyne	HRH3	15	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1N1CCOCC1	ZINC000875175522	FD	On-Demand	Anodyne	SLC6A3	40	38
CN(C)CCCOc1ccc(CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875175523	GD	On-Demand	Anodyne	HRH3	15	42
CC[C@@H](NC(=O)N1C[C@H]2C(=O)N(C)C(=O)[C@H]2C1)c1ccccc1	ZINC000875175544	DD	On-Demand	Anodyne	CXCR2	15	41
CC[C@@H](NC(=O)N1C[C@H]2C(=O)N(C)C(=O)[C@H]2C1)c1ccccc1	ZINC000875175544	DD	On-Demand	Anodyne	TACR3	46	37
CC[C@@H](NC(=O)N1C[C@H]2C(=O)N(C)C(=O)[C@H]2C1)c1ccccc1	ZINC000875175544	DD	On-Demand	Anodyne	BIRC8	43	30
CCOC(=O)[C@H](C)C1CN(C(=O)NCC(C)(C)c2cccc(C)c2)C1	ZINC000875175557	EG	On-Demand	Anodyne	AMY2	43	30
O=C(NCc1ccccc1N1CCOCC1)N1Cc2cccc(O)c2C1	ZINC000875175558	FE	On-Demand	Clean	SCN10A	15	46
O=CN1CCCN(C(=O)NCc2ccccc2N2CCOCC2)CC1	ZINC000875175559	EC	On-Demand	Anodyne	SCN10A	15	46
C[S@](=N)(=O)N1CCN(C(=O)NCc2ccccc2N2CCOCC2)CC1	ZINC000875175571	GC	On-Demand	Anodyne	SCN10A	15	45
CC[C@@H](NC(=O)N1CCN(C)c2ncccc2C1)c1ccccc1	ZINC000875175572	DG	On-Demand	Anodyne	PTAFR	30	42
CC[C@@H](NC(=O)N1CCN(C)c2ncccc2C1)c1ccccc1	ZINC000875175572	DG	On-Demand	Anodyne	TACR3	46	37
CC(C)(C)OC(=O)N1CCN(CCNC(=O)N2CC[C@@H]3CC[C@@H](O)[C@@H]32)CC1	ZINC000875175603	GD	On-Demand	Anodyne	GPR119	29	41
CC[C@@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccccc1	ZINC000875175604	EF	On-Demand	Anodyne	TACR3	47	40
CC[C@@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccccc1	ZINC000875175604	EF	On-Demand	Anodyne	UTS2	49	36
CC[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccccc1	ZINC000875175612	CE	On-Demand	Anodyne	TACR3	51	42
O=C(NCc1ccccc1N1CCOCC1)NCc1noc2ccc(F)cc12	ZINC000875175626	GF	On-Demand	Anodyne	P2RX7	29	40
O=C(NCc1ccccc1N1CCOCC1)NCc1noc2ccc(F)cc12	ZINC000875175626	GF	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1ccccc1N1CCOCC1)N[C@H]1CC12CCC2	ZINC000875175636	DE	On-Demand	Anodyne	SCN10A	15	45
O=C(NCc1ccccc1N1CCOCC1)N[C@@H]1CC12CCC2	ZINC000875175637	DE	On-Demand	Anodyne	SCN10A	15	45
CCC1(CC)CCCN1C(=O)NCc1ccccc1N1CCOCC1	ZINC000875175638	EG	On-Demand	Anodyne	KCNQ2	63	34
CCC1(CC)CCCN1C(=O)NCc1ccccc1N1CCOCC1	ZINC000875175638	EG	On-Demand	Anodyne	SCN10A	15	44
CCOc1cccc([C@@H](C)NC(=O)NC2CC(C(=O)OC)C2)c1	ZINC000875175643	DE	On-Demand	Anodyne	ACACB	15	47
CCOc1cccc([C@@H](C)NC(=O)NC2CC(C(=O)OC)C2)c1	ZINC000875175643	DE	On-Demand	Anodyne	PDS	52	42
CCOc1cccc([C@H](C)NC(=O)NC2CC(C(=O)OC)C2)c1	ZINC000875175644	DE	On-Demand	Anodyne	ACACB	15	47
CCOc1cccc([C@H](C)NC(=O)NC2CC(C(=O)OC)C2)c1	ZINC000875175644	DE	On-Demand	Anodyne	PDS	52	42
CCOc1cccc([C@@H](C)NC(=O)N2CC(O)(C(=O)OC)C2)c1	ZINC000875175645	DD	On-Demand	Anodyne	ACACB	17	44
CCOc1cccc([C@@H](C)NC(=O)N2CC(O)(C(=O)OC)C2)c1	ZINC000875175645	DD	On-Demand	Anodyne	PDS	37	42
CCOc1cccc([C@H](C)NC(=O)N2CC(O)(C(=O)OC)C2)c1	ZINC000875175646	DD	On-Demand	Anodyne	ACACB	17	44
CCOc1cccc([C@H](C)NC(=O)N2CC(O)(C(=O)OC)C2)c1	ZINC000875175646	DD	On-Demand	Anodyne	PDS	37	42
CCOc1cccc([C@@H](C)NC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875175648	EG	On-Demand	Anodyne	FKBP1A	41	39
CCOc1cccc([C@@H](C)NC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875175648	EG	On-Demand	Anodyne	REN	16	40
CCOc1cccc([C@H](C)NC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875175649	EG	On-Demand	Anodyne	FKBP1A	41	39
CCOc1cccc([C@H](C)NC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875175649	EG	On-Demand	Anodyne	REN	16	40
CCOc1cccc([C@H](C)NC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875175650	EG	On-Demand	Anodyne	FKBP1A	41	39
CCOc1cccc([C@H](C)NC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875175650	EG	On-Demand	Anodyne	REN	16	40
CCOc1cccc([C@@H](C)NC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875175651	EG	On-Demand	Anodyne	FKBP1A	41	39
CCOc1cccc([C@@H](C)NC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875175651	EG	On-Demand	Anodyne	REN	16	40
CC[C@@H](NC(=O)NNc1cccc(C)n1)c1ccccc1	ZINC000875175659	CG	On-Demand	Reactive	TACR3	56	46
CC[C@@H](NC(=O)NNc1cccc(C)n1)c1ccccc1	ZINC000875175659	CG	On-Demand	Reactive	GRM5	15	41
CC[C@@H](NC(=O)N1CCCCCCNC(=O)CC1)c1ccccc1	ZINC000875175666	EG	On-Demand	Anodyne	TACR3	40	42
O=C(NCc1ccccc1N1CCOCC1)N1OC2CCC1CC2	ZINC000875175692	EE	On-Demand	Anodyne	SCN10A	15	47
O=C(NCc1ccc(C(F)(F)F)s1)NCc1ccccc1N1CCOCC1	ZINC000875175701	GH	On-Demand	Anodyne	SCN10A	15	44
CCOc1cccc([C@H](C)NC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875175704	DF	On-Demand	Anodyne	PDS	17	40
CCOc1cccc([C@@H](C)NC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875175707	DF	On-Demand	Anodyne	PDS	17	40
CCOc1cccc([C@@H](C)NC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875175710	DF	On-Demand	Anodyne	PDS	17	40
CCOc1cccc([C@H](C)NC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875175711	DF	On-Demand	Anodyne	PDS	17	40
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)[C@@H](NC=O)C(C)C	ZINC000875175723	FF	On-Demand	Anodyne	LCK	16	45
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)[C@@H](NC=O)C(C)C	ZINC000875175723	FF	On-Demand	Anodyne	MAPK14	32	48
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)[C@@H](NC=O)C(C)C	ZINC000875175723	FF	On-Demand	Anodyne	PRNP	42	39
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)[C@@H](NC=O)C(C)C	ZINC000875175723	FF	On-Demand	Anodyne	SMO	25	40
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)[C@@H](NC=O)C(C)C	ZINC000875175723	FF	On-Demand	Anodyne	KCNK3	108	45
Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)[C@@H](NC=O)C(C)C	ZINC000875175723	FF	On-Demand	Anodyne	KCNK9	56	45
O=C(NCc1ccccc1N1CCOCC1)N[C@@H]1CCOC[C@H]1O	ZINC000875175726	EC	On-Demand	Anodyne	SCN10A	15	45
O=C(NCCO)C1CCN(C(=O)NCc2cccc3cccnc23)CC1	ZINC000875175729	FD	On-Demand	Anodyne	EPHX2	26	45
CCOc1cccc([C@@H](C)NC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)c1	ZINC000875175744	GF	On-Demand	Anodyne	PDS	28	41
CC[C@@H](NC(=O)N1CCC(C(=O)NOC)CC1)c1ccccc1	ZINC000875175746	DE	On-Demand	Anodyne	CACNA1H	20	41
CC[C@@H](NC(=O)N1CCC(C(=O)NOC)CC1)c1ccccc1	ZINC000875175746	DE	On-Demand	Anodyne	CCR5	34	42
CC[C@@H](NC(=O)N1CCC(C(=O)NOC)CC1)c1ccccc1	ZINC000875175746	DE	On-Demand	Anodyne	TACR3	44	37
CC[C@@H](NC(=O)N1CCC(C(=O)NOC)CC1)c1ccccc1	ZINC000875175746	DE	On-Demand	Anodyne	AMY2	55	33
CC[C@@H](NC(=O)N1CCC(C(=O)NOC)CC1)c1ccccc1	ZINC000875175746	DE	On-Demand	Anodyne	XIAP	46	37
CCOc1cccc([C@H](C)NC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)c1	ZINC000875175747	GF	On-Demand	Anodyne	PDS	28	41
CCOc1cccc([C@@H](C)NC(=O)N2CCCC[C@@H]2CNC(=O)NC)c1	ZINC000875175750	FF	On-Demand	Anodyne	FKBP1A	46	41
CCOc1cccc([C@H](C)NC(=O)N2CCCC[C@@H]2CNC(=O)NC)c1	ZINC000875175752	FF	On-Demand	Anodyne	FKBP1A	46	41
CCOc1cccc([C@H](C)NC(=O)N2CCCC[C@H]2CNC(=O)NC)c1	ZINC000875175754	FF	On-Demand	Anodyne	FKBP1A	46	41
CCOc1cccc([C@@H](C)NC(=O)N2CCCC[C@H]2CNC(=O)NC)c1	ZINC000875175757	FF	On-Demand	Anodyne	FKBP1A	46	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1N1CCOCC1	ZINC000875175769	ED	On-Demand	Anodyne	KCNQ2	63	36
O=C(NCc1ccccc1Oc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875175779	FF	On-Demand	Anodyne	S1PR2	25	40
O=C(NCc1ccccc1Oc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875175779	FF	On-Demand	Anodyne	EPHX2	19	43
O=C(NCc1ccccc1Oc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875175779	FF	On-Demand	Anodyne	CCR8	35	48
CCOc1cccc([C@@H](C)NC(=O)NN=c2cc[nH]cc2C)c1	ZINC000875175795	DF	On-Demand	Reactive	PDS	32	41
CCOc1cccc([C@H](C)NC(=O)NN=c2cc[nH]cc2C)c1	ZINC000875175797	DF	On-Demand	Reactive	PDS	32	41
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H](c3ccccc3)C3CCC3)CC2)CC1	ZINC000875175798	GD	On-Demand	Anodyne	L3MBTL3	78	43
CN1CCN(C2CCN(C(=O)C(=O)N[C@H](c3ccccc3)C3CCC3)CC2)CC1	ZINC000875175801	GD	On-Demand	Anodyne	L3MBTL3	78	43
Cc1cccc(C(C)(C)CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875175811	EE	On-Demand	Anodyne	CHRM3	16	43
Cc1cccc(C(C)(C)CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875175811	EE	On-Demand	Anodyne	CCR2	23	42
Cc1cccc(C(C)(C)CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875175811	EE	On-Demand	Anodyne	EPHX2	18	42
CS(=O)(=O)c1cccc(OC(=O)c2c(C(F)F)nc3n2CCCC3)c1	ZINC000875175821	FF	On-Demand	Anodyne	NR1H3	43	37
CC[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccccc1	ZINC000875175830	DD	On-Demand	Anodyne	CACNA1H	30	49
CC[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccccc1	ZINC000875175830	DD	On-Demand	Anodyne	GHRHR	45	33
CC[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccccc1	ZINC000875175830	DD	On-Demand	Anodyne	TACR3	47	38
CC[C@@H](NC(=O)N1CCCC[C@@H]1CNC(=O)NC)c1ccccc1	ZINC000875175833	EF	On-Demand	Anodyne	HCRTR1	16	44
CC[C@@H](NC(=O)N1CCCC[C@@H]1CNC(=O)NC)c1ccccc1	ZINC000875175833	EF	On-Demand	Anodyne	TACR3	44	39
CC[C@@H](NC(=O)N1CCCC[C@H]1CNC(=O)NC)c1ccccc1	ZINC000875175834	EF	On-Demand	Anodyne	HCRTR1	16	44
CC[C@@H](NC(=O)N1CCCC[C@H]1CNC(=O)NC)c1ccccc1	ZINC000875175834	EF	On-Demand	Anodyne	TACR3	44	39
CC[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccccc1	ZINC000875175836	EF	On-Demand	Anodyne	CCR5	41	51
CC[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccccc1	ZINC000875175836	EF	On-Demand	Anodyne	TACR3	45	45
CC[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccccc1	ZINC000875175836	EF	On-Demand	Anodyne	CALCRL	48	39
CC[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccccc1	ZINC000875175836	EF	On-Demand	Anodyne	L3MBTL3	77	43
CC[C@@H](NC(=O)N(CCOC)C1CCOCC1)c1ccccc1	ZINC000875175843	DF	On-Demand	Anodyne	TACR3	52	40
CC[C@@H](NC(=O)N(CCOC)C1CCOCC1)c1ccccc1	ZINC000875175843	DF	On-Demand	Anodyne	AMY2	46	32
CC[C@@H](NC(=O)N1CC(O)(C(=O)OC)C1)c1ccccc1	ZINC000875175850	CD	On-Demand	Anodyne	CACNA1H	17	40
CC[C@@H](NC(=O)N1CC(O)(C(=O)OC)C1)c1ccccc1	ZINC000875175850	CD	On-Demand	Anodyne	TACR3	46	39
O=C(NCc1ccccc1N1CCOCC1)NCc1cccc2ncccc12	ZINC000875175861	GG	On-Demand	Anodyne	METAP1	41	38
O=C(NCc1ccccc1N1CCOCC1)NCc1cccc2ncccc12	ZINC000875175861	GG	On-Demand	Anodyne	PIK3CA	40	38
O=C(NCc1ccccc1N1CCOCC1)NCc1cccc2ncccc12	ZINC000875175861	GG	On-Demand	Anodyne	PIK3CD	27	42
O=C(NCc1ccccc1N1CCOCC1)NCc1cccc2ncccc12	ZINC000875175861	GG	On-Demand	Anodyne	SCN10A	25	47
O=C(NCc1ccccc1N1CCOCC1)NCc1cccc2ncccc12	ZINC000875175861	GG	On-Demand	Anodyne	PIK3CB	35	42
CCOc1cccc([C@@H](C)NC(=O)N2Cc3cccc(O)c3C2)c1	ZINC000875175862	EH	On-Demand	Clean	PDS	23	41
CCOc1cccc([C@H](C)NC(=O)N2Cc3cccc(O)c3C2)c1	ZINC000875175863	EH	On-Demand	Clean	PDS	23	41
O=C(NCc1cccc2cccnc12)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875175883	FH	On-Demand	Anodyne	HCRTR1	17	41
O=C(NCc1cccc2cccnc12)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875175885	FH	On-Demand	Anodyne	HCRTR1	17	41
CC[C@@H](NC(=O)NCc1cc(C(=O)OC)co1)c1ccccc1	ZINC000875175886	DG	On-Demand	Anodyne	TACR3	47	38
O=C(NCc1cccc2cccnc12)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875175888	FH	On-Demand	Anodyne	HCRTR1	17	41
O=C(NCc1cccc2cccnc12)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875175890	FH	On-Demand	Anodyne	HCRTR1	17	41
C#CC[C@@H](COC)NC(=O)C(=O)NCc1ccc(OC)c(OC2CCCC2)c1	ZINC000875175900	GD	On-Demand	Mild	PDE4A	47	43
C#CC[C@@H](COC)NC(=O)C(=O)NCc1ccc(OC)c(OC2CCCC2)c1	ZINC000875175900	GD	On-Demand	Mild	PDE4B	26	43
C#CC[C@@H](COC)NC(=O)C(=O)NCc1ccc(OC)c(OC2CCCC2)c1	ZINC000875175900	GD	On-Demand	Mild	PDE4D	32	43
C#CC[C@@H](COC)NC(=O)C(=O)NCc1ccc(OC)c(OC2CCCC2)c1	ZINC000875175900	GD	On-Demand	Mild	PDE4C	17	43
C#CC[C@H](COC)NC(=O)C(=O)NCc1ccc(OC)c(OC2CCCC2)c1	ZINC000875175901	GD	On-Demand	Mild	PDE4A	47	43
C#CC[C@H](COC)NC(=O)C(=O)NCc1ccc(OC)c(OC2CCCC2)c1	ZINC000875175901	GD	On-Demand	Mild	PDE4B	26	43
C#CC[C@H](COC)NC(=O)C(=O)NCc1ccc(OC)c(OC2CCCC2)c1	ZINC000875175901	GD	On-Demand	Mild	PDE4D	32	43
C#CC[C@H](COC)NC(=O)C(=O)NCc1ccc(OC)c(OC2CCCC2)c1	ZINC000875175901	GD	On-Demand	Mild	PDE4C	17	43
CC[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875175906	CF	On-Demand	Anodyne	CCR5	47	39
CC[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875175906	CF	On-Demand	Anodyne	TACR3	49	39
CC[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875175906	CF	On-Demand	Anodyne	AMY2	45	31
CC[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875175907	CF	On-Demand	Anodyne	CCR5	47	39
CC[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875175907	CF	On-Demand	Anodyne	TACR3	49	39
CC[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875175907	CF	On-Demand	Anodyne	AMY2	45	31
CC(=O)C1CCN(C(=O)NCCc2c[nH]c3cc(Cl)ccc23)CC1	ZINC000875175909	EG	On-Demand	Anodyne	EPHX2	15	45
COC(=O)N(C)NC(=O)NCCc1c[nH]c2cc(Cl)ccc12	ZINC000875175911	DE	On-Demand	Reactive	HTR1D	15	41
COC(=O)N(C)NC(=O)NCCc1c[nH]c2cc(Cl)ccc12	ZINC000875175911	DE	On-Demand	Reactive	NQO2	29	46
COC(=O)N(C)NC(=O)NCCc1c[nH]c2cc(Cl)ccc12	ZINC000875175911	DE	On-Demand	Reactive	MPO	45	34
COC(=O)N(C)NC(=O)NCCc1c[nH]c2cc(Cl)ccc12	ZINC000875175911	DE	On-Demand	Reactive	MTNR1A	38	46
COC(=O)N(C)NC(=O)NCCc1c[nH]c2cc(Cl)ccc12	ZINC000875175911	DE	On-Demand	Reactive	MTNR1B	19	47
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3ccccc3C(F)(F)F)C[C@@H]1C2	ZINC000875175919	FF	On-Demand	Anodyne	EPHX2	17	41
O=C(NCCOC(F)(F)C(F)(F)F)NCc1ccccc1N1CCOCC1	ZINC000875175920	GE	On-Demand	Anodyne	SCN10A	16	46
CC[C@@H](NC(=O)N[C@@H]1C[C@H]2C[C@@]2(C(=O)OC)C1)c1ccccc1	ZINC000875175923	DF	On-Demand	Anodyne	TACR3	44	38
CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccccc1	ZINC000875175929	DF	On-Demand	Anodyne	SLC6A4	31	45
CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccccc1	ZINC000875175929	DF	On-Demand	Anodyne	SLC6A3	75	45
CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccccc1	ZINC000875175929	DF	On-Demand	Anodyne	TIMP3	57	32
CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccccc1	ZINC000875175929	DF	On-Demand	Anodyne	TACR3	46	38
CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccccc1	ZINC000875175931	DF	On-Demand	Anodyne	SLC6A4	31	45
CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccccc1	ZINC000875175931	DF	On-Demand	Anodyne	SLC6A3	75	45
CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccccc1	ZINC000875175931	DF	On-Demand	Anodyne	TIMP3	57	32
CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccccc1	ZINC000875175931	DF	On-Demand	Anodyne	TACR3	46	38
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3ccc(OC)cc3)CC2)C1	ZINC000875175935	GC	On-Demand	Anodyne	DRD4	25	48
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3ccc(OC)cc3)CC2)C1	ZINC000875175935	GC	On-Demand	Anodyne	ACHE	31	49
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3ccc(OC)cc3)CC2)C1	ZINC000875175935	GC	On-Demand	Anodyne	AVPR1B	41	33
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3ccc(OC)cc3)CC2)C1	ZINC000875175935	GC	On-Demand	Anodyne	HRH3	18	41
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3ccc(OC)cc3)CC2)C1	ZINC000875175935	GC	On-Demand	Anodyne	SIGMAR1	46	51
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3ccc(OC)cc3)CC2)C1	ZINC000875175935	GC	On-Demand	Anodyne	MMP13	34	44
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3ccc(OC)cc3)CC2)C1	ZINC000875175935	GC	On-Demand	Anodyne	CHEK2	18	40
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3ccc(OC)cc3)CC2)C1	ZINC000875175935	GC	On-Demand	Anodyne	CCR3	39	41
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3ccc(OC)cc3)CC2)C1	ZINC000875175935	GC	On-Demand	Anodyne	FAAH	17	48
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3ccc(OC)cc3)CC2)C1	ZINC000875175935	GC	On-Demand	Anodyne	MMP9	29	42
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3ccc(OC)cc3)CC2)C1	ZINC000875175935	GC	On-Demand	Anodyne	PDK1	42	39
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3ccc(OC)cc3)CC2)C1	ZINC000875175935	GC	On-Demand	Anodyne	CXCR3	28	41
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3ccc(OC)cc3)CC2)C1	ZINC000875175935	GC	On-Demand	Anodyne	MMP1	29	44
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3ccc(OC)cc3)CC2)C1	ZINC000875175935	GC	On-Demand	Anodyne	MCHR1	33	43
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3ccc(OC)cc3)CC2)C1	ZINC000875175935	GC	On-Demand	Anodyne	CACNA1G	21	43
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3ccc(OC)cc3)CC2)C1	ZINC000875175935	GC	On-Demand	Anodyne	CACNA1I	62	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(Br)c1	ZINC000875175950	FF	On-Demand	Anodyne	SLC6A4	32	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(Br)c1	ZINC000875175950	FF	On-Demand	Anodyne	SLC6A3	59	49
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(Br)c1	ZINC000875175952	FF	On-Demand	Anodyne	SLC6A4	32	49
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(Br)c1	ZINC000875175952	FF	On-Demand	Anodyne	SLC6A3	59	49
C[C@@H]1CN(C(=O)NCc2noc(-c3cccs3)n2)CC[C@@H](C(F)(F)F)O1	ZINC000875175957	GG	On-Demand	Anodyne	ETHR	55	47
C[C@@H]1CN(C(=O)NCc2noc(-c3cccs3)n2)CC[C@H](C(F)(F)F)O1	ZINC000875175958	GG	On-Demand	Anodyne	ETHR	55	47
CCOc1cccc([C@H](C)NC(=O)N[C@@H](CC)C[C@@H](C)O)c1	ZINC000875175965	DF	On-Demand	Anodyne	PDS	78	49
CCOc1cccc([C@H](C)NC(=O)N[C@H](CC)C[C@H](C)O)c1	ZINC000875175966	DF	On-Demand	Anodyne	PDS	78	49
CCOc1cccc([C@H](C)NC(=O)N[C@H](CC)C[C@@H](C)O)c1	ZINC000875175971	DF	On-Demand	Anodyne	PDS	78	49
CCOc1cccc([C@H](C)NC(=O)N[C@@H](CC)C[C@H](C)O)c1	ZINC000875175972	DF	On-Demand	Anodyne	PDS	78	49
CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1ccccc1	ZINC000875175987	DG	On-Demand	Anodyne	TACR3	44	36
CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1ccccc1	ZINC000875175987	DG	On-Demand	Anodyne	XIAP	58	39
CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1ccccc1	ZINC000875175987	DG	On-Demand	Anodyne	BIRC2	42	31
CONC(=O)C1CCN(C(=O)NCCc2c[nH]c3cc(Cl)ccc23)CC1	ZINC000875175991	GE	On-Demand	Anodyne	MTNR1A	20	49
CONC(=O)C1CCN(C(=O)NCCc2c[nH]c3cc(Cl)ccc23)CC1	ZINC000875175991	GE	On-Demand	Anodyne	EPHX2	15	49
O=C(NCc1ccccc1N1CCOCC1)NCc1cc2c(nc1O)CCCC2	ZINC000875175992	GF	On-Demand	Anodyne	SCN10A	15	46
O=C(NCc1ccccc1N1CCOCC1)N1CCC(CO)(CO)CC1	ZINC000875175998	FC	On-Demand	Anodyne	SCN10A	15	46
CCOc1cccc([C@@H](C)NC(=O)NN=c2cc[nH]c(C)c2)c1	ZINC000875176000	DF	On-Demand	Reactive	PDS	37	42
CCOc1cccc([C@H](C)NC(=O)NN=c2cc[nH]c(C)c2)c1	ZINC000875176001	DF	On-Demand	Reactive	PDS	37	42
O=C(NCc1ccccc1C(F)(F)F)N1CCC(CO)(CO)CC1	ZINC000875176002	ED	On-Demand	Anodyne	P2RX7	42	40
O=C(NCc1ccccc1C(F)(F)F)N1CCC(CO)(CO)CC1	ZINC000875176002	ED	On-Demand	Anodyne	EPHX2	23	47
O=C(NCc1ccccc1C(F)(F)F)N1CCC(CO)(CO)CC1	ZINC000875176002	ED	On-Demand	Anodyne	RBP4	89	40
CCOc1cccc([C@@H](C)NC(=O)NC2(C)CC(F)(F)C2)c1	ZINC000875176003	DH	On-Demand	Anodyne	PDS	51	43
CCOc1cccc([C@H](C)NC(=O)NC2(C)CC(F)(F)C2)c1	ZINC000875176005	DH	On-Demand	Anodyne	PDS	51	43
O=C(NCc1ccc(O)c(Cl)c1)NCc1ccccc1N1CCOCC1	ZINC000875176013	GF	On-Demand	Anodyne	AVPR2	15	42
O=C(NCc1ccc(O)c(Cl)c1)NCc1ccccc1N1CCOCC1	ZINC000875176013	GF	On-Demand	Anodyne	P2RX7	16	42
O=C(NCc1ccc(O)c(Cl)c1)NCc1ccccc1N1CCOCC1	ZINC000875176013	GF	On-Demand	Anodyne	SCN2A	17	40
O=C(NCc1ccc(O)c(Cl)c1)NCc1ccccc1N1CCOCC1	ZINC000875176013	GF	On-Demand	Anodyne	SCN10A	22	52
O=C(NCc1ccc(O)c(Cl)c1)NCc1ccccc1N1CCOCC1	ZINC000875176013	GF	On-Demand	Anodyne	PIK3CB	26	40
O=C(NCc1ccc(O)c(Cl)c1)NCc1ccccc1N1CCOCC1	ZINC000875176013	GF	On-Demand	Anodyne	NCE103	15	49
CC(C)(C)OC(=O)N1CCN(CCNC(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875176017	GD	On-Demand	Anodyne	CACNA1I	42	34
CC(C)(C)OC(=O)N1CCN(CCNC(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875176017	GD	On-Demand	Anodyne	GPR119	42	40
CC[C@@H](NC(=O)N[C@H](C)c1ccccc1O)c1ccccc1	ZINC000875176018	CH	On-Demand	Clean	MME	47	39
CC[C@@H](NC(=O)N[C@H](C)c1ccccc1O)c1ccccc1	ZINC000875176018	CH	On-Demand	Clean	TACR3	55	44
CC[C@@H](NC(=O)N[C@H](C)c1ccccc1O)c1ccccc1	ZINC000875176018	CH	On-Demand	Clean	SOAT1	41	40
CC[C@@H](NC(=O)N[C@H](C)c1ccccc1O)c1ccccc1	ZINC000875176018	CH	On-Demand	Clean	ACE2	53	37
CC(C)(C)OC(=O)N1CCN(CCNC(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875176019	GD	On-Demand	Anodyne	CACNA1I	42	34
CC(C)(C)OC(=O)N1CCN(CCNC(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875176019	GD	On-Demand	Anodyne	GPR119	42	40
CC[C@@H](NC(=O)N[C@@H](C)c1ccccc1O)c1ccccc1	ZINC000875176020	CH	On-Demand	Clean	MME	47	39
CC[C@@H](NC(=O)N[C@@H](C)c1ccccc1O)c1ccccc1	ZINC000875176020	CH	On-Demand	Clean	TACR3	55	44
CC[C@@H](NC(=O)N[C@@H](C)c1ccccc1O)c1ccccc1	ZINC000875176020	CH	On-Demand	Clean	SOAT1	41	40
CC[C@@H](NC(=O)N[C@@H](C)c1ccccc1O)c1ccccc1	ZINC000875176020	CH	On-Demand	Clean	ACE2	53	37
CCOc1cccc([C@H](C)NC(=O)N(C)OCC(F)(F)F)c1	ZINC000875176024	DG	On-Demand	Anodyne	PDS	67	42
CCOc1cccc([C@@H](C)NC(=O)N(C)OCC(F)(F)F)c1	ZINC000875176025	DG	On-Demand	Anodyne	PDS	67	42
CS(=O)(=O)c1cccc(OC(=O)[C@@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875176031	FG	On-Demand	Anodyne	FKBP1A	18	44
CS(=O)(=O)c1cccc(OC(=O)[C@@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875176031	FG	On-Demand	Anodyne	C3AR1	37	40
CS(=O)(=O)c1cccc(OC(=O)[C@@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875176031	FG	On-Demand	Anodyne	FAAH	16	41
CS(=O)(=O)c1cccc(OC(=O)[C@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875176032	FG	On-Demand	Anodyne	FKBP1A	18	44
CS(=O)(=O)c1cccc(OC(=O)[C@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875176032	FG	On-Demand	Anodyne	C3AR1	37	40
CS(=O)(=O)c1cccc(OC(=O)[C@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875176032	FG	On-Demand	Anodyne	FAAH	16	41
COC(=O)N(C)NC(=O)NCc1cccc(Br)c1	ZINC000875176037	DD	On-Demand	Reactive	PDS	42	40
CC[C@@H](NC(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21)c1ccccc1	ZINC000875176041	DG	On-Demand	Anodyne	ACE	27	41
CC[C@@H](NC(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21)c1ccccc1	ZINC000875176041	DG	On-Demand	Anodyne	TACR3	45	38
CC[C@@H](NC(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21)c1ccccc1	ZINC000875176041	DG	On-Demand	Anodyne	XIAP	42	39
CC[C@@H](NC(=O)N1CC(CNC(=O)C(F)(F)F)C1)c1ccccc1	ZINC000875176047	EE	On-Demand	Anodyne	TACR3	41	35
CC[C@@H](NC(=O)N1CC[C@]2(C(=O)OC)CCC[C@H]12)c1ccccc1	ZINC000875176050	EG	On-Demand	Anodyne	TIMP3	57	32
CC[C@@H](NC(=O)N1CC[C@]2(C(=O)OC)CCC[C@H]12)c1ccccc1	ZINC000875176050	EG	On-Demand	Anodyne	TACR3	43	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1noc(-c2cccs2)n1	ZINC000875176060	FE	On-Demand	Anodyne	SLC6A4	19	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1noc(-c2cccs2)n1	ZINC000875176060	FE	On-Demand	Anodyne	SLC6A3	35	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1noc(-c2cccs2)n1	ZINC000875176061	FE	On-Demand	Anodyne	SLC6A4	19	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1noc(-c2cccs2)n1	ZINC000875176061	FE	On-Demand	Anodyne	SLC6A3	35	44
COCC(C)(C)CCNC(=O)NCc1ccccc1N1CCOCC1	ZINC000875176066	EE	On-Demand	Anodyne	SCN10A	15	45
CCOc1cccc([C@@H](C)NC(=O)NNc2cccc(C)n2)c1	ZINC000875176074	DG	On-Demand	Reactive	PDS	37	44
CCOc1cccc([C@H](C)NC(=O)NNc2cccc(C)n2)c1	ZINC000875176075	DG	On-Demand	Reactive	PDS	37	44
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2cccc(OCC)c2)C1	ZINC000875176077	EF	On-Demand	Anodyne	ACACB	20	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2cccc(OCC)c2)C1	ZINC000875176077	EF	On-Demand	Anodyne	PDS	43	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2cccc(OCC)c2)C1	ZINC000875176079	EF	On-Demand	Anodyne	ACACB	20	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2cccc(OCC)c2)C1	ZINC000875176079	EF	On-Demand	Anodyne	PDS	43	41
CCOc1cccc([C@@H](C)NC(=O)N2CC(CNC(=O)C(F)(F)F)C2)c1	ZINC000875176086	FE	On-Demand	Anodyne	PDS	41	38
CCOc1cccc([C@H](C)NC(=O)N2CC(CNC(=O)C(F)(F)F)C2)c1	ZINC000875176087	FE	On-Demand	Anodyne	PDS	41	38
CS(=O)(=O)c1cccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875176088	FF	On-Demand	Anodyne	DRD2	21	55
CS(=O)(=O)c1cccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875176088	FF	On-Demand	Anodyne	DRD4	46	40
CS(=O)(=O)c1cccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875176088	FF	On-Demand	Anodyne	ACHE	37	41
CS(=O)(=O)c1cccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875176088	FF	On-Demand	Anodyne	SLC6A1	54	34
CS(=O)(=O)c1cccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875176088	FF	On-Demand	Anodyne	DRD3	16	40
CS(=O)(=O)c1cccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875176088	FF	On-Demand	Anodyne	SIGMAR1	49	48
CS(=O)(=O)c1cccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875176088	FF	On-Demand	Anodyne	CCR5	50	39
CS(=O)(=O)c1cccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875176088	FF	On-Demand	Anodyne	SLC18A3	21	43
CS(=O)(=O)c1cccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875176088	FF	On-Demand	Anodyne	S1PR5	16	40
CS(=O)(=O)c1cccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875176088	FF	On-Demand	Anodyne	MCHR1	15	40
CS(=O)(=O)c1cccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875176089	FF	On-Demand	Anodyne	DRD2	21	55
CS(=O)(=O)c1cccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875176089	FF	On-Demand	Anodyne	DRD4	46	40
CS(=O)(=O)c1cccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875176089	FF	On-Demand	Anodyne	ACHE	37	41
CS(=O)(=O)c1cccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875176089	FF	On-Demand	Anodyne	SLC6A1	54	34
CS(=O)(=O)c1cccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875176089	FF	On-Demand	Anodyne	DRD3	16	40
CS(=O)(=O)c1cccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875176089	FF	On-Demand	Anodyne	SIGMAR1	49	48
CS(=O)(=O)c1cccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875176089	FF	On-Demand	Anodyne	CCR5	50	39
CS(=O)(=O)c1cccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875176089	FF	On-Demand	Anodyne	SLC18A3	21	43
CS(=O)(=O)c1cccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875176089	FF	On-Demand	Anodyne	S1PR5	16	40
CS(=O)(=O)c1cccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875176089	FF	On-Demand	Anodyne	MCHR1	15	40
CCOc1cccc([C@H](C)NC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875176091	CE	On-Demand	Anodyne	PDS	73	44
CCOc1cccc([C@@H](C)NC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875176092	CE	On-Demand	Anodyne	PDS	73	44
O=C(NCc1ncc(Cl)s1)NCc1ccccc1N1CCOCC1	ZINC000875176095	FF	On-Demand	Anodyne	SCN2A	18	41
O=C(NCc1ncc(Cl)s1)NCc1ccccc1N1CCOCC1	ZINC000875176095	FF	On-Demand	Anodyne	SCN10A	28	53
O=C(NCc1ccccc1N1CCOCC1)NCc1cccc2[nH]ccc12	ZINC000875176101	FG	On-Demand	Anodyne	PIK3CD	16	43
O=C(NCc1ccccc1N1CCOCC1)NCc1cccc2[nH]ccc12	ZINC000875176101	FG	On-Demand	Anodyne	SCN10A	15	47
O=C(NCc1ccccc1N1CCOCC1)NCc1cccc2[nH]ccc12	ZINC000875176101	FG	On-Demand	Anodyne	ATR	51	41
CC[C@@H](NC(=O)NCCN1CCOC[C@H]1CC)c1ccccc1	ZINC000875176133	DF	On-Demand	Anodyne	TACR3	45	37
CC[C@@H](NC(=O)N1CC[C@@H](c2nc(C)cs2)C1)c1ccccc1	ZINC000875176142	EI	On-Demand	Anodyne	CCR5	31	42
CC[C@@H](NC(=O)N1CC[C@@H](c2nc(C)cs2)C1)c1ccccc1	ZINC000875176142	EI	On-Demand	Anodyne	TACR3	46	38
CC[C@@H](NC(=O)N1CC[C@H](c2nc(C)cs2)C1)c1ccccc1	ZINC000875176144	EI	On-Demand	Anodyne	CCR5	31	42
CC[C@@H](NC(=O)N1CC[C@H](c2nc(C)cs2)C1)c1ccccc1	ZINC000875176144	EI	On-Demand	Anodyne	TACR3	46	38
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1C(F)(F)F	ZINC000875176145	DG	On-Demand	Anodyne	ANPEP	23	47
CC(C)(C(=O)Oc1cccc(S(C)(=O)=O)c1)[C@@H]1CCCCO1	ZINC000875176150	EF	On-Demand	Anodyne	PRTN3	43	31
CC(C)(C(=O)Oc1cccc(S(C)(=O)=O)c1)[C@H]1CCCCO1	ZINC000875176153	EF	On-Demand	Anodyne	PRTN3	43	31
O=C(N[C@H](c1ccc(Cl)cc1)C1CCC1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875176164	GD	On-Demand	Anodyne	CCR1	44	36
O=C(N[C@@H](c1ccc(Cl)cc1)C1CCC1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875176166	GD	On-Demand	Anodyne	CCR1	44	36
CCOc1cccc([C@H](C)NC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875176167	FH	On-Demand	Anodyne	PDS	20	41
CCOc1cccc([C@@H](C)NC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875176169	FH	On-Demand	Anodyne	PDS	20	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccc(Br)c2)C1	ZINC000875176171	FF	On-Demand	Anodyne	PDS	43	39
CC[C@@H](NC(=O)NNc1nnc(C)n1C)c1ccccc1	ZINC000875176175	CD	On-Demand	Reactive	TACR3	51	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CC)c2ccccc2)C1	ZINC000875176189	DF	On-Demand	Anodyne	ACE	36	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CC)c2ccccc2)C1	ZINC000875176189	DF	On-Demand	Anodyne	TACR3	44	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CC)c2ccccc2)C1	ZINC000875176191	DF	On-Demand	Anodyne	ACE	36	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CC)c2ccccc2)C1	ZINC000875176191	DF	On-Demand	Anodyne	TACR3	44	38
O=C(NCc1ccccc1N1CCOCC1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875176204	GD	On-Demand	Anodyne	SCN10A	15	46
CC[C@@H](NC(=O)N1C[C@@]2(C)CS(=O)(=O)C[C@@]2(C)C1)c1ccccc1	ZINC000875176231	FF	On-Demand	Anodyne	TACR3	44	38
CC[C@@H](NC(=O)NN(C)C(=O)OC)c1ccccc1	ZINC000875176235	CE	On-Demand	Reactive	TACR3	59	47
CC[C@@H](NC(=O)NN(C)C(=O)OC)c1ccccc1	ZINC000875176235	CE	On-Demand	Reactive	ACE2	42	33
CC[C@@H](NC(=O)NN(C)C(=O)OC)c1ccccc1	ZINC000875176235	CE	On-Demand	Reactive	UTS2	48	39
CC[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1ccccc1	ZINC000875176250	EH	On-Demand	Anodyne	CACNA1H	29	48
CC[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1ccccc1	ZINC000875176250	EH	On-Demand	Anodyne	TACR3	46	37
COC(=O)C1(O)CN(C(=O)NCc2ccccc2C(F)(F)F)C1	ZINC000875176252	ED	On-Demand	Anodyne	P2RX7	41	39
COC(=O)C1(O)CN(C(=O)NCc2ccccc2C(F)(F)F)C1	ZINC000875176252	ED	On-Demand	Anodyne	EPHX2	15	41
COC(=O)C1(O)CN(C(=O)NCc2ccccc2C(F)(F)F)C1	ZINC000875176252	ED	On-Demand	Anodyne	RBP4	54	37
CC[C@@H](NC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000875176256	EI	On-Demand	Anodyne	CACNA1H	15	41
CC[C@@H](NC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000875176256	EI	On-Demand	Anodyne	KCNQ2	43	36
CC[C@@H](NC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000875176256	EI	On-Demand	Anodyne	TACR3	44	37
CC[C@@H](NC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000875176256	EI	On-Demand	Anodyne	EPHX2	22	40
CC[C@@H](NC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000875176257	EI	On-Demand	Anodyne	CACNA1H	15	41
CC[C@@H](NC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000875176257	EI	On-Demand	Anodyne	KCNQ2	43	36
CC[C@@H](NC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000875176257	EI	On-Demand	Anodyne	TACR3	44	37
CC[C@@H](NC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000875176257	EI	On-Demand	Anodyne	EPHX2	22	40
O=C(NCc1ccccc1N1CCOCC1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875176258	GD	On-Demand	Anodyne	SCN10A	15	46
O=C(NCc1ccccc1N1CCOCC1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875176259	GD	On-Demand	Anodyne	SCN10A	15	46
O=C(NCc1ccccc1N1CCOCC1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875176260	GD	On-Demand	Anodyne	SCN10A	15	46
O=C(NCc1noc(-c2cccs2)n1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875176266	GH	On-Demand	Anodyne	CPT1A	66	38
O=C(NCc1noc(-c2cccs2)n1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875176267	GH	On-Demand	Anodyne	CPT1A	66	38
O=C(NCc1noc(-c2cccs2)n1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875176268	GH	On-Demand	Anodyne	CPT1A	66	38
O=C(NCc1noc(-c2cccs2)n1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875176269	GH	On-Demand	Anodyne	CPT1A	66	38
CC(=O)N1CCC[C@@H]1C(=O)Oc1cccc(S(C)(=O)=O)c1	ZINC000875176271	DD	On-Demand	Anodyne	FKBP1A	69	36
CC(=O)N1CCC[C@@H]1C(=O)Oc1cccc(S(C)(=O)=O)c1	ZINC000875176271	DD	On-Demand	Anodyne	PREP	40	39
CC(=O)N1CCC[C@@H]1C(=O)Oc1cccc(S(C)(=O)=O)c1	ZINC000875176271	DD	On-Demand	Anodyne	WNT3	41	38
O=C(NCc1noc(-c2cccs2)n1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875176278	FF	On-Demand	Anodyne	ETHR	35	41
CCC(=O)Nc1ccc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)cc1	ZINC000875176287	GJ	On-Demand	Anodyne	KCNK3	86	38
CCC(=O)Nc1ccc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)cc1	ZINC000875176287	GJ	On-Demand	Anodyne	KCNK9	46	36
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2Oc2ccccc2)CC1	ZINC000875176294	GF	On-Demand	Anodyne	EPHX2	35	47
O=C(NCc1ccccc1N1CCOCC1)N[C@H]1CCCn2nccc21	ZINC000875176302	FE	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1ccccc1N1CCOCC1)N[C@@H]1CCCn2nccc21	ZINC000875176303	FE	On-Demand	Anodyne	SCN10A	15	44
CN1CCN(C(=O)NCc2noc(-c3cccs3)n2)CCC1(C)C	ZINC000875176304	EE	On-Demand	Anodyne	ETHR	34	40
O=C(NCc1ccccc1N1CCOCC1)N1C[C@H]2COC[C@H]2C1	ZINC000875176325	ED	On-Demand	Anodyne	SCN10A	15	48
O=C(NCc1noc(-c2cccs2)n1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875176330	GG	On-Demand	Anodyne	ETHR	38	43
O=C(NCc1noc(-c2cccs2)n1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875176331	GG	On-Demand	Anodyne	ETHR	38	43
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cccc(S(C)(=O)=O)c1	ZINC000875176342	ED	On-Demand	Anodyne	CTSK	31	41
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cccc(S(C)(=O)=O)c1	ZINC000875176342	ED	On-Demand	Anodyne	CAPNS1	55	31
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cccc(S(C)(=O)=O)c1	ZINC000875176342	ED	On-Demand	Anodyne	CAPN1	51	38
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cccc(S(C)(=O)=O)c1	ZINC000875176342	ED	On-Demand	Anodyne	CAPN2	49	34
CS(=O)(=O)c1cccc(OC(=O)C2(NC(=O)OCc3ccccc3)CC2)c1	ZINC000875176346	GE	On-Demand	Anodyne	CTSK	16	44
CS(=O)(=O)c1cccc(OC(=O)C2(NC(=O)OCc3ccccc3)CC2)c1	ZINC000875176346	GE	On-Demand	Anodyne	CAPN2	43	33
CS(=O)(=O)c1cccc(OC(=O)C2(NC(=O)OCc3ccccc3)CC2)c1	ZINC000875176346	GE	On-Demand	Anodyne	SLC12A5	68	48
C=CCSCCNC(=O)N(CC)[C@H](C)[C@@H](O)c1ccccc1	ZINC000875176350	DG	On-Demand	Mild	NPY5R	21	42
C=CCSCCNC(=O)N(CC)[C@@H](C)[C@@H](O)c1ccccc1	ZINC000875176351	DG	On-Demand	Mild	NPY5R	21	42
C=CCSCCNC(=O)N(CC)[C@@H](C)[C@H](O)c1ccccc1	ZINC000875176352	DG	On-Demand	Mild	NPY5R	21	42
C=CCSCCNC(=O)N(CC)[C@H](C)[C@H](O)c1ccccc1	ZINC000875176353	DG	On-Demand	Mild	NPY5R	21	42
O=C(NCc1cccc2cccnc12)N1CCC[C@H](OC2CCC2)CC1	ZINC000875176368	FH	On-Demand	Anodyne	EPHX2	27	50
O=C(NCc1cccc2cccnc12)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875176369	FH	On-Demand	Anodyne	EPHX2	27	50
CCOc1cccc([C@H](C)NC(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875176378	ED	On-Demand	Anodyne	CACNA1H	35	41
CCOc1cccc([C@H](C)NC(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875176378	ED	On-Demand	Anodyne	PDS	49	44
CCOc1cccc([C@@H](C)NC(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875176379	ED	On-Demand	Anodyne	CACNA1H	35	41
CCOc1cccc([C@@H](C)NC(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875176379	ED	On-Demand	Anodyne	PDS	49	44
Cc1nccnc1[C@H](C)NC(=O)NCc1ccccc1N1CCOCC1	ZINC000875176390	FE	On-Demand	Anodyne	SCN10A	18	46
CC[C@@H](NC(=O)N1C[C@H](N(C)C)[C@H](n2ccnn2)C1)c1ccccc1	ZINC000875176391	ED	On-Demand	Anodyne	TACR3	45	38
Cc1nccnc1[C@@H](C)NC(=O)NCc1ccccc1N1CCOCC1	ZINC000875176394	FE	On-Demand	Anodyne	SCN10A	18	46
CCOC(=O)c1cc(CNC(=O)N[C@@H](CC)c2ccccc2)on1	ZINC000875176395	EF	On-Demand	Anodyne	TACR3	48	39
CCOC(=O)c1cc(CNC(=O)N[C@H](CC)c2ccccc2)on1	ZINC000875176397	EF	On-Demand	Anodyne	TACR3	48	39
CC[C@@H](NC(=O)NC1(C)CC(F)(F)C1)c1ccccc1	ZINC000875176422	CH	On-Demand	Anodyne	TACR3	51	41
O=C(NCc1ccccc1N1CCOCC1)N1CC(OCC(F)F)C1	ZINC000875176424	FD	On-Demand	Anodyne	SCN10A	15	43
CC[C@@H](NC(=O)N1CCC(c2nnnn2C)CC1)c1ccccc1	ZINC000875176427	EE	On-Demand	Anodyne	CCR5	27	41
CC[C@@H](NC(=O)N1CCC(c2nnnn2C)CC1)c1ccccc1	ZINC000875176427	EE	On-Demand	Anodyne	TACR3	44	35
CN(C)C[C@@H]1CN(C(=O)NCc2ccccc2C(F)(F)F)C[C@H]1CN(C)C	ZINC000875176429	GF	On-Demand	Anodyne	P2RX7	49	44
CN(C)C[C@@H]1CN(C(=O)NCc2ccccc2C(F)(F)F)C[C@H]1CN(C)C	ZINC000875176429	GF	On-Demand	Anodyne	EPHX2	18	44
CN(C)C[C@@H]1CN(C(=O)NCc2ccccc2C(F)(F)F)C[C@H]1CN(C)C	ZINC000875176429	GF	On-Demand	Anodyne	RBP4	91	43
O=CN1CCCN(C(=O)NCCc2c[nH]c3cc(Cl)ccc23)CC1	ZINC000875176443	EE	On-Demand	Anodyne	ACHE	31	43
O=C(NCc1ccccc1N1CCOCC1)NC[C@H](n1cncn1)C(F)(F)F	ZINC000875176460	GD	On-Demand	Anodyne	SCN10A	16	46
O=C(NCc1ccccc1N1CCOCC1)NC[C@@H](n1cncn1)C(F)(F)F	ZINC000875176464	GD	On-Demand	Anodyne	SCN10A	16	46
CC[C@@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)c1ccccc1	ZINC000875176479	CG	On-Demand	Anodyne	SLC6A1	86	41
CC[C@@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)c1ccccc1	ZINC000875176479	CG	On-Demand	Anodyne	KCNQ2	47	37
CC[C@@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)c1ccccc1	ZINC000875176479	CG	On-Demand	Anodyne	CCR5	49	47
CC[C@@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)c1ccccc1	ZINC000875176479	CG	On-Demand	Anodyne	TACR3	47	42
CC[C@@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)c1ccccc1	ZINC000875176479	CG	On-Demand	Anodyne	REN	15	42
CC[C@@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)c1ccccc1	ZINC000875176479	CG	On-Demand	Anodyne	DPP7	51	37
CC[C@@H](NC(=O)N1CCC[C@H](C(C)=O)C1)c1ccccc1	ZINC000875176480	CG	On-Demand	Anodyne	SLC6A1	86	41
CC[C@@H](NC(=O)N1CCC[C@H](C(C)=O)C1)c1ccccc1	ZINC000875176480	CG	On-Demand	Anodyne	KCNQ2	47	37
CC[C@@H](NC(=O)N1CCC[C@H](C(C)=O)C1)c1ccccc1	ZINC000875176480	CG	On-Demand	Anodyne	CCR5	49	47
CC[C@@H](NC(=O)N1CCC[C@H](C(C)=O)C1)c1ccccc1	ZINC000875176480	CG	On-Demand	Anodyne	TACR3	47	42
CC[C@@H](NC(=O)N1CCC[C@H](C(C)=O)C1)c1ccccc1	ZINC000875176480	CG	On-Demand	Anodyne	REN	15	42
CC[C@@H](NC(=O)N1CCC[C@H](C(C)=O)C1)c1ccccc1	ZINC000875176480	CG	On-Demand	Anodyne	DPP7	51	37
O=C(NCc1ccccc1N1CCOCC1)N[C@H]1CCOC[C@H]1O	ZINC000875176481	EC	On-Demand	Anodyne	SCN10A	15	45
CC[C@@H](NC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1ccccc1	ZINC000875176484	EH	On-Demand	Anodyne	CCR5	19	43
CC[C@@H](NC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1ccccc1	ZINC000875176484	EH	On-Demand	Anodyne	TACR3	40	34
CC[C@@H](NC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1ccccc1	ZINC000875176484	EH	On-Demand	Anodyne	RBP4	43	34
O=C(NCc1ccccc1N1CCOCC1)N[C@H]1CCOC[C@@H]1O	ZINC000875176485	EC	On-Demand	Anodyne	SCN10A	15	45
CC[C@@H](NC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1ccccc1	ZINC000875176487	EH	On-Demand	Anodyne	CCR5	19	43
CC[C@@H](NC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1ccccc1	ZINC000875176487	EH	On-Demand	Anodyne	TACR3	40	34
CC[C@@H](NC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1ccccc1	ZINC000875176487	EH	On-Demand	Anodyne	RBP4	43	34
O=C(NCc1ccccc1N1CCOCC1)N[C@@H]1CCOC[C@@H]1O	ZINC000875176489	EC	On-Demand	Anodyne	SCN10A	15	45
O=C(NCc1ccccc1N1CCOCC1)N(CCO)CCOCCO	ZINC000875176498	FC	On-Demand	Anodyne	SCN10A	15	43
CC[C@@H](NC(=O)N1CCN(c2ccc(C#N)nc2)CC1)c1ccccc1	ZINC000875176510	EF	On-Demand	Mild	PTAFR	31	42
CC[C@@H](NC(=O)N1CCN(c2ccc(C#N)nc2)CC1)c1ccccc1	ZINC000875176510	EF	On-Demand	Mild	TACR3	41	35
CC[C@@H](NC(=O)NCc1ccc(N(C)C(C)=O)cc1)c1ccccc1	ZINC000875176513	EH	On-Demand	Anodyne	ANPEP	20	44
CC[C@@H](NC(=O)NCc1ccc(N(C)C(C)=O)cc1)c1ccccc1	ZINC000875176513	EH	On-Demand	Anodyne	TACR3	51	42
CC[C@@H](NC(=O)NCc1ccc(N(C)C(C)=O)cc1)c1ccccc1	ZINC000875176513	EH	On-Demand	Anodyne	PDS	48	37
CC[C@@H](NC(=O)N(CCOC)CC1CCN(C)CC1)c1ccccc1	ZINC000875176526	EG	On-Demand	Anodyne	TACR3	44	38
CC[C@@H](NC(=O)N(CCOC)CC1CCN(C)CC1)c1ccccc1	ZINC000875176526	EG	On-Demand	Anodyne	AMY2	46	32
C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1N1CCOCC1	ZINC000875176541	FD	On-Demand	Anodyne	SCN10A	15	44
C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1N1CCOCC1	ZINC000875176543	FD	On-Demand	Anodyne	SCN10A	15	44
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1N1CCOCC1	ZINC000875176544	FD	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1ccccc1N1CCOCC1)N[C@H](CF)c1ccc(F)cc1	ZINC000875176559	GG	On-Demand	Anodyne	KCNQ2	51	40
O=C(NCc1ccccc1N1CCOCC1)N[C@@H](CF)c1ccc(F)cc1	ZINC000875176560	GG	On-Demand	Anodyne	KCNQ2	51	40
O=C1CCN(C(=O)NCc2ccccc2N2CCOCC2)CCCCCCN1	ZINC000875176565	GE	On-Demand	Anodyne	SCN10A	17	42
O=C(NCc1ccccc1N1CCOCC1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875176570	GG	On-Demand	Anodyne	SCN10A	15	45
O=C(NCc1ccccc1N1CCOCC1)N1CCC(CCO)(CCO)CC1	ZINC000875176574	GD	On-Demand	Anodyne	SCN10A	15	45
CC[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1	ZINC000875176596	ED	On-Demand	Anodyne	CCR5	28	44
CC[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1	ZINC000875176596	ED	On-Demand	Anodyne	TACR3	43	37
CC[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1	ZINC000875176596	ED	On-Demand	Anodyne	EPHX2	17	42
CC[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1	ZINC000875176596	ED	On-Demand	Anodyne	XIAP	44	33
CC[C@@H](NC(=O)NC[C@@H]1CCO[C@@H]1C(=O)OC)c1ccccc1	ZINC000875176598	DE	On-Demand	Anodyne	TACR3	44	37
CCn1c(CCNC(=O)N2CCC3(CCN(C)CC3)CC2)nc2ccccc21	ZINC000875176610	GG	On-Demand	Anodyne	HRH1	22	41
O=C(NCc1ccccc1N1CCOCC1)N1CCCC(F)(F)CC1	ZINC000875176612	FF	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1ccccc1N1CCOCC1)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875176613	ED	On-Demand	Anodyne	SCN10A	15	45
O=C(NCc1ccccc1N1CCOCC1)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875176615	ED	On-Demand	Anodyne	SCN10A	15	45
CC[C@@H](NC(=O)NC[C@@H]1CC(C(F)(F)F)=NO1)c1ccccc1	ZINC000875176619	EG	On-Demand	Anodyne	TACR3	46	37
CC[C@@H](NC(=O)NC[C@H]1CC(C(F)(F)F)=NO1)c1ccccc1	ZINC000875176623	EG	On-Demand	Anodyne	TACR3	46	37
CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(c1noc(C)n1)C2)c1ccccc1	ZINC000875176637	FH	On-Demand	Anodyne	CCR5	19	52
CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(c1noc(C)n1)C2)c1ccccc1	ZINC000875176637	FH	On-Demand	Anodyne	TACR3	44	36
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](CC)c1ccccc1	ZINC000875176652	CF	On-Demand	Anodyne	MME	63	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](CC)c1ccccc1	ZINC000875176652	CF	On-Demand	Anodyne	ANPEP	49	33
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](CC)c1ccccc1	ZINC000875176652	CF	On-Demand	Anodyne	TACR3	55	43
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](CC)c1ccccc1	ZINC000875176652	CF	On-Demand	Anodyne	ACE2	50	34
CC[C@@H](NC(=O)N1CCc2ccc(NC(C)=O)cc2C1)c1ccccc1	ZINC000875176681	FH	On-Demand	Anodyne	NPY2R	41	35
CC[C@@H](NC(=O)N1CCc2ccc(NC(C)=O)cc2C1)c1ccccc1	ZINC000875176681	FH	On-Demand	Anodyne	MAPK1	43	42
O=C(NCc1ccccc1N1CCOCC1)N1C[C@@H](CO)[C@H](C(F)(F)F)C1	ZINC000875176700	GD	On-Demand	Anodyne	SCN10A	15	45
C[C@@H]1O[C@H](C)[C@@H](NC(=O)NCc2ccccc2N2CCOCC2)[C@H]1C	ZINC000875176702	EE	On-Demand	Anodyne	SCN10A	15	44
C[C@@H]1O[C@H](C)[C@H](NC(=O)NCc2ccccc2N2CCOCC2)[C@@H]1C	ZINC000875176705	EE	On-Demand	Anodyne	SCN10A	15	44
Cc1cccc(C(C)(C)CNC(=O)N2CCC(C(=O)NCCO)CC2)c1	ZINC000875176706	FD	On-Demand	Anodyne	EPHX2	32	40
C[C@@H]1O[C@H](C)[C@@H](NC(=O)NCc2ccccc2N2CCOCC2)[C@@H]1C	ZINC000875176707	EE	On-Demand	Anodyne	SCN10A	15	44
C[C@@H]1O[C@H](C)[C@H](NC(=O)NCc2ccccc2N2CCOCC2)[C@H]1C	ZINC000875176708	EE	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1ccccc1N1CCOCC1)N(C1CC1)C1CC1	ZINC000875176709	DE	On-Demand	Anodyne	SCN10A	16	48
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2N2CCOCC2)CC1	ZINC000875176723	GC	On-Demand	Anodyne	EPHX2	24	51
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2N2CCOCC2)CC1	ZINC000875176723	GC	On-Demand	Anodyne	SCN10A	15	45
CC[C@@H](NC(=O)N1C[C@H]2C(=O)OC[C@H]2C1)c1ccccc1	ZINC000875176728	CD	On-Demand	Anodyne	TACR3	46	37
CC[C@@H](NC(=O)N1CCC[C@@H](CCC(=O)OC)C1)c1ccccc1	ZINC000875176730	EH	On-Demand	Anodyne	TACR3	40	35
CC[C@@H](NC(=O)N1CCC[C@@H](CCC(=O)OC)C1)c1ccccc1	ZINC000875176730	EH	On-Demand	Anodyne	REN	21	42
CC[C@@H](NC(=O)N1CCC[C@H](CCC(=O)OC)C1)c1ccccc1	ZINC000875176732	EH	On-Demand	Anodyne	TACR3	40	35
CC[C@@H](NC(=O)N1CCC[C@H](CCC(=O)OC)C1)c1ccccc1	ZINC000875176732	EH	On-Demand	Anodyne	REN	21	42
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(OCCCN(C)C)cc2)CC1	ZINC000875176737	GD	On-Demand	Anodyne	HRH3	27	40
CC[C@H](C[C@H](C)O)NC(=O)NCCc1c[nH]c2cc(Cl)ccc12	ZINC000875176750	EG	On-Demand	Anodyne	GRPR	49	30
O=C(NCc1ccccc1N1CCOCC1)N[C@H]1COC[C@H]1O	ZINC000875176751	DC	On-Demand	Anodyne	SCN10A	15	47
CN(Cc1ccns1)C(=O)NCc1ccccc1N1CCOCC1	ZINC000875176769	EE	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1ccccc1N1CCOCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875176773	GF	On-Demand	Anodyne	KCNQ2	43	34
O=C(NCc1ccccc1N1CCOCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875176774	GF	On-Demand	Anodyne	KCNQ2	43	34
O=C(NCc1ccccc1N1CCOCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875176775	GF	On-Demand	Anodyne	KCNQ2	43	34
O=C(NCc1ccccc1N1CCOCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875176776	GF	On-Demand	Anodyne	KCNQ2	43	34
O=C(NCc1ccccc1N1CCOCC1)NCC1CC=CC1	ZINC000875176784	DE	On-Demand	Anodyne	SCN10A	15	47
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(OCCCN(C)C)cc2)C1	ZINC000875176785	GD	On-Demand	Anodyne	HRH3	38	47
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(OCCCN(C)C)cc2)C1	ZINC000875176786	GD	On-Demand	Anodyne	HRH3	38	47
O=CN1CCCN(C(=O)NCCCOc2ccc(Cl)cc2Cl)CC1	ZINC000875176801	FF	On-Demand	Anodyne	EPHX2	15	40
O=CN1CCCN(C(=O)NCc2ccccc2C(F)(F)F)CC1	ZINC000875176806	EE	On-Demand	Anodyne	P2RX7	46	38
O=CN1CCCN(C(=O)NCc2ccccc2C(F)(F)F)CC1	ZINC000875176806	EE	On-Demand	Anodyne	EPHX2	17	42
O=CN1CCCN(C(=O)NCc2ccccc2C(F)(F)F)CC1	ZINC000875176806	EE	On-Demand	Anodyne	RBP4	73	37
COCCN(CC1CCN(C)CC1)C(=O)NCC(C)(C)c1ccccc1OC	ZINC000875176812	GF	On-Demand	Anodyne	ACKR3	66	34
O=C(NCCO)C1CCN(C(=O)NCCc2c[nH]c3cc(Cl)ccc23)CC1	ZINC000875176820	GD	On-Demand	Anodyne	MTNR1A	18	48
O=C(NCCO)C1CCN(C(=O)NCCc2c[nH]c3cc(Cl)ccc23)CC1	ZINC000875176820	GD	On-Demand	Anodyne	EPHX2	16	49
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](c2ccc(Cl)cc2)C2CCC2)CC1	ZINC000875176822	GG	On-Demand	Anodyne	CCR1	40	38
CC(=O)C1CCN(C(=O)C(=O)N[C@H](c2ccc(Cl)cc2)C2CCC2)CC1	ZINC000875176823	GG	On-Demand	Anodyne	CCR1	40	38
CC[C@@H](NC(=O)N1Cc2cccc(O)c2C1)c1ccccc1	ZINC000875176836	CH	On-Demand	Clean	TACR3	45	38
CC[C@@H](NC(=O)N1CCCN(C(=O)CC(C)C)CC1)c1ccccc1	ZINC000875176837	EG	On-Demand	Anodyne	PTAFR	24	49
CC[C@@H](NC(=O)N1CCCN(C(=O)CC(C)C)CC1)c1ccccc1	ZINC000875176837	EG	On-Demand	Anodyne	RIR1_HHV11	63	36
CC[C@@H](NC(=O)N1CCCN(C(=O)CC(C)C)CC1)c1ccccc1	ZINC000875176837	EG	On-Demand	Anodyne	TACR3	44	38
CC[C@@H](NC(=O)N1CCC[C@H]1c1cncc(C)c1)c1ccccc1	ZINC000875176839	DI	On-Demand	Anodyne	PREP	40	33
CC[C@@H](NC(=O)N1CCC[C@H]1c1cncc(C)c1)c1ccccc1	ZINC000875176839	DI	On-Demand	Anodyne	TACR3	44	38
CC[C@@H](NC(=O)N1CCC[C@@H]1c1cncc(C)c1)c1ccccc1	ZINC000875176842	DI	On-Demand	Anodyne	PREP	40	33
CC[C@@H](NC(=O)N1CCC[C@@H]1c1cncc(C)c1)c1ccccc1	ZINC000875176842	DI	On-Demand	Anodyne	TACR3	44	38
CC[C@@H](NC(=O)NN=c1cc[nH]c(C)c1)c1ccccc1	ZINC000875176847	CF	On-Demand	Reactive	TACR3	49	40
CC[C@@H](NC(=O)N1CC2(CC(=O)N2Cc2ccccc2)C1)c1ccccc1	ZINC000875176849	FG	On-Demand	Anodyne	TACR3	40	35
CC[C@@H](NC(=O)N(C)CCN1CC2(CCOCC2)C1)c1ccccc1	ZINC000875176850	EF	On-Demand	Anodyne	CASR	49	38
CC[C@@H](NC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)c1ccccc1	ZINC000875176862	FG	On-Demand	Anodyne	TACR3	42	35
CC[C@@H](NC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)c1ccccc1	ZINC000875176862	FG	On-Demand	Anodyne	ETHR	60	36
CC[C@@H](NC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)c1ccccc1	ZINC000875176864	FG	On-Demand	Anodyne	TACR3	42	35
CC[C@@H](NC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)c1ccccc1	ZINC000875176864	FG	On-Demand	Anodyne	ETHR	60	36
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC(C)(C)c1cccc(C)c1	ZINC000875176873	EG	On-Demand	Anodyne	SLC6A3	40	36
CC[C@@H](NC(=O)N(C)OCC(F)(F)F)c1ccccc1	ZINC000875176879	CG	On-Demand	Anodyne	TACR3	49	41
O=C(NCc1ccccc1C(F)(F)F)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875176885	GF	On-Demand	Anodyne	P2RX7	43	41
O=C(NCc1ccccc1C(F)(F)F)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875176885	GF	On-Demand	Anodyne	RBP4	75	43
COC(=O)c1oc(CNC(=O)NCc2ccccc2N2CCOCC2)cc1C	ZINC000875176896	GE	On-Demand	Anodyne	SCN10A	15	45
O=C(NCc1ccnc(-n2cncn2)c1)NCc1ccccc1N1CCOCC1	ZINC000875176898	GD	On-Demand	Anodyne	NOS2	51	33
O=C(NCc1ccnc(-n2cncn2)c1)NCc1ccccc1N1CCOCC1	ZINC000875176898	GD	On-Demand	Anodyne	SCN10A	19	45
O=C(NCc1ccccc1N1CCOCC1)N1CC[C@H]2CC[C@@H](C1)S2	ZINC000875176911	FF	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1ccccc1N1CCOCC1)NCc1cccc2c1CCOC2	ZINC000875176914	GF	On-Demand	Anodyne	SCN10A	15	48
O=C(NCc1ccccc1N1CCOCC1)NC[C@@H]1CCCO[C@H]1c1cn[nH]c1	ZINC000875176915	GE	On-Demand	Anodyne	SCN10A	15	44
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1nccn1C)CC2	ZINC000875176916	FD	On-Demand	Anodyne	SLC18A2	47	33
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1nccn1C)CC2	ZINC000875176917	FD	On-Demand	Anodyne	SLC18A2	47	33
O=C(NCc1ccccc1N1CCOCC1)N1CC=CC1	ZINC000875176935	CD	On-Demand	Anodyne	KCNQ2	58	36
O=C(NCc1ccccc1N1CCOCC1)N1CC=CC1	ZINC000875176935	CD	On-Demand	Anodyne	SCN10A	16	50
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2nc3ccccc3n2CC)C1	ZINC000875176937	FE	On-Demand	Anodyne	PDE6D	49	34
COc1ccc([C@@H](NC(=O)NCc2ccccc2N2CCOCC2)C2CC2)cn1	ZINC000875176938	GF	On-Demand	Anodyne	OXTR	15	41
COc1ccc([C@H](NC(=O)NCc2ccccc2N2CCOCC2)C2CC2)cn1	ZINC000875176939	GF	On-Demand	Anodyne	OXTR	15	41
CCC[C@@H](CC)NC(=O)NNc1cccc(C)n1	ZINC000875176943	CF	On-Demand	Reactive	GRM5	15	40
CCC[C@H](CC)NC(=O)NNc1cccc(C)n1	ZINC000875176944	CF	On-Demand	Reactive	GRM5	15	40
O=C(NCc1ccccc1N1CCOCC1)NCc1cccc(F)c1F	ZINC000875176945	FF	On-Demand	Anodyne	KCNQ2	46	35
O=C(NCc1ccccc1N1CCOCC1)NCc1cccc(F)c1F	ZINC000875176945	FF	On-Demand	Anodyne	P2RX7	20	41
O=C(NCc1ccccc1N1CCOCC1)NCc1cccc(F)c1F	ZINC000875176945	FF	On-Demand	Anodyne	SCN10A	16	50
O=C(NCc1ccccc1N1CCOCC1)NCc1cccc(F)c1F	ZINC000875176945	FF	On-Demand	Anodyne	STAT6	51	44
COC(=O)C1(O)CN(C(=O)NCc2ccccc2N2CCOCC2)C1	ZINC000875176950	EB	On-Demand	Anodyne	SCN10A	15	46
CC(=O)Nc1cc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)ccc1C	ZINC000875176962	GJ	On-Demand	Anodyne	MAPK14	27	54
CC(=O)Nc1cc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)ccc1C	ZINC000875176962	GJ	On-Demand	Anodyne	KCNK3	96	40
CC(=O)Nc1cc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)ccc1C	ZINC000875176962	GJ	On-Demand	Anodyne	KCNK9	49	39
O=C(NCc1ccccc1N1CCOCC1)N[C@@H]1C[C@H](CO)C1	ZINC000875176969	DD	On-Demand	Anodyne	SCN10A	15	45
C[C@@H]1O[C@H](C)C[C@H]1NC(=O)NCc1ccccc1N1CCOCC1	ZINC000875176972	ED	On-Demand	Anodyne	SCN10A	15	43
COc1cccc([C@H](CNC(=O)NCc2ccccc2N2CCOCC2)OC)c1	ZINC000875176974	GF	On-Demand	Anodyne	DRD4	46	38
COc1cccc([C@H](CNC(=O)NCc2ccccc2N2CCOCC2)OC)c1	ZINC000875176974	GF	On-Demand	Anodyne	CASR	36	44
COc1cccc([C@H](CNC(=O)NCc2ccccc2N2CCOCC2)OC)c1	ZINC000875176974	GF	On-Demand	Anodyne	HTR7	15	42
COc1cccc([C@H](CNC(=O)NCc2ccccc2N2CCOCC2)OC)c1	ZINC000875176974	GF	On-Demand	Anodyne	KCNQ2	42	46
COc1cccc([C@H](CNC(=O)NCc2ccccc2N2CCOCC2)OC)c1	ZINC000875176974	GF	On-Demand	Anodyne	SOAT1	24	40
CCn1nncc1CNC(=O)NCc1ccccc1N1CCOCC1	ZINC000875176976	ED	On-Demand	Anodyne	SCN10A	15	47
CCCCCCCNC(=O)C(=O)NCC1(C)CCOCC1	ZINC000875176991	CE	On-Demand	Mild	ASAH1	53	38
CC[C@@H](NC(=O)N1CCc2c(CC(N)=O)cccc2C1)c1ccccc1	ZINC000875177022	FF	On-Demand	Anodyne	Q6PRC7_IXORI	45	37
O=C(NCc1ccccc1C(F)(F)F)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875177028	FH	On-Demand	Anodyne	P2RX7	45	44
O=C(NCc1ccccc1C(F)(F)F)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875177028	FH	On-Demand	Anodyne	RBP4	54	35
CC[C@@H](NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1)c1ccccc1	ZINC000875177031	FI	On-Demand	Anodyne	CCR5	21	51
CC[C@@H](NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1)c1ccccc1	ZINC000875177031	FI	On-Demand	Anodyne	CPT1A	16	43
CC[C@@H](NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1)c1ccccc1	ZINC000875177031	FI	On-Demand	Anodyne	TACR3	45	37
CC[C@@H](NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1)c1ccccc1	ZINC000875177031	FI	On-Demand	Anodyne	SMO	46	46
CC[C@@H](NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1)c1ccccc1	ZINC000875177031	FI	On-Demand	Anodyne	ETHR	67	47
CC[C@@H](NC(=O)N1CC[C@](C)(C(F)(F)F)C1)c1ccccc1	ZINC000875177034	DI	On-Demand	Anodyne	CACNA1H	22	45
CC[C@@H](NC(=O)N1CC[C@](C)(C(F)(F)F)C1)c1ccccc1	ZINC000875177034	DI	On-Demand	Anodyne	TACR3	41	35
CC[C@@H](NC(=O)N1CC[C@@](C)(C(F)(F)F)C1)c1ccccc1	ZINC000875177035	DI	On-Demand	Anodyne	CACNA1H	22	45
CC[C@@H](NC(=O)N1CC[C@@](C)(C(F)(F)F)C1)c1ccccc1	ZINC000875177035	DI	On-Demand	Anodyne	TACR3	41	35
O=C(NCc1ccccc1C(F)(F)F)NC[C@H]1C[C@H](O)C1	ZINC000875177044	DE	On-Demand	Anodyne	P2RX7	41	38
O=C(NCc1cccc2ncccc12)C(=O)N[C@@H](c1ccccc1)C1CCC1	ZINC000875177047	FH	On-Demand	Anodyne	TACR3	22	43
O=C(NCc1ccccc1N1CCOCC1)NC[C@H](n1cccn1)C(F)(F)F	ZINC000875177050	GE	On-Demand	Anodyne	SCN10A	15	45
O=C(NCc1cccc2ncccc12)C(=O)N[C@H](c1ccccc1)C1CCC1	ZINC000875177051	FH	On-Demand	Anodyne	TACR3	22	43
O=C(NCc1ccccc1N1CCOCC1)NC[C@@H](n1cccn1)C(F)(F)F	ZINC000875177052	GE	On-Demand	Anodyne	SCN10A	15	45
CC[C@@H](NC(=O)N1CCc2cccc(NC(C)=O)c2C1)c1ccccc1	ZINC000875177055	FH	On-Demand	Anodyne	KCNQ2	46	36
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2C(F)(F)F)CC1	ZINC000875177057	FD	On-Demand	Anodyne	P2RX7	46	42
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2C(F)(F)F)CC1	ZINC000875177057	FD	On-Demand	Anodyne	EPHX2	34	56
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2C(F)(F)F)CC1	ZINC000875177057	FD	On-Demand	Anodyne	RBP4	82	39
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2C(F)(F)F)CC1	ZINC000875177057	FD	On-Demand	Anodyne	SFRP1	90	32
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2C(F)(F)F)CC1	ZINC000875177057	FD	On-Demand	Anodyne	SCD	23	40
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2C(F)(F)F)CC1	ZINC000875177057	FD	On-Demand	Anodyne	WNT3	65	32
CC[C@@H](NC(=O)N1CCN([S@@](C)(=N)=O)CC1)c1ccccc1	ZINC000875177061	DE	On-Demand	Anodyne	TACR3	46	40
CC[C@@H](NC(=O)N1CCN([S@](C)(=N)=O)CC1)c1ccccc1	ZINC000875177063	DE	On-Demand	Anodyne	TACR3	46	40
O=C(NCc1ccccc1N1CCOCC1)N1CCC(CCF)CC1	ZINC000875177072	EF	On-Demand	Anodyne	EPHX2	26	44
O=C(NCc1ccccc1N1CCOCC1)N1CCC(CCF)CC1	ZINC000875177072	EF	On-Demand	Anodyne	SCN10A	15	45
CC(C)(C)OC(=O)N[C@@H](CNC(=O)C(=O)N[C@H]1CC12CCC2)c1ccccc1	ZINC000875177078	GE	On-Demand	Anodyne	CTSK	21	44
CC(C)(C)OC(=O)N[C@@H](CNC(=O)C(=O)N[C@@H]1CC12CCC2)c1ccccc1	ZINC000875177080	GE	On-Demand	Anodyne	CTSK	21	44
CN(Cc1ncc[nH]1)C(=O)NCc1ccccc1N1CCOCC1	ZINC000875177082	ED	On-Demand	Anodyne	SCN10A	18	45
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(Br)c1	ZINC000875177090	EF	On-Demand	Anodyne	ANPEP	28	48
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(Br)c1	ZINC000875177090	EF	On-Demand	Anodyne	PDS	62	45
C/C=C\CNC(=O)NCc1ccccc1N1CCOCC1	ZINC000875177100	CD	On-Demand	Anodyne	SCN10A	15	47
C/C=C/CNC(=O)NCc1ccccc1N1CCOCC1	ZINC000875177101	CD	On-Demand	Anodyne	SCN10A	15	47
CCn1c(CCNC(=O)N2CCC(CO)(CO)CC2)nc2ccccc21	ZINC000875177103	FD	On-Demand	Anodyne	AGTR1	22	45
CCn1c(CCNC(=O)N2CCC(CO)(CO)CC2)nc2ccccc21	ZINC000875177103	FD	On-Demand	Anodyne	AGTR1B	21	45
CC[C@@H](NC(=O)N[C@H]1CCN(CC(C)(C)O)C1)c1ccccc1	ZINC000875177111	DE	On-Demand	Anodyne	CCR5	43	39
CC[C@@H](NC(=O)N[C@H]1CCN(CC(C)(C)O)C1)c1ccccc1	ZINC000875177111	DE	On-Demand	Anodyne	TACR3	45	39
Cc1nnc(NNC(=O)NCc2ccccc2C(F)(F)F)n1C	ZINC000875177114	ED	On-Demand	Reactive	P2RX7	40	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC(C)(C)c1ccccc1OC	ZINC000875177116	FF	On-Demand	Anodyne	SLC6A3	41	39
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2ccc(OCCN(C)C)cc2)C1	ZINC000875177124	GD	On-Demand	Anodyne	HRH3	22	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2ccc(OCCN(C)C)cc2)C1	ZINC000875177125	GD	On-Demand	Anodyne	HRH3	22	43
CN(C[C@@H]1C[C@H](O)C1)C(=O)NCc1ccccc1N1CCOCC1	ZINC000875177131	ED	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1ccccc1C(F)(F)F)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875177132	FH	On-Demand	Anodyne	P2RX7	41	39
O=C(NCc1ccccc1C(F)(F)F)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875177132	FH	On-Demand	Anodyne	EPHX2	25	46
O=C(NCc1ccccc1C(F)(F)F)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875177132	FH	On-Demand	Anodyne	RBP4	82	41
O=C(NCc1ccccc1C(F)(F)F)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875177134	FH	On-Demand	Anodyne	P2RX7	41	39
O=C(NCc1ccccc1C(F)(F)F)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875177134	FH	On-Demand	Anodyne	EPHX2	25	46
O=C(NCc1ccccc1C(F)(F)F)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875177134	FH	On-Demand	Anodyne	RBP4	82	41
O=C(NCc1ccccc1N1CCOCC1)N1[C@H]2CC[C@H]1CC1(CC1)C2	ZINC000875177142	FG	On-Demand	Anodyne	SCN10A	15	45
O=C(NCc1ccccc1N1CCOCC1)NC[C@H]1CCC12CCOCC2	ZINC000875177143	FF	On-Demand	Anodyne	SCN10A	15	45
O=C(NCc1ccccc1N1CCOCC1)NC[C@@H]1CCC12CCOCC2	ZINC000875177144	FF	On-Demand	Anodyne	SCN10A	15	45
CCn1c(CCNC(=O)N2CC[C@]3(C(=O)OC)CCC[C@H]23)nc2ccccc21	ZINC000875177145	GF	On-Demand	Anodyne	PDE6D	41	32
O=C(NCc1ccccc1N1CCOCC1)N[C@H](c1ccccn1)C1CCC1	ZINC000875177150	GG	On-Demand	Anodyne	SCN10A	20	42
O=C(NCc1ccccc1N1CCOCC1)N[C@@H](c1ccccn1)C1CCC1	ZINC000875177151	GG	On-Demand	Anodyne	SCN10A	20	42
O=C(NCc1ccccc1N1CCOCC1)N1CCCC2(CC1)CC2	ZINC000875177158	EF	On-Demand	Anodyne	SCN10A	15	45
O=C(NCc1ccccc1N1CCOCC1)NCc1ccsc1C(F)(F)F	ZINC000875177164	GH	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1ccccc1N1CCOCC1)N1CC2(CCCO2)C1	ZINC000875177165	ED	On-Demand	Anodyne	SCN10A	18	46
Cc1nnc(NNC(=O)NCc2ccccc2N2CCOCC2)n1C	ZINC000875177170	EC	On-Demand	Reactive	SCN10A	15	44
CC(=O)N(C)c1ccc(CNC(=O)NCc2ccccc2N2CCOCC2)cc1	ZINC000875177186	GF	On-Demand	Anodyne	SCN10A	15	43
O=C(NCc1ccccc1N1CCOCC1)NCC1(C(F)(F)F)CCCC1	ZINC000875177187	GG	On-Demand	Anodyne	SCN10A	15	45
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000875177195	FD	On-Demand	Reactive	DRD4	30	52
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000875177195	FD	On-Demand	Reactive	ACHE	38	51
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000875177195	FD	On-Demand	Reactive	AVPR1B	43	35
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000875177195	FD	On-Demand	Reactive	KCNH2	15	44
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000875177195	FD	On-Demand	Reactive	HTR4	43	39
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000875177195	FD	On-Demand	Reactive	LTA4H	33	43
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000875177195	FD	On-Demand	Reactive	HRH3	17	46
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000875177195	FD	On-Demand	Reactive	SIGMAR1	48	50
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000875177195	FD	On-Demand	Reactive	MMP13	32	44
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000875177195	FD	On-Demand	Reactive	CCR3	62	46
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000875177195	FD	On-Demand	Reactive	MMP9	26	44
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000875177195	FD	On-Demand	Reactive	PDK1	41	38
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000875177195	FD	On-Demand	Reactive	MMP1	27	44
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000875177195	FD	On-Demand	Reactive	MCHR1	46	49
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000875177195	FD	On-Demand	Reactive	CACNA1G	28	44
COC(=O)N(C)NC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000875177195	FD	On-Demand	Reactive	CACNA1I	68	46
CC[C@@H](NC(=O)NC1CC(C(=O)OC)C1)c1ccccc1	ZINC000875177197	CE	On-Demand	Anodyne	MME	43	38
CC[C@@H](NC(=O)NC1CC(C(=O)OC)C1)c1ccccc1	ZINC000875177197	CE	On-Demand	Anodyne	TIMP3	41	34
CC[C@@H](NC(=O)NC1CC(C(=O)OC)C1)c1ccccc1	ZINC000875177197	CE	On-Demand	Anodyne	TACR3	51	42
CCOc1ccccc1[C@@H](C)NC(=O)N1CC[C@@]2(CC(C(=O)OC)=NO2)C1	ZINC000875177204	GE	On-Demand	Anodyne	HCN1	57	36
CCOc1ccccc1[C@@H](C)NC(=O)N1CC[C@@]2(CC(C(=O)OC)=NO2)C1	ZINC000875177204	GE	On-Demand	Anodyne	HCN4	47	34
CCOc1ccccc1[C@H](C)NC(=O)N1CC[C@]2(CC(C(=O)OC)=NO2)C1	ZINC000875177205	GE	On-Demand	Anodyne	HCN1	57	36
CCOc1ccccc1[C@H](C)NC(=O)N1CC[C@]2(CC(C(=O)OC)=NO2)C1	ZINC000875177205	GE	On-Demand	Anodyne	HCN4	47	34
CCOc1ccccc1[C@H](C)NC(=O)N1CC[C@@]2(CC(C(=O)OC)=NO2)C1	ZINC000875177206	GE	On-Demand	Anodyne	HCN1	57	36
CCOc1ccccc1[C@H](C)NC(=O)N1CC[C@@]2(CC(C(=O)OC)=NO2)C1	ZINC000875177206	GE	On-Demand	Anodyne	HCN4	47	34
CCOc1ccccc1[C@@H](C)NC(=O)N1CC[C@]2(CC(C(=O)OC)=NO2)C1	ZINC000875177207	GE	On-Demand	Anodyne	HCN1	57	36
CCOc1ccccc1[C@@H](C)NC(=O)N1CC[C@]2(CC(C(=O)OC)=NO2)C1	ZINC000875177207	GE	On-Demand	Anodyne	HCN4	47	34
CCOc1ccccc1[C@H](C)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875177218	ED	On-Demand	Anodyne	GHRHR	41	32
CCOc1ccccc1[C@H](C)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875177218	ED	On-Demand	Anodyne	HCN1	74	40
CCOc1ccccc1[C@H](C)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875177218	ED	On-Demand	Anodyne	HCN4	56	40
CCOc1ccccc1[C@@H](C)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875177219	ED	On-Demand	Anodyne	GHRHR	41	32
CCOc1ccccc1[C@@H](C)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875177219	ED	On-Demand	Anodyne	HCN1	74	40
CCOc1ccccc1[C@@H](C)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875177219	ED	On-Demand	Anodyne	HCN4	56	40
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875177234	FD	On-Demand	Anodyne	BMP1	60	38
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875177234	FD	On-Demand	Anodyne	NOS2	95	36
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875177235	FD	On-Demand	Anodyne	BMP1	60	38
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875177235	FD	On-Demand	Anodyne	NOS2	95	36
CCCOc1ccc([C@@H](C)NC(=O)NN(C)C(=O)OC)cc1	ZINC000875177242	DE	On-Demand	Reactive	ACACA	32	58
CCCOc1ccc([C@@H](C)NC(=O)NN(C)C(=O)OC)cc1	ZINC000875177242	DE	On-Demand	Reactive	ACACB	34	58
CCCOc1ccc([C@H](C)NC(=O)NN(C)C(=O)OC)cc1	ZINC000875177243	DE	On-Demand	Reactive	ACACA	32	58
CCCOc1ccc([C@H](C)NC(=O)NN(C)C(=O)OC)cc1	ZINC000875177243	DE	On-Demand	Reactive	ACACB	34	58
CCOc1ccccc1[C@@H](C)NC(=O)NNc1cccc(C)n1	ZINC000875177244	DG	On-Demand	Reactive	GRM5	15	46
CCOc1ccccc1[C@H](C)NC(=O)NNc1cccc(C)n1	ZINC000875177245	DG	On-Demand	Reactive	GRM5	15	46
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1cc(Cl)ccc1Cl	ZINC000875177250	DG	On-Demand	Anodyne	CACNA1I	46	34
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1cc(Cl)ccc1Cl	ZINC000875177251	DG	On-Demand	Anodyne	CACNA1I	46	34
CCCOc1ccc([C@@H](C)NC(=O)N2CC(CNC(=O)C(F)(F)F)C2)cc1	ZINC000875177255	GF	On-Demand	Anodyne	ACACA	22	47
CCCOc1ccc([C@@H](C)NC(=O)N2CC(CNC(=O)C(F)(F)F)C2)cc1	ZINC000875177255	GF	On-Demand	Anodyne	ACACB	23	47
CCCOc1ccc([C@H](C)NC(=O)N2CC(CNC(=O)C(F)(F)F)C2)cc1	ZINC000875177256	GF	On-Demand	Anodyne	ACACA	22	47
CCCOc1ccc([C@H](C)NC(=O)N2CC(CNC(=O)C(F)(F)F)C2)cc1	ZINC000875177256	GF	On-Demand	Anodyne	ACACB	23	47
COc1ncccc1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875177257	EE	On-Demand	Anodyne	CTSK	18	52
COc1ncccc1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875177257	EE	On-Demand	Anodyne	CAPN2	67	36
COc1ncccc1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875177257	EE	On-Demand	Anodyne	NPR	53	34
COc1ncccc1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875177257	EE	On-Demand	Anodyne	SLC12A5	58	37
CCOc1ccccc1[C@@H](C)NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875177276	DD	On-Demand	Anodyne	HCN1	44	36
CCOc1ccccc1[C@@H](C)NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875177276	DD	On-Demand	Anodyne	HCN4	41	33
N#CCc1ccsc1C(=O)Nc1ccc(N2CCOCC2)cc1C(F)(F)F	ZINC000875177277	GH	On-Demand	Mild	PTK2	15	42
CCCOc1ccc([C@@H](C)NC(=O)N(C)OCC(F)(F)F)cc1	ZINC000875177278	EH	On-Demand	Anodyne	ACACA	30	55
CCCOc1ccc([C@@H](C)NC(=O)N(C)OCC(F)(F)F)cc1	ZINC000875177278	EH	On-Demand	Anodyne	ACACB	31	55
CCCOc1ccc([C@H](C)NC(=O)N(C)OCC(F)(F)F)cc1	ZINC000875177279	EH	On-Demand	Anodyne	ACACA	30	55
CCCOc1ccc([C@H](C)NC(=O)N(C)OCC(F)(F)F)cc1	ZINC000875177279	EH	On-Demand	Anodyne	ACACB	31	55
CCOc1ccccc1[C@@H](C)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875177292	EE	On-Demand	Anodyne	SSTR5	48	34
CCOc1ccccc1[C@@H](C)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875177292	EE	On-Demand	Anodyne	BIRC2	38	40
CCOc1ccccc1[C@@H](C)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875177292	EE	On-Demand	Anodyne	HCN1	62	36
CCOc1ccccc1[C@@H](C)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875177292	EE	On-Demand	Anodyne	HCN4	54	36
CCOc1ccccc1[C@H](C)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875177293	EE	On-Demand	Anodyne	SSTR5	48	34
CCOc1ccccc1[C@H](C)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875177293	EE	On-Demand	Anodyne	BIRC2	38	40
CCOc1ccccc1[C@H](C)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875177293	EE	On-Demand	Anodyne	HCN1	62	36
CCOc1ccccc1[C@H](C)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875177293	EE	On-Demand	Anodyne	HCN4	54	36
CCOc1ccccc1[C@@H](C)NC(=O)N1CCCC[C@H]1CNC(=O)NC	ZINC000875177297	FF	On-Demand	Anodyne	HCN1	61	37
CCOc1ccccc1[C@@H](C)NC(=O)N1CCCC[C@H]1CNC(=O)NC	ZINC000875177297	FF	On-Demand	Anodyne	HCN4	53	37
CCOc1ccccc1[C@H](C)NC(=O)N1CCCC[C@H]1CNC(=O)NC	ZINC000875177298	FF	On-Demand	Anodyne	HCN1	61	37
CCOc1ccccc1[C@H](C)NC(=O)N1CCCC[C@H]1CNC(=O)NC	ZINC000875177298	FF	On-Demand	Anodyne	HCN4	53	37
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC(C)(C)c2ccc(F)cc2)C1	ZINC000875177299	EE	On-Demand	Anodyne	CACNA1G	40	48
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC(C)(C)c2ccc(F)cc2)C1	ZINC000875177300	EE	On-Demand	Anodyne	CACNA1G	40	48
O=C(NCc1ccc(F)cc1F)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875177307	DF	On-Demand	Anodyne	P2RX7	43	41
Cc1nnc(NNC(=O)NCc2ccc(C(C)(C)C)cc2)n1C	ZINC000875177318	DE	On-Demand	Reactive	TRPV1	20	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCOC1	ZINC000875177320	FD	On-Demand	Anodyne	CHRM2	15	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCOC1	ZINC000875177320	FD	On-Demand	Anodyne	DRD2	33	46
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCOC1	ZINC000875177320	FD	On-Demand	Anodyne	DRD4	56	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCOC1	ZINC000875177320	FD	On-Demand	Anodyne	ACHE	64	60
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCOC1	ZINC000875177320	FD	On-Demand	Anodyne	DRD3	26	46
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCOC1	ZINC000875177320	FD	On-Demand	Anodyne	SLC6A3	18	48
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCOC1	ZINC000875177320	FD	On-Demand	Anodyne	KCNH2	15	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCOC1	ZINC000875177320	FD	On-Demand	Anodyne	CHRM3	21	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCOC1	ZINC000875177320	FD	On-Demand	Anodyne	LTA4H	20	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCOC1	ZINC000875177320	FD	On-Demand	Anodyne	SIGMAR1	69	49
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCOC1	ZINC000875177320	FD	On-Demand	Anodyne	BCHE	18	52
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCOC1	ZINC000875177320	FD	On-Demand	Anodyne	CCR3	48	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCOC1	ZINC000875177320	FD	On-Demand	Anodyne	MCHR1	43	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCOC1	ZINC000875177320	FD	On-Demand	Anodyne	CACNA1G	32	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCOC1	ZINC000875177321	FD	On-Demand	Anodyne	CHRM2	15	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCOC1	ZINC000875177321	FD	On-Demand	Anodyne	DRD2	33	46
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCOC1	ZINC000875177321	FD	On-Demand	Anodyne	DRD4	56	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCOC1	ZINC000875177321	FD	On-Demand	Anodyne	ACHE	64	60
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCOC1	ZINC000875177321	FD	On-Demand	Anodyne	DRD3	26	46
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCOC1	ZINC000875177321	FD	On-Demand	Anodyne	SLC6A3	18	48
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCOC1	ZINC000875177321	FD	On-Demand	Anodyne	KCNH2	15	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCOC1	ZINC000875177321	FD	On-Demand	Anodyne	CHRM3	21	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCOC1	ZINC000875177321	FD	On-Demand	Anodyne	LTA4H	20	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCOC1	ZINC000875177321	FD	On-Demand	Anodyne	SIGMAR1	69	49
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCOC1	ZINC000875177321	FD	On-Demand	Anodyne	BCHE	18	52
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCOC1	ZINC000875177321	FD	On-Demand	Anodyne	CCR3	48	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCOC1	ZINC000875177321	FD	On-Demand	Anodyne	MCHR1	43	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCOC1	ZINC000875177321	FD	On-Demand	Anodyne	CACNA1G	32	42
O=C(NCCO)C1CCN(C(=O)NCc2c(F)cccc2Cl)CC1	ZINC000875177326	FD	On-Demand	Anodyne	P2RX7	28	49
O=C(NCCO)C1CCN(C(=O)NCc2c(F)cccc2Cl)CC1	ZINC000875177326	FD	On-Demand	Anodyne	EPHX2	28	54
COC(=O)C1(O)CN(C(=O)NCc2ccc(C(C)(C)C)cc2)C1	ZINC000875177333	DD	On-Demand	Anodyne	TRPV1	32	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2ccc(OC)cc2)C1	ZINC000875177338	EF	On-Demand	Anodyne	MMP13	17	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2ccc(OC)cc2)C1	ZINC000875177338	EF	On-Demand	Anodyne	MMP9	17	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2ccc(OC)cc2)C1	ZINC000875177338	EF	On-Demand	Anodyne	MMP1	20	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2ccc(OC)cc2)C1	ZINC000875177339	EF	On-Demand	Anodyne	MMP13	17	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2ccc(OC)cc2)C1	ZINC000875177339	EF	On-Demand	Anodyne	MMP9	17	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2ccc(OC)cc2)C1	ZINC000875177339	EF	On-Demand	Anodyne	MMP1	20	43
O=C(NCc1ccc(F)cc1F)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875177344	EG	On-Demand	Anodyne	EPHX2	24	55
O=C(NCc1ccc(F)cc1F)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875177344	EG	On-Demand	Anodyne	NPSR1	25	40
O=C(NCc1ccc(F)cc1F)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875177345	EG	On-Demand	Anodyne	EPHX2	24	55
O=C(NCc1ccc(F)cc1F)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875177345	EG	On-Demand	Anodyne	NPSR1	25	40
O=C(NCCO)C1CCN(C(=O)NCc2ccc(F)cc2F)CC1	ZINC000875177349	EC	On-Demand	Anodyne	HTR2A	17	40
O=C(NCCO)C1CCN(C(=O)NCc2ccc(F)cc2F)CC1	ZINC000875177349	EC	On-Demand	Anodyne	P2RX7	43	40
O=C(NCCO)C1CCN(C(=O)NCc2ccc(F)cc2F)CC1	ZINC000875177349	EC	On-Demand	Anodyne	EPHX2	30	55
COC(=O)N(C)NC(=O)N[C@H](C)c1ccc(OC)cc1	ZINC000875177353	CD	On-Demand	Reactive	ACACA	25	42
COC(=O)N(C)NC(=O)N[C@H](C)c1ccc(OC)cc1	ZINC000875177353	CD	On-Demand	Reactive	ACACB	26	45
COC(=O)N(C)NC(=O)N[C@@H](C)c1ccc(OC)cc1	ZINC000875177354	CD	On-Demand	Reactive	ACACA	25	42
COC(=O)N(C)NC(=O)N[C@@H](C)c1ccc(OC)cc1	ZINC000875177354	CD	On-Demand	Reactive	ACACB	26	45
Cc1nnc(NNC(=O)NCc2ccc(F)cc2F)n1C	ZINC000875177363	CD	On-Demand	Reactive	P2RX7	60	44
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(F)cc1F	ZINC000875177397	FE	On-Demand	Anodyne	P2RX7	44	39
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(F)cc1F	ZINC000875177397	FE	On-Demand	Anodyne	ACKR3	60	36
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)N[C@H]3CCOC3)C2)c1	ZINC000875177398	FC	On-Demand	Anodyne	DRD4	40	44
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)N[C@H]3CCOC3)C2)c1	ZINC000875177398	FC	On-Demand	Anodyne	CCR3	29	42
CCOc1ccccc1[C@@H](C)NC(=O)N1CCCC[C@@H]1CNC(=O)NC	ZINC000875177399	FF	On-Demand	Anodyne	HCN1	61	37
CCOc1ccccc1[C@@H](C)NC(=O)N1CCCC[C@@H]1CNC(=O)NC	ZINC000875177399	FF	On-Demand	Anodyne	HCN4	53	37
CCOc1ccccc1[C@H](C)NC(=O)N1CCCC[C@@H]1CNC(=O)NC	ZINC000875177400	FF	On-Demand	Anodyne	HCN1	61	37
CCOc1ccccc1[C@H](C)NC(=O)N1CCCC[C@@H]1CNC(=O)NC	ZINC000875177400	FF	On-Demand	Anodyne	HCN4	53	37
CCCOc1ccc([C@@H](C)NC(=O)NNc2nnc(C)n2C)cc1	ZINC000875177405	EE	On-Demand	Reactive	ACACA	26	48
CCCOc1ccc([C@@H](C)NC(=O)NNc2nnc(C)n2C)cc1	ZINC000875177405	EE	On-Demand	Reactive	ACACB	27	48
CCCOc1ccc([C@H](C)NC(=O)NNc2nnc(C)n2C)cc1	ZINC000875177406	EE	On-Demand	Reactive	ACACA	26	48
CCCOc1ccc([C@H](C)NC(=O)NNc2nnc(C)n2C)cc1	ZINC000875177406	EE	On-Demand	Reactive	ACACB	27	48
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)NC1(C)CC(F)(F)C1	ZINC000875177420	EG	On-Demand	Anodyne	BMP1	52	37
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)NC1(C)CC(F)(F)C1	ZINC000875177420	EG	On-Demand	Anodyne	NOS2	49	33
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)NC1(C)CC(F)(F)C1	ZINC000875177421	EG	On-Demand	Anodyne	BMP1	52	37
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)NC1(C)CC(F)(F)C1	ZINC000875177421	EG	On-Demand	Anodyne	NOS2	49	33
CCCOc1ccc([C@H](C)NC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)cc1	ZINC000875177435	GF	On-Demand	Anodyne	ACACA	25	51
CCCOc1ccc([C@H](C)NC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)cc1	ZINC000875177435	GF	On-Demand	Anodyne	ACACB	28	51
CCCOc1ccc([C@@H](C)NC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)cc1	ZINC000875177436	GF	On-Demand	Anodyne	ACACA	25	51
CCCOc1ccc([C@@H](C)NC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)cc1	ZINC000875177436	GF	On-Demand	Anodyne	ACACB	28	51
CCOc1ccccc1[C@H](C)NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875177437	FH	On-Demand	Anodyne	HCN1	81	42
CCOc1ccccc1[C@H](C)NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875177437	FH	On-Demand	Anodyne	HCN4	55	40
CCOc1ccccc1[C@@H](C)NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875177438	FH	On-Demand	Anodyne	HCN1	81	42
CCOc1ccccc1[C@@H](C)NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875177438	FH	On-Demand	Anodyne	HCN4	55	40
COc1ncccc1NC(=O)C1(C)CC(F)(F)C1	ZINC000875177443	CE	On-Demand	Anodyne	P2RY1	40	39
COc1ncccc1NC(=O)C1(C)CC(F)(F)C1	ZINC000875177443	CE	On-Demand	Anodyne	G2YM83_BOTF4	66	34
CCOc1ccccc1[C@@H](C)NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875177448	EG	On-Demand	Anodyne	HCN1	40	34
CCOc1ccccc1[C@H](C)NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875177449	EG	On-Demand	Anodyne	HCN1	40	34
CCCOc1ccc([C@@H](C)NC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875177450	EG	On-Demand	Anodyne	ACACA	27	53
CCCOc1ccc([C@@H](C)NC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875177450	EG	On-Demand	Anodyne	ACACB	28	53
CCCOc1ccc([C@H](C)NC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875177451	EG	On-Demand	Anodyne	ACACA	27	53
CCCOc1ccc([C@H](C)NC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875177451	EG	On-Demand	Anodyne	ACACB	28	53
CCCOc1ccc([C@H](C)NC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875177452	EG	On-Demand	Anodyne	ACACA	27	53
CCCOc1ccc([C@H](C)NC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875177452	EG	On-Demand	Anodyne	ACACB	28	53
CCCOc1ccc([C@@H](C)NC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875177453	EG	On-Demand	Anodyne	ACACA	27	53
CCCOc1ccc([C@@H](C)NC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875177453	EG	On-Demand	Anodyne	ACACB	28	53
CCOc1ccccc1[C@H](C)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875177454	CE	On-Demand	Anodyne	HCN1	50	35
CCOc1ccccc1[C@H](C)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875177454	CE	On-Demand	Anodyne	HCN4	42	35
CCOc1ccccc1[C@@H](C)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875177455	CE	On-Demand	Anodyne	HCN1	50	35
CCOc1ccccc1[C@@H](C)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875177455	CE	On-Demand	Anodyne	HCN4	42	35
CCOc1ccccc1[C@@H](C)NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875177456	EF	On-Demand	Anodyne	SLC6A4	29	43
CCOc1ccccc1[C@@H](C)NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875177456	EF	On-Demand	Anodyne	SLC6A3	63	43
CCOc1ccccc1[C@H](C)NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875177457	EF	On-Demand	Anodyne	SLC6A4	29	43
CCOc1ccccc1[C@H](C)NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875177457	EF	On-Demand	Anodyne	SLC6A3	63	43
CCOc1ccccc1[C@H](C)NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875177458	EF	On-Demand	Anodyne	SLC6A4	29	43
CCOc1ccccc1[C@H](C)NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875177458	EF	On-Demand	Anodyne	SLC6A3	63	43
CCOc1ccccc1[C@@H](C)NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875177459	EF	On-Demand	Anodyne	SLC6A4	29	43
CCOc1ccccc1[C@@H](C)NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875177459	EF	On-Demand	Anodyne	SLC6A3	63	43
CCOc1ccccc1[C@H](C)NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875177475	FD	On-Demand	Anodyne	HCN1	51	35
CCOc1ccccc1[C@H](C)NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875177475	FD	On-Demand	Anodyne	HCN4	44	35
CCOc1ccccc1[C@@H](C)NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875177476	FD	On-Demand	Anodyne	HCN1	51	35
CCOc1ccccc1[C@@H](C)NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875177476	FD	On-Demand	Anodyne	HCN4	44	35
O=C(/C=C/c1ccc(O)cc1)Nc1ccc(Cl)c2cccnc12	ZINC000875177477	DI	On-Demand	Anodyne	MMP2	15	58
O=C(/C=C/c1ccc(O)cc1)Nc1ccc(Cl)c2cccnc12	ZINC000875177477	DI	On-Demand	Anodyne	MMP9	15	58
O=C(/C=C\c1ccc(O)cc1)Nc1ccc(Cl)c2cccnc12	ZINC000875177478	DI	On-Demand	Anodyne	MMP2	15	58
O=C(/C=C\c1ccc(O)cc1)Nc1ccc(Cl)c2cccnc12	ZINC000875177478	DI	On-Demand	Anodyne	MMP9	15	58
CCOc1ccccc1[C@@H](C)NC(=O)N1CC(O)(C(=O)OC)C1	ZINC000875177484	DD	On-Demand	Anodyne	HCN1	60	37
CCOc1ccccc1[C@@H](C)NC(=O)N1CC(O)(C(=O)OC)C1	ZINC000875177484	DD	On-Demand	Anodyne	HCN4	51	37
CCOc1ccccc1[C@H](C)NC(=O)N1CC(O)(C(=O)OC)C1	ZINC000875177485	DD	On-Demand	Anodyne	HCN1	60	37
CCOc1ccccc1[C@H](C)NC(=O)N1CC(O)(C(=O)OC)C1	ZINC000875177485	DD	On-Demand	Anodyne	HCN4	51	37
O=C(NCc1cccc2ccccc12)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875177498	FF	On-Demand	Anodyne	KCNJ11	59	31
O=C(NCc1cccc2ccccc12)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875177498	FF	On-Demand	Anodyne	P2RX7	30	42
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)N[C@@H]3CCOC3)C2)c1	ZINC000875177499	FC	On-Demand	Anodyne	DRD4	40	44
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)N[C@@H]3CCOC3)C2)c1	ZINC000875177499	FC	On-Demand	Anodyne	CCR3	29	42
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)N[C@H]3CCOC3)C2)c1	ZINC000875177500	FC	On-Demand	Anodyne	DRD4	40	44
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)N[C@H]3CCOC3)C2)c1	ZINC000875177500	FC	On-Demand	Anodyne	CCR3	29	42
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)N[C@@H]3CCOC3)C2)c1	ZINC000875177501	FC	On-Demand	Anodyne	DRD4	40	44
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)N[C@@H]3CCOC3)C2)c1	ZINC000875177501	FC	On-Demand	Anodyne	CCR3	29	42
CCC[C@H](NC(=O)C(=O)N1CCC(C)(N2CCCCC2)CC1)c1ccccn1	ZINC000875177509	GF	On-Demand	Anodyne	CCR5	25	41
CCC[C@@H](NC(=O)C(=O)N1CCC(C)(N2CCCCC2)CC1)c1ccccn1	ZINC000875177510	GF	On-Demand	Anodyne	CCR5	25	41
O=C(NCC[C@H](O)C1CCCC1)NCc1ccc(F)cc1F	ZINC000875177511	DF	On-Demand	Anodyne	P2RX7	43	38
O=C(NCC[C@@H](O)C1CCCC1)NCc1ccc(F)cc1F	ZINC000875177512	DF	On-Demand	Anodyne	P2RX7	43	38
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2c(F)cccc2Cl)C1	ZINC000875177523	EF	On-Demand	Anodyne	P2RX7	21	47
CCC[C@@H](NC(=O)C(=O)NCC[C@H]1CCSC1)c1ccccn1	ZINC000875177527	EE	On-Demand	Anodyne	SIRT3	40	32
CCC[C@@H](NC(=O)C(=O)NCC[C@H]1CCSC1)c1ccccn1	ZINC000875177527	EE	On-Demand	Anodyne	SIRT2	44	32
CCC[C@@H](NC(=O)C(=O)NCC[C@H]1CCSC1)c1ccccn1	ZINC000875177527	EE	On-Demand	Anodyne	SIRT1	40	32
CCC[C@H](NC(=O)C(=O)NCC[C@@H]1CCSC1)c1ccccn1	ZINC000875177528	EE	On-Demand	Anodyne	SIRT3	40	32
CCC[C@H](NC(=O)C(=O)NCC[C@@H]1CCSC1)c1ccccn1	ZINC000875177528	EE	On-Demand	Anodyne	SIRT2	44	32
CCC[C@H](NC(=O)C(=O)NCC[C@@H]1CCSC1)c1ccccn1	ZINC000875177528	EE	On-Demand	Anodyne	SIRT1	40	32
CCC[C@@H](NC(=O)C(=O)NCC[C@@H]1CCSC1)c1ccccn1	ZINC000875177529	EE	On-Demand	Anodyne	SIRT3	40	32
CCC[C@@H](NC(=O)C(=O)NCC[C@@H]1CCSC1)c1ccccn1	ZINC000875177529	EE	On-Demand	Anodyne	SIRT2	44	32
CCC[C@@H](NC(=O)C(=O)NCC[C@@H]1CCSC1)c1ccccn1	ZINC000875177529	EE	On-Demand	Anodyne	SIRT1	40	32
CCC[C@H](NC(=O)C(=O)NCC[C@H]1CCSC1)c1ccccn1	ZINC000875177530	EE	On-Demand	Anodyne	SIRT3	40	32
CCC[C@H](NC(=O)C(=O)NCC[C@H]1CCSC1)c1ccccn1	ZINC000875177530	EE	On-Demand	Anodyne	SIRT2	44	32
CCC[C@H](NC(=O)C(=O)NCC[C@H]1CCSC1)c1ccccn1	ZINC000875177530	EE	On-Demand	Anodyne	SIRT1	40	32
CCC[C@H](NC(=O)C(=O)NCCC1CCN(C(C)C)CC1)c1ccccn1	ZINC000875177573	FF	On-Demand	Anodyne	SIRT3	55	35
CCC[C@H](NC(=O)C(=O)NCCC1CCN(C(C)C)CC1)c1ccccn1	ZINC000875177573	FF	On-Demand	Anodyne	SIRT2	56	35
CCC[C@H](NC(=O)C(=O)NCCC1CCN(C(C)C)CC1)c1ccccn1	ZINC000875177573	FF	On-Demand	Anodyne	SIRT1	55	35
CCC[C@@H](NC(=O)C(=O)NCCC1CCN(C(C)C)CC1)c1ccccn1	ZINC000875177574	FF	On-Demand	Anodyne	SIRT3	55	35
CCC[C@@H](NC(=O)C(=O)NCCC1CCN(C(C)C)CC1)c1ccccn1	ZINC000875177574	FF	On-Demand	Anodyne	SIRT2	56	35
CCC[C@@H](NC(=O)C(=O)NCCC1CCN(C(C)C)CC1)c1ccccn1	ZINC000875177574	FF	On-Demand	Anodyne	SIRT1	55	35
CCCCCCCNC(=O)C(=O)NCC1CCN(C(C)=O)CC1	ZINC000875177575	ED	On-Demand	Mild	EPHX2	20	48
CCCCCCCNC(=O)C(=O)NCC1CCN(C(C)=O)CC1	ZINC000875177575	ED	On-Demand	Mild	ASAH1	80	37
CCCCCCCNC(=O)C(=O)NCC1(N2CCCC2)CCOCC1	ZINC000875177604	FD	On-Demand	Mild	HCN1	43	37
CCCOc1ccc([C@H](C)NC(=O)N(CCOC)C2CCOCC2)cc1	ZINC000875177622	FG	On-Demand	Anodyne	ACACA	26	52
CCCOc1ccc([C@H](C)NC(=O)N(CCOC)C2CCOCC2)cc1	ZINC000875177622	FG	On-Demand	Anodyne	ACACB	26	52
CCCOc1ccc([C@@H](C)NC(=O)N(CCOC)C2CCOCC2)cc1	ZINC000875177623	FG	On-Demand	Anodyne	ACACA	26	52
CCCOc1ccc([C@@H](C)NC(=O)N(CCOC)C2CCOCC2)cc1	ZINC000875177623	FG	On-Demand	Anodyne	ACACB	26	52
O=C(NCc1cccc2ccccc12)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875177628	EH	On-Demand	Anodyne	P2RX7	15	47
O=C(N[C@H]1CCN(CC2CC2)C1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875177643	FD	On-Demand	Anodyne	OXTR	44	35
O=C(N[C@H]1CCN(CC2CC2)C1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875177643	FD	On-Demand	Anodyne	SIGMAR1	20	47
O=C(N[C@@H]1CCN(CC2CC2)C1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875177644	FD	On-Demand	Anodyne	OXTR	44	35
O=C(N[C@@H]1CCN(CC2CC2)C1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875177644	FD	On-Demand	Anodyne	SIGMAR1	20	47
O=C(N[C@H]1CCN(CC2CC2)C1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875177645	FD	On-Demand	Anodyne	OXTR	44	35
O=C(N[C@H]1CCN(CC2CC2)C1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875177645	FD	On-Demand	Anodyne	SIGMAR1	20	47
O=C(N[C@@H]1CCN(CC2CC2)C1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875177646	FD	On-Demand	Anodyne	OXTR	44	35
O=C(N[C@@H]1CCN(CC2CC2)C1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875177646	FD	On-Demand	Anodyne	SIGMAR1	20	47
CCOc1ccccc1[C@@H](C)NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1	ZINC000875177652	GF	On-Demand	Anodyne	HCN1	48	34
CCOc1ccccc1[C@@H](C)NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1	ZINC000875177652	GF	On-Demand	Anodyne	HCN4	40	34
CCOc1ccccc1[C@H](C)NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1	ZINC000875177653	GF	On-Demand	Anodyne	HCN1	48	34
CCOc1ccccc1[C@H](C)NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1	ZINC000875177653	GF	On-Demand	Anodyne	HCN4	40	34
CCCOc1ccc([C@@H](C)NC(=O)N(CC)OCC)cc1	ZINC000875177654	CH	On-Demand	Anodyne	ACACA	33	59
CCCOc1ccc([C@@H](C)NC(=O)N(CC)OCC)cc1	ZINC000875177654	CH	On-Demand	Anodyne	ACACB	34	59
CCCOc1ccc([C@H](C)NC(=O)N(CC)OCC)cc1	ZINC000875177655	CH	On-Demand	Anodyne	ACACA	33	59
CCCOc1ccc([C@H](C)NC(=O)N(CC)OCC)cc1	ZINC000875177655	CH	On-Demand	Anodyne	ACACB	34	59
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CCCN(C=O)CC1	ZINC000875177688	ED	On-Demand	Anodyne	BMP1	51	38
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CCCN(C=O)CC1	ZINC000875177688	ED	On-Demand	Anodyne	NOS2	95	36
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CCCN(C=O)CC1	ZINC000875177688	ED	On-Demand	Anodyne	Q6PRC7_IXORI	46	33
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CCCN(C=O)CC1	ZINC000875177689	ED	On-Demand	Anodyne	BMP1	51	38
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CCCN(C=O)CC1	ZINC000875177689	ED	On-Demand	Anodyne	NOS2	95	36
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CCCN(C=O)CC1	ZINC000875177689	ED	On-Demand	Anodyne	Q6PRC7_IXORI	46	33
O=C(NC[C@H]1C[C@H](O)C1)NC(Cc1ccccc1)Cc1ccccc1	ZINC000875177690	EF	On-Demand	Anodyne	MME	97	44
O=C(NC[C@H]1C[C@H](O)C1)NC(Cc1ccccc1)Cc1ccccc1	ZINC000875177690	EF	On-Demand	Anodyne	ANPEP	47	38
O=C(NC[C@H]1C[C@H](O)C1)NC(Cc1ccccc1)Cc1ccccc1	ZINC000875177690	EF	On-Demand	Anodyne	FCER2	40	34
O=C(NC[C@H]1C[C@H](O)C1)NC(Cc1ccccc1)Cc1ccccc1	ZINC000875177690	EF	On-Demand	Anodyne	CPA1	44	37
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875177723	ED	On-Demand	Anodyne	BMP1	42	35
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875177723	ED	On-Demand	Anodyne	NOS2	57	34
CCCCCCCNC(=O)C(=O)N[C@H]1CCN(CC2CC2)C1	ZINC000875177739	DD	On-Demand	Mild	ASAH1	76	43
CCCCCCCNC(=O)C(=O)N[C@@H]1CCN(CC2CC2)C1	ZINC000875177741	DD	On-Demand	Mild	ASAH1	76	43
C#CC[C@@H](COC)NC(=O)C(=O)NCC(C)(C)c1ccc(F)cc1	ZINC000875177742	ED	On-Demand	Mild	CACNA1G	20	40
C#CC[C@H](COC)NC(=O)C(=O)NCC(C)(C)c1ccc(F)cc1	ZINC000875177744	ED	On-Demand	Mild	CACNA1G	20	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2ccccc2OCC)C1	ZINC000875177745	EF	On-Demand	Anodyne	HCN1	48	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2ccccc2OCC)C1	ZINC000875177745	EF	On-Demand	Anodyne	HCN4	40	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2ccccc2OCC)C1	ZINC000875177749	EF	On-Demand	Anodyne	HCN1	48	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2ccccc2OCC)C1	ZINC000875177749	EF	On-Demand	Anodyne	HCN4	40	34
CCCOc1ccc([C@H](C)NC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875177752	EH	On-Demand	Clean	ACACA	27	49
CCCOc1ccc([C@H](C)NC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875177752	EH	On-Demand	Clean	ACACB	28	49
CCCOc1ccc([C@@H](C)NC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875177760	EH	On-Demand	Clean	ACACA	27	49
CCCOc1ccc([C@@H](C)NC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875177760	EH	On-Demand	Clean	ACACB	28	49
O=C(NCc1ccc(F)cc1F)N1CCC[C@H](OC2CCC2)CC1	ZINC000875177765	EH	On-Demand	Anodyne	HTR2A	16	40
O=C(NCc1ccc(F)cc1F)N1CCC[C@H](OC2CCC2)CC1	ZINC000875177765	EH	On-Demand	Anodyne	P2RX7	34	41
O=C(NCc1ccc(F)cc1F)N1CCC[C@H](OC2CCC2)CC1	ZINC000875177765	EH	On-Demand	Anodyne	EPHX2	27	58
O=C(NCc1ccc(F)cc1F)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875177767	EH	On-Demand	Anodyne	HTR2A	16	40
O=C(NCc1ccc(F)cc1F)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875177767	EH	On-Demand	Anodyne	P2RX7	34	41
O=C(NCc1ccc(F)cc1F)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875177767	EH	On-Demand	Anodyne	EPHX2	27	58
O=C(NCCO)C1CCN(C(=O)NCc2cccc(Cl)c2Cl)CC1	ZINC000875177799	FE	On-Demand	Anodyne	P2RX7	59	48
O=C(NCCO)C1CCN(C(=O)NCc2cccc(Cl)c2Cl)CC1	ZINC000875177799	FE	On-Demand	Anodyne	EPHX2	32	56
CCCOc1ccc([C@@H](C)NC(=O)N2CC(O)(C(=O)OC)C2)cc1	ZINC000875177810	ED	On-Demand	Anodyne	ACACA	29	53
CCCOc1ccc([C@@H](C)NC(=O)N2CC(O)(C(=O)OC)C2)cc1	ZINC000875177810	ED	On-Demand	Anodyne	ACACB	30	53
CCCOc1ccc([C@H](C)NC(=O)N2CC(O)(C(=O)OC)C2)cc1	ZINC000875177812	ED	On-Demand	Anodyne	ACACA	29	53
CCCOc1ccc([C@H](C)NC(=O)N2CC(O)(C(=O)OC)C2)cc1	ZINC000875177812	ED	On-Demand	Anodyne	ACACB	30	53
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(OC)cc1	ZINC000875177824	EE	On-Demand	Anodyne	SLC6A4	29	47
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(OC)cc1	ZINC000875177824	EE	On-Demand	Anodyne	SLC6A3	57	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(OC)cc1	ZINC000875177826	EE	On-Demand	Anodyne	SLC6A4	29	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(OC)cc1	ZINC000875177826	EE	On-Demand	Anodyne	SLC6A3	57	47
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(OC)cc1	ZINC000875177829	EE	On-Demand	Anodyne	SLC6A4	29	47
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(OC)cc1	ZINC000875177829	EE	On-Demand	Anodyne	SLC6A3	57	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(OC)cc1	ZINC000875177830	EE	On-Demand	Anodyne	SLC6A4	29	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(OC)cc1	ZINC000875177830	EE	On-Demand	Anodyne	SLC6A3	57	47
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCCCC#N)CC2	ZINC000875177842	FD	On-Demand	Mild	SLC18A2	51	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCCCC#N)CC2	ZINC000875177846	FD	On-Demand	Mild	SLC18A2	51	36
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875177873	GD	On-Demand	Anodyne	NOS2	93	36
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875177873	GD	On-Demand	Anodyne	MCHR1	35	50
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875177874	GD	On-Demand	Anodyne	NOS2	93	36
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875177874	GD	On-Demand	Anodyne	MCHR1	35	50
CCCOc1ccc([C@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)cc1	ZINC000875177877	GE	On-Demand	Anodyne	ACACA	24	57
CCCOc1ccc([C@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)cc1	ZINC000875177877	GE	On-Demand	Anodyne	ACACB	25	57
CCCOc1ccc([C@@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)cc1	ZINC000875177878	GE	On-Demand	Anodyne	ACACA	24	57
CCCOc1ccc([C@@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)cc1	ZINC000875177878	GE	On-Demand	Anodyne	ACACB	25	57
CCOc1ccccc1[C@@H](C)NC(=O)NCCN1CCOC[C@@H]1CC	ZINC000875177880	EF	On-Demand	Anodyne	HCN1	50	38
CCOc1ccccc1[C@@H](C)NC(=O)NCCN1CCOC[C@@H]1CC	ZINC000875177880	EF	On-Demand	Anodyne	HCN4	41	34
CCOc1ccccc1[C@H](C)NC(=O)NCCN1CCOC[C@@H]1CC	ZINC000875177881	EF	On-Demand	Anodyne	HCN1	50	38
CCOc1ccccc1[C@H](C)NC(=O)NCCN1CCOC[C@@H]1CC	ZINC000875177881	EF	On-Demand	Anodyne	HCN4	41	34
CCOc1ccccc1[C@@H](C)NC(=O)NCCN1CCOC[C@H]1CC	ZINC000875177882	EF	On-Demand	Anodyne	HCN1	50	38
CCOc1ccccc1[C@@H](C)NC(=O)NCCN1CCOC[C@H]1CC	ZINC000875177882	EF	On-Demand	Anodyne	HCN4	41	34
CCOc1ccccc1[C@H](C)NC(=O)NCCN1CCOC[C@H]1CC	ZINC000875177883	EF	On-Demand	Anodyne	HCN1	50	38
CCOc1ccccc1[C@H](C)NC(=O)NCCN1CCOC[C@H]1CC	ZINC000875177883	EF	On-Demand	Anodyne	HCN4	41	34
CCOc1ccccc1[C@H](C)NC(=O)N(CCOC)CC1CCN(C)CC1	ZINC000875177888	GG	On-Demand	Anodyne	HCN1	55	35
CCOc1ccccc1[C@H](C)NC(=O)N(CCOC)CC1CCN(C)CC1	ZINC000875177888	GG	On-Demand	Anodyne	HCN4	42	33
CCOc1ccccc1[C@@H](C)NC(=O)N(CCOC)CC1CCN(C)CC1	ZINC000875177889	GG	On-Demand	Anodyne	HCN1	55	35
CCOc1ccccc1[C@@H](C)NC(=O)N(CCOC)CC1CCN(C)CC1	ZINC000875177889	GG	On-Demand	Anodyne	HCN4	42	33
COC(=O)C1(O)CN(C(=O)NCc2cccc3ccccc23)C1	ZINC000875177894	DD	On-Demand	Anodyne	Q6PRC7_IXORI	40	34
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)N(C)OCC(F)(F)F	ZINC000875177935	EF	On-Demand	Anodyne	EDNRB	43	35
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)N(C)OCC(F)(F)F	ZINC000875177935	EF	On-Demand	Anodyne	BMP1	58	37
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)N(C)OCC(F)(F)F	ZINC000875177935	EF	On-Demand	Anodyne	NOS2	72	33
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N(C)OCC(F)(F)F	ZINC000875177937	EF	On-Demand	Anodyne	EDNRB	43	35
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N(C)OCC(F)(F)F	ZINC000875177937	EF	On-Demand	Anodyne	BMP1	58	37
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N(C)OCC(F)(F)F	ZINC000875177937	EF	On-Demand	Anodyne	NOS2	72	33
COc1ccccc1[C@@H]1CN(C(=O)C(=O)N[C@@H]2CCN(CC3CC3)C2)CCO1	ZINC000875177939	GD	On-Demand	Anodyne	DRD4	18	41
COc1ccccc1[C@@H]1CN(C(=O)C(=O)N[C@H]2CCN(CC3CC3)C2)CCO1	ZINC000875177941	GD	On-Demand	Anodyne	DRD4	18	41
COc1ccccc1[C@H]1CN(C(=O)C(=O)N[C@H]2CCN(CC3CC3)C2)CCO1	ZINC000875177943	GD	On-Demand	Anodyne	DRD4	18	41
COc1ccccc1[C@H]1CN(C(=O)C(=O)N[C@@H]2CCN(CC3CC3)C2)CCO1	ZINC000875177944	GD	On-Demand	Anodyne	DRD4	18	41
O=C(N[C@@H]1CCOC1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875177956	EC	On-Demand	Anodyne	ETHR	54	48
O=CN1CCCN(C(=O)NC(Cc2ccccc2)Cc2ccccc2)CC1	ZINC000875177965	FF	On-Demand	Anodyne	ACE	44	44
O=CN1CCCN(C(=O)NC(Cc2ccccc2)Cc2ccccc2)CC1	ZINC000875177965	FF	On-Demand	Anodyne	MME	80	44
O=CN1CCCN(C(=O)NC(Cc2ccccc2)Cc2ccccc2)CC1	ZINC000875177965	FF	On-Demand	Anodyne	CYSP_TRYCR	15	40
O=CN1CCCN(C(=O)NC(Cc2ccccc2)Cc2ccccc2)CC1	ZINC000875177965	FF	On-Demand	Anodyne	PREP	21	44
O=CN1CCCN(C(=O)NC(Cc2ccccc2)Cc2ccccc2)CC1	ZINC000875177965	FF	On-Demand	Anodyne	CAPN1	61	39
O=CN1CCCN(C(=O)NC(Cc2ccccc2)Cc2ccccc2)CC1	ZINC000875177965	FF	On-Demand	Anodyne	CAPN2	46	32
O=CN1CCCN(C(=O)NC(Cc2ccccc2)Cc2ccccc2)CC1	ZINC000875177965	FF	On-Demand	Anodyne	ACE2	43	31
O=CN1CCCN(C(=O)NC(Cc2ccccc2)Cc2ccccc2)CC1	ZINC000875177965	FF	On-Demand	Anodyne	DPP7	41	40
O=CN1CCCN(C(=O)NC(Cc2ccccc2)Cc2ccccc2)CC1	ZINC000875177965	FF	On-Demand	Anodyne	Q6PRC7_IXORI	47	37
CCOc1ccccc1[C@@H](C)NC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875177967	FH	On-Demand	Anodyne	HCN1	48	35
CCOc1ccccc1[C@@H](C)NC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875177967	FH	On-Demand	Anodyne	HCN4	40	32
CCOc1ccccc1[C@@H](C)NC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875177968	FH	On-Demand	Anodyne	HCN1	48	35
CCOc1ccccc1[C@@H](C)NC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875177968	FH	On-Demand	Anodyne	HCN4	40	32
O=C(N[C@H]1CCOC1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875177969	EC	On-Demand	Anodyne	ETHR	54	48
CCOc1ccccc1[C@H](C)NC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875177970	FH	On-Demand	Anodyne	HCN1	48	35
CCOc1ccccc1[C@H](C)NC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875177970	FH	On-Demand	Anodyne	HCN4	40	32
CCOc1ccccc1[C@H](C)NC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875177972	FH	On-Demand	Anodyne	HCN1	48	35
CCOc1ccccc1[C@H](C)NC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875177972	FH	On-Demand	Anodyne	HCN4	40	32
CC[C@]1(C(=O)Nc2ccccc2COCc2ccccc2)CCNC1=O	ZINC000875177977	FG	On-Demand	Anodyne	TIMP3	55	30
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)CCc1ccc2c(c1)OCO2	ZINC000875178008	FE	On-Demand	Anodyne	BMP1	62	35
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)CCc1ccc2c(c1)OCO2	ZINC000875178008	FE	On-Demand	Anodyne	NOS2	88	34
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)CCc1ccc2c(c1)OCO2	ZINC000875178009	FE	On-Demand	Anodyne	BMP1	62	35
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)CCc1ccc2c(c1)OCO2	ZINC000875178009	FE	On-Demand	Anodyne	NOS2	88	34
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)CCc1ccc2c(c1)OCO2	ZINC000875178011	FE	On-Demand	Anodyne	BMP1	62	35
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)CCc1ccc2c(c1)OCO2	ZINC000875178011	FE	On-Demand	Anodyne	NOS2	88	34
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)CCc1ccc2c(c1)OCO2	ZINC000875178013	FE	On-Demand	Anodyne	BMP1	62	35
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)CCc1ccc2c(c1)OCO2	ZINC000875178013	FE	On-Demand	Anodyne	NOS2	88	34
CCCOc1ccc([C@H](C)NC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875178025	FE	On-Demand	Anodyne	ACACA	29	51
CCCOc1ccc([C@H](C)NC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875178025	FE	On-Demand	Anodyne	ACACB	31	51
CCCOc1ccc([C@H](C)NC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875178025	FE	On-Demand	Anodyne	PLA2G4B	50	32
CCCOc1ccc([C@@H](C)NC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875178027	FE	On-Demand	Anodyne	ACACA	29	51
CCCOc1ccc([C@@H](C)NC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875178027	FE	On-Demand	Anodyne	ACACB	31	51
CCCOc1ccc([C@@H](C)NC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875178027	FE	On-Demand	Anodyne	PLA2G4B	50	32
O=CN1CCCN(C(=O)NCc2cccc(Cl)c2Cl)CC1	ZINC000875178030	EE	On-Demand	Anodyne	P2RX7	36	43
O=CN1CCCN(C(=O)NCc2cccc(Cl)c2Cl)CC1	ZINC000875178030	EE	On-Demand	Anodyne	DPP7	22	41
COC(=O)N(C)NC(=O)NCc1ccc(C(C)(C)C)cc1	ZINC000875178053	CE	On-Demand	Reactive	TRPV1	40	50
COC(=O)N(C)NC(=O)NCc1ccc(C(C)(C)C)cc1	ZINC000875178053	CE	On-Demand	Reactive	MT-ND1	31	43
N#Cc1cc(F)ccc1N1CCN(C(=O)C(=O)N[C@@H]2CCN(CC3CC3)C2)CC1	ZINC000875178063	GC	On-Demand	Mild	CCR3	38	40
N#Cc1cc(F)ccc1N1CCN(C(=O)C(=O)N[C@H]2CCN(CC3CC3)C2)CC1	ZINC000875178065	GC	On-Demand	Mild	CCR3	38	40
CCOc1ccccc1[C@@H](C)NC(=O)NC1(C)CC(F)(F)C1	ZINC000875178067	DH	On-Demand	Anodyne	HCN1	50	35
CCOc1ccccc1[C@@H](C)NC(=O)NC1(C)CC(F)(F)C1	ZINC000875178067	DH	On-Demand	Anodyne	HCN4	41	35
CCOc1ccccc1[C@H](C)NC(=O)NC1(C)CC(F)(F)C1	ZINC000875178069	DH	On-Demand	Anodyne	HCN1	50	35
CCOc1ccccc1[C@H](C)NC(=O)NC1(C)CC(F)(F)C1	ZINC000875178069	DH	On-Demand	Anodyne	HCN4	41	35
CCCOc1ccc([C@@H](C)NC(=O)NC2(C)CC(F)(F)C2)cc1	ZINC000875178081	EI	On-Demand	Anodyne	ACACA	27	54
CCCOc1ccc([C@@H](C)NC(=O)NC2(C)CC(F)(F)C2)cc1	ZINC000875178081	EI	On-Demand	Anodyne	ACACB	29	54
CCCOc1ccc([C@H](C)NC(=O)NC2(C)CC(F)(F)C2)cc1	ZINC000875178084	EI	On-Demand	Anodyne	ACACA	27	54
CCCOc1ccc([C@H](C)NC(=O)NC2(C)CC(F)(F)C2)cc1	ZINC000875178084	EI	On-Demand	Anodyne	ACACB	29	54
CCOc1ccccc1[C@H](C)NC(=O)N1CCCCCCNC(=O)CC1	ZINC000875178094	FG	On-Demand	Anodyne	HCN1	59	36
CCOc1ccccc1[C@H](C)NC(=O)N1CCCCCCNC(=O)CC1	ZINC000875178094	FG	On-Demand	Anodyne	HCN4	50	36
CCOc1ccccc1[C@@H](C)NC(=O)N1CCCCCCNC(=O)CC1	ZINC000875178096	FG	On-Demand	Anodyne	HCN1	59	36
CCOc1ccccc1[C@@H](C)NC(=O)N1CCCCCCNC(=O)CC1	ZINC000875178096	FG	On-Demand	Anodyne	HCN4	50	36
CCCOc1ccc([C@H](C)NC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875178098	EE	On-Demand	Anodyne	ACACA	27	49
CCCOc1ccc([C@H](C)NC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875178098	EE	On-Demand	Anodyne	ACACB	29	49
CCCOc1ccc([C@@H](C)NC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875178099	EE	On-Demand	Anodyne	ACACA	27	49
CCCOc1ccc([C@@H](C)NC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875178099	EE	On-Demand	Anodyne	ACACB	29	49
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)CCc2ccc3c(c2)OCO3)C1	ZINC000875178102	GF	On-Demand	Anodyne	EDNRB	47	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)CCc2ccc3c(c2)OCO3)C1	ZINC000875178102	GF	On-Demand	Anodyne	EDNRA	54	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)CCc2ccc3c(c2)OCO3)C1	ZINC000875178102	GF	On-Demand	Anodyne	BMP1	62	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)CCc2ccc3c(c2)OCO3)C1	ZINC000875178102	GF	On-Demand	Anodyne	NOS2	86	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)CCc2ccc3c(c2)OCO3)C1	ZINC000875178103	GF	On-Demand	Anodyne	EDNRB	47	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)CCc2ccc3c(c2)OCO3)C1	ZINC000875178103	GF	On-Demand	Anodyne	EDNRA	54	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)CCc2ccc3c(c2)OCO3)C1	ZINC000875178103	GF	On-Demand	Anodyne	BMP1	62	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)CCc2ccc3c(c2)OCO3)C1	ZINC000875178103	GF	On-Demand	Anodyne	NOS2	86	38
COC(=O)N(C)NC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000875178104	EF	On-Demand	Reactive	MME	117	45
COC(=O)N(C)NC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000875178104	EF	On-Demand	Reactive	ANPEP	68	37
COC(=O)N(C)NC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000875178104	EF	On-Demand	Reactive	CTSB	46	40
COC(=O)N(C)NC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000875178104	EF	On-Demand	Reactive	PAPA1_CARPA	60	39
COC(=O)N(C)NC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000875178104	EF	On-Demand	Reactive	CTSK	17	40
COC(=O)N(C)NC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000875178104	EF	On-Demand	Reactive	CTSL	29	40
COC(=O)N(C)NC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000875178104	EF	On-Demand	Reactive	CPA1	51	38
COC(=O)N(C)NC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000875178104	EF	On-Demand	Reactive	CTRB1	43	40
COC(=O)N(C)NC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000875178104	EF	On-Demand	Reactive	CAPNS1	58	34
COC(=O)N(C)NC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000875178104	EF	On-Demand	Reactive	NPY5R	17	40
COC(=O)N(C)NC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000875178104	EF	On-Demand	Reactive	CAPN1	63	37
COC(=O)N(C)NC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000875178104	EF	On-Demand	Reactive	CAPN2	55	33
COC(=O)N(C)NC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000875178104	EF	On-Demand	Reactive	ACE2	60	37
COC(=O)N(C)NC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000875178104	EF	On-Demand	Reactive	FPR1	47	36
COC(=O)N(C)NC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000875178104	EF	On-Demand	Reactive	NPR	24	40
COC(=O)N(C)NC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000875178104	EF	On-Demand	Reactive	AMP1_PLAFQ	45	35
O=C(NCc1cccc2ncccc12)C(=O)NCC1(N2CCCC2)CCOCC1	ZINC000875178107	GD	On-Demand	Anodyne	HCN1	57	37
O=C(NCc1cccc2ncccc12)C(=O)NCC1(N2CCCC2)CCOCC1	ZINC000875178107	GD	On-Demand	Anodyne	HCN4	48	31
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)C(=O)NCCCCC#N	ZINC000875178112	FG	On-Demand	Mild	MDM2	90	32
CCOc1ccccc1[C@H](C)NC(=O)N[C@@H]1C[C@H]2C[C@@]2(C(=O)OC)C1	ZINC000875178113	EF	On-Demand	Anodyne	HCN1	48	33
CCOc1ccccc1[C@H](C)NC(=O)N[C@@H]1C[C@H]2C[C@@]2(C(=O)OC)C1	ZINC000875178113	EF	On-Demand	Anodyne	HCN4	40	33
CCOc1ccccc1[C@@H](C)NC(=O)N[C@@H]1C[C@H]2C[C@@]2(C(=O)OC)C1	ZINC000875178114	EF	On-Demand	Anodyne	HCN1	48	33
CCOc1ccccc1[C@@H](C)NC(=O)N[C@@H]1C[C@H]2C[C@@]2(C(=O)OC)C1	ZINC000875178114	EF	On-Demand	Anodyne	HCN4	40	33
CCOc1ccccc1[C@@H](C)NC(=O)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875178128	FE	On-Demand	Anodyne	HCN1	50	35
CCOc1ccccc1[C@@H](C)NC(=O)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875178128	FE	On-Demand	Anodyne	HCN4	42	35
CCOc1ccccc1[C@H](C)NC(=O)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875178129	FE	On-Demand	Anodyne	HCN1	50	35
CCOc1ccccc1[C@H](C)NC(=O)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875178129	FE	On-Demand	Anodyne	HCN4	42	35
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875178208	GG	On-Demand	Anodyne	NOS2	93	36
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875178208	GG	On-Demand	Anodyne	MCHR1	21	40
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875178210	GG	On-Demand	Anodyne	NOS2	93	36
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875178210	GG	On-Demand	Anodyne	MCHR1	21	40
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875178212	GG	On-Demand	Anodyne	NOS2	93	36
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875178212	GG	On-Demand	Anodyne	MCHR1	21	40
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875178215	GG	On-Demand	Anodyne	NOS2	93	36
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875178215	GG	On-Demand	Anodyne	MCHR1	21	40
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCOC1	ZINC000875178217	DD	On-Demand	Anodyne	SIGMAR1	24	41
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCOC1	ZINC000875178217	DD	On-Demand	Anodyne	FAAH	50	40
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCOC1	ZINC000875178217	DD	On-Demand	Anodyne	CES1	58	40
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCOC1	ZINC000875178217	DD	On-Demand	Anodyne	AMP1_PLAFQ	22	44
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCOC1	ZINC000875178218	DD	On-Demand	Anodyne	SIGMAR1	24	41
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCOC1	ZINC000875178218	DD	On-Demand	Anodyne	FAAH	50	40
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCOC1	ZINC000875178218	DD	On-Demand	Anodyne	CES1	58	40
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCOC1	ZINC000875178218	DD	On-Demand	Anodyne	AMP1_PLAFQ	22	44
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)C(=O)NCC2CC=CC2)C1	ZINC000875178220	FD	On-Demand	Anodyne	CACNA1I	47	34
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)C(=O)NCC2CC=CC2)C1	ZINC000875178220	FD	On-Demand	Anodyne	GPR119	32	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)C(=O)NCC2CC=CC2)C1	ZINC000875178222	FD	On-Demand	Anodyne	CACNA1I	47	34
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)C(=O)NCC2CC=CC2)C1	ZINC000875178222	FD	On-Demand	Anodyne	GPR119	32	42
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(F)cc1F	ZINC000875178225	CE	On-Demand	Anodyne	P2RX7	41	41
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)N[C@@H]2CCN(CC3CC3)C2)c1	ZINC000875178227	FD	On-Demand	Anodyne	SSTR5	30	41
Cc1cncc([C@H]2CCCN2C(=O)C(=O)N[C@@H]2CCN(CC3CC3)C2)c1	ZINC000875178230	FD	On-Demand	Anodyne	SSTR5	30	41
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)N[C@H]2CCN(CC3CC3)C2)c1	ZINC000875178232	FD	On-Demand	Anodyne	SSTR5	30	41
Cc1cncc([C@H]2CCCN2C(=O)C(=O)N[C@H]2CCN(CC3CC3)C2)c1	ZINC000875178234	FD	On-Demand	Anodyne	SSTR5	30	41
CN(C)C[C@@H]1CN(C(=O)NCc2cccc(Cl)c2Cl)C[C@H]1CN(C)C	ZINC000875178235	GF	On-Demand	Anodyne	P2RX7	65	51
N#CCCCCNC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875178236	ED	On-Demand	Mild	DPP4	27	42
N#CCCCCNC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875178236	ED	On-Demand	Mild	DPP8	17	42
N#CCCCCNC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875178238	ED	On-Demand	Mild	DPP4	27	42
N#CCCCCNC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875178238	ED	On-Demand	Mild	DPP8	17	42
N#CCCCCNC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875178240	ED	On-Demand	Mild	DPP4	27	42
N#CCCCCNC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875178240	ED	On-Demand	Mild	DPP8	17	42
N#CCCCCNC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875178242	ED	On-Demand	Mild	DPP4	27	42
N#CCCCCNC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875178242	ED	On-Demand	Mild	DPP8	17	42
CN(C)C[C@@H]1CN(C(=O)NCc2cccc3ccccc23)C[C@H]1CN(C)C	ZINC000875178259	FF	On-Demand	Anodyne	Q6PRC7_IXORI	49	39
CC[C@]1(C(=O)Nc2cccnc2OC)CCNC1=O	ZINC000875178263	CC	On-Demand	Anodyne	G2YM83_BOTF4	44	32
CCCOc1ccc([C@@H](C)NC(=O)NC[C@H]2C[C@H](O)C2)cc1	ZINC000875178265	DF	On-Demand	Anodyne	ACACA	26	53
CCCOc1ccc([C@@H](C)NC(=O)NC[C@H]2C[C@H](O)C2)cc1	ZINC000875178265	DF	On-Demand	Anodyne	ACACB	28	53
CCCOc1ccc([C@H](C)NC(=O)NC[C@H]2C[C@H](O)C2)cc1	ZINC000875178267	DF	On-Demand	Anodyne	ACACA	26	53
CCCOc1ccc([C@H](C)NC(=O)NC[C@H]2C[C@H](O)C2)cc1	ZINC000875178267	DF	On-Demand	Anodyne	ACACB	28	53
O=C1CCN(C(=O)NCc2ccc(F)cc2F)CCCCCCN1	ZINC000875178275	EF	On-Demand	Anodyne	P2RX7	29	40
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2Br)CC1	ZINC000875178287	GD	On-Demand	Anodyne	EPHX2	30	49
O=C(NCCO)C1CCN(C(=O)NCc2cccc3ccccc23)CC1	ZINC000875178305	FD	On-Demand	Anodyne	MTNR1A	21	41
O=C(NCCO)C1CCN(C(=O)NCc2cccc3ccccc23)CC1	ZINC000875178305	FD	On-Demand	Anodyne	MTNR1B	16	40
O=C(NCCO)C1CCN(C(=O)NCc2cccc3ccccc23)CC1	ZINC000875178305	FD	On-Demand	Anodyne	EPHX2	30	52
O=C(NCCO)C1CCN(C(=O)NCc2cccc3ccccc23)CC1	ZINC000875178305	FD	On-Demand	Anodyne	Q6PRC7_IXORI	48	41
CCOc1ccccc1[C@H](C)NC(=O)N1CCCN(C=O)CC1	ZINC000875178308	DE	On-Demand	Anodyne	HCN1	61	38
CCOc1ccccc1[C@H](C)NC(=O)N1CCCN(C=O)CC1	ZINC000875178308	DE	On-Demand	Anodyne	HCN4	52	38
CCOc1ccccc1[C@@H](C)NC(=O)N1CCCN(C=O)CC1	ZINC000875178309	DE	On-Demand	Anodyne	HCN1	61	38
CCOc1ccccc1[C@@H](C)NC(=O)N1CCCN(C=O)CC1	ZINC000875178309	DE	On-Demand	Anodyne	HCN4	52	38
CCOc1ccccc1[C@H](C)NC(=O)NC1CC(C(=O)OC)C1	ZINC000875178310	DE	On-Demand	Anodyne	HCN1	47	33
CCOc1ccccc1[C@@H](C)NC(=O)NC1CC(C(=O)OC)C1	ZINC000875178311	DE	On-Demand	Anodyne	HCN1	47	33
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccc3ccccc23)C1	ZINC000875178318	EG	On-Demand	Anodyne	AMP1_PLAFQ	37	46
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccc3ccccc23)C1	ZINC000875178318	EG	On-Demand	Anodyne	Q6PRC7_IXORI	56	40
COC(=O)N(C)NC(=O)N[C@@H](C)CCc1ccc2c(c1)OCO2	ZINC000875178342	DD	On-Demand	Reactive	EDNRB	66	35
COC(=O)N(C)NC(=O)N[C@@H](C)CCc1ccc2c(c1)OCO2	ZINC000875178342	DD	On-Demand	Reactive	EDNRA	61	36
COC(=O)N(C)NC(=O)N[C@@H](C)CCc1ccc2c(c1)OCO2	ZINC000875178342	DD	On-Demand	Reactive	BMP1	69	42
COC(=O)N(C)NC(=O)N[C@@H](C)CCc1ccc2c(c1)OCO2	ZINC000875178342	DD	On-Demand	Reactive	NOS2	67	33
COC(=O)N(C)NC(=O)N[C@H](C)CCc1ccc2c(c1)OCO2	ZINC000875178343	DD	On-Demand	Reactive	EDNRB	66	35
COC(=O)N(C)NC(=O)N[C@H](C)CCc1ccc2c(c1)OCO2	ZINC000875178343	DD	On-Demand	Reactive	EDNRA	61	36
COC(=O)N(C)NC(=O)N[C@H](C)CCc1ccc2c(c1)OCO2	ZINC000875178343	DD	On-Demand	Reactive	BMP1	69	42
COC(=O)N(C)NC(=O)N[C@H](C)CCc1ccc2c(c1)OCO2	ZINC000875178343	DD	On-Demand	Reactive	NOS2	67	33
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H]1CCOC1	ZINC000875178355	ED	On-Demand	Anodyne	C3AR1	42	43
O=C(N[C@H]1CCOC1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875178356	ED	On-Demand	Anodyne	C3AR1	42	43
O=C(N[C@@H]1CCOC1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875178357	ED	On-Demand	Anodyne	C3AR1	42	43
O=C(N[C@H]1CCOC1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875178358	ED	On-Demand	Anodyne	C3AR1	42	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)C1	ZINC000875178363	GD	On-Demand	Anodyne	GPR119	21	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)C1	ZINC000875178365	GD	On-Demand	Anodyne	GPR119	21	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)C1	ZINC000875178366	GD	On-Demand	Anodyne	GPR119	21	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)C1	ZINC000875178367	GD	On-Demand	Anodyne	GPR119	21	40
CC(C)(C)OC(=O)NC1(CNC(=O)NCc2ccc(F)cc2F)CCOCC1	ZINC000875178368	GF	On-Demand	Anodyne	P2RX7	19	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1c(C)cc(C)cc1C	ZINC000875178372	EF	On-Demand	Anodyne	SLC6A3	51	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1c(C)cc(C)cc1C	ZINC000875178376	EF	On-Demand	Anodyne	SLC6A3	51	38
CN(C)C[C@@H]1CN(C(=O)NCc2ccc(F)cc2F)C[C@H]1CN(C)C	ZINC000875178377	FD	On-Demand	Anodyne	P2RX7	58	41
COC(=O)C1(O)CN(C(=O)NCc2ccc(F)cc2F)C1	ZINC000875178382	DC	On-Demand	Anodyne	P2RX7	48	41
COC(=O)C1(O)CN(C(=O)NCc2ccc(F)cc2F)C1	ZINC000875178382	DC	On-Demand	Anodyne	BDKRB1	24	41
O=C(NCc1ccc(F)cc1F)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875178401	EG	On-Demand	Anodyne	F2	35	44
O=C(NCc1ccc(F)cc1F)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875178401	EG	On-Demand	Anodyne	P2RX7	37	42
O=C(NCc1ccc(F)cc1F)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875178402	EG	On-Demand	Anodyne	F2	35	44
O=C(NCc1ccc(F)cc1F)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875178402	EG	On-Demand	Anodyne	P2RX7	37	42
O=C(NCc1ccc(F)cc1F)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875178403	EG	On-Demand	Anodyne	F2	35	44
O=C(NCc1ccc(F)cc1F)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875178403	EG	On-Demand	Anodyne	P2RX7	37	42
O=C(NCc1ccc(F)cc1F)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875178404	EG	On-Demand	Anodyne	F2	35	44
O=C(NCc1ccc(F)cc1F)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875178404	EG	On-Demand	Anodyne	P2RX7	37	42
O=CN1CCCN(C(=O)NCc2cccc3ccccc23)CC1	ZINC000875178410	DE	On-Demand	Anodyne	Q6PRC7_IXORI	50	39
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N1Cc2cccc(O)c2C1	ZINC000875178413	FG	On-Demand	Clean	BMP1	62	36
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N1Cc2cccc(O)c2C1	ZINC000875178413	FG	On-Demand	Clean	NOS2	91	34
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)N1Cc2cccc(O)c2C1	ZINC000875178415	FG	On-Demand	Clean	BMP1	62	36
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)N1Cc2cccc(O)c2C1	ZINC000875178415	FG	On-Demand	Clean	NOS2	91	34
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1Br	ZINC000875178426	FF	On-Demand	Anodyne	SLC6A4	31	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1Br	ZINC000875178426	FF	On-Demand	Anodyne	SLC6A3	59	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1Br	ZINC000875178428	FF	On-Demand	Anodyne	SLC6A4	31	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1Br	ZINC000875178428	FF	On-Demand	Anodyne	SLC6A3	59	40
O=C(NCc1ccccc1Br)N1CCC(CO)(CO)CC1	ZINC000875178439	FD	On-Demand	Anodyne	EPHX2	17	46
CCC[C@@H](NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccn1	ZINC000875178441	ED	On-Demand	Anodyne	GRIN2B	19	40
CCC[C@H](NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccn1	ZINC000875178442	ED	On-Demand	Anodyne	GRIN2B	19	40
CCC[C@@H](NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccn1	ZINC000875178443	ED	On-Demand	Anodyne	GRIN2B	19	40
CCC[C@H](NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccn1	ZINC000875178444	ED	On-Demand	Anodyne	GRIN2B	19	40
O=C(NCc1ccc(F)cc1F)N1CCC(CO)(CO)CC1	ZINC000875178447	DD	On-Demand	Anodyne	CACNA1H	47	35
O=C(NCc1ccc(F)cc1F)N1CCC(CO)(CO)CC1	ZINC000875178447	DD	On-Demand	Anodyne	P2RX7	41	40
O=C(NCc1ccc(F)cc1F)N1CCC(CO)(CO)CC1	ZINC000875178447	DD	On-Demand	Anodyne	EPHX2	15	47
O=C(NCc1cccc(Cl)c1Cl)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875178468	GF	On-Demand	Anodyne	P2RX7	61	46
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCc2ccc(F)cc2F)C1	ZINC000875178470	GE	On-Demand	Anodyne	EPHX2	29	43
O=C(N[C@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCc2ccc(F)cc2F)C1	ZINC000875178472	GE	On-Demand	Anodyne	EPHX2	29	43
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875178473	FG	On-Demand	Anodyne	NOS2	74	33
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCc2ccc(F)cc2F)C1	ZINC000875178474	GE	On-Demand	Anodyne	EPHX2	29	43
O=C(N[C@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCc2ccc(F)cc2F)C1	ZINC000875178475	GE	On-Demand	Anodyne	EPHX2	29	43
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)c1ccc(OC)cc1	ZINC000875178479	CF	On-Demand	Anodyne	ACACB	24	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)c1ccc(OC)cc1	ZINC000875178480	CF	On-Demand	Anodyne	ACACB	24	40
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875178499	FG	On-Demand	Anodyne	NOS2	74	33
O=C(Nc1ccccc1COCc1ccccc1)[C@@]12CCCC[C@@H]1C2	ZINC000875178500	EJ	On-Demand	Anodyne	TIMP3	54	32
O=C(Nc1ccccc1COCc1ccccc1)[C@@]12CCCC[C@@H]1C2	ZINC000875178500	EJ	On-Demand	Anodyne	SLC12A5	42	34
O=C(Nc1ccccc1COCc1ccccc1)[C@]12CCCC[C@@H]1C2	ZINC000875178501	EJ	On-Demand	Anodyne	TIMP3	54	32
O=C(Nc1ccccc1COCc1ccccc1)[C@]12CCCC[C@@H]1C2	ZINC000875178501	EJ	On-Demand	Anodyne	SLC12A5	42	34
O=C(Nc1ccccc1COCc1ccccc1)[C@@]12CCCC[C@H]1C2	ZINC000875178502	EJ	On-Demand	Anodyne	TIMP3	54	32
O=C(Nc1ccccc1COCc1ccccc1)[C@@]12CCCC[C@H]1C2	ZINC000875178502	EJ	On-Demand	Anodyne	SLC12A5	42	34
O=C(Nc1ccccc1COCc1ccccc1)[C@]12CCCC[C@H]1C2	ZINC000875178503	EJ	On-Demand	Anodyne	TIMP3	54	32
O=C(Nc1ccccc1COCc1ccccc1)[C@]12CCCC[C@H]1C2	ZINC000875178503	EJ	On-Demand	Anodyne	SLC12A5	42	34
C[C@@H]1CN(C(=O)NCc2ccc(F)cc2F)CC[C@H](C(F)(F)F)O1	ZINC000875178547	FG	On-Demand	Anodyne	TRPV1	43	33
C[C@@H]1CN(C(=O)NCc2ccc(F)cc2F)CC[C@H](C(F)(F)F)O1	ZINC000875178547	FG	On-Demand	Anodyne	PRCP	42	33
C[C@@H]1CN(C(=O)NCc2ccc(F)cc2F)CC[C@H](C(F)(F)F)O1	ZINC000875178547	FG	On-Demand	Anodyne	P2RX7	39	40
C[C@@H]1CN(C(=O)NCc2ccc(F)cc2F)CC[C@H](C(F)(F)F)O1	ZINC000875178547	FG	On-Demand	Anodyne	EPHX2	17	44
C[C@@H]1CN(C(=O)NCc2ccc(F)cc2F)CC[C@@H](C(F)(F)F)O1	ZINC000875178548	FG	On-Demand	Anodyne	TRPV1	43	33
C[C@@H]1CN(C(=O)NCc2ccc(F)cc2F)CC[C@@H](C(F)(F)F)O1	ZINC000875178548	FG	On-Demand	Anodyne	PRCP	42	33
C[C@@H]1CN(C(=O)NCc2ccc(F)cc2F)CC[C@@H](C(F)(F)F)O1	ZINC000875178548	FG	On-Demand	Anodyne	P2RX7	39	40
C[C@@H]1CN(C(=O)NCc2ccc(F)cc2F)CC[C@@H](C(F)(F)F)O1	ZINC000875178548	FG	On-Demand	Anodyne	EPHX2	17	44
CC[C@@H]1COCCN1CCNC(=O)NCc1c(F)cccc1Cl	ZINC000875178561	EE	On-Demand	Anodyne	P2RX7	16	44
O=C(NCc1ccc(F)cc1F)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875178565	EF	On-Demand	Anodyne	HTR2A	15	41
O=C(NCc1ccc(F)cc1F)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875178565	EF	On-Demand	Anodyne	PRCP	40	31
O=C(NCc1ccc(F)cc1F)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875178565	EF	On-Demand	Anodyne	EPHX2	15	46
O=C(NCc1ccc(F)cc1F)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875178566	EF	On-Demand	Anodyne	HTR2A	15	41
O=C(NCc1ccc(F)cc1F)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875178566	EF	On-Demand	Anodyne	PRCP	40	31
O=C(NCc1ccc(F)cc1F)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875178566	EF	On-Demand	Anodyne	EPHX2	15	46
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc2ccccc12	ZINC000875178578	DG	On-Demand	Anodyne	MME	16	44
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc2ccccc12	ZINC000875178578	DG	On-Demand	Anodyne	ANPEP	32	64
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc2ccccc12	ZINC000875178578	DG	On-Demand	Anodyne	CTSB	17	47
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc2ccccc12	ZINC000875178578	DG	On-Demand	Anodyne	MTNR1A	22	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc2ccccc12	ZINC000875178578	DG	On-Demand	Anodyne	CAPN2	24	47
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc2ccccc12	ZINC000875178578	DG	On-Demand	Anodyne	ACE2	15	44
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc2ccccc12	ZINC000875178578	DG	On-Demand	Anodyne	AMP1_PLAFQ	26	53
CCC[C@H](NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1)c1ccccn1	ZINC000875178596	GF	On-Demand	Anodyne	ROCK1	25	43
CCC[C@H](NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1)c1ccccn1	ZINC000875178596	GF	On-Demand	Anodyne	ROCK2	17	43
CCC[C@@H](NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1)c1ccccn1	ZINC000875178598	GF	On-Demand	Anodyne	ROCK1	25	43
CCC[C@@H](NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1)c1ccccn1	ZINC000875178598	GF	On-Demand	Anodyne	ROCK2	17	43
COc1cccc(C(C)(C)C(=O)Nc2cccnc2OC)c1	ZINC000875178611	DG	On-Demand	Anodyne	P2RY1	48	53
O=C(N[C@H]1CCN(CC2CC2)C1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875178616	GD	On-Demand	Anodyne	C3AR1	45	44
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H]1CCN(CC2CC2)C1	ZINC000875178617	GD	On-Demand	Anodyne	C3AR1	45	44
O=C(N[C@H]1CCN(CC2CC2)C1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875178618	GD	On-Demand	Anodyne	C3AR1	45	44
O=C(N[C@@H]1CCN(CC2CC2)C1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875178619	GD	On-Demand	Anodyne	C3AR1	45	44
CCOc1ccccc1[C@H](C)NC(=O)N(C)CCN1CC2(CCOCC2)C1	ZINC000875178621	GF	On-Demand	Anodyne	HCN1	41	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(F)cc1F	ZINC000875178622	DE	On-Demand	Anodyne	SLC6A4	31	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(F)cc1F	ZINC000875178622	DE	On-Demand	Anodyne	SLC6A3	61	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(F)cc1F	ZINC000875178622	DE	On-Demand	Anodyne	P2RX7	57	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(F)cc1F	ZINC000875178623	DE	On-Demand	Anodyne	SLC6A4	31	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(F)cc1F	ZINC000875178623	DE	On-Demand	Anodyne	SLC6A3	61	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(F)cc1F	ZINC000875178623	DE	On-Demand	Anodyne	P2RX7	57	39
CCOc1ccccc1[C@@H](C)NC(=O)N(C)CCN1CC2(CCOCC2)C1	ZINC000875178625	GF	On-Demand	Anodyne	HCN1	41	41
C[C@H](NC(=O)C(=O)NCC1(N2CCCC2)CCOCC1)c1ccnn1C	ZINC000875178635	FC	On-Demand	Anodyne	HCN1	77	44
C[C@H](NC(=O)C(=O)NCC1(N2CCCC2)CCOCC1)c1ccnn1C	ZINC000875178635	FC	On-Demand	Anodyne	HCN4	53	37
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)C(=O)N2CCC(CCF)CC2)C1	ZINC000875178650	GE	On-Demand	Anodyne	GPR119	27	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)C(=O)N2CCC(CCF)CC2)C1	ZINC000875178652	GE	On-Demand	Anodyne	GPR119	27	42
CC[C@@H]1COCCN1CCNC(=O)NCc1ccc(F)cc1F	ZINC000875178675	ED	On-Demand	Anodyne	P2RX7	45	42
N#CCCCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875178688	FE	On-Demand	Mild	DRD2	28	43
N#CCCCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875178688	FE	On-Demand	Mild	DRD4	47	42
N#CCCCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875178688	FE	On-Demand	Mild	ACHE	66	62
N#CCCCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875178688	FE	On-Demand	Mild	DRD3	30	42
N#CCCCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875178688	FE	On-Demand	Mild	SLC6A3	20	52
N#CCCCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875178688	FE	On-Demand	Mild	HTR4	29	43
N#CCCCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875178688	FE	On-Demand	Mild	SIGMAR1	65	45
N#CCCCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875178688	FE	On-Demand	Mild	BCHE	19	50
N#CCCCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875178688	FE	On-Demand	Mild	CCR3	48	47
N#CCCCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875178688	FE	On-Demand	Mild	MCHR1	23	41
N#CCCCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875178688	FE	On-Demand	Mild	CACNA1G	30	40
N#CCCCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875178688	FE	On-Demand	Mild	CYP2J2	43	30
CCCOc1ccc([C@@H](C)NC(=O)N2CC[C@@]3(CC(C(=O)OC)=NO3)C2)cc1	ZINC000875178703	GF	On-Demand	Anodyne	ACACA	19	43
CCCOc1ccc([C@@H](C)NC(=O)N2CC[C@@]3(CC(C(=O)OC)=NO3)C2)cc1	ZINC000875178703	GF	On-Demand	Anodyne	ACACB	21	43
CCCOc1ccc([C@H](C)NC(=O)N2CC[C@@]3(CC(C(=O)OC)=NO3)C2)cc1	ZINC000875178704	GF	On-Demand	Anodyne	ACACA	19	43
CCCOc1ccc([C@H](C)NC(=O)N2CC[C@@]3(CC(C(=O)OC)=NO3)C2)cc1	ZINC000875178704	GF	On-Demand	Anodyne	ACACB	21	43
CCCOc1ccc([C@@H](C)NC(=O)N2CC[C@]3(CC(C(=O)OC)=NO3)C2)cc1	ZINC000875178706	GF	On-Demand	Anodyne	ACACA	19	43
CCCOc1ccc([C@@H](C)NC(=O)N2CC[C@]3(CC(C(=O)OC)=NO3)C2)cc1	ZINC000875178706	GF	On-Demand	Anodyne	ACACB	21	43
CCCOc1ccc([C@H](C)NC(=O)N2CC[C@]3(CC(C(=O)OC)=NO3)C2)cc1	ZINC000875178707	GF	On-Demand	Anodyne	ACACA	19	43
CCCOc1ccc([C@H](C)NC(=O)N2CC[C@]3(CC(C(=O)OC)=NO3)C2)cc1	ZINC000875178707	GF	On-Demand	Anodyne	ACACB	21	43
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccc(Cl)c2Cl)C1	ZINC000875178713	FG	On-Demand	Anodyne	P2RX7	57	47
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2(N3CCCC3)CCOCC2)C1	ZINC000875178725	FC	On-Demand	Anodyne	HCN1	41	32
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2(N3CCCC3)CCOCC2)C1	ZINC000875178725	FC	On-Demand	Anodyne	HCN4	41	32
Cc1nnc(NNC(=O)NCc2c(F)cccc2Cl)n1C	ZINC000875178727	DD	On-Demand	Reactive	P2RX7	34	47
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2(N3CCCC3)CCOCC2)C1	ZINC000875178728	FC	On-Demand	Anodyne	HCN1	41	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2(N3CCCC3)CCOCC2)C1	ZINC000875178728	FC	On-Demand	Anodyne	HCN4	41	32
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875178733	GE	On-Demand	Anodyne	GPR119	26	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875178736	GE	On-Demand	Anodyne	GPR119	26	40
COC(=O)C1(O)CN(C(=O)N[C@H](C)CCc2ccc3c(c2)OCO3)C1	ZINC000875178737	FC	On-Demand	Anodyne	BMP1	69	40
COC(=O)C1(O)CN(C(=O)N[C@H](C)CCc2ccc3c(c2)OCO3)C1	ZINC000875178737	FC	On-Demand	Anodyne	NOS2	74	34
COC(=O)C1(O)CN(C(=O)N[C@@H](C)CCc2ccc3c(c2)OCO3)C1	ZINC000875178739	FC	On-Demand	Anodyne	BMP1	69	40
COC(=O)C1(O)CN(C(=O)N[C@@H](C)CCc2ccc3c(c2)OCO3)C1	ZINC000875178739	FC	On-Demand	Anodyne	NOS2	74	34
COC[C@H](NC(=O)C(=O)NCCCCC#N)c1cccc(Br)c1	ZINC000875178740	GE	On-Demand	Mild	PAPA1_CARPA	22	40
COC[C@@H](NC(=O)C(=O)NCCCCC#N)c1cccc(Br)c1	ZINC000875178741	GE	On-Demand	Mild	PAPA1_CARPA	22	40
CCCOc1ccc([C@H](C)NC(=O)N[C@@H](CC)C[C@H](C)O)cc1	ZINC000875178754	DG	On-Demand	Anodyne	ACACA	28	55
CCCOc1ccc([C@H](C)NC(=O)N[C@@H](CC)C[C@H](C)O)cc1	ZINC000875178754	DG	On-Demand	Anodyne	ACACB	29	55
CCCOc1ccc([C@H](C)NC(=O)N[C@H](CC)C[C@@H](C)O)cc1	ZINC000875178757	DG	On-Demand	Anodyne	ACACA	28	55
CCCOc1ccc([C@H](C)NC(=O)N[C@H](CC)C[C@@H](C)O)cc1	ZINC000875178757	DG	On-Demand	Anodyne	ACACB	29	55
CCCOc1ccc([C@H](C)NC(=O)N[C@H](CC)C[C@H](C)O)cc1	ZINC000875178759	DG	On-Demand	Anodyne	ACACA	28	55
CCCOc1ccc([C@H](C)NC(=O)N[C@H](CC)C[C@H](C)O)cc1	ZINC000875178759	DG	On-Demand	Anodyne	ACACB	29	55
CCCOc1ccc([C@H](C)NC(=O)N[C@@H](CC)C[C@@H](C)O)cc1	ZINC000875178761	DG	On-Demand	Anodyne	ACACA	28	55
CCCOc1ccc([C@H](C)NC(=O)N[C@@H](CC)C[C@@H](C)O)cc1	ZINC000875178761	DG	On-Demand	Anodyne	ACACB	29	55
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1cc(Cl)ccc1Cl	ZINC000875178763	EH	On-Demand	Anodyne	CACNA1H	50	36
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1cc(Cl)ccc1Cl	ZINC000875178763	EH	On-Demand	Anodyne	CCR1	43	39
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1cc(Cl)ccc1Cl	ZINC000875178763	EH	On-Demand	Anodyne	CACNA1I	43	33
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1cc(Cl)ccc1Cl	ZINC000875178765	EH	On-Demand	Anodyne	CACNA1H	50	36
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1cc(Cl)ccc1Cl	ZINC000875178765	EH	On-Demand	Anodyne	CCR1	43	39
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1cc(Cl)ccc1Cl	ZINC000875178765	EH	On-Demand	Anodyne	CACNA1I	43	33
CCOc1ccccc1[C@H](C)NC(=O)N1CCN(C)C(C)(C)CC1	ZINC000875178778	EG	On-Demand	Anodyne	HCN1	68	39
CCOc1ccccc1[C@H](C)NC(=O)N1CCN(C)C(C)(C)CC1	ZINC000875178778	EG	On-Demand	Anodyne	HCN4	53	39
COCCN(CC1CCN(C)CC1)C(=O)NCc1c(F)cccc1Cl	ZINC000875178779	FF	On-Demand	Anodyne	P2RX7	15	43
CCOc1ccccc1[C@@H](C)NC(=O)N1CCN(C)C(C)(C)CC1	ZINC000875178780	EG	On-Demand	Anodyne	HCN1	68	39
CCOc1ccccc1[C@@H](C)NC(=O)N1CCN(C)C(C)(C)CC1	ZINC000875178780	EG	On-Demand	Anodyne	HCN4	53	39
O=C(NCc1ccc(F)cc1F)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875178788	EE	On-Demand	Anodyne	P2RX7	38	40
O=C(NCc1ccc(F)cc1F)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875178790	EE	On-Demand	Anodyne	P2RX7	38	40
O=C(NC(Cc1ccccc1)Cc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875178793	GF	On-Demand	Anodyne	ACE	50	40
O=C(NC(Cc1ccccc1)Cc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875178793	GF	On-Demand	Anodyne	GHRHR	59	36
O=C(NC(Cc1ccccc1)Cc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875178793	GF	On-Demand	Anodyne	MME	102	42
O=C(NC(Cc1ccccc1)Cc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875178793	GF	On-Demand	Anodyne	CYSP_TRYCR	26	41
O=C(NC(Cc1ccccc1)Cc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875178793	GF	On-Demand	Anodyne	CPA1	44	37
O=C(NC(Cc1ccccc1)Cc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875178793	GF	On-Demand	Anodyne	TIMP3	68	34
O=C(NC(Cc1ccccc1)Cc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875178793	GF	On-Demand	Anodyne	PIN1	15	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)C(=O)NCC[C@@H]2CCCOC2)C1	ZINC000875178807	GD	On-Demand	Anodyne	GPR119	24	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)C(=O)NCC[C@@H]2CCCOC2)C1	ZINC000875178808	GD	On-Demand	Anodyne	GPR119	24	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)C(=O)NCC[C@H]2CCCOC2)C1	ZINC000875178809	GD	On-Demand	Anodyne	GPR119	24	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)C(=O)NCC[C@H]2CCCOC2)C1	ZINC000875178810	GD	On-Demand	Anodyne	GPR119	24	40
C=CC(C)(C)CCCNC(=O)C(=O)NCC1CCN(C(C)=O)CC1	ZINC000875178830	ED	On-Demand	Mild	CACNA1I	41	32
CC(C)[C@H]1CCC[C@H](NC(=O)C(=O)N2CCC(N3CCN(C)CC3)CC2)C1	ZINC000875178842	GD	On-Demand	Anodyne	L3MBTL3	53	42
CC(C)[C@H]1CCC[C@@H](NC(=O)C(=O)N2CCC(N3CCN(C)CC3)CC2)C1	ZINC000875178844	GD	On-Demand	Anodyne	L3MBTL3	53	42
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCc2ccc(F)cc2F)[C@@H](O)C1	ZINC000875178845	GE	On-Demand	Anodyne	P2RX7	48	39
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCc2ccc(F)cc2F)[C@@H](O)C1	ZINC000875178845	GE	On-Demand	Anodyne	EPHX2	18	41
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCc2ccc(F)cc2F)[C@@H](O)C1	ZINC000875178845	GE	On-Demand	Anodyne	GPR119	42	53
CCOc1ccccc1[C@@H](C)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875178846	EG	On-Demand	Anodyne	AMY2	45	30
CCOc1ccccc1[C@@H](C)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875178846	EG	On-Demand	Anodyne	REN	16	43
CCOc1ccccc1[C@@H](C)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875178846	EG	On-Demand	Anodyne	BIRC2	36	40
CCOc1ccccc1[C@@H](C)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875178846	EG	On-Demand	Anodyne	HCN1	52	36
CCOc1ccccc1[C@@H](C)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875178846	EG	On-Demand	Anodyne	HCN4	45	36
CCOc1ccccc1[C@H](C)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875178847	EG	On-Demand	Anodyne	AMY2	45	30
CCOc1ccccc1[C@H](C)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875178847	EG	On-Demand	Anodyne	REN	16	43
CCOc1ccccc1[C@H](C)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875178847	EG	On-Demand	Anodyne	BIRC2	36	40
CCOc1ccccc1[C@H](C)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875178847	EG	On-Demand	Anodyne	HCN1	52	36
CCOc1ccccc1[C@H](C)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875178847	EG	On-Demand	Anodyne	HCN4	45	36
CCOc1ccccc1[C@@H](C)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875178848	EG	On-Demand	Anodyne	AMY2	45	30
CCOc1ccccc1[C@@H](C)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875178848	EG	On-Demand	Anodyne	REN	16	43
CCOc1ccccc1[C@@H](C)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875178848	EG	On-Demand	Anodyne	BIRC2	36	40
CCOc1ccccc1[C@@H](C)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875178848	EG	On-Demand	Anodyne	HCN1	52	36
CCOc1ccccc1[C@@H](C)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875178848	EG	On-Demand	Anodyne	HCN4	45	36
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NCc2ccc(F)cc2F)[C@@H](O)C1	ZINC000875178849	GE	On-Demand	Anodyne	P2RX7	48	39
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NCc2ccc(F)cc2F)[C@@H](O)C1	ZINC000875178849	GE	On-Demand	Anodyne	EPHX2	18	41
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NCc2ccc(F)cc2F)[C@@H](O)C1	ZINC000875178849	GE	On-Demand	Anodyne	GPR119	42	53
CCOc1ccccc1[C@H](C)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875178850	EG	On-Demand	Anodyne	AMY2	45	30
CCOc1ccccc1[C@H](C)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875178850	EG	On-Demand	Anodyne	REN	16	43
CCOc1ccccc1[C@H](C)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875178850	EG	On-Demand	Anodyne	BIRC2	36	40
CCOc1ccccc1[C@H](C)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875178850	EG	On-Demand	Anodyne	HCN1	52	36
CCOc1ccccc1[C@H](C)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875178850	EG	On-Demand	Anodyne	HCN4	45	36
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCc2ccc(F)cc2F)[C@H](O)C1	ZINC000875178852	GE	On-Demand	Anodyne	P2RX7	48	39
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCc2ccc(F)cc2F)[C@H](O)C1	ZINC000875178852	GE	On-Demand	Anodyne	EPHX2	18	41
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCc2ccc(F)cc2F)[C@H](O)C1	ZINC000875178852	GE	On-Demand	Anodyne	GPR119	42	53
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NCc2ccc(F)cc2F)[C@H](O)C1	ZINC000875178856	GE	On-Demand	Anodyne	P2RX7	48	39
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NCc2ccc(F)cc2F)[C@H](O)C1	ZINC000875178856	GE	On-Demand	Anodyne	EPHX2	18	41
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NCc2ccc(F)cc2F)[C@H](O)C1	ZINC000875178856	GE	On-Demand	Anodyne	GPR119	42	53
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875178901	DD	On-Demand	Anodyne	BMP1	56	41
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875178901	DD	On-Demand	Anodyne	NOS2	92	36
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875178902	DD	On-Demand	Anodyne	BMP1	56	41
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875178902	DD	On-Demand	Anodyne	NOS2	92	36
COc1ccc(N2CCN(C(=O)C(=O)NCCCCC#N)CC2)c(OC)c1	ZINC000875178909	FD	On-Demand	Mild	HTR1A	40	47
COc1ccc(N2CCN(C(=O)C(=O)NCCCCC#N)CC2)c(OC)c1	ZINC000875178909	FD	On-Demand	Mild	DRD2	38	47
COc1ccc(N2CCN(C(=O)C(=O)NCCCCC#N)CC2)c(OC)c1	ZINC000875178909	FD	On-Demand	Mild	DRD4	46	36
COc1ccc(N2CCN(C(=O)C(=O)NCCCCC#N)CC2)c(OC)c1	ZINC000875178909	FD	On-Demand	Mild	ADRA1D	25	41
COc1ccc(N2CCN(C(=O)C(=O)NCCCCC#N)CC2)c(OC)c1	ZINC000875178909	FD	On-Demand	Mild	ADRA1A	25	41
COc1ccc(N2CCN(C(=O)C(=O)NCCCCC#N)CC2)c(OC)c1	ZINC000875178909	FD	On-Demand	Mild	DRD3	64	47
O=C(NCc1cccc2ccccc12)N1CCC(CO)(CO)CC1	ZINC000875178910	EE	On-Demand	Anodyne	EPHX2	15	46
O=C(NCc1cccc2ccccc12)N1CCC(CO)(CO)CC1	ZINC000875178910	EE	On-Demand	Anodyne	Q6PRC7_IXORI	47	36
CCCOc1ccc([C@@H](C)NC(=O)NC[C@@H]2CCO[C@@H]2C(=O)OC)cc1	ZINC000875178911	FE	On-Demand	Anodyne	ACACA	20	48
CCCOc1ccc([C@@H](C)NC(=O)NC[C@@H]2CCO[C@@H]2C(=O)OC)cc1	ZINC000875178911	FE	On-Demand	Anodyne	ACACB	20	48
CCCOc1ccc([C@H](C)NC(=O)NC[C@@H]2CCO[C@@H]2C(=O)OC)cc1	ZINC000875178912	FE	On-Demand	Anodyne	ACACA	20	48
CCCOc1ccc([C@H](C)NC(=O)NC[C@@H]2CCO[C@@H]2C(=O)OC)cc1	ZINC000875178912	FE	On-Demand	Anodyne	ACACB	20	48
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1cc(Cl)ccc1Cl	ZINC000875178929	GF	On-Demand	Anodyne	CACNA1H	43	33
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1cc(Cl)ccc1Cl	ZINC000875178929	GF	On-Demand	Anodyne	EPHX2	23	51
O=C(NCCCCN1CCN(c2ncccn2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875178931	GC	On-Demand	Anodyne	HTR1A	49	60
O=C(NCCCCN1CCN(c2ncccn2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875178931	GC	On-Demand	Anodyne	DRD2	48	53
O=C(NCCCCN1CCN(c2ncccn2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875178931	GC	On-Demand	Anodyne	DRD4	23	43
O=C(NCCCCN1CCN(c2ncccn2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875178931	GC	On-Demand	Anodyne	HTR2A	29	47
O=C(NCCCCN1CCN(c2ncccn2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875178931	GC	On-Demand	Anodyne	HTR2C	19	47
O=C(NCCCCN1CCN(c2ncccn2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875178931	GC	On-Demand	Anodyne	DRD3	65	47
O=C(NCCCCN1CCN(c2ncccn2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875178932	GC	On-Demand	Anodyne	HTR1A	49	60
O=C(NCCCCN1CCN(c2ncccn2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875178932	GC	On-Demand	Anodyne	DRD2	48	53
O=C(NCCCCN1CCN(c2ncccn2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875178932	GC	On-Demand	Anodyne	DRD4	23	43
O=C(NCCCCN1CCN(c2ncccn2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875178932	GC	On-Demand	Anodyne	HTR2A	29	47
O=C(NCCCCN1CCN(c2ncccn2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875178932	GC	On-Demand	Anodyne	HTR2C	19	47
O=C(NCCCCN1CCN(c2ncccn2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875178932	GC	On-Demand	Anodyne	DRD3	65	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc2ccccc12	ZINC000875178933	EG	On-Demand	Anodyne	SLC6A4	32	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc2ccccc12	ZINC000875178933	EG	On-Demand	Anodyne	SLC6A3	59	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc2ccccc12	ZINC000875178934	EG	On-Demand	Anodyne	SLC6A4	32	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc2ccccc12	ZINC000875178934	EG	On-Demand	Anodyne	SLC6A3	59	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1c(F)cccc1Cl	ZINC000875178961	EF	On-Demand	Anodyne	SLC6A3	61	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1c(F)cccc1Cl	ZINC000875178961	EF	On-Demand	Anodyne	P2RX7	27	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1c(F)cccc1Cl	ZINC000875178963	EF	On-Demand	Anodyne	SLC6A3	61	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1c(F)cccc1Cl	ZINC000875178963	EF	On-Demand	Anodyne	P2RX7	27	48
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875178971	EF	On-Demand	Anodyne	BMP1	47	39
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875178971	EF	On-Demand	Anodyne	NOS2	99	38
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875178971	EF	On-Demand	Anodyne	MCHR1	24	41
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875178973	EF	On-Demand	Anodyne	BMP1	47	39
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875178973	EF	On-Demand	Anodyne	NOS2	99	38
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875178973	EF	On-Demand	Anodyne	MCHR1	24	41
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875178975	EF	On-Demand	Anodyne	BMP1	47	39
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875178975	EF	On-Demand	Anodyne	NOS2	99	38
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875178975	EF	On-Demand	Anodyne	MCHR1	24	41
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875178977	EF	On-Demand	Anodyne	BMP1	47	39
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875178977	EF	On-Demand	Anodyne	NOS2	99	38
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875178977	EF	On-Demand	Anodyne	MCHR1	24	41
O=C(NCc1ccc(F)cc1F)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875178978	FH	On-Demand	Anodyne	P2RX7	43	40
CCCOc1ccc([C@@H](C)NC(=O)N(C)CCN2CC3(CCOCC3)C2)cc1	ZINC000875178979	GG	On-Demand	Anodyne	ACACA	21	45
CCCOc1ccc([C@@H](C)NC(=O)N(C)CCN2CC3(CCOCC3)C2)cc1	ZINC000875178979	GG	On-Demand	Anodyne	ACACB	22	45
COC(=O)N(C)NC(=O)NCc1ccc(F)cc1F	ZINC000875178980	CD	On-Demand	Reactive	P2RX7	45	44
CCCOc1ccc([C@H](C)NC(=O)N(C)CCN2CC3(CCOCC3)C2)cc1	ZINC000875178981	GG	On-Demand	Anodyne	ACACA	21	45
CCCOc1ccc([C@H](C)NC(=O)N(C)CCN2CC3(CCOCC3)C2)cc1	ZINC000875178981	GG	On-Demand	Anodyne	ACACB	22	45
CCCOc1ccc([C@@H](C)NC(=O)N[C@@H]2CCOC[C@H]2O)cc1	ZINC000875178983	DD	On-Demand	Anodyne	ACACA	25	52
CCCOc1ccc([C@@H](C)NC(=O)N[C@@H]2CCOC[C@H]2O)cc1	ZINC000875178983	DD	On-Demand	Anodyne	ACACB	27	52
CCOc1ccccc1[C@H](C)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875179004	DF	On-Demand	Anodyne	HCN1	51	35
CCOc1ccccc1[C@H](C)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875179004	DF	On-Demand	Anodyne	HCN4	44	35
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(Cl)c1Cl	ZINC000875179006	DG	On-Demand	Anodyne	ANPEP	18	50
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(Cl)c1Cl	ZINC000875179006	DG	On-Demand	Anodyne	P2RX7	29	43
CCOc1ccccc1[C@@H](C)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875179007	DF	On-Demand	Anodyne	HCN1	51	35
CCOc1ccccc1[C@@H](C)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875179007	DF	On-Demand	Anodyne	HCN4	44	35
CCOc1ccccc1[C@H](C)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875179009	DF	On-Demand	Anodyne	HCN1	51	35
CCOc1ccccc1[C@H](C)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875179009	DF	On-Demand	Anodyne	HCN4	44	35
CCOc1ccccc1[C@@H](C)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875179011	DF	On-Demand	Anodyne	HCN1	51	35
CCOc1ccccc1[C@@H](C)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875179011	DF	On-Demand	Anodyne	HCN4	44	35
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1cc(Cl)ccc1Cl	ZINC000875179028	FF	On-Demand	Anodyne	CACNA1H	68	42
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1cc(Cl)ccc1Cl	ZINC000875179028	FF	On-Demand	Anodyne	CCR1	46	37
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1cc(Cl)ccc1Cl	ZINC000875179028	FF	On-Demand	Anodyne	EPHX2	16	40
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)C(=O)N[C@@H]1CCOC1	ZINC000875179029	FD	On-Demand	Anodyne	SIGMAR1	24	45
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)C(=O)N[C@H]1CCOC1	ZINC000875179031	FD	On-Demand	Anodyne	SIGMAR1	24	45
C=CC(C)(C)CCNC(=O)C(=O)NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000875179037	GE	On-Demand	Mild	GPR119	24	41
C=CC(C)(C)CCNC(=O)C(=O)NCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000875179039	GE	On-Demand	Mild	GPR119	24	41
CC(=O)C1CCN(C(=O)C(=O)NCC2(N3CCCC3)CCOCC2)CC1	ZINC000875179040	FC	On-Demand	Anodyne	HCN1	41	31
CC(=O)C1CCN(C(=O)C(=O)NCC2(N3CCCC3)CCOCC2)CC1	ZINC000875179040	FC	On-Demand	Anodyne	HCN4	41	31
O=C(NCc1ccc(F)cc1F)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875179079	EG	On-Demand	Anodyne	P2RX7	39	42
O=C(NCc1cccc(Cl)c1Cl)NC[C@H]1C[C@H](O)C1	ZINC000875179084	DF	On-Demand	Anodyne	P2RX7	48	46
O=C(NCc1ccccc1Br)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875179085	GG	On-Demand	Anodyne	EPHX2	21	44
O=C(NCc1ccccc1Br)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875179086	GG	On-Demand	Anodyne	EPHX2	21	44
O=C(N[C@@H]1CCN(CC2CC2)C1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875179101	FD	On-Demand	Anodyne	FKBP1A	18	40
O=C(N[C@@H]1CCN(CC2CC2)C1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875179102	FD	On-Demand	Anodyne	FKBP1A	18	40
O=C(N[C@@H]1CCN(CC2CC2)C1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875179103	FD	On-Demand	Anodyne	FKBP1A	18	40
O=C(N[C@@H]1CCN(CC2CC2)C1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875179104	FD	On-Demand	Anodyne	FKBP1A	18	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)CCc1ccc2c(c1)OCO2	ZINC000875179120	EF	On-Demand	Anodyne	BMP1	51	37
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)CCc1ccc2c(c1)OCO2	ZINC000875179120	EF	On-Demand	Anodyne	NOS2	52	33
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)CCc1ccc2c(c1)OCO2	ZINC000875179122	EF	On-Demand	Anodyne	BMP1	51	37
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)CCc1ccc2c(c1)OCO2	ZINC000875179122	EF	On-Demand	Anodyne	NOS2	52	33
CCCCCCCNC(=O)C(=O)N[C@@H]1CCOC1	ZINC000875179127	CC	On-Demand	Mild	EPHX2	16	48
CCCCCCCNC(=O)C(=O)N[C@@H]1CCOC1	ZINC000875179127	CC	On-Demand	Mild	ASAH1	49	35
CCCCCCCNC(=O)C(=O)N[C@@H]1CCOC1	ZINC000875179127	CC	On-Demand	Mild	LASR	54	35
CCCCCCCNC(=O)C(=O)N[C@H]1CCOC1	ZINC000875179128	CC	On-Demand	Mild	EPHX2	16	48
CCCCCCCNC(=O)C(=O)N[C@H]1CCOC1	ZINC000875179128	CC	On-Demand	Mild	ASAH1	49	35
CCCCCCCNC(=O)C(=O)N[C@H]1CCOC1	ZINC000875179128	CC	On-Demand	Mild	LASR	54	35
CC(=O)C1CCN(C(=O)C(=O)NCC(C)(C)c2ccc(F)cc2)CC1	ZINC000875179152	EE	On-Demand	Anodyne	CACNA1G	41	54
CN1CCN(C(=O)NCc2ccc(F)cc2F)CCC1(C)C	ZINC000875179153	DF	On-Demand	Anodyne	CACNA1H	45	37
CN1CCN(C(=O)NCc2ccc(F)cc2F)CCC1(C)C	ZINC000875179153	DF	On-Demand	Anodyne	P2RX7	48	39
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1Br	ZINC000875179164	EF	On-Demand	Anodyne	ANPEP	36	63
Cc1ccccc1CN1CCO[C@@H](CNC(=O)C(=O)N[C@H]2CCOC2)C1	ZINC000875179170	FC	On-Demand	Anodyne	DRD4	17	43
Cc1ccccc1CN1CCO[C@@H](CNC(=O)C(=O)N[C@@H]2CCOC2)C1	ZINC000875179171	FC	On-Demand	Anodyne	DRD4	17	43
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(F)cc2F)C1	ZINC000875179183	EE	On-Demand	Anodyne	P2RX7	53	40
O=C(NCc1cccc(Cl)c1Cl)N1CCC(CO)(CO)CC1	ZINC000875179190	EE	On-Demand	Anodyne	P2RX7	45	46
O=C(NCc1cccc(Cl)c1Cl)N1CCC(CO)(CO)CC1	ZINC000875179190	EE	On-Demand	Anodyne	EPHX2	17	50
COC(=O)N(C)NC(=O)NCc1cccc(Cl)c1Cl	ZINC000875179193	DE	On-Demand	Reactive	P2RX7	32	44
CCC[C@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccccn1	ZINC000875179206	GD	On-Demand	Anodyne	L3MBTL3	47	37
CCC[C@@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccccn1	ZINC000875179207	GD	On-Demand	Anodyne	L3MBTL3	47	37
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccccc2Br)C1	ZINC000875179209	FF	On-Demand	Anodyne	AMP1_PLAFQ	47	36
Cc1nnc(NNC(=O)NCc2cccc(Cl)c2Cl)n1C	ZINC000875179244	EE	On-Demand	Reactive	P2RX7	66	45
CN(C)C[C@@H]1CN(C(=O)NCc2c(F)cccc2Cl)C[C@H]1CN(C)C	ZINC000875179247	FE	On-Demand	Anodyne	P2RX7	25	48
O=C(N[C@H]1CCOC1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875179268	DD	On-Demand	Anodyne	OXTR	40	35
O=C(N[C@@H]1CCOC1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875179269	DD	On-Demand	Anodyne	OXTR	40	35
O=C(N[C@H]1CCOC1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875179270	DD	On-Demand	Anodyne	OXTR	40	35
O=C(N[C@@H]1CCOC1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875179271	DD	On-Demand	Anodyne	OXTR	40	35
O=C(NCc1ccc(F)cc1F)NC[C@H]1C[C@H](O)C1	ZINC000875179272	CD	On-Demand	Anodyne	P2RX7	48	41
COC(=O)C1(O)CN(C(=O)NCc2cccc(Cl)c2Cl)C1	ZINC000875179277	ED	On-Demand	Anodyne	P2RX7	46	46
COC(=O)C1(O)CN(C(=O)N[C@@H](C)c2ccc(OC)cc2)C1	ZINC000875179287	DC	On-Demand	Anodyne	ACACB	26	40
COC(=O)C1(O)CN(C(=O)N[C@H](C)c2ccc(OC)cc2)C1	ZINC000875179288	DC	On-Demand	Anodyne	ACACB	26	40
CN(CCNC(=O)C(=O)NCc1ccc(OC(F)F)cc1F)C1CCCC1	ZINC000875179319	GE	On-Demand	Anodyne	TRPV1	40	35
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NCCN(C)C2CCCC2)CCO1	ZINC000875179337	GD	On-Demand	Anodyne	MBTPS1	40	31
COc1ccccc1[C@H]1CN(C(=O)C(=O)NCCN(C)C2CCCC2)CCO1	ZINC000875179338	GD	On-Demand	Anodyne	MBTPS1	40	31
CCC[C@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1ccc(Cl)c(Cl)c1	ZINC000875179368	GI	On-Demand	Anodyne	CACNA1H	54	41
CN1CCN(C2CCN(C(=O)N[C@H]3CCC(C)(C)c4ccccc43)CC2)CC1	ZINC000875179371	GG	On-Demand	Anodyne	CALCRL	44	35
CN1CCN(C2CCN(C(=O)N[C@H]3CCC(C)(C)c4ccccc43)CC2)CC1	ZINC000875179371	GG	On-Demand	Anodyne	L3MBTL3	73	41
CN1CCN(C2CCN(C(=O)N[C@@H]3CCC(C)(C)c4ccccc43)CC2)CC1	ZINC000875179372	GG	On-Demand	Anodyne	CALCRL	44	35
CN1CCN(C2CCN(C(=O)N[C@@H]3CCC(C)(C)c4ccccc43)CC2)CC1	ZINC000875179372	GG	On-Demand	Anodyne	L3MBTL3	73	41
CN(C)C[C@@H]1CN(C(=O)NCc2cc3ccccc3[nH]2)C[C@H]1CN(C)C	ZINC000875179400	FE	On-Demand	Anodyne	AKR1C3	16	40
COc1ccccc1[C@H]1CCCN(C(=O)NCCS(=O)(=O)NC(C)C)CC1	ZINC000875179459	GE	On-Demand	Anodyne	HTR1A	15	40
COc1ccccc1[C@H]1CCCN(C(=O)NCCS(=O)(=O)NC(C)C)CC1	ZINC000875179459	GE	On-Demand	Anodyne	DRD2	18	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCCS(=O)(=O)NC(C)C)CC1	ZINC000875179460	GE	On-Demand	Anodyne	HTR1A	15	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCCS(=O)(=O)NC(C)C)CC1	ZINC000875179460	GE	On-Demand	Anodyne	DRD2	18	43
CN(C)C[C@@H]1CN(C(=O)NCCCc2cccc(Cl)c2)C[C@H]1CN(C)C	ZINC000875179512	GF	On-Demand	Anodyne	SLC6A5	15	40
CN1CCC(N(C(=O)CC(F)(F)C(F)(F)F)c2ccccc2)CC1	ZINC000875179528	FH	On-Demand	Anodyne	OPRD1	16	50
CCO[C@H](C(=O)N(c1ccccc1)C1CCN(C)CC1)C1CCOCC1	ZINC000875179539	FF	On-Demand	Anodyne	AMY2	44	31
CCO[C@@H](C(=O)N(c1ccccc1)C1CCN(C)CC1)C1CCOCC1	ZINC000875179541	FF	On-Demand	Anodyne	AMY2	44	31
O=C(NCCCN1CCCCC1=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875179550	GD	On-Demand	Anodyne	TYRO3	20	42
O=C(NCCCN1CCCCC1=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875179551	GD	On-Demand	Anodyne	TYRO3	20	42
O=C(NCCCN1CCCCC1=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875179552	GD	On-Demand	Anodyne	TYRO3	20	42
O=C(NCCCN1CCCCC1=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875179553	GD	On-Demand	Anodyne	TYRO3	20	42
COCCCCCNC(=O)NC1CC(C(=O)OC)C1	ZINC000875179556	CD	On-Demand	Anodyne	EPHX2	28	59
COCCCCCNC(=O)NC1CC(Nc2ccccc2)C1	ZINC000875179562	DF	On-Demand	Anodyne	EPHX2	36	49
CC[C@@H](NC(=O)NCCCCCOC)[C@@H](O)c1ccccc1	ZINC000875179564	DF	On-Demand	Anodyne	C3AR1	43	31
CC[C@@H](NC(=O)NCCCCCOC)[C@@H](O)c1ccccc1	ZINC000875179564	DF	On-Demand	Anodyne	TACR3	43	40
CC[C@@H](NC(=O)NCCCCCOC)[C@@H](O)c1ccccc1	ZINC000875179564	DF	On-Demand	Anodyne	SOAT1	21	41
CC[C@@H](NC(=O)NCCCCCOC)[C@H](O)c1ccccc1	ZINC000875179566	DF	On-Demand	Anodyne	C3AR1	43	31
CC[C@@H](NC(=O)NCCCCCOC)[C@H](O)c1ccccc1	ZINC000875179566	DF	On-Demand	Anodyne	TACR3	43	40
CC[C@@H](NC(=O)NCCCCCOC)[C@H](O)c1ccccc1	ZINC000875179566	DF	On-Demand	Anodyne	SOAT1	21	41
COCCCCCNC(=O)N1Cc2cccc(O)c2C1	ZINC000875179573	CE	On-Demand	Clean	ASAH1	61	32
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)Cn2nccc2C)cc1	ZINC000875179618	ED	On-Demand	Mild	F13A1	50	37
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCN2CCCCC2=O)C1	ZINC000875179634	EC	On-Demand	Anodyne	TYRO3	20	42
O=C(NCCCc1cccc(Cl)c1)N1CCC(CO)(CO)CC1	ZINC000875179637	EE	On-Demand	Anodyne	EPHX2	19	45
N#Cc1cccc([C@H](NC(=O)NCC(=O)NC2CCCCC2)C(F)(F)F)c1	ZINC000875179645	GF	On-Demand	Mild	FAAH	15	47
N#Cc1cccc([C@H](NC(=O)NCC(=O)NC2CCCCC2)C(F)(F)F)c1	ZINC000875179645	GF	On-Demand	Mild	CCR2	40	41
N#Cc1cccc([C@H](NC(=O)NCC(=O)NC2CCCCC2)C(F)(F)F)c1	ZINC000875179645	GF	On-Demand	Mild	MCHR1	18	40
N#Cc1cccc([C@@H](NC(=O)NCC(=O)NC2CCCCC2)C(F)(F)F)c1	ZINC000875179647	GF	On-Demand	Mild	FAAH	15	47
N#Cc1cccc([C@@H](NC(=O)NCC(=O)NC2CCCCC2)C(F)(F)F)c1	ZINC000875179647	GF	On-Demand	Mild	CCR2	40	41
N#Cc1cccc([C@@H](NC(=O)NCC(=O)NC2CCCCC2)C(F)(F)F)c1	ZINC000875179647	GF	On-Demand	Mild	MCHR1	18	40
CN(Cc1ccns1)C(=O)NCc1ccc(N(C)C)c(F)c1	ZINC000875179650	DF	On-Demand	Clean	UL54	74	34
C[C@@H](CC(=O)N(c1ccccc1)C1CCN(C)CC1)NC(=O)OC(C)(C)C	ZINC000875179669	GG	On-Demand	Anodyne	PGC	49	32
C[C@@H](CC(=O)N(c1ccccc1)C1CCN(C)CC1)NC(=O)OC(C)(C)C	ZINC000875179669	GG	On-Demand	Anodyne	AMY2	45	30
C[C@@H](CC(=O)N(c1ccccc1)C1CCN(C)CC1)NC(=O)OC(C)(C)C	ZINC000875179669	GG	On-Demand	Anodyne	REN	48	36
C[C@@H](CC(=O)N(c1ccccc1)C1CCN(C)CC1)NC(=O)OC(C)(C)C	ZINC000875179669	GG	On-Demand	Anodyne	FPR1	46	36
O=C(NCCCN1CCCCC1=O)C(=O)NCc1ccc(Br)cn1	ZINC000875179670	GC	On-Demand	Anodyne	TYRO3	21	40
CCCCCCCNC(=O)C(=O)N[C@H](C)[C@H](C)N1CCOCC1	ZINC000875179682	ED	On-Demand	Mild	ASAH1	77	45
CCCCCCCNC(=O)C(=O)N[C@@H](C)[C@H](C)N1CCOCC1	ZINC000875179683	ED	On-Demand	Mild	ASAH1	77	45
CCCCCCCNC(=O)C(=O)N[C@H](C)[C@@H](C)N1CCOCC1	ZINC000875179685	ED	On-Demand	Mild	ASAH1	77	45
CCCCCCCNC(=O)C(=O)N[C@@H](C)[C@@H](C)N1CCOCC1	ZINC000875179686	ED	On-Demand	Mild	ASAH1	77	45
COCCCCCNC(=O)NC[C@H]1CN(Cc2ccccc2C)CCO1	ZINC000875179712	FE	On-Demand	Anodyne	DRD4	22	40
C[C@H]1CC(=O)N[C@@H](C(=O)N2Cc3ccccc3C[C@H]2C(=O)NCCN(C)C)C1	ZINC000875179713	GC	On-Demand	Anodyne	OPRM1	18	43
C[C@H]1CC(=O)N[C@@H](C(=O)N2Cc3ccccc3C[C@H]2C(=O)NCCN(C)C)C1	ZINC000875179713	GC	On-Demand	Anodyne	OPRD1	60	43
C[C@H]1CC(=O)N[C@@H](C(=O)N2Cc3ccccc3C[C@H]2C(=O)NCCN(C)C)C1	ZINC000875179713	GC	On-Demand	Anodyne	CFTR	62	33
C[C@H]1CC(=O)N[C@@H](C(=O)N2Cc3ccccc3C[C@H]2C(=O)NCCN(C)C)C1	ZINC000875179713	GC	On-Demand	Anodyne	ADAM9	59	33
C[C@H]1CC(=O)N[C@@H](C(=O)N2Cc3ccccc3C[C@@H]2C(=O)NCCN(C)C)C1	ZINC000875179714	GC	On-Demand	Anodyne	OPRM1	18	43
C[C@H]1CC(=O)N[C@@H](C(=O)N2Cc3ccccc3C[C@@H]2C(=O)NCCN(C)C)C1	ZINC000875179714	GC	On-Demand	Anodyne	OPRD1	60	43
C[C@H]1CC(=O)N[C@@H](C(=O)N2Cc3ccccc3C[C@@H]2C(=O)NCCN(C)C)C1	ZINC000875179714	GC	On-Demand	Anodyne	CFTR	62	33
C[C@H]1CC(=O)N[C@@H](C(=O)N2Cc3ccccc3C[C@@H]2C(=O)NCCN(C)C)C1	ZINC000875179714	GC	On-Demand	Anodyne	ADAM9	59	33
COCCCCCNC(=O)NC[C@@H]1CN(Cc2ccccc2C)CCO1	ZINC000875179715	FE	On-Demand	Anodyne	DRD4	22	40
N#Cc1cccc([C@H](NC(=O)NCC(=O)NC2CCCC2)C(F)(F)F)c1	ZINC000875179718	FF	On-Demand	Mild	CCR2	43	42
N#Cc1cccc([C@H](NC(=O)NCC(=O)NC2CCCC2)C(F)(F)F)c1	ZINC000875179718	FF	On-Demand	Mild	MCHR1	19	40
N#Cc1cccc([C@@H](NC(=O)NCC(=O)NC2CCCC2)C(F)(F)F)c1	ZINC000875179719	FF	On-Demand	Mild	CCR2	43	42
N#Cc1cccc([C@@H](NC(=O)NCC(=O)NC2CCCC2)C(F)(F)F)c1	ZINC000875179719	FF	On-Demand	Mild	MCHR1	19	40
CCn1ncnc1-c1ccc(C(=O)N(c2ccccc2)C2CCN(C)CC2)cc1	ZINC000875179732	GH	On-Demand	Anodyne	OPRD1	20	40
COCCCCCNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875179763	EG	On-Demand	Anodyne	KCNA3	41	42
COCCCCCNC(=O)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875179786	CE	On-Demand	Anodyne	EPHX2	19	43
COCCCCCNC(=O)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875179787	CE	On-Demand	Anodyne	EPHX2	19	43
COCCCCCNC(=O)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875179788	CE	On-Demand	Anodyne	EPHX2	19	43
COCCCCCNC(=O)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875179789	CE	On-Demand	Anodyne	EPHX2	19	43
CN1CCC(N(C(=O)c2coc(C(C)(C)C)n2)c2ccccc2)CC1	ZINC000875179800	EH	On-Demand	Anodyne	HTR1F	50	35
CCC1(N(C)C)CCN(C(=O)NCc2ccc(N(C)C)c(F)c2)CC1	ZINC000875179810	FF	On-Demand	Clean	CACNA1H	49	33
O=C(NCCCN1CCCCC1=O)C(=O)NCc1cccc2ncccc12	ZINC000875179829	FD	On-Demand	Anodyne	HNMT	68	37
O=C(NCCCN1CCCCC1=O)C(=O)NCc1cccc2ncccc12	ZINC000875179829	FD	On-Demand	Anodyne	TYRO3	20	40
Cc1nnc(NNC(=O)NCCCc2cccc(Cl)c2)n1C	ZINC000875179842	DE	On-Demand	Reactive	SCNN1A	43	38
N#C[C@@]1(C(=O)Oc2cccc(NC(=O)c3ccccc3)c2)CCCOC1	ZINC000875179864	FG	On-Demand	Mild	KCNK3	100	45
N#C[C@@]1(C(=O)Oc2cccc(NC(=O)c3ccccc3)c2)CCCOC1	ZINC000875179864	FG	On-Demand	Mild	KCNK9	50	37
N#C[C@]1(C(=O)Oc2cccc(NC(=O)c3ccccc3)c2)CCCOC1	ZINC000875179865	FG	On-Demand	Mild	KCNK3	100	45
N#C[C@]1(C(=O)Oc2cccc(NC(=O)c3ccccc3)c2)CCCOC1	ZINC000875179865	FG	On-Demand	Mild	KCNK9	50	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC(C)(C)c1ccc(OC)cc1	ZINC000875179874	FF	On-Demand	Anodyne	SLC6A4	22	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC(C)(C)c1ccc(OC)cc1	ZINC000875179874	FF	On-Demand	Anodyne	SLC6A3	39	42
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)C2(F)CCOCC2)cc1	ZINC000875179888	FD	On-Demand	Mild	MMP13	19	42
Cc1ccnn1CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NCCN(C)C	ZINC000875179904	FC	On-Demand	Anodyne	OPRM1	19	45
Cc1ccnn1CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NCCN(C)C	ZINC000875179904	FC	On-Demand	Anodyne	OPRD1	73	45
Cc1ccnn1CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NCCN(C)C	ZINC000875179904	FC	On-Demand	Anodyne	CFTR	59	37
Cc1ccnn1CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NCCN(C)C	ZINC000875179904	FC	On-Demand	Anodyne	ADAM9	58	33
Cc1ccnn1CC(=O)N1Cc2ccccc2C[C@H]1C(=O)NCCN(C)C	ZINC000875179905	FC	On-Demand	Anodyne	OPRM1	19	45
Cc1ccnn1CC(=O)N1Cc2ccccc2C[C@H]1C(=O)NCCN(C)C	ZINC000875179905	FC	On-Demand	Anodyne	OPRD1	73	45
Cc1ccnn1CC(=O)N1Cc2ccccc2C[C@H]1C(=O)NCCN(C)C	ZINC000875179905	FC	On-Demand	Anodyne	CFTR	59	37
Cc1ccnn1CC(=O)N1Cc2ccccc2C[C@H]1C(=O)NCCN(C)C	ZINC000875179905	FC	On-Demand	Anodyne	ADAM9	58	33
COCCCCCNC(=O)N1CC[C@@H](O)[C@H]1c1ccc(Br)cc1	ZINC000875179918	GG	On-Demand	Anodyne	ASAH1	52	33
CN1CCN(C2CCN(C(=O)NCc3ccc(N(C)C)c(F)c3)CC2)CC1	ZINC000875179919	GD	On-Demand	Clean	L3MBTL3	75	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(N(C)C)c(F)c1	ZINC000875179953	EE	On-Demand	Clean	SLC6A3	51	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(N(C)C)c(F)c1	ZINC000875179954	EE	On-Demand	Clean	SLC6A3	51	37
COCCCCCNC(=O)NC1(C)CC(F)(F)C1	ZINC000875179964	CE	On-Demand	Anodyne	EPHX2	24	49
CCO[C@H](C(=O)N(c1ccccc1)C1CCN(C)CC1)C1CCCC1	ZINC000875180000	EH	On-Demand	Anodyne	OPRD1	15	46
CCO[C@H](C(=O)N(c1ccccc1)C1CCN(C)CC1)C1CCCC1	ZINC000875180000	EH	On-Demand	Anodyne	AMY2	52	37
CCO[C@@H](C(=O)N(c1ccccc1)C1CCN(C)CC1)C1CCCC1	ZINC000875180001	EH	On-Demand	Anodyne	OPRD1	15	46
CCO[C@@H](C(=O)N(c1ccccc1)C1CCN(C)CC1)C1CCCC1	ZINC000875180001	EH	On-Demand	Anodyne	AMY2	52	37
COCCCCCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875180004	EE	On-Demand	Anodyne	HRH2	23	41
COCCCCCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875180004	EE	On-Demand	Anodyne	MAOB	17	42
COCCCCCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875180004	EE	On-Demand	Anodyne	ADRB3	31	40
COCCCCCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875180004	EE	On-Demand	Anodyne	CTSV	30	42
COCCCCCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875180005	EE	On-Demand	Anodyne	HRH2	23	41
COCCCCCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875180005	EE	On-Demand	Anodyne	MAOB	17	42
COCCCCCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875180005	EE	On-Demand	Anodyne	ADRB3	31	40
COCCCCCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875180005	EE	On-Demand	Anodyne	CTSV	30	42
CCC[C@H](NC(=O)N(C)CCS(N)(=O)=O)c1ccc(Cl)c(Cl)c1	ZINC000875180015	GF	On-Demand	Anodyne	UTS2	58	33
COCCN(CC1CCN(C)CC1)C(=O)NCC(C)(C)c1ccc(OC)cc1	ZINC000875180033	GF	On-Demand	Anodyne	MMP3	20	40
COCCN(CC1CCN(C)CC1)C(=O)NCC(C)(C)c1ccc(OC)cc1	ZINC000875180033	GF	On-Demand	Anodyne	MMP1	19	40
COC(=O)[C@@]12C[C@@H](NC(=O)NCC(=O)NC3CCCCC3)C[C@@H]1C2	ZINC000875180050	ED	On-Demand	Anodyne	EPHX2	17	43
Cc1ccn(C[C@H](C)C(=O)N2Cc3ccccc3C[C@H]2C(=O)NCCN(C)C)n1	ZINC000875180080	GD	On-Demand	Anodyne	OPRM1	24	48
Cc1ccn(C[C@H](C)C(=O)N2Cc3ccccc3C[C@H]2C(=O)NCCN(C)C)n1	ZINC000875180080	GD	On-Demand	Anodyne	OPRD1	84	48
Cc1ccn(C[C@H](C)C(=O)N2Cc3ccccc3C[C@H]2C(=O)NCCN(C)C)n1	ZINC000875180080	GD	On-Demand	Anodyne	CFTR	49	34
Cc1ccn(C[C@H](C)C(=O)N2Cc3ccccc3C[C@H]2C(=O)NCCN(C)C)n1	ZINC000875180080	GD	On-Demand	Anodyne	ADAM9	48	31
Cc1ccn(C[C@H](C)C(=O)N2Cc3ccccc3C[C@@H]2C(=O)NCCN(C)C)n1	ZINC000875180081	GD	On-Demand	Anodyne	OPRM1	24	48
Cc1ccn(C[C@H](C)C(=O)N2Cc3ccccc3C[C@@H]2C(=O)NCCN(C)C)n1	ZINC000875180081	GD	On-Demand	Anodyne	OPRD1	84	48
Cc1ccn(C[C@H](C)C(=O)N2Cc3ccccc3C[C@@H]2C(=O)NCCN(C)C)n1	ZINC000875180081	GD	On-Demand	Anodyne	CFTR	49	34
Cc1ccn(C[C@H](C)C(=O)N2Cc3ccccc3C[C@@H]2C(=O)NCCN(C)C)n1	ZINC000875180081	GD	On-Demand	Anodyne	ADAM9	48	31
Cc1ccn(C[C@@H](C)C(=O)N2Cc3ccccc3C[C@@H]2C(=O)NCCN(C)C)n1	ZINC000875180082	GD	On-Demand	Anodyne	OPRM1	24	48
Cc1ccn(C[C@@H](C)C(=O)N2Cc3ccccc3C[C@@H]2C(=O)NCCN(C)C)n1	ZINC000875180082	GD	On-Demand	Anodyne	OPRD1	84	48
Cc1ccn(C[C@@H](C)C(=O)N2Cc3ccccc3C[C@@H]2C(=O)NCCN(C)C)n1	ZINC000875180082	GD	On-Demand	Anodyne	CFTR	49	34
Cc1ccn(C[C@@H](C)C(=O)N2Cc3ccccc3C[C@@H]2C(=O)NCCN(C)C)n1	ZINC000875180082	GD	On-Demand	Anodyne	ADAM9	48	31
Cc1ccn(C[C@@H](C)C(=O)N2Cc3ccccc3C[C@H]2C(=O)NCCN(C)C)n1	ZINC000875180083	GD	On-Demand	Anodyne	OPRM1	24	48
Cc1ccn(C[C@@H](C)C(=O)N2Cc3ccccc3C[C@H]2C(=O)NCCN(C)C)n1	ZINC000875180083	GD	On-Demand	Anodyne	OPRD1	84	48
Cc1ccn(C[C@@H](C)C(=O)N2Cc3ccccc3C[C@H]2C(=O)NCCN(C)C)n1	ZINC000875180083	GD	On-Demand	Anodyne	CFTR	49	34
Cc1ccn(C[C@@H](C)C(=O)N2Cc3ccccc3C[C@H]2C(=O)NCCN(C)C)n1	ZINC000875180083	GD	On-Demand	Anodyne	ADAM9	48	31
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCCN1CCCCC1=O	ZINC000875180091	FC	On-Demand	Anodyne	TYRO3	20	43
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCCN1CCCCC1=O	ZINC000875180092	FC	On-Demand	Anodyne	TYRO3	20	43
O=C(NCCCc1cccc(Cl)c1)NC[C@H]1C[C@H](O)C1	ZINC000875180129	CE	On-Demand	Anodyne	SLC6A5	15	40
O=CN1CCCN(C(=O)NCCCc2cccc(Cl)c2)CC1	ZINC000875180137	DE	On-Demand	Anodyne	SLC6A5	16	42
O=CN1CCCN(C(=O)NCCCc2cccc(Cl)c2)CC1	ZINC000875180137	DE	On-Demand	Anodyne	EPHX2	16	41
O=CN1CCCN(C(=O)NCCCc2cccc(Cl)c2)CC1	ZINC000875180137	DE	On-Demand	Anodyne	DPP7	22	43
O=C(NCCCN1CCCCC1=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875180139	GD	On-Demand	Anodyne	OXTR	41	38
O=C(NCCCN1CCCCC1=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875180139	GD	On-Demand	Anodyne	TYRO3	18	41
O=C(NCCCN1CCCCC1=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875180143	GD	On-Demand	Anodyne	OXTR	41	38
O=C(NCCCN1CCCCC1=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875180143	GD	On-Demand	Anodyne	TYRO3	18	41
COCCCCCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875180154	EG	On-Demand	Anodyne	FKBP1A	55	41
COCCCCCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875180154	EG	On-Demand	Anodyne	DRD3	25	41
COCCCCCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875180154	EG	On-Demand	Anodyne	CPT1A	72	33
COCCCCCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875180154	EG	On-Demand	Anodyne	AMY2	44	31
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)c2cccn(C3CC3)c2=O)cc1	ZINC000875180155	GE	On-Demand	Mild	F13A1	61	36
COCCCCCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875180156	EG	On-Demand	Anodyne	FKBP1A	55	41
COCCCCCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875180156	EG	On-Demand	Anodyne	DRD3	25	41
COCCCCCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875180156	EG	On-Demand	Anodyne	CPT1A	72	33
COCCCCCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875180156	EG	On-Demand	Anodyne	AMY2	44	31
COCCCCCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875180157	EG	On-Demand	Anodyne	FKBP1A	55	41
COCCCCCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875180157	EG	On-Demand	Anodyne	DRD3	25	41
COCCCCCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875180157	EG	On-Demand	Anodyne	CPT1A	72	33
COCCCCCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875180157	EG	On-Demand	Anodyne	AMY2	44	31
COCCCCCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875180159	EG	On-Demand	Anodyne	FKBP1A	55	41
COCCCCCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875180159	EG	On-Demand	Anodyne	DRD3	25	41
COCCCCCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875180159	EG	On-Demand	Anodyne	CPT1A	72	33
COCCCCCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875180159	EG	On-Demand	Anodyne	AMY2	44	31
CO[C@H](C(=O)OC(C)(C)C)C(=O)N(c1ccccc1)C1CCN(C)CC1	ZINC000875180179	FE	On-Demand	Anodyne	AMY2	47	32
COCCCCCNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875180191	EE	On-Demand	Anodyne	SCN2A	15	40
COCCCCCNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875180191	EE	On-Demand	Anodyne	ASAH1	43	34
CN(C)CCOc1ccccc1CNC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875180213	GG	On-Demand	Anodyne	EPHX2	24	51
CN(C)CCOc1ccccc1CNC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875180216	GG	On-Demand	Anodyne	EPHX2	24	51
O=C(N[C@H]1COc2ccccc21)N1CC(c2ccccc2)C1	ZINC000875180227	CF	On-Demand	Anodyne	EPHX2	18	45
O=C(N[C@H]1COc2ccccc21)N1CC(c2ccccc2)C1	ZINC000875180227	CF	On-Demand	Anodyne	RBP4	51	36
O=C(N[C@H]1COc2ccccc21)N1CCCC2(CC1)CC2	ZINC000875180230	CG	On-Demand	Anodyne	EPHX2	17	40
O=C(N[C@H]1COc2ccccc21)N1CCC[C@H](OC2CCC2)CC1	ZINC000875180272	EG	On-Demand	Anodyne	EPHX2	24	41
O=C(N[C@H]1COc2ccccc21)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875180273	EG	On-Demand	Anodyne	EPHX2	24	41
CN1CCN(C(=O)NCc2cc3ccccc3[nH]2)CCC1(C)C	ZINC000875180278	DF	On-Demand	Anodyne	HRH4	18	45
COCCCCCNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875180331	EF	On-Demand	Mild	ITK	22	55
COCCCCCNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875180331	EF	On-Demand	Mild	PANC	54	37
CC(=O)N(C)c1ccc(CNC(=O)NCC(=O)NCCc2ccccc2)cc1	ZINC000875180345	GD	On-Demand	Anodyne	CA5B	16	40
CC(=O)N(C)c1ccc(CNC(=O)NCC(=O)NC2CCCCC2)cc1	ZINC000875180353	FD	On-Demand	Anodyne	EPHX2	16	44
C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C(=O)N1Cc2ccccc2C[C@@H]1C(=O)NCCN(C)C	ZINC000875180360	FD	On-Demand	Anodyne	OPRM1	18	44
C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C(=O)N1Cc2ccccc2C[C@@H]1C(=O)NCCN(C)C	ZINC000875180360	FD	On-Demand	Anodyne	OPRD1	61	44
C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C(=O)N1Cc2ccccc2C[C@@H]1C(=O)NCCN(C)C	ZINC000875180360	FD	On-Demand	Anodyne	CFTR	64	34
C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C(=O)N1Cc2ccccc2C[C@@H]1C(=O)NCCN(C)C	ZINC000875180360	FD	On-Demand	Anodyne	ADAM9	56	34
C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C(=O)N1Cc2ccccc2C[C@H]1C(=O)NCCN(C)C	ZINC000875180361	FD	On-Demand	Anodyne	OPRM1	18	44
C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C(=O)N1Cc2ccccc2C[C@H]1C(=O)NCCN(C)C	ZINC000875180361	FD	On-Demand	Anodyne	OPRD1	61	44
C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C(=O)N1Cc2ccccc2C[C@H]1C(=O)NCCN(C)C	ZINC000875180361	FD	On-Demand	Anodyne	CFTR	64	34
C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C(=O)N1Cc2ccccc2C[C@H]1C(=O)NCCN(C)C	ZINC000875180361	FD	On-Demand	Anodyne	ADAM9	56	34
COCCCCCNC(=O)NNc1cccc(C)n1	ZINC000875180362	CD	On-Demand	Reactive	GRM5	19	41
C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C(=O)N1Cc2ccccc2C[C@@H]1C(=O)NCCN(C)C	ZINC000875180364	FD	On-Demand	Anodyne	OPRM1	18	44
C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C(=O)N1Cc2ccccc2C[C@@H]1C(=O)NCCN(C)C	ZINC000875180364	FD	On-Demand	Anodyne	OPRD1	61	44
C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C(=O)N1Cc2ccccc2C[C@@H]1C(=O)NCCN(C)C	ZINC000875180364	FD	On-Demand	Anodyne	CFTR	64	34
C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C(=O)N1Cc2ccccc2C[C@@H]1C(=O)NCCN(C)C	ZINC000875180364	FD	On-Demand	Anodyne	ADAM9	56	34
C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C(=O)N1Cc2ccccc2C[C@H]1C(=O)NCCN(C)C	ZINC000875180365	FD	On-Demand	Anodyne	OPRM1	18	44
C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C(=O)N1Cc2ccccc2C[C@H]1C(=O)NCCN(C)C	ZINC000875180365	FD	On-Demand	Anodyne	OPRD1	61	44
C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C(=O)N1Cc2ccccc2C[C@H]1C(=O)NCCN(C)C	ZINC000875180365	FD	On-Demand	Anodyne	CFTR	64	34
C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C(=O)N1Cc2ccccc2C[C@H]1C(=O)NCCN(C)C	ZINC000875180365	FD	On-Demand	Anodyne	ADAM9	56	34
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)[C@@]23CCCC[C@H]2C3)cc1	ZINC000875180370	EG	On-Demand	Mild	F13A1	40	37
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)[C@]23CCCC[C@@H]2C3)cc1	ZINC000875180371	EG	On-Demand	Mild	F13A1	40	37
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)[C@]23CCCC[C@H]2C3)cc1	ZINC000875180372	EG	On-Demand	Mild	F13A1	40	37
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)[C@@]23CCCC[C@@H]2C3)cc1	ZINC000875180373	EG	On-Demand	Mild	F13A1	40	37
CC[C@H](C[C@H](C)O)NC(=O)NCCc1ccc(OC)cc1OC	ZINC000875180374	DE	On-Demand	Anodyne	NQO2	37	43
CC[C@H](C[C@H](C)O)NC(=O)NCCc1ccc(OC)cc1OC	ZINC000875180374	DE	On-Demand	Anodyne	MTNR1A	99	45
CC[C@H](C[C@H](C)O)NC(=O)NCCc1ccc(OC)cc1OC	ZINC000875180374	DE	On-Demand	Anodyne	MTNR1B	76	42
COCCCCCNC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875180377	BC	On-Demand	Anodyne	EPHX2	28	47
CN1CCN(C2CCN(C(=O)C(=O)NCCN(C)C3CCCC3)CC2)CC1	ZINC000875180379	GC	On-Demand	Anodyne	L3MBTL3	51	40
O=C(NCCCN1CCCCC1=O)C(=O)NCc1ncc(Cl)s1	ZINC000875180381	FC	On-Demand	Anodyne	TYRO3	22	44
O=C(CCCOC1CCOCC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O	ZINC000875180435	GG	On-Demand	Clean	CASP2	17	42
O=C(CCCOC1CCOCC1)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O	ZINC000875180435	GG	On-Demand	Clean	CASP6	18	42
COCCCCCNC(=O)NNc1ccc(OC)cc1Br	ZINC000875180446	FF	On-Demand	Reactive	MTNR1A	54	40
COCCCCCNC(=O)NNc1ccc(OC)cc1Br	ZINC000875180446	FF	On-Demand	Reactive	MTNR1B	45	40
CCO[C@H](C(=O)N(c1ccccc1)C1CCN(C)CC1)[C@@H]1CCOC1	ZINC000875180447	EF	On-Demand	Anodyne	AMY2	45	32
CCO[C@H](C(=O)N(c1ccccc1)C1CCN(C)CC1)[C@H]1CCOC1	ZINC000875180449	EF	On-Demand	Anodyne	AMY2	45	32
CCO[C@@H](C(=O)N(c1ccccc1)C1CCN(C)CC1)[C@H]1CCOC1	ZINC000875180451	EF	On-Demand	Anodyne	AMY2	45	32
CCO[C@@H](C(=O)N(c1ccccc1)C1CCN(C)CC1)[C@@H]1CCOC1	ZINC000875180452	EF	On-Demand	Anodyne	AMY2	45	32
CC(=O)C1CCN(C(=O)NCc2ccc(N(C)C)c(F)c2)CC1	ZINC000875180470	DE	On-Demand	Clean	EPHX2	15	42
CN1CCC(N(C(=O)CCCOC2CCOCC2)c2ccccc2)CC1	ZINC000875180471	FG	On-Demand	Anodyne	CYP2J2	45	32
CCC[C@H](CC)C(=O)N(c1ccccc1)C1CCN(C)CC1	ZINC000875180481	DH	On-Demand	Anodyne	OPRD1	20	47
CCC[C@H](CC)C(=O)N(c1ccccc1)C1CCN(C)CC1	ZINC000875180481	DH	On-Demand	Anodyne	AMY2	44	31
CCOC1CC2(C1)C[C@H]2C(=O)N1Cc2ccccc2C[C@H]1C(=O)NCCN(C)C	ZINC000875180489	GD	On-Demand	Anodyne	OPRM1	15	43
CCOC1CC2(C1)C[C@H]2C(=O)N1Cc2ccccc2C[C@H]1C(=O)NCCN(C)C	ZINC000875180489	GD	On-Demand	Anodyne	OPRD1	55	43
CCOC1CC2(C1)C[C@H]2C(=O)N1Cc2ccccc2C[C@H]1C(=O)NCCN(C)C	ZINC000875180489	GD	On-Demand	Anodyne	CFTR	60	35
CCOC1CC2(C1)C[C@H]2C(=O)N1Cc2ccccc2C[C@H]1C(=O)NCCN(C)C	ZINC000875180489	GD	On-Demand	Anodyne	ADAM9	63	37
CCOC1CC2(C1)C[C@H]2C(=O)N1Cc2ccccc2C[C@@H]1C(=O)NCCN(C)C	ZINC000875180492	GD	On-Demand	Anodyne	OPRM1	15	43
CCOC1CC2(C1)C[C@H]2C(=O)N1Cc2ccccc2C[C@@H]1C(=O)NCCN(C)C	ZINC000875180492	GD	On-Demand	Anodyne	OPRD1	55	43
CCOC1CC2(C1)C[C@H]2C(=O)N1Cc2ccccc2C[C@@H]1C(=O)NCCN(C)C	ZINC000875180492	GD	On-Demand	Anodyne	CFTR	60	35
CCOC1CC2(C1)C[C@H]2C(=O)N1Cc2ccccc2C[C@@H]1C(=O)NCCN(C)C	ZINC000875180492	GD	On-Demand	Anodyne	ADAM9	63	37
C=CCN(C)S(=O)(=O)c1ccc(NC(=O)[C@@H]2CCC(=O)N2C(C)C)cc1	ZINC000875180539	GD	On-Demand	Mild	F13A1	63	36
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(Br)c(F)c1	ZINC000875180542	EF	On-Demand	Anodyne	ANPEP	18	44
O=C(OCC(=O)N1CCN(Cc2cccc3ccccc23)CC1)c1cccc2ncccc12	ZINC000875180576	IH	On-Demand	Anodyne	HTR1B	15	43
COCCCCCNC(=O)N1CCCCCCNC(=O)CC1	ZINC000875180580	DD	On-Demand	Anodyne	ASAH1	52	31
CC[C@@H]1COCCN1CCNC(=O)NCCCCCOC	ZINC000875180589	DD	On-Demand	Anodyne	EPHX2	15	41
O=C(NCCCc1cccc(Cl)c1)N1Cc2cccc(O)c2C1	ZINC000875180616	EH	On-Demand	Clean	SLC6A5	16	40
O=C(Nc1ccc(Cl)c2cccnc12)c1cc(S(=O)(=O)N2CCCC2)ccc1Br	ZINC000875180623	JJ	On-Demand	Anodyne	G2YM83_BOTF4	42	30
O=C(CNC(=O)NCc1ccc(O)c(Cl)c1)NC1CCCCC1	ZINC000875180642	EE	On-Demand	Anodyne	EPHX2	19	46
O=C(CNC(=O)NCc1ccc(O)c(Cl)c1)NC1CCCCC1	ZINC000875180642	EE	On-Demand	Anodyne	NCE103	17	46
COC(=O)N(C)NC(=O)NCCCc1cccc(Cl)c1	ZINC000875180647	CE	On-Demand	Reactive	MTNR1A	37	46
COC(=O)N(C)NC(=O)NCCCc1cccc(Cl)c1	ZINC000875180647	CE	On-Demand	Reactive	MTNR1B	32	46
COC(=O)N(C)NC(=O)NCCCc1cccc(Cl)c1	ZINC000875180647	CE	On-Demand	Reactive	CRTM	56	43
COCCCCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875180671	EH	On-Demand	Anodyne	HTR1A	33	42
COCCCCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875180671	EH	On-Demand	Anodyne	DRD2	41	46
COCCCCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875180671	EH	On-Demand	Anodyne	DRD4	24	46
COCCCCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875180671	EH	On-Demand	Anodyne	HTR1D	15	42
COCCCCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875180671	EH	On-Demand	Anodyne	HTR1B	17	42
COCCCCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875180671	EH	On-Demand	Anodyne	DRD3	51	39
COCCCCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875180671	EH	On-Demand	Anodyne	KCNA3	40	41
COCCCCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875180671	EH	On-Demand	Anodyne	RBP4	29	40
COCCCCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875180674	EH	On-Demand	Anodyne	HTR1A	33	42
COCCCCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875180674	EH	On-Demand	Anodyne	DRD2	41	46
COCCCCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875180674	EH	On-Demand	Anodyne	DRD4	24	46
COCCCCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875180674	EH	On-Demand	Anodyne	HTR1D	15	42
COCCCCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875180674	EH	On-Demand	Anodyne	HTR1B	17	42
COCCCCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875180674	EH	On-Demand	Anodyne	DRD3	51	39
COCCCCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875180674	EH	On-Demand	Anodyne	KCNA3	40	41
COCCCCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875180674	EH	On-Demand	Anodyne	RBP4	29	40
C[C@H](NC(=O)C(=O)NCCN(C)C1CCCC1)c1ccc(C(F)(F)F)nc1	ZINC000875180678	GE	On-Demand	Anodyne	TRPV1	50	35
CCC[C@H](NC(=O)N1CCCN(C=O)CC1)c1ccc(Cl)c(Cl)c1	ZINC000875180690	FH	On-Demand	Anodyne	MAPK1	44	40
COCCCCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875180695	DF	On-Demand	Anodyne	TRY1_BOVIN	47	34
COCCCCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875180696	DF	On-Demand	Anodyne	TRY1_BOVIN	47	34
COCCCCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875180697	DF	On-Demand	Anodyne	TRY1_BOVIN	47	34
COCCCCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875180699	DF	On-Demand	Anodyne	TRY1_BOVIN	47	34
COCC(C)(C)CCNC(=O)C(=O)NCCCN1CCCCC1=O	ZINC000875180725	EC	On-Demand	Anodyne	TYRO3	19	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCCOC)C1	ZINC000875180729	DD	On-Demand	Anodyne	ASAH1	43	34
COc1cccc([C@H](O)C2CCN(C(=O)NCc3cc4ccccc4[nH]3)CC2)c1	ZINC000875180736	GH	On-Demand	Anodyne	GRIN2B	15	43
CONC(=O)C1CCN(C(=O)NCc2ccc(N(C)C)c(F)c2)CC1	ZINC000875180751	FD	On-Demand	Clean	EPHX2	15	43
CCOC(=O)[C@@H]1CC[C@H](C(=O)N(c2ccccc2)C2CCN(C)CC2)C1	ZINC000875180773	FG	On-Demand	Anodyne	OPRD1	15	48
CCOC(=O)[C@@H]1CC[C@H](C(=O)N(c2ccccc2)C2CCN(C)CC2)C1	ZINC000875180773	FG	On-Demand	Anodyne	AMY2	43	30
C[C@@H](CN(C)C(=O)NCc1cc2ccccc2[nH]1)NC(=O)OC(C)(C)C	ZINC000875180813	FG	On-Demand	Anodyne	FPR1	44	36
CONC(=O)C1CCN(C(=O)NCC(C)(C)c2ccc(OC)cc2)CC1	ZINC000875180836	FE	On-Demand	Anodyne	MTNR1A	20	42
CONC(=O)C1CCN(C(=O)NCC(C)(C)c2ccc(OC)cc2)CC1	ZINC000875180836	FE	On-Demand	Anodyne	MTNR1B	20	42
CONC(=O)C1CCN(C(=O)NCC(C)(C)c2ccc(OC)cc2)CC1	ZINC000875180836	FE	On-Demand	Anodyne	CACNA1G	34	46
COCCCCCNC(=O)N[C@@H]1CC(C)(C)CC[C@H]1O	ZINC000875180850	CE	On-Demand	Anodyne	EPHX2	24	49
COCCCCCNC(=O)N[C@@H]1C[C@H]2C[C@@]2(C(=O)OC)C1	ZINC000875180859	CD	On-Demand	Anodyne	EPHX2	26	46
COCCCCCNC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875180869	DE	On-Demand	Anodyne	ASAH1	48	34
COCCCCCNC(=O)NC1([C@@H]2CCCCO2)CCC1	ZINC000875180877	CF	On-Demand	Anodyne	EPHX2	20	47
COCCCCCNC(=O)NC1([C@H]2CCCCO2)CCC1	ZINC000875180879	CF	On-Demand	Anodyne	EPHX2	20	47
CN1CCC(CNC(=O)NCC(=O)NC2CCCCC2)(c2ccccc2)CC1	ZINC000875180884	GE	On-Demand	Anodyne	KCNA3	51	48
CN1CCC(CNC(=O)NCC(=O)NC2CCCCC2)(c2ccccc2)CC1	ZINC000875180884	GE	On-Demand	Anodyne	SOAT1	15	45
CN1CCC(CNC(=O)NCC(=O)NC2CCCCC2)(c2ccccc2)CC1	ZINC000875180884	GE	On-Demand	Anodyne	EPHX2	33	42
CN1CCC(CNC(=O)NCC(=O)NC2CCCCC2)(c2ccccc2)CC1	ZINC000875180884	GE	On-Demand	Anodyne	NPFFR1	29	44
CN1CCC(CNC(=O)NCC(=O)NC2CCCCC2)(c2ccccc2)CC1	ZINC000875180884	GE	On-Demand	Anodyne	HCN1	44	34
COCCCCCNC(=O)N1CCCSC[C@H]1c1ccccc1OC	ZINC000875180939	FH	On-Demand	Anodyne	DRD3	41	38
COCCCCCNC(=O)N1CCCSC[C@@H]1c1ccccc1OC	ZINC000875180940	FH	On-Demand	Anodyne	DRD3	41	38
COCCCCCNC(=O)NCC[C@H](O)C1CCCC1	ZINC000875180944	CE	On-Demand	Anodyne	EPHX2	22	55
COCCCCCNC(=O)NCC[C@@H](O)C1CCCC1	ZINC000875180945	CE	On-Demand	Anodyne	EPHX2	22	55
COC(=O)c1cc(C(=O)N(c2ccccc2)C2CCN(C)CC2)ccc1C	ZINC000875180961	FH	On-Demand	Anodyne	OPRD1	21	40
O=C(N[C@H]1COc2ccccc21)N1CCC(CO)(CO)CC1	ZINC000875181002	DC	On-Demand	Anodyne	GHRHR	45	34
O=C(N[C@H]1COc2ccccc21)N1CCC(CO)(CO)CC1	ZINC000875181002	DC	On-Demand	Anodyne	EPHX2	21	47
C[C@@H]1CN(C(=O)N[C@@H]2COc3ccccc32)CC[C@H](C(F)(F)F)O1	ZINC000875181007	EF	On-Demand	Anodyne	RBP4	72	34
C[C@@H]1CN(C(=O)N[C@H]2COc3ccccc32)CC[C@@H](C(F)(F)F)O1	ZINC000875181008	EF	On-Demand	Anodyne	RBP4	72	34
C[C@@H]1CN(C(=O)N[C@@H]2COc3ccccc32)CC[C@@H](C(F)(F)F)O1	ZINC000875181009	EF	On-Demand	Anodyne	RBP4	72	34
C[C@@H]1CN(C(=O)N[C@H]2COc3ccccc32)CC[C@H](C(F)(F)F)O1	ZINC000875181010	EF	On-Demand	Anodyne	RBP4	72	34
O=C(N[C@H]1COc2ccccc21)N1CCO[C@H](C(F)F)CC1	ZINC000875181015	DE	On-Demand	Anodyne	RBP4	42	35
O=C(N[C@H]1COc2ccccc21)N1CCO[C@@H](C(F)F)CC1	ZINC000875181017	DE	On-Demand	Anodyne	RBP4	42	35
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(N(C)C)c(F)c1	ZINC000875181022	GE	On-Demand	Clean	UL54	47	31
CN1CCN(C(=O)NCc2cc3ccccc3[nH]2)Cc2cccnc21	ZINC000875181043	EF	On-Demand	Anodyne	HRH4	20	43
CN(CCNC(=O)C(=O)N1CCC(C)(N2CCCCC2)CC1)C1CCCC1	ZINC000875181055	GD	On-Demand	Anodyne	CCR5	15	43
O=C(NCCCCC1CC1)C(=O)NCCCN1CCCCC1=O	ZINC000875181057	DD	On-Demand	Anodyne	TYRO3	20	41
O=C(NCCO)C1CCN(C(=O)NCCCc2cccc(Cl)c2)CC1	ZINC000875181071	FD	On-Demand	Anodyne	SCNN1A	43	36
O=C(NCCO)C1CCN(C(=O)NCCCc2cccc(Cl)c2)CC1	ZINC000875181071	FD	On-Demand	Anodyne	MTNR1A	15	43
O=C(NCCO)C1CCN(C(=O)NCCCc2cccc(Cl)c2)CC1	ZINC000875181071	FD	On-Demand	Anodyne	MTNR1B	15	43
O=C(NCCO)C1CCN(C(=O)NCCCc2cccc(Cl)c2)CC1	ZINC000875181071	FD	On-Demand	Anodyne	EPHX2	23	52
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccc(OC)cc1OC	ZINC000875181097	FD	On-Demand	Anodyne	MTNR1A	86	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccc(OC)cc1OC	ZINC000875181097	FD	On-Demand	Anodyne	MTNR1B	68	38
CCC[C@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(Cl)c(Cl)c1	ZINC000875181098	GH	On-Demand	Anodyne	TACR2	44	36
CCC[C@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(Cl)c(Cl)c1	ZINC000875181098	GH	On-Demand	Anodyne	MAPK1	44	43
CO[C@@H]1CC[C@@H](C)N(C(=O)NCc2cc3ccccc3[nH]2)C1	ZINC000875181114	DF	On-Demand	Anodyne	PLD1	50	36
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2ccc(OC)cc2OC)C1	ZINC000875181127	FE	On-Demand	Anodyne	NQO2	30	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2ccc(OC)cc2OC)C1	ZINC000875181127	FE	On-Demand	Anodyne	MTNR1A	94	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2ccc(OC)cc2OC)C1	ZINC000875181127	FE	On-Demand	Anodyne	MTNR1B	73	37
CC(=O)C1CCN(C(=O)N[C@@H]2CCC(C)(C)c3ccccc32)CC1	ZINC000875181144	EH	On-Demand	Anodyne	EPHX2	19	40
CC(=O)C1CCN(C(=O)N[C@H]2CCC(C)(C)c3ccccc32)CC1	ZINC000875181145	EH	On-Demand	Anodyne	EPHX2	19	40
COCC(C)(C)CCNC(=O)C(=O)N[C@H](C)c1oc2ccc(OC)cc2c1C	ZINC000875181177	GG	On-Demand	Anodyne	MTNR1A	43	37
O=C(NCc1cc2ccccc2[nH]1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875181202	DG	On-Demand	Anodyne	AKR1C3	16	40
O=C(NCc1cc2ccccc2[nH]1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875181203	DG	On-Demand	Anodyne	AKR1C3	16	40
O=C(NCc1cc2ccccc2[nH]1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875181204	DG	On-Demand	Anodyne	AKR1C3	16	40
O=C(NCc1cc2ccccc2[nH]1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875181205	DG	On-Demand	Anodyne	AKR1C3	16	40
O=C(N[C@H]1COc2ccccc21)N1CCCC(F)(F)CC1	ZINC000875181213	CF	On-Demand	Anodyne	EPHX2	17	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc2ccccc2[nH]1	ZINC000875181216	EE	On-Demand	Anodyne	SLC6A4	31	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc2ccccc2[nH]1	ZINC000875181216	EE	On-Demand	Anodyne	SLC6A3	63	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc2ccccc2[nH]1	ZINC000875181216	EE	On-Demand	Anodyne	GLRA1	46	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc2ccccc2[nH]1	ZINC000875181217	EE	On-Demand	Anodyne	SLC6A4	31	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc2ccccc2[nH]1	ZINC000875181217	EE	On-Demand	Anodyne	SLC6A3	63	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc2ccccc2[nH]1	ZINC000875181217	EE	On-Demand	Anodyne	GLRA1	46	43
CN(C)CCOc1ccccc1CNC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875181224	GF	On-Demand	Anodyne	CCR8	31	40
CN(CCNC(=O)NCc1ccc(N(C)C)c(F)c1)CC(F)F	ZINC000875181247	ED	On-Demand	Clean	UL54	41	30
CN(C)CCOc1ccccc1CNC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875181281	ED	On-Demand	Anodyne	EPHX2	15	48
CN(C)CCOc1ccccc1CNC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875181282	ED	On-Demand	Anodyne	EPHX2	15	48
O=C(NCC[C@@H](O)COCc1ccccc1)N[C@H]1COc2ccccc21	ZINC000875181283	FE	On-Demand	Anodyne	NAAA	27	42
O=C(NCC[C@@H](O)COCc1ccccc1)N[C@@H]1COc2ccccc21	ZINC000875181284	FE	On-Demand	Anodyne	NAAA	27	42
O=C(NCc1cc2ccccc2[nH]1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875181289	EH	On-Demand	Anodyne	EPHX2	22	43
O=C(NCc1cc2ccccc2[nH]1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875181289	EH	On-Demand	Anodyne	AKR1C3	17	43
O=C(NCc1cc2ccccc2[nH]1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875181290	EH	On-Demand	Anodyne	EPHX2	22	43
O=C(NCc1cc2ccccc2[nH]1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875181290	EH	On-Demand	Anodyne	AKR1C3	17	43
CN1CC[C@H]2CN(C(=O)NCc3cc4ccccc4[nH]3)CC[C@H]21	ZINC000875181299	DE	On-Demand	Anodyne	HRH4	15	41
CN1CC[C@H]2CN(C(=O)NCc3cc4ccccc4[nH]3)CC[C@H]21	ZINC000875181299	DE	On-Demand	Anodyne	CYP51A1	21	40
CN1CC[C@H]2CN(C(=O)NCc3cc4ccccc4[nH]3)CC[C@H]21	ZINC000875181299	DE	On-Demand	Anodyne	PLD1	88	39
CN1CC[C@H]2CN(C(=O)NCc3cc4ccccc4[nH]3)CC[C@H]21	ZINC000875181299	DE	On-Demand	Anodyne	PLD2	61	42
CN1CC[C@H]2CN(C(=O)NCc3cc4ccccc4[nH]3)CC[C@@H]21	ZINC000875181300	DE	On-Demand	Anodyne	HRH4	15	41
CN1CC[C@H]2CN(C(=O)NCc3cc4ccccc4[nH]3)CC[C@@H]21	ZINC000875181300	DE	On-Demand	Anodyne	CYP51A1	21	40
CN1CC[C@H]2CN(C(=O)NCc3cc4ccccc4[nH]3)CC[C@@H]21	ZINC000875181300	DE	On-Demand	Anodyne	PLD1	88	39
CN1CC[C@H]2CN(C(=O)NCc3cc4ccccc4[nH]3)CC[C@@H]21	ZINC000875181300	DE	On-Demand	Anodyne	PLD2	61	42
O=C(NCc1cc2ccccc2[nH]1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875181340	GH	On-Demand	Anodyne	EPHX2	17	41
O=C(NCc1cc2ccccc2[nH]1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875181340	GH	On-Demand	Anodyne	SMO	45	47
O=C(NCc1cc2ccccc2[nH]1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875181340	GH	On-Demand	Anodyne	ETHR	62	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1OCCN(C)C	ZINC000875181347	GD	On-Demand	Anodyne	SLC6A3	40	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1OCCN(C)C	ZINC000875181348	GD	On-Demand	Anodyne	SLC6A3	40	38
O=C(NCc1cc2ccccc2[nH]1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875181353	ED	On-Demand	Anodyne	PLD1	41	35
O=C(NCc1cc2ccccc2[nH]1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875181353	ED	On-Demand	Anodyne	AKR1C3	17	43
O=C(NCc1cc2ccccc2[nH]1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875181354	ED	On-Demand	Anodyne	PLD1	41	35
O=C(NCc1cc2ccccc2[nH]1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875181354	ED	On-Demand	Anodyne	AKR1C3	17	43
O=C(NCc1cc2ccccc2[nH]1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875181355	ED	On-Demand	Anodyne	PLD1	41	35
O=C(NCc1cc2ccccc2[nH]1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875181355	ED	On-Demand	Anodyne	AKR1C3	17	43
O=C(NCc1cc2ccccc2[nH]1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875181356	ED	On-Demand	Anodyne	PLD1	41	35
O=C(NCc1cc2ccccc2[nH]1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875181356	ED	On-Demand	Anodyne	AKR1C3	17	43
O=C(N[C@H]1COc2ccccc21)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875181389	EE	On-Demand	Anodyne	RBP4	52	39
O=C(N[C@H]1COc2ccccc21)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875181391	EE	On-Demand	Anodyne	RBP4	52	39
COC(=O)c1cc(Cl)ccc1NC(=O)[C@@H]1CCN(C)C[C@@H]1c1cnn(C)c1	ZINC000875181395	GF	On-Demand	Anodyne	SLC6A3	18	42
COC(=O)c1cc(Cl)ccc1NC(=O)[C@H]1CCN(C)C[C@@H]1c1cnn(C)c1	ZINC000875181396	GF	On-Demand	Anodyne	SLC6A3	18	42
COC(=O)c1cc(Cl)ccc1NC(=O)[C@H]1CCN(C)C[C@H]1c1cnn(C)c1	ZINC000875181397	GF	On-Demand	Anodyne	SLC6A3	18	42
COC(=O)c1cc(Cl)ccc1NC(=O)[C@@H]1CCN(C)C[C@H]1c1cnn(C)c1	ZINC000875181398	GF	On-Demand	Anodyne	SLC6A3	18	42
CN(C)CCOc1ccccc1CNC(=O)N1CCC(CO)(CO)CC1	ZINC000875181472	FC	On-Demand	Anodyne	EPHX2	15	42
O=C(NCc1cc2ccccc2[nH]1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875181493	FF	On-Demand	Anodyne	ETHR	47	33
O=C(NCc1cc2ccccc2[nH]1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875181494	FF	On-Demand	Anodyne	ETHR	47	33
O=C(NCc1cc2ccccc2[nH]1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875181523	EH	On-Demand	Anodyne	PLD1	45	33
O=C(NCc1cc2ccccc2[nH]1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875181524	EH	On-Demand	Anodyne	PLD1	45	33
O=C(NCc1cc2ccccc2[nH]1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875181525	EH	On-Demand	Anodyne	PLD1	45	33
O=C(NCc1cc2ccccc2[nH]1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875181526	EH	On-Demand	Anodyne	PLD1	45	33
CCn1nc(C)c(CN(C)C(=O)NCc2ccc(N(C)C)c(F)c2)c1C	ZINC000875181542	FG	On-Demand	Clean	P2RX7	15	43
O=C(NCc1cc2ccccc2[nH]1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875181545	EG	On-Demand	Anodyne	AKR1C3	16	40
O=C(NCc1cc2ccccc2[nH]1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875181546	EG	On-Demand	Anodyne	AKR1C3	16	40
CN(C)CCOc1ccccc1CNC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875181562	GE	On-Demand	Anodyne	EPHX2	17	48
CN(C)CCOc1ccccc1CNC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875181563	GE	On-Demand	Anodyne	EPHX2	17	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1COc2ccccc21	ZINC000875181564	DD	On-Demand	Anodyne	SLC6A4	20	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1COc2ccccc21	ZINC000875181564	DD	On-Demand	Anodyne	SLC6A3	40	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1COc2ccccc21	ZINC000875181565	DD	On-Demand	Anodyne	SLC6A4	20	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1COc2ccccc21	ZINC000875181565	DD	On-Demand	Anodyne	SLC6A3	40	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1COc2ccccc21	ZINC000875181566	DD	On-Demand	Anodyne	SLC6A4	20	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1COc2ccccc21	ZINC000875181566	DD	On-Demand	Anodyne	SLC6A3	40	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1COc2ccccc21	ZINC000875181567	DD	On-Demand	Anodyne	SLC6A4	20	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1COc2ccccc21	ZINC000875181567	DD	On-Demand	Anodyne	SLC6A3	40	40
COC(=O)c1cc(Cl)ccc1NC(=O)c1cnn(C(C)C)c1Cl	ZINC000875181604	FH	On-Demand	Anodyne	F10	46	42
CN(C)CCOc1ccccc1CNC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875181612	GC	On-Demand	Anodyne	EPHX2	25	49
CC(=O)C1CCN(C(=O)NCc2cc3ccccc3[nH]2)CC1	ZINC000875181636	CF	On-Demand	Anodyne	CYP51A1	21	41
CC(=O)C1CCN(C(=O)NCc2cc3ccccc3[nH]2)CC1	ZINC000875181636	CF	On-Demand	Anodyne	PLD1	46	35
CC(=O)C1CCN(C(=O)NCc2cc3ccccc3[nH]2)CC1	ZINC000875181636	CF	On-Demand	Anodyne	EPHX2	27	40
CC(=O)C1CCN(C(=O)NCc2cc3ccccc3[nH]2)CC1	ZINC000875181636	CF	On-Demand	Anodyne	AKR1C3	18	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1OCCN(C)C	ZINC000875181641	ED	On-Demand	Anodyne	ANPEP	16	45
CN1CCN(C2CCN(C(=O)NCc3cc4ccccc4[nH]3)CC2)CC1	ZINC000875181655	FE	On-Demand	Anodyne	HRH4	23	47
CN1CCN(C2CCN(C(=O)NCc3cc4ccccc4[nH]3)CC2)CC1	ZINC000875181655	FE	On-Demand	Anodyne	PLD1	68	38
CN1CCN(C2CCN(C(=O)NCc3cc4ccccc4[nH]3)CC2)CC1	ZINC000875181655	FE	On-Demand	Anodyne	PLD2	51	41
CN1CCN(C2CCN(C(=O)NCc3cc4ccccc4[nH]3)CC2)CC1	ZINC000875181655	FE	On-Demand	Anodyne	GLRA1	20	41
CN1CCN(C2CCN(C(=O)NCc3cc4ccccc4[nH]3)CC2)CC1	ZINC000875181655	FE	On-Demand	Anodyne	CALCRL	44	45
CN1CCN(C2CCN(C(=O)NCc3cc4ccccc4[nH]3)CC2)CC1	ZINC000875181655	FE	On-Demand	Anodyne	AKR1C3	17	41
CN1CCN(C2CCN(C(=O)NCc3cc4ccccc4[nH]3)CC2)CC1	ZINC000875181655	FE	On-Demand	Anodyne	L3MBTL3	68	40
O=C(N[C@H]1COc2ccccc21)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875181665	EF	On-Demand	Anodyne	EPHX2	19	47
O=C(N[C@H]1COc2ccccc21)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875181666	EF	On-Demand	Anodyne	EPHX2	19	47
COC(=O)c1cc(Cl)ccc1NC(=O)[C@@H]1CCC(=O)N1C(C)C	ZINC000875181673	EE	On-Demand	Anodyne	P2RX7	28	56
CC[C@@H]1COCCN1CCNC(=O)NCc1cc2ccccc2[nH]1	ZINC000875181677	EE	On-Demand	Anodyne	PLD1	42	33
O=C(N[C@H]1COc2ccccc21)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875181695	ED	On-Demand	Anodyne	RBP4	50	37
CONC(=O)C1CCN(C(=O)NCc2cc3ccccc3[nH]2)CC1	ZINC000875181746	ED	On-Demand	Anodyne	EPHX2	29	42
O=C(NCCN1CC[C@H](O)C1)N[C@H]1COc2ccccc21	ZINC000875181785	CC	On-Demand	Anodyne	OPRK1	17	40
O=C(NCCN1CC[C@@H](O)C1)N[C@@H]1COc2ccccc21	ZINC000875181786	CC	On-Demand	Anodyne	OPRK1	17	40
O=C(NCCN1CC[C@H](O)C1)N[C@@H]1COc2ccccc21	ZINC000875181787	CC	On-Demand	Anodyne	OPRK1	17	40
O=C(NCCN1CC[C@@H](O)C1)N[C@H]1COc2ccccc21	ZINC000875181788	CC	On-Demand	Anodyne	OPRK1	17	40
O=C(NCCO)C1CCN(C(=O)NCc2cc3ccccc3[nH]2)CC1	ZINC000875181807	ED	On-Demand	Anodyne	PLD1	44	33
O=C(NCCO)C1CCN(C(=O)NCc2cc3ccccc3[nH]2)CC1	ZINC000875181807	ED	On-Demand	Anodyne	EPHX2	26	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1cc2ccccc2[nH]1	ZINC000875181820	CF	On-Demand	Anodyne	ANPEP	17	41
COC(=O)c1cc(Cl)ccc1NC(=O)CN1CCCCC(=O)C1=O	ZINC000875181824	FD	On-Demand	Anodyne	Q9FYV8_MAIZE	45	39
C[C@@H]1CN(C(=O)NCc2cc3ccccc3[nH]2)CC[C@@H](C(F)(F)F)O1	ZINC000875181844	FG	On-Demand	Anodyne	AKR1C3	17	41
C[C@@H]1CN(C(=O)NCc2cc3ccccc3[nH]2)CC[C@H](C(F)(F)F)O1	ZINC000875181845	FG	On-Demand	Anodyne	AKR1C3	17	41
O=C(NCc1cc2ccccc2[nH]1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875181930	EG	On-Demand	Anodyne	GLRA1	20	41
O=C(N[C@H]1COc2ccccc21)N(C1CC1)C1CC1	ZINC000875181932	CE	On-Demand	Anodyne	TRAR	40	32
CN(C)CCOc1ccccc1CNC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875181944	FE	On-Demand	Anodyne	AMY2	49	38
CN(C)CCOc1ccccc1CNC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875181944	FE	On-Demand	Anodyne	EPHX2	15	49
CN(C)CCOc1ccccc1CNC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875181945	FE	On-Demand	Anodyne	AMY2	49	38
CN(C)CCOc1ccccc1CNC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875181945	FE	On-Demand	Anodyne	EPHX2	15	49
O=C(NCc1cccc(CN2CCCCCC2)c1)N1CCC(CO)(CO)CC1	ZINC000875181948	GE	On-Demand	Anodyne	HRH2	36	49
O=C(NCc1cccc(CN2CCCCCC2)c1)N1CCC(CO)(CO)CC1	ZINC000875181948	GE	On-Demand	Anodyne	CHRM3	22	41
O=C(NCc1cccc(CN2CCCCCC2)c1)N1CCC(CO)(CO)CC1	ZINC000875181948	GE	On-Demand	Anodyne	SIGMAR1	29	42
O=C(NCc1cccc(CN2CCCCCC2)c1)N1CCC(CO)(CO)CC1	ZINC000875181948	GE	On-Demand	Anodyne	NPFFR2	34	40
O=C(NCc1cccc(CN2CCCCCC2)c1)N1CCC(CO)(CO)CC1	ZINC000875181948	GE	On-Demand	Anodyne	FAAH	23	42
O=C(NCc1cccc(CN2CCCCCC2)c1)N1CCC(CO)(CO)CC1	ZINC000875181948	GE	On-Demand	Anodyne	NPFFR1	47	40
O=C(NCc1ccc(-n2cnc3ccccc32)cc1)N1CCC(CO)(CO)CC1	ZINC000875181955	GE	On-Demand	Anodyne	F9	30	42
C=CCN1CCC(NC(=O)C(=O)NCC2(c3cccc(Cl)c3)CCC2)CC1	ZINC000875181956	GF	On-Demand	Mild	MCHR1	16	43
CC[C@@H](NC(=O)C(=O)N[C@@H]1CCN(CCOC)C1)c1cccc(OC)c1OC	ZINC000875181983	GD	On-Demand	Anodyne	HTR1A	17	43
CC[C@@H](NC(=O)C(=O)N[C@@H]1CCN(CCOC)C1)c1cccc(OC)c1OC	ZINC000875181983	GD	On-Demand	Anodyne	DRD2	25	44
CC[C@@H](NC(=O)C(=O)N[C@@H]1CCN(CCOC)C1)c1cccc(OC)c1OC	ZINC000875181983	GD	On-Demand	Anodyne	DRD3	22	43
CC[C@@H](NC(=O)C(=O)N[C@@H]1CCN(CCOC)C1)c1cccc(OC)c1OC	ZINC000875181983	GD	On-Demand	Anodyne	HTR4	55	37
CC[C@@H](NC(=O)C(=O)N[C@@H]1CCN(CCOC)C1)c1cccc(OC)c1OC	ZINC000875181983	GD	On-Demand	Anodyne	HTR7	19	48
CC[C@@H](NC(=O)C(=O)N[C@H]1CCN(CCOC)C1)c1cccc(OC)c1OC	ZINC000875181984	GD	On-Demand	Anodyne	HTR1A	17	43
CC[C@@H](NC(=O)C(=O)N[C@H]1CCN(CCOC)C1)c1cccc(OC)c1OC	ZINC000875181984	GD	On-Demand	Anodyne	DRD2	25	44
CC[C@@H](NC(=O)C(=O)N[C@H]1CCN(CCOC)C1)c1cccc(OC)c1OC	ZINC000875181984	GD	On-Demand	Anodyne	DRD3	22	43
CC[C@@H](NC(=O)C(=O)N[C@H]1CCN(CCOC)C1)c1cccc(OC)c1OC	ZINC000875181984	GD	On-Demand	Anodyne	HTR4	55	37
CC[C@@H](NC(=O)C(=O)N[C@H]1CCN(CCOC)C1)c1cccc(OC)c1OC	ZINC000875181984	GD	On-Demand	Anodyne	HTR7	19	48
O=C(NCCO)C1CCN(C(=O)NCCc2ccccc2Br)CC1	ZINC000875182010	GD	On-Demand	Anodyne	MTNR1A	16	41
O=C(NCCO)C1CCN(C(=O)NCCc2ccccc2Br)CC1	ZINC000875182010	GD	On-Demand	Anodyne	EPHX2	17	42
C=CCN1CCC(NC(=O)C(=O)N2CCC[C@@H]2c2cncc(C)c2)CC1	ZINC000875182028	FD	On-Demand	Mild	SSTR5	30	41
C=CCN1CCC(NC(=O)C(=O)N2CCC[C@H]2c2cncc(C)c2)CC1	ZINC000875182029	FD	On-Demand	Mild	SSTR5	30	41
CC[C@@H](NC(=O)NCCCOC1CCCC1)[C@@H](O)c1ccccc1	ZINC000875182030	EG	On-Demand	Anodyne	AMY2	45	32
CC[C@@H](NC(=O)NCCCOC1CCCC1)[C@H](O)c1ccccc1	ZINC000875182031	EG	On-Demand	Anodyne	AMY2	45	32
O=C(NCc1ccc(-n2cnc3ccccc32)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875182050	FF	On-Demand	Anodyne	F9	30	41
C=C(C)CN1CCC(NC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000875182063	GE	On-Demand	Mild	OXTR	53	38
C=C(C)CN1CCC(NC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000875182063	GE	On-Demand	Mild	SIGMAR1	18	43
C=C(C)CN1CCC(NC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000875182064	GE	On-Demand	Mild	OXTR	53	38
C=C(C)CN1CCC(NC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000875182064	GE	On-Demand	Mild	SIGMAR1	18	43
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(Cc2cccs2)CC1	ZINC000875182084	FF	On-Demand	Anodyne	HTR4	49	36
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(Cc2cccs2)CC1	ZINC000875182084	FF	On-Demand	Anodyne	CACNA1I	57	36
O=C(NCC1CCN(Cc2cccs2)CC1)N1Cc2cccc(O)c2C1	ZINC000875182109	FG	On-Demand	Clean	CACNA1I	49	35
Cc1nnc(NNC(=O)NCc2cccc(CN3CCCCCC3)c2)n1C	ZINC000875182110	FE	On-Demand	Reactive	HRH2	44	45
O=C(N[C@@H]1CCN(CC(F)(F)F)C1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875182151	FF	On-Demand	Anodyne	HPGDS	36	43
O=C(N[C@@H]1CCN(CC(F)(F)F)C1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875182152	FF	On-Demand	Anodyne	HPGDS	36	43
O=C(N[C@@H]1CCN(CC(F)(F)F)C1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875182153	FF	On-Demand	Anodyne	HPGDS	36	43
O=C(N[C@@H]1CCN(CC(F)(F)F)C1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875182154	FF	On-Demand	Anodyne	HPGDS	36	43
COC(=O)N(C)NC(=O)NCC1CCN(Cc2cccs2)CC1	ZINC000875182174	ED	On-Demand	Reactive	CACNA1I	58	36
COC(=O)C1(O)CN(C(=O)NCc2cccc(CN3CCCCCC3)c2)C1	ZINC000875182188	GD	On-Demand	Anodyne	HRH2	34	47
COC(=O)C1(O)CN(C(=O)NCc2cccc(CN3CCCCCC3)c2)C1	ZINC000875182188	GD	On-Demand	Anodyne	CHRM3	18	41
COC(=O)C1(O)CN(C(=O)NCc2cccc(CN3CCCCCC3)c2)C1	ZINC000875182188	GD	On-Demand	Anodyne	HRH3	17	45
O=C(NCCCOC1CCCC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875182196	EG	On-Demand	Anodyne	EPHX2	17	45
O=C(NCCCOC1CCCC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875182197	EG	On-Demand	Anodyne	EPHX2	17	45
COC(=O)C1(O)CN(C(=O)NCC2CCN(Cc3cccs3)CC2)C1	ZINC000875182204	FC	On-Demand	Anodyne	CACNA1I	56	35
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCOC3CCCC3)C[C@@H]1C2	ZINC000875182260	DD	On-Demand	Anodyne	EPHX2	24	49
COCCn1cc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)cn1	ZINC000875182271	FG	On-Demand	Anodyne	MAPK10	18	46
COCCn1cc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)cn1	ZINC000875182271	FG	On-Demand	Anodyne	PANC	57	37
Cc1ccnn1CC(=O)N1c2ccccc2CC[C@H]1C(=O)N1CCN(C)CC1	ZINC000875182325	GD	On-Demand	Anodyne	ACE	20	45
Cc1ccnn1CC(=O)N1c2ccccc2CC[C@@H]1C(=O)N1CCN(C)CC1	ZINC000875182326	GD	On-Demand	Anodyne	ACE	20	45
O=C(NCc1ccc(Cn2cnc3ccccc32)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875182327	FF	On-Demand	Anodyne	NR1I2	43	36
C=C(C)CN1CCC(NC(=O)C(=O)N2CCC[C@H]2c2cncc(C)c2)CC1	ZINC000875182370	FE	On-Demand	Mild	SSTR5	31	41
C=C(C)CN1CCC(NC(=O)C(=O)N2CCC[C@@H]2c2cncc(C)c2)CC1	ZINC000875182371	FE	On-Demand	Mild	SSTR5	31	41
CCCCCCCNC(=O)C(=O)N[C@H](CC)c1nc(C)cs1	ZINC000875182377	EG	On-Demand	Mild	ASAH1	53	33
CCCCCCCNC(=O)C(=O)N[C@@H](CC)c1nc(C)cs1	ZINC000875182378	EG	On-Demand	Mild	ASAH1	53	33
O=C(NCC1CCN(Cc2cccs2)CC1)N1CCC(CO)(CO)CC1	ZINC000875182397	GD	On-Demand	Anodyne	CACNA1I	42	34
O=CN1CCCN(C(=O)NCc2ccc(Cn3cnc4ccccc43)cc2)CC1	ZINC000875182417	GE	On-Demand	Anodyne	NR1I2	41	34
COc1cccc(C(C)(C)C(=O)N(C)c2nc(C)cs2)c1	ZINC000875182437	DG	On-Demand	Anodyne	HSD17B2	24	42
C=C(C)CN1CCC(NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875182442	GE	On-Demand	Mild	CHRNA7	41	37
C=C(C)CN1CCC(NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875182442	GE	On-Demand	Mild	C3AR1	47	45
C=C(C)CN1CCC(NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875182443	GE	On-Demand	Mild	CHRNA7	41	37
C=C(C)CN1CCC(NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875182443	GE	On-Demand	Mild	C3AR1	47	45
O=CN1CCCN(C(=O)NCc2ccc(-n3cnc4ccccc43)cc2)CC1	ZINC000875182444	GE	On-Demand	Anodyne	F9	29	40
O=CN1CCCN(C(=O)NCc2ccc(-n3cnc4ccccc43)cc2)CC1	ZINC000875182444	GE	On-Demand	Anodyne	HPGD	42	41
O=CN1CCCN(C(=O)NCc2cccc(CN3CCCCCC3)c2)CC1	ZINC000875182448	FE	On-Demand	Anodyne	HRH2	38	46
O=CN1CCCN(C(=O)NCc2cccc(CN3CCCCCC3)c2)CC1	ZINC000875182448	FE	On-Demand	Anodyne	CHRM3	16	42
O=CN1CCCN(C(=O)NCc2cccc(CN3CCCCCC3)c2)CC1	ZINC000875182448	FE	On-Demand	Anodyne	SIGMAR1	22	41
O=CN1CCCN(C(=O)NCc2cccc(CN3CCCCCC3)c2)CC1	ZINC000875182448	FE	On-Demand	Anodyne	FAAH	25	44
O=CN1CCCN(C(=O)NCc2cccc(CN3CCCCCC3)c2)CC1	ZINC000875182448	FE	On-Demand	Anodyne	DPP7	40	37
O=C(NCc1cccc(CN2CCCCCC2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875182449	EF	On-Demand	Anodyne	HRH2	40	52
O=C(NCc1cccc(CN2CCCCCC2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875182449	EF	On-Demand	Anodyne	CHRM3	22	41
O=C(NCc1cccc(CN2CCCCCC2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875182449	EF	On-Demand	Anodyne	SIGMAR1	23	42
C=CCN1CCC(NC(=O)C(=O)NCc2ccc(CN3CCNC3=O)cc2)CC1	ZINC000875182459	GC	On-Demand	Mild	MCHR1	15	44
Cc1nnc(NNC(=O)NCC2CCN(Cc3cccs3)CC2)n1C	ZINC000875182463	FD	On-Demand	Reactive	CACNA1I	40	35
COC(=O)C1(O)CN(C(=O)NCc2ccc(Cn3cnc4ccccc43)cc2)C1	ZINC000875182540	GD	On-Demand	Anodyne	NR1I2	41	33
CC(C)(C)OC(=O)CCNC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875182543	GD	On-Demand	Anodyne	F2	22	40
CC(C)(C)OC(=O)CCNC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875182543	GD	On-Demand	Anodyne	FKBP1A	26	40
CC(C)(C)OC(=O)CCNC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875182544	GD	On-Demand	Anodyne	F2	22	40
CC(C)(C)OC(=O)CCNC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875182544	GD	On-Demand	Anodyne	FKBP1A	26	40
CC(C)(C)OC(=O)CCNC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875182545	GD	On-Demand	Anodyne	F2	22	40
CC(C)(C)OC(=O)CCNC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875182545	GD	On-Demand	Anodyne	FKBP1A	26	40
CC(C)(C)OC(=O)CCNC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875182546	GD	On-Demand	Anodyne	F2	22	40
CC(C)(C)OC(=O)CCNC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875182546	GD	On-Demand	Anodyne	FKBP1A	26	40
C=CCN1CCC(NC(=O)C(=O)N(Cc2ccccc2)[C@H](CC)CO)CC1	ZINC000875182573	FD	On-Demand	Mild	SIGMAR1	19	42
O=C(N[C@H]1CCN(CC(F)(F)F)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875182596	FE	On-Demand	Anodyne	EPHX2	23	41
O=C(N[C@H]1CCN(CC(F)(F)F)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875182596	FE	On-Demand	Anodyne	HPGDS	35	41
O=C(N[C@@H]1CCN(CC(F)(F)F)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875182597	FE	On-Demand	Anodyne	EPHX2	23	41
O=C(N[C@@H]1CCN(CC(F)(F)F)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875182597	FE	On-Demand	Anodyne	HPGDS	35	41
O=C(N[C@H]1CCN(CC(F)(F)F)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875182598	FE	On-Demand	Anodyne	EPHX2	23	41
O=C(N[C@H]1CCN(CC(F)(F)F)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875182598	FE	On-Demand	Anodyne	HPGDS	35	41
O=C(N[C@@H]1CCN(CC(F)(F)F)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875182599	FE	On-Demand	Anodyne	EPHX2	23	41
O=C(N[C@@H]1CCN(CC(F)(F)F)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875182599	FE	On-Demand	Anodyne	HPGDS	35	41
CC[C@H](C[C@H](C)O)NC(=O)NCCc1ccccc1Br	ZINC000875182675	EF	On-Demand	Anodyne	ANPEP	30	48
C=CCN1CCC(NC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000875182681	FD	On-Demand	Mild	OXTR	41	35
C=CCN1CCC(NC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000875182681	FD	On-Demand	Mild	SIGMAR1	20	46
C=CCN1CCC(NC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000875182682	FD	On-Demand	Mild	OXTR	41	35
C=CCN1CCC(NC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000875182682	FD	On-Demand	Mild	SIGMAR1	20	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1CCN(Cc2cccs2)CC1	ZINC000875182700	GF	On-Demand	Anodyne	SLC6A3	23	41
COC(=O)N(C)NC(=O)NCCc1ccccc1Br	ZINC000875182706	ED	On-Demand	Reactive	MTNR1A	48	44
CC(=O)C1CCN(C(=O)NCc2ccc(-n3cnc4ccccc43)cc2)CC1	ZINC000875182707	GH	On-Demand	Anodyne	F9	33	40
CC(=O)C1CCN(C(=O)NCc2ccc(-n3cnc4ccccc43)cc2)CC1	ZINC000875182707	GH	On-Demand	Anodyne	HPGD	42	38
O=C(NCC1CCN(Cc2cccs2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875182714	EE	On-Demand	Anodyne	HTR4	45	35
O=C(NCC1CCN(Cc2cccs2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875182714	EE	On-Demand	Anodyne	SIGMAR1	15	45
O=C(NCC1CCN(Cc2cccs2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875182714	EE	On-Demand	Anodyne	CACNA1I	59	37
C=C(C)CN1CCC(NC(=O)C(=O)N(Cc2ccccc2)[C@H](CC)CO)CC1	ZINC000875182725	GD	On-Demand	Mild	SIGMAR1	19	42
N#Cc1ccc(Cn2cc(NC(=O)NCCCOC3CCCC3)cn2)cc1	ZINC000875182752	FG	On-Demand	Mild	CCR3	22	44
N#Cc1ccc(Cn2cc(NC(=O)NCCCOC3CCCC3)cn2)cc1	ZINC000875182752	FG	On-Demand	Mild	ITK	20	52
N#Cc1ccc(Cn2cc(NC(=O)NCCCOC3CCCC3)cn2)cc1	ZINC000875182752	FG	On-Demand	Mild	PANC	57	38
C=CCN1CCC(NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875182753	GE	On-Demand	Mild	C3AR1	47	46
C=CCN1CCC(NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875182754	GE	On-Demand	Mild	C3AR1	47	46
COC(=O)N(C)NC(=O)NCc1cccc(CN2CCCCCC2)c1	ZINC000875182805	EE	On-Demand	Reactive	ACHE	15	49
COC(=O)N(C)NC(=O)NCc1cccc(CN2CCCCCC2)c1	ZINC000875182805	EE	On-Demand	Reactive	HRH2	44	51
COC(=O)N(C)NC(=O)NCc1cccc(CN2CCCCCC2)c1	ZINC000875182805	EE	On-Demand	Reactive	CHRM3	18	42
COC(=O)N(C)NC(=O)NCc1cccc(CN2CCCCCC2)c1	ZINC000875182805	EE	On-Demand	Reactive	HRH3	20	44
COC(=O)N(C)NC(=O)NCc1cccc(CN2CCCCCC2)c1	ZINC000875182805	EE	On-Demand	Reactive	MCHR1	16	44
COC(=O)N(C)NC(=O)NCc1cccc(CN2CCCCCC2)c1	ZINC000875182805	EE	On-Demand	Reactive	NPFFR1	41	38
O=C(NCc1ccc(OC(F)F)cc1F)C(=O)NC1CCN(CCO)CC1	ZINC000875182831	GC	On-Demand	Anodyne	SLC6A5	20	41
COc1ccc([C@@H]2CN(C(=O)C(=O)NC3CCN(CCO)CC3)CCO2)cc1	ZINC000875182835	GC	On-Demand	Anodyne	MCHR1	16	41
CC[C@@H](NC(=O)NCc1cccc(N(C)C)c1)[C@@H](O)c1ccccc1	ZINC000875182850	EG	On-Demand	Anodyne	CTSD	20	41
CC[C@@H](NC(=O)NCc1cccc(N(C)C)c1)[C@@H](O)c1ccccc1	ZINC000875182850	EG	On-Demand	Anodyne	PDS	55	36
CC[C@@H](NC(=O)NCc1cccc(N(C)C)c1)[C@H](O)c1ccccc1	ZINC000875182853	EG	On-Demand	Anodyne	CTSD	20	41
CC[C@@H](NC(=O)NCc1cccc(N(C)C)c1)[C@H](O)c1ccccc1	ZINC000875182853	EG	On-Demand	Anodyne	PDS	55	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCn1cc(C)cn1)CC2	ZINC000875182871	GD	On-Demand	Anodyne	SLC18A2	45	34
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCn1cc(C)cn1)CC2	ZINC000875182872	GD	On-Demand	Anodyne	SLC18A2	45	34
C[C@@H](CN(C)C(=O)NCc1cccc(N(C)C)c1)NC(=O)OC(C)(C)C	ZINC000875182874	FF	On-Demand	Anodyne	FPR1	44	35
CC(=O)Nc1cc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCOCC3)c2)ccc1F	ZINC000875182879	JF	On-Demand	Anodyne	CNR2	19	58
CC(=O)Nc1cc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCOCC3)c2)ccc1F	ZINC000875182879	JF	On-Demand	Anodyne	MAPK14	24	41
CC(=O)Nc1cc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCOCC3)c2)ccc1F	ZINC000875182879	JF	On-Demand	Anodyne	CPT1A	93	42
CC(=O)Nc1cc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCOCC3)c2)ccc1F	ZINC000875182879	JF	On-Demand	Anodyne	CPT2	51	39
CC(=O)Nc1cc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCOCC3)c2)ccc1F	ZINC000875182879	JF	On-Demand	Anodyne	NR1H4	21	44
CC(=O)Nc1cc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCOCC3)c2)ccc1F	ZINC000875182879	JF	On-Demand	Anodyne	CPT1B	57	40
CC(=O)C1CCN(C(=O)NCCNC(=O)Cc2cccc(F)c2)CC1	ZINC000875182880	ED	On-Demand	Anodyne	CACNA1G	31	42
COc1cccc([C@H](O)C2CCN(C(=O)NCc3cccc(OC)n3)CC2)c1	ZINC000875182947	GF	On-Demand	Anodyne	DRD4	40	31
O=C(NCC1CC=CC1)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875182957	GD	On-Demand	Anodyne	SLC6A3	26	45
O=C(NCC1CC=CC1)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875182957	GD	On-Demand	Anodyne	HTR4	56	38
O=C(NCC1CC=CC1)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875182957	GD	On-Demand	Anodyne	GRIN2B	27	50
O=C(NCC1CC=CC1)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875182957	GD	On-Demand	Anodyne	CCR3	18	43
O=C(NCC1CC=CC1)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875182957	GD	On-Demand	Anodyne	CACNA1I	64	39
O=C(NCC1CC=CC1)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875182957	GD	On-Demand	Anodyne	Q8WSF8_APLCA	24	40
O=C(NCC1CC=CC1)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875182959	GD	On-Demand	Anodyne	SLC6A3	26	45
O=C(NCC1CC=CC1)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875182959	GD	On-Demand	Anodyne	HTR4	56	38
O=C(NCC1CC=CC1)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875182959	GD	On-Demand	Anodyne	GRIN2B	27	50
O=C(NCC1CC=CC1)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875182959	GD	On-Demand	Anodyne	CCR3	18	43
O=C(NCC1CC=CC1)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875182959	GD	On-Demand	Anodyne	CACNA1I	64	39
O=C(NCC1CC=CC1)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875182959	GD	On-Demand	Anodyne	Q8WSF8_APLCA	24	40
COc1ccc2c(c1)CC[C@H]2C(=O)N(C)c1ccccn1	ZINC000875183028	CF	On-Demand	Anodyne	PPARD	39	40
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NC2CCN(CCO)CC2)c1	ZINC000875183036	FC	On-Demand	Anodyne	SSTR5	32	42
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NC2CCN(CCO)CC2)c1	ZINC000875183038	FC	On-Demand	Anodyne	SSTR5	32	42
N#CCN1CCC(NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875183116	GD	On-Demand	Mild	C3AR1	47	48
Cn1nc(Cl)c(C(=O)Nc2ccccc2OC2CCCC2)c1Cl	ZINC000875183121	FI	On-Demand	Anodyne	G2YM83_BOTF4	52	34
CONC(=O)C1CCN(C(=O)NCc2cccc(OC)n2)CC1	ZINC000875183145	DC	On-Demand	Anodyne	EPHX2	24	41
CONC(=O)C1CCN(C(=O)NCc2cccc(OC)n2)CC1	ZINC000875183145	DC	On-Demand	Anodyne	PDE8B	41	33
CONC(=O)C1CCN(C(=O)NCc2cccc(OC)n2)CC1	ZINC000875183145	DC	On-Demand	Anodyne	PTR1	44	33
N#CCN1CCC(NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875183146	GD	On-Demand	Mild	C3AR1	47	48
CC(=O)N(C)c1ccc(CNC(=O)NCCC(=O)NCc2ccccc2)cc1	ZINC000875183159	GE	On-Demand	Anodyne	TPSAB1	15	40
CC(=O)[C@@H]1CCCN(C(=O)NCCC(=O)N2CCN(c3ccccc3)CC2)C1	ZINC000875183189	GD	On-Demand	Anodyne	SLC6A1	88	33
CC(=O)[C@@H]1CCCN(C(=O)NCCC(=O)N2CCN(c3ccccc3)CC2)C1	ZINC000875183189	GD	On-Demand	Anodyne	SSTR1	43	38
CC(=O)[C@@H]1CCCN(C(=O)NCCC(=O)N2CCN(c3ccccc3)CC2)C1	ZINC000875183189	GD	On-Demand	Anodyne	ADAM10	42	48
CC(=O)[C@H]1CCCN(C(=O)NCCC(=O)N2CCN(c3ccccc3)CC2)C1	ZINC000875183192	GD	On-Demand	Anodyne	SLC6A1	88	33
CC(=O)[C@H]1CCCN(C(=O)NCCC(=O)N2CCN(c3ccccc3)CC2)C1	ZINC000875183192	GD	On-Demand	Anodyne	SSTR1	43	38
CC(=O)[C@H]1CCCN(C(=O)NCCC(=O)N2CCN(c3ccccc3)CC2)C1	ZINC000875183192	GD	On-Demand	Anodyne	ADAM10	42	48
O=C(CCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)N1CCCCCC1	ZINC000875183225	FF	On-Demand	Anodyne	DPP4	15	43
O=C(CCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)N1CCCCCC1	ZINC000875183225	FF	On-Demand	Anodyne	PREP	79	39
O=C(CCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)N1CCCCCC1	ZINC000875183227	FF	On-Demand	Anodyne	DPP4	15	43
O=C(CCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)N1CCCCCC1	ZINC000875183227	FF	On-Demand	Anodyne	PREP	79	39
O=C(CCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)N1CCCCCC1	ZINC000875183235	FF	On-Demand	Anodyne	DPP4	15	43
O=C(CCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)N1CCCCCC1	ZINC000875183235	FF	On-Demand	Anodyne	PREP	79	39
O=C(CCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)N1CCCCCC1	ZINC000875183237	FF	On-Demand	Anodyne	DPP4	15	43
O=C(CCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)N1CCCCCC1	ZINC000875183237	FF	On-Demand	Anodyne	PREP	79	39
O=C(Nc1ccc(CNC(=O)N2CC[C@@H]3CSC[C@@H]3C2)cc1)c1cccnc1	ZINC000875183294	GG	On-Demand	Anodyne	CHRNA7	50	38
O=C(Nc1ccc(CNC(=O)N2CC[C@@H]3CSC[C@@H]3C2)cc1)c1cccnc1	ZINC000875183294	GG	On-Demand	Anodyne	NAMPT	117	42
O=C(Nc1ccc(CNC(=O)N2CC[C@H]3CSC[C@@H]3C2)cc1)c1cccnc1	ZINC000875183298	GG	On-Demand	Anodyne	CHRNA7	50	38
O=C(Nc1ccc(CNC(=O)N2CC[C@H]3CSC[C@@H]3C2)cc1)c1cccnc1	ZINC000875183298	GG	On-Demand	Anodyne	NAMPT	117	42
O=C(Nc1ccc(CNC(=O)N2CC[C@H]3CSC[C@H]3C2)cc1)c1cccnc1	ZINC000875183299	GG	On-Demand	Anodyne	CHRNA7	50	38
O=C(Nc1ccc(CNC(=O)N2CC[C@H]3CSC[C@H]3C2)cc1)c1cccnc1	ZINC000875183299	GG	On-Demand	Anodyne	NAMPT	117	42
O=C(CCNC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1)N1CCCCCC1	ZINC000875183304	FE	On-Demand	Anodyne	PREP	49	36
CCOC(=O)[C@H](C)C1CN(C(=O)NCC(=O)Nc2cccc(CC)c2)C1	ZINC000875183305	FE	On-Demand	Anodyne	P2RY14	47	35
CCO[C@H](C(=O)N(C)c1ccccn1)C1CCCC1	ZINC000875183329	CF	On-Demand	Anodyne	AMY2	49	33
CCO[C@@H](C(=O)N(C)c1ccccn1)C1CCCC1	ZINC000875183330	CF	On-Demand	Anodyne	AMY2	49	33
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ccccn1	ZINC000875183353	FG	On-Demand	Anodyne	HRAS	40	39
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ccccn1	ZINC000875183353	FG	On-Demand	Anodyne	CASP3	16	41
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ccccn1	ZINC000875183353	FG	On-Demand	Anodyne	BMP1	16	42
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ccccn1	ZINC000875183353	FG	On-Demand	Anodyne	KLK3	77	35
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ccccn1	ZINC000875183353	FG	On-Demand	Anodyne	CTSB	69	47
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ccccn1	ZINC000875183353	FG	On-Demand	Anodyne	PAPA1_CARPA	79	47
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ccccn1	ZINC000875183353	FG	On-Demand	Anodyne	CYSP_TRYCR	54	40
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ccccn1	ZINC000875183353	FG	On-Demand	Anodyne	CTSK	39	50
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ccccn1	ZINC000875183353	FG	On-Demand	Anodyne	CTSL	47	47
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ccccn1	ZINC000875183353	FG	On-Demand	Anodyne	CAPNS1	65	38
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ccccn1	ZINC000875183353	FG	On-Demand	Anodyne	CTSS	17	47
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ccccn1	ZINC000875183353	FG	On-Demand	Anodyne	CAPN1	78	49
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ccccn1	ZINC000875183353	FG	On-Demand	Anodyne	CASP1	21	41
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ccccn1	ZINC000875183353	FG	On-Demand	Anodyne	CAPN2	115	40
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ccccn1	ZINC000875183353	FG	On-Demand	Anodyne	CASP9	29	41
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ccccn1	ZINC000875183353	FG	On-Demand	Anodyne	NPR	72	42
COc1ccc(N2CCN(C(=O)NCc3cccc(OC)n3)CC2)c(OC)c1	ZINC000875183359	GE	On-Demand	Clean	HTR1A	51	45
COc1ccc(N2CCN(C(=O)NCc3cccc(OC)n3)CC2)c(OC)c1	ZINC000875183359	GE	On-Demand	Clean	DRD2	42	41
COc1ccc(N2CCN(C(=O)NCc3cccc(OC)n3)CC2)c(OC)c1	ZINC000875183359	GE	On-Demand	Clean	DRD4	45	36
COc1ccc(N2CCN(C(=O)NCc3cccc(OC)n3)CC2)c(OC)c1	ZINC000875183359	GE	On-Demand	Clean	HTR1B	19	45
COc1ccc(N2CCN(C(=O)NCc3cccc(OC)n3)CC2)c(OC)c1	ZINC000875183359	GE	On-Demand	Clean	HTR2A	15	40
COc1ccc(N2CCN(C(=O)NCc3cccc(OC)n3)CC2)c(OC)c1	ZINC000875183359	GE	On-Demand	Clean	DRD3	60	40
COc1ccc(N2CCN(C(=O)NCc3cccc(OC)n3)CC2)c(OC)c1	ZINC000875183359	GE	On-Demand	Clean	PDGFRB	63	40
COc1ccc(N2CCN(C(=O)NCc3cccc(OC)n3)CC2)c(OC)c1	ZINC000875183359	GE	On-Demand	Clean	HTR7	41	40
COc1ccc(N2CCN(C(=O)NCc3cccc(OC)n3)CC2)c(OC)c1	ZINC000875183359	GE	On-Demand	Clean	LCK	17	41
COc1ccc(N2CCN(C(=O)NCc3cccc(OC)n3)CC2)c(OC)c1	ZINC000875183359	GE	On-Demand	Clean	MTNR1B	23	42
C[C@@H](CC(=O)N(C)c1ccccn1)NC(=O)OC(C)(C)C	ZINC000875183365	CE	On-Demand	Anodyne	REN	41	35
C[C@@H](CC(=O)N(C)c1ccccn1)NC(=O)OC(C)(C)C	ZINC000875183365	CE	On-Demand	Anodyne	FPR1	44	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(N(C)C)c1	ZINC000875183390	ED	On-Demand	Anodyne	SLC6A3	50	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(N(C)C)c1	ZINC000875183391	ED	On-Demand	Anodyne	SLC6A3	50	47
CC(=O)[C@H]1CCCN(C(=O)NCCNC(=O)Cc2cccc(F)c2)C1	ZINC000875183403	ED	On-Demand	Anodyne	KCNQ2	17	44
CC(=O)[C@H]1CCCN(C(=O)NCCNC(=O)Cc2cccc(F)c2)C1	ZINC000875183403	ED	On-Demand	Anodyne	CCR3	41	37
CC(=O)[C@H]1CCCN(C(=O)NCCNC(=O)Cc2cccc(F)c2)C1	ZINC000875183403	ED	On-Demand	Anodyne	DPP7	41	34
CC(=O)[C@H]1CCCN(C(=O)NCCNC(=O)Cc2cccc(F)c2)C1	ZINC000875183403	ED	On-Demand	Anodyne	CACNA1G	31	40
CC(=O)[C@@H]1CCCN(C(=O)NCCNC(=O)Cc2cccc(F)c2)C1	ZINC000875183404	ED	On-Demand	Anodyne	KCNQ2	17	44
CC(=O)[C@@H]1CCCN(C(=O)NCCNC(=O)Cc2cccc(F)c2)C1	ZINC000875183404	ED	On-Demand	Anodyne	CCR3	41	37
CC(=O)[C@@H]1CCCN(C(=O)NCCNC(=O)Cc2cccc(F)c2)C1	ZINC000875183404	ED	On-Demand	Anodyne	DPP7	41	34
CC(=O)[C@@H]1CCCN(C(=O)NCCNC(=O)Cc2cccc(F)c2)C1	ZINC000875183404	ED	On-Demand	Anodyne	CACNA1G	31	40
CC(=O)Nc1cccc2c1CN(C(=O)NCc1cccc(N(C)C)c1)CC2	ZINC000875183410	FF	On-Demand	Anodyne	P2RY14	42	31
O=C(NCc1ccccc1O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875183422	EG	On-Demand	Clean	C3AR1	44	42
O=C(NCc1ccccc1O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875183422	EG	On-Demand	Clean	NAMPT	47	41
O=C(NCc1ccccc1O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875183424	EG	On-Demand	Clean	C3AR1	44	42
O=C(NCc1ccccc1O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875183424	EG	On-Demand	Clean	NAMPT	47	41
N#CCN1CCC(NC(=O)C(=O)NCC2(c3cccc(Cl)c3)CCC2)CC1	ZINC000875183445	GD	On-Demand	Mild	MCHR1	28	43
O=C(CCNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)N1CCCCCC1	ZINC000875183461	GG	On-Demand	Anodyne	PREP	38	40
C#C[C@@H]1CC[C@@H](NC(=O)NCCC(=O)N2CCN(c3ccccn3)CC2)CC1	ZINC000875183471	GD	On-Demand	Mild	EPHX2	15	43
C#CC[C@@H](CCOC)NC(=O)NCCC(=O)N1CCN(c2ccccn2)CC1	ZINC000875183490	GC	On-Demand	Mild	DRD4	23	41
C#CC[C@H](CCOC)NC(=O)NCCC(=O)N1CCN(c2ccccn2)CC1	ZINC000875183492	GC	On-Demand	Mild	DRD4	23	41
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875183493	GD	On-Demand	Anodyne	GRIN2B	59	41
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875183493	GD	On-Demand	Anodyne	CCR3	27	40
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875183494	GD	On-Demand	Anodyne	GRIN2B	59	41
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875183494	GD	On-Demand	Anodyne	CCR3	27	40
CN1CC[C@H]2CN(C(=O)NCc3ccc(NC(=O)c4cccnc4)cc3)CC[C@H]21	ZINC000875183504	GF	On-Demand	Anodyne	CHRNA7	50	37
CN1CC[C@H]2CN(C(=O)NCc3ccc(NC(=O)c4cccnc4)cc3)CC[C@H]21	ZINC000875183504	GF	On-Demand	Anodyne	NAMPT	123	42
CC[C@@H](C)[C@@H](NC(=O)c1c(Cl)nn(C)c1Cl)c1nc2ccccc2[nH]1	ZINC000875183506	GI	On-Demand	Anodyne	PIN1	24	41
CC[C@@H](C)[C@H](NC(=O)c1c(Cl)nn(C)c1Cl)c1nc2ccccc2[nH]1	ZINC000875183508	GI	On-Demand	Anodyne	PIN1	24	41
CC[C@H](C)[C@H](NC(=O)c1c(Cl)nn(C)c1Cl)c1nc2ccccc2[nH]1	ZINC000875183511	GI	On-Demand	Anodyne	PIN1	24	41
CN1CC[C@H]2CN(C(=O)NCc3ccc(NC(=O)c4cccnc4)cc3)CC[C@@H]21	ZINC000875183514	GF	On-Demand	Anodyne	CHRNA7	50	37
CN1CC[C@H]2CN(C(=O)NCc3ccc(NC(=O)c4cccnc4)cc3)CC[C@@H]21	ZINC000875183514	GF	On-Demand	Anodyne	NAMPT	123	42
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCC(=O)N2CCN(c3ccccn3)CC2)C1	ZINC000875183537	GD	On-Demand	Anodyne	DRD4	25	41
N#CCN1CCC(NC(=O)C(=O)NCCCCCCc2ccccc2)CC1	ZINC000875183542	FE	On-Demand	Mild	DRD2	22	41
N#CCN1CCC(NC(=O)C(=O)NCCCCCCc2ccccc2)CC1	ZINC000875183542	FE	On-Demand	Mild	FKBP1A	16	44
N#CCN1CCC(NC(=O)C(=O)NCCCCCCc2ccccc2)CC1	ZINC000875183542	FE	On-Demand	Mild	DRD4	27	49
N#CCN1CCC(NC(=O)C(=O)NCCCCCCc2ccccc2)CC1	ZINC000875183542	FE	On-Demand	Mild	HTR2A	16	49
N#CCN1CCC(NC(=O)C(=O)NCCCCCCc2ccccc2)CC1	ZINC000875183542	FE	On-Demand	Mild	SIGMAR1	41	47
N#CCN1CCC(NC(=O)C(=O)NCCCCCCc2ccccc2)CC1	ZINC000875183542	FE	On-Demand	Mild	CCR3	17	41
N#CCN1CCC(NC(=O)C(=O)NCCCCCCc2ccccc2)CC1	ZINC000875183542	FE	On-Demand	Mild	FAAH	19	41
N#CCN1CCC(NC(=O)C(=O)NCCCCCCc2ccccc2)CC1	ZINC000875183542	FE	On-Demand	Mild	TGM2	15	42
N#CCN1CCC(NC(=O)C(=O)NCCCCCCc2ccccc2)CC1	ZINC000875183542	FE	On-Demand	Mild	AMP1_PLAFQ	18	40
N#CCN1CCC(NC(=O)C(=O)NCCCCCCc2ccccc2)CC1	ZINC000875183542	FE	On-Demand	Mild	MCHR1	16	41
O=CN1CCCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)CC1	ZINC000875183549	FC	On-Demand	Anodyne	HTR1A	56	46
O=CN1CCCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)CC1	ZINC000875183549	FC	On-Demand	Anodyne	DRD2	50	43
O=CN1CCCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)CC1	ZINC000875183549	FC	On-Demand	Anodyne	DRD4	26	41
O=CN1CCCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)CC1	ZINC000875183549	FC	On-Demand	Anodyne	ADRA1D	24	41
O=CN1CCCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)CC1	ZINC000875183549	FC	On-Demand	Anodyne	HTR2A	47	46
O=CN1CCCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)CC1	ZINC000875183549	FC	On-Demand	Anodyne	HTR2C	31	41
O=CN1CCCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)CC1	ZINC000875183549	FC	On-Demand	Anodyne	ADRA1A	28	42
O=CN1CCCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)CC1	ZINC000875183549	FC	On-Demand	Anodyne	ADRA1B	15	42
O=CN1CCCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)CC1	ZINC000875183549	FC	On-Demand	Anodyne	DRD3	68	46
O=CN1CCCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)CC1	ZINC000875183549	FC	On-Demand	Anodyne	HTR7	62	40
CC(=O)C1CCN(C(=O)NCCC(=O)N2CCN(c3ccccn3)CC2)CC1	ZINC000875183566	GD	On-Demand	Anodyne	SSTR1	43	37
O=C(CC(F)(F)C(F)(F)F)Oc1cccc(C(=O)NC2CC2)c1	ZINC000875183567	EG	On-Demand	Anodyne	PLG	17	42
O=C(CC(F)(F)C(F)(F)F)Oc1cccc(C(=O)NC2CC2)c1	ZINC000875183567	EG	On-Demand	Anodyne	DRD4	41	31
O=C(CC(F)(F)C(F)(F)F)Oc1cccc(C(=O)NC2CC2)c1	ZINC000875183567	EG	On-Demand	Anodyne	FAAH	23	42
O=C(CC(F)(F)C(F)(F)F)Oc1cccc(C(=O)NC2CC2)c1	ZINC000875183567	EG	On-Demand	Anodyne	CCR2	42	40
O=C(CC(F)(F)C(F)(F)F)Oc1cccc(C(=O)NC2CC2)c1	ZINC000875183567	EG	On-Demand	Anodyne	PLAU	23	41
O=C(CC(F)(F)C(F)(F)F)Oc1cccc(C(=O)NC2CC2)c1	ZINC000875183567	EG	On-Demand	Anodyne	ST14	18	42
O=C(NCCC(=O)N1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875183579	FC	On-Demand	Anodyne	SSTR1	42	38
O=C(NCCC(=O)N1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875183579	FC	On-Demand	Anodyne	ADAM10	36	42
O=C(NCC1(c2cccc(Cl)c2)CCC1)C(=O)NC1CCN(CCO)CC1	ZINC000875183583	GD	On-Demand	Anodyne	HTR1A	18	46
O=C(NCC1(c2cccc(Cl)c2)CCC1)C(=O)NC1CCN(CCO)CC1	ZINC000875183583	GD	On-Demand	Anodyne	DRD2	18	43
O=C(NCC1(c2cccc(Cl)c2)CCC1)C(=O)NC1CCN(CCO)CC1	ZINC000875183583	GD	On-Demand	Anodyne	HTR2A	15	40
O=C(NCC1(c2cccc(Cl)c2)CCC1)C(=O)NC1CCN(CCO)CC1	ZINC000875183583	GD	On-Demand	Anodyne	DRD3	26	43
O=C(NCC1(c2cccc(Cl)c2)CCC1)C(=O)NC1CCN(CCO)CC1	ZINC000875183583	GD	On-Demand	Anodyne	SIGMAR1	17	43
O=C(NCC1(c2cccc(Cl)c2)CCC1)C(=O)NC1CCN(CCO)CC1	ZINC000875183583	GD	On-Demand	Anodyne	CACNA1I	19	44
O=C(NCCC(=O)N1CCN(c2ccccc2)CC1)NCC[C@H]1CCSC1	ZINC000875183586	GE	On-Demand	Anodyne	SSTR1	42	38
O=C(NCCC(=O)N1CCN(c2ccccc2)CC1)NCC[C@@H]1CCSC1	ZINC000875183587	GE	On-Demand	Anodyne	SSTR1	42	38
CONC(=O)C1CCN(C(=O)NCc2cccc(N(C)C)c2)CC1	ZINC000875183593	ED	On-Demand	Anodyne	EPHX2	18	43
COc1cccc([C@H](O)C2CCN(C(=O)NCc3cccc(N(C)C)c3)CC2)c1	ZINC000875183594	GG	On-Demand	Anodyne	OPRD1	17	44
COc1cccc([C@H](O)C2CCN(C(=O)NCc3cccc(N(C)C)c3)CC2)c1	ZINC000875183594	GG	On-Demand	Anodyne	CTSD	15	43
COc1cccc([C@H](O)C2CCN(C(=O)NCc3cccc(N(C)C)c3)CC2)c1	ZINC000875183594	GG	On-Demand	Anodyne	BACE1	16	43
O=CN1CCCN(C(=O)NCCNC(=O)Cc2cccc(F)c2)CC1	ZINC000875183605	FC	On-Demand	Anodyne	KCNQ2	17	46
CCOC(=O)[C@@H]1CC[C@H](C(=O)N(C)c2ccccn2)C1	ZINC000875183641	CE	On-Demand	Anodyne	FASN	34	41
CCC[C@@H](CC)C(=O)Oc1c(OC)cccc1C(=O)N(C)C	ZINC000875183675	DG	On-Demand	Anodyne	CXCR2	48	36
CCC[C@@H](CC)C(=O)Oc1c(OC)cccc1C(=O)N(C)C	ZINC000875183675	DG	On-Demand	Anodyne	CXCR1	50	34
CCC[C@H](CC)C(=O)Oc1c(OC)cccc1C(=O)N(C)C	ZINC000875183676	DG	On-Demand	Anodyne	CXCR2	48	36
CCC[C@H](CC)C(=O)Oc1c(OC)cccc1C(=O)N(C)C	ZINC000875183676	DG	On-Demand	Anodyne	CXCR1	50	34
C[C@@H](CC(=O)N(C)c1ccc(Br)cn1)NC(=O)OC(C)(C)C	ZINC000875183683	FG	On-Demand	Anodyne	PAPA1_CARPA	31	40
CN(C(=O)[C@@]1(C)CN(C(=O)OC(C)(C)C)CCO1)c1ccccn1	ZINC000875183687	EE	On-Demand	Anodyne	GPR119	18	42
CC[C@@H](NC(C)=O)C(=O)Oc1c(OC)cccc1C(=O)N(C)C	ZINC000875183721	DD	On-Demand	Anodyne	CXCR2	61	38
CC[C@@H](NC(C)=O)C(=O)Oc1c(OC)cccc1C(=O)N(C)C	ZINC000875183721	DD	On-Demand	Anodyne	PTPRA	44	33
CC[C@@H](NC(C)=O)C(=O)Oc1c(OC)cccc1C(=O)N(C)C	ZINC000875183721	DD	On-Demand	Anodyne	CXCR1	63	35
Cc1ccc2c(c1)[C@H](NC(=O)C(=O)N1CCC(N3CCN(C)CC3)CC1)CC2	ZINC000875183737	GD	On-Demand	Anodyne	L3MBTL3	58	40
O=CN1CCCN(C(=O)NCCC(=O)N2CCN(c3ccccc3)CC2)CC1	ZINC000875183748	GC	On-Demand	Anodyne	ADAM10	33	42
O=C(NCCCN1CCN(c2ccncc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875183771	EC	On-Demand	Anodyne	HTR1A	55	45
O=C(NCCCN1CCN(c2ccncc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875183771	EC	On-Demand	Anodyne	DRD2	44	44
O=C(NCCCN1CCN(c2ccncc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875183771	EC	On-Demand	Anodyne	DRD4	27	42
O=C(NCCCN1CCN(c2ccncc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875183771	EC	On-Demand	Anodyne	ADRA1D	20	40
O=C(NCCCN1CCN(c2ccncc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875183771	EC	On-Demand	Anodyne	HTR2A	46	45
O=C(NCCCN1CCN(c2ccncc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875183771	EC	On-Demand	Anodyne	HTR2C	31	42
O=C(NCCCN1CCN(c2ccncc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875183771	EC	On-Demand	Anodyne	ADRA1A	20	41
O=C(NCCCN1CCN(c2ccncc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875183771	EC	On-Demand	Anodyne	DRD3	65	45
O=C(NCCCN1CCN(c2ccncc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875183771	EC	On-Demand	Anodyne	HTR7	47	37
CN1CC[C@@H](C(=O)Oc2cccc(C(=O)NC3CC3)c2)[C@H](c2cnn(C)c2)C1	ZINC000875183776	GD	On-Demand	Anodyne	DRD4	42	32
CN1CC[C@@H](C(=O)Oc2cccc(C(=O)NC3CC3)c2)[C@H](c2cnn(C)c2)C1	ZINC000875183776	GD	On-Demand	Anodyne	MAPK13	43	31
CN1CC[C@@H](C(=O)Oc2cccc(C(=O)NC3CC3)c2)[C@@H](c2cnn(C)c2)C1	ZINC000875183779	GD	On-Demand	Anodyne	DRD4	42	32
CN1CC[C@@H](C(=O)Oc2cccc(C(=O)NC3CC3)c2)[C@@H](c2cnn(C)c2)C1	ZINC000875183779	GD	On-Demand	Anodyne	MAPK13	43	31
O=C(NCCCN1CCN(c2ccncc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875183780	GE	On-Demand	Clean	HTR1A	71	47
O=C(NCCCN1CCN(c2ccncc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875183780	GE	On-Demand	Clean	DRD2	56	48
O=C(NCCCN1CCN(c2ccncc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875183780	GE	On-Demand	Clean	DRD4	45	37
O=C(NCCCN1CCN(c2ccncc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875183780	GE	On-Demand	Clean	ADRA1D	27	41
O=C(NCCCN1CCN(c2ccncc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875183780	GE	On-Demand	Clean	HTR2A	53	47
O=C(NCCCN1CCN(c2ccncc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875183780	GE	On-Demand	Clean	HTR2C	33	40
O=C(NCCCN1CCN(c2ccncc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875183780	GE	On-Demand	Clean	ADRA1A	32	41
O=C(NCCCN1CCN(c2ccncc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875183780	GE	On-Demand	Clean	ADRA1B	17	41
O=C(NCCCN1CCN(c2ccncc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875183780	GE	On-Demand	Clean	DRD3	81	47
O=C(NCCCN1CCN(c2ccncc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875183780	GE	On-Demand	Clean	DRD5	15	40
O=C(NCCCN1CCN(c2ccncc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875183780	GE	On-Demand	Clean	HTR7	69	41
CN1CCC(CNC(=O)NCc2ccccc2O)(c2ccccc2)CC1	ZINC000875183784	FF	On-Demand	Clean	KCNA3	50	40
CN1CCC(CNC(=O)NCc2ccccc2O)(c2ccccc2)CC1	ZINC000875183784	FF	On-Demand	Clean	SOAT1	17	46
O=C(NCCCN1CCN(c2ccncc2)CC1)NCC[C@H](O)C1CCCC1	ZINC000875183797	GD	On-Demand	Anodyne	HTR1A	49	44
O=C(NCCCN1CCN(c2ccncc2)CC1)NCC[C@H](O)C1CCCC1	ZINC000875183797	GD	On-Demand	Anodyne	DRD2	34	42
O=C(NCCCN1CCN(c2ccncc2)CC1)NCC[C@H](O)C1CCCC1	ZINC000875183797	GD	On-Demand	Anodyne	HTR2A	39	43
O=C(NCCCN1CCN(c2ccncc2)CC1)NCC[C@H](O)C1CCCC1	ZINC000875183797	GD	On-Demand	Anodyne	ADRA1A	19	44
O=C(NCCCN1CCN(c2ccncc2)CC1)NCC[C@H](O)C1CCCC1	ZINC000875183797	GD	On-Demand	Anodyne	DRD3	50	43
O=C(NCCCN1CCN(c2ccncc2)CC1)NCC[C@H](O)C1CCCC1	ZINC000875183797	GD	On-Demand	Anodyne	CCR3	29	40
O=C(NCCCN1CCN(c2ccncc2)CC1)NCC[C@@H](O)C1CCCC1	ZINC000875183798	GD	On-Demand	Anodyne	HTR1A	49	44
O=C(NCCCN1CCN(c2ccncc2)CC1)NCC[C@@H](O)C1CCCC1	ZINC000875183798	GD	On-Demand	Anodyne	DRD2	34	42
O=C(NCCCN1CCN(c2ccncc2)CC1)NCC[C@@H](O)C1CCCC1	ZINC000875183798	GD	On-Demand	Anodyne	HTR2A	39	43
O=C(NCCCN1CCN(c2ccncc2)CC1)NCC[C@@H](O)C1CCCC1	ZINC000875183798	GD	On-Demand	Anodyne	ADRA1A	19	44
O=C(NCCCN1CCN(c2ccncc2)CC1)NCC[C@@H](O)C1CCCC1	ZINC000875183798	GD	On-Demand	Anodyne	DRD3	50	43
O=C(NCCCN1CCN(c2ccncc2)CC1)NCC[C@@H](O)C1CCCC1	ZINC000875183798	GD	On-Demand	Anodyne	CCR3	29	40
Cc1ccc(CN2CC[C@@H](NC(=O)NCc3ccccc3O)C2)cc1	ZINC000875183805	EF	On-Demand	Clean	CHRM2	20	48
Cc1ccc(CN2CC[C@@H](NC(=O)NCc3ccccc3O)C2)cc1	ZINC000875183805	EF	On-Demand	Clean	CHRM1	17	48
Cc1ccc(CN2CC[C@@H](NC(=O)NCc3ccccc3O)C2)cc1	ZINC000875183805	EF	On-Demand	Clean	DRD2	15	51
Cc1ccc(CN2CC[C@@H](NC(=O)NCc3ccccc3O)C2)cc1	ZINC000875183805	EF	On-Demand	Clean	DRD4	52	51
Cc1ccc(CN2CC[C@@H](NC(=O)NCc3ccccc3O)C2)cc1	ZINC000875183805	EF	On-Demand	Clean	ACHE	21	44
Cc1ccc(CN2CC[C@@H](NC(=O)NCc3ccccc3O)C2)cc1	ZINC000875183805	EF	On-Demand	Clean	CHRM3	26	48
Cc1ccc(CN2CC[C@@H](NC(=O)NCc3ccccc3O)C2)cc1	ZINC000875183805	EF	On-Demand	Clean	SIGMAR1	36	57
Cc1ccc(CN2CC[C@@H](NC(=O)NCc3ccccc3O)C2)cc1	ZINC000875183805	EF	On-Demand	Clean	SSTR5	44	35
Cc1ccc(CN2CC[C@@H](NC(=O)NCc3ccccc3O)C2)cc1	ZINC000875183805	EF	On-Demand	Clean	CCR3	51	48
Cc1ccc(CN2CC[C@@H](NC(=O)NCc3ccccc3O)C2)cc1	ZINC000875183805	EF	On-Demand	Clean	MLNR	72	37
Cc1ccc(CN2CC[C@@H](NC(=O)NCc3ccccc3O)C2)cc1	ZINC000875183805	EF	On-Demand	Clean	CCR2	23	50
Cc1ccc(CN2CC[C@@H](NC(=O)NCc3ccccc3O)C2)cc1	ZINC000875183805	EF	On-Demand	Clean	EPHX2	29	44
Cc1ccc(CN2CC[C@@H](NC(=O)NCc3ccccc3O)C2)cc1	ZINC000875183805	EF	On-Demand	Clean	MCHR1	51	60
Cc1ccc(CN2CC[C@@H](NC(=O)NCc3ccccc3O)C2)cc1	ZINC000875183805	EF	On-Demand	Clean	BIRC2	54	43
Cc1ccc(CN2CC[C@H](NC(=O)NCc3ccccc3O)C2)cc1	ZINC000875183806	EF	On-Demand	Clean	CHRM2	20	48
Cc1ccc(CN2CC[C@H](NC(=O)NCc3ccccc3O)C2)cc1	ZINC000875183806	EF	On-Demand	Clean	CHRM1	17	48
Cc1ccc(CN2CC[C@H](NC(=O)NCc3ccccc3O)C2)cc1	ZINC000875183806	EF	On-Demand	Clean	DRD2	15	51
Cc1ccc(CN2CC[C@H](NC(=O)NCc3ccccc3O)C2)cc1	ZINC000875183806	EF	On-Demand	Clean	DRD4	52	51
Cc1ccc(CN2CC[C@H](NC(=O)NCc3ccccc3O)C2)cc1	ZINC000875183806	EF	On-Demand	Clean	ACHE	21	44
Cc1ccc(CN2CC[C@H](NC(=O)NCc3ccccc3O)C2)cc1	ZINC000875183806	EF	On-Demand	Clean	CHRM3	26	48
Cc1ccc(CN2CC[C@H](NC(=O)NCc3ccccc3O)C2)cc1	ZINC000875183806	EF	On-Demand	Clean	SIGMAR1	36	57
Cc1ccc(CN2CC[C@H](NC(=O)NCc3ccccc3O)C2)cc1	ZINC000875183806	EF	On-Demand	Clean	SSTR5	44	35
Cc1ccc(CN2CC[C@H](NC(=O)NCc3ccccc3O)C2)cc1	ZINC000875183806	EF	On-Demand	Clean	CCR3	51	48
Cc1ccc(CN2CC[C@H](NC(=O)NCc3ccccc3O)C2)cc1	ZINC000875183806	EF	On-Demand	Clean	MLNR	72	37
Cc1ccc(CN2CC[C@H](NC(=O)NCc3ccccc3O)C2)cc1	ZINC000875183806	EF	On-Demand	Clean	CCR2	23	50
Cc1ccc(CN2CC[C@H](NC(=O)NCc3ccccc3O)C2)cc1	ZINC000875183806	EF	On-Demand	Clean	EPHX2	29	44
Cc1ccc(CN2CC[C@H](NC(=O)NCc3ccccc3O)C2)cc1	ZINC000875183806	EF	On-Demand	Clean	MCHR1	51	60
Cc1ccc(CN2CC[C@H](NC(=O)NCc3ccccc3O)C2)cc1	ZINC000875183806	EF	On-Demand	Clean	BIRC2	54	43
O=C(NCCC[C@@H]1CCOC1=O)NC1(c2ccc(Br)cc2)CC1	ZINC000875183839	GG	On-Demand	Anodyne	TRAR	19	40
O=C(NCCC[C@H]1CCOC1=O)NC1(c2ccc(Br)cc2)CC1	ZINC000875183840	GG	On-Demand	Anodyne	TRAR	19	40
CN(Cc1ccc2cc[nH]c2c1)C(=O)NCc1cccc(N(C)C)c1	ZINC000875183842	EH	On-Demand	Anodyne	HSD17B2	17	41
CONC(=O)C1CCN(C(=O)NCc2cc(C)cc3c(C)c(C)[nH]c23)CC1	ZINC000875183866	FF	On-Demand	Anodyne	EPHX2	16	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCNC(=O)Cc1cccc(F)c1	ZINC000875183903	GD	On-Demand	Anodyne	SLC6A4	21	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCNC(=O)Cc1cccc(F)c1	ZINC000875183903	GD	On-Demand	Anodyne	SLC6A3	45	45
COc1cccc(C[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)c2ccccn2)c1	ZINC000875183935	GG	On-Demand	Anodyne	PGC	52	35
COc1cccc(C[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)c2ccccn2)c1	ZINC000875183935	GG	On-Demand	Anodyne	PAPA1_CARPA	55	47
COc1cccc(C[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)c2ccccn2)c1	ZINC000875183935	GG	On-Demand	Anodyne	CTSL	28	49
COc1cccc(C[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)c2ccccn2)c1	ZINC000875183935	GG	On-Demand	Anodyne	REN	61	40
COc1cccc(C[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)c2ccccn2)c1	ZINC000875183935	GG	On-Demand	Anodyne	REN1	20	40
COc1cccc(C[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)c2ccccn2)c1	ZINC000875183935	GG	On-Demand	Anodyne	CTSS	19	49
COc1cccc(C[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)c2ccccn2)c1	ZINC000875183935	GG	On-Demand	Anodyne	FPR1	53	40
COc1cccc(C[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)c2ccccn2)c1	ZINC000875183936	GG	On-Demand	Anodyne	PGC	52	35
COc1cccc(C[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)c2ccccn2)c1	ZINC000875183936	GG	On-Demand	Anodyne	PAPA1_CARPA	55	47
COc1cccc(C[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)c2ccccn2)c1	ZINC000875183936	GG	On-Demand	Anodyne	CTSL	28	49
COc1cccc(C[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)c2ccccn2)c1	ZINC000875183936	GG	On-Demand	Anodyne	REN	61	40
COc1cccc(C[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)c2ccccn2)c1	ZINC000875183936	GG	On-Demand	Anodyne	REN1	20	40
COc1cccc(C[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)c2ccccn2)c1	ZINC000875183936	GG	On-Demand	Anodyne	CTSS	19	49
COc1cccc(C[C@@H](NC(=O)OC(C)(C)C)C(=O)N(C)c2ccccn2)c1	ZINC000875183936	GG	On-Demand	Anodyne	FPR1	53	40
CCO[C@@H](C(=O)Oc1c(OC)cccc1C(=O)N(C)C)C1CCCC1	ZINC000875183972	EF	On-Demand	Anodyne	AMY2	44	31
CN(C(=O)c1cc(NC(=O)OC(C)(C)C)ccc1Cl)c1ccccn1	ZINC000875184000	FI	On-Demand	Anodyne	GRM4	59	42
CC[C@@H](NC(=O)NCCC(=O)N1CCCCCC1)[C@H](O)c1ccccc1	ZINC000875184061	FF	On-Demand	Anodyne	KCNQ2	43	35
CC[C@@H](NC(=O)NCCC(=O)N1CCCCCC1)[C@H](O)c1ccccc1	ZINC000875184061	FF	On-Demand	Anodyne	RIR1_HHV11	42	37
CC[C@@H](NC(=O)NCCC(=O)N1CCCCCC1)[C@@H](O)c1ccccc1	ZINC000875184062	FF	On-Demand	Anodyne	KCNQ2	43	35
CC[C@@H](NC(=O)NCCC(=O)N1CCCCCC1)[C@@H](O)c1ccccc1	ZINC000875184062	FF	On-Demand	Anodyne	RIR1_HHV11	42	37
O=C(COCc1ccnc(O)c1)Oc1cccc(C(=O)NC2CC2)c1	ZINC000875184073	ED	On-Demand	Anodyne	PLG	17	44
O=C(COCc1ccnc(O)c1)Oc1cccc(C(=O)NC2CC2)c1	ZINC000875184073	ED	On-Demand	Anodyne	FAAH	23	41
O=C(COCc1ccnc(O)c1)Oc1cccc(C(=O)NC2CC2)c1	ZINC000875184073	ED	On-Demand	Anodyne	ST14	16	44
O=C(COCc1ccnc(O)c1)Oc1cccc(C(=O)NC2CC2)c1	ZINC000875184073	ED	On-Demand	Anodyne	HPGDS	33	40
N#CCN1CCC(NC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000875184074	FD	On-Demand	Mild	OXTR	43	36
N#CCN1CCC(NC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000875184075	FD	On-Demand	Mild	OXTR	43	36
CC[C@H](C[C@H](C)O)NC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875184079	FD	On-Demand	Anodyne	HTR1A	46	44
CC[C@H](C[C@H](C)O)NC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875184079	FD	On-Demand	Anodyne	DRD2	37	40
CC[C@H](C[C@H](C)O)NC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875184079	FD	On-Demand	Anodyne	HTR2A	39	42
CC[C@H](C[C@H](C)O)NC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875184079	FD	On-Demand	Anodyne	ADRA1A	19	43
CC[C@H](C[C@H](C)O)NC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875184079	FD	On-Demand	Anodyne	DRD3	54	42
O=C(CCNC(=O)N1CCC[C@@](O)(c2ccccc2)C1)N1CCCCCC1	ZINC000875184083	FE	On-Demand	Anodyne	EPHX2	15	47
O=C(CCNC(=O)N1CCC[C@](O)(c2ccccc2)C1)N1CCCCCC1	ZINC000875184084	FE	On-Demand	Anodyne	EPHX2	15	47
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000875184090	GB	On-Demand	Anodyne	HTR1A	67	45
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000875184090	GB	On-Demand	Anodyne	DRD2	55	40
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000875184090	GB	On-Demand	Anodyne	DRD4	43	35
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000875184090	GB	On-Demand	Anodyne	ADRA1D	48	42
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000875184090	GB	On-Demand	Anodyne	HTR2A	49	45
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000875184090	GB	On-Demand	Anodyne	HTR2C	32	40
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000875184090	GB	On-Demand	Anodyne	ADRA1A	66	40
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000875184090	GB	On-Demand	Anodyne	ADRA1B	38	42
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000875184090	GB	On-Demand	Anodyne	DRD3	74	45
COC(=O)C1(O)CN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000875184090	GB	On-Demand	Anodyne	HTR7	61	40
O=C(CCNC(=O)N1Cc2cccc(O)c2C1)N1CCN(c2ccccc2)CC1	ZINC000875184092	GE	On-Demand	Clean	SSTR1	41	36
O=C(CCNC(=O)N1Cc2cccc(O)c2C1)N1CCN(c2ccccc2)CC1	ZINC000875184092	GE	On-Demand	Clean	ADAM10	37	41
CC[C@H](C[C@H](C)O)NC(=O)NCCC(=O)N1CCN(c2ccccc2)CC1	ZINC000875184107	GD	On-Demand	Anodyne	RIR1_HHV11	41	38
COCC1CC(NC(=O)NCCC(=O)N2CCN(c3ccccc3)CC2)C1	ZINC000875184113	FD	On-Demand	Anodyne	SSTR1	40	36
COCC1CC(NC(=O)NCCC(=O)N2CCN(c3ccccc3)CC2)C1	ZINC000875184113	FD	On-Demand	Anodyne	ADAM10	36	40
CC(=O)[C@H]1CCCN(C(=O)NCc2cccc(N(C)C)c2)C1	ZINC000875184141	DE	On-Demand	Anodyne	DPP7	48	37
CC(=O)[C@@H]1CCCN(C(=O)NCc2cccc(N(C)C)c2)C1	ZINC000875184142	DE	On-Demand	Anodyne	DPP7	48	37
O=C(NC1CCN(CCO)CC1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875184149	FC	On-Demand	Anodyne	OXTR	47	36
O=C(NC1CCN(CCO)CC1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875184149	FC	On-Demand	Anodyne	SIGMAR1	25	42
O=C(NC1CCN(CCO)CC1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875184150	FC	On-Demand	Anodyne	OXTR	47	36
O=C(NC1CCN(CCO)CC1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875184150	FC	On-Demand	Anodyne	SIGMAR1	25	42
O=C(Cc1cccc(F)c1)NCCNC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875184155	GC	On-Demand	Anodyne	CACNA1H	51	37
O=C(Cc1cccc(F)c1)NCCNC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875184155	GC	On-Demand	Anodyne	PLD2	49	36
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCc1cccc(N(C)C)c1)CC2	ZINC000875184156	FF	On-Demand	Anodyne	P2RY14	42	31
O=C(Cc1cccc(F)c1)NCCNC(=O)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875184161	GC	On-Demand	Anodyne	SIGMAR1	15	47
O=C(Cc1cccc(F)c1)NCCNC(=O)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875184162	GC	On-Demand	Anodyne	SIGMAR1	15	47
O=C(Cc1cccc(F)c1)NCCNC(=O)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875184163	GC	On-Demand	Anodyne	SIGMAR1	15	47
O=C(Cc1cccc(F)c1)NCCNC(=O)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875184164	GC	On-Demand	Anodyne	SIGMAR1	15	47
C[C@H](NC(=O)C(=O)NC1CCN(CCO)CC1)c1ccc(C(F)(F)F)nc1	ZINC000875184166	GC	On-Demand	Anodyne	SLC6A5	29	42
CCCCCCCNC(=O)C(=O)N[C@@H]1CCc2nc(CC)nn2C1	ZINC000875184167	ED	On-Demand	Mild	ASAH1	46	32
CCCCCCCNC(=O)C(=O)N[C@H]1CCc2nc(CC)nn2C1	ZINC000875184168	ED	On-Demand	Mild	ASAH1	46	32
CC(=O)Nc1cc(NC(=O)c2ccccc2Nc2ccc(SC(F)F)cc2)ccc1F	ZINC000875184178	IK	On-Demand	Anodyne	KCNK3	50	33
CC(=O)Nc1cc(NC(=O)c2ccccc2Nc2ccc(SC(F)F)cc2)ccc1F	ZINC000875184178	IK	On-Demand	Anodyne	KCNK9	48	33
CCCCCCCNC(=O)C(=O)NC1CCN(CCO)CC1	ZINC000875184195	DC	On-Demand	Mild	HTR4	28	42
CCCCCCCNC(=O)C(=O)NC1CCN(CCO)CC1	ZINC000875184195	DC	On-Demand	Mild	ASAH1	57	33
O=C(NCC1CCN(Cc2ccccc2Cl)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875184239	GF	On-Demand	Anodyne	DRD4	15	46
O=C(NCC1CCN(Cc2ccccc2Cl)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875184239	GF	On-Demand	Anodyne	ACHE	20	42
O=C(NCC1CCN(Cc2ccccc2Cl)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875184239	GF	On-Demand	Anodyne	SIGMAR1	25	44
O=C(NCC1CCN(Cc2ccccc2Cl)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875184239	GF	On-Demand	Anodyne	CACNA1I	55	36
O=C(NCC1CCN(Cc2ccccc2Cl)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875184240	GF	On-Demand	Anodyne	DRD4	15	46
O=C(NCC1CCN(Cc2ccccc2Cl)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875184240	GF	On-Demand	Anodyne	ACHE	20	42
O=C(NCC1CCN(Cc2ccccc2Cl)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875184240	GF	On-Demand	Anodyne	SIGMAR1	25	44
O=C(NCC1CCN(Cc2ccccc2Cl)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875184240	GF	On-Demand	Anodyne	CACNA1I	55	36
CN(C(=O)c1cnc(C2CCN(C(=O)OC(C)(C)C)CC2)o1)c1ccccn1	ZINC000875184291	GG	On-Demand	Anodyne	GPR119	42	48
CC(C)(C)OC(=O)NCC12CCC(CC1)N2C(=O)NCc1ccccc1O	ZINC000875184331	GG	On-Demand	Clean	HCN1	43	32
CC(C)(C)OC(=O)NCC12CCC(CC1)N2C(=O)NCc1ccccc1O	ZINC000875184331	GG	On-Demand	Clean	HCN4	41	32
CN1CC[C@H]2CN(C(=O)NCCC(=O)N3CCN(c4ccccc4)CC3)CC[C@H]21	ZINC000875184347	GD	On-Demand	Anodyne	HTR1A	16	40
CN1CC[C@H]2CN(C(=O)NCCC(=O)N3CCN(c4ccccc4)CC3)CC[C@H]21	ZINC000875184347	GD	On-Demand	Anodyne	DRD3	19	43
CN1CC[C@H]2CN(C(=O)NCCC(=O)N3CCN(c4ccccc4)CC3)CC[C@H]21	ZINC000875184347	GD	On-Demand	Anodyne	SSTR1	51	37
CN1CC[C@H]2CN(C(=O)NCCC(=O)N3CCN(c4ccccc4)CC3)CC[C@H]21	ZINC000875184347	GD	On-Demand	Anodyne	ADAM10	36	43
CN1CC[C@H]2CN(C(=O)NCCC(=O)N3CCN(c4ccccc4)CC3)CC[C@H]21	ZINC000875184347	GD	On-Demand	Anodyne	CCR8	45	33
CN1CC[C@H]2CN(C(=O)NCCC(=O)N3CCN(c4ccccc4)CC3)CC[C@@H]21	ZINC000875184348	GD	On-Demand	Anodyne	HTR1A	16	40
CN1CC[C@H]2CN(C(=O)NCCC(=O)N3CCN(c4ccccc4)CC3)CC[C@@H]21	ZINC000875184348	GD	On-Demand	Anodyne	DRD3	19	43
CN1CC[C@H]2CN(C(=O)NCCC(=O)N3CCN(c4ccccc4)CC3)CC[C@@H]21	ZINC000875184348	GD	On-Demand	Anodyne	SSTR1	51	37
CN1CC[C@H]2CN(C(=O)NCCC(=O)N3CCN(c4ccccc4)CC3)CC[C@@H]21	ZINC000875184348	GD	On-Demand	Anodyne	ADAM10	36	43
CN1CC[C@H]2CN(C(=O)NCCC(=O)N3CCN(c4ccccc4)CC3)CC[C@@H]21	ZINC000875184348	GD	On-Demand	Anodyne	CCR8	45	33
O=C(NCCC(=O)N1CCN(c2ccccn2)CC1)N[C@H]1CCCC[C@H]1F	ZINC000875184361	GD	On-Demand	Anodyne	Q59401_ENTCL	46	32
CC[C@H](C[C@H](C)O)NC(=O)NCCC(=O)N1CCCCCC1	ZINC000875184388	DD	On-Demand	Anodyne	RIR1_HHV11	78	46
C#CC[C@H](CCOC)NC(=O)NCCC(=O)N1CCN(c2ccccc2)CC1	ZINC000875184391	GD	On-Demand	Mild	P2RY12	68	34
C#CC[C@@H](CCOC)NC(=O)NCCC(=O)N1CCN(c2ccccc2)CC1	ZINC000875184392	GD	On-Demand	Mild	P2RY12	68	34
O=C(NCCC(=O)N1CCCCCC1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875184403	GE	On-Demand	Anodyne	HRH2	25	43
O=C(NCCC(=O)N1CCCCCC1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875184403	GE	On-Demand	Anodyne	DPP7	58	48
O=C(NCCC(=O)N1CCCCCC1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875184404	GE	On-Demand	Anodyne	HRH2	25	43
O=C(NCCC(=O)N1CCCCCC1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875184404	GE	On-Demand	Anodyne	DPP7	58	48
CN1CCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)CCC1(C)C	ZINC000875184406	GD	On-Demand	Anodyne	HTR1A	49	45
CN1CCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)CCC1(C)C	ZINC000875184406	GD	On-Demand	Anodyne	DRD2	40	40
CN1CCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)CCC1(C)C	ZINC000875184406	GD	On-Demand	Anodyne	ADRA1D	39	42
CN1CCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)CCC1(C)C	ZINC000875184406	GD	On-Demand	Anodyne	HTR2A	39	43
CN1CCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)CCC1(C)C	ZINC000875184406	GD	On-Demand	Anodyne	ADRA1A	55	40
CN1CCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)CCC1(C)C	ZINC000875184406	GD	On-Demand	Anodyne	ADRA1B	30	42
CN1CCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)CCC1(C)C	ZINC000875184406	GD	On-Demand	Anodyne	DRD3	58	43
CN1CCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)CCC1(C)C	ZINC000875184406	GD	On-Demand	Anodyne	HTR7	41	38
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(Cl)c2cccnc12	ZINC000875184427	IG	On-Demand	Anodyne	CASP3	15	47
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(Cl)c2cccnc12	ZINC000875184427	IG	On-Demand	Anodyne	KLK3	90	46
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(Cl)c2cccnc12	ZINC000875184427	IG	On-Demand	Anodyne	CTSB	60	40
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(Cl)c2cccnc12	ZINC000875184427	IG	On-Demand	Anodyne	PAPA1_CARPA	67	36
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(Cl)c2cccnc12	ZINC000875184427	IG	On-Demand	Anodyne	CYSP_TRYCR	56	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(Cl)c2cccnc12	ZINC000875184427	IG	On-Demand	Anodyne	CTSK	32	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(Cl)c2cccnc12	ZINC000875184427	IG	On-Demand	Anodyne	CTSL	45	38
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(Cl)c2cccnc12	ZINC000875184427	IG	On-Demand	Anodyne	CAPNS1	57	34
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(Cl)c2cccnc12	ZINC000875184427	IG	On-Demand	Anodyne	HDAC2	19	50
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(Cl)c2cccnc12	ZINC000875184427	IG	On-Demand	Anodyne	MMP11	72	35
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(Cl)c2cccnc12	ZINC000875184427	IG	On-Demand	Anodyne	CAPN1	74	49
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(Cl)c2cccnc12	ZINC000875184427	IG	On-Demand	Anodyne	CAPN2	120	40
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(Cl)c2cccnc12	ZINC000875184427	IG	On-Demand	Anodyne	TPSAB1	44	36
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(Cl)c2cccnc12	ZINC000875184427	IG	On-Demand	Anodyne	NPR	46	30
O=C(NC1CCN(CCO)CC1)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875184444	GC	On-Demand	Anodyne	CCR3	38	40
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(NC(=O)c3cccnc3)cc2)C1	ZINC000875184470	GF	On-Demand	Anodyne	CHRNA7	45	37
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(NC(=O)c3cccnc3)cc2)C1	ZINC000875184470	GF	On-Demand	Anodyne	PRNP	45	38
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(NC(=O)c3cccnc3)cc2)C1	ZINC000875184470	GF	On-Demand	Anodyne	PREP	17	43
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(NC(=O)c3cccnc3)cc2)C1	ZINC000875184470	GF	On-Demand	Anodyne	NAMPT	132	50
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(NC(=O)c3cccnc3)cc2)C1	ZINC000875184471	GF	On-Demand	Anodyne	CHRNA7	45	37
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(NC(=O)c3cccnc3)cc2)C1	ZINC000875184471	GF	On-Demand	Anodyne	PRNP	45	38
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(NC(=O)c3cccnc3)cc2)C1	ZINC000875184471	GF	On-Demand	Anodyne	PREP	17	43
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(NC(=O)c3cccnc3)cc2)C1	ZINC000875184471	GF	On-Demand	Anodyne	NAMPT	132	50
CCOC1CC2(C1)C[C@@H]2NC(=O)NCc1cccc(N(C)C)c1	ZINC000875184484	DF	On-Demand	Anodyne	TIMP3	42	37
CCOC1CC2(C1)C[C@H]2NC(=O)NCc1cccc(N(C)C)c1	ZINC000875184485	DF	On-Demand	Anodyne	TIMP3	42	37
O=C(Cc1cccc(F)c1)NCCNC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875184489	GE	On-Demand	Anodyne	SLC12A5	42	34
O=C(Cc1cccc(F)c1)NCCNC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875184490	GE	On-Demand	Anodyne	SLC12A5	42	34
CN1CCN(C2CCN(C(=O)NCc3cccc(N(C)C)c3)CC2)CC1	ZINC000875184521	FD	On-Demand	Anodyne	L3MBTL3	75	40
O=C(NCc1cccc2ncccc12)C(=O)NC1CCN(CCO)CC1	ZINC000875184522	FC	On-Demand	Anodyne	SIGMAR1	15	41
CN(C(=O)[C@H](Cc1cccnc1)C1CCCC1)c1ccccn1	ZINC000875184626	DG	On-Demand	Anodyne	C3AR1	42	40
Cc1ccc(N2CCC[C@@H](NC(=O)C(=O)NCCCCC3CC3)C2)nn1	ZINC000875184649	FD	On-Demand	Anodyne	SCD1	22	40
COCC(C)(C)CCNC(=O)NCCC(=O)N1CCN(c2ccccn2)CC1	ZINC000875184650	GD	On-Demand	Anodyne	DRD4	24	42
O=C(CCNC(=O)N1C[C@H]2CC=CC[C@H]2C1)N1CCN(c2ccccn2)CC1	ZINC000875184655	GD	On-Demand	Anodyne	SSTR1	20	41
COC(=O)c1ccc(CC(=O)Oc2cccc(C(=O)NC3CC3)c2)cn1	ZINC000875184675	FD	On-Demand	Anodyne	PLG	16	40
COC(=O)c1ccc(CC(=O)Oc2cccc(C(=O)NC3CC3)c2)cn1	ZINC000875184675	FD	On-Demand	Anodyne	DRD4	40	31
COC(=O)c1ccc(CC(=O)Oc2cccc(C(=O)NC3CC3)c2)cn1	ZINC000875184675	FD	On-Demand	Anodyne	MAPK14	30	40
COC(=O)c1ccc(CC(=O)Oc2cccc(C(=O)NC3CC3)c2)cn1	ZINC000875184675	FD	On-Demand	Anodyne	PDE4B	53	33
COC(=O)c1ccc(CC(=O)Oc2cccc(C(=O)NC3CC3)c2)cn1	ZINC000875184675	FD	On-Demand	Anodyne	FAAH	32	42
COC(=O)c1ccc(CC(=O)Oc2cccc(C(=O)NC3CC3)c2)cn1	ZINC000875184675	FD	On-Demand	Anodyne	ST14	15	40
COC(=O)c1ccc(CC(=O)Oc2cccc(C(=O)NC3CC3)c2)cn1	ZINC000875184675	FD	On-Demand	Anodyne	MCHR1	15	45
COC(=O)N(C)NC(=O)NCCC(=O)N1CCN(c2ccccc2)CC1	ZINC000875184704	FC	On-Demand	Reactive	HTR1A	15	40
COC(=O)N(C)NC(=O)NCCC(=O)N1CCN(c2ccccc2)CC1	ZINC000875184704	FC	On-Demand	Reactive	DRD3	17	40
COC(=O)N(C)NC(=O)NCCC(=O)N1CCN(c2ccccc2)CC1	ZINC000875184704	FC	On-Demand	Reactive	SSTR1	44	40
CN(C(=O)[C@H](F)[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccccn1	ZINC000875184751	EF	On-Demand	Anodyne	GPR119	50	49
CN(C(=O)[C@H](F)[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccccn1	ZINC000875184754	EF	On-Demand	Anodyne	GPR119	50	49
O=CN1CCCN(C(=O)NCc2ccc(NC(=O)c3cccnc3)cc2)CC1	ZINC000875184795	GD	On-Demand	Anodyne	NAMPT	105	47
Cc1ccc(CNC(=O)C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)o1	ZINC000875184806	GD	On-Demand	Anodyne	HTR4	49	35
Cc1ccc(CNC(=O)C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)o1	ZINC000875184806	GD	On-Demand	Anodyne	CACNA1I	53	36
Cc1ccc(CNC(=O)C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)o1	ZINC000875184807	GD	On-Demand	Anodyne	HTR4	49	35
Cc1ccc(CNC(=O)C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)o1	ZINC000875184807	GD	On-Demand	Anodyne	CACNA1I	53	36
O=C(NC1CCN(CCO)CC1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875184811	GC	On-Demand	Anodyne	SIGMAR1	16	45
O=C(NC1CCN(CCO)CC1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875184811	GC	On-Demand	Anodyne	CCR5	16	41
O=C(NC1CCN(CCO)CC1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875184812	GC	On-Demand	Anodyne	SIGMAR1	16	45
O=C(NC1CCN(CCO)CC1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875184812	GC	On-Demand	Anodyne	CCR5	16	41
O=C(NC1CCN(CCO)CC1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875184813	GC	On-Demand	Anodyne	SIGMAR1	16	45
O=C(NC1CCN(CCO)CC1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875184813	GC	On-Demand	Anodyne	CCR5	16	41
O=C(NC1CCN(CCO)CC1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875184814	GC	On-Demand	Anodyne	SIGMAR1	16	45
O=C(NC1CCN(CCO)CC1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875184814	GC	On-Demand	Anodyne	CCR5	16	41
CONC(=O)C1CCN(C(=O)NCCNC(=O)Cc2cccc(F)c2)CC1	ZINC000875184834	GC	On-Demand	Anodyne	EPHX2	20	43
CONC(=O)C1CCN(C(=O)NCCNC(=O)Cc2cccc(F)c2)CC1	ZINC000875184834	GC	On-Demand	Anodyne	CACNA1G	38	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(N(C)C)c1	ZINC000875184839	CE	On-Demand	Anodyne	ANPEP	18	44
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(N(C)C)c1	ZINC000875184839	CE	On-Demand	Anodyne	PDS	49	33
CN1CCN(C(=O)NCc2ccc(NC(=O)c3cccnc3)cc2)CCC1(C)C	ZINC000875184846	GF	On-Demand	Anodyne	NAMPT	102	43
O=C(NC1CCN(CCO)CC1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875184851	GC	On-Demand	Anodyne	CHRNA7	46	36
O=C(NC1CCN(CCO)CC1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875184851	GC	On-Demand	Anodyne	C3AR1	48	47
O=C(NC1CCN(CCO)CC1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875184852	GC	On-Demand	Anodyne	CHRNA7	46	36
O=C(NC1CCN(CCO)CC1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875184852	GC	On-Demand	Anodyne	C3AR1	48	47
CC(=O)C1CCN(C(=O)NCc2cccc(N(C)C)c2)CC1	ZINC000875184880	DE	On-Demand	Anodyne	EPHX2	19	41
O=C(NC1CC1)c1cccc(OC(=O)c2scnc2C(F)F)c1	ZINC000875184888	EG	On-Demand	Anodyne	FAAH	20	40
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCC(=O)N2CCN(c3ccccc3)CC2)C1	ZINC000875184896	GD	On-Demand	Anodyne	SSTR1	40	36
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(OC)n1	ZINC000875184935	DD	On-Demand	Anodyne	SLC6A4	28	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(OC)n1	ZINC000875184935	DD	On-Demand	Anodyne	SLC6A3	50	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(OC)n1	ZINC000875184936	DD	On-Demand	Anodyne	SLC6A4	28	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(OC)n1	ZINC000875184936	DD	On-Demand	Anodyne	SLC6A3	50	38
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NC2CCN(CC#N)CC2)c1	ZINC000875184938	FD	On-Demand	Mild	SSTR5	31	43
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NC2CCN(CC#N)CC2)c1	ZINC000875184939	FD	On-Demand	Mild	SSTR5	31	43
C#CC[C@@H](COC)NC(=O)C(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875184981	GC	On-Demand	Mild	GRIN2B	54	38
C#CC[C@H](COC)NC(=O)C(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875184982	GC	On-Demand	Mild	GRIN2B	54	38
O=C(Cc1cccc(F)c1)NCCNC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875184989	GF	On-Demand	Anodyne	EPHX2	19	41
O=C(Cc1cccc(F)c1)NCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875184990	GF	On-Demand	Anodyne	EPHX2	19	41
C[C@@H](NC(=O)NCCNC(=O)Cc1cccc(F)c1)c1ccccc1O	ZINC000875185010	FE	On-Demand	Clean	ANPEP	16	45
C[C@H](NC(=O)NCCNC(=O)Cc1cccc(F)c1)c1ccccc1O	ZINC000875185011	FE	On-Demand	Clean	ANPEP	16	45
O=C(Nc1ccc(CNC(=O)N2C[C@H]3CC=CC[C@H]3C2)cc1)c1cccnc1	ZINC000875185019	GG	On-Demand	Anodyne	CHRNA7	40	37
O=C(Nc1ccc(CNC(=O)N2C[C@H]3CC=CC[C@H]3C2)cc1)c1cccnc1	ZINC000875185019	GG	On-Demand	Anodyne	CYP2C9	20	40
O=C(Nc1ccc(CNC(=O)N2C[C@H]3CC=CC[C@H]3C2)cc1)c1cccnc1	ZINC000875185019	GG	On-Demand	Anodyne	NAMPT	122	43
CO[C@@H]1CC[C@@H](C)N(C(=O)NCc2ccc(NC(=O)c3cccnc3)cc2)C1	ZINC000875185024	GG	On-Demand	Anodyne	PANC	45	33
CO[C@@H]1CC[C@@H](C)N(C(=O)NCc2ccc(NC(=O)c3cccnc3)cc2)C1	ZINC000875185024	GG	On-Demand	Anodyne	NOD2	40	34
CO[C@@H]1CC[C@@H](C)N(C(=O)NCc2ccc(NC(=O)c3cccnc3)cc2)C1	ZINC000875185024	GG	On-Demand	Anodyne	NAMPT	92	40
O=C(Cc1cccc(F)c1)NCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875185073	GE	On-Demand	Anodyne	KCNQ2	16	42
O=C(Cc1cccc(F)c1)NCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875185074	GE	On-Demand	Anodyne	KCNQ2	16	42
O=C(Cc1cccc(F)c1)NCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875185075	GE	On-Demand	Anodyne	KCNQ2	16	42
O=C(Cc1cccc(F)c1)NCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875185076	GE	On-Demand	Anodyne	KCNQ2	16	42
C[C@H](NC(=O)NCCC(=O)N1CCN(c2ccccc2)CC1)c1ccccc1O	ZINC000875185085	GE	On-Demand	Clean	MC4R	18	40
C[C@@H](NC(=O)NCCC(=O)N1CCN(c2ccccc2)CC1)c1ccccc1O	ZINC000875185086	GE	On-Demand	Clean	MC4R	18	40
Cc1nccnc1[C@H](C)NC(=O)NCCC(=O)N1CCN(c2ccccc2)CC1	ZINC000875185094	GD	On-Demand	Anodyne	PTAFR	28	42
Cc1nccnc1[C@@H](C)NC(=O)NCCC(=O)N1CCN(c2ccccc2)CC1	ZINC000875185095	GD	On-Demand	Anodyne	PTAFR	28	42
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875185117	FC	On-Demand	Reactive	HTR1A	74	46
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875185117	FC	On-Demand	Reactive	DRD2	58	42
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875185117	FC	On-Demand	Reactive	DRD4	44	36
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875185117	FC	On-Demand	Reactive	ADRA1D	40	45
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875185117	FC	On-Demand	Reactive	HTR2A	53	44
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875185117	FC	On-Demand	Reactive	HTR2C	37	42
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875185117	FC	On-Demand	Reactive	ADRA1A	53	45
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875185117	FC	On-Demand	Reactive	ADRA1B	24	43
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875185117	FC	On-Demand	Reactive	DRD3	86	44
COC(=O)N(C)NC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000875185117	FC	On-Demand	Reactive	HTR7	79	41
O=C(NCCCN1CCN(c2ccncc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875185130	GC	On-Demand	Anodyne	HTR1A	54	48
O=C(NCCCN1CCN(c2ccncc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875185130	GC	On-Demand	Anodyne	DRD2	44	44
O=C(NCCCN1CCN(c2ccncc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875185130	GC	On-Demand	Anodyne	DRD4	25	42
O=C(NCCCN1CCN(c2ccncc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875185130	GC	On-Demand	Anodyne	ADRA1D	37	44
O=C(NCCCN1CCN(c2ccncc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875185130	GC	On-Demand	Anodyne	HTR2A	46	48
O=C(NCCCN1CCN(c2ccncc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875185130	GC	On-Demand	Anodyne	HTR2C	31	42
O=C(NCCCN1CCN(c2ccncc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875185130	GC	On-Demand	Anodyne	ADRA1A	53	42
O=C(NCCCN1CCN(c2ccncc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875185130	GC	On-Demand	Anodyne	ADRA1B	29	44
O=C(NCCCN1CCN(c2ccncc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875185130	GC	On-Demand	Anodyne	DRD3	62	48
O=C(NCCCN1CCN(c2ccncc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875185130	GC	On-Demand	Anodyne	HTR7	48	39
COCC1CC(NC(=O)NCCC(=O)N2CCN(c3ccccn3)CC2)C1	ZINC000875185146	GC	On-Demand	Anodyne	DRD4	25	41
O=C(CCNC(=O)N1Cc2cccc(O)c2C1)N1CCN(c2ccccn2)CC1	ZINC000875185156	GD	On-Demand	Clean	DRD4	23	42
O=C(CCNC(=O)N1Cc2cccc(O)c2C1)N1CCN(c2ccccn2)CC1	ZINC000875185156	GD	On-Demand	Clean	SSTR1	25	41
O=C(NCCC(=O)N1CCN(c2ccccc2)CC1)N[C@H]1CC12CCC2	ZINC000875185161	FD	On-Demand	Anodyne	ADAM10	38	42
O=C(NCCC(=O)N1CCN(c2ccccc2)CC1)N[C@@H]1CC12CCC2	ZINC000875185162	FD	On-Demand	Anodyne	ADAM10	38	42
COC(=O)[C@@]12C[C@@H](NC(=O)NCCC(=O)NCc3ccccc3)C[C@@H]1C2	ZINC000875185167	FD	On-Demand	Anodyne	EPHX2	19	42
CCCCCCCNC(=O)C(=O)N[C@@H]1CCc2ncnn2C1	ZINC000875185187	DC	On-Demand	Mild	ASAH1	68	33
CCCCCCCNC(=O)C(=O)N[C@@H]1CCc2ncnn2C1	ZINC000875185187	DC	On-Demand	Mild	LASR	44	31
CCCCCCCNC(=O)C(=O)N[C@H]1CCc2ncnn2C1	ZINC000875185188	DC	On-Demand	Mild	ASAH1	68	33
CCCCCCCNC(=O)C(=O)N[C@H]1CCc2ncnn2C1	ZINC000875185188	DC	On-Demand	Mild	LASR	44	31
CC(=O)C1CCN(C(=O)NCc2ccc(NC(=O)c3cccnc3)cc2)CC1	ZINC000875185213	GF	On-Demand	Anodyne	TRPV1	15	40
CC(=O)C1CCN(C(=O)NCc2ccc(NC(=O)c3cccnc3)cc2)CC1	ZINC000875185213	GF	On-Demand	Anodyne	CHRNA7	50	37
CC(=O)C1CCN(C(=O)NCc2ccc(NC(=O)c3cccnc3)cc2)CC1	ZINC000875185213	GF	On-Demand	Anodyne	PRNP	52	39
CC(=O)C1CCN(C(=O)NCc2ccc(NC(=O)c3cccnc3)cc2)CC1	ZINC000875185213	GF	On-Demand	Anodyne	EPHX2	21	43
CC(=O)C1CCN(C(=O)NCc2ccc(NC(=O)c3cccnc3)cc2)CC1	ZINC000875185213	GF	On-Demand	Anodyne	CYP2C9	26	41
CC(=O)C1CCN(C(=O)NCc2ccc(NC(=O)c3cccnc3)cc2)CC1	ZINC000875185213	GF	On-Demand	Anodyne	SCD	19	40
CC(=O)C1CCN(C(=O)NCc2ccc(NC(=O)c3cccnc3)cc2)CC1	ZINC000875185213	GF	On-Demand	Anodyne	NAMPT	160	45
Cc1cncc([C@@H]2CCCN2C(=O)NCc2cccc(N(C)C)c2)c1	ZINC000875185223	EH	On-Demand	Anodyne	PREP	39	41
Cc1cncc([C@H]2CCCN2C(=O)NCc2cccc(N(C)C)c2)c1	ZINC000875185224	EH	On-Demand	Anodyne	PREP	39	41
COc1ccccc1[C@H]1CN(C(=O)C(=O)NC2CCN(CCO)CC2)CCO1	ZINC000875185246	GC	On-Demand	Anodyne	DRD2	24	44
COc1ccccc1[C@H]1CN(C(=O)C(=O)NC2CCN(CCO)CC2)CCO1	ZINC000875185246	GC	On-Demand	Anodyne	DRD4	24	41
COc1ccccc1[C@H]1CN(C(=O)C(=O)NC2CCN(CCO)CC2)CCO1	ZINC000875185246	GC	On-Demand	Anodyne	HTR4	31	42
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NC2CCN(CCO)CC2)CCO1	ZINC000875185247	GC	On-Demand	Anodyne	DRD2	24	44
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NC2CCN(CCO)CC2)CCO1	ZINC000875185247	GC	On-Demand	Anodyne	DRD4	24	41
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NC2CCN(CCO)CC2)CCO1	ZINC000875185247	GC	On-Demand	Anodyne	HTR4	31	42
Cc1ccc(N2CCC[C@@H](NC(=O)C(=O)NCC[C@@H]3CCSC3)C2)nn1	ZINC000875185252	GD	On-Demand	Anodyne	SIRT2	44	31
Cc1ccc(N2CCC[C@@H](NC(=O)C(=O)NCC[C@@H]3CCSC3)C2)nn1	ZINC000875185252	GD	On-Demand	Anodyne	SIRT1	40	32
Cc1ccc(N2CCC[C@@H](NC(=O)C(=O)NCC[C@H]3CCSC3)C2)nn1	ZINC000875185254	GD	On-Demand	Anodyne	SIRT2	44	31
Cc1ccc(N2CCC[C@@H](NC(=O)C(=O)NCC[C@H]3CCSC3)C2)nn1	ZINC000875185254	GD	On-Demand	Anodyne	SIRT1	40	32
CC(=O)C1CCN(C(=O)NCCC(=O)N2CCN(c3ccccc3)CC2)CC1	ZINC000875185282	GD	On-Demand	Anodyne	SSTR1	44	40
CC(=O)C1CCN(C(=O)NCCC(=O)N2CCN(c3ccccc3)CC2)CC1	ZINC000875185282	GD	On-Demand	Anodyne	ADAM10	37	42
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(C(=O)Cc2ccccc2OC)CC1	ZINC000875185294	GE	On-Demand	Anodyne	EPHX2	30	42
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875185298	FE	On-Demand	Anodyne	SSTR2	62	35
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875185298	FE	On-Demand	Anodyne	TACR1	24	40
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875185298	FE	On-Demand	Anodyne	CCKAR	101	41
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875185298	FE	On-Demand	Anodyne	NMBR	42	40
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875185298	FE	On-Demand	Anodyne	MC3R	62	38
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875185298	FE	On-Demand	Anodyne	MC5R	63	42
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875185298	FE	On-Demand	Anodyne	GRPR	74	32
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875185298	FE	On-Demand	Anodyne	ECE1	40	33
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875185298	FE	On-Demand	Anodyne	MMP11	62	34
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875185298	FE	On-Demand	Anodyne	CCKBR	92	42
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875185298	FE	On-Demand	Anodyne	GHSR	54	36
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875185298	FE	On-Demand	Anodyne	MMP9	15	46
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875185298	FE	On-Demand	Anodyne	MC1R	78	38
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875185298	FE	On-Demand	Anodyne	KISS1R	51	31
CC[C@H](C(=O)N1CCC(NC(=O)NC2CC(COC)C2)CC1)c1ccccc1	ZINC000875185306	GF	On-Demand	Anodyne	CHRM1	19	45
CC[C@H](C(=O)N1CCC(NC(=O)NC2CC(COC)C2)CC1)c1ccccc1	ZINC000875185306	GF	On-Demand	Anodyne	C3AR1	36	40
CC[C@H](C(=O)N1CCC(NC(=O)NC2CC(COC)C2)CC1)c1ccccc1	ZINC000875185306	GF	On-Demand	Anodyne	EPHX2	50	47
CC[C@@H](C(=O)N1CCC(NC(=O)NC2CC(COC)C2)CC1)c1ccccc1	ZINC000875185307	GF	On-Demand	Anodyne	CHRM1	19	45
CC[C@@H](C(=O)N1CCC(NC(=O)NC2CC(COC)C2)CC1)c1ccccc1	ZINC000875185307	GF	On-Demand	Anodyne	C3AR1	36	40
CC[C@@H](C(=O)N1CCC(NC(=O)NC2CC(COC)C2)CC1)c1ccccc1	ZINC000875185307	GF	On-Demand	Anodyne	EPHX2	50	47
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N[C@H]1CC12CCC2	ZINC000875185321	EE	On-Demand	Anodyne	ACHE	25	41
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N[C@H]1CC12CCC2	ZINC000875185321	EE	On-Demand	Anodyne	BCHE	17	41
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N[C@H]1CC12CCC2	ZINC000875185321	EE	On-Demand	Anodyne	NMBR	80	34
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N[C@H]1CC12CCC2	ZINC000875185321	EE	On-Demand	Anodyne	GRPR	42	33
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N[C@@H]1CC12CCC2	ZINC000875185322	EE	On-Demand	Anodyne	ACHE	25	41
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N[C@@H]1CC12CCC2	ZINC000875185322	EE	On-Demand	Anodyne	BCHE	17	41
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N[C@@H]1CC12CCC2	ZINC000875185322	EE	On-Demand	Anodyne	NMBR	80	34
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N[C@@H]1CC12CCC2	ZINC000875185322	EE	On-Demand	Anodyne	GRPR	42	33
CCO[C@H](C(=O)N1C[C@@H]2CCCN2Cc2ccccc21)[C@@H]1CCOC1	ZINC000875185323	EE	On-Demand	Anodyne	AVPR2	20	40
CCO[C@H](C(=O)N1C[C@H]2CCCN2Cc2ccccc21)[C@@H]1CCOC1	ZINC000875185324	EE	On-Demand	Anodyne	AVPR2	20	40
CCO[C@H](C(=O)N1C[C@@H]2CCCN2Cc2ccccc21)[C@H]1CCOC1	ZINC000875185325	EE	On-Demand	Anodyne	AVPR2	20	40
CCO[C@H](C(=O)N1C[C@H]2CCCN2Cc2ccccc21)[C@H]1CCOC1	ZINC000875185326	EE	On-Demand	Anodyne	AVPR2	20	40
CC[C@H](C(=O)N1CCC(NC(=O)NC2(C)CC(F)(F)C2)CC1)c1ccccc1	ZINC000875185334	GH	On-Demand	Anodyne	EPHX2	43	46
CC[C@@H](C(=O)N1CCC(NC(=O)NC2(C)CC(F)(F)C2)CC1)c1ccccc1	ZINC000875185335	GH	On-Demand	Anodyne	EPHX2	43	46
CN1CCN(C(=O)NCc2ccc(NC(=O)c3ccncc3)cc2)CCC1(C)C	ZINC000875185412	GF	On-Demand	Anodyne	NAMPT	56	38
CC[C@H](C(=O)N1CCC(NC(=O)N2CCC[C@@H](C(C)=O)C2)CC1)c1ccccc1	ZINC000875185414	GG	On-Demand	Anodyne	KCNQ2	47	40
CC[C@H](C(=O)N1CCC(NC(=O)N2CCC[C@@H](C(C)=O)C2)CC1)c1ccccc1	ZINC000875185414	GG	On-Demand	Anodyne	EPHX2	31	41
CC[C@H](C(=O)N1CCC(NC(=O)N2CCC[C@@H](C(C)=O)C2)CC1)c1ccccc1	ZINC000875185414	GG	On-Demand	Anodyne	DPP7	59	38
CC[C@H](C(=O)N1CCC(NC(=O)N2CCC[C@H](C(C)=O)C2)CC1)c1ccccc1	ZINC000875185415	GG	On-Demand	Anodyne	KCNQ2	47	40
CC[C@H](C(=O)N1CCC(NC(=O)N2CCC[C@H](C(C)=O)C2)CC1)c1ccccc1	ZINC000875185415	GG	On-Demand	Anodyne	EPHX2	31	41
CC[C@H](C(=O)N1CCC(NC(=O)N2CCC[C@H](C(C)=O)C2)CC1)c1ccccc1	ZINC000875185415	GG	On-Demand	Anodyne	DPP7	59	38
CC[C@@H](C(=O)N1CCC(NC(=O)N2CCC[C@H](C(C)=O)C2)CC1)c1ccccc1	ZINC000875185416	GG	On-Demand	Anodyne	KCNQ2	47	40
CC[C@@H](C(=O)N1CCC(NC(=O)N2CCC[C@H](C(C)=O)C2)CC1)c1ccccc1	ZINC000875185416	GG	On-Demand	Anodyne	EPHX2	31	41
CC[C@@H](C(=O)N1CCC(NC(=O)N2CCC[C@H](C(C)=O)C2)CC1)c1ccccc1	ZINC000875185416	GG	On-Demand	Anodyne	DPP7	59	38
CC[C@@H](C(=O)N1CCC(NC(=O)N2CCC[C@@H](C(C)=O)C2)CC1)c1ccccc1	ZINC000875185417	GG	On-Demand	Anodyne	KCNQ2	47	40
CC[C@@H](C(=O)N1CCC(NC(=O)N2CCC[C@@H](C(C)=O)C2)CC1)c1ccccc1	ZINC000875185417	GG	On-Demand	Anodyne	EPHX2	31	41
CC[C@@H](C(=O)N1CCC(NC(=O)N2CCC[C@@H](C(C)=O)C2)CC1)c1ccccc1	ZINC000875185417	GG	On-Demand	Anodyne	DPP7	59	38
O=C(Nc1ccc(CNC(=O)N2C[C@H]3CC=CC[C@H]3C2)cc1)c1ccncc1	ZINC000875185461	GG	On-Demand	Anodyne	NAMPT	66	39
CC(C)n1ncc(C(=O)N2C[C@@H]3CCCN3Cc3ccccc32)c1Cl	ZINC000875185497	FH	On-Demand	Anodyne	AVPR2	66	38
CC(C)n1ncc(C(=O)N2C[C@H]3CCCN3Cc3ccccc32)c1Cl	ZINC000875185498	FH	On-Demand	Anodyne	AVPR2	66	38
CC[C@H](C(=O)N1CCC(NC(=O)N[C@H](C)c2ccnn2C)CC1)c1ccccc1	ZINC000875185506	GF	On-Demand	Anodyne	EPHX2	31	44
CC[C@H](C(=O)N1CCC(NC(=O)N[C@@H](C)c2ccnn2C)CC1)c1ccccc1	ZINC000875185507	GF	On-Demand	Anodyne	EPHX2	31	44
CC[C@@H](C(=O)N1CCC(NC(=O)N[C@@H](C)c2ccnn2C)CC1)c1ccccc1	ZINC000875185508	GF	On-Demand	Anodyne	EPHX2	31	44
CC[C@@H](C(=O)N1CCC(NC(=O)N[C@H](C)c2ccnn2C)CC1)c1ccccc1	ZINC000875185509	GF	On-Demand	Anodyne	EPHX2	31	44
COCC1CC(NC(=O)NC2CCN(C(=O)Cc3ccccc3OC)CC2)C1	ZINC000875185522	GD	On-Demand	Anodyne	GRIN2B	18	40
COCC1CC(NC(=O)NC2CCN(C(=O)Cc3ccccc3OC)CC2)C1	ZINC000875185522	GD	On-Demand	Anodyne	SIGMAR1	18	53
COCC1CC(NC(=O)NC2CCN(C(=O)Cc3ccccc3OC)CC2)C1	ZINC000875185522	GD	On-Demand	Anodyne	CCR3	20	50
COCC1CC(NC(=O)NC2CCN(C(=O)Cc3ccccc3OC)CC2)C1	ZINC000875185522	GD	On-Demand	Anodyne	EPHX2	47	46
COCC1CC(NC(=O)NC2CCN(C(=O)Cc3ccccc3OC)CC2)C1	ZINC000875185522	GD	On-Demand	Anodyne	CCR8	31	41
COC(=O)N(C)NC(=O)NCCc1cccc(C)c1	ZINC000875185526	CD	On-Demand	Reactive	MTNR1A	44	39
CC(=O)C1CCN(C(=O)NCc2ccc(NC(=O)c3ccncc3)cc2)CC1	ZINC000875185541	GF	On-Demand	Anodyne	PRNP	54	41
CC(=O)C1CCN(C(=O)NCc2ccc(NC(=O)c3ccncc3)cc2)CC1	ZINC000875185541	GF	On-Demand	Anodyne	NAMPT	106	43
O=C(c1cccn(C2CC2)c1=O)N1C[C@@H]2CCCN2Cc2ccccc21	ZINC000875185594	EF	On-Demand	Anodyne	AVPR2	71	41
O=C(c1cccn(C2CC2)c1=O)N1C[C@@H]2CCCN2Cc2ccccc21	ZINC000875185594	EF	On-Demand	Anodyne	AVPR1A	33	40
O=C(c1cccn(C2CC2)c1=O)N1C[C@H]2CCCN2Cc2ccccc21	ZINC000875185595	EF	On-Demand	Anodyne	AVPR2	71	41
O=C(c1cccn(C2CC2)c1=O)N1C[C@H]2CCCN2Cc2ccccc21	ZINC000875185595	EF	On-Demand	Anodyne	AVPR1A	33	40
CO[C@@H]1CC[C@@H](C)N(C(=O)NCc2ccc(NC(=O)c3ccncc3)cc2)C1	ZINC000875185602	GG	On-Demand	Anodyne	NOD2	42	36
CC[C@H](C(=O)N1CCC(NC(=O)NCCC(C)(C)OC)CC1)c1ccccc1	ZINC000875185609	GG	On-Demand	Anodyne	EPHX2	37	45
CC[C@@H](C(=O)N1CCC(NC(=O)NCCC(C)(C)OC)CC1)c1ccccc1	ZINC000875185610	GG	On-Demand	Anodyne	EPHX2	37	45
O=C(Nc1ccc(CNC(=O)N2CC[C@@H]3CSC[C@@H]3C2)cc1)c1ccncc1	ZINC000875185636	GG	On-Demand	Anodyne	NAMPT	73	41
O=C(Nc1ccc(CNC(=O)N2CC[C@@H]3CSC[C@H]3C2)cc1)c1ccncc1	ZINC000875185637	GG	On-Demand	Anodyne	NAMPT	73	41
O=C(Nc1ccc(CNC(=O)N2CC[C@H]3CSC[C@@H]3C2)cc1)c1ccncc1	ZINC000875185638	GG	On-Demand	Anodyne	NAMPT	73	41
O=C(Nc1ccc(CNC(=O)N2CC[C@H]3CSC[C@H]3C2)cc1)c1ccncc1	ZINC000875185639	GG	On-Demand	Anodyne	NAMPT	73	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cccc(C)c1	ZINC000875185647	DE	On-Demand	Anodyne	SLC6A3	52	38
O=C(NCc1ccc(NC(=O)c2ccc(F)cc2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875185663	FF	On-Demand	Anodyne	SSTR3	19	40
CN1CC[C@H]2CN(C(=O)NCc3ccc(NC(=O)c4ccncc4)cc3)CC[C@H]21	ZINC000875185680	GF	On-Demand	Anodyne	PRNP	45	39
CN1CC[C@H]2CN(C(=O)NCc3ccc(NC(=O)c4ccncc4)cc3)CC[C@H]21	ZINC000875185680	GF	On-Demand	Anodyne	NAMPT	69	41
CN1CC[C@H]2CN(C(=O)NCc3ccc(NC(=O)c4ccncc4)cc3)CC[C@@H]21	ZINC000875185681	GF	On-Demand	Anodyne	PRNP	45	39
CN1CC[C@H]2CN(C(=O)NCc3ccc(NC(=O)c4ccncc4)cc3)CC[C@@H]21	ZINC000875185681	GF	On-Demand	Anodyne	NAMPT	69	41
CC[C@H](C(=O)N1CCC(NC(=O)NCc2ccnc(F)c2)CC1)c1ccccc1	ZINC000875185696	GG	On-Demand	Anodyne	EPHX2	34	40
CC[C@@H](C(=O)N1CCC(NC(=O)NCc2ccnc(F)c2)CC1)c1ccccc1	ZINC000875185697	GG	On-Demand	Anodyne	EPHX2	34	40
CC[C@@H](C(=O)N1CCC(NC(=O)N2C[C@H]3CC=CC[C@H]3C2)CC1)c1ccccc1	ZINC000875185698	GH	On-Demand	Anodyne	EPHX2	32	44
CC[C@H](C(=O)N1CCC(NC(=O)N2C[C@H]3CC=CC[C@H]3C2)CC1)c1ccccc1	ZINC000875185699	GH	On-Demand	Anodyne	EPHX2	32	44
O=C(c1cccc2scnc12)N1C[C@@H]2CCCN2Cc2ccccc21	ZINC000875185701	EH	On-Demand	Anodyne	AVPR2	44	39
O=C(c1cccc2scnc12)N1C[C@H]2CCCN2Cc2ccccc21	ZINC000875185702	EH	On-Demand	Anodyne	AVPR2	44	39
COCC(C)(C)CCNC(=O)C(=O)NCC1(N2CCC(OC)CC2)CCCC1	ZINC000875185703	GD	On-Demand	Anodyne	HCN1	53	34
COCC(C)(C)CCNC(=O)C(=O)NCC1(N2CCC(OC)CC2)CCCC1	ZINC000875185703	GD	On-Demand	Anodyne	HCN4	52	34
CC[C@@H](C(=O)N1CCC(NC(=O)N[C@@H]2CCOC[C@H]2O)CC1)c1ccccc1	ZINC000875185706	GD	On-Demand	Anodyne	EPHX2	34	46
C#CC[C@@H](COC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185713	ED	On-Demand	Mild	TACR1	22	44
C#CC[C@@H](COC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185713	ED	On-Demand	Mild	CCKAR	80	41
C#CC[C@@H](COC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185713	ED	On-Demand	Mild	NMBR	17	45
C#CC[C@@H](COC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185713	ED	On-Demand	Mild	GRPR	51	36
C#CC[C@@H](COC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185713	ED	On-Demand	Mild	CCKBR	52	36
C#CC[C@@H](COC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185713	ED	On-Demand	Mild	GHSR	55	36
C#CC[C@@H](COC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185713	ED	On-Demand	Mild	MMP9	16	49
C#CC[C@@H](COC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185713	ED	On-Demand	Mild	MC1R	44	37
C#CC[C@@H](COC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185713	ED	On-Demand	Mild	MMP1	16	40
C#CC[C@@H](COC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185713	ED	On-Demand	Mild	KISS1R	53	31
C#CC[C@H](COC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185714	ED	On-Demand	Mild	TACR1	22	44
C#CC[C@H](COC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185714	ED	On-Demand	Mild	CCKAR	80	41
C#CC[C@H](COC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185714	ED	On-Demand	Mild	NMBR	17	45
C#CC[C@H](COC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185714	ED	On-Demand	Mild	GRPR	51	36
C#CC[C@H](COC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185714	ED	On-Demand	Mild	CCKBR	52	36
C#CC[C@H](COC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185714	ED	On-Demand	Mild	GHSR	55	36
C#CC[C@H](COC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185714	ED	On-Demand	Mild	MMP9	16	49
C#CC[C@H](COC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185714	ED	On-Demand	Mild	MC1R	44	37
C#CC[C@H](COC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185714	ED	On-Demand	Mild	MMP1	16	40
C#CC[C@H](COC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185714	ED	On-Demand	Mild	KISS1R	53	31
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185718	FD	On-Demand	Mild	SSTR2	54	35
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185718	FD	On-Demand	Mild	TACR1	23	41
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185718	FD	On-Demand	Mild	CCKAR	100	40
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185718	FD	On-Demand	Mild	NMBR	19	44
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185718	FD	On-Demand	Mild	MC3R	41	38
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185718	FD	On-Demand	Mild	GRPR	50	33
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185718	FD	On-Demand	Mild	ECE1	44	34
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185718	FD	On-Demand	Mild	MMP11	51	33
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185718	FD	On-Demand	Mild	CCKBR	76	36
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185718	FD	On-Demand	Mild	GHSR	57	36
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185718	FD	On-Demand	Mild	MMP9	17	48
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185718	FD	On-Demand	Mild	MC1R	53	38
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185718	FD	On-Demand	Mild	MMP1	16	41
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185718	FD	On-Demand	Mild	KISS1R	66	33
C#CC[C@H](CCOC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185719	FD	On-Demand	Mild	SSTR2	54	35
C#CC[C@H](CCOC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185719	FD	On-Demand	Mild	TACR1	23	41
C#CC[C@H](CCOC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185719	FD	On-Demand	Mild	CCKAR	100	40
C#CC[C@H](CCOC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185719	FD	On-Demand	Mild	NMBR	19	44
C#CC[C@H](CCOC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185719	FD	On-Demand	Mild	MC3R	41	38
C#CC[C@H](CCOC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185719	FD	On-Demand	Mild	GRPR	50	33
C#CC[C@H](CCOC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185719	FD	On-Demand	Mild	ECE1	44	34
C#CC[C@H](CCOC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185719	FD	On-Demand	Mild	MMP11	51	33
C#CC[C@H](CCOC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185719	FD	On-Demand	Mild	CCKBR	76	36
C#CC[C@H](CCOC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185719	FD	On-Demand	Mild	GHSR	57	36
C#CC[C@H](CCOC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185719	FD	On-Demand	Mild	MMP9	17	48
C#CC[C@H](CCOC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185719	FD	On-Demand	Mild	MC1R	53	38
C#CC[C@H](CCOC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185719	FD	On-Demand	Mild	MMP1	16	41
C#CC[C@H](CCOC)NC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185719	FD	On-Demand	Mild	KISS1R	66	33
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(Oc2cccc(F)c2)nc1	ZINC000875185729	FG	On-Demand	Anodyne	PDS	56	43
CC(=O)C1CCN(C(=O)C(=O)NCCc2ccc(OCC(C)C)cc2)CC1	ZINC000875185730	FE	On-Demand	Anodyne	ADRB1	31	41
CC(=O)C1CCN(C(=O)C(=O)NCCc2ccc(OCC(C)C)cc2)CC1	ZINC000875185730	FE	On-Demand	Anodyne	ADRB3	17	41
O=C(NCCc1cc(F)cc(F)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875185737	FH	On-Demand	Anodyne	EPHX2	15	40
O=C(NCCc1cc(F)cc(F)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875185738	FH	On-Demand	Anodyne	EPHX2	15	40
O=C1CCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)CCCCCCN1	ZINC000875185744	GE	On-Demand	Anodyne	MC4R	26	43
O=C1CCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)CCCCCCN1	ZINC000875185744	GE	On-Demand	Anodyne	MC3R	56	39
O=C1CCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)CCCCCCN1	ZINC000875185744	GE	On-Demand	Anodyne	MC5R	45	43
O=C1CCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)CCCCCCN1	ZINC000875185744	GE	On-Demand	Anodyne	MC1R	53	43
O=C1CCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)CCCCCCN1	ZINC000875185744	GE	On-Demand	Anodyne	KISS1R	49	31
CC[C@H](C(=O)N1CCC(NC(=O)N[C@H](CC)C[C@H](C)O)CC1)c1ccccc1	ZINC000875185747	GG	On-Demand	Anodyne	KCNQ2	44	38
CC[C@H](C(=O)N1CCC(NC(=O)N[C@H](CC)C[C@H](C)O)CC1)c1ccccc1	ZINC000875185747	GG	On-Demand	Anodyne	EPHX2	35	47
CC[C@H](C(=O)N1CCC(NC(=O)N[C@H](CC)C[C@H](C)O)CC1)c1ccccc1	ZINC000875185747	GG	On-Demand	Anodyne	CCR8	23	40
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(C(=O)[C@H](CC)c2ccccc2)CC1	ZINC000875185748	GG	On-Demand	Anodyne	KCNQ2	44	38
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(C(=O)[C@H](CC)c2ccccc2)CC1	ZINC000875185748	GG	On-Demand	Anodyne	EPHX2	35	47
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(C(=O)[C@H](CC)c2ccccc2)CC1	ZINC000875185748	GG	On-Demand	Anodyne	CCR8	23	40
CC[C@H](C(=O)N1CCC(NC(=O)N[C@H](CC)C[C@@H](C)O)CC1)c1ccccc1	ZINC000875185749	GG	On-Demand	Anodyne	KCNQ2	44	38
CC[C@H](C(=O)N1CCC(NC(=O)N[C@H](CC)C[C@@H](C)O)CC1)c1ccccc1	ZINC000875185749	GG	On-Demand	Anodyne	EPHX2	35	47
CC[C@H](C(=O)N1CCC(NC(=O)N[C@H](CC)C[C@@H](C)O)CC1)c1ccccc1	ZINC000875185749	GG	On-Demand	Anodyne	CCR8	23	40
CC(=O)C1CCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875185763	FE	On-Demand	Anodyne	HTR1D	61	36
CC(=O)C1CCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875185763	FE	On-Demand	Anodyne	HTR1B	53	41
CC(=O)C1CCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875185763	FE	On-Demand	Anodyne	SSTR2	64	39
CC(=O)C1CCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875185763	FE	On-Demand	Anodyne	EDNRA	25	42
CC(=O)C1CCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875185763	FE	On-Demand	Anodyne	TACR1	24	40
CC(=O)C1CCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875185763	FE	On-Demand	Anodyne	MC4R	30	40
CC(=O)C1CCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875185763	FE	On-Demand	Anodyne	CCKAR	65	39
CC(=O)C1CCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875185763	FE	On-Demand	Anodyne	MPO	41	33
CC(=O)C1CCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875185763	FE	On-Demand	Anodyne	BRS3	25	40
CC(=O)C1CCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875185763	FE	On-Demand	Anodyne	MC3R	51	37
CC(=O)C1CCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875185763	FE	On-Demand	Anodyne	MC5R	52	41
CC(=O)C1CCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875185763	FE	On-Demand	Anodyne	CCKBR	60	39
CC(=O)C1CCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875185763	FE	On-Demand	Anodyne	GHSR	50	39
CC(=O)C1CCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875185763	FE	On-Demand	Anodyne	CCR2	17	40
CC(=O)C1CCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875185763	FE	On-Demand	Anodyne	MC1R	56	40
CC(=O)C1CCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875185763	FE	On-Demand	Anodyne	KISS1R	46	30
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1(N2CCC(OC)CC2)CCCC1	ZINC000875185780	GD	On-Demand	Mild	HCN1	54	34
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1(N2CCC(OC)CC2)CCCC1	ZINC000875185780	GD	On-Demand	Mild	HCN4	52	34
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1(N2CCC(OC)CC2)CCCC1	ZINC000875185781	GD	On-Demand	Mild	HCN1	54	34
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1(N2CCC(OC)CC2)CCCC1	ZINC000875185781	GD	On-Demand	Mild	HCN4	52	34
CC(=O)C1CCN(C(=O)NCc2ccc(NC(=O)c3ccc(F)cc3)cc2)CC1	ZINC000875185816	GH	On-Demand	Anodyne	HTR1F	48	45
CC(=O)C1CCN(C(=O)NCc2ccc(NC(=O)c3ccc(F)cc3)cc2)CC1	ZINC000875185816	GH	On-Demand	Anodyne	CCR3	56	43
CC(=O)C1CCN(C(=O)NCc2ccc(NC(=O)c3ccc(F)cc3)cc2)CC1	ZINC000875185816	GH	On-Demand	Anodyne	PRNP	57	35
CC(=O)C1CCN(C(=O)NCc2ccc(NC(=O)c3ccc(F)cc3)cc2)CC1	ZINC000875185816	GH	On-Demand	Anodyne	SSTR3	19	41
CC(=O)C1CCN(C(=O)NCc2ccc(NC(=O)c3ccc(F)cc3)cc2)CC1	ZINC000875185816	GH	On-Demand	Anodyne	EPHX2	36	41
CC(=O)C1CCN(C(=O)NCc2ccc(NC(=O)c3ccc(F)cc3)cc2)CC1	ZINC000875185816	GH	On-Demand	Anodyne	MCHR1	19	44
CC(=O)C1CCN(C(=O)NCc2ccc(NC(=O)c3ccc(F)cc3)cc2)CC1	ZINC000875185816	GH	On-Demand	Anodyne	NOD2	42	37
CC(=O)C1CCN(C(=O)NCc2ccc(NC(=O)c3ccc(F)cc3)cc2)CC1	ZINC000875185816	GH	On-Demand	Anodyne	NAMPT	40	36
CCn1ncnc1-c1ccc(C(=O)N2C[C@@H]3CCCN3Cc3ccccc32)cc1	ZINC000875185846	GH	On-Demand	Anodyne	AVPR2	91	43
CCn1ncnc1-c1ccc(C(=O)N2C[C@@H]3CCCN3Cc3ccccc32)cc1	ZINC000875185846	GH	On-Demand	Anodyne	AVPR1A	58	43
CCn1ncnc1-c1ccc(C(=O)N2C[C@H]3CCCN3Cc3ccccc32)cc1	ZINC000875185847	GH	On-Demand	Anodyne	AVPR2	91	43
CCn1ncnc1-c1ccc(C(=O)N2C[C@H]3CCCN3Cc3ccccc32)cc1	ZINC000875185847	GH	On-Demand	Anodyne	AVPR1A	58	43
C[C@H](NC(=O)C(=O)NCCCc1c[nH]c2ccccc12)c1ccnn1C	ZINC000875185861	FD	On-Demand	Anodyne	HRH2	20	45
C[C@H](NC(=O)C(=O)NCCCc1c[nH]c2ccccc12)c1ccnn1C	ZINC000875185861	FD	On-Demand	Anodyne	SSTR2	50	35
C[C@H](NC(=O)C(=O)NCCCc1c[nH]c2ccccc12)c1ccnn1C	ZINC000875185861	FD	On-Demand	Anodyne	EDNRB	50	34
C[C@H](NC(=O)C(=O)NCCCc1c[nH]c2ccccc12)c1ccnn1C	ZINC000875185861	FD	On-Demand	Anodyne	TACR1	26	42
C[C@H](NC(=O)C(=O)NCCCc1c[nH]c2ccccc12)c1ccnn1C	ZINC000875185861	FD	On-Demand	Anodyne	MC4R	50	40
C[C@H](NC(=O)C(=O)NCCCc1c[nH]c2ccccc12)c1ccnn1C	ZINC000875185861	FD	On-Demand	Anodyne	CCKAR	94	41
C[C@H](NC(=O)C(=O)NCCCc1c[nH]c2ccccc12)c1ccnn1C	ZINC000875185861	FD	On-Demand	Anodyne	BRS3	28	42
C[C@H](NC(=O)C(=O)NCCCc1c[nH]c2ccccc12)c1ccnn1C	ZINC000875185861	FD	On-Demand	Anodyne	NMBR	41	41
C[C@H](NC(=O)C(=O)NCCCc1c[nH]c2ccccc12)c1ccnn1C	ZINC000875185861	FD	On-Demand	Anodyne	MC3R	76	40
C[C@H](NC(=O)C(=O)NCCCc1c[nH]c2ccccc12)c1ccnn1C	ZINC000875185861	FD	On-Demand	Anodyne	MC5R	76	37
C[C@H](NC(=O)C(=O)NCCCc1c[nH]c2ccccc12)c1ccnn1C	ZINC000875185861	FD	On-Demand	Anodyne	MMP2	25	40
C[C@H](NC(=O)C(=O)NCCCc1c[nH]c2ccccc12)c1ccnn1C	ZINC000875185861	FD	On-Demand	Anodyne	MMP8	34	40
C[C@H](NC(=O)C(=O)NCCCc1c[nH]c2ccccc12)c1ccnn1C	ZINC000875185861	FD	On-Demand	Anodyne	GRPR	62	34
C[C@H](NC(=O)C(=O)NCCCc1c[nH]c2ccccc12)c1ccnn1C	ZINC000875185861	FD	On-Demand	Anodyne	ECE1	49	38
C[C@H](NC(=O)C(=O)NCCCc1c[nH]c2ccccc12)c1ccnn1C	ZINC000875185861	FD	On-Demand	Anodyne	MMP11	80	34
C[C@H](NC(=O)C(=O)NCCCc1c[nH]c2ccccc12)c1ccnn1C	ZINC000875185861	FD	On-Demand	Anodyne	CCKBR	75	36
C[C@H](NC(=O)C(=O)NCCCc1c[nH]c2ccccc12)c1ccnn1C	ZINC000875185861	FD	On-Demand	Anodyne	GHSR	74	42
C[C@H](NC(=O)C(=O)NCCCc1c[nH]c2ccccc12)c1ccnn1C	ZINC000875185861	FD	On-Demand	Anodyne	MMP9	23	43
C[C@H](NC(=O)C(=O)NCCCc1c[nH]c2ccccc12)c1ccnn1C	ZINC000875185861	FD	On-Demand	Anodyne	CAPN2	16	41
C[C@H](NC(=O)C(=O)NCCCc1c[nH]c2ccccc12)c1ccnn1C	ZINC000875185861	FD	On-Demand	Anodyne	MC1R	104	40
C[C@H](NC(=O)C(=O)NCCCc1c[nH]c2ccccc12)c1ccnn1C	ZINC000875185861	FD	On-Demand	Anodyne	KISS1R	79	37
C[C@H](NC(=O)C(=O)NCCCc1c[nH]c2ccccc12)c1ccnn1C	ZINC000875185861	FD	On-Demand	Anodyne	ERAP2	40	35
O=C(c1cc(Br)cnc1F)N1C[C@@H]2CCCN2Cc2ccccc21	ZINC000875185892	GH	On-Demand	Anodyne	AVPR2	53	42
O=C(c1cc(Br)cnc1F)N1C[C@@H]2CCCN2Cc2ccccc21	ZINC000875185892	GH	On-Demand	Anodyne	AVPR1A	17	40
O=C(c1cc(Br)cnc1F)N1C[C@H]2CCCN2Cc2ccccc21	ZINC000875185893	GH	On-Demand	Anodyne	AVPR2	53	42
O=C(c1cc(Br)cnc1F)N1C[C@H]2CCCN2Cc2ccccc21	ZINC000875185893	GH	On-Demand	Anodyne	AVPR1A	17	40
O=CN1CCCN(C(=O)NCc2ccc(NC(=O)c3ccc(F)cc3)cc2)CC1	ZINC000875185896	GE	On-Demand	Anodyne	PRNP	40	34
O=CN1CCCN(C(=O)NCc2ccc(NC(=O)c3ccc(F)cc3)cc2)CC1	ZINC000875185896	GE	On-Demand	Anodyne	NPSR1	24	40
O=CN1CCCN(C(=O)NCc2ccc(NC(=O)c3ccc(F)cc3)cc2)CC1	ZINC000875185896	GE	On-Demand	Anodyne	NOD2	42	36
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(NC(=O)c3ccncc3)cc2)C1	ZINC000875185910	GF	On-Demand	Anodyne	PRNP	51	39
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(NC(=O)c3ccncc3)cc2)C1	ZINC000875185910	GF	On-Demand	Anodyne	EPHX2	17	42
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(NC(=O)c3ccncc3)cc2)C1	ZINC000875185910	GF	On-Demand	Anodyne	DPP7	40	41
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(NC(=O)c3ccncc3)cc2)C1	ZINC000875185910	GF	On-Demand	Anodyne	NAMPT	73	44
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(NC(=O)c3ccncc3)cc2)C1	ZINC000875185911	GF	On-Demand	Anodyne	PRNP	51	39
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(NC(=O)c3ccncc3)cc2)C1	ZINC000875185911	GF	On-Demand	Anodyne	EPHX2	17	42
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(NC(=O)c3ccncc3)cc2)C1	ZINC000875185911	GF	On-Demand	Anodyne	DPP7	40	41
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(NC(=O)c3ccncc3)cc2)C1	ZINC000875185911	GF	On-Demand	Anodyne	NAMPT	73	44
O=C(NCCCCC1CC1)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185932	EF	On-Demand	Anodyne	HTR1A	16	43
O=C(NCCCCC1CC1)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185932	EF	On-Demand	Anodyne	ACHE	34	45
O=C(NCCCCC1CC1)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185932	EF	On-Demand	Anodyne	HTR1D	45	37
O=C(NCCCCC1CC1)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185932	EF	On-Demand	Anodyne	HTR1B	37	43
O=C(NCCCCC1CC1)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185932	EF	On-Demand	Anodyne	SSTR2	51	38
O=C(NCCCCC1CC1)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185932	EF	On-Demand	Anodyne	SLC6A4	15	59
O=C(NCCCCC1CC1)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185932	EF	On-Demand	Anodyne	EDNRA	17	40
O=C(NCCCCC1CC1)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185932	EF	On-Demand	Anodyne	TACR1	22	42
O=C(NCCCCC1CC1)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185932	EF	On-Demand	Anodyne	TPR	16	52
O=C(NCCCCC1CC1)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185932	EF	On-Demand	Anodyne	MC4R	34	42
O=C(NCCCCC1CC1)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185932	EF	On-Demand	Anodyne	CCKAR	92	41
O=C(NCCCCC1CC1)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185932	EF	On-Demand	Anodyne	BCHE	23	45
O=C(NCCCCC1CC1)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185932	EF	On-Demand	Anodyne	MPO	64	38
O=C(NCCCCC1CC1)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185932	EF	On-Demand	Anodyne	BRS3	27	42
O=C(NCCCCC1CC1)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185932	EF	On-Demand	Anodyne	NMBR	61	43
O=C(NCCCCC1CC1)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185932	EF	On-Demand	Anodyne	MC3R	62	37
O=C(NCCCCC1CC1)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185932	EF	On-Demand	Anodyne	MC5R	51	43
O=C(NCCCCC1CC1)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185932	EF	On-Demand	Anodyne	GRIA1	18	42
O=C(NCCCCC1CC1)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185932	EF	On-Demand	Anodyne	ECE1	40	36
O=C(NCCCCC1CC1)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185932	EF	On-Demand	Anodyne	SSTR3	30	40
O=C(NCCCCC1CC1)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185932	EF	On-Demand	Anodyne	CCKBR	76	42
O=C(NCCCCC1CC1)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185932	EF	On-Demand	Anodyne	GHSR	53	38
O=C(NCCCCC1CC1)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185932	EF	On-Demand	Anodyne	MMP9	17	59
O=C(NCCCCC1CC1)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185932	EF	On-Demand	Anodyne	MC1R	65	45
O=C(NCCCCC1CC1)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185932	EF	On-Demand	Anodyne	KISS1R	58	31
C#CC[C@@H](COC)NC(=O)C(=O)NCC1(N2CCC(OC)CC2)CCCC1	ZINC000875185933	GC	On-Demand	Mild	HCN1	52	32
C#CC[C@@H](COC)NC(=O)C(=O)NCC1(N2CCC(OC)CC2)CCCC1	ZINC000875185933	GC	On-Demand	Mild	HCN4	50	32
C#CC[C@H](COC)NC(=O)C(=O)NCC1(N2CCC(OC)CC2)CCCC1	ZINC000875185934	GC	On-Demand	Mild	HCN1	52	32
C#CC[C@H](COC)NC(=O)C(=O)NCC1(N2CCC(OC)CC2)CCCC1	ZINC000875185934	GC	On-Demand	Mild	HCN4	50	32
O=C(NCCO)C1CCN(C(=O)NCCc2cc(F)cc(F)c2)CC1	ZINC000875185942	FD	On-Demand	Anodyne	CACNA1G	36	40
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875185943	GF	On-Demand	Anodyne	CCKAR	64	36
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875185943	GF	On-Demand	Anodyne	CCKBR	51	36
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875185943	GF	On-Demand	Anodyne	MC1R	48	39
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875185944	GF	On-Demand	Anodyne	CCKAR	64	36
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875185944	GF	On-Demand	Anodyne	CCKBR	51	36
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875185944	GF	On-Demand	Anodyne	MC1R	48	39
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875185945	GF	On-Demand	Anodyne	CCKAR	64	36
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875185945	GF	On-Demand	Anodyne	CCKBR	51	36
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875185945	GF	On-Demand	Anodyne	MC1R	48	39
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875185946	GF	On-Demand	Anodyne	CCKAR	64	36
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875185946	GF	On-Demand	Anodyne	CCKBR	51	36
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875185946	GF	On-Demand	Anodyne	MC1R	48	39
COCC(C)(C)CCNC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185951	FE	On-Demand	Anodyne	TACR1	20	41
COCC(C)(C)CCNC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185951	FE	On-Demand	Anodyne	CCKAR	89	41
COCC(C)(C)CCNC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185951	FE	On-Demand	Anodyne	MPO	45	35
COCC(C)(C)CCNC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185951	FE	On-Demand	Anodyne	NMBR	67	32
COCC(C)(C)CCNC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185951	FE	On-Demand	Anodyne	MTNR1A	26	40
COCC(C)(C)CCNC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185951	FE	On-Demand	Anodyne	CCKBR	84	44
COCC(C)(C)CCNC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185951	FE	On-Demand	Anodyne	GHSR	57	39
COCC(C)(C)CCNC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185951	FE	On-Demand	Anodyne	MMP9	15	55
COCC(C)(C)CCNC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185951	FE	On-Demand	Anodyne	MC1R	44	36
CC[C@H](C(=O)N1CCC(NC(=O)N2CCC(C(C)=O)CC2)CC1)c1ccccc1	ZINC000875185952	GG	On-Demand	Anodyne	KCNQ2	47	41
CC[C@H](C(=O)N1CCC(NC(=O)N2CCC(C(C)=O)CC2)CC1)c1ccccc1	ZINC000875185952	GG	On-Demand	Anodyne	EPHX2	46	43
CC[C@H](C(=O)N1CCC(NC(=O)N2CCC(C(C)=O)CC2)CC1)c1ccccc1	ZINC000875185952	GG	On-Demand	Anodyne	CCR8	28	40
CC[C@@H](C(=O)N1CCC(NC(=O)N2CCC(C(C)=O)CC2)CC1)c1ccccc1	ZINC000875185953	GG	On-Demand	Anodyne	KCNQ2	47	41
CC[C@@H](C(=O)N1CCC(NC(=O)N2CCC(C(C)=O)CC2)CC1)c1ccccc1	ZINC000875185953	GG	On-Demand	Anodyne	EPHX2	46	43
CC[C@@H](C(=O)N1CCC(NC(=O)N2CCC(C(C)=O)CC2)CC1)c1ccccc1	ZINC000875185953	GG	On-Demand	Anodyne	CCR8	28	40
COCCN(CC1CCN(C)CC1)C(=O)NCCc1cc(F)cc(F)c1	ZINC000875185956	FF	On-Demand	Anodyne	CACNA1I	57	33
COCCN(CC1CCN(C)CC1)C(=O)NCCc1cc(F)cc(F)c1	ZINC000875185956	FF	On-Demand	Anodyne	ACKR3	50	31
C#C[C@@H]1CC[C@@H](NC(=O)NC2CCN(C(=O)[C@H](CC)c3ccccc3)CC2)CC1	ZINC000875185963	GH	On-Demand	Mild	KCNQ2	45	39
C#C[C@@H]1CC[C@@H](NC(=O)NC2CCN(C(=O)[C@H](CC)c3ccccc3)CC2)CC1	ZINC000875185963	GH	On-Demand	Mild	EPHX2	37	46
C#C[C@@H]1CC[C@@H](NC(=O)NC2CCN(C(=O)[C@@H](CC)c3ccccc3)CC2)CC1	ZINC000875185964	GH	On-Demand	Mild	KCNQ2	45	39
C#C[C@@H]1CC[C@@H](NC(=O)NC2CCN(C(=O)[C@@H](CC)c3ccccc3)CC2)CC1	ZINC000875185964	GH	On-Demand	Mild	EPHX2	37	46
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875185970	GG	On-Demand	Anodyne	HTR1D	42	35
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875185970	GG	On-Demand	Anodyne	HTR1B	36	41
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875185970	GG	On-Demand	Anodyne	SSTR2	67	36
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875185970	GG	On-Demand	Anodyne	CCKAR	55	39
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875185970	GG	On-Demand	Anodyne	MC3R	53	41
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875185970	GG	On-Demand	Anodyne	MC5R	42	44
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875185970	GG	On-Demand	Anodyne	CCKBR	47	39
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875185970	GG	On-Demand	Anodyne	MC1R	47	41
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875185971	GG	On-Demand	Anodyne	HTR1D	42	35
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875185971	GG	On-Demand	Anodyne	HTR1B	36	41
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875185971	GG	On-Demand	Anodyne	SSTR2	67	36
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875185971	GG	On-Demand	Anodyne	CCKAR	55	39
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875185971	GG	On-Demand	Anodyne	MC3R	53	41
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875185971	GG	On-Demand	Anodyne	MC5R	42	44
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875185971	GG	On-Demand	Anodyne	CCKBR	47	39
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875185971	GG	On-Demand	Anodyne	MC1R	47	41
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875185983	FF	On-Demand	Anodyne	CCKAR	57	36
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875185983	FF	On-Demand	Anodyne	MPO	41	34
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875185983	FF	On-Demand	Anodyne	MC3R	52	36
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875185983	FF	On-Demand	Anodyne	MC5R	45	40
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875185983	FF	On-Demand	Anodyne	CCKBR	57	40
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875185983	FF	On-Demand	Anodyne	MC1R	58	38
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875185983	FF	On-Demand	Anodyne	KISS1R	56	31
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185984	GF	On-Demand	Anodyne	HTR1A	17	42
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185984	GF	On-Demand	Anodyne	HTR1D	58	37
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185984	GF	On-Demand	Anodyne	HTR1B	50	39
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185984	GF	On-Demand	Anodyne	SLC6A4	15	42
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185984	GF	On-Demand	Anodyne	BRS3	24	40
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185985	GF	On-Demand	Anodyne	HTR1A	17	42
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185985	GF	On-Demand	Anodyne	HTR1D	58	37
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185985	GF	On-Demand	Anodyne	HTR1B	50	39
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185985	GF	On-Demand	Anodyne	SLC6A4	15	42
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875185985	GF	On-Demand	Anodyne	BRS3	24	40
N#Cc1ccc(Cn2cc(NC(=O)NCC3CCOCC3)cn2)cc1	ZINC000875185999	EE	On-Demand	Mild	CCR3	20	42
N#Cc1ccc(Cn2cc(NC(=O)NCC3CCOCC3)cn2)cc1	ZINC000875185999	EE	On-Demand	Mild	ITK	18	50
N#Cc1ccc(Cn2cc(NC(=O)NCC3CCOCC3)cn2)cc1	ZINC000875185999	EE	On-Demand	Mild	PANC	58	39
CCCCCCCNC(=O)C(=O)NCCc1c(C)noc1C	ZINC000875186017	DE	On-Demand	Mild	ASAH1	68	33
O=CN1CCCN(C(=O)NCc2ccc(NC(=O)c3ccncc3)cc2)CC1	ZINC000875186072	GD	On-Demand	Anodyne	PRNP	45	38
O=CN1CCCN(C(=O)NCc2ccc(NC(=O)c3ccncc3)cc2)CC1	ZINC000875186072	GD	On-Demand	Anodyne	NAMPT	53	41
CC(C)(C)OC(=O)NCCNC(=O)N[C@@](C)(CO)Cc1ccccc1F	ZINC000875186119	FD	On-Demand	Anodyne	PAPA1_CARPA	25	45
CC(C)(C)OC(=O)NCCNC(=O)N[C@](C)(CO)Cc1ccccc1F	ZINC000875186121	FD	On-Demand	Anodyne	PAPA1_CARPA	25	45
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(NC(=O)c3ccc(F)cc3)cc2)C1	ZINC000875186122	GH	On-Demand	Anodyne	HTR1F	41	43
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(NC(=O)c3ccc(F)cc3)cc2)C1	ZINC000875186122	GH	On-Demand	Anodyne	CCR3	96	38
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(NC(=O)c3ccc(F)cc3)cc2)C1	ZINC000875186122	GH	On-Demand	Anodyne	PRNP	50	34
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(NC(=O)c3ccc(F)cc3)cc2)C1	ZINC000875186122	GH	On-Demand	Anodyne	SSTR3	19	41
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(NC(=O)c3ccc(F)cc3)cc2)C1	ZINC000875186122	GH	On-Demand	Anodyne	DPP7	43	33
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(NC(=O)c3ccc(F)cc3)cc2)C1	ZINC000875186122	GH	On-Demand	Anodyne	MCHR1	15	44
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(NC(=O)c3ccc(F)cc3)cc2)C1	ZINC000875186122	GH	On-Demand	Anodyne	NOD2	40	35
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(NC(=O)c3ccc(F)cc3)cc2)C1	ZINC000875186123	GH	On-Demand	Anodyne	HTR1F	41	43
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(NC(=O)c3ccc(F)cc3)cc2)C1	ZINC000875186123	GH	On-Demand	Anodyne	CCR3	96	38
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(NC(=O)c3ccc(F)cc3)cc2)C1	ZINC000875186123	GH	On-Demand	Anodyne	PRNP	50	34
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(NC(=O)c3ccc(F)cc3)cc2)C1	ZINC000875186123	GH	On-Demand	Anodyne	SSTR3	19	41
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(NC(=O)c3ccc(F)cc3)cc2)C1	ZINC000875186123	GH	On-Demand	Anodyne	DPP7	43	33
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(NC(=O)c3ccc(F)cc3)cc2)C1	ZINC000875186123	GH	On-Demand	Anodyne	MCHR1	15	44
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(NC(=O)c3ccc(F)cc3)cc2)C1	ZINC000875186123	GH	On-Demand	Anodyne	NOD2	40	35
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875186125	FE	On-Demand	Anodyne	HTR1B	32	40
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875186125	FE	On-Demand	Anodyne	MC5R	35	40
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875186125	FE	On-Demand	Anodyne	MC1R	42	37
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875186126	FE	On-Demand	Anodyne	HTR1B	32	40
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875186126	FE	On-Demand	Anodyne	MC5R	35	40
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875186126	FE	On-Demand	Anodyne	MC1R	42	37
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875186128	FE	On-Demand	Anodyne	HTR1B	32	40
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875186128	FE	On-Demand	Anodyne	MC5R	35	40
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875186128	FE	On-Demand	Anodyne	MC1R	42	37
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875186130	FE	On-Demand	Anodyne	HTR1B	32	40
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875186130	FE	On-Demand	Anodyne	MC5R	35	40
O=C(NCCCc1c[nH]c2ccccc12)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875186130	FE	On-Demand	Anodyne	MC1R	42	37
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875186154	FE	On-Demand	Anodyne	HTR1D	54	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875186154	FE	On-Demand	Anodyne	HTR1B	47	37
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875186154	FE	On-Demand	Anodyne	SSTR2	77	39
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875186154	FE	On-Demand	Anodyne	EDNRA	24	44
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875186154	FE	On-Demand	Anodyne	CCKAR	79	39
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875186154	FE	On-Demand	Anodyne	NMBR	49	36
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875186154	FE	On-Demand	Anodyne	MC3R	63	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875186154	FE	On-Demand	Anodyne	MC5R	64	44
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875186154	FE	On-Demand	Anodyne	GRPR	46	31
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875186154	FE	On-Demand	Anodyne	CCKBR	60	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875186154	FE	On-Demand	Anodyne	GHSR	50	37
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875186154	FE	On-Demand	Anodyne	MC1R	74	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875186154	FE	On-Demand	Anodyne	KISS1R	63	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875186155	FE	On-Demand	Anodyne	HTR1D	54	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875186155	FE	On-Demand	Anodyne	HTR1B	47	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875186155	FE	On-Demand	Anodyne	SSTR2	77	39
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875186155	FE	On-Demand	Anodyne	EDNRA	24	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875186155	FE	On-Demand	Anodyne	CCKAR	79	39
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875186155	FE	On-Demand	Anodyne	NMBR	49	36
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875186155	FE	On-Demand	Anodyne	MC3R	63	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875186155	FE	On-Demand	Anodyne	MC5R	64	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875186155	FE	On-Demand	Anodyne	GRPR	46	31
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875186155	FE	On-Demand	Anodyne	CCKBR	60	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875186155	FE	On-Demand	Anodyne	GHSR	50	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875186155	FE	On-Demand	Anodyne	MC1R	74	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875186155	FE	On-Demand	Anodyne	KISS1R	63	32
Cc1noc(C)c1CCNC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875186196	GD	On-Demand	Anodyne	P2RX7	17	47
Cc1noc(C)c1CCNC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875186196	GD	On-Demand	Anodyne	NPY2R	50	42
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875186237	FE	On-Demand	Anodyne	F2	32	42
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875186237	FE	On-Demand	Anodyne	PLG	20	42
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875186237	FE	On-Demand	Anodyne	PRSS1	16	40
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875186237	FE	On-Demand	Anodyne	FKBP1A	29	40
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875186237	FE	On-Demand	Anodyne	ELANE	19	41
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875186237	FE	On-Demand	Anodyne	TRY1_BOVIN	40	42
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875186237	FE	On-Demand	Anodyne	PREP	36	40
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875186237	FE	On-Demand	Anodyne	REN	43	36
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875186237	FE	On-Demand	Anodyne	WNT3	41	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Oc2cccc(F)c2)nc1	ZINC000875186238	GG	On-Demand	Anodyne	SLC6A3	27	41
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875186239	FE	On-Demand	Anodyne	F2	32	42
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875186239	FE	On-Demand	Anodyne	PLG	20	42
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875186239	FE	On-Demand	Anodyne	PRSS1	16	40
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875186239	FE	On-Demand	Anodyne	FKBP1A	29	40
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875186239	FE	On-Demand	Anodyne	ELANE	19	41
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875186239	FE	On-Demand	Anodyne	TRY1_BOVIN	40	42
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875186239	FE	On-Demand	Anodyne	PREP	36	40
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875186239	FE	On-Demand	Anodyne	REN	43	36
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875186239	FE	On-Demand	Anodyne	WNT3	41	33
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Oc2cccc(F)c2)nc1	ZINC000875186240	GG	On-Demand	Anodyne	SLC6A3	27	41
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875186241	FE	On-Demand	Anodyne	F2	32	42
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875186241	FE	On-Demand	Anodyne	PLG	20	42
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875186241	FE	On-Demand	Anodyne	PRSS1	16	40
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875186241	FE	On-Demand	Anodyne	FKBP1A	29	40
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875186241	FE	On-Demand	Anodyne	ELANE	19	41
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875186241	FE	On-Demand	Anodyne	TRY1_BOVIN	40	42
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875186241	FE	On-Demand	Anodyne	PREP	36	40
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875186241	FE	On-Demand	Anodyne	REN	43	36
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875186241	FE	On-Demand	Anodyne	WNT3	41	33
CC[C@@H](C(=O)N1CCC(NC(=O)N[C@H]2CC23CCC3)CC1)c1ccccc1	ZINC000875186242	FG	On-Demand	Anodyne	EPHX2	38	46
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875186243	FE	On-Demand	Anodyne	F2	32	42
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875186243	FE	On-Demand	Anodyne	PLG	20	42
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875186243	FE	On-Demand	Anodyne	PRSS1	16	40
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875186243	FE	On-Demand	Anodyne	FKBP1A	29	40
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875186243	FE	On-Demand	Anodyne	ELANE	19	41
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875186243	FE	On-Demand	Anodyne	TRY1_BOVIN	40	42
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875186243	FE	On-Demand	Anodyne	PREP	36	40
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875186243	FE	On-Demand	Anodyne	REN	43	36
CC(C)(C)OC(=O)NCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875186243	FE	On-Demand	Anodyne	WNT3	41	33
CC[C@H](C(=O)N1CCC(NC(=O)N[C@H]2CC23CCC3)CC1)c1ccccc1	ZINC000875186244	FG	On-Demand	Anodyne	EPHX2	38	46
CC[C@H](C(=O)N1CCC(NC(=O)N[C@@H]2CC23CCC3)CC1)c1ccccc1	ZINC000875186246	FG	On-Demand	Anodyne	EPHX2	38	46
CC[C@@H](C(=O)N1CCC(NC(=O)N[C@@H]2CC23CCC3)CC1)c1ccccc1	ZINC000875186247	FG	On-Demand	Anodyne	EPHX2	38	46
Cc1noc(C)c1CCNC(=O)C(=O)NCc1cn(C(F)F)c2ccccc12	ZINC000875186285	GF	On-Demand	Anodyne	P2RX7	20	47
CN1CC[C@H]2CN(C(=O)C(=O)NCCCc3c[nH]c4ccccc34)CC[C@@H]21	ZINC000875186297	FD	On-Demand	Anodyne	HTR1D	62	36
CN1CC[C@H]2CN(C(=O)C(=O)NCCCc3c[nH]c4ccccc34)CC[C@@H]21	ZINC000875186297	FD	On-Demand	Anodyne	HTR1B	54	43
CN1CC[C@H]2CN(C(=O)C(=O)NCCCc3c[nH]c4ccccc34)CC[C@@H]21	ZINC000875186297	FD	On-Demand	Anodyne	SSTR2	53	36
CN1CC[C@H]2CN(C(=O)C(=O)NCCCc3c[nH]c4ccccc34)CC[C@@H]21	ZINC000875186297	FD	On-Demand	Anodyne	CCKAR	53	36
CN1CC[C@H]2CN(C(=O)C(=O)NCCCc3c[nH]c4ccccc34)CC[C@@H]21	ZINC000875186297	FD	On-Demand	Anodyne	MC3R	52	36
CN1CC[C@H]2CN(C(=O)C(=O)NCCCc3c[nH]c4ccccc34)CC[C@@H]21	ZINC000875186297	FD	On-Demand	Anodyne	MC5R	44	40
CN1CC[C@H]2CN(C(=O)C(=O)NCCCc3c[nH]c4ccccc34)CC[C@@H]21	ZINC000875186297	FD	On-Demand	Anodyne	CCKBR	44	38
CN1CC[C@H]2CN(C(=O)C(=O)NCCCc3c[nH]c4ccccc34)CC[C@@H]21	ZINC000875186297	FD	On-Demand	Anodyne	MC1R	54	36
CN1CC[C@H]2CN(C(=O)C(=O)NCCCc3c[nH]c4ccccc34)CC[C@@H]21	ZINC000875186297	FD	On-Demand	Anodyne	KISS1R	62	31
CN1CC[C@H]2CN(C(=O)C(=O)NCCCc3c[nH]c4ccccc34)CC[C@H]21	ZINC000875186299	FD	On-Demand	Anodyne	HTR1D	62	36
CN1CC[C@H]2CN(C(=O)C(=O)NCCCc3c[nH]c4ccccc34)CC[C@H]21	ZINC000875186299	FD	On-Demand	Anodyne	HTR1B	54	43
CN1CC[C@H]2CN(C(=O)C(=O)NCCCc3c[nH]c4ccccc34)CC[C@H]21	ZINC000875186299	FD	On-Demand	Anodyne	SSTR2	53	36
CN1CC[C@H]2CN(C(=O)C(=O)NCCCc3c[nH]c4ccccc34)CC[C@H]21	ZINC000875186299	FD	On-Demand	Anodyne	CCKAR	53	36
CN1CC[C@H]2CN(C(=O)C(=O)NCCCc3c[nH]c4ccccc34)CC[C@H]21	ZINC000875186299	FD	On-Demand	Anodyne	MC3R	52	36
CN1CC[C@H]2CN(C(=O)C(=O)NCCCc3c[nH]c4ccccc34)CC[C@H]21	ZINC000875186299	FD	On-Demand	Anodyne	MC5R	44	40
CN1CC[C@H]2CN(C(=O)C(=O)NCCCc3c[nH]c4ccccc34)CC[C@H]21	ZINC000875186299	FD	On-Demand	Anodyne	CCKBR	44	38
CN1CC[C@H]2CN(C(=O)C(=O)NCCCc3c[nH]c4ccccc34)CC[C@H]21	ZINC000875186299	FD	On-Demand	Anodyne	MC1R	54	36
CN1CC[C@H]2CN(C(=O)C(=O)NCCCc3c[nH]c4ccccc34)CC[C@H]21	ZINC000875186299	FD	On-Demand	Anodyne	KISS1R	62	31
Cn1nc(Cl)c(C(=O)N2C[C@H]3CCCN3Cc3ccccc32)c1Cl	ZINC000875186304	FG	On-Demand	Anodyne	AVPR2	44	37
Cn1nc(Cl)c(C(=O)N2C[C@@H]3CCCN3Cc3ccccc32)c1Cl	ZINC000875186306	FG	On-Demand	Anodyne	AVPR2	44	37
O=C(NCC1(c2c(F)cccc2F)CCCC1)N1CCC2(CCNC2=O)CC1	ZINC000875186308	GG	On-Demand	Anodyne	CACNA1H	44	33
O=C(NCC1CCOCC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875186314	DE	On-Demand	Anodyne	CNR2	16	41
O=C(NCC1CCOCC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875186314	DE	On-Demand	Anodyne	EPHX2	18	42
O=C(NCC1CCOCC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875186315	DE	On-Demand	Anodyne	CNR2	16	41
O=C(NCC1CCOCC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875186315	DE	On-Demand	Anodyne	EPHX2	18	42
O=C(NCCCc1c[nH]c2ccccc12)C(=O)NCC[C@H]1CCSC1	ZINC000875186337	FE	On-Demand	Anodyne	MC3R	41	34
O=C(NCCCc1c[nH]c2ccccc12)C(=O)NCC[C@H]1CCSC1	ZINC000875186337	FE	On-Demand	Anodyne	MC1R	33	40
O=C(NCCCc1c[nH]c2ccccc12)C(=O)NCC[C@@H]1CCSC1	ZINC000875186338	FE	On-Demand	Anodyne	MC3R	41	34
O=C(NCCCc1c[nH]c2ccccc12)C(=O)NCC[C@@H]1CCSC1	ZINC000875186338	FE	On-Demand	Anodyne	MC1R	33	40
COc1cc(NC(=O)c2ccco2)c(C(=O)Nc2ccc(F)c(NC(C)=O)c2)cc1OC	ZINC000875186350	IH	On-Demand	Anodyne	GRM4	21	57
O=C(Nc1ccc(CNC(=O)N2C[C@H]3C(=O)OC[C@H]3C2)cc1)c1ccc(F)cc1	ZINC000875186353	GE	On-Demand	Anodyne	NPSR1	23	40
CCCCCCCNC(=O)C(=O)NCCn1cc(C)cn1	ZINC000875186354	CD	On-Demand	Mild	ASAH1	101	40
O=C(c1cnc2nccn2c1)N1C[C@@H]2CCCN2Cc2ccccc21	ZINC000875186361	EE	On-Demand	Anodyne	AVPR2	42	39
O=C(c1cnc2nccn2c1)N1C[C@H]2CCCN2Cc2ccccc21	ZINC000875186362	EE	On-Demand	Anodyne	AVPR2	42	39
CC[C@@H](C(=O)N1CCC(NC(=O)NC[C@H]2C[C@H](O)C2)CC1)c1ccccc1	ZINC000875186372	FE	On-Demand	Anodyne	EPHX2	46	45
CC[C@@H](C(=O)N1CCC(NC(=O)NC[C@H]2C[C@H](O)C2)CC1)c1ccccc1	ZINC000875186372	FE	On-Demand	Anodyne	CCR8	23	40
CC[C@H](C(=O)N1CCC(NC(=O)NC[C@H]2C[C@H](O)C2)CC1)c1ccccc1	ZINC000875186373	FE	On-Demand	Anodyne	EPHX2	46	45
CC[C@H](C(=O)N1CCC(NC(=O)NC[C@H]2C[C@H](O)C2)CC1)c1ccccc1	ZINC000875186373	FE	On-Demand	Anodyne	CCR8	23	40
N#Cc1cc(C(=O)N2C[C@@H]3CCCN3Cc3ccccc32)co1	ZINC000875186382	DF	On-Demand	Mild	AVPR2	43	40
N#Cc1cc(C(=O)N2C[C@H]3CCCN3Cc3ccccc32)co1	ZINC000875186383	DF	On-Demand	Mild	AVPR2	43	40
C#C[C@@H]1CC[C@@H](NC(=O)NC2CCN(C(=O)Cc3ccccc3OC)CC2)CC1	ZINC000875186393	GF	On-Demand	Mild	DRD2	16	40
C#C[C@@H]1CC[C@@H](NC(=O)NC2CCN(C(=O)Cc3ccccc3OC)CC2)CC1	ZINC000875186393	GF	On-Demand	Mild	SIGMAR1	15	53
C#C[C@@H]1CC[C@@H](NC(=O)NC2CCN(C(=O)Cc3ccccc3OC)CC2)CC1	ZINC000875186393	GF	On-Demand	Mild	CCR3	15	47
C#C[C@@H]1CC[C@@H](NC(=O)NC2CCN(C(=O)Cc3ccccc3OC)CC2)CC1	ZINC000875186393	GF	On-Demand	Mild	EPHX2	41	44
C#C[C@@H]1CC[C@@H](NC(=O)NC2CCN(C(=O)Cc3ccccc3OC)CC2)CC1	ZINC000875186393	GF	On-Demand	Mild	CCR8	32	41
Cc1noc(C)c1CCNC(=O)C(=O)NCc1cccc2ncccc12	ZINC000875186442	FD	On-Demand	Anodyne	P2RX7	25	52
O=C(NCC1CCOCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875186450	ED	On-Demand	Anodyne	DRD4	21	40
O=C(NCC1CCOCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875186450	ED	On-Demand	Anodyne	ACHE	26	40
O=C(NCC1CCOCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875186450	ED	On-Demand	Anodyne	FAAH	17	40
CC(C)(C)OC(=O)NCCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875186451	FE	On-Demand	Anodyne	PAPA1_CARPA	30	42
CC(C)(C)OC(=O)NCCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875186451	FE	On-Demand	Anodyne	CTSL	19	42
CC(C)(C)OC(=O)NCCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875186451	FE	On-Demand	Anodyne	FPR1	42	39
CC(C)(C)OC(=O)NCCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875186451	FE	On-Demand	Anodyne	PDS	65	38
CC(C)(C)OC(=O)NCCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875186452	FE	On-Demand	Anodyne	PAPA1_CARPA	30	42
CC(C)(C)OC(=O)NCCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875186452	FE	On-Demand	Anodyne	CTSL	19	42
CC(C)(C)OC(=O)NCCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875186452	FE	On-Demand	Anodyne	FPR1	42	39
CC(C)(C)OC(=O)NCCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875186452	FE	On-Demand	Anodyne	PDS	65	38
CC[C@@H](NC(=O)NCCNC(=O)OC(C)(C)C)[C@@H](O)c1ccccc1	ZINC000875186457	FE	On-Demand	Anodyne	PAPA1_CARPA	34	41
CC[C@@H](NC(=O)NCCNC(=O)OC(C)(C)C)[C@@H](O)c1ccccc1	ZINC000875186457	FE	On-Demand	Anodyne	CTSK	20	46
CC[C@@H](NC(=O)NCCNC(=O)OC(C)(C)C)[C@@H](O)c1ccccc1	ZINC000875186457	FE	On-Demand	Anodyne	FPR1	41	34
CC[C@@H](NC(=O)NCCNC(=O)OC(C)(C)C)[C@H](O)c1ccccc1	ZINC000875186459	FE	On-Demand	Anodyne	PAPA1_CARPA	34	41
CC[C@@H](NC(=O)NCCNC(=O)OC(C)(C)C)[C@H](O)c1ccccc1	ZINC000875186459	FE	On-Demand	Anodyne	CTSK	20	46
CC[C@@H](NC(=O)NCCNC(=O)OC(C)(C)C)[C@H](O)c1ccccc1	ZINC000875186459	FE	On-Demand	Anodyne	FPR1	41	34
CC[C@H](C(=O)N1CCC(NC(=O)NCc2cnn(CC)n2)CC1)c1ccccc1	ZINC000875186476	GE	On-Demand	Anodyne	EPHX2	32	41
CC[C@@H](C(=O)N1CCC(NC(=O)NCc2cnn(CC)n2)CC1)c1ccccc1	ZINC000875186477	GE	On-Demand	Anodyne	EPHX2	32	41
Cc1noc(C)c1CCNC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875186483	FD	On-Demand	Anodyne	ADAMTS4	29	41
CC(C)(C)OC(=O)N1CC[C@H]2[C@H]1CCCN2C(=O)NCC1CCOCC1	ZINC000875186491	FF	On-Demand	Anodyne	CACNA1I	40	31
CC(C)(C)OC(=O)N1CC[C@H]2[C@@H]1CCCN2C(=O)NCC1CCOCC1	ZINC000875186492	FF	On-Demand	Anodyne	CACNA1I	40	31
CC(C)(C)OC(=O)N1CC[C@@H]2[C@H]1CCCN2C(=O)NCC1CCOCC1	ZINC000875186493	FF	On-Demand	Anodyne	CACNA1I	40	31
CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H]1CCCN2C(=O)NCC1CCOCC1	ZINC000875186494	FF	On-Demand	Anodyne	CACNA1I	40	31
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(CS(C)(=O)=O)c1	ZINC000875186511	GD	On-Demand	Anodyne	SLC6A3	51	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(CS(C)(=O)=O)c1	ZINC000875186512	GD	On-Demand	Anodyne	SLC6A3	51	41
O=C(NCc1ccc(OCC2CC2)nc1)N1Cc2cccc(O)c2C1	ZINC000875186520	EF	On-Demand	Clean	NAMPT	24	40
CC(=O)Nc1cc(NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)c2ccccc2)ccc1F	ZINC000875186575	IH	On-Demand	Anodyne	OPRD1	59	37
CC(=O)Nc1cc(NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)c2ccccc2)ccc1F	ZINC000875186575	IH	On-Demand	Anodyne	HDAC8	15	52
CC(=O)Nc1cc(NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)c2ccccc2)ccc1F	ZINC000875186575	IH	On-Demand	Anodyne	CFTR	102	59
CC(=O)Nc1cc(NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)c2ccccc2)ccc1F	ZINC000875186575	IH	On-Demand	Anodyne	ADAM9	42	35
C#CC[C@@H](COC)NC(=O)NC1CCN(C(=O)[C@@H](CC)c2ccccc2)CC1	ZINC000875186576	GF	On-Demand	Mild	EPHX2	27	41
C#CC[C@H](COC)NC(=O)NC1CCN(C(=O)[C@@H](CC)c2ccccc2)CC1	ZINC000875186577	GF	On-Demand	Mild	EPHX2	27	41
C#CC[C@@H](COC)NC(=O)NC1CCN(C(=O)[C@H](CC)c2ccccc2)CC1	ZINC000875186578	GF	On-Demand	Mild	EPHX2	27	41
C#CC[C@H](COC)NC(=O)NC1CCN(C(=O)[C@H](CC)c2ccccc2)CC1	ZINC000875186579	GF	On-Demand	Mild	EPHX2	27	41
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NCC1CCOCC1	ZINC000875186626	EE	On-Demand	Anodyne	CACNA1I	55	34
CCC1(CC)CCCN1C(=O)NCc1cccc(CS(C)(=O)=O)c1	ZINC000875186641	FG	On-Demand	Anodyne	SLC12A5	59	37
Cc1noc(C)c1CCNC(=O)C(=O)NCc1ccc(OC(F)F)cc1F	ZINC000875186655	GE	On-Demand	Anodyne	P2RX7	25	54
CC[C@H](C(=O)N1CCC(NC(=O)N[C@@H]2C[C@@H](SC)C2)CC1)c1ccccc1	ZINC000875186717	GG	On-Demand	Anodyne	CHRM1	15	42
CC[C@H](C(=O)N1CCC(NC(=O)N[C@@H]2C[C@@H](SC)C2)CC1)c1ccccc1	ZINC000875186717	GG	On-Demand	Anodyne	EPHX2	41	47
CC[C@@H](C(=O)N1CCC(NC(=O)N[C@@H]2C[C@@H](SC)C2)CC1)c1ccccc1	ZINC000875186718	GG	On-Demand	Anodyne	CHRM1	15	42
CC[C@@H](C(=O)N1CCC(NC(=O)N[C@@H]2C[C@@H](SC)C2)CC1)c1ccccc1	ZINC000875186718	GG	On-Demand	Anodyne	EPHX2	41	47
CC(C)(C)OC(=O)NCCNC(=O)N[C@@](C)(CO)Cc1ccc(F)cc1	ZINC000875186728	FD	On-Demand	Anodyne	PAPA1_CARPA	22	42
CC(C)(C)OC(=O)NCCNC(=O)N[C@](C)(CO)Cc1ccc(F)cc1	ZINC000875186729	FD	On-Demand	Anodyne	PAPA1_CARPA	22	42
CC[C@@H](NC(=O)NCc1cccc(CS(C)(=O)=O)c1)[C@@H](O)c1ccccc1	ZINC000875186737	GF	On-Demand	Anodyne	ANPEP	16	41
CC[C@@H](NC(=O)NCc1cccc(CS(C)(=O)=O)c1)[C@@H](O)c1ccccc1	ZINC000875186737	GF	On-Demand	Anodyne	PDS	47	36
CC[C@@H](NC(=O)NCc1cccc(CS(C)(=O)=O)c1)[C@H](O)c1ccccc1	ZINC000875186740	GF	On-Demand	Anodyne	ANPEP	16	41
CC[C@@H](NC(=O)NCc1cccc(CS(C)(=O)=O)c1)[C@H](O)c1ccccc1	ZINC000875186740	GF	On-Demand	Anodyne	PDS	47	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCC2CC2)nc1	ZINC000875186764	FE	On-Demand	Anodyne	SLC6A3	45	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCC2CC2)nc1	ZINC000875186765	FE	On-Demand	Anodyne	SLC6A3	45	38
C#CC[C@H](CCOC)NC(=O)NC1CCN(C(=O)[C@@H](CC)c2ccccc2)CC1	ZINC000875186772	GF	On-Demand	Mild	P2RY12	66	32
C#CC[C@H](CCOC)NC(=O)NC1CCN(C(=O)[C@@H](CC)c2ccccc2)CC1	ZINC000875186772	GF	On-Demand	Mild	EPHX2	25	40
C#CC[C@@H](CCOC)NC(=O)NC1CCN(C(=O)[C@@H](CC)c2ccccc2)CC1	ZINC000875186773	GF	On-Demand	Mild	P2RY12	66	32
C#CC[C@@H](CCOC)NC(=O)NC1CCN(C(=O)[C@@H](CC)c2ccccc2)CC1	ZINC000875186773	GF	On-Demand	Mild	EPHX2	25	40
C#CC[C@@H](CCOC)NC(=O)NC1CCN(C(=O)[C@H](CC)c2ccccc2)CC1	ZINC000875186774	GF	On-Demand	Mild	P2RY12	66	32
C#CC[C@@H](CCOC)NC(=O)NC1CCN(C(=O)[C@H](CC)c2ccccc2)CC1	ZINC000875186774	GF	On-Demand	Mild	EPHX2	25	40
C#CC[C@H](CCOC)NC(=O)NC1CCN(C(=O)[C@H](CC)c2ccccc2)CC1	ZINC000875186775	GF	On-Demand	Mild	P2RY12	66	32
C#CC[C@H](CCOC)NC(=O)NC1CCN(C(=O)[C@H](CC)c2ccccc2)CC1	ZINC000875186775	GF	On-Demand	Mild	EPHX2	25	40
CONC(=O)C1CCN(C(=O)NCC2(c3c(F)cccc3F)CCCC2)CC1	ZINC000875186777	GF	On-Demand	Anodyne	CACNA1G	37	43
C[C@@H](NC(=O)NCCNC(=O)OC(C)(C)C)[C@@H](O)C(F)(F)F	ZINC000875186813	ED	On-Demand	Anodyne	CTSK	15	41
C[C@H](NC(=O)NCCNC(=O)OC(C)(C)C)[C@@H](O)C(F)(F)F	ZINC000875186814	ED	On-Demand	Anodyne	CTSK	15	41
C[C@@H](NC(=O)NCCNC(=O)OC(C)(C)C)[C@H](O)C(F)(F)F	ZINC000875186815	ED	On-Demand	Anodyne	CTSK	15	41
C[C@H](NC(=O)NCCNC(=O)OC(C)(C)C)[C@H](O)C(F)(F)F	ZINC000875186816	ED	On-Demand	Anodyne	CTSK	15	41
O=C(NCC1CCOCC1)NNc1ccc(OCc2ccccc2)cc1	ZINC000875186824	FG	On-Demand	Reactive	ALOX5	16	42
O=C(NCC1CCOCC1)NNc1ccc(OCc2ccccc2)cc1	ZINC000875186824	FG	On-Demand	Reactive	MAOB	21	40
O=C(NCC1CCOCC1)NNc1ccc(OCc2ccccc2)cc1	ZINC000875186824	FG	On-Demand	Reactive	LTA4H	32	46
O=C(NCC1CCOCC1)NNc1ccc(OCc2ccccc2)cc1	ZINC000875186824	FG	On-Demand	Reactive	ADAM17	19	47
O=C(NCC1CCOCC1)NNc1ccc(OCc2ccccc2)cc1	ZINC000875186824	FG	On-Demand	Reactive	FFAR1	25	40
O=C(NCC1CCOCC1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875186880	ED	On-Demand	Anodyne	CACNA1I	41	37
O=C(NCC1CCOCC1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875186881	ED	On-Demand	Anodyne	CACNA1I	41	37
O=C(NCC1CCOCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875186899	DE	On-Demand	Anodyne	F2	29	45
O=C(NCC1CCOCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875186900	DE	On-Demand	Anodyne	F2	29	45
O=C(NCC1CCOCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875186901	DE	On-Demand	Anodyne	F2	29	45
O=C(NCC1CCOCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875186902	DE	On-Demand	Anodyne	F2	29	45
COc1ccccc1[C@H]1CCCN(C(=O)NCC2CCOCC2)CC1	ZINC000875186938	EG	On-Demand	Anodyne	DRD2	19	45
COc1ccccc1[C@H]1CCCN(C(=O)NCC2CCOCC2)CC1	ZINC000875186938	EG	On-Demand	Anodyne	RBP4	29	40
COc1ccccc1[C@H]1CCCN(C(=O)NCC2CCOCC2)CC1	ZINC000875186938	EG	On-Demand	Anodyne	SMO	24	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCC2CCOCC2)CC1	ZINC000875186939	EG	On-Demand	Anodyne	DRD2	19	45
COc1ccccc1[C@@H]1CCCN(C(=O)NCC2CCOCC2)CC1	ZINC000875186939	EG	On-Demand	Anodyne	RBP4	29	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCC2CCOCC2)CC1	ZINC000875186939	EG	On-Demand	Anodyne	SMO	24	41
CC[C@H](C(=O)N1CCC(NC(=O)NNc2cccc(C)n2)CC1)c1ccccc1	ZINC000875186958	GG	On-Demand	Reactive	EPHX2	30	44
CC[C@@H](C(=O)N1CCC(NC(=O)NNc2cccc(C)n2)CC1)c1ccccc1	ZINC000875186959	GG	On-Demand	Reactive	EPHX2	30	44
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(CS(C)(=O)=O)c1	ZINC000875186979	ED	On-Demand	Anodyne	ANPEP	21	46
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(CS(C)(=O)=O)c1	ZINC000875186979	ED	On-Demand	Anodyne	PDS	48	33
CC[C@H](C(=O)N1CCC(NC(=O)NN(C)C(=O)OC)CC1)c1ccccc1	ZINC000875186983	GE	On-Demand	Reactive	EPHX2	41	45
CC[C@@H](C(=O)N1CCC(NC(=O)NN(C)C(=O)OC)CC1)c1ccccc1	ZINC000875186984	GE	On-Demand	Reactive	EPHX2	41	45
CC[C@H](C(=O)N1CCC(NC(=O)NN=c2cc[nH]cc2C)CC1)c1ccccc1	ZINC000875186986	GF	On-Demand	Reactive	EPHX2	25	40
CC[C@@H](C(=O)N1CCC(NC(=O)NN=c2cc[nH]cc2C)CC1)c1ccccc1	ZINC000875186987	GF	On-Demand	Reactive	EPHX2	25	40
CC[C@H](C(=O)N1CCC(NC(=O)NN=c2cc[nH]c(C)c2)CC1)c1ccccc1	ZINC000875187000	GF	On-Demand	Reactive	EPHX2	28	41
CC[C@@H](C(=O)N1CCC(NC(=O)NN=c2cc[nH]c(C)c2)CC1)c1ccccc1	ZINC000875187001	GF	On-Demand	Reactive	EPHX2	28	41
CCC[C@H](CCO)NC(=O)NCCNC(=O)OC(C)(C)C	ZINC000875187007	DD	On-Demand	Anodyne	CTSK	17	45
CCC[C@@H](CCO)NC(=O)NCCNC(=O)OC(C)(C)C	ZINC000875187008	DD	On-Demand	Anodyne	CTSK	17	45
O=C(NCC1CCOCC1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875187013	GF	On-Demand	Anodyne	SMO	23	41
O=C(NCC1CCOCC1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875187027	EF	On-Demand	Anodyne	F2	20	42
O=C(NCC1CCOCC1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875187027	EF	On-Demand	Anodyne	CPT1A	66	36
O=C(NCC1CCOCC1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875187028	EF	On-Demand	Anodyne	F2	20	42
O=C(NCC1CCOCC1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875187028	EF	On-Demand	Anodyne	CPT1A	66	36
O=C(NCC1CCOCC1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875187029	EF	On-Demand	Anodyne	F2	20	42
O=C(NCC1CCOCC1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875187029	EF	On-Demand	Anodyne	CPT1A	66	36
O=C(NCC1CCOCC1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875187030	EF	On-Demand	Anodyne	F2	20	42
O=C(NCC1CCOCC1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875187030	EF	On-Demand	Anodyne	CPT1A	66	36
C[C@H](O)c1ccc(CNC(=O)NCCC[C@@H]2CCOC2=O)cc1	ZINC000875187041	DD	On-Demand	Anodyne	LUXR	47	34
C[C@H](O)c1ccc(CNC(=O)NCCC[C@@H]2CCOC2=O)cc1	ZINC000875187041	DD	On-Demand	Anodyne	TRAR	52	34
C[C@H](O)c1ccc(CNC(=O)NCCC[C@H]2CCOC2=O)cc1	ZINC000875187042	DD	On-Demand	Anodyne	LUXR	47	34
C[C@H](O)c1ccc(CNC(=O)NCCC[C@H]2CCOC2=O)cc1	ZINC000875187042	DD	On-Demand	Anodyne	TRAR	52	34
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc([C@H](C)O)cc2)C1	ZINC000875187062	DE	On-Demand	Anodyne	DPP7	73	37
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc([C@H](C)O)cc2)C1	ZINC000875187062	DE	On-Demand	Anodyne	NAMPT	27	40
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc([C@H](C)O)cc2)C1	ZINC000875187063	DE	On-Demand	Anodyne	DPP7	73	37
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc([C@H](C)O)cc2)C1	ZINC000875187063	DE	On-Demand	Anodyne	NAMPT	27	40
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc([C@@H](C)O)cc2)C1	ZINC000875187064	DE	On-Demand	Anodyne	DPP7	73	37
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc([C@@H](C)O)cc2)C1	ZINC000875187064	DE	On-Demand	Anodyne	NAMPT	27	40
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc([C@@H](C)O)cc2)C1	ZINC000875187065	DE	On-Demand	Anodyne	DPP7	73	37
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc([C@@H](C)O)cc2)C1	ZINC000875187065	DE	On-Demand	Anodyne	NAMPT	27	40
N#Cc1ccccc1N1CCC(NC(=O)NCc2ccccc2CO)CC1	ZINC000875187067	FF	On-Demand	Mild	EPHX2	20	45
CC(C)(C)OC(=O)NCC12CCC(CC1)N2C(=O)NCc1ccccc1CO	ZINC000875187082	GF	On-Demand	Anodyne	HCN1	40	31
CC(C)(C)OC(=O)NCC12CCC(CC1)N2C(=O)NCc1ccccc1CO	ZINC000875187082	GF	On-Demand	Anodyne	HCN4	40	31
C[C@H](O)c1ccc(CNC(=O)NCc2ncc(Cl)s2)cc1	ZINC000875187086	EF	On-Demand	Anodyne	FFAR2	23	40
CC[C@@](C)(NC(=O)NCc1ccc(CO)c(F)c1)c1ccc(F)cc1	ZINC000875187113	EH	On-Demand	Anodyne	TRPV1	29	47
C[C@H](O)c1ccc(CNC(=O)N[C@@H]2CC[C@@H](NC(=O)OC(C)(C)C)CC2)cc1	ZINC000875187141	GG	On-Demand	Anodyne	EPHX2	15	40
C[C@H](O)c1ccc(CNC(=O)N(C)CCc2cccc(C#N)c2)cc1	ZINC000875187149	EF	On-Demand	Mild	PDS	25	42
C[C@H](O)c1ccc(CNC(=O)N2CCC(CCF)CC2)cc1	ZINC000875187158	DG	On-Demand	Anodyne	EPHX2	20	40
C[C@H](O)c1ccc(CNC(=O)N2CCC(CCF)CC2)cc1	ZINC000875187158	DG	On-Demand	Anodyne	TPSAB1	15	41
C[C@H](O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875187173	FH	On-Demand	Anodyne	FKBP1A	42	40
C[C@H](O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875187173	FH	On-Demand	Anodyne	CCR5	28	44
C[C@H](O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875187173	FH	On-Demand	Anodyne	PREP	31	44
C[C@H](O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875187173	FH	On-Demand	Anodyne	TMPRSS11D	64	37
C[C@H](O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875187174	FH	On-Demand	Anodyne	FKBP1A	42	40
C[C@H](O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875187174	FH	On-Demand	Anodyne	CCR5	28	44
C[C@H](O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875187174	FH	On-Demand	Anodyne	PREP	31	44
C[C@H](O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875187174	FH	On-Demand	Anodyne	TMPRSS11D	64	37
C[C@H](O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875187175	FH	On-Demand	Anodyne	FKBP1A	42	40
C[C@H](O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875187175	FH	On-Demand	Anodyne	CCR5	28	44
C[C@H](O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875187175	FH	On-Demand	Anodyne	PREP	31	44
C[C@H](O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875187175	FH	On-Demand	Anodyne	TMPRSS11D	64	37
C[C@H](O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875187176	FH	On-Demand	Anodyne	FKBP1A	42	40
C[C@H](O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875187176	FH	On-Demand	Anodyne	CCR5	28	44
C[C@H](O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875187176	FH	On-Demand	Anodyne	PREP	31	44
C[C@H](O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875187176	FH	On-Demand	Anodyne	TMPRSS11D	64	37
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@]3(CC(=O)c4ccccc4O3)C2)cc1	ZINC000875187181	GG	On-Demand	Anodyne	EPHX2	15	47
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@@]3(CC(=O)c4ccccc4O3)C2)cc1	ZINC000875187183	GG	On-Demand	Anodyne	EPHX2	15	47
C[C@H](O)c1ccc(CNC(=O)N2CC(c3ccccc3)C2)cc1	ZINC000875187215	DG	On-Demand	Anodyne	CCR5	26	40
C[C@H](O)c1ccc(CNC(=O)N2CC(c3ccccc3)C2)cc1	ZINC000875187215	DG	On-Demand	Anodyne	TPSAB1	15	47
C[C@H](O)c1ccc(CNC(=O)N2CC(c3ccccc3)C2)cc1	ZINC000875187215	DG	On-Demand	Anodyne	NPSR1	27	42
C[C@H](O)c1ccc(CNC(=O)N2CC(c3ccccc3)C2)cc1	ZINC000875187215	DG	On-Demand	Anodyne	NAMPT	18	43
C[C@H](O)c1ccc(CNC(=O)N2Cc3ccccc3[C@H](C)C2)cc1	ZINC000875187224	DH	On-Demand	Anodyne	NPSR1	26	40
C[C@H](O)c1ccc(CNC(=O)N2Cc3ccccc3[C@H](C)C2)cc1	ZINC000875187224	DH	On-Demand	Anodyne	NAMPT	23	46
C[C@H](O)c1ccc(CNC(=O)N2Cc3ccccc3[C@@H](C)C2)cc1	ZINC000875187225	DH	On-Demand	Anodyne	NPSR1	26	40
C[C@H](O)c1ccc(CNC(=O)N2Cc3ccccc3[C@@H](C)C2)cc1	ZINC000875187225	DH	On-Demand	Anodyne	NAMPT	23	46
C[C@@H]1CN(C(=O)NCc2ccc([C@@H](C)O)cc2)Cc2ccccc21	ZINC000875187226	DH	On-Demand	Anodyne	NPSR1	26	40
C[C@@H]1CN(C(=O)NCc2ccc([C@@H](C)O)cc2)Cc2ccccc21	ZINC000875187226	DH	On-Demand	Anodyne	NAMPT	23	46
C[C@H](O)c1ccc(CNC(=O)N2CCC(Cc3nccs3)CC2)cc1	ZINC000875187232	FG	On-Demand	Anodyne	GRIN2B	28	41
CC(C)(C)OC(=O)CN1CCC(NC(=O)NCc2ccccc2CO)CC1	ZINC000875187264	GD	On-Demand	Anodyne	SIGMAR1	15	41
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCc1ccc(CO)c(F)c1)CC2	ZINC000875187265	GG	On-Demand	Anodyne	SLC18A2	46	33
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCc1ccc(CO)c(F)c1)CC2	ZINC000875187265	GG	On-Demand	Anodyne	HCRTR1	16	46
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCc1ccc(CO)c(F)c1)CC2	ZINC000875187265	GG	On-Demand	Anodyne	HCRTR2	16	42
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCc1ccc(CO)c(F)c1)CC2	ZINC000875187266	GG	On-Demand	Anodyne	SLC18A2	46	33
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCc1ccc(CO)c(F)c1)CC2	ZINC000875187266	GG	On-Demand	Anodyne	HCRTR1	16	46
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCc1ccc(CO)c(F)c1)CC2	ZINC000875187266	GG	On-Demand	Anodyne	HCRTR2	16	42
O=C(NCc1ccc(CO)c(F)c1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875187267	FE	On-Demand	Anodyne	SIGMAR1	19	43
Cc1cccc(CN2CCO[C@@H](CNC(=O)NCc3ccccc3CO)C2)c1	ZINC000875187302	GE	On-Demand	Anodyne	DRD4	25	40
Cc1cccc(CN2CCO[C@@H](CNC(=O)NCc3ccccc3CO)C2)c1	ZINC000875187302	GE	On-Demand	Anodyne	CHRM3	15	40
Cc1cccc(CN2CCO[C@H](CNC(=O)NCc3ccccc3CO)C2)c1	ZINC000875187303	GE	On-Demand	Anodyne	DRD4	25	40
Cc1cccc(CN2CCO[C@H](CNC(=O)NCc3ccccc3CO)C2)c1	ZINC000875187303	GE	On-Demand	Anodyne	CHRM3	15	40
C[C@H](O)c1ccc(CNC(=O)NCc2cc(C(F)(F)F)cc(Cl)n2)cc1	ZINC000875187309	GH	On-Demand	Anodyne	TACR1	23	41
C[C@H](O)c1ccc(CNC(=O)NCc2cc(C(F)(F)F)cc(Cl)n2)cc1	ZINC000875187309	GH	On-Demand	Anodyne	CCR2	42	41
O=C(NCc1ccc(CO)c(F)c1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875187330	FG	On-Demand	Anodyne	PREP	20	40
O=C(NCc1ccc(CO)c(F)c1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875187331	FG	On-Demand	Anodyne	PREP	20	40
O=C(NCc1ccc(CO)c(F)c1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875187332	FG	On-Demand	Anodyne	PREP	20	40
O=C(NCc1ccc(CO)c(F)c1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875187333	FG	On-Demand	Anodyne	PREP	20	40
Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)c1scnc1C(F)F	ZINC000875187337	GJ	On-Demand	Anodyne	MAPK11	37	40
Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)c1scnc1C(F)F	ZINC000875187337	GJ	On-Demand	Anodyne	MAPK14	50	40
Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)c1scnc1C(F)F	ZINC000875187337	GJ	On-Demand	Anodyne	MAPK13	70	35
CONC(=O)C1CCN(C(=O)NCc2ccc([C@@H](C)O)cc2)CC1	ZINC000875187408	ED	On-Demand	Anodyne	EPHX2	19	42
CONC(=O)C1CCN(C(=O)NCc2ccc([C@H](C)O)cc2)CC1	ZINC000875187409	ED	On-Demand	Anodyne	EPHX2	19	42
CCC(CC)(CNC(=O)NCc1ccc(CO)c(F)c1)C(F)(F)F	ZINC000875187443	FG	On-Demand	Anodyne	TRPV1	22	47
CC(=O)Nc1cc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)ccc1F	ZINC000875187486	JJ	On-Demand	Bother	PYGL	19	40
CC(=O)Nc1cc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)ccc1F	ZINC000875187486	JJ	On-Demand	Bother	GRM4	40	44
CC(=O)Nc1cc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)ccc1F	ZINC000875187486	JJ	On-Demand	Bother	KCNMA1	39	44
CC(=O)Nc1cc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)ccc1F	ZINC000875187486	JJ	On-Demand	Bother	NR2E3	64	38
CC(=O)Nc1cc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)ccc1F	ZINC000875187486	JJ	On-Demand	Bother	SMO	20	41
CC(=O)Nc1cc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)ccc1F	ZINC000875187486	JJ	On-Demand	Bother	WDR5	36	46
Cc1ccc(CN2CCO[C@H](CNC(=O)NCc3ccccc3CO)C2)cc1	ZINC000875187509	GE	On-Demand	Anodyne	DRD4	25	44
CONC(=O)C1CCN(C(=O)NCc2ccc(CO)c(F)c2)CC1	ZINC000875187511	EC	On-Demand	Anodyne	EPHX2	26	49
C[C@H](O)c1ccc(CNC(=O)NCc2ccc(OC(F)F)cc2F)cc1	ZINC000875187516	FG	On-Demand	Anodyne	TRPV1	88	36
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NCc2ccccc2CO)C(C)(C)C1	ZINC000875187528	GG	On-Demand	Anodyne	GPR119	29	45
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCc2ccccc2CO)C(C)(C)C1	ZINC000875187529	GG	On-Demand	Anodyne	GPR119	29	45
C[C@H](O)c1ccc(CNC(=O)N2CCN([S@@](C)(=N)=O)CC2)cc1	ZINC000875187530	ED	On-Demand	Anodyne	NAMPT	26	41
C[C@H](O)c1ccc(CNC(=O)N2CCN([S@](C)(=N)=O)CC2)cc1	ZINC000875187531	ED	On-Demand	Anodyne	NAMPT	26	41
COC[C@H](NC(=O)NCc1ccccc1CO)c1cccc(Br)c1	ZINC000875187551	GG	On-Demand	Anodyne	ANPEP	19	40
COC[C@@H](NC(=O)NCc1ccccc1CO)c1cccc(Br)c1	ZINC000875187552	GG	On-Demand	Anodyne	ANPEP	19	40
C[C@H](O)c1ccc(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875187556	FF	On-Demand	Anodyne	ADRB2	41	38
C[C@H](O)c1ccc(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875187556	FF	On-Demand	Anodyne	ADRB3	29	41
C[C@H](O)c1ccc(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875187556	FF	On-Demand	Anodyne	PDS	76	40
C[C@H](O)c1ccc(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875187557	FF	On-Demand	Anodyne	ADRB2	41	38
C[C@H](O)c1ccc(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875187557	FF	On-Demand	Anodyne	ADRB3	29	41
C[C@H](O)c1ccc(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875187557	FF	On-Demand	Anodyne	PDS	76	40
C[C@H](O)c1ccc(CNC(=O)N2CCN(C)c3ncccc3C2)cc1	ZINC000875187558	EE	On-Demand	Anodyne	NAMPT	27	47
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875187566	ED	On-Demand	Anodyne	SLC6A4	32	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875187566	ED	On-Demand	Anodyne	SLC6A3	65	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875187567	ED	On-Demand	Anodyne	SLC6A4	32	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875187567	ED	On-Demand	Anodyne	SLC6A3	65	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875187568	ED	On-Demand	Anodyne	SLC6A4	32	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875187568	ED	On-Demand	Anodyne	SLC6A3	65	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875187569	ED	On-Demand	Anodyne	SLC6A4	32	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875187569	ED	On-Demand	Anodyne	SLC6A3	65	41
C[C@H](O)c1ccc(CNC(=O)NC[C@@H](C)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000875187587	GF	On-Demand	Anodyne	TRPV1	15	40
C[C@H](O)c1ccc(CNC(=O)NC[C@H](C)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000875187588	GF	On-Demand	Anodyne	TRPV1	15	40
Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)[C@]1(C)CCC(=O)N1	ZINC000875187608	FF	On-Demand	Anodyne	CNR2	17	44
Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)[C@]1(C)CCC(=O)N1	ZINC000875187608	FF	On-Demand	Anodyne	MAPK14	40	42
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CN(C(=O)NCc1ccc(CO)c(F)c1)C2	ZINC000875187609	GF	On-Demand	Anodyne	GPR119	32	40
CC[C@@H](NC(=O)NCc1ccccc1CO)c1cccc(OC)c1OC	ZINC000875187616	FG	On-Demand	Anodyne	ANPEP	15	47
CCOC1CC2(C1)C[C@H]2C(=O)Nc1sc(-c2ccccc2)cc1C#N	ZINC000875187623	FI	On-Demand	Mild	TIMP3	59	31
O=C(NCc1ccc(CO)c(F)c1)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875187635	FG	On-Demand	Anodyne	NAMPT	47	39
O=C(NCc1ccc(CO)c(F)c1)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875187636	FG	On-Demand	Anodyne	NAMPT	47	39
C[C@]1(C(F)(F)F)CCN(C(=O)NCc2ccc(CO)c(F)c2)C1	ZINC000875187665	EF	On-Demand	Anodyne	EPHX2	18	40
C[C@H](O)c1ccc(CNC(=O)N[C@H](C)c2cc3cnccc3o2)cc1	ZINC000875187673	EG	On-Demand	Anodyne	NAMPT	45	41
C[C@H](O)c1ccc(CNC(=O)N[C@@H](C)c2cc3cnccc3o2)cc1	ZINC000875187675	EG	On-Demand	Anodyne	NAMPT	45	41
Cc1nccnc1[C@@H](C)NC(=O)NCc1ccccc1CO	ZINC000875187692	DD	On-Demand	Anodyne	ANPEP	20	43
Cc1nccnc1[C@H](C)NC(=O)NCc1ccccc1CO	ZINC000875187693	DD	On-Demand	Anodyne	ANPEP	20	43
C[C@H](O)c1ccc(CNC(=O)N[C@H](C)c2ccccc2O)cc1	ZINC000875187701	DG	On-Demand	Clean	ANPEP	18	44
C[C@H](O)c1ccc(CNC(=O)N[C@@H](C)c2ccccc2O)cc1	ZINC000875187703	DG	On-Demand	Clean	ANPEP	18	44
C[C@@H](NC(=O)NCCc1ccc(O)cc1)c1ccns1	ZINC000875187716	CE	On-Demand	Anodyne	GRIA1	42	31
CC[C@H](C[C@H](C)O)NC(=O)NCCc1ccc(O)cc1	ZINC000875187754	CD	On-Demand	Anodyne	ADRB3	21	42
CC[C@H](C[C@H](C)O)NC(=O)NCCc1ccc(O)cc1	ZINC000875187754	CD	On-Demand	Anodyne	GRIA1	47	33
CC[C@H](C[C@H](C)O)NC(=O)NCCc1ccc(O)cc1	ZINC000875187754	CD	On-Demand	Anodyne	CAPN2	15	42
Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)C1(C)CC(F)(F)C1	ZINC000875187764	FI	On-Demand	Anodyne	CNR2	17	45
Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)C1(C)CC(F)(F)C1	ZINC000875187764	FI	On-Demand	Anodyne	MAPK11	37	40
Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)C1(C)CC(F)(F)C1	ZINC000875187764	FI	On-Demand	Anodyne	MAPK14	51	40
Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)C1(C)CC(F)(F)C1	ZINC000875187764	FI	On-Demand	Anodyne	MAPK13	54	36
O=C(NCc1ccccc1CO)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875187772	FG	On-Demand	Anodyne	C3AR1	41	41
O=C(NCc1ccccc1CO)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875187772	FG	On-Demand	Anodyne	NAMPT	48	41
O=C(NCc1ccccc1CO)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875187774	FG	On-Demand	Anodyne	C3AR1	41	41
O=C(NCc1ccccc1CO)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875187774	FG	On-Demand	Anodyne	NAMPT	48	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC(=O)NCc2ccccc2CO)CC1	ZINC000875187790	GG	On-Demand	Anodyne	ACACB	16	46
CC[C@]1(C(=O)Nc2ccc(C(=O)NC3CCCCC3)cc2C)CCNC1=O	ZINC000875187791	FF	On-Demand	Anodyne	CNR2	21	45
CC[C@]1(C(=O)Nc2ccc(C(=O)NC3CCCCC3)cc2C)CCNC1=O	ZINC000875187791	FF	On-Demand	Anodyne	MAPK14	42	42
O=C(NCc1ccc(CO)c(F)c1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875187797	FE	On-Demand	Anodyne	F2R	41	32
O=C(NCc1ccc(CO)c(F)c1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875187798	FE	On-Demand	Anodyne	F2R	41	32
CS(=O)(=O)N1CCN(CCNC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875187799	GC	On-Demand	Anodyne	DRD3	19	40
CS(=O)(=O)N1CCN(CCNC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875187799	GC	On-Demand	Anodyne	HTR4	32	44
CS(=O)(=O)N1CCN(CCNC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875187799	GC	On-Demand	Anodyne	CCR3	37	43
CS(=O)(=O)N1CCN(CCNC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875187799	GC	On-Demand	Anodyne	EPHX2	34	41
O=C(NCc1ccccc1CO)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875187810	FF	On-Demand	Anodyne	EPHX2	16	44
O=C(NCc1ccccc1CO)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875187810	FF	On-Demand	Anodyne	SLC12A5	57	33
CCN(CCNC(=O)OC(C)(C)C)C(=O)NCCc1ccc(O)cc1	ZINC000875187824	FE	On-Demand	Anodyne	PAPA1_CARPA	16	40
Cc1cncc([C@@H]2CCCN2C(=O)NCc2ccc([C@@H](C)O)cc2)c1	ZINC000875187828	EG	On-Demand	Anodyne	ADAM17	16	42
Cc1cncc([C@H]2CCCN2C(=O)NCc2ccc([C@@H](C)O)cc2)c1	ZINC000875187830	EG	On-Demand	Anodyne	ADAM17	16	42
Cc1cncc([C@H]2CCCN2C(=O)NCc2ccc([C@H](C)O)cc2)c1	ZINC000875187832	EG	On-Demand	Anodyne	ADAM17	16	42
Cc1cncc([C@@H]2CCCN2C(=O)NCc2ccc([C@H](C)O)cc2)c1	ZINC000875187834	EG	On-Demand	Anodyne	ADAM17	16	42
CN1CCN(C2CCN(C(=O)NCc3ccc(CO)c(F)c3)CC2)CC1	ZINC000875187842	FD	On-Demand	Anodyne	EPHX2	15	41
CN1CCN(C2CCN(C(=O)NCc3ccc(CO)c(F)c3)CC2)CC1	ZINC000875187842	FD	On-Demand	Anodyne	L3MBTL3	83	40
O=C(NCCC[C@@H]1CCOC1=O)NCc1ccccc1CO	ZINC000875187848	DD	On-Demand	Anodyne	LUXR	50	36
O=C(NCCC[C@@H]1CCOC1=O)NCc1ccccc1CO	ZINC000875187848	DD	On-Demand	Anodyne	TRAR	51	36
O=C(NCCC[C@H]1CCOC1=O)NCc1ccccc1CO	ZINC000875187850	DD	On-Demand	Anodyne	LUXR	50	36
O=C(NCCC[C@H]1CCOC1=O)NCc1ccccc1CO	ZINC000875187850	DD	On-Demand	Anodyne	TRAR	51	36
CCOCCCCNC(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875187865	FH	On-Demand	Anodyne	DRD4	40	30
C#C[C@@H]1CC[C@@H](NC(=O)NCc2ccccc2CO)CC1	ZINC000875187882	CE	On-Demand	Mild	EPHX2	15	46
C[C@H](O)c1ccc(CNC(=O)N[C@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000875187886	FH	On-Demand	Anodyne	TRPV1	64	31
C[C@H](O)c1ccc(CNC(=O)N[C@@H](C)c2ccc(C(F)(F)F)nc2)cc1	ZINC000875187888	FH	On-Demand	Anodyne	TRPV1	64	31
O=C(NCCC[C@@H]1CCOC1=O)NCCc1ccc(O)cc1	ZINC000875187917	DD	On-Demand	Anodyne	CXCR4	50	34
O=C(NCCC[C@@H]1CCOC1=O)NCCc1ccc(O)cc1	ZINC000875187917	DD	On-Demand	Anodyne	LUXR	67	39
O=C(NCCC[C@@H]1CCOC1=O)NCCc1ccc(O)cc1	ZINC000875187917	DD	On-Demand	Anodyne	TRAR	69	39
O=C(NCCC[C@H]1CCOC1=O)NCCc1ccc(O)cc1	ZINC000875187918	DD	On-Demand	Anodyne	CXCR4	50	34
O=C(NCCC[C@H]1CCOC1=O)NCCc1ccc(O)cc1	ZINC000875187918	DD	On-Demand	Anodyne	LUXR	67	39
O=C(NCCC[C@H]1CCOC1=O)NCCc1ccc(O)cc1	ZINC000875187918	DD	On-Demand	Anodyne	TRAR	69	39
O=C(NCCCc1nc2ccccc2[nH]1)N1Cc2cccc(O)c2C1	ZINC000875187922	EF	On-Demand	Clean	OPRD1	25	43
C[C@]1(C(F)(F)F)CCN(C(=O)NCCc2ccc(O)cc2)C1	ZINC000875187938	DF	On-Demand	Anodyne	EPHX2	16	49
O=C(NCc1ccc(CO)c(F)c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875187941	FF	On-Demand	Anodyne	F2	37	41
O=C(NCc1ccc(CO)c(F)c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875187941	FF	On-Demand	Anodyne	DPP4	20	40
O=C(NCc1ccc(CO)c(F)c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875187941	FF	On-Demand	Anodyne	PREP	23	43
O=C(NCc1ccc(CO)c(F)c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875187941	FF	On-Demand	Anodyne	TMPRSS11D	51	33
O=C(NCc1ccc(CO)c(F)c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875187943	FF	On-Demand	Anodyne	F2	37	41
O=C(NCc1ccc(CO)c(F)c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875187943	FF	On-Demand	Anodyne	DPP4	20	40
O=C(NCc1ccc(CO)c(F)c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875187943	FF	On-Demand	Anodyne	PREP	23	43
O=C(NCc1ccc(CO)c(F)c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875187943	FF	On-Demand	Anodyne	TMPRSS11D	51	33
O=C(NCc1ccc(CO)c(F)c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875187944	FF	On-Demand	Anodyne	F2	37	41
O=C(NCc1ccc(CO)c(F)c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875187944	FF	On-Demand	Anodyne	DPP4	20	40
O=C(NCc1ccc(CO)c(F)c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875187944	FF	On-Demand	Anodyne	PREP	23	43
O=C(NCc1ccc(CO)c(F)c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875187944	FF	On-Demand	Anodyne	TMPRSS11D	51	33
O=C(NCc1ccc(CO)c(F)c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875187945	FF	On-Demand	Anodyne	F2	37	41
O=C(NCc1ccc(CO)c(F)c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875187945	FF	On-Demand	Anodyne	DPP4	20	40
O=C(NCc1ccc(CO)c(F)c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875187945	FF	On-Demand	Anodyne	PREP	23	43
O=C(NCc1ccc(CO)c(F)c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875187945	FF	On-Demand	Anodyne	TMPRSS11D	51	33
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCc1ccc([C@H](C)O)cc1)CC2	ZINC000875187951	GH	On-Demand	Anodyne	SLC18A2	51	40
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCc1ccc([C@H](C)O)cc1)CC2	ZINC000875187951	GH	On-Demand	Anodyne	HCRTR1	16	49
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCc1ccc([C@H](C)O)cc1)CC2	ZINC000875187951	GH	On-Demand	Anodyne	MTNR1B	17	50
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCc1ccc([C@H](C)O)cc1)CC2	ZINC000875187954	GH	On-Demand	Anodyne	SLC18A2	51	40
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCc1ccc([C@H](C)O)cc1)CC2	ZINC000875187954	GH	On-Demand	Anodyne	HCRTR1	16	49
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCc1ccc([C@H](C)O)cc1)CC2	ZINC000875187954	GH	On-Demand	Anodyne	MTNR1B	17	50
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCc1ccc([C@@H](C)O)cc1)CC2	ZINC000875187956	GH	On-Demand	Anodyne	SLC18A2	51	40
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCc1ccc([C@@H](C)O)cc1)CC2	ZINC000875187956	GH	On-Demand	Anodyne	HCRTR1	16	49
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCc1ccc([C@@H](C)O)cc1)CC2	ZINC000875187956	GH	On-Demand	Anodyne	MTNR1B	17	50
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCc1ccc([C@@H](C)O)cc1)CC2	ZINC000875187958	GH	On-Demand	Anodyne	SLC18A2	51	40
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCc1ccc([C@@H](C)O)cc1)CC2	ZINC000875187958	GH	On-Demand	Anodyne	HCRTR1	16	49
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCc1ccc([C@@H](C)O)cc1)CC2	ZINC000875187958	GH	On-Demand	Anodyne	MTNR1B	17	50
C[C@H](O)c1ccc(CNC(=O)N2CCC(c3nnnn3C)CC2)cc1	ZINC000875187970	ED	On-Demand	Anodyne	IL2RA	41	33
O=C(COc1cccc(Cl)c1)Nc1ccccc1C(=O)NC1CCCC1	ZINC000875188018	FI	On-Demand	Anodyne	CNR1	27	43
O=C(COc1cccc(Cl)c1)Nc1ccccc1C(=O)NC1CCCC1	ZINC000875188018	FI	On-Demand	Anodyne	DRD4	18	45
O=C(COc1cccc(Cl)c1)Nc1ccccc1C(=O)NC1CCCC1	ZINC000875188018	FI	On-Demand	Anodyne	CNR2	33	43
O=C(COc1cccc(Cl)c1)Nc1ccccc1C(=O)NC1CCCC1	ZINC000875188018	FI	On-Demand	Anodyne	SLC6A5	20	41
O=C(COc1cccc(Cl)c1)Nc1ccccc1C(=O)NC1CCCC1	ZINC000875188018	FI	On-Demand	Anodyne	MCHR1	22	52
C[C@@H](NC(=O)NCCc1ccc(O)cc1)c1ccnn1C	ZINC000875188022	CD	On-Demand	Anodyne	GRIA1	47	34
CCC1(CC)CCCN1C(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875188037	DH	On-Demand	Anodyne	SLC12A5	59	34
CCC1(CC)CCCN1C(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875188039	DH	On-Demand	Anodyne	SLC12A5	59	34
Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)C1(F)CCOCC1	ZINC000875188042	FH	On-Demand	Anodyne	CNR2	20	46
Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)C1(F)CCOCC1	ZINC000875188042	FH	On-Demand	Anodyne	MAPK14	47	43
Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)C1(F)CCOCC1	ZINC000875188042	FH	On-Demand	Anodyne	MAPK13	47	36
CS(=O)(=O)N1CCN(CCNC(=O)NNc2cccc(F)c2Cl)CC1	ZINC000875188044	GC	On-Demand	Reactive	DRD4	46	37
COc1ccc([C@@H]2CN(C(=O)NCc3ccc(CO)c(F)c3)CCO2)cc1	ZINC000875188047	FF	On-Demand	Anodyne	NOS2	67	34
C[C@H](O)c1ccc(CNC(=O)N[C@@H](CF)c2ccc(F)cc2)cc1	ZINC000875188083	EG	On-Demand	Anodyne	ANPEP	16	54
C[C@H](O)c1ccc(CNC(=O)N[C@@H](CF)c2ccc(F)cc2)cc1	ZINC000875188083	EG	On-Demand	Anodyne	AMP1_PLAFQ	15	40
C[C@H](O)c1ccc(CNC(=O)N[C@@H](CF)c2ccc(F)cc2)cc1	ZINC000875188083	EG	On-Demand	Anodyne	LEF	47	33
C[C@H](O)c1ccc(CNC(=O)N[C@H](CF)c2ccc(F)cc2)cc1	ZINC000875188086	EG	On-Demand	Anodyne	ANPEP	16	54
C[C@H](O)c1ccc(CNC(=O)N[C@H](CF)c2ccc(F)cc2)cc1	ZINC000875188086	EG	On-Demand	Anodyne	AMP1_PLAFQ	15	40
C[C@H](O)c1ccc(CNC(=O)N[C@H](CF)c2ccc(F)cc2)cc1	ZINC000875188086	EG	On-Demand	Anodyne	LEF	47	33
O=C(NCc1ccc(CO)c(F)c1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875188087	FF	On-Demand	Anodyne	EPHX2	19	51
O=C(NCc1ccc(CO)c(F)c1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875188087	FF	On-Demand	Anodyne	NPSR1	26	41
O=C(NCc1ccc(CO)c(F)c1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875188088	FF	On-Demand	Anodyne	EPHX2	19	51
O=C(NCc1ccc(CO)c(F)c1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875188088	FF	On-Demand	Anodyne	NPSR1	26	41
CC(=O)C1CCN(C(=O)NCc2ccc([C@@H](C)O)cc2)CC1	ZINC000875188104	DE	On-Demand	Anodyne	EPHX2	19	40
CC(=O)C1CCN(C(=O)NCc2ccc([C@@H](C)O)cc2)CC1	ZINC000875188104	DE	On-Demand	Anodyne	NAMPT	26	42
CC(=O)C1CCN(C(=O)NCc2ccc([C@H](C)O)cc2)CC1	ZINC000875188105	DE	On-Demand	Anodyne	EPHX2	19	40
CC(=O)C1CCN(C(=O)NCc2ccc([C@H](C)O)cc2)CC1	ZINC000875188105	DE	On-Demand	Anodyne	NAMPT	26	42
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NCc1ccc(CO)c(F)c1	ZINC000875188110	GF	On-Demand	Anodyne	TRPV1	21	44
C[C@H](O)c1ccc(CNC(=O)NCCn2ccc(C(F)(F)F)n2)cc1	ZINC000875188118	FE	On-Demand	Anodyne	TRPV1	40	31
C[C@H](O)c1ccc(CNC(=O)NCCn2ccc(C(F)(F)F)n2)cc1	ZINC000875188118	FE	On-Demand	Anodyne	CARM1	40	34
C[C@H](O)c1ccc(CNC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875188140	DD	On-Demand	Anodyne	NAMPT	18	40
Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)c1sccc1CC#N	ZINC000875188158	GI	On-Demand	Mild	MAPK11	33	41
Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)c1sccc1CC#N	ZINC000875188158	GI	On-Demand	Mild	MAPK14	33	41
COCC(C)(C)CCNC(=O)NCc1ccc(CO)c(F)c1	ZINC000875188161	DE	On-Demand	Anodyne	TRPV1	20	47
C[C@]1(NC(=O)C(F)(F)F)CCN(C(=O)NCCc2ccc(O)cc2)C1	ZINC000875188175	FD	On-Demand	Anodyne	EPHX2	15	46
C[C@H](O)c1ccc(CNC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)cc1	ZINC000875188178	GH	On-Demand	Mild	CTSF	74	36
NC(=O)Cc1cccc2c1CCN(C(=O)NCCc1ccc(O)cc1)C2	ZINC000875188181	FD	On-Demand	Anodyne	FABI	50	35
C[C@H](O)c1ccc(CNC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)cc1	ZINC000875188185	GH	On-Demand	Mild	CTSF	74	36
C[C@H](O)c1ccc(CNC(=O)N[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000875188194	FH	On-Demand	Anodyne	KCNA5	17	40
C[C@H](O)c1ccc(CNC(=O)N[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000875188194	FH	On-Demand	Anodyne	C3AR1	38	40
C[C@H](O)c1ccc(CNC(=O)N[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000875188194	FH	On-Demand	Anodyne	NAMPT	57	42
COc1ccc([C@@H]2CN(C(=O)NCCc3ccc(O)cc3)CCO2)cc1	ZINC000875188199	FF	On-Demand	Anodyne	MMP3	16	46
COc1ccc([C@@H]2CN(C(=O)NCCc3ccc(O)cc3)CCO2)cc1	ZINC000875188199	FF	On-Demand	Anodyne	MMP7	16	46
COc1ccc([C@@H]2CN(C(=O)NCCc3ccc(O)cc3)CCO2)cc1	ZINC000875188199	FF	On-Demand	Anodyne	MMP1	17	46
C[C@H](O)c1ccc(CNC(=O)N[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000875188200	FH	On-Demand	Anodyne	KCNA5	17	40
C[C@H](O)c1ccc(CNC(=O)N[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000875188200	FH	On-Demand	Anodyne	C3AR1	38	40
C[C@H](O)c1ccc(CNC(=O)N[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000875188200	FH	On-Demand	Anodyne	NAMPT	57	42
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCc1ccc(CO)c(F)c1)CC2	ZINC000875188214	FF	On-Demand	Anodyne	MAPK1	21	43
CC(=O)Nc1cccc2c1CN(C(=O)NCCc1ccc(O)cc1)CC2	ZINC000875188217	FF	On-Demand	Anodyne	FABI	48	35
CCOC1CC2(C1)C[C@@H]2NC(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875188247	DE	On-Demand	Anodyne	TIMP3	47	38
O=C(CSCC(=O)Nc1ccccc1C(=O)NC1CCCC1)Nc1ccc(F)cc1	ZINC000875188250	IH	On-Demand	Anodyne	CNR1	17	52
O=C(CSCC(=O)Nc1ccccc1C(=O)NC1CCCC1)Nc1ccc(F)cc1	ZINC000875188250	IH	On-Demand	Anodyne	CNR2	32	52
O=C(CSCC(=O)Nc1ccccc1C(=O)NC1CCCC1)Nc1ccc(F)cc1	ZINC000875188250	IH	On-Demand	Anodyne	EPHX2	30	40
O=C(NCCCCC1CC1)NCCc1ccc(O)cc1	ZINC000875188253	CF	On-Demand	Anodyne	GRIA1	48	35
O=C(NCCCCC1CC1)NCCc1ccc(O)cc1	ZINC000875188253	CF	On-Demand	Anodyne	SLC6A5	27	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCc2nc3ccccc3[nH]2)C1	ZINC000875188254	FE	On-Demand	Anodyne	OPRD1	19	41
CCOC1CC2(C1)C[C@@H]2NC(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875188304	DE	On-Demand	Anodyne	TIMP3	47	38
CCOC1CC2(C1)C[C@H]2NC(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875188305	DE	On-Demand	Anodyne	TIMP3	47	38
CCOC1CC2(C1)C[C@H]2NC(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875188306	DE	On-Demand	Anodyne	TIMP3	47	38
C#CC[C@@H](COC)NC(=O)NCc1ccccc1CO	ZINC000875188332	CD	On-Demand	Mild	ANPEP	15	40
C#CC[C@H](COC)NC(=O)NCc1ccccc1CO	ZINC000875188333	CD	On-Demand	Mild	ANPEP	15	40
CCOC1CC2(C1)C[C@@H]2NC(=O)NCc1ccccc1CO	ZINC000875188335	DD	On-Demand	Anodyne	TIMP3	61	37
CCOC1CC2(C1)C[C@H]2NC(=O)NCc1ccccc1CO	ZINC000875188336	DD	On-Demand	Anodyne	TIMP3	61	37
C[C@@H]1CN(C(=O)NCc2ccc(CO)c(F)c2)Cc2ccccc21	ZINC000875188345	EG	On-Demand	Anodyne	NAMPT	18	41
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(CO)c(F)c2)C1	ZINC000875188351	DD	On-Demand	Anodyne	EPHX2	15	49
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(CO)c(F)c2)C1	ZINC000875188351	DD	On-Demand	Anodyne	DPP7	47	33
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(CO)c(F)c2)C1	ZINC000875188352	DD	On-Demand	Anodyne	EPHX2	15	49
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(CO)c(F)c2)C1	ZINC000875188352	DD	On-Demand	Anodyne	DPP7	47	33
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875188359	CE	On-Demand	Anodyne	ANPEP	18	44
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875188361	CE	On-Demand	Anodyne	ANPEP	18	44
CN1CCC(CNC(=O)NCc2ccccc2CO)(c2ccccc2)CC1	ZINC000875188362	FF	On-Demand	Anodyne	KCNA3	48	39
CN1CCC(CNC(=O)NCc2ccccc2CO)(c2ccccc2)CC1	ZINC000875188362	FF	On-Demand	Anodyne	SOAT1	17	45
Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)[C@@H](NC=O)C(C)C	ZINC000875188363	FF	On-Demand	Anodyne	MAPK14	44	38
Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)[C@@H](NC=O)C(C)C	ZINC000875188363	FF	On-Demand	Anodyne	MAPK13	53	37
CS(=O)(=O)N1CCN(CCNC(=O)N2Cc3cccc(O)c3C2)CC1	ZINC000875188364	FB	On-Demand	Clean	DRD4	46	35
CS(=O)(=O)N1CCN(CCNC(=O)N2Cc3cccc(O)c3C2)CC1	ZINC000875188364	FB	On-Demand	Clean	HTR4	23	43
O=C(NCc1ccc(CO)c(F)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875188365	FF	On-Demand	Anodyne	EPHX2	25	49
O=C(NCc1ccc(CO)c(F)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875188366	FF	On-Demand	Anodyne	EPHX2	25	49
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCc1ccc([C@H](C)O)cc1)CC2	ZINC000875188381	FF	On-Demand	Anodyne	MAPK1	31	42
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCc1ccc([C@@H](C)O)cc1)CC2	ZINC000875188382	FF	On-Demand	Anodyne	MAPK1	31	42
COC(=O)[C@@H]1CO[C@H](CCC(=O)Nc2sc(-c3ccccc3)cc2C#N)C1	ZINC000875188388	GH	On-Demand	Mild	VIPR1	25	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccc(O)cc1	ZINC000875188419	DD	On-Demand	Anodyne	SLC6A4	25	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccc(O)cc1	ZINC000875188419	DD	On-Demand	Anodyne	SLC6A3	49	42
CC(=O)[C@H]1CCCN(C(=O)NCCc2ccc(O)cc2)C1	ZINC000875188442	CD	On-Demand	Anodyne	OPRM1	16	42
CC(=O)[C@H]1CCCN(C(=O)NCCc2ccc(O)cc2)C1	ZINC000875188442	CD	On-Demand	Anodyne	DPP7	55	38
CC(=O)[C@H]1CCCN(C(=O)NCCc2ccc(O)cc2)C1	ZINC000875188442	CD	On-Demand	Anodyne	GPBAR1	25	42
CC(=O)[C@H]1CCCN(C(=O)NCCc2ccc(O)cc2)C1	ZINC000875188442	CD	On-Demand	Anodyne	BIRC2	23	40
C[C@H](O)c1ccc(CNC(=O)N[C@H](CCc2ccccc2)c2ccccn2)cc1	ZINC000875188443	GI	On-Demand	Anodyne	MME	40	36
C[C@H](O)c1ccc(CNC(=O)N[C@H](CCc2ccccc2)c2ccccn2)cc1	ZINC000875188443	GI	On-Demand	Anodyne	ANPEP	35	44
C[C@H](O)c1ccc(CNC(=O)N[C@H](CCc2ccccc2)c2ccccn2)cc1	ZINC000875188443	GI	On-Demand	Anodyne	CAPN2	26	41
C[C@H](O)c1ccc(CNC(=O)N[C@H](CCc2ccccc2)c2ccccn2)cc1	ZINC000875188443	GI	On-Demand	Anodyne	AMP1_PLAFQ	43	35
CC(=O)[C@@H]1CCCN(C(=O)NCCc2ccc(O)cc2)C1	ZINC000875188444	CD	On-Demand	Anodyne	OPRM1	16	42
CC(=O)[C@@H]1CCCN(C(=O)NCCc2ccc(O)cc2)C1	ZINC000875188444	CD	On-Demand	Anodyne	DPP7	55	38
CC(=O)[C@@H]1CCCN(C(=O)NCCc2ccc(O)cc2)C1	ZINC000875188444	CD	On-Demand	Anodyne	GPBAR1	25	42
CC(=O)[C@@H]1CCCN(C(=O)NCCc2ccc(O)cc2)C1	ZINC000875188444	CD	On-Demand	Anodyne	BIRC2	23	40
C[C@H](O)c1ccc(CNC(=O)N[C@@H](CCc2ccccc2)c2ccccn2)cc1	ZINC000875188449	GI	On-Demand	Anodyne	MME	40	36
C[C@H](O)c1ccc(CNC(=O)N[C@@H](CCc2ccccc2)c2ccccn2)cc1	ZINC000875188449	GI	On-Demand	Anodyne	ANPEP	35	44
C[C@H](O)c1ccc(CNC(=O)N[C@@H](CCc2ccccc2)c2ccccn2)cc1	ZINC000875188449	GI	On-Demand	Anodyne	CAPN2	26	41
C[C@H](O)c1ccc(CNC(=O)N[C@@H](CCc2ccccc2)c2ccccn2)cc1	ZINC000875188449	GI	On-Demand	Anodyne	AMP1_PLAFQ	43	35
CC(C)(C)OC(=O)CN1CCC(NC(=O)NCCc2ccc(O)cc2)CC1	ZINC000875188467	GE	On-Demand	Anodyne	SSTR5	41	35
CC(C)(C)OC(=O)CN1CCC(NC(=O)NCCc2ccc(O)cc2)CC1	ZINC000875188467	GE	On-Demand	Anodyne	EPHX2	20	45
COC(=O)[C@@H]1CN(C(=O)NCc2ccc([C@@H](C)O)cc2)Cc2ccccc21	ZINC000875188481	FF	On-Demand	Anodyne	NPSR1	25	40
COC(=O)[C@@H]1CN(C(=O)NCc2ccc([C@@H](C)O)cc2)Cc2ccccc21	ZINC000875188481	FF	On-Demand	Anodyne	NAMPT	22	43
COC(=O)[C@@H]1CN(C(=O)NCc2ccc([C@H](C)O)cc2)Cc2ccccc21	ZINC000875188484	FF	On-Demand	Anodyne	NPSR1	25	40
COC(=O)[C@@H]1CN(C(=O)NCc2ccc([C@H](C)O)cc2)Cc2ccccc21	ZINC000875188484	FF	On-Demand	Anodyne	NAMPT	22	43
O=C(NCCc1ccc(O)cc1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875188485	EF	On-Demand	Anodyne	EPHX2	15	62
O=C(NCCc1ccc(O)cc1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875188485	EF	On-Demand	Anodyne	SLC12A5	45	34
O=C(NCCc1ccc(O)cc1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875188486	EF	On-Demand	Anodyne	EPHX2	15	62
O=C(NCCc1ccc(O)cc1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875188486	EF	On-Demand	Anodyne	SLC12A5	45	34
COC(=O)[C@H]1CN(C(=O)NCc2ccc([C@@H](C)O)cc2)Cc2ccccc21	ZINC000875188487	FF	On-Demand	Anodyne	NPSR1	25	40
COC(=O)[C@H]1CN(C(=O)NCc2ccc([C@@H](C)O)cc2)Cc2ccccc21	ZINC000875188487	FF	On-Demand	Anodyne	NAMPT	22	43
COC(=O)[C@H]1CN(C(=O)NCc2ccc([C@H](C)O)cc2)Cc2ccccc21	ZINC000875188491	FF	On-Demand	Anodyne	NPSR1	25	40
COC(=O)[C@H]1CN(C(=O)NCc2ccc([C@H](C)O)cc2)Cc2ccccc21	ZINC000875188491	FF	On-Demand	Anodyne	NAMPT	22	43
C[C@H](O)c1ccc(CNC(=O)N2CCc3nc(C(C)(C)C)ncc3C2)cc1	ZINC000875188518	FG	On-Demand	Anodyne	MAPK1	54	50
C[C@H](O)c1ccc(CNC(=O)N2CCc3nc(C(C)(C)C)ncc3C2)cc1	ZINC000875188518	FG	On-Demand	Anodyne	NAMPT	26	40
C[C@H](O)c1ccc(CNC(=O)N2Cc3cccnc3N3C[C@H](O)C[C@H]3C2)cc1	ZINC000875188587	GD	On-Demand	Anodyne	NAMPT	23	42
C[C@H](O)c1ccc(CNC(=O)N2Cc3cccnc3N3C[C@H](O)C[C@H]3C2)cc1	ZINC000875188587	GD	On-Demand	Anodyne	VHL	40	30
C[C@H](O)c1ccc(CNC(=O)N2CCc3nc(C4CC4)ncc3C2)cc1	ZINC000875188589	FF	On-Demand	Anodyne	MAPK1	54	49
C[C@H](O)c1ccc(CNC(=O)N2CCc3nc(C4CC4)ncc3C2)cc1	ZINC000875188589	FF	On-Demand	Anodyne	NAMPT	28	40
C[C@H](O)c1ccc(CNC(=O)NCC[C@@H](O)COCc2ccccc2)cc1	ZINC000875188598	FF	On-Demand	Anodyne	CAPN1	24	40
C[C@H](O)c1ccc(CNC(=O)NCC[C@@H](O)COCc2ccccc2)cc1	ZINC000875188598	FF	On-Demand	Anodyne	CAPN2	43	33
C[C@H](O)c1ccc(CNC(=O)NCC[C@@H](O)COCc2ccccc2)cc1	ZINC000875188598	FF	On-Demand	Anodyne	PDS	49	35
N#Cc1ccc(N2CCN(C(=O)NCCc3ccc(O)cc3)CC2)cc1	ZINC000875188617	FE	On-Demand	Mild	CTSK	28	44
N#Cc1ccc(N2CCN(C(=O)NCCc3ccc(O)cc3)CC2)cc1	ZINC000875188617	FE	On-Demand	Mild	GPBAR1	31	41
N#Cc1ccc(N2CCN(C(=O)NCCc3ccc(O)cc3)CC2)cc1	ZINC000875188617	FE	On-Demand	Mild	KCNJ1	15	42
O=C(NCCc1ccc(O)cc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875188646	EG	On-Demand	Anodyne	EPHX2	20	40
O=C(NCCc1ccc(O)cc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875188648	EG	On-Demand	Anodyne	EPHX2	20	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC(=O)NCCc2ccc(O)cc2)C1	ZINC000875188651	FF	On-Demand	Anodyne	PAPA1_CARPA	16	40
CC(C)(C)OC(=O)NC1CC(CNC(=O)NCCc2ccc(O)cc2)C1	ZINC000875188653	FF	On-Demand	Anodyne	PAPA1_CARPA	16	40
O=C(NCCc1ccc(O)cc1)N[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1	ZINC000875188659	FE	On-Demand	Anodyne	CA2	15	45
O=C(NCCc1ccc(O)cc1)N[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1	ZINC000875188659	FE	On-Demand	Anodyne	CA1	17	45
O=C(NCCc1ccc(O)cc1)N[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1	ZINC000875188659	FE	On-Demand	Anodyne	CA5B	16	40
C[C@H](O)c1ccc(CNC(=O)N2C[C@H](O)C[C@@H]2C2CC2)cc1	ZINC000875188670	DD	On-Demand	Anodyne	VHL	60	33
C[C@H](O)c1ccc(CNC(=O)N2C[C@@H](O)C[C@@H]2C2CC2)cc1	ZINC000875188671	DD	On-Demand	Anodyne	VHL	60	33
C[C@H](O)c1ccc(CNC(=O)N2C[C@@H](O)C[C@H]2C2CC2)cc1	ZINC000875188672	DD	On-Demand	Anodyne	VHL	60	33
C[C@H](O)c1ccc(CNC(=O)N2C[C@H](O)C[C@H]2C2CC2)cc1	ZINC000875188674	DD	On-Demand	Anodyne	VHL	60	33
C[C@H](O)c1ccc(CNC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)cc1	ZINC000875188677	GG	On-Demand	Anodyne	OPRL1	21	47
C[C@H](O)c1ccc(CNC(=O)N2CC3(CC(=O)N3Cc3ccccc3)C2)cc1	ZINC000875188687	GE	On-Demand	Anodyne	NAMPT	21	40
O=C(NCCCc1nc2ccccc2[nH]1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875188694	GG	On-Demand	Anodyne	PRCP	16	41
O=C(NCCCc1nc2ccccc2[nH]1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875188694	GG	On-Demand	Anodyne	HCRTR2	16	42
O=C(NCCCc1nc2ccccc2[nH]1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875188696	GG	On-Demand	Anodyne	PRCP	16	41
O=C(NCCCc1nc2ccccc2[nH]1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875188696	GG	On-Demand	Anodyne	HCRTR2	16	42
O=C(NCCCc1nc2ccccc2[nH]1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875188699	GG	On-Demand	Anodyne	PRCP	16	41
O=C(NCCCc1nc2ccccc2[nH]1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875188699	GG	On-Demand	Anodyne	HCRTR2	16	42
O=C(NCCCc1nc2ccccc2[nH]1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875188701	GG	On-Demand	Anodyne	PRCP	16	41
O=C(NCCCc1nc2ccccc2[nH]1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875188701	GG	On-Demand	Anodyne	HCRTR2	16	42
C[C@H](O)c1ccc(CNC(=O)N2C[C@@H]3CC[C@H](C2)N3C(=O)OC(C)(C)C)cc1	ZINC000875188711	GG	On-Demand	Anodyne	GPR119	25	40
COC(=O)N(C)NC(=O)NCCCc1nc2ccccc2[nH]1	ZINC000875188729	DD	On-Demand	Reactive	CACNA1G	24	45
CN1CCN(C(=O)NCc2ccnc(-n3ccnc3)c2)Cc2cccnc21	ZINC000875188734	FD	On-Demand	Anodyne	NOS2	105	42
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC[C@@](F)(c2ccccc2)C1	ZINC000875188741	GG	On-Demand	Anodyne	NOS2	94	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC[C@](F)(c2ccccc2)C1	ZINC000875188753	GG	On-Demand	Anodyne	NOS2	94	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875188759	EE	On-Demand	Anodyne	NOS2	107	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875188761	EE	On-Demand	Anodyne	NOS2	107	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875188763	EE	On-Demand	Anodyne	NOS2	107	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875188765	EE	On-Demand	Anodyne	NOS2	107	41
CN1CC[C@H]2CN(C(=O)NCc3ccnc(-n4ccnc4)c3)CC[C@@H]21	ZINC000875188779	ED	On-Demand	Anodyne	NOS2	107	41
CN1CC[C@H]2CN(C(=O)NCc3ccnc(-n4ccnc4)c3)CC[C@H]21	ZINC000875188783	ED	On-Demand	Anodyne	NOS2	107	41
CCOC(=O)[C@@]1(C)CN(C(=O)NCc2ccnc(-n3ccnc3)c2)CCO1	ZINC000875188784	FD	On-Demand	Anodyne	NOS2	103	39
O=C(NCc1ccnc(-n2ccnc2)c1)N1[C@H]2CC[C@H]1CC1(C2)CC1(F)F	ZINC000875188788	FG	On-Demand	Anodyne	NOS2	101	38
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875188793	GF	On-Demand	Anodyne	NOS2	98	40
O=CN1CCCN(C(=O)NCCc2ccc(O)cc2)CC1	ZINC000875188796	CC	On-Demand	Anodyne	ADRB1	17	42
O=CN1CCCN(C(=O)NCCc2ccc(O)cc2)CC1	ZINC000875188796	CC	On-Demand	Anodyne	ADRB3	15	42
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC2(CCSCC2)CC1	ZINC000875188803	FG	On-Demand	Anodyne	NOS2	103	40
O=C(NCCc1ccc(O)cc1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875188804	FG	On-Demand	Anodyne	OPRM1	20	44
O=C(NCCc1ccc(O)cc1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875188804	FG	On-Demand	Anodyne	LNPEP	48	32
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC(CCF)CC1	ZINC000875188805	EF	On-Demand	Anodyne	NOS2	106	41
CN1CCN(C2CCN(C(=O)C(=O)NCCCc3cccc(F)c3)CC2)CC1	ZINC000875188806	GD	On-Demand	Anodyne	L3MBTL3	58	37
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875188808	FG	On-Demand	Anodyne	NOS2	94	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875188810	FG	On-Demand	Anodyne	NOS2	94	41
O=C(NCC[C@@H](O)C(F)F)NCc1ccnc(-n2ccnc2)c1	ZINC000875188824	ED	On-Demand	Anodyne	NOS2	93	34
O=C(NCC[C@H](O)C(F)F)NCc1ccnc(-n2ccnc2)c1	ZINC000875188825	ED	On-Demand	Anodyne	NOS2	93	34
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@]12CCCC[C@@H]1C2	ZINC000875188827	DE	On-Demand	Anodyne	NOS2	104	43
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@]12CCCC[C@@H]1C2	ZINC000875188828	DE	On-Demand	Anodyne	NOS2	104	43
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@]12CCCC[C@H]1C2	ZINC000875188830	DE	On-Demand	Anodyne	NOS2	104	43
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@]12CCCC[C@H]1C2	ZINC000875188832	DE	On-Demand	Anodyne	NOS2	104	43
O=C(NCCCCC1CC1)NCc1ccnc(-n2ccnc2)c1	ZINC000875188841	DF	On-Demand	Anodyne	NOS2	101	38
Cc1ccc(CN2CC[C@H](NC(=O)NCc3ccnc(-n4ccnc4)c3)C2)cc1	ZINC000875188842	GF	On-Demand	Anodyne	DRD4	21	41
Cc1ccc(CN2CC[C@H](NC(=O)NCc3ccnc(-n4ccnc4)c3)C2)cc1	ZINC000875188842	GF	On-Demand	Anodyne	SSTR5	44	43
Cc1ccc(CN2CC[C@H](NC(=O)NCc3ccnc(-n4ccnc4)c3)C2)cc1	ZINC000875188842	GF	On-Demand	Anodyne	CCR3	28	41
Cc1ccc(CN2CC[C@H](NC(=O)NCc3ccnc(-n4ccnc4)c3)C2)cc1	ZINC000875188842	GF	On-Demand	Anodyne	NOS2	107	42
Cc1ccc(CN2CC[C@H](NC(=O)NCc3ccnc(-n4ccnc4)c3)C2)cc1	ZINC000875188842	GF	On-Demand	Anodyne	MCHR1	23	51
Cc1ccc(CN2CC[C@@H](NC(=O)NCc3ccnc(-n4ccnc4)c3)C2)cc1	ZINC000875188843	GF	On-Demand	Anodyne	DRD4	21	41
Cc1ccc(CN2CC[C@@H](NC(=O)NCc3ccnc(-n4ccnc4)c3)C2)cc1	ZINC000875188843	GF	On-Demand	Anodyne	SSTR5	44	43
Cc1ccc(CN2CC[C@@H](NC(=O)NCc3ccnc(-n4ccnc4)c3)C2)cc1	ZINC000875188843	GF	On-Demand	Anodyne	CCR3	28	41
Cc1ccc(CN2CC[C@@H](NC(=O)NCc3ccnc(-n4ccnc4)c3)C2)cc1	ZINC000875188843	GF	On-Demand	Anodyne	NOS2	107	42
Cc1ccc(CN2CC[C@@H](NC(=O)NCc3ccnc(-n4ccnc4)c3)C2)cc1	ZINC000875188843	GF	On-Demand	Anodyne	MCHR1	23	51
O=C(NCCSCCC(F)(F)F)NCc1ccnc(-n2ccnc2)c1	ZINC000875188844	FF	On-Demand	Anodyne	NOS2	78	33
COC(=O)C1(O)CN(C(=O)NC2CCN(C(=O)CC(C)C)CC2)C1	ZINC000875188846	EB	On-Demand	Anodyne	EPHX2	17	43
O=C(NCc1ccnc(-n2ccnc2)c1)N1C[C@H]2COC[C@H]2C1	ZINC000875188851	DD	On-Demand	Anodyne	NOS2	112	44
N#CCCN1CCN(C(=O)NCc2ccnc(-n3ccnc3)c2)CC1	ZINC000875188853	ED	On-Demand	Mild	NOS2	95	40
O=C(NCc1ccnc(-n2ccnc2)c1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875188855	FG	On-Demand	Anodyne	NOS2	99	44
O=C(NCC[C@H](O)C1CCCC1)NCc1ccnc(-n2ccnc2)c1	ZINC000875188866	EE	On-Demand	Anodyne	NOS2	103	39
O=C(NCC[C@@H](O)C1CCCC1)NCc1ccnc(-n2ccnc2)c1	ZINC000875188867	EE	On-Demand	Anodyne	NOS2	103	39
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@H]2CC[C@@H](C1)S2	ZINC000875188874	EE	On-Demand	Anodyne	NOS2	108	42
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H]1CCN(C2CCC2)C1=O	ZINC000875188875	FD	On-Demand	Anodyne	NOS2	104	40
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1CCN(C2CCC2)C1=O	ZINC000875188876	FD	On-Demand	Anodyne	NOS2	104	40
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1C[C@H]1C1CCOCC1	ZINC000875188880	FE	On-Demand	Anodyne	NOS2	103	39
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(C(=O)CC(C)C)CC3)C[C@@H]1C2	ZINC000875188882	FD	On-Demand	Anodyne	EPHX2	33	46
CC(C)[C@H]1CN(C(=O)NCc2ccnc(-n3ccnc3)c2)CCN1C	ZINC000875188883	ED	On-Demand	Anodyne	NOS2	111	43
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC2(CCCO2)C1	ZINC000875188890	DD	On-Demand	Anodyne	NOS2	100	38
C[C@@H](CN(C)C(=O)NCc1ccc([C@H](C)O)cc1)NC(=O)OC(C)(C)C	ZINC000875188914	FF	On-Demand	Anodyne	FPR1	41	33
C[C@H](O)c1ccc(CNC(=O)N(C)C[C@@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000875188915	FF	On-Demand	Anodyne	FPR1	41	33
C[C@@H](CN(C)C(=O)NCc1ccc([C@@H](C)O)cc1)NC(=O)OC(C)(C)C	ZINC000875188916	FF	On-Demand	Anodyne	FPR1	41	33
C[C@H](O)c1ccc(CNC(=O)NCc2ccc(C(C)(C)C)o2)cc1	ZINC000875188921	EH	On-Demand	Anodyne	TRPV1	15	42
C[C@H](O)c1ccc(CNC(=O)N2CC[C@@H](O)C[C@H]2C)cc1	ZINC000875188939	CD	On-Demand	Anodyne	VHL	48	32
CCc1nccn1C[C@H]1CCCN1C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875189018	GE	On-Demand	Anodyne	NOS2	105	41
C[C@@H]1O[C@H](C)[C@H](NC(=O)NCc2ccnc(-n3ccnc3)c2)[C@H]1C	ZINC000875189022	ED	On-Demand	Anodyne	NOS2	100	37
C[C@@H]1O[C@H](C)[C@@H](NC(=O)NCc2ccnc(-n3ccnc3)c2)[C@@H]1C	ZINC000875189025	ED	On-Demand	Anodyne	NOS2	100	37
C[C@@H]1O[C@H](C)[C@@H](NC(=O)NCc2ccnc(-n3ccnc3)c2)[C@H]1C	ZINC000875189028	ED	On-Demand	Anodyne	NOS2	100	37
C[C@@H]1O[C@H](C)[C@H](NC(=O)NCc2ccnc(-n3ccnc3)c2)[C@@H]1C	ZINC000875189030	ED	On-Demand	Anodyne	NOS2	100	37
O=C(NCCc1ccc(O)cc1)NCc1cc(C(F)(F)F)cc(Cl)n1	ZINC000875189032	FH	On-Demand	Anodyne	SLC6A5	15	41
CN(CCNC(=O)NC1CCC(C)(N(C)C)CC1)C1CCCCC1	ZINC000875189039	EF	On-Demand	Anodyne	EPHX2	16	46
C[C@@H]1O[C@H](C)C[C@H]1NC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875189040	DD	On-Demand	Anodyne	NOS2	102	38
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1C[C@H](O)C1	ZINC000875189057	DC	On-Demand	Anodyne	NOS2	101	37
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875189060	DC	On-Demand	Anodyne	NOS2	101	37
O=C(NCc1ccnc(-n2ccnc2)c1)NCC1CC(O)C1	ZINC000875189063	DC	On-Demand	Anodyne	NOS2	101	37
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H]1CO[C@H](C2CC2)C1	ZINC000875189064	ED	On-Demand	Anodyne	NOS2	101	38
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1CO[C@H](C2CC2)C1	ZINC000875189067	ED	On-Demand	Anodyne	NOS2	101	38
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H]1CO[C@@H](C2CC2)C1	ZINC000875189069	ED	On-Demand	Anodyne	NOS2	101	38
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1CO[C@@H](C2CC2)C1	ZINC000875189070	ED	On-Demand	Anodyne	NOS2	101	38
C#CC[C@@H](CCOC)NC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875189074	ED	On-Demand	Mild	NOS2	96	38
C#CC[C@H](CCOC)NC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875189076	ED	On-Demand	Mild	NOS2	96	38
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(C(=O)CC(C)C)CC1	ZINC000875189080	ED	On-Demand	Anodyne	RIR1_HHV11	70	40
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(C(=O)CC(C)C)CC1	ZINC000875189080	ED	On-Demand	Anodyne	EPHX2	23	48
O=C(NCCCCC1CC1)C(=O)NCCCc1cccc(F)c1	ZINC000875189087	DF	On-Demand	Anodyne	MTNR1A	18	40
O=C(NCCCCC1CC1)C(=O)NCCCc1cccc(F)c1	ZINC000875189087	DF	On-Demand	Anodyne	MTNR1B	18	40
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1Cc2cncn2C1	ZINC000875189089	DC	On-Demand	Anodyne	NOS2	92	36
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H]1Cc2cncn2C1	ZINC000875189091	DC	On-Demand	Anodyne	NOS2	92	36
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875189092	GG	On-Demand	Anodyne	NOS2	96	35
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1C[C@@H]2CCC[C@H]2O1	ZINC000875189100	EE	On-Demand	Anodyne	NOS2	99	38
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1C[C@@H]2CCC[C@@H]2O1	ZINC000875189105	EE	On-Demand	Anodyne	NOS2	99	38
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1C[C@H]2CCC[C@H]2O1	ZINC000875189107	EE	On-Demand	Anodyne	NOS2	99	38
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1C[C@H]2CCC[C@@H]2O1	ZINC000875189109	EE	On-Demand	Anodyne	NOS2	99	38
O=C(NCCC[C@H]1C=CCC1)NCc1ccnc(-n2ccnc2)c1	ZINC000875189121	EF	On-Demand	Anodyne	NOS2	96	36
O=C(NCCC[C@@H]1C=CCC1)NCc1ccnc(-n2ccnc2)c1	ZINC000875189123	EF	On-Demand	Anodyne	NOS2	96	36
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875189125	GE	On-Demand	Anodyne	NOS2	98	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875189128	GE	On-Demand	Anodyne	NOS2	98	41
C[C@H]1CCC[C@@H](C2CN(C(=O)NCc3ccnc(-n4ccnc4)c3)C2)C1	ZINC000875189130	FG	On-Demand	Anodyne	NOS2	103	38
O=C(NC1CCN(C(=O)NCCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875189135	GG	On-Demand	Anodyne	DRD4	18	41
O=C(NC1CCN(C(=O)NCCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875189135	GG	On-Demand	Anodyne	OPRM1	48	47
O=C(NC1CCN(C(=O)NCCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875189135	GG	On-Demand	Anodyne	OPRD1	37	47
O=C(NC1CCN(C(=O)NCCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875189135	GG	On-Demand	Anodyne	GRIN2B	48	42
O=C(NC1CCN(C(=O)NCCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875189135	GG	On-Demand	Anodyne	SIGMAR1	19	45
O=C(NC1CCN(C(=O)NCCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875189135	GG	On-Demand	Anodyne	CTSB	29	53
O=C(NC1CCN(C(=O)NCCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875189135	GG	On-Demand	Anodyne	CTSK	30	53
O=C(NC1CCN(C(=O)NCCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875189135	GG	On-Demand	Anodyne	CTSL	41	53
O=C(NC1CCN(C(=O)NCCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875189135	GG	On-Demand	Anodyne	PREP	32	42
O=C(NC1CCN(C(=O)NCCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875189135	GG	On-Demand	Anodyne	CAPNS1	23	41
O=C(NC1CCN(C(=O)NCCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875189135	GG	On-Demand	Anodyne	SLC6A5	57	38
O=C(NC1CCN(C(=O)NCCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875189135	GG	On-Demand	Anodyne	CAPN1	37	43
O=C(NC1CCN(C(=O)NCCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875189135	GG	On-Demand	Anodyne	CAPN2	70	43
O=C(NC1CCN(C(=O)NCCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875189135	GG	On-Demand	Anodyne	EPHX2	41	51
O=C(NC1CCN(C(=O)NCCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875189135	GG	On-Demand	Anodyne	TGM2	50	45
O=C(NC1CCN(C(=O)NCCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875189135	GG	On-Demand	Anodyne	TPSAB1	23	41
O=C(NC1CCN(C(=O)NCCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875189135	GG	On-Demand	Anodyne	F13A1	26	45
O=C(NC1CCN(C(=O)NCCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875189135	GG	On-Demand	Anodyne	NAAA	51	36
O=C(NC1CCN(C(=O)NCCc2ccc(O)cc2)CC1)OCc1ccccc1	ZINC000875189135	GG	On-Demand	Anodyne	CCR8	23	40
C[C@@H]1C[C@H](O)CCN1C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875189143	DD	On-Demand	Anodyne	NOS2	106	39
COc1cccc([C@H](CNC(=O)NCc2ccnc(-n3ccnc3)c2)OC)c1	ZINC000875189150	GE	On-Demand	Anodyne	NOS2	79	37
COc1cccc([C@H](CNC(=O)NCc2ccnc(-n3ccnc3)c2)OC)c1	ZINC000875189150	GE	On-Demand	Anodyne	ROCK2	18	42
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875189151	DD	On-Demand	Anodyne	NOS2	88	35
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000875189158	FG	On-Demand	Anodyne	NOS2	105	40
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCN(CCc2cnccn2)CC1	ZINC000875189159	GD	On-Demand	Anodyne	NOS2	97	39
O=C(NCC[C@@H]1CCCOC1)NCc1ccnc(-n2ccnc2)c1	ZINC000875189160	ED	On-Demand	Anodyne	NOS2	102	41
O=C(NCC[C@H]1CCCOC1)NCc1ccnc(-n2ccnc2)c1	ZINC000875189161	ED	On-Demand	Anodyne	NOS2	102	41
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H]1CCCn2nccc21	ZINC000875189163	ED	On-Demand	Anodyne	NOS2	106	42
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1CCCn2nccc21	ZINC000875189164	ED	On-Demand	Anodyne	NOS2	106	42
Cc1ncc([C@@H](C)NC(=O)NCc2ccnc(-n3ccnc3)c2)s1	ZINC000875189167	EF	On-Demand	Anodyne	NOS2	72	33
Cc1ncc([C@H](C)NC(=O)NCc2ccnc(-n3ccnc3)c2)s1	ZINC000875189168	EF	On-Demand	Anodyne	NOS2	72	33
CCC1(N2CCOCC2)CCN(C(=O)NCc2ccnc(-n3ccnc3)c2)CC1	ZINC000875189169	GE	On-Demand	Anodyne	NOS2	101	38
CN1Cc2ccccc2[C@H]1CNC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875189170	FE	On-Demand	Anodyne	NOS2	101	37
CN1Cc2ccccc2[C@@H]1CNC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875189171	FE	On-Demand	Anodyne	NOS2	101	37
CO[C@H]1CCN([C@@H]2CCC[C@@H]2N(C)C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000875189173	GE	On-Demand	Anodyne	NOS2	105	39
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1CCO[C@H]1c1ccccc1	ZINC000875189174	GF	On-Demand	Anodyne	NOS2	106	39
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875189187	GD	On-Demand	Anodyne	NOS2	104	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875189190	ED	On-Demand	Anodyne	NOS2	105	39
C[C@H](O)c1ccc(CNC(=O)NCc2cccnc2O)cc1	ZINC000875189221	DD	On-Demand	Anodyne	TRPV1	16	40
CO[C@@H]1C[C@@H]2CN(C(=O)NCc3ccc([C@@H](C)O)cc3)Cc3cccnc3N2C1	ZINC000875189224	GE	On-Demand	Anodyne	NAMPT	22	41
CO[C@@H]1C[C@@H]2CN(C(=O)NCc3ccc([C@H](C)O)cc3)Cc3cccnc3N2C1	ZINC000875189226	GE	On-Demand	Anodyne	NAMPT	22	41
O=C(NCCc1ccc(O)cc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875189232	EF	On-Demand	Anodyne	F2	34	43
O=C(NCCc1ccc(O)cc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875189232	EF	On-Demand	Anodyne	ACE	38	42
O=C(NCCc1ccc(O)cc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875189232	EF	On-Demand	Anodyne	OPRM1	38	47
O=C(NCCc1ccc(O)cc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875189232	EF	On-Demand	Anodyne	OPRD1	20	40
O=C(NCCc1ccc(O)cc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875189232	EF	On-Demand	Anodyne	PREP	57	38
O=C(NCCc1ccc(O)cc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875189232	EF	On-Demand	Anodyne	XIAP	35	40
O=C(NCCc1ccc(O)cc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875189232	EF	On-Demand	Anodyne	TMPRSS11D	41	34
O=C(NCCc1ccc(O)cc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875189233	EF	On-Demand	Anodyne	F2	34	43
O=C(NCCc1ccc(O)cc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875189233	EF	On-Demand	Anodyne	ACE	38	42
O=C(NCCc1ccc(O)cc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875189233	EF	On-Demand	Anodyne	OPRM1	38	47
O=C(NCCc1ccc(O)cc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875189233	EF	On-Demand	Anodyne	OPRD1	20	40
O=C(NCCc1ccc(O)cc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875189233	EF	On-Demand	Anodyne	PREP	57	38
O=C(NCCc1ccc(O)cc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875189233	EF	On-Demand	Anodyne	XIAP	35	40
O=C(NCCc1ccc(O)cc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875189233	EF	On-Demand	Anodyne	TMPRSS11D	41	34
O=C(NCCc1ccc(O)cc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875189234	EF	On-Demand	Anodyne	F2	34	43
O=C(NCCc1ccc(O)cc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875189234	EF	On-Demand	Anodyne	ACE	38	42
O=C(NCCc1ccc(O)cc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875189234	EF	On-Demand	Anodyne	OPRM1	38	47
O=C(NCCc1ccc(O)cc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875189234	EF	On-Demand	Anodyne	OPRD1	20	40
O=C(NCCc1ccc(O)cc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875189234	EF	On-Demand	Anodyne	PREP	57	38
O=C(NCCc1ccc(O)cc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875189234	EF	On-Demand	Anodyne	XIAP	35	40
O=C(NCCc1ccc(O)cc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875189234	EF	On-Demand	Anodyne	TMPRSS11D	41	34
O=C(NCCc1ccc(O)cc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875189235	EF	On-Demand	Anodyne	F2	34	43
O=C(NCCc1ccc(O)cc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875189235	EF	On-Demand	Anodyne	ACE	38	42
O=C(NCCc1ccc(O)cc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875189235	EF	On-Demand	Anodyne	OPRM1	38	47
O=C(NCCc1ccc(O)cc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875189235	EF	On-Demand	Anodyne	OPRD1	20	40
O=C(NCCc1ccc(O)cc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875189235	EF	On-Demand	Anodyne	PREP	57	38
O=C(NCCc1ccc(O)cc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875189235	EF	On-Demand	Anodyne	XIAP	35	40
O=C(NCCc1ccc(O)cc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875189235	EF	On-Demand	Anodyne	TMPRSS11D	41	34
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC(Cc2nccs2)CC1	ZINC000875189240	GF	On-Demand	Anodyne	NOS2	102	39
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1CCO[C@H]1c1ccc(F)cc1	ZINC000875189252	GF	On-Demand	Anodyne	NOS2	98	36
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H](C1CCC1)[C@H]1CCCO1	ZINC000875189253	FE	On-Demand	Anodyne	NOS2	99	38
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H](C1CCC1)[C@@H]1CCCO1	ZINC000875189254	FE	On-Demand	Anodyne	NOS2	99	38
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H](C1CCC1)[C@H]1CCCO1	ZINC000875189256	FE	On-Demand	Anodyne	NOS2	99	38
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H](C1CCC1)[C@@H]1CCCO1	ZINC000875189258	FE	On-Demand	Anodyne	NOS2	99	38
COc1ccc([C@@H]2CN(C(=O)NCc3ccnc(-n4ccnc4)c3)CCO2)cc1	ZINC000875189260	GF	On-Demand	Anodyne	NOS2	118	46
CC(C)c1noc(CCCNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)n1	ZINC000875189268	GG	On-Demand	Anodyne	CPT1A	53	33
COc1ccc([C@@H]2CN(C(=O)NCc3ccc([C@@H](C)O)cc3)CCO2)cc1	ZINC000875189269	FG	On-Demand	Anodyne	MMP13	18	42
COc1ccc([C@@H]2CN(C(=O)NCc3ccc([C@@H](C)O)cc3)CCO2)cc1	ZINC000875189269	FG	On-Demand	Anodyne	MMP3	17	42
COc1ccc([C@@H]2CN(C(=O)NCc3ccc([C@@H](C)O)cc3)CCO2)cc1	ZINC000875189269	FG	On-Demand	Anodyne	MMP1	17	42
CC(C)c1noc(CCCNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)n1	ZINC000875189270	GG	On-Demand	Anodyne	CPT1A	53	33
COc1ccc([C@@H]2CN(C(=O)NCc3ccc([C@H](C)O)cc3)CCO2)cc1	ZINC000875189271	FG	On-Demand	Anodyne	MMP13	18	42
COc1ccc([C@@H]2CN(C(=O)NCc3ccc([C@H](C)O)cc3)CCO2)cc1	ZINC000875189271	FG	On-Demand	Anodyne	MMP3	17	42
COc1ccc([C@@H]2CN(C(=O)NCc3ccc([C@H](C)O)cc3)CCO2)cc1	ZINC000875189271	FG	On-Demand	Anodyne	MMP1	17	42
CC(C)c1noc(CCCNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)n1	ZINC000875189272	GG	On-Demand	Anodyne	CPT1A	53	33
CC(C)c1noc(CCCNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)n1	ZINC000875189274	GG	On-Demand	Anodyne	CPT1A	53	33
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCc2nc(C3CC3)ncc2C1	ZINC000875189275	GE	On-Demand	Anodyne	NOS2	105	40
CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1CN2C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875189278	GE	On-Demand	Anodyne	NOS2	99	37
COC(=O)[C@@]1(C)CN(C(=O)NCc2ccnc(-n3ccnc3)c2)C[C@@H]1C	ZINC000875189298	FD	On-Demand	Anodyne	NOS2	101	38
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1CC2(CCOCC2)CO1	ZINC000875189302	FD	On-Demand	Anodyne	NOS2	97	39
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@H]1CC2(CCOCC2)CO1	ZINC000875189305	FD	On-Demand	Anodyne	NOS2	97	39
CC(=O)C1CCN(C(=O)NCc2ccnc(-n3ccnc3)c2)CC1	ZINC000875189308	ED	On-Demand	Anodyne	NOS2	110	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCO[C@@H](CCF)C1	ZINC000875189310	ED	On-Demand	Anodyne	NOS2	114	44
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCO[C@H](CCF)C1	ZINC000875189313	ED	On-Demand	Anodyne	NOS2	114	44
O=C(NCCOC(F)(F)C(F)(F)F)NCc1ccnc(-n2ccnc2)c1	ZINC000875189315	GE	On-Demand	Anodyne	NOS2	83	33
C[C@@](CO)(Cc1ccc(F)cc1)NC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875189320	GE	On-Demand	Anodyne	NOS2	93	34
O=C(NCc1ccnc(-n2ccnc2)c1)N1C[C@@H](CO)[C@H](C(F)(F)F)C1	ZINC000875189335	FD	On-Demand	Anodyne	NOS2	95	40
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H](CCc1ccccc1)C(F)F	ZINC000875189338	GG	On-Demand	Anodyne	NOS2	89	37
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H](CCc1ccccc1)C(F)F	ZINC000875189351	GG	On-Demand	Anodyne	NOS2	89	37
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1CCO[C@H]1c1ccncc1	ZINC000875189354	FD	On-Demand	Anodyne	NOS2	104	39
CC1(C)CCC[C@@](O)(CNC(=O)NCc2ccnc(-n3ccnc3)c2)CC1	ZINC000875189357	FF	On-Demand	Anodyne	NOS2	100	38
CC1(C)CCC[C@](O)(CNC(=O)NCc2ccnc(-n3ccnc3)c2)CC1	ZINC000875189360	FF	On-Demand	Anodyne	NOS2	100	38
C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCCN2C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000875189364	GG	On-Demand	Anodyne	NOS2	100	40
C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCCN2C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000875189366	GG	On-Demand	Anodyne	NOS2	100	40
C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCCN2C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000875189368	GG	On-Demand	Anodyne	NOS2	100	40
C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCCN2C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000875189369	GG	On-Demand	Anodyne	NOS2	100	40
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC[C@H](c2ccc(F)c(F)c2)C1	ZINC000875189372	GH	On-Demand	Anodyne	NOS2	108	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC[C@@H](c2ccc(F)c(F)c2)C1	ZINC000875189381	GH	On-Demand	Anodyne	NOS2	108	41
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NC[C@@H](C)Cn1ccnc1C)CC2	ZINC000875189385	GG	On-Demand	Anodyne	SLC18A2	47	35
C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875189386	ED	On-Demand	Anodyne	NOS2	100	37
C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875189390	ED	On-Demand	Anodyne	NOS2	100	37
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875189392	ED	On-Demand	Anodyne	NOS2	100	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NC[C@H](C)Cn1ccnc1C)CC2	ZINC000875189393	GG	On-Demand	Anodyne	SLC18A2	47	35
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NC[C@@H](C)Cn1ccnc1C)CC2	ZINC000875189395	GG	On-Demand	Anodyne	SLC18A2	47	35
C[C@]1(NC(=O)C(F)(F)F)CCN(C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000875189396	GD	On-Demand	Anodyne	NOS2	98	37
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NC[C@H](C)Cn1ccnc1C)CC2	ZINC000875189397	GG	On-Demand	Anodyne	SLC18A2	47	35
CC(=O)C1CCN(C(=O)C(=O)NCCCc2cccc(F)c2)CC1	ZINC000875189402	ED	On-Demand	Anodyne	MTNR1A	20	40
CC(=O)C1CCN(C(=O)C(=O)NCCCc2cccc(F)c2)CC1	ZINC000875189402	ED	On-Demand	Anodyne	MTNR1B	22	40
CC(=O)C1CCN(C(=O)C(=O)NCCCc2cccc(F)c2)CC1	ZINC000875189402	ED	On-Demand	Anodyne	CACNA1G	25	43
N#Cc1ccc(N2CCN(C(=O)NCCc3ccc(O)cc3)CC2)cn1	ZINC000875189404	FD	On-Demand	Mild	CTSK	27	45
N#Cc1ccc(N2CCN(C(=O)NCCc3ccc(O)cc3)CC2)cn1	ZINC000875189404	FD	On-Demand	Mild	CTSL	18	45
N#Cc1ccc(N2CCN(C(=O)NCCc3ccc(O)cc3)CC2)cn1	ZINC000875189404	FD	On-Demand	Mild	GPBAR1	26	43
Cc1nccnc1[C@@H](C)NC(=O)NCCc1ccc(O)cc1	ZINC000875189415	DE	On-Demand	Anodyne	GRIA1	41	32
Cc1nccnc1[C@H](C)NC(=O)NCCc1ccc(O)cc1	ZINC000875189417	DE	On-Demand	Anodyne	GRIA1	41	32
O=C(NCCc1ccc(O)cc1)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875189419	DE	On-Demand	Anodyne	YARS	41	33
O=C(NCCc1ccc(O)cc1)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875189420	DE	On-Demand	Anodyne	YARS	41	33
Cn1ccnc1[C@@H]1OCCC[C@H]1CNC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875189421	GD	On-Demand	Anodyne	NOS2	97	35
O=C(NCCc1ccc(O)cc1)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875189422	DE	On-Demand	Anodyne	YARS	41	33
O=C(NCCc1ccc(O)cc1)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875189423	DE	On-Demand	Anodyne	YARS	41	33
O=C(NCCc1ccc(O)cc1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875189427	EG	On-Demand	Anodyne	GHRHR	31	42
O=C(NCCc1ccc(O)cc1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875189429	EG	On-Demand	Anodyne	GHRHR	31	42
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1[C@H]2C[C@@H]3CO[C@@H]1[C@H]3C2	ZINC000875189432	ED	On-Demand	Anodyne	NOS2	105	39
C[C@@H](CN(C)C(=O)NCCc1ccc(O)cc1)NC(=O)OC(C)(C)C	ZINC000875189433	FE	On-Demand	Anodyne	PAPA1_CARPA	32	45
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1[C@H]2C[C@@H]3CO[C@H]1[C@H]3C2	ZINC000875189434	ED	On-Demand	Anodyne	NOS2	105	39
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1[C@@H]2C[C@@H]3[C@@H]1OC[C@@H]3C2	ZINC000875189436	ED	On-Demand	Anodyne	NOS2	105	39
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1[C@@H]2C[C@H]3[C@H](CO[C@H]31)C2	ZINC000875189438	ED	On-Demand	Anodyne	NOS2	105	39
COc1cccc([C@H](O)C2CCN(C(=O)NCCc3ccc(O)cc3)CC2)c1	ZINC000875189441	GG	On-Demand	Anodyne	ADRB1	36	45
COc1cccc([C@H](O)C2CCN(C(=O)NCCc3ccc(O)cc3)CC2)c1	ZINC000875189441	GG	On-Demand	Anodyne	DRD4	43	33
COc1cccc([C@H](O)C2CCN(C(=O)NCCc3ccc(O)cc3)CC2)c1	ZINC000875189441	GG	On-Demand	Anodyne	OPRD1	21	46
COc1cccc([C@H](O)C2CCN(C(=O)NCCc3ccc(O)cc3)CC2)c1	ZINC000875189441	GG	On-Demand	Anodyne	ADRB3	48	45
COc1cccc([C@H](O)C2CCN(C(=O)NCCc3ccc(O)cc3)CC2)c1	ZINC000875189441	GG	On-Demand	Anodyne	MTNR1A	59	38
COc1cccc([C@H](O)C2CCN(C(=O)NCCc3ccc(O)cc3)CC2)c1	ZINC000875189441	GG	On-Demand	Anodyne	MTNR1B	56	38
O=C(NCCc1ccc(O)cc1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875189444	FF	On-Demand	Anodyne	GPBAR1	19	41
C[C@@H]1CN(C(=O)NCc2ccnc(-n3ccnc3)c2)CC[C@@H](C(F)(F)F)O1	ZINC000875189449	GF	On-Demand	Anodyne	NOS2	107	40
C[C@@H]1CN(C(=O)NCc2ccnc(-n3ccnc3)c2)CC[C@H](C(F)(F)F)O1	ZINC000875189452	GF	On-Demand	Anodyne	NOS2	107	40
CCOC[C@H]1CN(C(=O)NCc2ccnc(-n3ccnc3)c2)CCO1	ZINC000875189459	ED	On-Demand	Anodyne	NOS2	113	42
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875189461	GF	On-Demand	Anodyne	NOS2	103	39
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875189461	GF	On-Demand	Anodyne	EPHX2	22	47
O=C1CCN(C(=O)NCc2ccnc(-n3ccnc3)c2)CCCCCCN1	ZINC000875189473	FD	On-Demand	Anodyne	NOS2	102	39
C[C@]1(C(F)(F)F)CN(C(=O)NCc2ccnc(-n3ccnc3)c2)CCO1	ZINC000875189477	FE	On-Demand	Anodyne	NOS2	104	39
C[C@@H](NC(=O)NCCc1ccc(O)cc1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875189486	FE	On-Demand	Anodyne	GPR119	22	40
O=C(NCc1ccnc(-n2ccnc2)c1)NCC1CCC2(CC1)CC2	ZINC000875189525	EG	On-Demand	Anodyne	NOS2	101	38
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875189535	FE	On-Demand	Anodyne	NOS2	101	40
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875189535	FE	On-Demand	Anodyne	MAPK1	43	31
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875189537	FE	On-Demand	Anodyne	NOS2	101	40
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875189537	FE	On-Demand	Anodyne	MAPK1	43	31
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875189540	FE	On-Demand	Anodyne	NOS2	101	40
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875189540	FE	On-Demand	Anodyne	MAPK1	43	31
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875189542	FE	On-Demand	Anodyne	NOS2	101	40
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875189542	FE	On-Demand	Anodyne	MAPK1	43	31
C[C@@H]1CN(C(=O)NCc2ccnc(-n3ccnc3)c2)C[C@@H](C)C1(F)F	ZINC000875189546	EF	On-Demand	Anodyne	NOS2	105	41
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H]1[C@@H]2c3cccc(Cl)c3C[C@H]21	ZINC000875189548	GG	On-Demand	Anodyne	NOS2	84	34
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1[C@@H]2Cc3c(Cl)cccc3[C@@H]21	ZINC000875189549	GG	On-Demand	Anodyne	NOS2	84	34
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1[C@H]2Cc3c(Cl)cccc3[C@H]21	ZINC000875189550	GG	On-Demand	Anodyne	NOS2	84	34
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1[C@H]2Cc3c(Cl)cccc3[C@@H]21	ZINC000875189551	GG	On-Demand	Anodyne	NOS2	84	34
O=C(NCc1ccnc(-n2ccnc2)c1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875189554	GE	On-Demand	Anodyne	NOS2	107	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@H](O)[C@H]2CCCC[C@H]21	ZINC000875189557	FE	On-Demand	Anodyne	NOS2	105	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@H](O)[C@@H]2CCCC[C@@H]21	ZINC000875189558	FE	On-Demand	Anodyne	NOS2	105	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@H](O)[C@H]2CCCC[C@@H]21	ZINC000875189559	FE	On-Demand	Anodyne	NOS2	105	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@H](O)[C@@H]2CCCC[C@H]21	ZINC000875189560	FE	On-Demand	Anodyne	NOS2	105	41
COc1ccc(N2CCN(C(=O)NCc3ccc([C@H](C)O)cc3)CC2)c(OC)c1	ZINC000875189566	GF	On-Demand	Clean	HTR1A	36	43
COc1ccc(N2CCN(C(=O)NCc3ccc([C@H](C)O)cc3)CC2)c(OC)c1	ZINC000875189566	GF	On-Demand	Clean	DRD2	33	44
COc1ccc(N2CCN(C(=O)NCc3ccc([C@H](C)O)cc3)CC2)c(OC)c1	ZINC000875189566	GF	On-Demand	Clean	DRD4	41	32
COc1ccc(N2CCN(C(=O)NCc3ccc([C@H](C)O)cc3)CC2)c(OC)c1	ZINC000875189566	GF	On-Demand	Clean	DRD3	43	42
COc1ccc(N2CCN(C(=O)NCc3ccc([C@H](C)O)cc3)CC2)c(OC)c1	ZINC000875189566	GF	On-Demand	Clean	PDGFRB	42	39
COc1ccc(N2CCN(C(=O)NCc3ccc([C@H](C)O)cc3)CC2)c(OC)c1	ZINC000875189566	GF	On-Demand	Clean	HTR7	31	43
COc1ccc(N2CCN(C(=O)NCc3ccc([C@@H](C)O)cc3)CC2)c(OC)c1	ZINC000875189568	GF	On-Demand	Clean	HTR1A	36	43
COc1ccc(N2CCN(C(=O)NCc3ccc([C@@H](C)O)cc3)CC2)c(OC)c1	ZINC000875189568	GF	On-Demand	Clean	DRD2	33	44
COc1ccc(N2CCN(C(=O)NCc3ccc([C@@H](C)O)cc3)CC2)c(OC)c1	ZINC000875189568	GF	On-Demand	Clean	DRD4	41	32
COc1ccc(N2CCN(C(=O)NCc3ccc([C@@H](C)O)cc3)CC2)c(OC)c1	ZINC000875189568	GF	On-Demand	Clean	DRD3	43	42
COc1ccc(N2CCN(C(=O)NCc3ccc([C@@H](C)O)cc3)CC2)c(OC)c1	ZINC000875189568	GF	On-Demand	Clean	PDGFRB	42	39
COc1ccc(N2CCN(C(=O)NCc3ccc([C@@H](C)O)cc3)CC2)c(OC)c1	ZINC000875189568	GF	On-Demand	Clean	HTR7	31	43
O=C(NCC[C@@H]1CCCS1)NCc1ccnc(-n2ccnc2)c1	ZINC000875189571	EE	On-Demand	Anodyne	NOS2	99	38
O=C(NCC[C@H]1CCCS1)NCc1ccnc(-n2ccnc2)c1	ZINC000875189573	EE	On-Demand	Anodyne	NOS2	99	38
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1C[C@H]1C1CCOCC1	ZINC000875189575	ED	On-Demand	Anodyne	NOS2	100	38
COc1cccc([C@H](O)C2CCN(C(=O)NCc3ccc([C@H](C)O)cc3)CC2)c1	ZINC000875189580	GG	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@H](O)C2CCN(C(=O)NCc3ccc([C@H](C)O)cc3)CC2)c1	ZINC000875189580	GG	On-Demand	Anodyne	OPRD1	15	49
O=C(NCC[C@@H]1CCSC1)NCc1ccnc(-n2ccnc2)c1	ZINC000875189581	EE	On-Demand	Anodyne	NOS2	97	36
COc1cccc([C@H](O)C2CCN(C(=O)NCc3ccc([C@@H](C)O)cc3)CC2)c1	ZINC000875189582	GG	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@H](O)C2CCN(C(=O)NCc3ccc([C@@H](C)O)cc3)CC2)c1	ZINC000875189582	GG	On-Demand	Anodyne	OPRD1	15	49
O=C(NCC[C@H]1CCSC1)NCc1ccnc(-n2ccnc2)c1	ZINC000875189583	EE	On-Demand	Anodyne	NOS2	97	36
CCC[C@@H](CNC(=O)NCc1ccnc(-n2ccnc2)c1)OCC	ZINC000875189588	EE	On-Demand	Anodyne	NOS2	89	37
CCC[C@H](CNC(=O)NCc1ccnc(-n2ccnc2)c1)OCC	ZINC000875189589	EE	On-Demand	Anodyne	NOS2	89	37
COCC(C)(C)CCNC(=O)C(=O)NCCCc1cccc(F)c1	ZINC000875189597	EE	On-Demand	Anodyne	MTNR1B	15	44
COCC(C)(C)CCNC(=O)C(=O)NCCCc1cccc(F)c1	ZINC000875189597	EE	On-Demand	Anodyne	CRTM	30	40
COc1ccc([C@@H]2CCN(C(=O)NCc3ccnc(-n4ccnc4)c3)C2)cc1F	ZINC000875189601	GG	On-Demand	Anodyne	NOS2	104	40
CC[C@@H](NC(=O)NCc1ccc([C@H](C)O)cc1)c1cccc(OC)c1OC	ZINC000875189620	FH	On-Demand	Anodyne	PDS	40	34
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@H]1CCN1C1CCCCC1	ZINC000875189624	FE	On-Demand	Anodyne	NOS2	105	42
CC[C@@H](NC(=O)NCc1ccc([C@@H](C)O)cc1)c1cccc(OC)c1OC	ZINC000875189626	FH	On-Demand	Anodyne	PDS	40	34
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1CCN1C1CCCCC1	ZINC000875189627	FE	On-Demand	Anodyne	NOS2	105	42
C[C@H](O)c1ccc(CNC(=O)N(C)[C@H]2CCCCN(C)C2=O)cc1	ZINC000875189629	ED	On-Demand	Anodyne	CCR5	18	49
CCC1(N2CCCC2)CCN(C(=O)NCc2ccnc(-n3ccnc3)c2)CC1	ZINC000875189630	GF	On-Demand	Anodyne	NOS2	100	37
C[C@H](O)c1ccc(CNC(=O)N(C)[C@@H]2CCCCN(C)C2=O)cc1	ZINC000875189634	ED	On-Demand	Anodyne	CCR5	18	49
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC(OCC(F)F)C1	ZINC000875189654	ED	On-Demand	Anodyne	NOS2	100	40
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H]1CCCC[C@H]1F	ZINC000875189659	DE	On-Demand	Anodyne	NOS2	101	40
CC[C@@H](NC(=O)NCCc1ccc(O)cc1)[C@@H](O)c1ccccc1	ZINC000875189662	EF	On-Demand	Anodyne	ADRB2	17	45
CC[C@@H](NC(=O)NCCc1ccc(O)cc1)[C@@H](O)c1ccccc1	ZINC000875189662	EF	On-Demand	Anodyne	OPRM1	15	40
CC[C@@H](NC(=O)NCCc1ccc(O)cc1)[C@@H](O)c1ccccc1	ZINC000875189662	EF	On-Demand	Anodyne	ADRB3	38	45
CC[C@@H](NC(=O)NCCc1ccc(O)cc1)[C@@H](O)c1ccccc1	ZINC000875189662	EF	On-Demand	Anodyne	NPY1R	18	40
CC[C@@H](NC(=O)NCCc1ccc(O)cc1)[C@@H](O)c1ccccc1	ZINC000875189662	EF	On-Demand	Anodyne	GRIA1	46	38
CC[C@@H](NC(=O)NCCc1ccc(O)cc1)[C@@H](O)c1ccccc1	ZINC000875189662	EF	On-Demand	Anodyne	CAPN2	23	42
CC[C@@H](NC(=O)NCCc1ccc(O)cc1)[C@H](O)c1ccccc1	ZINC000875189665	EF	On-Demand	Anodyne	ADRB2	17	45
CC[C@@H](NC(=O)NCCc1ccc(O)cc1)[C@H](O)c1ccccc1	ZINC000875189665	EF	On-Demand	Anodyne	OPRM1	15	40
CC[C@@H](NC(=O)NCCc1ccc(O)cc1)[C@H](O)c1ccccc1	ZINC000875189665	EF	On-Demand	Anodyne	ADRB3	38	45
CC[C@@H](NC(=O)NCCc1ccc(O)cc1)[C@H](O)c1ccccc1	ZINC000875189665	EF	On-Demand	Anodyne	NPY1R	18	40
CC[C@@H](NC(=O)NCCc1ccc(O)cc1)[C@H](O)c1ccccc1	ZINC000875189665	EF	On-Demand	Anodyne	GRIA1	46	38
CC[C@@H](NC(=O)NCCc1ccc(O)cc1)[C@H](O)c1ccccc1	ZINC000875189665	EF	On-Demand	Anodyne	CAPN2	23	42
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H]1CCC[C@@H]1O	ZINC000875189678	DC	On-Demand	Anodyne	NOS2	103	40
CO[C@H]1CCN([C@@H]2CCC[C@@H]2NC(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000875189682	GD	On-Demand	Anodyne	NOS2	99	39
C[C@@H]1CC(F)(F)CCN1C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875189684	EF	On-Demand	Anodyne	NOS2	104	37
C[C@H]1CC(F)(F)CCN1C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875189686	EF	On-Demand	Anodyne	NOS2	104	37
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1CCC12CCOCC2	ZINC000875189688	FE	On-Demand	Anodyne	NOS2	101	38
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@H]1CCC12CCOCC2	ZINC000875189690	FE	On-Demand	Anodyne	NOS2	101	38
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875189695	GF	On-Demand	Anodyne	NOS2	92	35
COC(=O)[C@@H]1CN(C(=O)NCc2ccnc(-n3ccnc3)c2)C[C@@H](C)O1	ZINC000875189697	FC	On-Demand	Anodyne	NOS2	109	43
O=C(NCc1ccnc(-n2ccnc2)c1)NCC1CC=CC1	ZINC000875189698	CE	On-Demand	Anodyne	NOS2	104	39
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1CCN1C1CCCC1	ZINC000875189699	FE	On-Demand	Anodyne	NOS2	107	42
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@H]1CCN1C1CCCC1	ZINC000875189700	FE	On-Demand	Anodyne	NOS2	107	42
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875189702	ED	On-Demand	Anodyne	NOS2	101	37
CC(=O)[C@H]1CCCN(C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000875189704	ED	On-Demand	Anodyne	NOS2	112	41
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000875189705	ED	On-Demand	Anodyne	NOS2	112	41
C[C@H](O)c1ccc(CNC(=O)NC2CCN(c3ccccc3C#N)CC2)cc1	ZINC000875189708	GG	On-Demand	Mild	EPHX2	17	40
CCC1(CC)CCCN1C(=O)NC1CCN(C(=O)CC(C)C)CC1	ZINC000875189721	EG	On-Demand	Anodyne	EPHX2	18	43
CCC[C@@H](CCO)NC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875189727	DD	On-Demand	Anodyne	NOS2	93	35
CCC[C@H](CCO)NC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875189728	DD	On-Demand	Anodyne	NOS2	93	35
O=C(NCCc1ccc(O)cc1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875189733	FG	On-Demand	Anodyne	SMO	42	46
O=C(NCCc1ccc(O)cc1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875189733	FG	On-Demand	Anodyne	ETHR	64	48
CC(=O)Nc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)ccc1F	ZINC000875189749	HH	On-Demand	Bother	NPY2R	46	34
CC(=O)Nc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)ccc1F	ZINC000875189749	HH	On-Demand	Bother	SLC6A9	17	55
CC(=O)Nc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)ccc1F	ZINC000875189749	HH	On-Demand	Bother	TAAR1	30	42
CC(=O)Nc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)ccc1F	ZINC000875189749	HH	On-Demand	Bother	WDR5	43	49
CN(CCNC(=O)NCc1nc(O)c2c(n1)CCOC2)C1CCCCC1	ZINC000875189751	FD	On-Demand	Anodyne	WNT3A	40	32
CCn1ncc(CNC(=O)NCCc2ccc(O)cc2)n1	ZINC000875189764	CD	On-Demand	Anodyne	GRIA1	40	32
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCc2cccc(F)c2)C1	ZINC000875189805	ED	On-Demand	Anodyne	CACNA1G	21	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCc2cccc(F)c2)C1	ZINC000875189807	ED	On-Demand	Anodyne	CACNA1G	21	41
C[C@H](O)c1ccc(CNC(=O)N2CC[C@@H](c3ccc(O)cc3)C2)cc1	ZINC000875189816	EG	On-Demand	Anodyne	CCR1	30	41
C[C@H](O)c1ccc(CNC(=O)N2CC[C@H](c3ccc(O)cc3)C2)cc1	ZINC000875189818	EG	On-Demand	Anodyne	CCR1	30	41
O=C(NCc1ccnc(-n2ccnc2)c1)NCC1(C(F)(F)F)CCCC1	ZINC000875189824	FG	On-Demand	Anodyne	NOS2	96	36
C[C@H](O)c1ccc(CNC(=O)N[C@@H]2CCN(C3CCC3)C2=O)cc1	ZINC000875189827	ED	On-Demand	Anodyne	XIAP	38	41
C[C@H](O)c1ccc(CNC(=O)N[C@@H]2CCN(C3CCC3)C2=O)cc1	ZINC000875189827	ED	On-Demand	Anodyne	BIRC2	57	38
C[C@H](O)c1ccc(CNC(=O)N[C@H]2CCN(C3CCC3)C2=O)cc1	ZINC000875189828	ED	On-Demand	Anodyne	XIAP	38	41
C[C@H](O)c1ccc(CNC(=O)N[C@H]2CCN(C3CCC3)C2=O)cc1	ZINC000875189828	ED	On-Demand	Anodyne	BIRC2	57	38
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCCC(F)(F)CC1	ZINC000875189847	EF	On-Demand	Anodyne	NOS2	102	39
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1CC[C@@H]2C[C@@H]2C1	ZINC000875189849	EF	On-Demand	Anodyne	NOS2	104	39
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1CC[C@@H]2C[C@H]2C1	ZINC000875189851	EF	On-Demand	Anodyne	NOS2	104	39
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1CC[C@H]2C[C@@H]2C1	ZINC000875189853	EF	On-Demand	Anodyne	NOS2	104	39
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@](O)(c3ccccc3)C2)cc1	ZINC000875189854	FF	On-Demand	Anodyne	OPRL1	19	42
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@](O)(c3ccccc3)C2)cc1	ZINC000875189854	FF	On-Demand	Anodyne	SLC12A5	52	33
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1CC[C@H]2C[C@H]2C1	ZINC000875189855	EF	On-Demand	Anodyne	NOS2	104	39
C[C@H](NC(=O)C(=O)NCCCc1cccc(F)c1)c1ccc(C(F)(F)F)nc1	ZINC000875189859	GG	On-Demand	Anodyne	TRPV1	54	40
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)cc1	ZINC000875189860	FF	On-Demand	Anodyne	OPRL1	19	42
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)cc1	ZINC000875189860	FF	On-Demand	Anodyne	SLC12A5	52	33
O=C(NCc1ccnc(-n2ccnc2)c1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875189861	FF	On-Demand	Anodyne	NOS2	104	41
O=C(NCc1ccnc(-n2ccnc2)c1)NC1([C@H]2CCCCO2)CCC1	ZINC000875189863	FF	On-Demand	Anodyne	NOS2	104	41
Cc1cncc([C@H]2CCCN2C(=O)NCc2ccnc(-n3ccnc3)c2)c1	ZINC000875189865	FG	On-Demand	Anodyne	SSTR5	23	40
Cc1cncc([C@H]2CCCN2C(=O)NCc2ccnc(-n3ccnc3)c2)c1	ZINC000875189865	FG	On-Demand	Anodyne	NOS2	103	40
Cc1cncc([C@@H]2CCCN2C(=O)NCc2ccnc(-n3ccnc3)c2)c1	ZINC000875189874	FG	On-Demand	Anodyne	SSTR5	23	40
Cc1cncc([C@@H]2CCCN2C(=O)NCc2ccnc(-n3ccnc3)c2)c1	ZINC000875189874	FG	On-Demand	Anodyne	NOS2	103	40
CN1CCN(C(=O)NCc2ccnc(-n3ccnc3)c2)CCC1(C)C	ZINC000875189877	ED	On-Demand	Anodyne	NOS2	103	40
C=CC(C)(C)CCNC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875189879	DF	On-Demand	Mild	NOS2	87	34
O=CN1CCCN(C(=O)NCc2ccnc(-n3ccnc3)c2)CC1	ZINC000875189881	EC	On-Demand	Anodyne	NOS2	109	44
O=C(NCCC[C@H]1CCOC1=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875189883	ED	On-Demand	Anodyne	NOS2	103	38
O=C(NCCC[C@@H]1CCOC1=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875189885	ED	On-Demand	Anodyne	NOS2	103	38
C/C=C/C[C@H]1CCCN(C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000875189886	EG	On-Demand	Anodyne	NOS2	107	40
C/C=C\C[C@@H]1CCCN(C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000875189887	EG	On-Demand	Anodyne	NOS2	107	40
C/C=C/C[C@@H]1CCCN(C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000875189888	EG	On-Demand	Anodyne	NOS2	107	40
C/C=C\C[C@H]1CCCN(C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000875189889	EG	On-Demand	Anodyne	NOS2	107	40
CO[C@@H]1C[C@@H](NC(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000875189894	DD	On-Demand	Anodyne	NOS2	102	39
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC(Cc2ccco2)C1	ZINC000875189905	EE	On-Demand	Anodyne	NOS2	107	43
CS[C@@H]1C[C@@H](NC(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000875189907	DD	On-Demand	Anodyne	NOS2	100	38
CC(=O)NC[C@@H]1CCCCN1C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875189909	FD	On-Demand	Anodyne	NOS2	109	45
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3ccnc(-n4ccnc4)c3)C[C@@H]1C2	ZINC000875189915	FD	On-Demand	Anodyne	NOS2	107	41
C[C@@]1(CNC(=O)NCc2ccnc(-n3ccnc3)c2)COc2ccccc2O1	ZINC000875189924	GE	On-Demand	Anodyne	NOS2	114	41
C[C@H](O)c1ccc(CNC(=O)N[C@H](C)CC2CCC2)cc1	ZINC000875189925	CG	On-Demand	Anodyne	PROC	47	36
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(C(=O)CC(C)C)CC2)C1	ZINC000875189928	FD	On-Demand	Anodyne	EPHX2	18	42
O=C(NCc1ccnc(-n2ccnc2)c1)NCC1([C@@H]2CCCCO2)CCC1	ZINC000875189931	FF	On-Demand	Anodyne	NOS2	105	41
O=C(NCc1ccnc(-n2ccnc2)c1)NCC1([C@H]2CCCCO2)CCC1	ZINC000875189933	FF	On-Demand	Anodyne	NOS2	105	41
CN(C)C[C@@H]1CN(C(=O)NCc2ccnc(-n3ccnc3)c2)C[C@H]1CN(C)C	ZINC000875189939	GD	On-Demand	Anodyne	NOS2	110	42
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875189941	EE	On-Demand	Anodyne	NOS2	90	35
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875189944	EE	On-Demand	Anodyne	NOS2	90	35
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875189946	EE	On-Demand	Anodyne	NOS2	90	35
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875189949	EE	On-Demand	Anodyne	NOS2	90	35
CN1CCO[C@H](CN(C)C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000875189964	EC	On-Demand	Anodyne	NOS2	110	44
CCOC(=O)C1=CC[C@H](NC(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000875189966	FD	On-Demand	Anodyne	NOS2	97	37
CCOC(=O)C1=CC[C@@H](NC(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000875189967	FD	On-Demand	Anodyne	NOS2	97	37
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCO[C@@H](C(F)F)CC1	ZINC000875189968	FD	On-Demand	Anodyne	NOS2	112	43
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCO[C@H](C(F)F)CC1	ZINC000875189969	FD	On-Demand	Anodyne	NOS2	112	43
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875189976	FF	On-Demand	Anodyne	NOS2	96	35
O=C(NCC[C@H]1CC=CCC1)NCc1ccnc(-n2ccnc2)c1	ZINC000875189977	EF	On-Demand	Anodyne	NOS2	97	36
O=C(NCC[C@@H]1CC=CCC1)NCc1ccnc(-n2ccnc2)c1	ZINC000875189978	EF	On-Demand	Anodyne	NOS2	97	36
CCC(CC)(CNC(=O)NCc1ccnc(-n2ccnc2)c1)C(F)(F)F	ZINC000875189981	FG	On-Demand	Anodyne	NOS2	92	35
CCO[C@@]1(C)C[C@H]1NC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875189984	DD	On-Demand	Anodyne	NOS2	103	37
O=C(NCc1ccnc(-n2ccnc2)c1)N1O[C@H]2C=C[C@H]1CC2	ZINC000875189987	DD	On-Demand	Anodyne	NOS2	103	40
CN1CCN(C2CCN(C(=O)NCCc3ccc(O)cc3)CC2)CC1	ZINC000875190032	ED	On-Demand	Anodyne	L3MBTL3	110	44
Cn1nccc1C(NC(=O)NCCc1ccc(O)cc1)c1ccnn1C	ZINC000875190048	FD	On-Demand	Anodyne	GRIA1	48	34
CC(=O)Nc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)ccc1F	ZINC000875190058	HF	On-Demand	Bother	NPY2R	41	33
CC(=O)Nc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)ccc1F	ZINC000875190058	HF	On-Demand	Bother	SLC6A9	16	57
CC(=O)Nc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)ccc1F	ZINC000875190058	HF	On-Demand	Bother	WDR5	41	48
CN(CCNC(=O)NCc1nc(-c2ccncc2)cs1)C1CCCCC1	ZINC000875190060	FG	On-Demand	Anodyne	ROCK1	22	41
CN(CCNC(=O)NCc1nc(-c2ccncc2)cs1)C1CCCCC1	ZINC000875190060	FG	On-Demand	Anodyne	ROCK2	15	41
N#Cc1ccccc1N1CCC(NC(=O)NCCc2ccc(O)cc2)CC1	ZINC000875190074	FF	On-Demand	Mild	DRD4	18	43
N#Cc1ccccc1N1CCC(NC(=O)NCCc2ccc(O)cc2)CC1	ZINC000875190074	FF	On-Demand	Mild	SLC6A5	40	34
O=C(NCCc1ccc(O)cc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875190090	EE	On-Demand	Anodyne	ADRB2	31	44
O=C(NCCc1ccc(O)cc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875190090	EE	On-Demand	Anodyne	ADRB1	57	52
O=C(NCCc1ccc(O)cc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875190090	EE	On-Demand	Anodyne	ADRB3	54	52
O=C(NCCc1ccc(O)cc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875190090	EE	On-Demand	Anodyne	SLC6A5	27	48
O=C(NCCc1ccc(O)cc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875190092	EE	On-Demand	Anodyne	ADRB2	31	44
O=C(NCCc1ccc(O)cc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875190092	EE	On-Demand	Anodyne	ADRB1	57	52
O=C(NCCc1ccc(O)cc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875190092	EE	On-Demand	Anodyne	ADRB3	54	52
O=C(NCCc1ccc(O)cc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875190092	EE	On-Demand	Anodyne	SLC6A5	27	48
CN1CCCC[C@H](N(C)C(=O)NCc2ccnc(-n3ccnc3)c2)C1=O	ZINC000875190116	FD	On-Demand	Anodyne	NOS2	110	44
CN1CCCC[C@@H](N(C)C(=O)NCc2ccnc(-n3ccnc3)c2)C1=O	ZINC000875190118	FD	On-Demand	Anodyne	NOS2	110	44
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1CCCN1CC(F)F	ZINC000875190126	FD	On-Demand	Anodyne	NOS2	106	42
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@H]1CCCN1CC(F)F	ZINC000875190129	FD	On-Demand	Anodyne	NOS2	106	42
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875190141	GG	On-Demand	Anodyne	NOS2	104	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875190144	GG	On-Demand	Anodyne	NOS2	104	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875190147	GG	On-Demand	Anodyne	NOS2	104	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875190149	GG	On-Demand	Anodyne	NOS2	104	41
CCOC(=O)[C@@H]1CN(C(=O)NCc2ccnc(-n3ccnc3)c2)CCC1(F)F	ZINC000875190153	GD	On-Demand	Anodyne	NOS2	105	40
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875190156	FE	On-Demand	Anodyne	NOS2	109	41
CCCCCCCNC(=O)C(=O)NCc1csc(CC)n1	ZINC000875190157	DE	On-Demand	Mild	ASAH1	86	40
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875190158	FE	On-Demand	Anodyne	NOS2	109	41
COCC1CC(NC(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000875190161	DD	On-Demand	Anodyne	NOS2	105	40
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC(Cc2cccs2)C1	ZINC000875190162	FF	On-Demand	Anodyne	NOS2	108	43
C=CC[C@H]1CCN(C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000875190166	DE	On-Demand	Mild	NOS2	106	41
C=CC[C@@H]1CCN(C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000875190167	DE	On-Demand	Mild	NOS2	106	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCCC2(CC1)CC2	ZINC000875190168	EF	On-Demand	Anodyne	NOS2	106	41
C[C@H](O)c1ccc(CNC(=O)N[C@@H](CO)c2cccc(C(F)(F)F)c2)cc1	ZINC000875190169	GG	On-Demand	Anodyne	TACR1	16	40
C[C@H](O)c1ccc(CNC(=O)N[C@@H](CO)c2cccc(C(F)(F)F)c2)cc1	ZINC000875190169	GG	On-Demand	Anodyne	CCR2	49	39
C[C@H](O)c1ccc(CNC(=O)N[C@@H](CO)c2cccc(C(F)(F)F)c2)cc1	ZINC000875190169	GG	On-Demand	Anodyne	PDS	49	44
CC[C@@H]1COCCN1CCNC(=O)NC1CCN(C(=O)CC(C)C)CC1	ZINC000875190172	FD	On-Demand	Anodyne	EPHX2	19	43
C[C@H](O)c1ccc(CNC(=O)N[C@H](CO)c2cccc(C(F)(F)F)c2)cc1	ZINC000875190175	GG	On-Demand	Anodyne	TACR1	16	40
C[C@H](O)c1ccc(CNC(=O)N[C@H](CO)c2cccc(C(F)(F)F)c2)cc1	ZINC000875190175	GG	On-Demand	Anodyne	CCR2	49	39
C[C@H](O)c1ccc(CNC(=O)N[C@H](CO)c2cccc(C(F)(F)F)c2)cc1	ZINC000875190175	GG	On-Demand	Anodyne	PDS	49	44
CN(C[C@@H]1C[C@H](O)C1)C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875190176	DD	On-Demand	Anodyne	NOS2	104	39
COc1ccccc1[C@H]1CN(C(=O)NCc2ccc([C@@H](C)O)cc2)CCO1	ZINC000875190183	FG	On-Demand	Anodyne	MBTPS1	43	31
CCC1(N(C)C)CCN(C(=O)NCc2ccnc(-n3ccnc3)c2)CC1	ZINC000875190186	FE	On-Demand	Anodyne	NOS2	107	40
COc1ccccc1[C@H]1CN(C(=O)NCc2ccc([C@H](C)O)cc2)CCO1	ZINC000875190187	FG	On-Demand	Anodyne	MBTPS1	43	31
COc1ccccc1[C@@H]1CN(C(=O)NCc2ccc([C@@H](C)O)cc2)CCO1	ZINC000875190188	FG	On-Demand	Anodyne	MBTPS1	43	31
COc1ccccc1[C@@H]1CN(C(=O)NCc2ccc([C@H](C)O)cc2)CCO1	ZINC000875190190	FG	On-Demand	Anodyne	MBTPS1	43	31
C[C@@]1(CNC(=O)NCc2ccnc(-n3ccnc3)c2)C[C@@H]2C[C@@H]2C1	ZINC000875190201	EF	On-Demand	Anodyne	NOS2	103	38
COc1ccccc1[C@@H]1CN(C(=O)NCc2ccnc(-n3ccnc3)c2)CCO1	ZINC000875190203	GF	On-Demand	Anodyne	NOS2	110	43
COc1ccccc1[C@H]1CN(C(=O)NCc2ccnc(-n3ccnc3)c2)CCO1	ZINC000875190205	GF	On-Demand	Anodyne	NOS2	110	43
C[C@@H]1CN(C(=O)NCc2ccnc(-n3ccnc3)c2)CC[C@H]1C(=O)OC(C)(C)C	ZINC000875190210	GF	On-Demand	Anodyne	NOS2	107	40
C[C@@H]1CN(C(=O)NCc2ccnc(-n3ccnc3)c2)CC[C@@H]1C(=O)OC(C)(C)C	ZINC000875190213	GF	On-Demand	Anodyne	NOS2	107	40
O=C(NCc1ccnc(-n2ccnc2)c1)N1C[C@H](O)C[C@H]1C1CC1	ZINC000875190214	ED	On-Demand	Anodyne	NOS2	101	37
O=C(NCc1ccnc(-n2ccnc2)c1)N1C[C@@H](O)C[C@H]1C1CC1	ZINC000875190216	ED	On-Demand	Anodyne	NOS2	101	37
O=C(NCc1ccnc(-n2ccnc2)c1)N1C[C@H](O)C[C@@H]1C1CC1	ZINC000875190217	ED	On-Demand	Anodyne	NOS2	101	37
O=C(NCc1ccnc(-n2ccnc2)c1)N1C[C@@H](O)C[C@@H]1C1CC1	ZINC000875190219	ED	On-Demand	Anodyne	NOS2	101	37
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875190222	GD	On-Demand	Anodyne	NOS2	105	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC(Oc2cccc(F)c2)CC1	ZINC000875190224	GG	On-Demand	Anodyne	NOS2	96	38
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC(Oc2cccc(F)c2)CC1	ZINC000875190224	GG	On-Demand	Anodyne	MLNR	15	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC(Oc2cccc(F)c2)CC1	ZINC000875190224	GG	On-Demand	Anodyne	EPHX2	20	42
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC(Oc2cccc(F)c2)CC1	ZINC000875190224	GG	On-Demand	Anodyne	SCD1	20	46
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875190226	FD	On-Demand	Anodyne	NOS2	93	36
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875190227	FD	On-Demand	Anodyne	NOS2	93	36
CC[C@@](C)(NC(=O)NCc1ccnc(-n2ccnc2)c1)c1ccc(F)cc1	ZINC000875190230	FH	On-Demand	Anodyne	NOS2	85	33
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1C[C@@H](Sc2ccccc2)C1	ZINC000875190232	GG	On-Demand	Anodyne	NOS2	94	37
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC(Oc2ccccc2F)CC1	ZINC000875190235	GG	On-Demand	Anodyne	NOS2	108	43
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC(Oc2ccccc2F)CC1	ZINC000875190235	GG	On-Demand	Anodyne	EPHX2	20	45
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC(Oc2ccccc2F)CC1	ZINC000875190235	GG	On-Demand	Anodyne	SCD1	42	44
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC(Oc2ccccc2F)CC1	ZINC000875190235	GG	On-Demand	Anodyne	SCD	26	41
C[C@H](NC(=O)C(=O)NCCCc1cccc(F)c1)c1ccnn1C	ZINC000875190238	ED	On-Demand	Anodyne	MTNR1A	16	40
C[C@H](NC(=O)C(=O)NCCCc1cccc(F)c1)c1ccnn1C	ZINC000875190238	ED	On-Demand	Anodyne	MTNR1B	19	40
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875190240	GF	On-Demand	Anodyne	NOS2	105	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875190241	GF	On-Demand	Anodyne	NOS2	105	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875190243	GF	On-Demand	Anodyne	NOS2	105	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875190245	GF	On-Demand	Anodyne	NOS2	105	41
C[C@H](O)c1ccc(CNC(=O)NCc2ccc(C(C)(C)C)nc2O)cc1	ZINC000875190254	FG	On-Demand	Anodyne	TRPV1	86	35
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H](c1ccccn1)C1CCC1	ZINC000875190256	FG	On-Demand	Anodyne	NOS2	98	36
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H](c1ccccn1)C1CCC1	ZINC000875190258	FG	On-Demand	Anodyne	NOS2	98	36
CN(CC1(C)COC1)C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875190259	DD	On-Demand	Anodyne	NOS2	104	38
O=C(NCc1ccnc(-n2ccnc2)c1)N1OC2CCC1CC2	ZINC000875190261	DE	On-Demand	Anodyne	NOS2	114	44
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H]1CCCC12CC2	ZINC000875190264	DE	On-Demand	Anodyne	NOS2	100	39
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1CCCC12CC2	ZINC000875190265	DE	On-Demand	Anodyne	NOS2	100	39
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1CCCC12CC2	ZINC000875190269	EF	On-Demand	Anodyne	NOS2	101	39
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@H]1CCCC12CC2	ZINC000875190270	EF	On-Demand	Anodyne	NOS2	101	39
C[C@H]1[C@H](CC(F)(F)F)C[C@@H](C)N1C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875190276	GH	On-Demand	Anodyne	NOS2	92	34
CCCOc1ccc(Cl)cc1NC(=O)[C@@H]1CNC(=O)C[C@H]1C(F)(F)F	ZINC000875190289	GG	On-Demand	Anodyne	CMA1	25	43
CCCOc1ccc(Cl)cc1NC(=O)[C@@H]1CNC(=O)C[C@@H]1C(F)(F)F	ZINC000875190290	GG	On-Demand	Anodyne	CMA1	25	43
CCCOc1ccc(Cl)cc1NC(=O)[C@H]1CNC(=O)C[C@@H]1C(F)(F)F	ZINC000875190291	GG	On-Demand	Anodyne	CMA1	25	43
CCCOc1ccc(Cl)cc1NC(=O)[C@H]1CNC(=O)C[C@H]1C(F)(F)F	ZINC000875190292	GG	On-Demand	Anodyne	CMA1	25	43
CCCCN1CCC(NC(=O)N[C@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000875190298	EG	On-Demand	Anodyne	CHRM1	24	41
CCCCN1CCC(NC(=O)N[C@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000875190298	EG	On-Demand	Anodyne	HTR4	52	38
CCCCN1CCC(NC(=O)N[C@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000875190298	EG	On-Demand	Anodyne	CHRM3	24	41
CCCCN1CCC(NC(=O)N[C@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000875190298	EG	On-Demand	Anodyne	SIGMAR1	26	42
CCCCN1CCC(NC(=O)N[C@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000875190298	EG	On-Demand	Anodyne	CCR5	47	45
CCCCN1CCC(NC(=O)N[C@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000875190298	EG	On-Demand	Anodyne	SOAT1	28	42
CCCCN1CCC(NC(=O)N[C@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000875190298	EG	On-Demand	Anodyne	CYP2J2	41	35
CCCCN1CCC(NC(=O)N[C@@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000875190299	EG	On-Demand	Anodyne	CHRM1	24	41
CCCCN1CCC(NC(=O)N[C@@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000875190299	EG	On-Demand	Anodyne	HTR4	52	38
CCCCN1CCC(NC(=O)N[C@@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000875190299	EG	On-Demand	Anodyne	CHRM3	24	41
CCCCN1CCC(NC(=O)N[C@@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000875190299	EG	On-Demand	Anodyne	SIGMAR1	26	42
CCCCN1CCC(NC(=O)N[C@@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000875190299	EG	On-Demand	Anodyne	CCR5	47	45
CCCCN1CCC(NC(=O)N[C@@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000875190299	EG	On-Demand	Anodyne	SOAT1	28	42
CCCCN1CCC(NC(=O)N[C@@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000875190299	EG	On-Demand	Anodyne	CYP2J2	41	35
CCCCN1CCC(NC(=O)N[C@@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000875190300	EG	On-Demand	Anodyne	CHRM1	24	41
CCCCN1CCC(NC(=O)N[C@@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000875190300	EG	On-Demand	Anodyne	HTR4	52	38
CCCCN1CCC(NC(=O)N[C@@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000875190300	EG	On-Demand	Anodyne	CHRM3	24	41
CCCCN1CCC(NC(=O)N[C@@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000875190300	EG	On-Demand	Anodyne	SIGMAR1	26	42
CCCCN1CCC(NC(=O)N[C@@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000875190300	EG	On-Demand	Anodyne	CCR5	47	45
CCCCN1CCC(NC(=O)N[C@@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000875190300	EG	On-Demand	Anodyne	SOAT1	28	42
CCCCN1CCC(NC(=O)N[C@@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000875190300	EG	On-Demand	Anodyne	CYP2J2	41	35
CCCCN1CCC(NC(=O)N[C@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000875190301	EG	On-Demand	Anodyne	CHRM1	24	41
CCCCN1CCC(NC(=O)N[C@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000875190301	EG	On-Demand	Anodyne	HTR4	52	38
CCCCN1CCC(NC(=O)N[C@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000875190301	EG	On-Demand	Anodyne	CHRM3	24	41
CCCCN1CCC(NC(=O)N[C@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000875190301	EG	On-Demand	Anodyne	SIGMAR1	26	42
CCCCN1CCC(NC(=O)N[C@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000875190301	EG	On-Demand	Anodyne	CCR5	47	45
CCCCN1CCC(NC(=O)N[C@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000875190301	EG	On-Demand	Anodyne	SOAT1	28	42
CCCCN1CCC(NC(=O)N[C@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000875190301	EG	On-Demand	Anodyne	CYP2J2	41	35
Cc1ccnn1CC(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1	ZINC000875190303	FE	On-Demand	Anodyne	LPL	54	45
Cc1ccnn1CC(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1	ZINC000875190303	FE	On-Demand	Anodyne	EPHX2	16	40
Cc1ccnn1CC(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1	ZINC000875190303	FE	On-Demand	Anodyne	LIPG	22	45
CCCCN1CCC(NC(=O)N2CCC[C@@H](CCC(=O)OC)C2)CC1	ZINC000875190304	FF	On-Demand	Anodyne	HTR4	44	39
CCCCN1CCC(NC(=O)N2CCC[C@H](CCC(=O)OC)C2)CC1	ZINC000875190305	FF	On-Demand	Anodyne	HTR4	44	39
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(-c3csc(C)n3)cc2)C1	ZINC000875190310	GG	On-Demand	Anodyne	VHL	56	31
C[C@@H](Cn1cncn1)NC(=O)N(C)C[C@H]1CCCCN1Cc1ccccc1	ZINC000875190314	FE	On-Demand	Anodyne	HIS3	58	38
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCCN(c3ccccc3Cl)C2)CC1	ZINC000875190324	GE	On-Demand	Anodyne	KCNQ2	52	37
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCCN(c3ccccc3Cl)C2)CC1	ZINC000875190325	GE	On-Demand	Anodyne	KCNQ2	52	37
C[C@H](O)c1ccc(CNC(=O)N(C)Cc2ccns2)cc1	ZINC000875190346	DF	On-Demand	Anodyne	UL54	54	33
C[C@@H](CN(C)C(=O)NCc1ccnc(-n2ccnc2)c1)C(C)(C)C	ZINC000875190360	EG	On-Demand	Anodyne	NOS2	96	37
CCCCN1CCC(NC(=O)N[C@@H](C)c2ccccc2O)CC1	ZINC000875190370	DG	On-Demand	Clean	CHRM1	19	42
CCCCN1CCC(NC(=O)N[C@@H](C)c2ccccc2O)CC1	ZINC000875190370	DG	On-Demand	Clean	DRD2	17	40
CCCCN1CCC(NC(=O)N[C@@H](C)c2ccccc2O)CC1	ZINC000875190370	DG	On-Demand	Clean	HTR4	71	39
CCCCN1CCC(NC(=O)N[C@@H](C)c2ccccc2O)CC1	ZINC000875190370	DG	On-Demand	Clean	CHRM3	21	41
CCCCN1CCC(NC(=O)N[C@@H](C)c2ccccc2O)CC1	ZINC000875190370	DG	On-Demand	Clean	HTR7	18	44
CCCCN1CCC(NC(=O)N[C@@H](C)c2ccccc2O)CC1	ZINC000875190370	DG	On-Demand	Clean	CYP2J2	40	35
CCCCN1CCC(NC(=O)N[C@H](C)c2ccccc2O)CC1	ZINC000875190371	DG	On-Demand	Clean	CHRM1	19	42
CCCCN1CCC(NC(=O)N[C@H](C)c2ccccc2O)CC1	ZINC000875190371	DG	On-Demand	Clean	DRD2	17	40
CCCCN1CCC(NC(=O)N[C@H](C)c2ccccc2O)CC1	ZINC000875190371	DG	On-Demand	Clean	HTR4	71	39
CCCCN1CCC(NC(=O)N[C@H](C)c2ccccc2O)CC1	ZINC000875190371	DG	On-Demand	Clean	CHRM3	21	41
CCCCN1CCC(NC(=O)N[C@H](C)c2ccccc2O)CC1	ZINC000875190371	DG	On-Demand	Clean	HTR7	18	44
CCCCN1CCC(NC(=O)N[C@H](C)c2ccccc2O)CC1	ZINC000875190371	DG	On-Demand	Clean	CYP2J2	40	35
O=C(NCc1ccnc(-n2ccnc2)c1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875190378	FE	On-Demand	Anodyne	NOS2	103	42
CCCCN1CCC(NC(=O)NCc2cc(C(=O)OC)co2)CC1	ZINC000875190380	EE	On-Demand	Anodyne	HTR4	58	44
O=C(NCc1ccnc(-n2ccnc2)c1)NC1CC(Nc2ccccc2)C1	ZINC000875190404	FF	On-Demand	Anodyne	NOS2	99	40
O=C(NCc1ccnc(-n2ccnc2)c1)NC1CC(Nc2ccccc2)C1	ZINC000875190404	FF	On-Demand	Anodyne	NAMPT	20	44
C[C@H](O)c1ccc(CNC(=O)N2CCc3c(CC(N)=O)cccc3C2)cc1	ZINC000875190410	FE	On-Demand	Anodyne	NAMPT	22	40
CCCCN1CCC(NC(=O)N2CCC(c3nc(C4CCC4)no3)CC2)CC1	ZINC000875190414	GG	On-Demand	Anodyne	SMO	37	46
CCCCN1CCC(NC(=O)N2CCC(c3nc(C4CCC4)no3)CC2)CC1	ZINC000875190414	GG	On-Demand	Anodyne	ETHR	55	47
C[C@@H](Cn1cncn1)NC(=O)NC1CC(Nc2ccccc2)C1	ZINC000875190418	DD	On-Demand	Anodyne	HIS3	85	41
C[C@H]1CC(=O)N[C@@H](C(=O)Nc2ccccc2S(=O)(=O)N2CCCCC2)C1	ZINC000875190421	GD	On-Demand	Anodyne	LPL	47	39
C[C@H]1CC(=O)N[C@@H](C(=O)Nc2ccccc2S(=O)(=O)N2CCCCC2)C1	ZINC000875190421	GD	On-Demand	Anodyne	EPHX2	28	43
CCCCN1CCC(NC(=O)N[C@@H]2CC(C)(C)CC[C@H]2O)CC1	ZINC000875190423	EE	On-Demand	Anodyne	EPHX2	19	46
C[C@@H](Cn1cncn1)NC(=O)N[C@@](C)(CO)Cc1ccc(Cl)cc1	ZINC000875190424	FD	On-Demand	Anodyne	HIS3	82	41
C[C@@H](Cn1cncn1)NC(=O)N[C@](C)(CO)Cc1ccc(Cl)cc1	ZINC000875190425	FD	On-Demand	Anodyne	HIS3	82	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCCC[C@@H]1[C@H]1CCCC[C@H]1O	ZINC000875190429	GF	On-Demand	Anodyne	NOS2	104	42
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O	ZINC000875190430	GF	On-Demand	Anodyne	NOS2	104	42
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O	ZINC000875190431	GF	On-Demand	Anodyne	NOS2	104	42
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O	ZINC000875190432	GF	On-Demand	Anodyne	NOS2	104	42
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875190435	GE	On-Demand	Anodyne	NOS2	95	43
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875190435	GE	On-Demand	Anodyne	FAAH	15	40
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875190435	GE	On-Demand	Anodyne	NAMPT	21	42
CC[C@@H](NC(=O)NC1CCN(C(=O)CC(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000875190441	GF	On-Demand	Anodyne	EPHX2	35	50
CC[C@@H](NC(=O)NC1CCN(C(=O)CC(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000875190441	GF	On-Demand	Anodyne	XIAP	39	42
CC[C@@H](NC(=O)NC1CCN(C(=O)CC(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000875190441	GF	On-Demand	Anodyne	BIRC3	20	42
CC[C@@H](NC(=O)NC1CCN(C(=O)CC(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000875190441	GF	On-Demand	Anodyne	BIRC2	27	42
CC[C@@H](NC(=O)NC1CCN(C(=O)CC(C)C)CC1)[C@H](O)c1ccccc1	ZINC000875190442	GF	On-Demand	Anodyne	EPHX2	35	50
CC[C@@H](NC(=O)NC1CCN(C(=O)CC(C)C)CC1)[C@H](O)c1ccccc1	ZINC000875190442	GF	On-Demand	Anodyne	XIAP	39	42
CC[C@@H](NC(=O)NC1CCN(C(=O)CC(C)C)CC1)[C@H](O)c1ccccc1	ZINC000875190442	GF	On-Demand	Anodyne	BIRC3	20	42
CC[C@@H](NC(=O)NC1CCN(C(=O)CC(C)C)CC1)[C@H](O)c1ccccc1	ZINC000875190442	GF	On-Demand	Anodyne	BIRC2	27	42
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875190443	DE	On-Demand	Anodyne	NOS2	94	36
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875190444	DE	On-Demand	Anodyne	NOS2	94	36
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875190445	DE	On-Demand	Anodyne	NOS2	94	36
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875190446	DE	On-Demand	Anodyne	NOS2	94	36
O=C(NCCN1CC[C@H](O)C1)NCc1ccnc(-n2ccnc2)c1	ZINC000875190450	EC	On-Demand	Anodyne	NOS2	106	39
O=C(NCCN1CC[C@@H](O)C1)NCc1ccnc(-n2ccnc2)c1	ZINC000875190451	EC	On-Demand	Anodyne	NOS2	106	39
CN(C)[C@@H]1CN(C(=O)NCc2ccnc(-n3ccnc3)c2)C[C@@H]1n1ccnn1	ZINC000875190452	GC	On-Demand	Anodyne	NOS2	98	39
Cn1ncc(C(F)(F)F)c1CNC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875190457	GE	On-Demand	Anodyne	NOS2	87	35
C[C@@](CO)(Cc1ccccc1F)NC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875190458	GE	On-Demand	Anodyne	NOS2	85	35
COc1ccc([C@@H](NC(=O)NCc2ccnc(-n3ccnc3)c2)C2CC2)cn1	ZINC000875190461	GF	On-Demand	Anodyne	NOS2	91	38
COc1ccc([C@H](NC(=O)NCc2ccnc(-n3ccnc3)c2)C2CC2)cn1	ZINC000875190462	GF	On-Demand	Anodyne	NOS2	91	38
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875190463	FD	On-Demand	Anodyne	NOS2	109	43
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875190464	FD	On-Demand	Anodyne	NOS2	109	43
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H](n1cccn1)C(F)(F)F	ZINC000875190466	GE	On-Demand	Anodyne	NOS2	76	32
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@H](n1cccn1)C(F)(F)F	ZINC000875190467	GE	On-Demand	Anodyne	NOS2	76	32
O=C(NCc1ccnc(-n2ccnc2)c1)N1C[C@@H]2CCC[C@]2(CO)C1	ZINC000875190468	ED	On-Demand	Anodyne	NOS2	113	44
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875190469	FF	On-Demand	Anodyne	NOS2	108	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875190470	FF	On-Demand	Anodyne	NOS2	108	41
C[C@H]1C[C@H](CO)CCN1C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875190481	ED	On-Demand	Anodyne	NOS2	102	38
O=C(NCc1ccnc(-n2ccnc2)c1)N1[C@H]2CC[C@H]1CC(F)(F)C2	ZINC000875190489	EF	On-Demand	Anodyne	NOS2	101	37
O=C(NCc1ccnc(-n2ccnc2)c1)N(C1CC1)C1CC1	ZINC000875190490	CE	On-Demand	Anodyne	NOS2	112	43
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1C[C@H]1C(F)(F)F	ZINC000875190491	EE	On-Demand	Anodyne	NOS2	99	36
C#CC[C@@H](COC)NC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875190492	DD	On-Demand	Mild	NOS2	88	37
C#CC[C@H](COC)NC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875190493	DD	On-Demand	Mild	NOS2	88	37
CC(C)c1cc([C@@H]2CCCN(C(=O)NCc3ccnc(-n4ccnc4)c3)C2)n[nH]1	ZINC000875190497	GG	On-Demand	Anodyne	NOS2	104	38
O=C(NCc1ccnc(-n2ccnc2)c1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875190505	FE	On-Demand	Anodyne	NOS2	98	36
CO[C@H]1CN(C(=O)NCc2ccnc(-n3ccnc3)c2)[C@](C)(CO)C1	ZINC000875190506	EC	On-Demand	Anodyne	NOS2	96	38
CO[C@H]1CN(C(=O)NCc2ccnc(-n3ccnc3)c2)[C@@](C)(CO)C1	ZINC000875190507	EC	On-Demand	Anodyne	NOS2	96	38
O=C(NCCn1ccc(C(F)(F)F)n1)NCc1ccnc(-n2ccnc2)c1	ZINC000875190511	GD	On-Demand	Anodyne	NOS2	78	32
O=C(NCc1ccnc(-n2ccnc2)c1)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875190515	ED	On-Demand	Anodyne	NOS2	94	37
O=C(NCc1ccnc(-n2ccnc2)c1)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875190516	ED	On-Demand	Anodyne	NOS2	94	37
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCN(c2cccc(F)c2)CC1	ZINC000875190518	GE	On-Demand	Anodyne	NOS2	94	40
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875190525	FF	On-Demand	Anodyne	NOS2	106	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875190525	FF	On-Demand	Anodyne	EPHX2	16	40
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875190526	FF	On-Demand	Anodyne	NOS2	106	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875190526	FF	On-Demand	Anodyne	EPHX2	16	40
O=C1OC[C@H]2CN(C(=O)NCc3ccnc(-n4ccnc4)c3)C[C@@H]12	ZINC000875190527	EC	On-Demand	Anodyne	NOS2	108	42
CCCCN1CCC(NC(=O)N2Cc3cccc(O)c3C2)CC1	ZINC000875190528	DF	On-Demand	Clean	HTR1A	17	50
CCCCN1CCC(NC(=O)N2Cc3cccc(O)c3C2)CC1	ZINC000875190528	DF	On-Demand	Clean	DRD2	23	40
CCCCN1CCC(NC(=O)N2Cc3cccc(O)c3C2)CC1	ZINC000875190528	DF	On-Demand	Clean	DRD4	22	41
CCCCN1CCC(NC(=O)N2Cc3cccc(O)c3C2)CC1	ZINC000875190528	DF	On-Demand	Clean	HTR4	46	38
CCCCN1CCC(NC(=O)N2Cc3cccc(O)c3C2)CC1	ZINC000875190528	DF	On-Demand	Clean	SLC6A5	15	42
COCC(C)(C)CCNC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875190531	EE	On-Demand	Anodyne	NOS2	93	37
CCCCN1CCC(NC(=O)N2CCC(C(=O)NOC)CC2)CC1	ZINC000875190532	ED	On-Demand	Anodyne	HTR4	46	42
CCCCN1CCC(NC(=O)N(C)Cc2ccc3cc[nH]c3c2)CC1	ZINC000875190533	EH	On-Demand	Anodyne	MCHR1	15	43
C[C@@H](Cn1cncn1)NC(=O)N(C)OCC(F)(F)F	ZINC000875190535	CC	On-Demand	Anodyne	HIS3	82	39
CCCCN1CCC(NC(=O)N2CCN(C)c3ncccc3C2)CC1	ZINC000875190541	EE	On-Demand	Anodyne	HTR4	41	36
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H](C)Cn1cncn1	ZINC000875190554	EC	On-Demand	Anodyne	HIS3	76	36
COCCN(CC1CCN(C)CC1)C(=O)N[C@H](C)Cn1cncn1	ZINC000875190555	EC	On-Demand	Anodyne	HIS3	76	36
CCCCN1CCC(NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)CC1	ZINC000875190556	GG	On-Demand	Anodyne	DRD2	15	42
CCCCN1CCC(NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)CC1	ZINC000875190556	GG	On-Demand	Anodyne	DRD4	20	42
CCCCN1CCC(NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)CC1	ZINC000875190556	GG	On-Demand	Anodyne	OPRL1	15	41
CCCCN1CCC(NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)CC1	ZINC000875190556	GG	On-Demand	Anodyne	HTR4	50	44
CCCCN1CCC(NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)CC1	ZINC000875190556	GG	On-Demand	Anodyne	CHRM3	19	40
CCCCN1CCC(NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)CC1	ZINC000875190556	GG	On-Demand	Anodyne	CCR1	29	45
CCCCN1CCC(NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)CC1	ZINC000875190556	GG	On-Demand	Anodyne	CYP2J2	40	35
C[C@@H](Cn1cncn1)NC(=O)N1C[C@@H]2CN(C(=O)OC(C)(C)C)C[C@]2(C)C1	ZINC000875190557	GD	On-Demand	Anodyne	HIS3	75	35
CCCCN1CCC(NC(=O)N(C)CCc2cccc(C#N)c2)CC1	ZINC000875190571	EG	On-Demand	Mild	CCR3	24	43
CCCCN1CCC(NC(=O)N(C)CCc2cccc(C#N)c2)CC1	ZINC000875190571	EG	On-Demand	Mild	MCHR1	40	42
CCCCN1CCC(NC(=O)N(CC)[C@@H](C)[C@@H](O)c2ccccc2)CC1	ZINC000875190574	FG	On-Demand	Anodyne	CHRM1	23	41
CCCCN1CCC(NC(=O)N(CC)[C@@H](C)[C@@H](O)c2ccccc2)CC1	ZINC000875190574	FG	On-Demand	Anodyne	HTR1D	15	41
CCCCN1CCC(NC(=O)N(CC)[C@@H](C)[C@@H](O)c2ccccc2)CC1	ZINC000875190574	FG	On-Demand	Anodyne	HTR4	56	37
CCCCN1CCC(NC(=O)N(CC)[C@@H](C)[C@@H](O)c2ccccc2)CC1	ZINC000875190574	FG	On-Demand	Anodyne	CHRM3	26	44
CCCCN1CCC(NC(=O)N(CC)[C@@H](C)[C@@H](O)c2ccccc2)CC1	ZINC000875190574	FG	On-Demand	Anodyne	SIGMAR1	24	41
CCCCN1CCC(NC(=O)N(CC)[C@@H](C)[C@@H](O)c2ccccc2)CC1	ZINC000875190574	FG	On-Demand	Anodyne	CCR5	54	42
CCCCN1CCC(NC(=O)N(CC)[C@@H](C)[C@@H](O)c2ccccc2)CC1	ZINC000875190574	FG	On-Demand	Anodyne	SOAT1	27	43
CCCCN1CCC(NC(=O)N(CC)[C@@H](C)[C@H](O)c2ccccc2)CC1	ZINC000875190575	FG	On-Demand	Anodyne	CHRM1	23	41
CCCCN1CCC(NC(=O)N(CC)[C@@H](C)[C@H](O)c2ccccc2)CC1	ZINC000875190575	FG	On-Demand	Anodyne	HTR1D	15	41
CCCCN1CCC(NC(=O)N(CC)[C@@H](C)[C@H](O)c2ccccc2)CC1	ZINC000875190575	FG	On-Demand	Anodyne	HTR4	56	37
CCCCN1CCC(NC(=O)N(CC)[C@@H](C)[C@H](O)c2ccccc2)CC1	ZINC000875190575	FG	On-Demand	Anodyne	CHRM3	26	44
CCCCN1CCC(NC(=O)N(CC)[C@@H](C)[C@H](O)c2ccccc2)CC1	ZINC000875190575	FG	On-Demand	Anodyne	SIGMAR1	24	41
CCCCN1CCC(NC(=O)N(CC)[C@@H](C)[C@H](O)c2ccccc2)CC1	ZINC000875190575	FG	On-Demand	Anodyne	CCR5	54	42
CCCCN1CCC(NC(=O)N(CC)[C@@H](C)[C@H](O)c2ccccc2)CC1	ZINC000875190575	FG	On-Demand	Anodyne	SOAT1	27	43
CCCCN1CCC(NC(=O)N(CC)[C@H](C)[C@H](O)c2ccccc2)CC1	ZINC000875190576	FG	On-Demand	Anodyne	CHRM1	23	41
CCCCN1CCC(NC(=O)N(CC)[C@H](C)[C@H](O)c2ccccc2)CC1	ZINC000875190576	FG	On-Demand	Anodyne	HTR1D	15	41
CCCCN1CCC(NC(=O)N(CC)[C@H](C)[C@H](O)c2ccccc2)CC1	ZINC000875190576	FG	On-Demand	Anodyne	HTR4	56	37
CCCCN1CCC(NC(=O)N(CC)[C@H](C)[C@H](O)c2ccccc2)CC1	ZINC000875190576	FG	On-Demand	Anodyne	CHRM3	26	44
CCCCN1CCC(NC(=O)N(CC)[C@H](C)[C@H](O)c2ccccc2)CC1	ZINC000875190576	FG	On-Demand	Anodyne	SIGMAR1	24	41
CCCCN1CCC(NC(=O)N(CC)[C@H](C)[C@H](O)c2ccccc2)CC1	ZINC000875190576	FG	On-Demand	Anodyne	CCR5	54	42
CCCCN1CCC(NC(=O)N(CC)[C@H](C)[C@H](O)c2ccccc2)CC1	ZINC000875190576	FG	On-Demand	Anodyne	SOAT1	27	43
CCCCN1CCC(NC(=O)N(CC)[C@H](C)[C@@H](O)c2ccccc2)CC1	ZINC000875190577	FG	On-Demand	Anodyne	CHRM1	23	41
CCCCN1CCC(NC(=O)N(CC)[C@H](C)[C@@H](O)c2ccccc2)CC1	ZINC000875190577	FG	On-Demand	Anodyne	HTR1D	15	41
CCCCN1CCC(NC(=O)N(CC)[C@H](C)[C@@H](O)c2ccccc2)CC1	ZINC000875190577	FG	On-Demand	Anodyne	HTR4	56	37
CCCCN1CCC(NC(=O)N(CC)[C@H](C)[C@@H](O)c2ccccc2)CC1	ZINC000875190577	FG	On-Demand	Anodyne	CHRM3	26	44
CCCCN1CCC(NC(=O)N(CC)[C@H](C)[C@@H](O)c2ccccc2)CC1	ZINC000875190577	FG	On-Demand	Anodyne	SIGMAR1	24	41
CCCCN1CCC(NC(=O)N(CC)[C@H](C)[C@@H](O)c2ccccc2)CC1	ZINC000875190577	FG	On-Demand	Anodyne	CCR5	54	42
CCCCN1CCC(NC(=O)N(CC)[C@H](C)[C@@H](O)c2ccccc2)CC1	ZINC000875190577	FG	On-Demand	Anodyne	SOAT1	27	43
Cc1ccn(C[C@H](C)C(=O)Nc2ccccc2S(=O)(=O)N2CCCCC2)n1	ZINC000875190578	GF	On-Demand	Anodyne	LPL	50	42
Cc1ccn(C[C@H](C)C(=O)Nc2ccccc2S(=O)(=O)N2CCCCC2)n1	ZINC000875190578	GF	On-Demand	Anodyne	KCNQ2	46	35
Cc1ccn(C[C@H](C)C(=O)Nc2ccccc2S(=O)(=O)N2CCCCC2)n1	ZINC000875190578	GF	On-Demand	Anodyne	LIPG	21	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000875190581	FD	On-Demand	Anodyne	NOS2	104	42
CCCCN1CCC(NC(=O)N2CCC[C@H]2c2cncc(C)c2)CC1	ZINC000875190583	EH	On-Demand	Anodyne	SSTR5	40	44
CCCCN1CCC(NC(=O)N2CCC[C@@H]2c2cncc(C)c2)CC1	ZINC000875190584	EH	On-Demand	Anodyne	SSTR5	40	44
C[C@@H](Cn1cncn1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875190589	CC	On-Demand	Anodyne	HIS3	80	38
C[C@@H](Cn1cncn1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875190590	CC	On-Demand	Anodyne	HIS3	80	38
CCCCN1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875190592	GG	On-Demand	Mild	SIGMAR1	17	43
CCCCN1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875190592	GG	On-Demand	Mild	CCR3	48	47
CCCCN1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875190592	GG	On-Demand	Mild	ITK	18	47
CCCCN1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875190592	GG	On-Demand	Mild	EPHX2	28	40
CCCCN1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875190592	GG	On-Demand	Mild	MCHR1	26	45
CCCCN1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875190592	GG	On-Demand	Mild	PANC	53	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cn1cncn1	ZINC000875190594	DC	On-Demand	Anodyne	HIS3	86	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cn1cncn1	ZINC000875190595	DC	On-Demand	Anodyne	HIS3	86	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cn1cncn1	ZINC000875190596	DC	On-Demand	Anodyne	HIS3	86	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cn1cncn1	ZINC000875190597	DC	On-Demand	Anodyne	HIS3	86	40
O=C(Cn1ncc2cccnc21)Nc1ccccc1S(=O)(=O)N1CCCCC1	ZINC000875190600	GE	On-Demand	Anodyne	NAMPT	23	42
CCCCN1CCC(NC(=O)N2CCc3c(CC(N)=O)cccc3C2)CC1	ZINC000875190601	FE	On-Demand	Anodyne	SLC6A5	15	41
CCOc1cc(C)ccc1NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875190602	EJ	On-Demand	Anodyne	KCNK3	25	40
CCOc1cc(C)ccc1NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875190602	EJ	On-Demand	Anodyne	KCNK9	15	40
CCCOc1ccc(Cl)cc1NC(=O)c1scnc1C(F)F	ZINC000875190603	EJ	On-Demand	Anodyne	F10	49	33
C[C@H](O)c1ccc(CNC(=O)NC2CCN(CC(=O)OC(C)(C)C)CC2)cc1	ZINC000875190643	GE	On-Demand	Anodyne	MCHR1	15	46
CCCCN1CCC(NC(=O)N2CCCN(C(=O)CC(C)C)CC2)CC1	ZINC000875190645	FF	On-Demand	Anodyne	RIR1_HHV11	48	30
C[C@@H](Cn1cncn1)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875190654	DB	On-Demand	Anodyne	HIS3	51	35
C[C@H](O)c1ccc(CNC(=O)N2CCC(N3CCN(C)CC3)CC2)cc1	ZINC000875190655	FD	On-Demand	Anodyne	L3MBTL3	91	43
C[C@H](O)c1ccc(CNC(=O)N2CCC(N3CCN(C)CC3)CC2)cc1	ZINC000875190655	FD	On-Demand	Anodyne	NAMPT	26	42
C[C@@H](Cn1cncn1)NC(=O)NNc1cccc(F)c1Br	ZINC000875190658	FD	On-Demand	Reactive	HIS3	84	39
COC(=O)c1ccc(OC)c2c1CCN(C(=O)N[C@H](C)Cn1cncn1)C2	ZINC000875190664	FD	On-Demand	Anodyne	HIS3	64	34
COC(=O)c1ccc(OC)c2c1CCN(C(=O)N[C@@H](C)Cn1cncn1)C2	ZINC000875190666	FD	On-Demand	Anodyne	HIS3	64	34
C[C@H](O)c1ccc(CNC(=O)N2Cc3cccnc3N3CCC[C@H]3C2)cc1	ZINC000875190667	FF	On-Demand	Anodyne	NAMPT	26	42
CCC[C@@H](CCO)NC(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875190671	CE	On-Demand	Anodyne	ANPEP	16	40
CCC[C@H](CCO)NC(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875190672	CE	On-Demand	Anodyne	ANPEP	16	40
CCC[C@H](CCO)NC(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875190673	CE	On-Demand	Anodyne	ANPEP	16	40
CCC[C@@H](CCO)NC(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875190674	CE	On-Demand	Anodyne	ANPEP	16	40
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875190695	FG	On-Demand	Anodyne	F2	43	42
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875190695	FG	On-Demand	Anodyne	ACE	40	40
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875190695	FG	On-Demand	Anodyne	TRY1_BOVIN	40	42
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875190695	FG	On-Demand	Anodyne	CCR5	23	43
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875190695	FG	On-Demand	Anodyne	PREP	42	47
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875190695	FG	On-Demand	Anodyne	XIAP	45	41
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875190695	FG	On-Demand	Anodyne	TMPRSS11D	68	39
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875190696	FG	On-Demand	Anodyne	F2	43	42
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875190696	FG	On-Demand	Anodyne	ACE	40	40
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875190696	FG	On-Demand	Anodyne	TRY1_BOVIN	40	42
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875190696	FG	On-Demand	Anodyne	CCR5	23	43
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875190696	FG	On-Demand	Anodyne	PREP	42	47
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875190696	FG	On-Demand	Anodyne	XIAP	45	41
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875190696	FG	On-Demand	Anodyne	TMPRSS11D	68	39
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875190697	FG	On-Demand	Anodyne	F2	43	42
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875190697	FG	On-Demand	Anodyne	ACE	40	40
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875190697	FG	On-Demand	Anodyne	TRY1_BOVIN	40	42
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875190697	FG	On-Demand	Anodyne	CCR5	23	43
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875190697	FG	On-Demand	Anodyne	PREP	42	47
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875190697	FG	On-Demand	Anodyne	XIAP	45	41
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875190697	FG	On-Demand	Anodyne	TMPRSS11D	68	39
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875190698	FG	On-Demand	Anodyne	F2	43	42
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875190698	FG	On-Demand	Anodyne	ACE	40	40
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875190698	FG	On-Demand	Anodyne	TRY1_BOVIN	40	42
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875190698	FG	On-Demand	Anodyne	CCR5	23	43
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875190698	FG	On-Demand	Anodyne	PREP	42	47
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875190698	FG	On-Demand	Anodyne	XIAP	45	41
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875190698	FG	On-Demand	Anodyne	TMPRSS11D	68	39
O=C(NCc1ccnc(-n2ccnc2)c1)NC1(c2c(F)cccc2F)CCC1	ZINC000875190728	GG	On-Demand	Anodyne	NOS2	100	40
C=CCCC(C)(C)CNC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875190729	EG	On-Demand	Mild	NOS2	82	33
CC(C)n1nccc1[C@@H]1OCC[C@H]1NC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875190740	GE	On-Demand	Anodyne	NOS2	101	36
CC[C@@H](NC(=O)NCc1ccnc(-n2ccnc2)c1)c1cccc(OC)c1OC	ZINC000875190743	GG	On-Demand	Anodyne	NOS2	83	35
O=C(NCc1ccnc(-n2ccnc2)c1)N1[C@H]2CC[C@H]1CC1(CC1)C2	ZINC000875190744	EF	On-Demand	Anodyne	NOS2	101	38
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1C[C@H](CO)C1	ZINC000875190747	DC	On-Demand	Anodyne	NOS2	101	38
CCC(F)(F)C(C)(C)CNC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875190748	FG	On-Demand	Anodyne	NOS2	90	34
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875190751	GG	On-Demand	Anodyne	NOS2	95	37
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875190751	GG	On-Demand	Anodyne	NAMPT	42	38
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875190752	GG	On-Demand	Anodyne	NOS2	95	37
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875190752	GG	On-Demand	Anodyne	NAMPT	42	38
C[C@@H](CN(C)C(=O)C(=O)NCCCc1cccc(F)c1)NC(=O)OC(C)(C)C	ZINC000875190755	GE	On-Demand	Anodyne	PAPA1_CARPA	27	46
C[C@]1(C(F)(F)F)CCN(C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000875190758	FF	On-Demand	Anodyne	NOS2	102	39
CC1(C)CCC[C@H]1CCNC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875190761	EG	On-Demand	Anodyne	NOS2	107	39
COC(=O)[C@@]1(OC)CCN(C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000875190764	FC	On-Demand	Anodyne	NOS2	99	39
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1Cc2ccccc2CO1	ZINC000875190765	FE	On-Demand	Anodyne	NOS2	103	38
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1CCN1C1CCCCCC1	ZINC000875190770	GF	On-Demand	Anodyne	NOS2	105	42
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@H]1CCN1C1CCCCCC1	ZINC000875190771	GF	On-Demand	Anodyne	NOS2	105	42
COC(=O)N(C)NC(=O)NC1CCN(C(=O)CC(C)C)CC1	ZINC000875190772	DC	On-Demand	Reactive	EPHX2	26	49
O=C(NCc1ccnc(-n2ccnc2)c1)NCc1cccc2c1CCOC2	ZINC000875190789	FE	On-Demand	Anodyne	NOS2	108	41
CCn1nc(C)c(CN(C)C(=O)NCc2ccnc(-n3ccnc3)c2)c1C	ZINC000875190790	FE	On-Demand	Anodyne	NOS2	90	34
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H]1[C@@H]2c3ccc(Cl)cc3C[C@H]21	ZINC000875190800	GG	On-Demand	Anodyne	NOS2	85	34
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1[C@@H]2Cc3cc(Cl)ccc3[C@@H]21	ZINC000875190804	GG	On-Demand	Anodyne	NOS2	85	34
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1[C@H]2Cc3cc(Cl)ccc3[C@H]21	ZINC000875190805	GG	On-Demand	Anodyne	NOS2	85	34
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1[C@H]2Cc3cc(Cl)ccc3[C@@H]21	ZINC000875190807	GG	On-Demand	Anodyne	NOS2	85	34
CN(CCNC(=O)NCc1ccnc(-n2ccnc2)c1)CC(F)F	ZINC000875190817	ED	On-Demand	Anodyne	NOS2	98	38
CC(=O)C1CCN(C(=O)NCc2ccc(-c3csc(C)n3)cc2)CC1	ZINC000875190822	FH	On-Demand	Anodyne	VHL	51	36
CO[C@@H]1CC[C@@H](C)N(C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000875190831	ED	On-Demand	Anodyne	NOS2	102	39
CCCCN1CCC(NC(=O)N(CC)OCC)CC1	ZINC000875190832	CE	On-Demand	Anodyne	HTR4	35	40
COC[C@]1(C)CN(C(=O)NCc2ccnc(-n3ccnc3)c2)CCO1	ZINC000875190846	ED	On-Demand	Anodyne	NOS2	112	42
COC[C@@]1(C)CN(C(=O)NCc2ccnc(-n3ccnc3)c2)CCO1	ZINC000875190847	ED	On-Demand	Anodyne	NOS2	112	42
CCOC1CC2(C1)C[C@H]2C(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1	ZINC000875190851	GG	On-Demand	Anodyne	LPL	47	40
CCOC1CC2(C1)C[C@H]2C(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1	ZINC000875190851	GG	On-Demand	Anodyne	LIPG	20	40
C[C@@H](Cn1cncn1)NC(=O)N[C@@](C)(CO)Cc1ccc(Br)cc1	ZINC000875190860	GD	On-Demand	Anodyne	HIS3	78	36
C[C@@H](Cn1cncn1)NC(=O)N[C@](C)(CO)Cc1ccc(Br)cc1	ZINC000875190861	GD	On-Demand	Anodyne	HIS3	78	36
C[C@@H]1CN(C(=O)NCc2ccnc(-n3ccnc3)c2)Cc2ccccc21	ZINC000875190866	EG	On-Demand	Anodyne	NOS2	108	44
CCCCCCCNC(=O)C(=O)N[C@H](C)c1csc(C)n1	ZINC000875190868	DF	On-Demand	Mild	ASAH1	74	34
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1csc(C)n1	ZINC000875190870	DF	On-Demand	Mild	ASAH1	74	34
CC[C@@H](NC(=O)NCc1ccnc(-n2ccnc2)c1)[C@H](O)c1ccccc1	ZINC000875190877	FF	On-Demand	Anodyne	NOS2	90	34
CC[C@@H](NC(=O)NCc1ccnc(-n2ccnc2)c1)[C@@H](O)c1ccccc1	ZINC000875190878	FF	On-Demand	Anodyne	NOS2	90	34
C[C@@H](Cn1cncn1)NC(=O)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875190881	DD	On-Demand	Anodyne	HIS3	78	37
CCCCCCCNC(=O)C(=O)NCCc1sc(C)nc1C	ZINC000875190886	EF	On-Demand	Mild	ASAH1	73	35
C[C@@H](Cn1cncn1)NC(=O)N1Cc2cccc(O)c2C1	ZINC000875190889	CD	On-Demand	Clean	HIS3	88	40
C[C@@H](Cn1cncn1)NC(=O)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875190892	EB	On-Demand	Anodyne	HIS3	76	36
C[C@@H](Cn1cncn1)NC(=O)N1Cc2cccnc2N2C[C@H](O)C[C@H]2C1	ZINC000875190894	FC	On-Demand	Anodyne	HIS3	49	33
C[C@@H](Cn1cncn1)NC(=O)NC1(C)CC(F)(F)C1	ZINC000875190897	CD	On-Demand	Anodyne	HIS3	85	40
O=C(Cc1ccc(Cl)cn1)Nc1ccccc1S(=O)(=O)N1CCCCC1	ZINC000875190905	GG	On-Demand	Anodyne	F10	15	40
O=C(Cc1ccc(Cl)cn1)Nc1ccccc1S(=O)(=O)N1CCCCC1	ZINC000875190905	GG	On-Demand	Anodyne	LPL	35	42
O=C(Cc1ccc(Cl)cn1)Nc1ccccc1S(=O)(=O)N1CCCCC1	ZINC000875190905	GG	On-Demand	Anodyne	KCNQ2	31	47
O=C(Cc1ccc(Cl)cn1)Nc1ccccc1S(=O)(=O)N1CCCCC1	ZINC000875190905	GG	On-Demand	Anodyne	LIPG	17	42
O=C1CC[C@H](C(=O)Nc2ccccc2S(=O)(=O)N2CCCCC2)O1	ZINC000875190906	FD	On-Demand	Anodyne	LPL	49	42
O=C1CC[C@H](C(=O)Nc2ccccc2S(=O)(=O)N2CCCCC2)O1	ZINC000875190906	FD	On-Demand	Anodyne	EPHX2	33	48
O=C1CC[C@H](C(=O)Nc2ccccc2S(=O)(=O)N2CCCCC2)O1	ZINC000875190906	FD	On-Demand	Anodyne	LIPG	20	42
COCC(C)(C)CCNC(=O)C(=O)NCC1(c2cccc(OC)c2)CCCC1	ZINC000875190912	GF	On-Demand	Anodyne	DRD4	43	32
COCC(C)(C)CCNC(=O)C(=O)NCC1(c2cccc(OC)c2)CCCC1	ZINC000875190912	GF	On-Demand	Anodyne	KCNA3	41	34
COCC(C)(C)CCNC(=O)C(=O)NCC1(c2cccc(OC)c2)CCCC1	ZINC000875190912	GF	On-Demand	Anodyne	SOAT1	17	44
N#CCc1ccsc1C(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1	ZINC000875190913	GG	On-Demand	Mild	LPL	47	39
C[C@H](O)c1ccc(CNC(=O)N2CCC(Oc3ccccc3F)CC2)cc1	ZINC000875190951	FH	On-Demand	Anodyne	EPHX2	24	46
C[C@H](O)c1ccc(CNC(=O)N2CCC(Oc3ccccc3F)CC2)cc1	ZINC000875190951	FH	On-Demand	Anodyne	NPSR1	25	41
C[C@H](O)c1ccc(CNC(=O)N2CCC(Oc3ccccc3F)CC2)cc1	ZINC000875190951	FH	On-Demand	Anodyne	SCD1	43	49
C[C@H](O)c1ccc(CNC(=O)N2CCC(Oc3ccccc3F)CC2)cc1	ZINC000875190951	FH	On-Demand	Anodyne	SCD	35	42
C[C@H](O)c1ccc(CNC(=O)NCC(C)(C)F)cc1	ZINC000875190953	CE	On-Demand	Anodyne	TRPV1	18	41
COc1ccccc1C[C@@](C)(CO)NC(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875190967	FF	On-Demand	Anodyne	TRPV1	16	42
COc1ccccc1C[C@](C)(CO)NC(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875190968	FF	On-Demand	Anodyne	TRPV1	16	42
COc1ccccc1C[C@@](C)(CO)NC(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000875190969	FF	On-Demand	Anodyne	TRPV1	16	42
COc1ccccc1C[C@](C)(CO)NC(=O)NCc1ccc([C@H](C)O)cc1	ZINC000875190970	FF	On-Demand	Anodyne	TRPV1	16	42
C[C@H](O)c1ccc(CNC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875190974	DF	On-Demand	Clean	NAMPT	25	48
C[C@H](O)c1ccc(CNC(=O)N2CCN(S(=O)(=O)C3CC3)CC2)cc1	ZINC000875191015	FD	On-Demand	Anodyne	NAMPT	38	44
C[C@@H](Cn1cncn1)NC(=O)N1CCC[C@]1(C)Cc1ccc(F)c(F)c1	ZINC000875191022	FF	On-Demand	Anodyne	HIS3	66	36
C[C@@H](Cn1cncn1)NC(=O)N1CCC[C@@]1(C)Cc1ccc(F)c(F)c1	ZINC000875191023	FF	On-Demand	Anodyne	HIS3	66	36
CCCCN1CCC(NC(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875191025	DE	On-Demand	Anodyne	CYP2J2	50	37
CCCCN1CCC(NC(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875191026	DE	On-Demand	Anodyne	CYP2J2	50	37
C[C@@H](Cn1cncn1)NC(=O)N[C@]1(C)C[C@H](C)CC(C)(C)C1	ZINC000875191029	DF	On-Demand	Anodyne	HIS3	77	36
C[C@@H]1CC(C)(C)C[C@](C)(NC(=O)N[C@H](C)Cn2cncn2)C1	ZINC000875191030	DF	On-Demand	Anodyne	HIS3	77	36
C#CC[C@@H](COC)NC(=O)C(=O)NCC1(c2cccc(OC)c2)CCCC1	ZINC000875191047	FD	On-Demand	Mild	SOAT1	17	44
C#CC[C@H](COC)NC(=O)C(=O)NCC1(c2cccc(OC)c2)CCCC1	ZINC000875191048	FD	On-Demand	Mild	SOAT1	17	44
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H](C)Cn3cncn3)C[C@@H]1C2	ZINC000875191051	DC	On-Demand	Anodyne	HIS3	61	34
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H](C)Cn3cncn3)C[C@@H]1C2	ZINC000875191052	DC	On-Demand	Anodyne	HIS3	61	34
COc1cccc(C2(CNC(=O)C(=O)N3CC[C@@H]4[C@@H](CCN4C)C3)CCCC2)c1	ZINC000875191058	GE	On-Demand	Anodyne	DRD4	42	33
COc1cccc(C2(CNC(=O)C(=O)N3CC[C@@H]4[C@@H](CCN4C)C3)CCCC2)c1	ZINC000875191058	GE	On-Demand	Anodyne	KCNA3	42	36
COc1cccc(C2(CNC(=O)C(=O)N3CC[C@@H]4[C@@H](CCN4C)C3)CCCC2)c1	ZINC000875191058	GE	On-Demand	Anodyne	SOAT1	17	44
COc1cccc(C2(CNC(=O)C(=O)N3CC[C@H]4[C@@H](CCN4C)C3)CCCC2)c1	ZINC000875191059	GE	On-Demand	Anodyne	DRD4	42	33
COc1cccc(C2(CNC(=O)C(=O)N3CC[C@H]4[C@@H](CCN4C)C3)CCCC2)c1	ZINC000875191059	GE	On-Demand	Anodyne	KCNA3	42	36
COc1cccc(C2(CNC(=O)C(=O)N3CC[C@H]4[C@@H](CCN4C)C3)CCCC2)c1	ZINC000875191059	GE	On-Demand	Anodyne	SOAT1	17	44
COc1cccc(C2(CNC(=O)C(=O)N3CC[C@H]4[C@H](CCN4C)C3)CCCC2)c1	ZINC000875191060	GE	On-Demand	Anodyne	DRD4	42	33
COc1cccc(C2(CNC(=O)C(=O)N3CC[C@H]4[C@H](CCN4C)C3)CCCC2)c1	ZINC000875191060	GE	On-Demand	Anodyne	KCNA3	42	36
COc1cccc(C2(CNC(=O)C(=O)N3CC[C@H]4[C@H](CCN4C)C3)CCCC2)c1	ZINC000875191060	GE	On-Demand	Anodyne	SOAT1	17	44
COc1cccc(C2(CNC(=O)C(=O)N3CC[C@@H]4[C@H](CCN4C)C3)CCCC2)c1	ZINC000875191061	GE	On-Demand	Anodyne	DRD4	42	33
COc1cccc(C2(CNC(=O)C(=O)N3CC[C@@H]4[C@H](CCN4C)C3)CCCC2)c1	ZINC000875191061	GE	On-Demand	Anodyne	KCNA3	42	36
COc1cccc(C2(CNC(=O)C(=O)N3CC[C@@H]4[C@H](CCN4C)C3)CCCC2)c1	ZINC000875191061	GE	On-Demand	Anodyne	SOAT1	17	44
C[C@@H](Cn1cncn1)NC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875191063	ED	On-Demand	Anodyne	HIS3	81	40
C[C@@H](Cn1cncn1)NC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875191065	ED	On-Demand	Anodyne	HIS3	81	40
C[C@@H](Cn1cncn1)NC(=O)N(C)CCN1CC2(CCOCC2)C1	ZINC000875191068	EC	On-Demand	Anodyne	HIS3	54	33
C[C@@H](Cn1cncn1)NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875191070	DD	On-Demand	Anodyne	HIS3	85	42
C[C@@H](Cn1cncn1)NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1	ZINC000875191074	EC	On-Demand	Anodyne	HIS3	81	39
C[C@@H](Cn1cncn1)NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875191077	ED	On-Demand	Anodyne	HIS3	85	41
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(-c3csc(C)n3)cc2)C1	ZINC000875191080	FH	On-Demand	Anodyne	VHL	53	38
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(-c3csc(C)n3)cc2)C1	ZINC000875191081	FH	On-Demand	Anodyne	VHL	53	38
C[C@@H](Cn1cncn1)NC(=O)NC(C)(C)[C@H]1CCCCO1	ZINC000875191085	CD	On-Demand	Anodyne	HIS3	71	40
C[C@@H](Cn1cncn1)NC(=O)NC(C)(C)[C@@H]1CCCCO1	ZINC000875191086	CD	On-Demand	Anodyne	HIS3	71	40
C[C@@H](Cn1cncn1)NC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875191096	ED	On-Demand	Anodyne	HIS3	80	39
C[C@@H](Cn1cncn1)NC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875191097	ED	On-Demand	Anodyne	HIS3	80	39
CC[C@@H]1COCCN1CCNC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875191101	FD	On-Demand	Anodyne	NOS2	107	46
CCCCN1CCC(NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875191102	FG	On-Demand	Anodyne	CHRM1	22	40
CCCCN1CCC(NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875191102	FG	On-Demand	Anodyne	HTR4	51	37
CCCCN1CCC(NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875191102	FG	On-Demand	Anodyne	CHRM3	21	42
CCCCN1CCC(NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875191102	FG	On-Demand	Anodyne	SIGMAR1	26	43
CCCCN1CCC(NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875191102	FG	On-Demand	Anodyne	CYP2J2	49	36
CCCCN1CCC(NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875191103	FG	On-Demand	Anodyne	CHRM1	22	40
CCCCN1CCC(NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875191103	FG	On-Demand	Anodyne	HTR4	51	37
CCCCN1CCC(NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875191103	FG	On-Demand	Anodyne	CHRM3	21	42
CCCCN1CCC(NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875191103	FG	On-Demand	Anodyne	SIGMAR1	26	43
CCCCN1CCC(NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875191103	FG	On-Demand	Anodyne	CYP2J2	49	36
CCCCN1CCC(NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875191104	FG	On-Demand	Anodyne	CHRM1	22	40
CCCCN1CCC(NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875191104	FG	On-Demand	Anodyne	HTR4	51	37
CCCCN1CCC(NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875191104	FG	On-Demand	Anodyne	CHRM3	21	42
CCCCN1CCC(NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875191104	FG	On-Demand	Anodyne	SIGMAR1	26	43
CCCCN1CCC(NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875191104	FG	On-Demand	Anodyne	CYP2J2	49	36
CCCCN1CCC(NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875191105	FG	On-Demand	Anodyne	CHRM1	22	40
CCCCN1CCC(NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875191105	FG	On-Demand	Anodyne	HTR4	51	37
CCCCN1CCC(NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875191105	FG	On-Demand	Anodyne	CHRM3	21	42
CCCCN1CCC(NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875191105	FG	On-Demand	Anodyne	SIGMAR1	26	43
CCCCN1CCC(NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875191105	FG	On-Demand	Anodyne	CYP2J2	49	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(-c2csc(C)n2)cc1	ZINC000875191106	GG	On-Demand	Anodyne	SLC6A3	44	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(-c2csc(C)n2)cc1	ZINC000875191106	GG	On-Demand	Anodyne	VHL	57	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(-c2csc(C)n2)cc1	ZINC000875191107	GG	On-Demand	Anodyne	SLC6A3	44	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(-c2csc(C)n2)cc1	ZINC000875191107	GG	On-Demand	Anodyne	VHL	57	33
CCCCN1CCC(NC(=O)N2CCO[C@H](c3noc(C4CC4)n3)C2)CC1	ZINC000875191112	GE	On-Demand	Anodyne	SMO	24	40
CCCCN1CCC(NC(=O)N2CCO[C@H](c3noc(C4CC4)n3)C2)CC1	ZINC000875191112	GE	On-Demand	Anodyne	ETHR	42	34
CCCCN1CCC(NC(=O)N2CCO[C@@H](c3noc(C4CC4)n3)C2)CC1	ZINC000875191113	GE	On-Demand	Anodyne	SMO	24	40
CCCCN1CCC(NC(=O)N2CCO[C@@H](c3noc(C4CC4)n3)C2)CC1	ZINC000875191113	GE	On-Demand	Anodyne	ETHR	42	34
C[C@@H](Cn1cncn1)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875191115	DD	On-Demand	Anodyne	HIS3	78	37
C[C@@H](Cn1cncn1)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875191118	DD	On-Demand	Anodyne	HIS3	78	37
CCCCN1CCC(NC(=O)NCc2ccc(N(C)C(C)=O)cc2)CC1	ZINC000875191123	FF	On-Demand	Anodyne	CCR3	16	42
CCCCN1CCC(NC(=O)NCc2ccc(N(C)C(C)=O)cc2)CC1	ZINC000875191123	FF	On-Demand	Anodyne	CCR5	15	48
CCCCN1CCC(NC(=O)NCc2ccc(N(C)C(C)=O)cc2)CC1	ZINC000875191123	FF	On-Demand	Anodyne	EPHX2	22	40
CCCCN1CCC(NC(=O)NCc2ccc(N(C)C(C)=O)cc2)CC1	ZINC000875191123	FF	On-Demand	Anodyne	MCHR1	16	48
CCCCN1CCC(NC(=O)NCc2ccc(N(C)C(C)=O)cc2)CC1	ZINC000875191123	FF	On-Demand	Anodyne	CYP2J2	48	37
CCCCN1CCC(NC(=O)NNc2cccc(C)n2)CC1	ZINC000875191126	DE	On-Demand	Reactive	HTR4	48	39
CCCCN1CCC(NC(=O)N2CCc3ccc(NC(C)=O)cc3C2)CC1	ZINC000875191129	FF	On-Demand	Anodyne	MCHR1	31	42
CCCCN1CCC(NC(=O)N2CCC[C@H](C(C)(C)O)C2)CC1	ZINC000875191142	EE	On-Demand	Anodyne	CYP2J2	40	34
CCCCN1CCC(NC(=O)N2CCC[C@@H](C(C)(C)O)C2)CC1	ZINC000875191144	EE	On-Demand	Anodyne	CYP2J2	40	34
C[C@H](O)c1ccc(CNC(=O)N2CCc3c(O)cccc3C2)cc1	ZINC000875191161	EF	On-Demand	Anodyne	FABI	45	31
C[C@H](O)c1ccc(CNC(=O)N2CCc3c(O)cccc3C2)cc1	ZINC000875191161	EF	On-Demand	Anodyne	NAMPT	23	43
C[C@H](O)c1ccc(CNC(=O)N[C@@H](C)[C@H](O)C(F)(F)F)cc1	ZINC000875191162	DD	On-Demand	Anodyne	ANPEP	17	43
C[C@H](O)c1ccc(CNC(=O)N[C@@H](C)[C@@H](O)C(F)(F)F)cc1	ZINC000875191163	DD	On-Demand	Anodyne	ANPEP	17	43
C[C@H](O)c1ccc(CNC(=O)N[C@H](C)[C@H](O)C(F)(F)F)cc1	ZINC000875191164	DD	On-Demand	Anodyne	ANPEP	17	43
C[C@H](O)c1ccc(CNC(=O)N[C@H](C)[C@@H](O)C(F)(F)F)cc1	ZINC000875191165	DD	On-Demand	Anodyne	ANPEP	17	43
COc1cccc(C2(CNC(=O)C(=O)N[C@@H](C)c3ccnn3C)CCCC2)c1	ZINC000875191167	GE	On-Demand	Anodyne	DRD4	40	30
COc1cccc(C2(CNC(=O)C(=O)N[C@@H](C)c3ccnn3C)CCCC2)c1	ZINC000875191167	GE	On-Demand	Anodyne	KCNA3	40	37
COc1cccc(C2(CNC(=O)C(=O)N[C@@H](C)c3ccnn3C)CCCC2)c1	ZINC000875191167	GE	On-Demand	Anodyne	SOAT1	20	51
COc1cccc(C2(CNC(=O)C(=O)N[C@H](C)c3ccnn3C)CCCC2)c1	ZINC000875191168	GE	On-Demand	Anodyne	DRD4	40	30
COc1cccc(C2(CNC(=O)C(=O)N[C@H](C)c3ccnn3C)CCCC2)c1	ZINC000875191168	GE	On-Demand	Anodyne	KCNA3	40	37
COc1cccc(C2(CNC(=O)C(=O)N[C@H](C)c3ccnn3C)CCCC2)c1	ZINC000875191168	GE	On-Demand	Anodyne	SOAT1	20	51
C[C@H](O)c1ccc(CNC(=O)NCc2ccccc2CC(F)(F)F)cc1	ZINC000875191170	FH	On-Demand	Anodyne	ANPEP	22	40
C[C@H](O)c1ccc(CNC(=O)NCc2ccccc2CC(F)(F)F)cc1	ZINC000875191170	FH	On-Demand	Anodyne	TRPV1	47	43
C[C@H](O)c1ccc(CNC(=O)NCc2ccccc2CC(F)(F)F)cc1	ZINC000875191170	FH	On-Demand	Anodyne	AMP1_PLAFQ	44	38
C[C@@H](Cn1cncn1)NC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875191198	DD	On-Demand	Anodyne	HIS3	56	35
C[C@@H](Cn1cncn1)NC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875191200	DD	On-Demand	Anodyne	HIS3	56	35
C[C@H](O)c1ccc(CNC(=O)NCC2(c3ccccc3)CCN(C)CC2)cc1	ZINC000875191220	GG	On-Demand	Anodyne	KCNA3	47	40
C[C@H](O)c1ccc(CNC(=O)NCC2(c3ccccc3)CCN(C)CC2)cc1	ZINC000875191220	GG	On-Demand	Anodyne	SOAT1	21	47
C[C@H](O)c1ccc(CNC(=O)NCC2(c3ccccc3)CCN(C)CC2)cc1	ZINC000875191220	GG	On-Demand	Anodyne	NPFFR1	15	42
CCCCN1CCC(NC(=O)N(CCOC)C2CCOCC2)CC1	ZINC000875191221	EE	On-Demand	Anodyne	HTR4	35	40
C[C@H](O)c1ccc(CNC(=O)N2CCN(CCc3cnccn3)CC2)cc1	ZINC000875191228	FD	On-Demand	Anodyne	NAMPT	32	40
CCCCN1CCC(NC(=O)N2CCC(C(C)=O)CC2)CC1	ZINC000875191238	DE	On-Demand	Anodyne	EPHX2	16	40
C[C@@H](Cn1cncn1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875191245	CC	On-Demand	Anodyne	HIS3	78	39
C[C@@H](Cn1cncn1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875191246	CC	On-Demand	Anodyne	HIS3	78	39
CCCCN1CCC(NC(=O)N2CC3(CC(=O)N3Cc3ccccc3)C2)CC1	ZINC000875191260	GE	On-Demand	Anodyne	CHRM1	22	42
CCCCN1CCC(NC(=O)N2CC3(CC(=O)N3Cc3ccccc3)C2)CC1	ZINC000875191260	GE	On-Demand	Anodyne	DRD4	29	44
CCCCN1CCC(NC(=O)N2CC3(CC(=O)N3Cc3ccccc3)C2)CC1	ZINC000875191260	GE	On-Demand	Anodyne	HTR4	40	39
CCCCN1CCC(NC(=O)N2CC3(CC(=O)N3Cc3ccccc3)C2)CC1	ZINC000875191260	GE	On-Demand	Anodyne	SIGMAR1	44	45
CCCCN1CCC(NC(=O)N2CC3(CC(=O)N3Cc3ccccc3)C2)CC1	ZINC000875191260	GE	On-Demand	Anodyne	CCR3	35	42
CCCCN1CCC(NC(=O)N2CC3(CC(=O)N3Cc3ccccc3)C2)CC1	ZINC000875191260	GE	On-Demand	Anodyne	EPHX2	15	40
CCCCN1CCC(NC(=O)N2CC3(CC(=O)N3Cc3ccccc3)C2)CC1	ZINC000875191260	GE	On-Demand	Anodyne	CYP2J2	47	36
CCc1nc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)cs1	ZINC000875191276	FD	On-Demand	Anodyne	SIRT3	54	33
CCc1nc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)cs1	ZINC000875191276	FD	On-Demand	Anodyne	SIRT2	55	34
CCc1nc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)cs1	ZINC000875191276	FD	On-Demand	Anodyne	SIRT1	54	33
CCOC(=O)[C@H](C)C1CN(C(=O)NCCN2CCCc3ccccc32)C1	ZINC000875191283	FE	On-Demand	Anodyne	ACE	22	44
COC(=O)N(C)NC(=O)NCc1ccc(-c2csc(C)n2)cc1	ZINC000875191284	EF	On-Demand	Reactive	ROCK1	18	45
COC(=O)N(C)NC(=O)NCc1ccc(-c2csc(C)n2)cc1	ZINC000875191284	EF	On-Demand	Reactive	ROCK2	21	45
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)Cn1cncn1	ZINC000875191286	CC	On-Demand	Anodyne	HIS3	90	43
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)Cn1cncn1	ZINC000875191289	CC	On-Demand	Anodyne	HIS3	90	43
C[C@@H](Cn1cncn1)NC(=O)NCC[C@H](O)C1CCCC1	ZINC000875191290	CC	On-Demand	Anodyne	HIS3	79	39
C[C@@H](Cn1cncn1)NC(=O)NCC[C@@H](O)C1CCCC1	ZINC000875191292	CC	On-Demand	Anodyne	HIS3	79	39
CCCCN1CCC(NC(=O)NCc2cc(C(=O)OCC)no2)CC1	ZINC000875191303	FD	On-Demand	Anodyne	HTR4	68	42
CCCNC(=O)c1ccc(Cl)cc1NC(=O)[C@@H]1COCCN1CC	ZINC000875191304	FE	On-Demand	Anodyne	SLC6A9	44	38
CCCNC(=O)c1ccc(Cl)cc1NC(=O)[C@H]1COCCN1CC	ZINC000875191305	FE	On-Demand	Anodyne	SLC6A9	44	38
CCCNC(=O)c1ccc(Cl)cc1NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875191306	GH	On-Demand	Anodyne	SLC6A9	47	34
C[C@@H](Cn1cncn1)NC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875191311	FE	On-Demand	Mild	HIS3	77	35
C[C@@H](Cn1cncn1)NC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875191312	FE	On-Demand	Mild	HIS3	77	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)Cn2cncn2)C1	ZINC000875191331	DC	On-Demand	Anodyne	HIS3	80	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)Cn2cncn2)C1	ZINC000875191334	DC	On-Demand	Anodyne	HIS3	80	37
C[C@@H](Cn1cncn1)NC(=O)N1CCN(C)C(C)(C)CC1	ZINC000875191367	CC	On-Demand	Anodyne	HIS3	79	37
COc1cccc([C@H](CNC(=O)NCc2ccc([C@@H](C)O)cc2)OC)c1	ZINC000875191384	FF	On-Demand	Anodyne	NR3C2	15	45
COc1cccc([C@H](CNC(=O)NCc2ccc([C@@H](C)O)cc2)OC)c1	ZINC000875191384	FF	On-Demand	Anodyne	MTNR1A	32	41
COc1cccc([C@H](CNC(=O)NCc2ccc([C@@H](C)O)cc2)OC)c1	ZINC000875191384	FF	On-Demand	Anodyne	MTNR1B	33	41
COc1cccc([C@H](CNC(=O)NCc2ccc([C@@H](C)O)cc2)OC)c1	ZINC000875191384	FF	On-Demand	Anodyne	SOAT1	15	42
COc1cccc([C@H](CNC(=O)NCc2ccc([C@@H](C)O)cc2)OC)c1	ZINC000875191384	FF	On-Demand	Anodyne	PDS	47	39
CCCCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875191385	GF	On-Demand	Anodyne	HTR4	40	41
CCCCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875191385	GF	On-Demand	Anodyne	SIGMAR1	20	45
CCCCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875191385	GF	On-Demand	Anodyne	MMP13	17	42
CCCCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875191385	GF	On-Demand	Anodyne	SLC6A5	34	51
CCCCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875191385	GF	On-Demand	Anodyne	MMP9	15	40
CCCCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875191385	GF	On-Demand	Anodyne	MMP1	16	40
CCCCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875191385	GF	On-Demand	Anodyne	MCHR1	20	42
COc1cccc([C@H](CNC(=O)NCc2ccc([C@H](C)O)cc2)OC)c1	ZINC000875191386	FF	On-Demand	Anodyne	NR3C2	15	45
COc1cccc([C@H](CNC(=O)NCc2ccc([C@H](C)O)cc2)OC)c1	ZINC000875191386	FF	On-Demand	Anodyne	MTNR1A	32	41
COc1cccc([C@H](CNC(=O)NCc2ccc([C@H](C)O)cc2)OC)c1	ZINC000875191386	FF	On-Demand	Anodyne	MTNR1B	33	41
COc1cccc([C@H](CNC(=O)NCc2ccc([C@H](C)O)cc2)OC)c1	ZINC000875191386	FF	On-Demand	Anodyne	SOAT1	15	42
COc1cccc([C@H](CNC(=O)NCc2ccc([C@H](C)O)cc2)OC)c1	ZINC000875191386	FF	On-Demand	Anodyne	PDS	47	39
CCCCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875191387	GF	On-Demand	Anodyne	HTR4	40	41
CCCCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875191387	GF	On-Demand	Anodyne	SIGMAR1	20	45
CCCCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875191387	GF	On-Demand	Anodyne	MMP13	17	42
CCCCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875191387	GF	On-Demand	Anodyne	SLC6A5	34	51
CCCCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875191387	GF	On-Demand	Anodyne	MMP9	15	40
CCCCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875191387	GF	On-Demand	Anodyne	MMP1	16	40
CCCCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875191387	GF	On-Demand	Anodyne	MCHR1	20	42
C[C@@H](Cn1cncn1)NC(=O)N1CC([C@@H]2CCC[C@@H](C)C2)C1	ZINC000875191396	DE	On-Demand	Anodyne	HIS3	77	37
C[C@H](O)c1ccc(CNC(=O)Nc2cnn(C3CCN(C)CC3)c2)cc1	ZINC000875191402	FF	On-Demand	Anodyne	NAMPT	61	38
C[C@@H](Cn1cncn1)NC(=O)N1CC([C@H]2CCC[C@@H](C)C2)C1	ZINC000875191403	DE	On-Demand	Anodyne	HIS3	77	37
C[C@H](O)c1ccc(CNC(=O)N2CCC(c3nc(C4CCC4)no3)CC2)cc1	ZINC000875191416	GG	On-Demand	Anodyne	SMO	41	45
C[C@H](O)c1ccc(CNC(=O)N2CCC(c3nc(C4CCC4)no3)CC2)cc1	ZINC000875191416	GG	On-Demand	Anodyne	ETHR	62	45
C[C@H](O)c1ccc(CNC(=O)N2CCC(Oc3cccc(F)c3)CC2)cc1	ZINC000875191420	FH	On-Demand	Anodyne	PRSS2	40	31
C[C@H](O)c1ccc(CNC(=O)N2CCC(Oc3cccc(F)c3)CC2)cc1	ZINC000875191420	FH	On-Demand	Anodyne	HRH3	17	45
C[C@H](O)c1ccc(CNC(=O)N2CCC(Oc3cccc(F)c3)CC2)cc1	ZINC000875191420	FH	On-Demand	Anodyne	CCR3	60	39
C[C@H](O)c1ccc(CNC(=O)N2CCC(Oc3cccc(F)c3)CC2)cc1	ZINC000875191420	FH	On-Demand	Anodyne	CCR5	66	36
C[C@H](O)c1ccc(CNC(=O)N2CCC(Oc3cccc(F)c3)CC2)cc1	ZINC000875191420	FH	On-Demand	Anodyne	MLNR	32	50
C[C@H](O)c1ccc(CNC(=O)N2CCC(Oc3cccc(F)c3)CC2)cc1	ZINC000875191420	FH	On-Demand	Anodyne	EPHX2	24	47
C[C@H](O)c1ccc(CNC(=O)N2CCC(Oc3cccc(F)c3)CC2)cc1	ZINC000875191420	FH	On-Demand	Anodyne	SCD1	15	47
C[C@@H](Cn1cncn1)NC(=O)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875191426	ED	On-Demand	Anodyne	HIS3	67	34
O=C(NCCN1CCCc2ccccc21)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875191428	GE	On-Demand	Anodyne	SMO	35	43
O=C(NCCN1CCCc2ccccc21)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875191428	GE	On-Demand	Anodyne	ETHR	53	36
O=C(NCCN1CCCc2ccccc21)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875191431	GE	On-Demand	Anodyne	SMO	35	43
O=C(NCCN1CCCc2ccccc21)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875191431	GE	On-Demand	Anodyne	ETHR	53	36
C[C@H](O)c1ccc(CNC(=O)N2C[C@H]3C[C@@H](O)C[C@H]2C3)cc1	ZINC000875191436	DD	On-Demand	Anodyne	VHL	40	33
C[C@H](O)c1ccc(CNC(=O)N2C[C@H]3C[C@H](O)C[C@H]2C3)cc1	ZINC000875191439	DD	On-Demand	Anodyne	VHL	40	33
CCCCN1CCC(NC(=O)NN(C)C(=O)OC)CC1	ZINC000875191446	CD	On-Demand	Reactive	HTR4	37	42
CCC1(CC)CCCN1C(=O)N[C@H](C)Cn1cncn1	ZINC000875191466	CE	On-Demand	Anodyne	HIS3	81	38
CCC1(CC)CCCN1C(=O)N[C@@H](C)Cn1cncn1	ZINC000875191468	CE	On-Demand	Anodyne	HIS3	81	38
COc1cccc(C2(CNC(=O)C(=O)N3CCC(C(C)=O)CC3)CCCC2)c1	ZINC000875191473	GE	On-Demand	Anodyne	DRD4	41	32
COc1cccc(C2(CNC(=O)C(=O)N3CCC(C(C)=O)CC3)CCCC2)c1	ZINC000875191473	GE	On-Demand	Anodyne	KCNA3	44	38
COc1cccc(C2(CNC(=O)C(=O)N3CCC(C(C)=O)CC3)CCCC2)c1	ZINC000875191473	GE	On-Demand	Anodyne	MTNR1A	37	42
COc1cccc(C2(CNC(=O)C(=O)N3CCC(C(C)=O)CC3)CCCC2)c1	ZINC000875191473	GE	On-Demand	Anodyne	MTNR1B	40	42
COc1cccc(C2(CNC(=O)C(=O)N3CCC(C(C)=O)CC3)CCCC2)c1	ZINC000875191473	GE	On-Demand	Anodyne	SOAT1	17	45
CCCCN1CCC(NC(=O)NN=c2cc[nH]cc2C)CC1	ZINC000875191477	DD	On-Demand	Reactive	HTR4	35	41
C[C@H](O)c1ccc(CNC(=O)N[C@@H](C)C2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000875191478	GF	On-Demand	Anodyne	GPR119	17	40
C[C@H](O)c1ccc(CNC(=O)N[C@H](C)C2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000875191480	GF	On-Demand	Anodyne	GPR119	17	40
C[C@H](O)c1ccc(CNC(=O)NCCN2CC[C@@H](O)C2)cc1	ZINC000875191490	DC	On-Demand	Anodyne	OPRK1	21	40
C[C@H](O)c1ccc(CNC(=O)NCCN2CC[C@@H](O)C2)cc1	ZINC000875191490	DC	On-Demand	Anodyne	CCR3	21	42
C[C@H](O)c1ccc(CNC(=O)NCCN2CC[C@@H](O)C2)cc1	ZINC000875191490	DC	On-Demand	Anodyne	CCR5	19	41
C[C@H](O)c1ccc(CNC(=O)NCCN2CC[C@H](O)C2)cc1	ZINC000875191492	DC	On-Demand	Anodyne	OPRK1	21	40
C[C@H](O)c1ccc(CNC(=O)NCCN2CC[C@H](O)C2)cc1	ZINC000875191492	DC	On-Demand	Anodyne	CCR3	21	42
C[C@H](O)c1ccc(CNC(=O)NCCN2CC[C@H](O)C2)cc1	ZINC000875191492	DC	On-Demand	Anodyne	CCR5	19	41
C[C@H](O)c1ccc(CNC(=O)N2CC[C@H]3CC[C@@H](C2)S3)cc1	ZINC000875191495	DF	On-Demand	Anodyne	NAMPT	26	40
CCCCN1CCC(NC(=O)N2C[C@H](OC)CC[C@H]2C)CC1	ZINC000875191499	DE	On-Demand	Anodyne	HTR4	33	41
CCCCN1CCC(NC(=O)N2C[C@H](OC)CC[C@@H]2C)CC1	ZINC000875191500	DE	On-Demand	Anodyne	HTR4	33	41
CCCCN1CCC(NC(=O)N2C[C@@H](OC)CC[C@@H]2C)CC1	ZINC000875191501	DE	On-Demand	Anodyne	HTR4	33	41
CCCCN1CCC(NC(=O)N2C[C@@H](OC)CC[C@H]2C)CC1	ZINC000875191502	DE	On-Demand	Anodyne	HTR4	33	41
CCC1(CC)CCCN1C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875191504	EG	On-Demand	Anodyne	NOS2	102	37
COc1ccccc1[C@@H]1CSCCCN1C(=O)N[C@@H](C)Cn1cncn1	ZINC000875191507	GF	On-Demand	Anodyne	HIS3	68	37
COc1ccccc1[C@@H]1CSCCCN1C(=O)N[C@H](C)Cn1cncn1	ZINC000875191508	GF	On-Demand	Anodyne	HIS3	68	37
C[C@@H](Cn1cncn1)NC(=O)NC1(C)CCC(C)(C)CC1	ZINC000875191511	CE	On-Demand	Anodyne	HIS3	86	41
C[C@@H](Cn1cncn1)NC(=O)N1CC[C@@H](O)[C@H]1c1ccc(Br)cc1	ZINC000875191540	GD	On-Demand	Anodyne	HIS3	80	36
CCCCN1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)CC1	ZINC000875191541	DF	On-Demand	Anodyne	HTR4	15	41
CCCCN1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)CC1	ZINC000875191542	DF	On-Demand	Anodyne	HTR4	15	41
CCCCN1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)CC1	ZINC000875191543	DF	On-Demand	Anodyne	HTR4	15	41
CCCCN1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)CC1	ZINC000875191544	DF	On-Demand	Anodyne	HTR4	15	41
CO[C@@H]1C[C@@H]2CN(C(=O)N[C@H](C)Cn3cncn3)Cc3cccnc3N2C1	ZINC000875191550	FC	On-Demand	Anodyne	HIS3	44	33
CO[C@@H]1C[C@@H]2CN(C(=O)N[C@@H](C)Cn3cncn3)Cc3cccnc3N2C1	ZINC000875191551	FC	On-Demand	Anodyne	HIS3	44	33
CCCCN1CCC(NC(=O)N(C)C[C@H]2CN(c3ccccc3)C(=O)O2)CC1	ZINC000875191557	GF	On-Demand	Anodyne	CYP2J2	45	33
CCCCN1CCC(NC(=O)N(C)C[C@@H]2CN(c3ccccc3)C(=O)O2)CC1	ZINC000875191558	GF	On-Demand	Anodyne	CYP2J2	45	33
COc1ccccc1[C@H]1CCCN(C(=O)N[C@H](C)Cn2cncn2)CC1	ZINC000875191560	FF	On-Demand	Anodyne	HIS3	66	36
COc1ccccc1[C@H]1CCCN(C(=O)N[C@@H](C)Cn2cncn2)CC1	ZINC000875191561	FF	On-Demand	Anodyne	HIS3	66	36
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H](C)Cn2cncn2)CC1	ZINC000875191562	FF	On-Demand	Anodyne	HIS3	66	36
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H](C)Cn2cncn2)CC1	ZINC000875191563	FF	On-Demand	Anodyne	HIS3	66	36
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1(c2cccc(OC)c2)CCCC1	ZINC000875191568	GE	On-Demand	Mild	SOAT1	17	43
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1(c2cccc(OC)c2)CCCC1	ZINC000875191569	GE	On-Demand	Mild	SOAT1	17	43
CCCCN1CCC(NC(=O)NCc2ccc(O)c(Cl)c2)CC1	ZINC000875191581	EG	On-Demand	Anodyne	HTR4	61	45
CCCCN1CCC(NC(=O)NCc2ccc(O)c(Cl)c2)CC1	ZINC000875191581	EG	On-Demand	Anodyne	SIGMAR1	27	53
CCCCN1CCC(NC(=O)NCc2ccc(O)c(Cl)c2)CC1	ZINC000875191581	EG	On-Demand	Anodyne	CCR3	33	42
CCCCN1CCC(NC(=O)NCc2ccc(O)c(Cl)c2)CC1	ZINC000875191581	EG	On-Demand	Anodyne	SLC6A5	24	45
CCCCN1CCC(NC(=O)NCc2ccc(O)c(Cl)c2)CC1	ZINC000875191581	EG	On-Demand	Anodyne	PDK1	40	36
CCCCN1CCC(NC(=O)NCc2ccc(O)c(Cl)c2)CC1	ZINC000875191581	EG	On-Demand	Anodyne	MCHR1	32	48
C[C@@H](Cn1cncn1)NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875191582	ED	On-Demand	Anodyne	HIS3	86	44
CCCCN1CCC(NC(=O)NCC[C@H](O)C2CCCC2)CC1	ZINC000875191595	EE	On-Demand	Anodyne	EPHX2	18	50
CCCCN1CCC(NC(=O)NCC[C@@H](O)C2CCCC2)CC1	ZINC000875191596	EE	On-Demand	Anodyne	EPHX2	18	50
CCCCN1CCC(NC(=O)NCc2cc(C)ccc2O)CC1	ZINC000875191607	DF	On-Demand	Clean	SIGMAR1	16	40
CCCCN1CCC(NC(=O)NCc2cc(C)ccc2O)CC1	ZINC000875191607	DF	On-Demand	Clean	EPHX2	25	40
CCCCN1CCC(NC(=O)NCc2cc(C)ccc2O)CC1	ZINC000875191607	DF	On-Demand	Clean	MCHR1	15	46
C[C@H]1CN(C(=O)N[C@H](C)Cn2cncn2)CC[C@H](C(F)(F)F)O1	ZINC000875191622	ED	On-Demand	Anodyne	HIS3	55	35
C[C@H]1CN(C(=O)N[C@H](C)Cn2cncn2)CC[C@@H](C(F)(F)F)O1	ZINC000875191623	ED	On-Demand	Anodyne	HIS3	55	35
CCCCN1CCC(NC(=O)N2CC[C@@H]3[C@@H](CCN3C)C2)CC1	ZINC000875191624	DD	On-Demand	Anodyne	HTR4	32	40
CCCCN1CCC(NC(=O)N2CC[C@@H]3[C@H](CCN3C)C2)CC1	ZINC000875191625	DD	On-Demand	Anodyne	HTR4	32	40
CCCCN1CCC(NC(=O)N2CC[C@H]3[C@@H](CCN3C)C2)CC1	ZINC000875191626	DD	On-Demand	Anodyne	HTR4	32	40
CCCCN1CCC(NC(=O)N2CC[C@H]3[C@H](CCN3C)C2)CC1	ZINC000875191627	DD	On-Demand	Anodyne	HTR4	32	40
C[C@@H](Cn1cncn1)NC(=O)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875191646	DC	On-Demand	Anodyne	HIS3	78	35
C[C@@H](Cn1cncn1)NC(=O)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875191648	DC	On-Demand	Anodyne	HIS3	78	35
C[C@@H](Cn1cncn1)NC(=O)N[C@@H]1CC(C)(C)CC[C@H]1O	ZINC000875191653	CC	On-Demand	Anodyne	HIS3	78	36
CCCCN1CCC(NC(=O)N2CCO[C@H](c3ccc(OC)cc3)C2)CC1	ZINC000875191654	GG	On-Demand	Anodyne	HTR4	41	40
CCCCN1CCC(NC(=O)N2CCO[C@H](c3ccc(OC)cc3)C2)CC1	ZINC000875191654	GG	On-Demand	Anodyne	MCHR1	23	41
CCCCN1CCC(NC(=O)N2CCO[C@@H](c3ccc(OC)cc3)C2)CC1	ZINC000875191655	GG	On-Demand	Anodyne	HTR4	41	40
CCCCN1CCC(NC(=O)N2CCO[C@@H](c3ccc(OC)cc3)C2)CC1	ZINC000875191655	GG	On-Demand	Anodyne	MCHR1	23	41
CCOc1cc(C)ccc1NC(=O)c1c(OC)ccc(F)c1OC	ZINC000875191657	EH	On-Demand	Anodyne	KCNMA1	23	44
CCOc1cc(C)ccc1NC(=O)c1c(OC)ccc(F)c1OC	ZINC000875191657	EH	On-Demand	Anodyne	KCNK3	42	40
CCOc1cc(C)ccc1NC(=O)c1c(OC)ccc(F)c1OC	ZINC000875191657	EH	On-Demand	Anodyne	KCNK9	32	40
CCCCN1CCC(NC(=O)NNC(=O)c2ccc(=O)n(C)c2)CC1	ZINC000875191658	EC	On-Demand	Reactive	HTR4	37	40
CCCCN1CCC(NC(=O)NNC(=O)c2ccc(=O)n(C)c2)CC1	ZINC000875191658	EC	On-Demand	Reactive	SLC6A5	35	51
CCCCN1CCC(NC(=O)NNC(=O)c2ccc(=O)n(C)c2)CC1	ZINC000875191658	EC	On-Demand	Reactive	CYP2J2	48	36
COc1cccc(C2(CNC(=O)C(=O)N3CC[C@H](C(C)(C)O)C3)CCCC2)c1	ZINC000875191669	GE	On-Demand	Anodyne	DRD4	40	31
COc1cccc(C2(CNC(=O)C(=O)N3CC[C@H](C(C)(C)O)C3)CCCC2)c1	ZINC000875191669	GE	On-Demand	Anodyne	KCNA3	41	36
COc1cccc(C2(CNC(=O)C(=O)N3CC[C@H](C(C)(C)O)C3)CCCC2)c1	ZINC000875191669	GE	On-Demand	Anodyne	MTNR1A	22	40
COc1cccc(C2(CNC(=O)C(=O)N3CC[C@H](C(C)(C)O)C3)CCCC2)c1	ZINC000875191669	GE	On-Demand	Anodyne	MTNR1B	24	40
COc1cccc(C2(CNC(=O)C(=O)N3CC[C@H](C(C)(C)O)C3)CCCC2)c1	ZINC000875191669	GE	On-Demand	Anodyne	SOAT1	16	43
COc1cccc(C2(CNC(=O)C(=O)N3CC[C@@H](C(C)(C)O)C3)CCCC2)c1	ZINC000875191670	GE	On-Demand	Anodyne	DRD4	40	31
COc1cccc(C2(CNC(=O)C(=O)N3CC[C@@H](C(C)(C)O)C3)CCCC2)c1	ZINC000875191670	GE	On-Demand	Anodyne	KCNA3	41	36
COc1cccc(C2(CNC(=O)C(=O)N3CC[C@@H](C(C)(C)O)C3)CCCC2)c1	ZINC000875191670	GE	On-Demand	Anodyne	MTNR1A	22	40
COc1cccc(C2(CNC(=O)C(=O)N3CC[C@@H](C(C)(C)O)C3)CCCC2)c1	ZINC000875191670	GE	On-Demand	Anodyne	MTNR1B	24	40
COc1cccc(C2(CNC(=O)C(=O)N3CC[C@@H](C(C)(C)O)C3)CCCC2)c1	ZINC000875191670	GE	On-Demand	Anodyne	SOAT1	16	43
CCCCN1CCC(NC(=O)N(C)OCC(F)(F)F)CC1	ZINC000875191675	DE	On-Demand	Anodyne	SLC6A5	25	41
CCCCN1CCC(NC(=O)N[C@H](C)[C@@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875191676	GF	On-Demand	Anodyne	DRD2	19	40
CCCCN1CCC(NC(=O)N[C@H](C)[C@@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875191676	GF	On-Demand	Anodyne	HTR4	58	45
CCCCN1CCC(NC(=O)N[C@H](C)[C@@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875191676	GF	On-Demand	Anodyne	MCHR1	18	42
CCCCN1CCC(NC(=O)N[C@@H](C)[C@@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875191677	GF	On-Demand	Anodyne	DRD2	19	40
CCCCN1CCC(NC(=O)N[C@@H](C)[C@@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875191677	GF	On-Demand	Anodyne	HTR4	58	45
CCCCN1CCC(NC(=O)N[C@@H](C)[C@@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875191677	GF	On-Demand	Anodyne	MCHR1	18	42
CCCCN1CCC(NC(=O)N[C@H](C)[C@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875191678	GF	On-Demand	Anodyne	DRD2	19	40
CCCCN1CCC(NC(=O)N[C@H](C)[C@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875191678	GF	On-Demand	Anodyne	HTR4	58	45
CCCCN1CCC(NC(=O)N[C@H](C)[C@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875191678	GF	On-Demand	Anodyne	MCHR1	18	42
CCCCN1CCC(NC(=O)N[C@@H](C)[C@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875191679	GF	On-Demand	Anodyne	DRD2	19	40
CCCCN1CCC(NC(=O)N[C@@H](C)[C@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875191679	GF	On-Demand	Anodyne	HTR4	58	45
CCCCN1CCC(NC(=O)N[C@@H](C)[C@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875191679	GF	On-Demand	Anodyne	MCHR1	18	42
CCCCN1CCC(NC(=O)NC(C)(C)C(O)(CC)CC)CC1	ZINC000875191681	EF	On-Demand	Anodyne	EPHX2	23	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(-c2csc(C)n2)cc1	ZINC000875191682	EG	On-Demand	Anodyne	ROCK1	19	44
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(-c2csc(C)n2)cc1	ZINC000875191682	EG	On-Demand	Anodyne	ROCK2	17	44
CCCCN1CCC(NC(=O)N2CCC[C@H](C(C)=O)C2)CC1	ZINC000875191686	DE	On-Demand	Anodyne	HTR4	42	41
CCCCN1CCC(NC(=O)N2CCC[C@@H](C(C)=O)C2)CC1	ZINC000875191687	DE	On-Demand	Anodyne	HTR4	42	41
CCCCN1CCC(NC(=O)N2CC(O)(C(=O)OC)C2)CC1	ZINC000875191692	DC	On-Demand	Anodyne	HTR4	33	41
CCOC1CC2(C1)C[C@@H]2NC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875191697	EE	On-Demand	Anodyne	NOS2	95	35
CCOC1CC2(C1)C[C@H]2NC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875191698	EE	On-Demand	Anodyne	NOS2	95	35
C[C@@H](Cn1cncn1)NC(=O)NNc1cccc(F)c1Cl	ZINC000875191710	DD	On-Demand	Reactive	HIS3	81	37
C#C[C@@H]1CC[C@@H](NC(=O)NCc2ccnc(-n3ccnc3)c2)CC1	ZINC000875191713	DE	On-Demand	Mild	NOS2	99	38
C[C@@H](Cn1cncn1)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875191721	FD	On-Demand	Anodyne	HIS3	86	41
CCO[C@@H](C(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1)[C@@H]1CCOC1	ZINC000875191722	GE	On-Demand	Anodyne	LPL	48	39
CCO[C@@H](C(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1)[C@@H]1CCOC1	ZINC000875191722	GE	On-Demand	Anodyne	KCNQ2	50	34
CCO[C@@H](C(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1)[C@H]1CCOC1	ZINC000875191723	GE	On-Demand	Anodyne	LPL	48	39
CCO[C@@H](C(=O)Nc1ccccc1S(=O)(=O)N1CCCCC1)[C@H]1CCOC1	ZINC000875191723	GE	On-Demand	Anodyne	KCNQ2	50	34
CCCCN1CCC(NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CC1	ZINC000875191733	ED	On-Demand	Anodyne	HTR4	29	40
CCCCN1CCC(NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CC1	ZINC000875191733	ED	On-Demand	Anodyne	SLC6A5	15	42
CCCCN1CCC(NC(=O)N2Cc3cccnc3N3C[C@H](O)C[C@H]3C2)CC1	ZINC000875191734	GD	On-Demand	Anodyne	HTR4	15	43
CCOC(=O)[C@@H]1CN(C(=O)N[C@H](C)Cn2cncn2)CCC1(F)F	ZINC000875191736	EC	On-Demand	Anodyne	HIS3	59	33
CCOC(=O)[C@@H]1CN(C(=O)N[C@@H](C)Cn2cncn2)CCC1(F)F	ZINC000875191737	EC	On-Demand	Anodyne	HIS3	59	33
CCCCN1CCC(NC(=O)NC2CC(C(=O)OC)C2)CC1	ZINC000875191740	DD	On-Demand	Anodyne	HTR4	46	44
CCCCN1CCC(NC(=O)NC2CC(C(=O)OC)C2)CC1	ZINC000875191740	DD	On-Demand	Anodyne	EPHX2	31	41
C[C@@H](Cn1cncn1)NC(=O)NC1([C@H]2CCCCO2)CCC1	ZINC000875191748	DD	On-Demand	Anodyne	HIS3	56	39
C[C@@H](Cn1cncn1)NC(=O)NC1([C@@H]2CCCCO2)CCC1	ZINC000875191749	DD	On-Demand	Anodyne	HIS3	56	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875191751	FD	On-Demand	Anodyne	NOS2	99	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875191752	FD	On-Demand	Anodyne	NOS2	99	38
C[C@@H](Cn1cncn1)NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875191754	DD	On-Demand	Anodyne	HIS3	82	39
C=CC(C)(C)CCCNC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000875191757	EG	On-Demand	Mild	NOS2	82	33
CCCCN1CCC(NC(=O)NC[C@H]2C[C@H](O)C2)CC1	ZINC000875191758	CD	On-Demand	Anodyne	EPHX2	22	44
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1cc(C(=O)NC(C)C)ccc1Cl	ZINC000875191761	GI	On-Demand	Anodyne	TAAR1	24	40
C[C@@H](Cn1cncn1)NC(=O)N1CCCCCCNC(=O)CC1	ZINC000875191769	DC	On-Demand	Anodyne	HIS3	76	34
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1CC12CCC2	ZINC000875191770	CE	On-Demand	Anodyne	NOS2	104	40
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H]1CC12CCC2	ZINC000875191771	CE	On-Demand	Anodyne	NOS2	104	40
CC(C)(C)OC(=O)C1CC(NC(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000875191786	FE	On-Demand	Anodyne	NOS2	95	37
CCCCN1CCC(NC(=O)N2CCO[C@H](c3ccccc3OC)C2)CC1	ZINC000875191787	GG	On-Demand	Anodyne	HTR1A	50	40
CCCCN1CCC(NC(=O)N2CCO[C@H](c3ccccc3OC)C2)CC1	ZINC000875191787	GG	On-Demand	Anodyne	CHRM1	15	41
CCCCN1CCC(NC(=O)N2CCO[C@H](c3ccccc3OC)C2)CC1	ZINC000875191787	GG	On-Demand	Anodyne	DRD2	55	47
CCCCN1CCC(NC(=O)N2CCO[C@H](c3ccccc3OC)C2)CC1	ZINC000875191787	GG	On-Demand	Anodyne	DRD4	41	40
CCCCN1CCC(NC(=O)N2CCO[C@H](c3ccccc3OC)C2)CC1	ZINC000875191787	GG	On-Demand	Anodyne	HTR2A	23	40
CCCCN1CCC(NC(=O)N2CCO[C@H](c3ccccc3OC)C2)CC1	ZINC000875191787	GG	On-Demand	Anodyne	DRD3	56	40
CCCCN1CCC(NC(=O)N2CCO[C@H](c3ccccc3OC)C2)CC1	ZINC000875191787	GG	On-Demand	Anodyne	HTR4	67	43
CCCCN1CCC(NC(=O)N2CCO[C@H](c3ccccc3OC)C2)CC1	ZINC000875191787	GG	On-Demand	Anodyne	HTR7	43	38
CCCCN1CCC(NC(=O)N2CCO[C@H](c3ccccc3OC)C2)CC1	ZINC000875191787	GG	On-Demand	Anodyne	SIGMAR1	29	41
CCCCN1CCC(NC(=O)N2CCO[C@@H](c3ccccc3OC)C2)CC1	ZINC000875191788	GG	On-Demand	Anodyne	HTR1A	50	40
CCCCN1CCC(NC(=O)N2CCO[C@@H](c3ccccc3OC)C2)CC1	ZINC000875191788	GG	On-Demand	Anodyne	CHRM1	15	41
CCCCN1CCC(NC(=O)N2CCO[C@@H](c3ccccc3OC)C2)CC1	ZINC000875191788	GG	On-Demand	Anodyne	DRD2	55	47
CCCCN1CCC(NC(=O)N2CCO[C@@H](c3ccccc3OC)C2)CC1	ZINC000875191788	GG	On-Demand	Anodyne	DRD4	41	40
CCCCN1CCC(NC(=O)N2CCO[C@@H](c3ccccc3OC)C2)CC1	ZINC000875191788	GG	On-Demand	Anodyne	HTR2A	23	40
CCCCN1CCC(NC(=O)N2CCO[C@@H](c3ccccc3OC)C2)CC1	ZINC000875191788	GG	On-Demand	Anodyne	DRD3	56	40
CCCCN1CCC(NC(=O)N2CCO[C@@H](c3ccccc3OC)C2)CC1	ZINC000875191788	GG	On-Demand	Anodyne	HTR4	67	43
CCCCN1CCC(NC(=O)N2CCO[C@@H](c3ccccc3OC)C2)CC1	ZINC000875191788	GG	On-Demand	Anodyne	HTR7	43	38
CCCCN1CCC(NC(=O)N2CCO[C@@H](c3ccccc3OC)C2)CC1	ZINC000875191788	GG	On-Demand	Anodyne	SIGMAR1	29	41
O=C(COC(=O)COCc1ccnc(O)c1)N[C@H]1CCCc2ccccc21	ZINC000875191798	FE	On-Demand	Anodyne	BDKRB1	42	35
O=C(COC(=O)COCc1ccnc(O)c1)N[C@@H]1CCCc2ccccc21	ZINC000875191799	FE	On-Demand	Anodyne	BDKRB1	42	35
O=C(NCCCc1ccc(Cl)cc1)N1CCC(CO)(CO)CC1	ZINC000875191814	EE	On-Demand	Anodyne	EPHX2	16	52
COC(=O)c1ccc(CC(=O)OCC(=O)N[C@H]2CCCc3ccccc32)cn1	ZINC000875191815	GE	On-Demand	Anodyne	BDKRB1	42	36
COC(=O)c1ccc(CC(=O)OCC(=O)N[C@@H]2CCCc3ccccc32)cn1	ZINC000875191816	GE	On-Demand	Anodyne	BDKRB1	42	36
CN1CCN(C2CCN(C(=O)N[C@H]3CCc4ccccc4C3)CC2)CC1	ZINC000875191827	FD	On-Demand	Anodyne	EPHX2	19	52
CN1CCN(C2CCN(C(=O)N[C@H]3CCc4ccccc4C3)CC2)CC1	ZINC000875191827	FD	On-Demand	Anodyne	L3MBTL3	77	43
CN1CCN(C2CCN(C(=O)N[C@@H]3CCc4ccccc4C3)CC2)CC1	ZINC000875191828	FD	On-Demand	Anodyne	EPHX2	19	52
CN1CCN(C2CCN(C(=O)N[C@@H]3CCc4ccccc4C3)CC2)CC1	ZINC000875191828	FD	On-Demand	Anodyne	L3MBTL3	77	43
CC(=O)[C@H]1CCCN(C(=O)NCCN2CCCc3ccccc32)C1	ZINC000875191831	EE	On-Demand	Anodyne	SLC6A1	43	32
CC(=O)[C@@H]1CCCN(C(=O)NCCN2CCCc3ccccc32)C1	ZINC000875191832	EE	On-Demand	Anodyne	SLC6A1	43	32
O=C(NCc1ccnc(Oc2ccc(F)cc2)c1)N1CCC(CO)(CO)CC1	ZINC000875191850	GE	On-Demand	Anodyne	S1PR2	28	44
O=C(CNC(=O)N1CCC(CO)(CO)CC1)N1CCN(c2ccccc2)CC1	ZINC000875191860	GC	On-Demand	Anodyne	ADAM10	36	41
O=C(NCCN1CCCc2ccccc21)NCc1ccnc(F)c1	ZINC000875191871	EE	On-Demand	Anodyne	AVPR2	21	42
CS[C@@H]1C[C@@H](NC(=O)NCC(=O)N2CCN(c3ccccc3)CC2)C1	ZINC000875191879	FD	On-Demand	Anodyne	ADAM10	34	40
O=C(N[C@@H](Cc1ccccc1)CN1CCOCC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875191880	GD	On-Demand	Anodyne	CTSS	17	45
O=C(N[C@H](Cc1ccccc1)CN1CCOCC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875191881	GD	On-Demand	Anodyne	CTSS	17	45
CC(=O)C1CCN(C(=O)NCC(=O)N2CCN(c3ccccc3)CC2)CC1	ZINC000875191883	FD	On-Demand	Anodyne	HTR1A	17	45
CC(=O)C1CCN(C(=O)NCC(=O)N2CCN(c3ccccc3)CC2)CC1	ZINC000875191883	FD	On-Demand	Anodyne	SSTR1	40	37
CC(=O)C1CCN(C(=O)NCC(=O)N2CCN(c3ccccc3)CC2)CC1	ZINC000875191883	FD	On-Demand	Anodyne	ADAM10	37	44
O=C(NCCO)C1CCN(C(=O)NCC2(c3ccc(F)cc3)CCC2)CC1	ZINC000875191899	GD	On-Demand	Anodyne	CACNA1G	42	60
O=C(N[C@H]1CCc2ccccc2C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875191905	EH	On-Demand	Anodyne	PREP	38	40
O=C(N[C@H]1CCc2ccccc2C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875191905	EH	On-Demand	Anodyne	EPHX2	23	51
O=C(N[C@H]1CCc2ccccc2C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875191906	EH	On-Demand	Anodyne	PREP	38	40
O=C(N[C@H]1CCc2ccccc2C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875191906	EH	On-Demand	Anodyne	EPHX2	23	51
O=C(N[C@@H]1CCc2ccccc2C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875191907	EH	On-Demand	Anodyne	PREP	38	40
O=C(N[C@@H]1CCc2ccccc2C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875191907	EH	On-Demand	Anodyne	EPHX2	23	51
O=C(N[C@@H]1CCc2ccccc2C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875191908	EH	On-Demand	Anodyne	PREP	38	40
O=C(N[C@@H]1CCc2ccccc2C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875191908	EH	On-Demand	Anodyne	EPHX2	23	51
O=CN1CCCN(C(=O)NCc2cccc(Cn3cnc4ccccc43)c2)CC1	ZINC000875191917	GE	On-Demand	Anodyne	NR1I2	44	37
O=C(CNC(=O)N1Cc2cccc(O)c2C1)N1CCN(c2ccccc2)CC1	ZINC000875191928	GD	On-Demand	Clean	HTR7	19	40
O=C(CNC(=O)N1Cc2cccc(O)c2C1)N1CCN(c2ccccc2)CC1	ZINC000875191928	GD	On-Demand	Clean	ADAM10	34	42
O=CN1CCCN(C(=O)NCC(=O)N2CCN(c3ccccc3)CC2)CC1	ZINC000875191942	FC	On-Demand	Anodyne	ADAM10	33	44
CC[C@H](C[C@H](C)O)NC(=O)NCCc1c[nH]c2cc(C)ccc12	ZINC000875191947	DF	On-Demand	Anodyne	GRPR	50	31
CC[C@H](C[C@H](C)O)NC(=O)NCC(=O)N1CCN(c2ccccc2)CC1	ZINC000875191954	FD	On-Demand	Anodyne	RIR1_HHV11	24	41
O=C(NCC(=O)N1CCN(c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875191955	EC	On-Demand	Anodyne	ADAM10	36	43
O=C(N[C@H]1CC12CCC2)C(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	ZINC000875191956	FD	On-Demand	Anodyne	TACR2	62	40
O=C(N[C@H](Cc1ccccc1)CN1CCOCC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875191957	FD	On-Demand	Anodyne	TACR2	62	40
O=C(N[C@@H](Cc1ccccc1)CN1CCOCC1)C(=O)N[C@H]1CC12CCC2	ZINC000875191958	FD	On-Demand	Anodyne	TACR2	62	40
O=C(N[C@@H](Cc1ccccc1)CN1CCOCC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875191959	FD	On-Demand	Anodyne	TACR2	62	40
CO[C@@H]1CC[C@@H](C)N(C(=O)NCC(=O)N2CCN(c3ccccc3)CC2)C1	ZINC000875191982	FD	On-Demand	Anodyne	HTR1A	20	40
CN1CCN(C2CCN(C(=O)NCC3(c4ccc(F)cc4)CCC3)CC2)CC1	ZINC000875191988	GF	On-Demand	Anodyne	HTR1F	42	33
CN1CCN(C2CCN(C(=O)NCC3(c4ccc(F)cc4)CCC3)CC2)CC1	ZINC000875191988	GF	On-Demand	Anodyne	CACNA1G	18	48
CN1CCN(C2CCN(C(=O)NCC3(c4ccc(F)cc4)CCC3)CC2)CC1	ZINC000875191988	GF	On-Demand	Anodyne	SMO	15	41
CN1CCN(C2CCN(C(=O)NCC3(c4ccc(F)cc4)CCC3)CC2)CC1	ZINC000875191988	GF	On-Demand	Anodyne	L3MBTL3	77	42
COC(=O)C1(O)CN(C(=O)NCC2(c3ccc(F)cc3)CCC2)C1	ZINC000875191989	ED	On-Demand	Anodyne	KCNA3	44	34
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	ZINC000875192005	GC	On-Demand	Mild	PSMB8	44	36
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	ZINC000875192006	GC	On-Demand	Mild	PSMB8	44	36
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	ZINC000875192007	GC	On-Demand	Mild	PSMB8	44	36
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	ZINC000875192008	GC	On-Demand	Mild	PSMB8	44	36
O=C(NCC(=O)N1CCN(c2ccccc2)CC1)NCc1ncc(Cl)s1	ZINC000875192017	GD	On-Demand	Anodyne	MAPK1	17	40
O=C(NCC(=O)N1CCN(c2ccccc2)CC1)NCc1ncc(Cl)s1	ZINC000875192017	GD	On-Demand	Anodyne	ADAM10	27	40
CC(=O)Nc1cc(NC(=O)c2cnn(-c3ccccc3)n2)ccc1F	ZINC000875192032	EF	On-Demand	Anodyne	GRM4	51	41
O=CN1CCCN(C(=O)NCCCc2ccc(Cl)cc2)CC1	ZINC000875192039	DE	On-Demand	Anodyne	EPHX2	15	50
O=CN1CCCN(C(=O)NCCCc2ccc(Cl)cc2)CC1	ZINC000875192039	DE	On-Demand	Anodyne	DPP7	44	39
CCO[C@@H](C(=O)Oc1cccc([N+](=O)[O-])c1C)C(C)C	ZINC000875192057	CF	On-Demand	Bother	COLA	48	31
O=C(NCC(=O)N1CCN(c2ccccc2)CC1)N[C@@H]1C[C@H]1C1CCOCC1	ZINC000875192071	GD	On-Demand	Anodyne	ADAM10	34	44
COCC1CC(NC(=O)NCC(=O)N2CCN(c3ccccc3)CC2)C1	ZINC000875192074	FD	On-Demand	Anodyne	EPHX2	16	40
COCC1CC(NC(=O)NCC(=O)N2CCN(c3ccccc3)CC2)C1	ZINC000875192074	FD	On-Demand	Anodyne	ADAM10	36	41
CN1CCN(C2CCN(C(=O)NCCN3CCCc4ccccc43)CC2)CC1	ZINC000875192094	GD	On-Demand	Anodyne	L3MBTL3	77	42
Cn1nnnc1C1CCN(C(=O)NCC2(c3ccc(F)cc3)CCC2)CC1	ZINC000875192099	FE	On-Demand	Anodyne	CCR3	55	35
Cn1nnnc1C1CCN(C(=O)NCC2(c3ccc(F)cc3)CCC2)CC1	ZINC000875192099	FE	On-Demand	Anodyne	SMO	15	41
CC(=O)[C@H]1CCCN(C(=O)NCC2(c3ccc(F)cc3)CCC2)C1	ZINC000875192112	EG	On-Demand	Anodyne	CACNA1G	36	52
CC(=O)[C@@H]1CCCN(C(=O)NCC2(c3ccc(F)cc3)CCC2)C1	ZINC000875192113	EG	On-Demand	Anodyne	CACNA1G	36	52
CC(=O)C1CCN(C(=O)NCc2cccc(Cn3cnc4ccccc43)c2)CC1	ZINC000875192114	GH	On-Demand	Anodyne	NR1I2	48	37
COC(=O)C1(O)CN(C(=O)NCc2cccc(Cn3cnc4ccccc43)c2)C1	ZINC000875192150	GD	On-Demand	Anodyne	CCR4	43	32
COC(=O)C1(O)CN(C(=O)NCc2cccc(Cn3cnc4ccccc43)c2)C1	ZINC000875192150	GD	On-Demand	Anodyne	NR1I2	44	36
O=C1OC[C@H]2CN(C(=O)NCc3cccc(Cn4cnc5ccccc54)c3)C[C@@H]12	ZINC000875192157	GE	On-Demand	Anodyne	NR1I2	41	36
O=C(NCC(=O)N1CCN(c2ccccc2)CC1)N[C@H]1CC12CCC2	ZINC000875192166	ED	On-Demand	Anodyne	ADAM10	38	43
O=C(NCC(=O)N1CCN(c2ccccc2)CC1)N[C@@H]1CC12CCC2	ZINC000875192167	ED	On-Demand	Anodyne	ADAM10	38	43
O=C(NCCO)C1CCN(C(=O)NCCCc2ccc(Cl)cc2)CC1	ZINC000875192180	FD	On-Demand	Anodyne	SCNN1A	42	32
O=C(NCCO)C1CCN(C(=O)NCCCc2ccc(Cl)cc2)CC1	ZINC000875192180	FD	On-Demand	Anodyne	EPHX2	21	48
O=C(NCCO)C1CCN(C(=O)NCCCc2ccc(Cl)cc2)CC1	ZINC000875192180	FD	On-Demand	Anodyne	GPBAR1	16	44
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCc2c[nH]c3cc(C)ccc23)C1	ZINC000875192182	EG	On-Demand	Anodyne	NQO2	30	42
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCc2c[nH]c3cc(C)ccc23)C1	ZINC000875192182	EG	On-Demand	Anodyne	MTNR1A	20	43
CN1CC[C@H]2CN(C(=O)NCC(=O)N3CCN(c4ccccc4)CC3)CC[C@@H]21	ZINC000875192188	GD	On-Demand	Anodyne	HTR1A	18	41
CN1CC[C@H]2CN(C(=O)NCC(=O)N3CCN(c4ccccc4)CC3)CC[C@@H]21	ZINC000875192188	GD	On-Demand	Anodyne	DRD3	17	44
CN1CC[C@H]2CN(C(=O)NCC(=O)N3CCN(c4ccccc4)CC3)CC[C@@H]21	ZINC000875192188	GD	On-Demand	Anodyne	SSTR1	58	35
CN1CC[C@H]2CN(C(=O)NCC(=O)N3CCN(c4ccccc4)CC3)CC[C@@H]21	ZINC000875192188	GD	On-Demand	Anodyne	ADAM10	36	45
CN1CC[C@H]2CN(C(=O)NCC(=O)N3CCN(c4ccccc4)CC3)CC[C@H]21	ZINC000875192191	GD	On-Demand	Anodyne	HTR1A	18	41
CN1CC[C@H]2CN(C(=O)NCC(=O)N3CCN(c4ccccc4)CC3)CC[C@H]21	ZINC000875192191	GD	On-Demand	Anodyne	DRD3	17	44
CN1CC[C@H]2CN(C(=O)NCC(=O)N3CCN(c4ccccc4)CC3)CC[C@H]21	ZINC000875192191	GD	On-Demand	Anodyne	SSTR1	58	35
CN1CC[C@H]2CN(C(=O)NCC(=O)N3CCN(c4ccccc4)CC3)CC[C@H]21	ZINC000875192191	GD	On-Demand	Anodyne	ADAM10	36	45
CC(=O)C1CCN(C(=O)NCC2(c3ccc(F)cc3)CCC2)CC1	ZINC000875192200	EG	On-Demand	Anodyne	KCNA3	41	36
CC(=O)C1CCN(C(=O)NCC2(c3ccc(F)cc3)CCC2)CC1	ZINC000875192200	EG	On-Demand	Anodyne	CACNA1G	40	56
CC(=O)C1CCN(C(=O)NCC2(c3ccc(F)cc3)CCC2)CC1	ZINC000875192200	EG	On-Demand	Anodyne	SMO	15	41
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCc3ccccc3C2)CC1	ZINC000875192205	ED	On-Demand	Anodyne	EPHX2	24	49
CC(=O)Nc1cc(NC(=O)c2ccccc2NC(=O)c2ccccc2Br)ccc1F	ZINC000875192212	JK	On-Demand	Anodyne	F10	15	41
CC(=O)Nc1cc(NC(=O)c2ccccc2NC(=O)c2ccccc2Br)ccc1F	ZINC000875192212	JK	On-Demand	Anodyne	GRM4	27	41
CC(=O)Nc1cc(NC(=O)c2ccccc2NC(=O)c2ccccc2Br)ccc1F	ZINC000875192212	JK	On-Demand	Anodyne	NR1H4	18	52
CC(=O)Nc1cc(NC(=O)c2ccccc2NC(=O)c2ccccc2Br)ccc1F	ZINC000875192212	JK	On-Demand	Anodyne	NR2E3	44	35
CC(=O)Nc1cc(NC(=O)c2ccccc2NC(=O)c2ccccc2Br)ccc1F	ZINC000875192212	JK	On-Demand	Anodyne	Q25615_ONCVO	60	35
CC(=O)Nc1cc(NC(=O)c2ccccc2NC(=O)c2ccccc2Br)ccc1F	ZINC000875192212	JK	On-Demand	Anodyne	KCNK3	68	37
CC(=O)Nc1cc(NC(=O)c2ccccc2NC(=O)c2ccccc2Br)ccc1F	ZINC000875192212	JK	On-Demand	Anodyne	KCNK9	64	37
C#CC[C@@H](CCOC)NC(=O)NCC(=O)N1CCN(c2ccccc2)CC1	ZINC000875192218	FD	On-Demand	Mild	P2RY12	51	33
C#CC[C@H](CCOC)NC(=O)NCC(=O)N1CCN(c2ccccc2)CC1	ZINC000875192219	FD	On-Demand	Mild	P2RY12	51	33
C#C[C@@H]1CC[C@@H](NC(=O)NCC(=O)N2CCN(c3ccccc3)CC2)CC1	ZINC000875192222	FD	On-Demand	Mild	EPHX2	20	42
C#C[C@@H]1CC[C@@H](NC(=O)NCC(=O)N2CCN(c3ccccc3)CC2)CC1	ZINC000875192222	FD	On-Demand	Mild	ADAM10	33	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCc2ccc(Cl)cc2)C1	ZINC000875192235	FG	On-Demand	Anodyne	MMP2	42	35
CC(=O)[C@H]1CCCN(C(=O)NCc2cccc(Cn3cnc4ccccc43)c2)C1	ZINC000875192250	GH	On-Demand	Anodyne	NR1I2	43	36
CC(=O)[C@@H]1CCCN(C(=O)NCc2cccc(Cn3cnc4ccccc43)c2)C1	ZINC000875192251	GH	On-Demand	Anodyne	NR1I2	43	36
CONC(=O)C1CCN(C(=O)NCC2(c3ccc(F)cc3)CCC2)CC1	ZINC000875192279	FE	On-Demand	Anodyne	KCNA3	44	35
CONC(=O)C1CCN(C(=O)NCC2(c3ccc(F)cc3)CCC2)CC1	ZINC000875192279	FE	On-Demand	Anodyne	CACNA1G	42	56
CONC(=O)C1CCN(C(=O)NCCc2c[nH]c3cc(C)ccc23)CC1	ZINC000875192287	FE	On-Demand	Anodyne	MTNR1A	20	47
Cc1nccnc1[C@H](C)NC(=O)NCC(=O)N1CCN(c2ccccc2)CC1	ZINC000875192313	GD	On-Demand	Anodyne	PTAFR	29	40
Cc1nccnc1[C@H](C)NC(=O)NCC(=O)N1CCN(c2ccccc2)CC1	ZINC000875192313	GD	On-Demand	Anodyne	PRNP	45	35
Cc1nccnc1[C@@H](C)NC(=O)NCC(=O)N1CCN(c2ccccc2)CC1	ZINC000875192314	GD	On-Demand	Anodyne	PTAFR	29	40
Cc1nccnc1[C@@H](C)NC(=O)NCC(=O)N1CCN(c2ccccc2)CC1	ZINC000875192314	GD	On-Demand	Anodyne	PRNP	45	35
CCOC(=O)c1cc(CNC(=O)NCCN2CCCc3ccccc32)on1	ZINC000875192321	FE	On-Demand	Anodyne	AVPR2	19	43
CC(=O)[C@H]1CCCN(C(=O)NCC(=O)N2CCN(c3ccccc3)CC2)C1	ZINC000875192365	FD	On-Demand	Anodyne	HTR1A	17	42
CC(=O)[C@H]1CCCN(C(=O)NCC(=O)N2CCN(c3ccccc3)CC2)C1	ZINC000875192365	FD	On-Demand	Anodyne	SLC6A1	82	37
CC(=O)[C@H]1CCCN(C(=O)NCC(=O)N2CCN(c3ccccc3)CC2)C1	ZINC000875192365	FD	On-Demand	Anodyne	ITGA4	24	40
CC(=O)[C@H]1CCCN(C(=O)NCC(=O)N2CCN(c3ccccc3)CC2)C1	ZINC000875192365	FD	On-Demand	Anodyne	PREP	46	41
CC(=O)[C@H]1CCCN(C(=O)NCC(=O)N2CCN(c3ccccc3)CC2)C1	ZINC000875192365	FD	On-Demand	Anodyne	ADAM10	44	49
CC(=O)[C@@H]1CCCN(C(=O)NCC(=O)N2CCN(c3ccccc3)CC2)C1	ZINC000875192366	FD	On-Demand	Anodyne	HTR1A	17	42
CC(=O)[C@@H]1CCCN(C(=O)NCC(=O)N2CCN(c3ccccc3)CC2)C1	ZINC000875192366	FD	On-Demand	Anodyne	SLC6A1	82	37
CC(=O)[C@@H]1CCCN(C(=O)NCC(=O)N2CCN(c3ccccc3)CC2)C1	ZINC000875192366	FD	On-Demand	Anodyne	ITGA4	24	40
CC(=O)[C@@H]1CCCN(C(=O)NCC(=O)N2CCN(c3ccccc3)CC2)C1	ZINC000875192366	FD	On-Demand	Anodyne	PREP	46	41
CC(=O)[C@@H]1CCCN(C(=O)NCC(=O)N2CCN(c3ccccc3)CC2)C1	ZINC000875192366	FD	On-Demand	Anodyne	ADAM10	44	49
CC(=O)[C@H]1CCCN(C(=O)NCCc2c[nH]c3cc(C)ccc23)C1	ZINC000875192376	EG	On-Demand	Anodyne	HTR1D	33	40
CC(=O)[C@H]1CCCN(C(=O)NCCc2c[nH]c3cc(C)ccc23)C1	ZINC000875192376	EG	On-Demand	Anodyne	HTR1B	30	40
CC(=O)[C@H]1CCCN(C(=O)NCCc2c[nH]c3cc(C)ccc23)C1	ZINC000875192376	EG	On-Demand	Anodyne	MTNR1A	15	40
CC(=O)[C@@H]1CCCN(C(=O)NCCc2c[nH]c3cc(C)ccc23)C1	ZINC000875192377	EG	On-Demand	Anodyne	HTR1D	33	40
CC(=O)[C@@H]1CCCN(C(=O)NCCc2c[nH]c3cc(C)ccc23)C1	ZINC000875192377	EG	On-Demand	Anodyne	HTR1B	30	40
CC(=O)[C@@H]1CCCN(C(=O)NCCc2c[nH]c3cc(C)ccc23)C1	ZINC000875192377	EG	On-Demand	Anodyne	MTNR1A	15	40
C#CC[C@@H](COC)NC(=O)NCc1cccc(Cn2cnc3ccccc32)c1	ZINC000875192394	GF	On-Demand	Mild	NR1I2	41	35
C#CC[C@H](COC)NC(=O)NCc1cccc(Cn2cnc3ccccc32)c1	ZINC000875192395	GF	On-Demand	Mild	NR1I2	41	35
O=C(NCc1cccc(Cn2cnc3ccccc32)c1)NC[C@H]1C[C@H](O)C1	ZINC000875192396	FF	On-Demand	Anodyne	NR1I2	46	40
COCC1CC(NC(=O)NCc2cccc(Cn3cnc4ccccc43)c2)C1	ZINC000875192405	GG	On-Demand	Anodyne	CCR4	46	33
COCC1CC(NC(=O)NCc2cccc(Cn3cnc4ccccc43)c2)C1	ZINC000875192405	GG	On-Demand	Anodyne	NR1I2	43	36
CCCCCCCNC(=O)C(=O)NCc1ccc(N(C)S(C)(=O)=O)cc1	ZINC000875192455	GD	On-Demand	Mild	S1PR2	40	37
CCCCCCCNC(=O)C(=O)NCc1ccc(N(C)S(C)(=O)=O)cc1	ZINC000875192455	GD	On-Demand	Mild	ASAH1	76	36
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cccc([N+](=O)[O-])c1C	ZINC000875192484	DE	On-Demand	Bother	COLA	81	32
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cccc([N+](=O)[O-])c1C	ZINC000875192484	DE	On-Demand	Bother	CAPNS1	41	31
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cccc([N+](=O)[O-])c1C	ZINC000875192484	DE	On-Demand	Bother	NPR	18	41
COc1ccccc1[C@H]1CCCN(C(=O)NCCn2ccnc2C)CC1	ZINC000875192492	FG	On-Demand	Anodyne	HTR1A	21	40
COc1ccccc1[C@H]1CCCN(C(=O)NCCn2ccnc2C)CC1	ZINC000875192492	FG	On-Demand	Anodyne	DRD2	19	42
COc1ccccc1[C@H]1CCCN(C(=O)NCCn2ccnc2C)CC1	ZINC000875192492	FG	On-Demand	Anodyne	ACKR3	62	31
COc1ccccc1[C@@H]1CCCN(C(=O)NCCn2ccnc2C)CC1	ZINC000875192493	FG	On-Demand	Anodyne	HTR1A	21	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCCn2ccnc2C)CC1	ZINC000875192493	FG	On-Demand	Anodyne	DRD2	19	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCCn2ccnc2C)CC1	ZINC000875192493	FG	On-Demand	Anodyne	ACKR3	62	31
COC(=O)N(C)NC(=O)NCC1(c2ccc(F)cc2)CCC1	ZINC000875192500	DE	On-Demand	Reactive	KCNA3	45	36
COC(=O)N(C)NC(=O)NCC(=O)N1CCN(c2ccccc2)CC1	ZINC000875192501	EC	On-Demand	Reactive	HTR1A	17	40
COC(=O)N(C)NC(=O)NCCc1c[nH]c2cc(C)ccc12	ZINC000875192520	DD	On-Demand	Reactive	NQO2	31	47
COC(=O)N(C)NC(=O)NCCc1c[nH]c2cc(C)ccc12	ZINC000875192520	DD	On-Demand	Reactive	MPO	41	34
COC(=O)N(C)NC(=O)NCCc1c[nH]c2cc(C)ccc12	ZINC000875192520	DD	On-Demand	Reactive	MTNR1A	41	49
COC(=O)N(C)NC(=O)NCCc1c[nH]c2cc(C)ccc12	ZINC000875192520	DD	On-Demand	Reactive	MTNR1B	20	47
CC(=O)C1CCN(C(=O)NCCc2c[nH]c3cc(C)ccc23)CC1	ZINC000875192523	EG	On-Demand	Anodyne	MTNR1A	15	42
O=C(CNC(=O)N1CC[C@H]2CSC[C@H]2C1)N1CCN(c2ccccc2)CC1	ZINC000875192552	GD	On-Demand	Anodyne	ADAM10	34	42
O=C(CNC(=O)N1CC[C@@H]2CSC[C@H]2C1)N1CCN(c2ccccc2)CC1	ZINC000875192553	GD	On-Demand	Anodyne	ADAM10	34	42
O=C(CNC(=O)N1CC[C@H]2CSC[C@@H]2C1)N1CCN(c2ccccc2)CC1	ZINC000875192554	GD	On-Demand	Anodyne	ADAM10	34	42
O=C(CNC(=O)N1CC[C@@H]2CSC[C@@H]2C1)N1CCN(c2ccccc2)CC1	ZINC000875192555	GD	On-Demand	Anodyne	ADAM10	34	42
Cc1cccc2c1OCC[C@@H]2NC(=O)Nc1cnn(C2CCN(C)CC2)c1	ZINC000875192616	FG	On-Demand	Anodyne	HTR1F	53	36
COC(=O)[C@@]12C[C@@H](NC(=O)NCC3(c4ccccc4OC)CC3)C[C@@H]1C2	ZINC000875192623	FE	On-Demand	Anodyne	KCNA3	47	41
CC(=O)Nc1cc(NC(=O)c2cccnc2S)ccc1F	ZINC000875192635	DF	On-Demand	Anodyne	BACE2	40	43
CC(=O)Nc1cc(NC(=O)c2cccnc2S)ccc1F	ZINC000875192635	DF	On-Demand	Anodyne	KDR	22	41
CC(=O)Nc1cc(NC(=O)c2cccnc2S)ccc1F	ZINC000875192635	DF	On-Demand	Anodyne	GRM4	72	50
CC(=O)Nc1cc(NC(=O)c2cccnc2S)ccc1F	ZINC000875192635	DF	On-Demand	Anodyne	TYK2	24	40
CC(=O)Nc1cc(NC(=O)c2cccnc2S)ccc1F	ZINC000875192635	DF	On-Demand	Anodyne	CSF1R	19	40
CC(=O)Nc1cc(NC(=O)c2cccnc2S)ccc1F	ZINC000875192635	DF	On-Demand	Anodyne	NR2E3	45	35
CC(=O)Nc1cc(NC(=O)c2cccnc2S)ccc1F	ZINC000875192635	DF	On-Demand	Anodyne	SHH	29	42
CC(=O)Nc1cc(NC(=O)c2cccnc2S)ccc1F	ZINC000875192635	DF	On-Demand	Anodyne	KCNK3	69	35
CC(=O)Nc1cc(NC(=O)c2cccnc2S)ccc1F	ZINC000875192635	DF	On-Demand	Anodyne	KCNK9	62	35
CC(=O)Nc1cc(NC(=O)c2cccnc2S)ccc1F	ZINC000875192635	DF	On-Demand	Anodyne	G2YM83_BOTF4	53	33
O=C(N[C@H]1CCc2ccccc2C1)N1CCC(CO)(CO)CC1	ZINC000875192646	DD	On-Demand	Anodyne	EPHX2	23	64
O=C(N[C@@H]1CCc2ccccc2C1)N1CCC(CO)(CO)CC1	ZINC000875192647	DD	On-Demand	Anodyne	EPHX2	23	64
O=C(NCc1ccc(OC2CCCC2)cc1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875192680	GF	On-Demand	Anodyne	EPHX2	17	41
O=C(N[C@H]1CCc2ccccc2C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875192737	FF	On-Demand	Anodyne	SMO	38	42
O=C(N[C@H]1CCc2ccccc2C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875192737	FF	On-Demand	Anodyne	ETHR	46	33
O=C(N[C@@H]1CCc2ccccc2C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875192738	FF	On-Demand	Anodyne	SMO	38	42
O=C(N[C@@H]1CCc2ccccc2C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875192738	FF	On-Demand	Anodyne	ETHR	46	33
O=C(N[C@H]1CCc2ccccc2C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875192739	FF	On-Demand	Anodyne	SMO	38	42
O=C(N[C@H]1CCc2ccccc2C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875192739	FF	On-Demand	Anodyne	ETHR	46	33
O=C(N[C@@H]1CCc2ccccc2C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875192740	FF	On-Demand	Anodyne	SMO	38	42
O=C(N[C@@H]1CCc2ccccc2C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875192740	FF	On-Demand	Anodyne	ETHR	46	33
CONC(=O)C1CCN(C(=O)N[C@H]2CCc3ccccc3C2)CC1	ZINC000875192760	ED	On-Demand	Anodyne	EPHX2	26	50
CONC(=O)C1CCN(C(=O)N[C@@H]2CCc3ccccc3C2)CC1	ZINC000875192761	ED	On-Demand	Anodyne	EPHX2	26	50
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCc3ccccc3C2)C1	ZINC000875192772	DF	On-Demand	Anodyne	PREP	54	43
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCc3ccccc3C2)C1	ZINC000875192773	DF	On-Demand	Anodyne	PREP	54	43
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCc3ccccc3C2)C1	ZINC000875192774	DF	On-Demand	Anodyne	PREP	54	43
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCc3ccccc3C2)C1	ZINC000875192775	DF	On-Demand	Anodyne	PREP	54	43
CC(=O)C1CCN(C(=O)NCc2ccc(OC3CCCCC3)nc2)CC1	ZINC000875192778	FG	On-Demand	Anodyne	EPHX2	21	40
O=C1CCN(C(=O)NCc2ccc(Oc3ccccc3)nc2)CCCCCCN1	ZINC000875192830	GG	On-Demand	Anodyne	NAMPT	32	41
C[C@H](NC(=O)C(=O)NCC[S@](=O)Cc1ccccc1)c1ccnn1C	ZINC000875192833	FC	On-Demand	Anodyne	CAPN2	40	33
C[C@H](NC(=O)C(=O)NCC[S@@](=O)Cc1ccccc1)c1ccnn1C	ZINC000875192836	FC	On-Demand	Anodyne	CAPN2	40	33
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCc2ccccc2C1	ZINC000875192891	EE	On-Demand	Anodyne	SLC6A4	22	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCc2ccccc2C1	ZINC000875192891	EE	On-Demand	Anodyne	SLC6A3	43	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCc2ccccc2C1	ZINC000875192892	EE	On-Demand	Anodyne	SLC6A4	22	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCc2ccccc2C1	ZINC000875192892	EE	On-Demand	Anodyne	SLC6A3	43	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCc2ccccc2C1	ZINC000875192893	EE	On-Demand	Anodyne	SLC6A4	22	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCc2ccccc2C1	ZINC000875192893	EE	On-Demand	Anodyne	SLC6A3	43	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCc2ccccc2C1	ZINC000875192894	EE	On-Demand	Anodyne	SLC6A4	22	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCc2ccccc2C1	ZINC000875192894	EE	On-Demand	Anodyne	SLC6A3	43	40
O=C(NCc1ccc(Oc2ccccc2)nc1)N1CCC(CO)(CO)CC1	ZINC000875192930	FE	On-Demand	Anodyne	NAMPT	40	41
O=C(N[C@@H]1CCc2ccccc2C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875192939	EF	On-Demand	Anodyne	EPHX2	16	51
O=C(N[C@H]1CCc2ccccc2C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875192940	EF	On-Demand	Anodyne	EPHX2	16	51
O=C(N[C@@H]1CCc2ccccc2C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875192941	EF	On-Demand	Anodyne	EPHX2	16	51
O=C(N[C@H]1CCc2ccccc2C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875192942	EF	On-Demand	Anodyne	EPHX2	16	51
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC[S@](=O)Cc2ccccc2)C1	ZINC000875192949	FC	On-Demand	Anodyne	DPP7	44	37
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC[S@@](=O)Cc2ccccc2)C1	ZINC000875192950	FC	On-Demand	Anodyne	DPP7	44	37
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC[S@](=O)Cc2ccccc2)C1	ZINC000875192951	FC	On-Demand	Anodyne	DPP7	44	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC[S@@](=O)Cc2ccccc2)C1	ZINC000875192952	FC	On-Demand	Anodyne	DPP7	44	37
CC(=O)C1CCN(C(=O)N[C@H]2CCc3ccccc3C2)CC1	ZINC000875192953	DF	On-Demand	Anodyne	EPHX2	28	54
CC(=O)C1CCN(C(=O)N[C@@H]2CCc3ccccc3C2)CC1	ZINC000875192954	DF	On-Demand	Anodyne	EPHX2	28	54
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCC[S@](=O)Cc2ccccc2)c1	ZINC000875192959	GE	On-Demand	Anodyne	PREP	47	35
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCC[S@@](=O)Cc2ccccc2)c1	ZINC000875192960	GE	On-Demand	Anodyne	PREP	47	35
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCC[S@](=O)Cc2ccccc2)c1	ZINC000875192961	GE	On-Demand	Anodyne	PREP	47	35
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCC[S@@](=O)Cc2ccccc2)c1	ZINC000875192962	GE	On-Demand	Anodyne	PREP	47	35
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@H]1CCc2ccccc2C1	ZINC000875192994	DF	On-Demand	Anodyne	TIMP3	55	35
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@@H]1CCc2ccccc2C1	ZINC000875192995	DF	On-Demand	Anodyne	TIMP3	55	35
O=C(NCCO)C1CCN(C(=O)NCc2ccc(OC3CCCC3)cc2)CC1	ZINC000875193028	GE	On-Demand	Anodyne	EPHX2	28	47
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCc3ccccc3C2)C1	ZINC000875193075	EE	On-Demand	Anodyne	ACE	32	48
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCc3ccccc3C2)C1	ZINC000875193076	EE	On-Demand	Anodyne	ACE	32	48
CC(C)(C)C(=O)NCCNC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875193096	ED	On-Demand	Anodyne	EPHX2	15	50
CC(C)(C)C(=O)NCCNC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875193097	ED	On-Demand	Anodyne	EPHX2	15	50
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2CCc3ccccc3C2)CC1	ZINC000875193103	ED	On-Demand	Anodyne	EPHX2	20	52
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2CCc3ccccc3C2)CC1	ZINC000875193104	ED	On-Demand	Anodyne	EPHX2	20	52
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(Oc2ccccc2)nc1	ZINC000875193107	EG	On-Demand	Anodyne	ACACA	21	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(Oc2ccccc2)nc1	ZINC000875193107	EG	On-Demand	Anodyne	ACACB	31	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(Oc2ccccc2)nc1	ZINC000875193107	EG	On-Demand	Anodyne	PDS	65	39
CC(C)(C)C(=O)NCCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875193118	FE	On-Demand	Anodyne	FKBP1A	37	45
CC(C)(C)C(=O)NCCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875193119	FE	On-Demand	Anodyne	FKBP1A	37	45
CC(C)(C)C(=O)NCCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875193120	FE	On-Demand	Anodyne	FKBP1A	37	45
CC(C)(C)C(=O)NCCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875193121	FE	On-Demand	Anodyne	FKBP1A	37	45
O=C(NCCC[C@@H]1CCOC1=O)N[C@@H]1CCc2ccccc2C1	ZINC000875193150	DE	On-Demand	Anodyne	LUXR	49	34
O=C(NCCC[C@@H]1CCOC1=O)N[C@@H]1CCc2ccccc2C1	ZINC000875193150	DE	On-Demand	Anodyne	TRAR	55	34
O=C(NCCC[C@H]1CCOC1=O)N[C@@H]1CCc2ccccc2C1	ZINC000875193151	DE	On-Demand	Anodyne	LUXR	49	34
O=C(NCCC[C@H]1CCOC1=O)N[C@@H]1CCc2ccccc2C1	ZINC000875193151	DE	On-Demand	Anodyne	TRAR	55	34
O=C(NCCC[C@H]1CCOC1=O)N[C@H]1CCc2ccccc2C1	ZINC000875193152	DE	On-Demand	Anodyne	LUXR	49	34
O=C(NCCC[C@H]1CCOC1=O)N[C@H]1CCc2ccccc2C1	ZINC000875193152	DE	On-Demand	Anodyne	TRAR	55	34
O=C(NCCC[C@@H]1CCOC1=O)N[C@H]1CCc2ccccc2C1	ZINC000875193153	DE	On-Demand	Anodyne	LUXR	49	34
O=C(NCCC[C@@H]1CCOC1=O)N[C@H]1CCc2ccccc2C1	ZINC000875193153	DE	On-Demand	Anodyne	TRAR	55	34
COC(=O)C1(O)CN(C(=O)NCC2(c3ccccc3OC)CC2)C1	ZINC000875193170	EC	On-Demand	Anodyne	KCNA3	47	39
CC(C)(C)C(=O)NCCNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875193197	FF	On-Demand	Mild	CTSF	61	33
CC(C)(C)C(=O)NCCNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875193198	FF	On-Demand	Mild	CTSF	61	33
COCCN(CC1CCN(C)CC1)C(=O)NCC1(c2ccccc2OC)CC1	ZINC000875193205	GF	On-Demand	Anodyne	KCNA3	46	38
COCCN(CC1CCN(C)CC1)C(=O)NCC1(c2ccccc2OC)CC1	ZINC000875193205	GF	On-Demand	Anodyne	HCN1	45	39
COCCN(CC1CCN(C)CC1)C(=O)NCC1(c2ccccc2OC)CC1	ZINC000875193205	GF	On-Demand	Anodyne	ACKR3	63	33
C[S@](=N)(=O)N1CCN(C(=O)NCc2ccc(OC3CCCCC3)nc2)CC1	ZINC000875193213	GE	On-Demand	Anodyne	NAMPT	40	38
O=CN1CCCN(C(=O)NCc2ccc(OC3CCCC3)cc2)CC1	ZINC000875193227	EE	On-Demand	Anodyne	EPHX2	23	46
O=C(NCc1ccc(OC2CCCC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875193236	FE	On-Demand	Anodyne	EPHX2	30	47
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(Oc3ccccc3)nc2)C1	ZINC000875193249	GG	On-Demand	Anodyne	ACACA	16	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(Oc3ccccc3)nc2)C1	ZINC000875193249	GG	On-Demand	Anodyne	ACACB	24	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(Oc3ccccc3)nc2)C1	ZINC000875193249	GG	On-Demand	Anodyne	PDS	45	34
O=C(NCc1ccnc(OC2CCCCC2)c1)N1CCC(CO)(CO)CC1	ZINC000875193250	GE	On-Demand	Anodyne	EPHX2	18	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2(c3ccccc3OC)CC2)C1	ZINC000875193297	FF	On-Demand	Anodyne	KCNA3	47	38
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2(c3ccccc3OC)CC2)C1	ZINC000875193297	FF	On-Demand	Anodyne	SOAT1	15	44
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2(c3ccccc3OC)CC2)C1	ZINC000875193297	FF	On-Demand	Anodyne	HCN1	65	34
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2(c3ccccc3OC)CC2)C1	ZINC000875193297	FF	On-Demand	Anodyne	HCN4	48	34
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1(c2ccccc2OC)CC1	ZINC000875193315	FE	On-Demand	Anodyne	KCNA3	46	39
CC(C)(C)C(=O)NCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875193363	EE	On-Demand	Anodyne	FKBP1A	27	41
CC(C)(C)C(=O)NCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875193364	EE	On-Demand	Anodyne	FKBP1A	27	41
CC(C)(C)C(=O)NCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875193365	EE	On-Demand	Anodyne	FKBP1A	27	41
CC(C)(C)C(=O)NCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875193366	EE	On-Demand	Anodyne	FKBP1A	27	41
Cc1cccc2c1OCC[C@@H]2NC(=O)N(C1CC1)C1CC1	ZINC000875193379	CG	On-Demand	Anodyne	LUXR	53	32
Cc1cccc2c1OCC[C@@H]2NC(=O)N(C1CC1)C1CC1	ZINC000875193379	CG	On-Demand	Anodyne	TRAR	66	32
CCC[C@H](CCO)NC(=O)N[C@H]1CCOc2c(C)cccc21	ZINC000875193392	DF	On-Demand	Anodyne	LASR	41	31
CCC[C@@H](CCO)NC(=O)N[C@H]1CCOc2c(C)cccc21	ZINC000875193393	DF	On-Demand	Anodyne	LASR	41	31
C[C@@H]1CN(CCNC(=O)N2CC[C@]3(CCc4ccccc43)C2)CCO1	ZINC000875193424	EE	On-Demand	Anodyne	OXTR	49	35
C[C@@H]1CN(CCNC(=O)N2CC[C@@]3(CCc4ccccc43)C2)CCO1	ZINC000875193425	EE	On-Demand	Anodyne	OXTR	49	35
COc1ccccc1[C@H]1CN(C(=O)NCCN2CCO[C@H](C)C2)CCO1	ZINC000875193445	FD	On-Demand	Anodyne	HTR1A	26	40
COc1ccccc1[C@H]1CN(C(=O)NCCN2CCO[C@H](C)C2)CCO1	ZINC000875193445	FD	On-Demand	Anodyne	DRD2	28	40
COc1ccccc1[C@H]1CN(C(=O)NCCN2CCO[C@H](C)C2)CCO1	ZINC000875193445	FD	On-Demand	Anodyne	DRD4	41	32
COc1ccccc1[C@H]1CN(C(=O)NCCN2CCO[C@H](C)C2)CCO1	ZINC000875193445	FD	On-Demand	Anodyne	DRD3	41	35
COc1ccccc1[C@H]1CN(C(=O)NCCN2CCO[C@@H](C)C2)CCO1	ZINC000875193446	FD	On-Demand	Anodyne	HTR1A	26	40
COc1ccccc1[C@H]1CN(C(=O)NCCN2CCO[C@@H](C)C2)CCO1	ZINC000875193446	FD	On-Demand	Anodyne	DRD2	28	40
COc1ccccc1[C@H]1CN(C(=O)NCCN2CCO[C@@H](C)C2)CCO1	ZINC000875193446	FD	On-Demand	Anodyne	DRD4	41	32
COc1ccccc1[C@H]1CN(C(=O)NCCN2CCO[C@@H](C)C2)CCO1	ZINC000875193446	FD	On-Demand	Anodyne	DRD3	41	35
COc1ccccc1[C@@H]1CN(C(=O)NCCN2CCO[C@H](C)C2)CCO1	ZINC000875193447	FD	On-Demand	Anodyne	HTR1A	26	40
COc1ccccc1[C@@H]1CN(C(=O)NCCN2CCO[C@H](C)C2)CCO1	ZINC000875193447	FD	On-Demand	Anodyne	DRD2	28	40
COc1ccccc1[C@@H]1CN(C(=O)NCCN2CCO[C@H](C)C2)CCO1	ZINC000875193447	FD	On-Demand	Anodyne	DRD4	41	32
COc1ccccc1[C@@H]1CN(C(=O)NCCN2CCO[C@H](C)C2)CCO1	ZINC000875193447	FD	On-Demand	Anodyne	DRD3	41	35
COc1ccccc1[C@@H]1CN(C(=O)NCCN2CCO[C@@H](C)C2)CCO1	ZINC000875193448	FD	On-Demand	Anodyne	HTR1A	26	40
COc1ccccc1[C@@H]1CN(C(=O)NCCN2CCO[C@@H](C)C2)CCO1	ZINC000875193448	FD	On-Demand	Anodyne	DRD2	28	40
COc1ccccc1[C@@H]1CN(C(=O)NCCN2CCO[C@@H](C)C2)CCO1	ZINC000875193448	FD	On-Demand	Anodyne	DRD4	41	32
COc1ccccc1[C@@H]1CN(C(=O)NCCN2CCO[C@@H](C)C2)CCO1	ZINC000875193448	FD	On-Demand	Anodyne	DRD3	41	35
O=C(NCC[S@@](=O)Cc1ccccc1)C(=O)N1CCC(CCF)CC1	ZINC000875193512	FD	On-Demand	Anodyne	ACHE	23	41
O=C(NCC[S@@](=O)Cc1ccccc1)C(=O)N1CCC(CCF)CC1	ZINC000875193512	FD	On-Demand	Anodyne	GRIN2B	48	34
O=C(NCC[S@](=O)Cc1ccccc1)C(=O)N1CCC(CCF)CC1	ZINC000875193513	FD	On-Demand	Anodyne	ACHE	23	41
O=C(NCC[S@](=O)Cc1ccccc1)C(=O)N1CCC(CCF)CC1	ZINC000875193513	FD	On-Demand	Anodyne	GRIN2B	48	34
COC(=O)C1(O)CN(C(=O)NCc2ccc(OC3CCCC3)cc2)C1	ZINC000875193520	ED	On-Demand	Anodyne	EPHX2	21	41
CC[C@H](C[C@H](C)O)NC(=O)NCC1(c2ccccc2OC)CC1	ZINC000875193529	DF	On-Demand	Anodyne	KCNA3	45	39
CC[C@H](C[C@H](C)O)NC(=O)NCC1(c2ccccc2OC)CC1	ZINC000875193529	DF	On-Demand	Anodyne	SOAT1	16	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Oc2ccccc2)nc1	ZINC000875193535	GG	On-Demand	Anodyne	SLC6A4	20	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Oc2ccccc2)nc1	ZINC000875193535	GG	On-Demand	Anodyne	SLC6A3	41	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Oc2ccccc2)nc1	ZINC000875193536	GG	On-Demand	Anodyne	SLC6A4	20	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Oc2ccccc2)nc1	ZINC000875193536	GG	On-Demand	Anodyne	SLC6A3	41	42
Cc1cccc2c1OCC[C@H]2NC(=O)N(C)OCC(F)(F)F	ZINC000875193547	DF	On-Demand	Anodyne	TRAR	52	35
Cc1cccc2c1OCC[C@@H]2NC(=O)N(C)OCC(F)(F)F	ZINC000875193548	DF	On-Demand	Anodyne	TRAR	52	35
O=C(NCc1ccc(OC2CCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875193556	DF	On-Demand	Anodyne	EPHX2	27	41
O=C(NCc1ccc(Oc2ccccc2)nc1)NC[C@H]1C[C@H](O)C1	ZINC000875193573	EE	On-Demand	Anodyne	NAMPT	16	42
O=C(NCc1nc(-c2ccncc2)cs1)N[C@H]1CCc2ccccc2C1	ZINC000875193583	FH	On-Demand	Anodyne	ROCK1	25	46
O=C(NCc1nc(-c2ccncc2)cs1)N[C@H]1CCc2ccccc2C1	ZINC000875193583	FH	On-Demand	Anodyne	ROCK2	15	46
O=C(NCc1nc(-c2ccncc2)cs1)N[C@@H]1CCc2ccccc2C1	ZINC000875193584	FH	On-Demand	Anodyne	ROCK1	25	46
O=C(NCc1nc(-c2ccncc2)cs1)N[C@@H]1CCc2ccccc2C1	ZINC000875193584	FH	On-Demand	Anodyne	ROCK2	15	46
COC(=O)N(C)NC(=O)NCC1(c2ccccc2OC)CC1	ZINC000875193610	DD	On-Demand	Reactive	KCNA3	49	41
Cc1cccc2c1OCC[C@@H]2NC(=O)N[C@@H]1C[C@H](CO)C1	ZINC000875193614	CD	On-Demand	Anodyne	LUXR	43	32
Cc1cccc2c1OCC[C@@H]2NC(=O)N1OC2CCC1CC2	ZINC000875193621	DG	On-Demand	Anodyne	LUXR	57	33
Cc1cccc2c1OCC[C@@H]2NC(=O)N1OC2CCC1CC2	ZINC000875193621	DG	On-Demand	Anodyne	TRAR	51	33
C[C@@H]1CN(CCNC(=O)NCc2cccc(OC(C)(C)C)c2)CCO1	ZINC000875193732	EE	On-Demand	Anodyne	DRD4	42	32
C[C@@H]1CN(CCNC(=O)NCc2cccc(OC(C)(C)C)c2)CCO1	ZINC000875193732	EE	On-Demand	Anodyne	HRH2	24	40
C[C@@H]1CN(CCNC(=O)NC(C)(C)[C@@H]2CCCCO2)CCO1	ZINC000875193741	DD	On-Demand	Anodyne	CACNA1H	22	42
C[C@@H]1CN(CCNC(=O)NC(C)(C)[C@H]2CCCCO2)CCO1	ZINC000875193743	DD	On-Demand	Anodyne	CACNA1H	22	42
C[C@@H]1CN(CCNC(=O)N[C@@H](CO)c2cccc(C(F)(F)F)c2)CCO1	ZINC000875193762	GD	On-Demand	Anodyne	CCR2	41	38
C[C@@H]1CN(CCNC(=O)N[C@H](CO)c2cccc(C(F)(F)F)c2)CCO1	ZINC000875193763	GD	On-Demand	Anodyne	CCR2	41	38
C[C@@H]1CN(CCNC(=O)N[C@](C)(CO)Cc2ccc(Cl)cc2)CCO1	ZINC000875193816	FD	On-Demand	Anodyne	CACNA1H	24	41
C[C@@H]1CN(CCNC(=O)N[C@@](C)(CO)Cc2ccc(Cl)cc2)CCO1	ZINC000875193819	FD	On-Demand	Anodyne	CACNA1H	24	41
COc1ccccc1N1CC[C@@H](CNC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875193824	ED	On-Demand	Anodyne	HTR1A	81	47
COc1ccccc1N1CC[C@@H](CNC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875193824	ED	On-Demand	Anodyne	DRD2	70	47
COc1ccccc1N1CC[C@@H](CNC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875193824	ED	On-Demand	Anodyne	DRD4	38	43
COc1ccccc1N1CC[C@@H](CNC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875193824	ED	On-Demand	Anodyne	ADRA1D	65	38
COc1ccccc1N1CC[C@@H](CNC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875193824	ED	On-Demand	Anodyne	ADRA1A	58	38
COc1ccccc1N1CC[C@@H](CNC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875193824	ED	On-Demand	Anodyne	ADRA1B	51	38
COc1ccccc1N1CC[C@@H](CNC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875193824	ED	On-Demand	Anodyne	DRD3	69	42
COc1ccccc1N1CC[C@@H](CNC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875193824	ED	On-Demand	Anodyne	HTR7	52	42
COc1ccccc1N1CC[C@H](CNC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875193826	ED	On-Demand	Anodyne	HTR1A	81	47
COc1ccccc1N1CC[C@H](CNC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875193826	ED	On-Demand	Anodyne	DRD2	70	47
COc1ccccc1N1CC[C@H](CNC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875193826	ED	On-Demand	Anodyne	DRD4	38	43
COc1ccccc1N1CC[C@H](CNC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875193826	ED	On-Demand	Anodyne	ADRA1D	65	38
COc1ccccc1N1CC[C@H](CNC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875193826	ED	On-Demand	Anodyne	ADRA1A	58	38
COc1ccccc1N1CC[C@H](CNC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875193826	ED	On-Demand	Anodyne	ADRA1B	51	38
COc1ccccc1N1CC[C@H](CNC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875193826	ED	On-Demand	Anodyne	DRD3	69	42
COc1ccccc1N1CC[C@H](CNC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875193826	ED	On-Demand	Anodyne	HTR7	52	42
N#Cc1c(NC(=O)COCc2ccnc(O)c2)sc2c1CCCCCC2	ZINC000875193844	FH	On-Demand	Mild	VIPR1	35	54
O=C(NCCCNC(=O)N1C[C@H]2CC=CC[C@H]2C1)c1ccccc1	ZINC000875193849	EE	On-Demand	Anodyne	DRD3	26	40
COc1ccccc1N1CC[C@@H](CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875193866	GD	On-Demand	Anodyne	HTR1A	66	43
COc1ccccc1N1CC[C@@H](CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875193866	GD	On-Demand	Anodyne	DRD2	57	42
COc1ccccc1N1CC[C@@H](CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875193866	GD	On-Demand	Anodyne	DRD4	40	40
COc1ccccc1N1CC[C@@H](CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875193866	GD	On-Demand	Anodyne	ADRA1D	55	38
COc1ccccc1N1CC[C@@H](CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875193866	GD	On-Demand	Anodyne	ADRA1A	49	38
COc1ccccc1N1CC[C@@H](CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875193866	GD	On-Demand	Anodyne	ADRA1B	41	38
COc1ccccc1N1CC[C@@H](CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875193866	GD	On-Demand	Anodyne	DRD3	60	41
COc1ccccc1N1CC[C@@H](CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875193866	GD	On-Demand	Anodyne	HTR4	49	34
COc1ccccc1N1CC[C@@H](CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875193866	GD	On-Demand	Anodyne	HTR7	49	37
COc1ccccc1N1CC[C@@H](CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875193866	GD	On-Demand	Anodyne	CACNA1I	50	35
COc1ccccc1N1CC[C@H](CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875193867	GD	On-Demand	Anodyne	HTR1A	66	43
COc1ccccc1N1CC[C@H](CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875193867	GD	On-Demand	Anodyne	DRD2	57	42
COc1ccccc1N1CC[C@H](CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875193867	GD	On-Demand	Anodyne	DRD4	40	40
COc1ccccc1N1CC[C@H](CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875193867	GD	On-Demand	Anodyne	ADRA1D	55	38
COc1ccccc1N1CC[C@H](CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875193867	GD	On-Demand	Anodyne	ADRA1A	49	38
COc1ccccc1N1CC[C@H](CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875193867	GD	On-Demand	Anodyne	ADRA1B	41	38
COc1ccccc1N1CC[C@H](CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875193867	GD	On-Demand	Anodyne	DRD3	60	41
COc1ccccc1N1CC[C@H](CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875193867	GD	On-Demand	Anodyne	HTR4	49	34
COc1ccccc1N1CC[C@H](CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875193867	GD	On-Demand	Anodyne	HTR7	49	37
COc1ccccc1N1CC[C@H](CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875193867	GD	On-Demand	Anodyne	CACNA1I	50	35
O=C(NCCCNC(=O)N1CCC2(CCNC2=O)CC1)c1ccccc1	ZINC000875193880	FD	On-Demand	Anodyne	GHRHR	42	32
O=C(NCCCNC(=O)N1CCC2(CCNC2=O)CC1)c1ccccc1	ZINC000875193880	FD	On-Demand	Anodyne	PLD2	53	38
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCCNC(=O)c2ccccc2)C1	ZINC000875193884	EE	On-Demand	Anodyne	HTR1A	17	44
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCCNC(=O)c2ccccc2)C1	ZINC000875193884	EE	On-Demand	Anodyne	DRD2	24	44
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCCNC(=O)c2ccccc2)C1	ZINC000875193884	EE	On-Demand	Anodyne	DRD4	44	35
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCCNC(=O)c2ccccc2)C1	ZINC000875193884	EE	On-Demand	Anodyne	DRD3	45	44
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCCNC(=O)c2ccccc2)C1	ZINC000875193884	EE	On-Demand	Anodyne	PLD1	44	38
COc1ccccc1N1CC[C@@H](CNC(=O)N[C@@H]2CCOC[C@H]2O)C1	ZINC000875193893	EC	On-Demand	Anodyne	HTR1A	60	46
COc1ccccc1N1CC[C@@H](CNC(=O)N[C@@H]2CCOC[C@H]2O)C1	ZINC000875193893	EC	On-Demand	Anodyne	DRD2	46	46
COc1ccccc1N1CC[C@@H](CNC(=O)N[C@@H]2CCOC[C@H]2O)C1	ZINC000875193893	EC	On-Demand	Anodyne	DRD4	29	41
COc1ccccc1N1CC[C@@H](CNC(=O)N[C@@H]2CCOC[C@H]2O)C1	ZINC000875193893	EC	On-Demand	Anodyne	ADRA1D	45	37
COc1ccccc1N1CC[C@@H](CNC(=O)N[C@@H]2CCOC[C@H]2O)C1	ZINC000875193893	EC	On-Demand	Anodyne	DRD3	55	41
COc1ccccc1N1CC[C@@H](CNC(=O)N[C@@H]2CCOC[C@H]2O)C1	ZINC000875193893	EC	On-Demand	Anodyne	HTR7	39	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCNC(=O)c2ccccc2)C1	ZINC000875193903	FD	On-Demand	Anodyne	ACE	23	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCNC(=O)c2ccccc2)C1	ZINC000875193903	FD	On-Demand	Anodyne	P2RY12	80	36
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCNC(=O)c2ccccc2)C1	ZINC000875193903	FD	On-Demand	Anodyne	DPP7	15	43
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCNC(=O)c2ccccc2)C1	ZINC000875193903	FD	On-Demand	Anodyne	CTRB_BOVIN	45	32
O=C(NCCCNC(=O)c1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000875193904	DC	On-Demand	Anodyne	EPHX2	15	42
CC(C)c1cc([C@@H]2CCCN(C(=O)NCCCNC(=O)c3ccccc3)C2)n[nH]1	ZINC000875193931	GG	On-Demand	Anodyne	MAP3K12	32	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@@H]1CCC=CO1	ZINC000875193941	GE	On-Demand	Anodyne	DRD2	18	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@@H]1CCC=CO1	ZINC000875193941	GE	On-Demand	Anodyne	DRD4	40	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@@H]1CCC=CO1	ZINC000875193941	GE	On-Demand	Anodyne	ACHE	58	57
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@@H]1CCC=CO1	ZINC000875193941	GE	On-Demand	Anodyne	SIGMAR1	52	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@@H]1CCC=CO1	ZINC000875193941	GE	On-Demand	Anodyne	MCHR1	16	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@H]1CCC=CO1	ZINC000875193942	GE	On-Demand	Anodyne	DRD2	18	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@H]1CCC=CO1	ZINC000875193942	GE	On-Demand	Anodyne	DRD4	40	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@H]1CCC=CO1	ZINC000875193942	GE	On-Demand	Anodyne	ACHE	58	57
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@H]1CCC=CO1	ZINC000875193942	GE	On-Demand	Anodyne	SIGMAR1	52	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@H]1CCC=CO1	ZINC000875193942	GE	On-Demand	Anodyne	MCHR1	16	40
O=C(NC[C@H]1CCC=CO1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875193992	FD	On-Demand	Anodyne	ETHR	65	45
CN1CCN(C2CCN(C(=O)NCCCNC(=O)c3ccccc3)CC2)CC1	ZINC000875193993	GD	On-Demand	Anodyne	HTR1A	19	47
CN1CCN(C2CCN(C(=O)NCCCNC(=O)c3ccccc3)CC2)CC1	ZINC000875193993	GD	On-Demand	Anodyne	DRD2	23	47
CN1CCN(C2CCN(C(=O)NCCCNC(=O)c3ccccc3)CC2)CC1	ZINC000875193993	GD	On-Demand	Anodyne	DRD4	41	32
CN1CCN(C2CCN(C(=O)NCCCNC(=O)c3ccccc3)CC2)CC1	ZINC000875193993	GD	On-Demand	Anodyne	DRD3	44	43
CN1CCN(C2CCN(C(=O)NCCCNC(=O)c3ccccc3)CC2)CC1	ZINC000875193993	GD	On-Demand	Anodyne	CCR3	22	49
CN1CCN(C2CCN(C(=O)NCCCNC(=O)c3ccccc3)CC2)CC1	ZINC000875193993	GD	On-Demand	Anodyne	PLD1	61	38
CN1CCN(C2CCN(C(=O)NCCCNC(=O)c3ccccc3)CC2)CC1	ZINC000875193993	GD	On-Demand	Anodyne	SLC6A5	20	43
CN1CCN(C2CCN(C(=O)NCCCNC(=O)c3ccccc3)CC2)CC1	ZINC000875193993	GD	On-Demand	Anodyne	EPHX2	24	41
CN1CCN(C2CCN(C(=O)NCCCNC(=O)c3ccccc3)CC2)CC1	ZINC000875193993	GD	On-Demand	Anodyne	PLD2	59	38
CN1CCN(C2CCN(C(=O)NCCCNC(=O)c3ccccc3)CC2)CC1	ZINC000875193993	GD	On-Demand	Anodyne	L3MBTL3	90	54
N#Cc1c(NC(=O)[C@H]2CCC(=O)O2)sc2c1CCCCCC2	ZINC000875193999	DF	On-Demand	Mild	VIPR1	30	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC(C)(C)c1ccccc1F	ZINC000875194018	EF	On-Demand	Anodyne	SLC6A3	43	38
C[C@@H]1CN(CCNC(=O)N[C@@H]2CCO[C@H]2c2ccc(F)c(F)c2)CCO1	ZINC000875194029	FD	On-Demand	Anodyne	ADRA1A	47	38
COc1ccc([C@@H]2CN(C(=O)NCCN3CCO[C@H](C)C3)CCO2)cc1	ZINC000875194055	FD	On-Demand	Anodyne	DRD4	41	32
COc1ccc([C@@H]2CN(C(=O)NCCN3CCO[C@@H](C)C3)CCO2)cc1	ZINC000875194056	FD	On-Demand	Anodyne	DRD4	41	32
C[C@@H]1CN(CCNC(=O)NNC(=O)c2nc3ccccc3s2)CCO1	ZINC000875194082	FC	On-Demand	Reactive	ST14	50	35
C[C@@H]1CN(CCNC(=O)NNC(=O)c2nc3ccccc3s2)CCO1	ZINC000875194082	FC	On-Demand	Reactive	TMPRSS6	77	35
CC(=O)[C@H]1CCCN(C(=O)NCCCNC(=O)c2ccccc2)C1	ZINC000875194126	ED	On-Demand	Anodyne	HTR1A	15	44
CC(=O)[C@H]1CCCN(C(=O)NCCCNC(=O)c2ccccc2)C1	ZINC000875194126	ED	On-Demand	Anodyne	DRD2	22	40
CC(=O)[C@H]1CCCN(C(=O)NCCCNC(=O)c2ccccc2)C1	ZINC000875194126	ED	On-Demand	Anodyne	SLC6A1	115	37
CC(=O)[C@H]1CCCN(C(=O)NCCCNC(=O)c2ccccc2)C1	ZINC000875194126	ED	On-Demand	Anodyne	DRD3	40	40
CC(=O)[C@H]1CCCN(C(=O)NCCCNC(=O)c2ccccc2)C1	ZINC000875194126	ED	On-Demand	Anodyne	PREP	57	46
CC(=O)[C@H]1CCCN(C(=O)NCCCNC(=O)c2ccccc2)C1	ZINC000875194126	ED	On-Demand	Anodyne	EPHX2	17	40
CC(=O)[C@H]1CCCN(C(=O)NCCCNC(=O)c2ccccc2)C1	ZINC000875194126	ED	On-Demand	Anodyne	DPP7	56	54
CC(=O)[C@H]1CCCN(C(=O)NCCCNC(=O)c2ccccc2)C1	ZINC000875194126	ED	On-Demand	Anodyne	L3MBTL3	28	41
CC(=O)[C@@H]1CCCN(C(=O)NCCCNC(=O)c2ccccc2)C1	ZINC000875194127	ED	On-Demand	Anodyne	HTR1A	15	44
CC(=O)[C@@H]1CCCN(C(=O)NCCCNC(=O)c2ccccc2)C1	ZINC000875194127	ED	On-Demand	Anodyne	DRD2	22	40
CC(=O)[C@@H]1CCCN(C(=O)NCCCNC(=O)c2ccccc2)C1	ZINC000875194127	ED	On-Demand	Anodyne	SLC6A1	115	37
CC(=O)[C@@H]1CCCN(C(=O)NCCCNC(=O)c2ccccc2)C1	ZINC000875194127	ED	On-Demand	Anodyne	DRD3	40	40
CC(=O)[C@@H]1CCCN(C(=O)NCCCNC(=O)c2ccccc2)C1	ZINC000875194127	ED	On-Demand	Anodyne	PREP	57	46
CC(=O)[C@@H]1CCCN(C(=O)NCCCNC(=O)c2ccccc2)C1	ZINC000875194127	ED	On-Demand	Anodyne	EPHX2	17	40
CC(=O)[C@@H]1CCCN(C(=O)NCCCNC(=O)c2ccccc2)C1	ZINC000875194127	ED	On-Demand	Anodyne	DPP7	56	54
CC(=O)[C@@H]1CCCN(C(=O)NCCCNC(=O)c2ccccc2)C1	ZINC000875194127	ED	On-Demand	Anodyne	L3MBTL3	28	41
COCC1CC(NC(=O)NCc2ccc(OC3CCCCC3)cc2)C1	ZINC000875194128	EH	On-Demand	Anodyne	EPHX2	35	45
COc1ccccc1N1CC[C@@H](CNC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875194136	FF	On-Demand	Clean	HTR1A	69	42
COc1ccccc1N1CC[C@@H](CNC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875194136	FF	On-Demand	Clean	DRD2	52	44
COc1ccccc1N1CC[C@@H](CNC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875194136	FF	On-Demand	Clean	DRD4	31	42
COc1ccccc1N1CC[C@@H](CNC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875194136	FF	On-Demand	Clean	ADRA1D	40	37
COc1ccccc1N1CC[C@@H](CNC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875194136	FF	On-Demand	Clean	HTR2A	15	40
COc1ccccc1N1CC[C@@H](CNC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875194136	FF	On-Demand	Clean	DRD3	55	41
COc1ccccc1N1CC[C@@H](CNC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875194136	FF	On-Demand	Clean	HTR7	45	42
COc1ccccc1N1CC[C@@H](CNC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875194136	FF	On-Demand	Clean	SSTR1	54	42
COc1ccccc1N1CC[C@H](CNC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875194137	FF	On-Demand	Clean	HTR1A	69	42
COc1ccccc1N1CC[C@H](CNC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875194137	FF	On-Demand	Clean	DRD2	52	44
COc1ccccc1N1CC[C@H](CNC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875194137	FF	On-Demand	Clean	DRD4	31	42
COc1ccccc1N1CC[C@H](CNC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875194137	FF	On-Demand	Clean	ADRA1D	40	37
COc1ccccc1N1CC[C@H](CNC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875194137	FF	On-Demand	Clean	HTR2A	15	40
COc1ccccc1N1CC[C@H](CNC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875194137	FF	On-Demand	Clean	DRD3	55	41
COc1ccccc1N1CC[C@H](CNC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875194137	FF	On-Demand	Clean	HTR7	45	42
COc1ccccc1N1CC[C@H](CNC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875194137	FF	On-Demand	Clean	SSTR1	54	42
Cc1cc(F)ccc1N1CCC[C@@H](NC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875194138	GD	On-Demand	Anodyne	CCR3	48	32
Cc1cc(F)ccc1N1CCC[C@@H](NC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875194139	GD	On-Demand	Anodyne	CCR3	48	32
Cc1cc(F)ccc1N1CCC[C@H](NC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875194140	GD	On-Demand	Anodyne	CCR3	48	32
Cc1cc(F)ccc1N1CCC[C@H](NC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875194141	GD	On-Demand	Anodyne	CCR3	48	32
COc1ccccc1N(C)C(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875194153	FI	On-Demand	Anodyne	HSD17B2	25	44
CN1CCN(C(=O)NCCCNC(=O)c2ccccc2)CCC1(C)C	ZINC000875194167	ED	On-Demand	Anodyne	HTR1A	16	46
CN1CCN(C(=O)NCCCNC(=O)c2ccccc2)CCC1(C)C	ZINC000875194167	ED	On-Demand	Anodyne	DRD2	19	43
CN1CCN(C(=O)NCCCNC(=O)c2ccccc2)CCC1(C)C	ZINC000875194167	ED	On-Demand	Anodyne	DRD4	41	32
CN1CCN(C(=O)NCCCNC(=O)c2ccccc2)CCC1(C)C	ZINC000875194167	ED	On-Demand	Anodyne	DRD3	40	43
Cc1ccnn1CC(=O)Nc1sc2c(c1C#N)CCCCCC2	ZINC000875194172	EG	On-Demand	Mild	VIPR1	37	59
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC[C@@H](C)c1ccccc1	ZINC000875194174	EF	On-Demand	Anodyne	SLC6A4	30	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC[C@@H](C)c1ccccc1	ZINC000875194174	EF	On-Demand	Anodyne	SLC6A3	71	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC[C@H](C)c1ccccc1	ZINC000875194175	EF	On-Demand	Anodyne	SLC6A4	30	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC[C@H](C)c1ccccc1	ZINC000875194175	EF	On-Demand	Anodyne	SLC6A3	71	44
N#Cc1c(NC(=O)c2cccn(C3CC3)c2=O)sc2c1CCCCCC2	ZINC000875194179	FI	On-Demand	Mild	VIPR1	30	49
O=C(N[C@H]1CCCOc2ccccc21)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875194183	FG	On-Demand	Anodyne	RBP4	46	38
O=C(N[C@@H]1CCCOc2ccccc21)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875194185	FG	On-Demand	Anodyne	RBP4	46	38
O=C(N[C@@H]1CCCOc2ccccc21)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875194187	FG	On-Demand	Anodyne	RBP4	46	38
O=C(N[C@H]1CCCOc2ccccc21)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875194189	FG	On-Demand	Anodyne	RBP4	46	38
O=C(NCCC[C@H]1CCOC1=O)NCc1ccc(OC2CCCCC2)cc1	ZINC000875194205	FH	On-Demand	Anodyne	TRAR	51	32
O=C(NCCC[C@@H]1CCOC1=O)NCc1ccc(OC2CCCCC2)cc1	ZINC000875194207	FH	On-Demand	Anodyne	TRAR	51	32
CC(=O)Nc1cccc2c1CN(C(=O)NCCCNC(=O)c1ccccc1)CC2	ZINC000875194263	GF	On-Demand	Anodyne	DRD4	41	32
N#Cc1c(NC(=O)[C@@H]2COC(=O)N2)sc2c1CCCCCC2	ZINC000875194285	DE	On-Demand	Mild	VIPR1	30	48
C[C@@H]1CN(CCNC(=O)NCc2noc3cc(F)ccc23)CCO1	ZINC000875194324	ED	On-Demand	Anodyne	DRD2	15	41
C[C@@H]1CN(CCNC(=O)N2CCN(c3ccc(F)cc3C#N)CC2)CCO1	ZINC000875194415	GD	On-Demand	Mild	DRD4	40	32
CCOC(=O)[C@H](C)C1CN(C(=O)NCC(C)(C)c2ccccc2F)C1	ZINC000875194429	FF	On-Demand	Anodyne	RBP4	42	35
C[C@@H]1CN(CCNC(=O)N2CCC(Oc3cccc(F)c3)CC2)CCO1	ZINC000875194441	FE	On-Demand	Anodyne	DRD4	40	30
C[C@@H]1CN(CCNC(=O)N2CCC(Oc3cccc(F)c3)CC2)CCO1	ZINC000875194441	FE	On-Demand	Anodyne	CCR3	45	42
C[C@@H]1CN(CCNC(=O)N2CCC(Oc3cccc(F)c3)CC2)CCO1	ZINC000875194441	FE	On-Demand	Anodyne	MLNR	29	49
C[C@@H]1CN(CCNC(=O)N2CCC(Oc3cccc(F)c3)CC2)CCO1	ZINC000875194441	FE	On-Demand	Anodyne	EPHX2	21	42
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccnc(OC3CCOCC3)c2)C1	ZINC000875194460	GD	On-Demand	Anodyne	HCRTR1	20	45
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccnc(OC3CCOCC3)c2)C1	ZINC000875194460	GD	On-Demand	Anodyne	HCRTR2	35	45
N#Cc1c(NC(=O)c2scnc2C(F)F)sc2c1CCCCCC2	ZINC000875194481	FJ	On-Demand	Mild	VIPR1	30	48
N#Cc1c(NC(=O)[C@@]2(C#N)CCCOC2)sc2c1CCCCCC2	ZINC000875194487	EH	On-Demand	Mild	VIPR1	31	50
N#Cc1c(NC(=O)[C@]2(C#N)CCCOC2)sc2c1CCCCCC2	ZINC000875194488	EH	On-Demand	Mild	VIPR1	31	50
O=C(N[C@H]1CCCOc2ccccc21)N1CCC(CO)(CO)CC1	ZINC000875194517	ED	On-Demand	Anodyne	EPHX2	19	49
O=C(N[C@@H]1CCCOc2ccccc21)N1CCC(CO)(CO)CC1	ZINC000875194518	ED	On-Demand	Anodyne	EPHX2	19	49
C[C@@H](CCNC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1	ZINC000875194519	ED	On-Demand	Anodyne	EPHX2	20	47
C[C@@H]1CN(Cc2ccccc2)C[C@H]1CNC(=O)C(=O)NC[C@H]1CCC=CO1	ZINC000875194521	FD	On-Demand	Anodyne	DRD4	17	46
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1CNC(=O)C(=O)NC[C@@H]1CCC=CO1	ZINC000875194522	FD	On-Demand	Anodyne	DRD4	17	46
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1CNC(=O)C(=O)NC[C@H]1CCC=CO1	ZINC000875194523	FD	On-Demand	Anodyne	DRD4	17	46
Cc1cncc([C@@H]2CCCN2C(=O)NCCCNC(=O)c2ccccc2)c1	ZINC000875194541	FG	On-Demand	Anodyne	DRD2	20	41
Cc1cncc([C@@H]2CCCN2C(=O)NCCCNC(=O)c2ccccc2)c1	ZINC000875194541	FG	On-Demand	Anodyne	DRD3	40	39
Cc1cncc([C@@H]2CCCN2C(=O)NCCCNC(=O)c2ccccc2)c1	ZINC000875194541	FG	On-Demand	Anodyne	PREP	65	48
Cc1cncc([C@H]2CCCN2C(=O)NCCCNC(=O)c2ccccc2)c1	ZINC000875194542	FG	On-Demand	Anodyne	DRD2	20	41
Cc1cncc([C@H]2CCCN2C(=O)NCCCNC(=O)c2ccccc2)c1	ZINC000875194542	FG	On-Demand	Anodyne	DRD3	40	39
Cc1cncc([C@H]2CCCN2C(=O)NCCCNC(=O)c2ccccc2)c1	ZINC000875194542	FG	On-Demand	Anodyne	PREP	65	48
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCCCNC(=O)c1ccccc1)CC2	ZINC000875194546	GF	On-Demand	Anodyne	DRD4	43	33
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCCCNC(=O)c1ccccc1)CC2	ZINC000875194546	GF	On-Demand	Anodyne	HDAC6	35	40
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCCCNC(=O)c1ccccc1)CC2	ZINC000875194546	GF	On-Demand	Anodyne	NOD2	42	36
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCCCNC(=O)c1ccccc1)CC2	ZINC000875194546	GF	On-Demand	Anodyne	KCNK3	42	34
N#Cc1ccc(N2CCN(C(=O)NCCCNC(=O)c3ccccc3)CC2)cc1	ZINC000875194547	GE	On-Demand	Mild	HTR1A	23	56
N#Cc1ccc(N2CCN(C(=O)NCCCNC(=O)c3ccccc3)CC2)cc1	ZINC000875194547	GE	On-Demand	Mild	DRD2	23	45
N#Cc1ccc(N2CCN(C(=O)NCCCNC(=O)c3ccccc3)CC2)cc1	ZINC000875194547	GE	On-Demand	Mild	DRD4	47	39
N#Cc1ccc(N2CCN(C(=O)NCCCNC(=O)c3ccccc3)CC2)cc1	ZINC000875194547	GE	On-Demand	Mild	HTR2A	16	46
N#Cc1ccc(N2CCN(C(=O)NCCCNC(=O)c3ccccc3)CC2)cc1	ZINC000875194547	GE	On-Demand	Mild	ADRA1A	15	41
N#Cc1ccc(N2CCN(C(=O)NCCCNC(=O)c3ccccc3)CC2)cc1	ZINC000875194547	GE	On-Demand	Mild	DRD3	44	51
N#Cc1ccc(N2CCN(C(=O)NCCCNC(=O)c3ccccc3)CC2)cc1	ZINC000875194547	GE	On-Demand	Mild	PRNP	43	39
N#Cc1ccc(N2CCN(C(=O)NCCCNC(=O)c3ccccc3)CC2)cc1	ZINC000875194547	GE	On-Demand	Mild	CTRB_BOVIN	44	34
COc1ccc(-c2nnc(S)n2CCC(=O)Nc2ccc(F)c(NC(C)=O)c2)cc1	ZINC000875194556	IG	On-Demand	Anodyne	ENPP1	66	31
COc1ccccc1N1CC[C@@H](CNC(=O)NN=c2cc[nH]cc2C)C1	ZINC000875194557	FD	On-Demand	Reactive	HTR1A	65	42
COc1ccccc1N1CC[C@@H](CNC(=O)NN=c2cc[nH]cc2C)C1	ZINC000875194557	FD	On-Demand	Reactive	DRD2	46	42
COc1ccccc1N1CC[C@@H](CNC(=O)NN=c2cc[nH]cc2C)C1	ZINC000875194557	FD	On-Demand	Reactive	ADRA1D	43	38
COc1ccccc1N1CC[C@@H](CNC(=O)NN=c2cc[nH]cc2C)C1	ZINC000875194557	FD	On-Demand	Reactive	ADRA1A	40	38
COc1ccccc1N1CC[C@@H](CNC(=O)NN=c2cc[nH]cc2C)C1	ZINC000875194557	FD	On-Demand	Reactive	DRD3	54	38
COc1ccccc1N1CC[C@@H](CNC(=O)NN=c2cc[nH]cc2C)C1	ZINC000875194557	FD	On-Demand	Reactive	HTR7	43	38
COc1ccccc1N1CC[C@H](CNC(=O)NN=c2cc[nH]cc2C)C1	ZINC000875194558	FD	On-Demand	Reactive	HTR1A	65	42
COc1ccccc1N1CC[C@H](CNC(=O)NN=c2cc[nH]cc2C)C1	ZINC000875194558	FD	On-Demand	Reactive	DRD2	46	42
COc1ccccc1N1CC[C@H](CNC(=O)NN=c2cc[nH]cc2C)C1	ZINC000875194558	FD	On-Demand	Reactive	ADRA1D	43	38
COc1ccccc1N1CC[C@H](CNC(=O)NN=c2cc[nH]cc2C)C1	ZINC000875194558	FD	On-Demand	Reactive	ADRA1A	40	38
COc1ccccc1N1CC[C@H](CNC(=O)NN=c2cc[nH]cc2C)C1	ZINC000875194558	FD	On-Demand	Reactive	DRD3	54	38
COc1ccccc1N1CC[C@H](CNC(=O)NN=c2cc[nH]cc2C)C1	ZINC000875194558	FD	On-Demand	Reactive	HTR7	43	38
CN1CC[C@H]2CN(C(=O)NCCCNC(=O)c3ccccc3)CC[C@H]21	ZINC000875194565	ED	On-Demand	Anodyne	HTR1A	21	45
CN1CC[C@H]2CN(C(=O)NCCCNC(=O)c3ccccc3)CC[C@H]21	ZINC000875194565	ED	On-Demand	Anodyne	DRD2	28	44
CN1CC[C@H]2CN(C(=O)NCCCNC(=O)c3ccccc3)CC[C@H]21	ZINC000875194565	ED	On-Demand	Anodyne	DRD4	41	33
CN1CC[C@H]2CN(C(=O)NCCCNC(=O)c3ccccc3)CC[C@H]21	ZINC000875194565	ED	On-Demand	Anodyne	HTR2A	17	44
CN1CC[C@H]2CN(C(=O)NCCCNC(=O)c3ccccc3)CC[C@H]21	ZINC000875194565	ED	On-Demand	Anodyne	DRD3	51	44
CN1CC[C@H]2CN(C(=O)NCCCNC(=O)c3ccccc3)CC[C@H]21	ZINC000875194565	ED	On-Demand	Anodyne	PLD1	64	38
CN1CC[C@H]2CN(C(=O)NCCCNC(=O)c3ccccc3)CC[C@H]21	ZINC000875194565	ED	On-Demand	Anodyne	PLD2	54	38
CN1CC[C@H]2CN(C(=O)NCCCNC(=O)c3ccccc3)CC[C@H]21	ZINC000875194565	ED	On-Demand	Anodyne	L3MBTL3	27	43
CN1CC[C@H]2CN(C(=O)NCCCNC(=O)c3ccccc3)CC[C@@H]21	ZINC000875194567	ED	On-Demand	Anodyne	HTR1A	21	45
CN1CC[C@H]2CN(C(=O)NCCCNC(=O)c3ccccc3)CC[C@@H]21	ZINC000875194567	ED	On-Demand	Anodyne	DRD2	28	44
CN1CC[C@H]2CN(C(=O)NCCCNC(=O)c3ccccc3)CC[C@@H]21	ZINC000875194567	ED	On-Demand	Anodyne	DRD4	41	33
CN1CC[C@H]2CN(C(=O)NCCCNC(=O)c3ccccc3)CC[C@@H]21	ZINC000875194567	ED	On-Demand	Anodyne	HTR2A	17	44
CN1CC[C@H]2CN(C(=O)NCCCNC(=O)c3ccccc3)CC[C@@H]21	ZINC000875194567	ED	On-Demand	Anodyne	DRD3	51	44
CN1CC[C@H]2CN(C(=O)NCCCNC(=O)c3ccccc3)CC[C@@H]21	ZINC000875194567	ED	On-Demand	Anodyne	PLD1	64	38
CN1CC[C@H]2CN(C(=O)NCCCNC(=O)c3ccccc3)CC[C@@H]21	ZINC000875194567	ED	On-Demand	Anodyne	PLD2	54	38
CN1CC[C@H]2CN(C(=O)NCCCNC(=O)c3ccccc3)CC[C@@H]21	ZINC000875194567	ED	On-Demand	Anodyne	L3MBTL3	27	43
COc1ccccc1N1CC[C@@H](CNC(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)C1	ZINC000875194570	GH	On-Demand	Anodyne	HTR1A	53	41
COc1ccccc1N1CC[C@@H](CNC(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)C1	ZINC000875194570	GH	On-Demand	Anodyne	DRD2	39	41
COc1ccccc1N1CC[C@@H](CNC(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)C1	ZINC000875194570	GH	On-Demand	Anodyne	ADRA1D	40	35
COc1ccccc1N1CC[C@@H](CNC(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)C1	ZINC000875194570	GH	On-Demand	Anodyne	DRD3	46	38
COc1ccccc1N1CC[C@H](CNC(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)C1	ZINC000875194571	GH	On-Demand	Anodyne	HTR1A	53	41
COc1ccccc1N1CC[C@H](CNC(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)C1	ZINC000875194571	GH	On-Demand	Anodyne	DRD2	39	41
COc1ccccc1N1CC[C@H](CNC(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)C1	ZINC000875194571	GH	On-Demand	Anodyne	ADRA1D	40	35
COc1ccccc1N1CC[C@H](CNC(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)C1	ZINC000875194571	GH	On-Demand	Anodyne	DRD3	46	38
CCC(=O)Nc1ccccc1C(=O)NC1CCCC1	ZINC000875194586	CF	On-Demand	Anodyne	CNR1	27	48
CCC(=O)Nc1ccccc1C(=O)NC1CCCC1	ZINC000875194586	CF	On-Demand	Anodyne	CNR2	42	48
CCC(=O)Nc1ccccc1C(=O)NC1CCCC1	ZINC000875194586	CF	On-Demand	Anodyne	KCNA3	21	44
CCC(=O)Nc1ccccc1C(=O)NC1CCCC1	ZINC000875194586	CF	On-Demand	Anodyne	EPHX2	27	42
CCC(=O)Nc1ccccc1C(=O)NC1CCCC1	ZINC000875194586	CF	On-Demand	Anodyne	CCR8	45	41
N#Cc1ccc(Cn2cc(NC(=O)NC3CCSCC3)cn2)cc1	ZINC000875194603	EF	On-Demand	Mild	ITK	18	52
N#Cc1ccc(Cn2cc(NC(=O)NC3CCSCC3)cn2)cc1	ZINC000875194603	EF	On-Demand	Mild	PANC	56	38
O=C(NCCCNC(=O)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1)c1ccccc1	ZINC000875194604	GC	On-Demand	Anodyne	DRD2	16	40
O=C(NCCCNC(=O)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1)c1ccccc1	ZINC000875194604	GC	On-Demand	Anodyne	DRD3	29	40
O=C(NCCCNC(=O)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1)c1ccccc1	ZINC000875194607	GC	On-Demand	Anodyne	DRD2	16	40
O=C(NCCCNC(=O)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1)c1ccccc1	ZINC000875194607	GC	On-Demand	Anodyne	DRD3	29	40
O=C(NCCCNC(=O)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1)c1ccccc1	ZINC000875194609	GC	On-Demand	Anodyne	DRD2	16	40
O=C(NCCCNC(=O)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1)c1ccccc1	ZINC000875194609	GC	On-Demand	Anodyne	DRD3	29	40
O=C(NCCCNC(=O)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1)c1ccccc1	ZINC000875194611	GC	On-Demand	Anodyne	DRD2	16	40
O=C(NCCCNC(=O)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1)c1ccccc1	ZINC000875194611	GC	On-Demand	Anodyne	DRD3	29	40
O=C1CCN(C(=O)NCCCNC(=O)c2ccccc2)CCCCCCN1	ZINC000875194668	FD	On-Demand	Anodyne	PLD2	40	33
O=C1CCN(C(=O)NCCCNC(=O)c2ccccc2)CCCCCCN1	ZINC000875194668	FD	On-Demand	Anodyne	DPP7	29	48
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCNC(=O)c3ccccc3)C[C@@H]1C2	ZINC000875194675	FD	On-Demand	Anodyne	DRD3	23	40
C[C@@H]1CN(Cc2ccccc2)C[C@H]1CNC(=O)C(=O)NC[C@@H]1CCC=CO1	ZINC000875194724	FD	On-Demand	Anodyne	DRD4	17	46
N#Cc1cc(C(=O)Nc2sc3c(c2C#N)CCCCCC3)co1	ZINC000875194736	EH	On-Demand	Mild	VIPR1	33	52
CCO[C@@H](C(=O)Nc1sc2c(c1C#N)CCCCCC2)[C@@H]1CCOC1	ZINC000875194756	FH	On-Demand	Mild	VIPR1	28	44
CCO[C@@H](C(=O)Nc1sc2c(c1C#N)CCCCCC2)[C@H]1CCOC1	ZINC000875194759	FH	On-Demand	Mild	VIPR1	28	44
C[C@@H](CCNC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875194768	DG	On-Demand	Anodyne	TRY1_BOVIN	45	33
C[C@@H](CCNC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875194768	DG	On-Demand	Anodyne	AMY2	46	31
C[C@@H](CCNC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875194770	DG	On-Demand	Anodyne	TRY1_BOVIN	45	33
C[C@@H](CCNC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875194770	DG	On-Demand	Anodyne	AMY2	46	31
O=C(NCc1ccc(OC2CCCCC2)cc1)N1CCC2(CCNC2=O)CC1	ZINC000875194803	GG	On-Demand	Anodyne	EPHX2	20	42
COc1cccc([C@H](CNC(=O)NCCN2CCO[C@H](C)C2)OC)c1	ZINC000875194804	FD	On-Demand	Anodyne	DRD4	49	37
COc1cccc([C@H](CNC(=O)NCCN2CCO[C@H](C)C2)OC)c1	ZINC000875194804	FD	On-Demand	Anodyne	CASR	26	43
COc1cccc([C@H](CNC(=O)NCCN2CCO[C@@H](C)C2)OC)c1	ZINC000875194807	FD	On-Demand	Anodyne	DRD4	49	37
COc1cccc([C@H](CNC(=O)NCCN2CCO[C@@H](C)C2)OC)c1	ZINC000875194807	FD	On-Demand	Anodyne	CASR	26	43
C[C@H]1CC(=O)N[C@@H](C(=O)Nc2sc3c(c2C#N)CCCCCC3)C1	ZINC000875194821	EG	On-Demand	Mild	VIPR1	30	46
C[C@@H]1CN(CCNC(=O)N2CCO[C@H](c3noc(C4CC4)n3)C2)CCO1	ZINC000875194839	FC	On-Demand	Anodyne	ETHR	41	35
C[C@@H]1CN(CCNC(=O)N2CCO[C@@H](c3noc(C4CC4)n3)C2)CCO1	ZINC000875194841	FC	On-Demand	Anodyne	ETHR	41	35
COc1ccccc1C[C@@](C)(CO)NC(=O)NCCN1CCO[C@H](C)C1	ZINC000875194842	FD	On-Demand	Anodyne	DRD2	15	40
COc1ccccc1C[C@](C)(CO)NC(=O)NCCN1CCO[C@H](C)C1	ZINC000875194844	FD	On-Demand	Anodyne	DRD2	15	40
COc1ccccc1C[C@](C)(CO)NC(=O)NCCN1CCO[C@@H](C)C1	ZINC000875194846	FD	On-Demand	Anodyne	DRD2	15	40
COc1ccccc1C[C@@](C)(CO)NC(=O)NCCN1CCO[C@@H](C)C1	ZINC000875194848	FD	On-Demand	Anodyne	DRD2	15	40
COc1ccccc1N1CC[C@H](CNC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875194895	FE	On-Demand	Anodyne	HTR1A	76	45
COc1ccccc1N1CC[C@H](CNC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875194895	FE	On-Demand	Anodyne	DRD2	61	47
COc1ccccc1N1CC[C@H](CNC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875194895	FE	On-Demand	Anodyne	DRD4	34	42
COc1ccccc1N1CC[C@H](CNC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875194895	FE	On-Demand	Anodyne	ADRA1D	60	43
COc1ccccc1N1CC[C@H](CNC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875194895	FE	On-Demand	Anodyne	HTR2A	18	41
COc1ccccc1N1CC[C@H](CNC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875194895	FE	On-Demand	Anodyne	ADRA1A	54	43
COc1ccccc1N1CC[C@H](CNC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875194895	FE	On-Demand	Anodyne	ADRA1B	46	43
COc1ccccc1N1CC[C@H](CNC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875194895	FE	On-Demand	Anodyne	DRD3	64	43
COc1ccccc1N1CC[C@H](CNC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875194895	FE	On-Demand	Anodyne	HTR7	49	41
COc1ccccc1N1CC[C@H](CNC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875194895	FE	On-Demand	Anodyne	CACNA1I	42	32
COc1ccccc1N1CC[C@@H](CNC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875194897	FE	On-Demand	Anodyne	HTR1A	76	45
COc1ccccc1N1CC[C@@H](CNC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875194897	FE	On-Demand	Anodyne	DRD2	61	47
COc1ccccc1N1CC[C@@H](CNC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875194897	FE	On-Demand	Anodyne	DRD4	34	42
COc1ccccc1N1CC[C@@H](CNC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875194897	FE	On-Demand	Anodyne	ADRA1D	60	43
COc1ccccc1N1CC[C@@H](CNC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875194897	FE	On-Demand	Anodyne	HTR2A	18	41
COc1ccccc1N1CC[C@@H](CNC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875194897	FE	On-Demand	Anodyne	ADRA1A	54	43
COc1ccccc1N1CC[C@@H](CNC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875194897	FE	On-Demand	Anodyne	ADRA1B	46	43
COc1ccccc1N1CC[C@@H](CNC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875194897	FE	On-Demand	Anodyne	DRD3	64	43
COc1ccccc1N1CC[C@@H](CNC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875194897	FE	On-Demand	Anodyne	HTR7	49	41
COc1ccccc1N1CC[C@@H](CNC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875194897	FE	On-Demand	Anodyne	CACNA1I	42	32
COc1ccccc1N1CC[C@H](CNC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875194899	FE	On-Demand	Anodyne	HTR1A	76	45
COc1ccccc1N1CC[C@H](CNC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875194899	FE	On-Demand	Anodyne	DRD2	61	47
COc1ccccc1N1CC[C@H](CNC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875194899	FE	On-Demand	Anodyne	DRD4	34	42
COc1ccccc1N1CC[C@H](CNC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875194899	FE	On-Demand	Anodyne	ADRA1D	60	43
COc1ccccc1N1CC[C@H](CNC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875194899	FE	On-Demand	Anodyne	HTR2A	18	41
COc1ccccc1N1CC[C@H](CNC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875194899	FE	On-Demand	Anodyne	ADRA1A	54	43
COc1ccccc1N1CC[C@H](CNC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875194899	FE	On-Demand	Anodyne	ADRA1B	46	43
COc1ccccc1N1CC[C@H](CNC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875194899	FE	On-Demand	Anodyne	DRD3	64	43
COc1ccccc1N1CC[C@H](CNC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875194899	FE	On-Demand	Anodyne	HTR7	49	41
COc1ccccc1N1CC[C@H](CNC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875194899	FE	On-Demand	Anodyne	CACNA1I	42	32
COc1ccccc1N1CC[C@@H](CNC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875194902	FE	On-Demand	Anodyne	HTR1A	76	45
COc1ccccc1N1CC[C@@H](CNC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875194902	FE	On-Demand	Anodyne	DRD2	61	47
COc1ccccc1N1CC[C@@H](CNC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875194902	FE	On-Demand	Anodyne	DRD4	34	42
COc1ccccc1N1CC[C@@H](CNC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875194902	FE	On-Demand	Anodyne	ADRA1D	60	43
COc1ccccc1N1CC[C@@H](CNC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875194902	FE	On-Demand	Anodyne	HTR2A	18	41
COc1ccccc1N1CC[C@@H](CNC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875194902	FE	On-Demand	Anodyne	ADRA1A	54	43
COc1ccccc1N1CC[C@@H](CNC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875194902	FE	On-Demand	Anodyne	ADRA1B	46	43
COc1ccccc1N1CC[C@@H](CNC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875194902	FE	On-Demand	Anodyne	DRD3	64	43
COc1ccccc1N1CC[C@@H](CNC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875194902	FE	On-Demand	Anodyne	HTR7	49	41
COc1ccccc1N1CC[C@@H](CNC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875194902	FE	On-Demand	Anodyne	CACNA1I	42	32
NC(=O)C1CC(NC(=O)NCc2ccc(OC3CCCCC3)cc2)C1	ZINC000875194918	EE	On-Demand	Anodyne	EPHX2	37	47
NC(=O)C1CC(NC(=O)NCc2ccc(OC3CCCCC3)cc2)C1	ZINC000875194918	EE	On-Demand	Anodyne	TPSAB1	15	43
C[C@@H]1CN(CCNC(=O)N[C@@H]2C[C@@H](S(=O)(=O)c3ccccc3)C2)CCO1	ZINC000875194922	GD	On-Demand	Anodyne	CTSS	20	40
O=C(NCc1cccc(F)c1F)C(=O)NC[C@H]1CCC=CO1	ZINC000875194932	DD	On-Demand	Anodyne	P2RX7	15	42
O=C(NCc1cccc(F)c1F)C(=O)NC[C@@H]1CCC=CO1	ZINC000875194934	DD	On-Demand	Anodyne	P2RX7	15	42
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2cccc(C)n2)C1	ZINC000875194944	FF	On-Demand	Reactive	HTR1A	72	41
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2cccc(C)n2)C1	ZINC000875194944	FF	On-Demand	Reactive	DRD2	49	41
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2cccc(C)n2)C1	ZINC000875194944	FF	On-Demand	Reactive	ADRA1D	42	38
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2cccc(C)n2)C1	ZINC000875194944	FF	On-Demand	Reactive	ADRA1A	41	38
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2cccc(C)n2)C1	ZINC000875194944	FF	On-Demand	Reactive	DRD3	59	39
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2cccc(C)n2)C1	ZINC000875194944	FF	On-Demand	Reactive	HTR7	49	39
COc1ccccc1N1CC[C@H](CNC(=O)NNc2cccc(C)n2)C1	ZINC000875194949	FF	On-Demand	Reactive	HTR1A	72	41
COc1ccccc1N1CC[C@H](CNC(=O)NNc2cccc(C)n2)C1	ZINC000875194949	FF	On-Demand	Reactive	DRD2	49	41
COc1ccccc1N1CC[C@H](CNC(=O)NNc2cccc(C)n2)C1	ZINC000875194949	FF	On-Demand	Reactive	ADRA1D	42	38
COc1ccccc1N1CC[C@H](CNC(=O)NNc2cccc(C)n2)C1	ZINC000875194949	FF	On-Demand	Reactive	ADRA1A	41	38
COc1ccccc1N1CC[C@H](CNC(=O)NNc2cccc(C)n2)C1	ZINC000875194949	FF	On-Demand	Reactive	DRD3	59	39
COc1ccccc1N1CC[C@H](CNC(=O)NNc2cccc(C)n2)C1	ZINC000875194949	FF	On-Demand	Reactive	HTR7	49	39
COCCN(CC1CCN(C)CC1)C(=O)NCCCNC(=O)c1ccccc1	ZINC000875194968	GD	On-Demand	Anodyne	HTR1A	16	42
COCCN(CC1CCN(C)CC1)C(=O)NCCCNC(=O)c1ccccc1	ZINC000875194968	GD	On-Demand	Anodyne	DRD2	24	42
COCCN(CC1CCN(C)CC1)C(=O)NCCCNC(=O)c1ccccc1	ZINC000875194968	GD	On-Demand	Anodyne	DRD4	41	32
COCCN(CC1CCN(C)CC1)C(=O)NCCCNC(=O)c1ccccc1	ZINC000875194968	GD	On-Demand	Anodyne	ACHE	17	44
COCCN(CC1CCN(C)CC1)C(=O)NCCCNC(=O)c1ccccc1	ZINC000875194968	GD	On-Demand	Anodyne	DRD3	43	42
COCCN(CC1CCN(C)CC1)C(=O)NCCCNC(=O)c1ccccc1	ZINC000875194968	GD	On-Demand	Anodyne	CACNA1I	57	37
COCCN(CC1CCN(C)CC1)C(=O)NCCCNC(=O)c1ccccc1	ZINC000875194968	GD	On-Demand	Anodyne	ACKR3	57	35
O=C(NCc1ccc(OC2CCCCC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875194979	GF	On-Demand	Anodyne	EPHX2	27	46
COC(=O)[C@@]12C[C@@H](NC(=O)NC[C@H]3CCN(c4ccccc4OC)C3)C[C@@H]1C2	ZINC000875194991	GE	On-Demand	Anodyne	HTR1A	49	43
COC(=O)[C@@]12C[C@@H](NC(=O)NC[C@H]3CCN(c4ccccc4OC)C3)C[C@@H]1C2	ZINC000875194991	GE	On-Demand	Anodyne	DRD2	43	41
COC(=O)[C@@]12C[C@@H](NC(=O)NC[C@H]3CCN(c4ccccc4OC)C3)C[C@@H]1C2	ZINC000875194991	GE	On-Demand	Anodyne	ADRA1D	40	36
COC(=O)[C@@]12C[C@@H](NC(=O)NC[C@H]3CCN(c4ccccc4OC)C3)C[C@@H]1C2	ZINC000875194991	GE	On-Demand	Anodyne	DRD3	48	38
COC(=O)[C@@]12C[C@@H](NC(=O)NC[C@@H]3CCN(c4ccccc4OC)C3)C[C@@H]1C2	ZINC000875194992	GE	On-Demand	Anodyne	HTR1A	49	43
COC(=O)[C@@]12C[C@@H](NC(=O)NC[C@@H]3CCN(c4ccccc4OC)C3)C[C@@H]1C2	ZINC000875194992	GE	On-Demand	Anodyne	DRD2	43	41
COC(=O)[C@@]12C[C@@H](NC(=O)NC[C@@H]3CCN(c4ccccc4OC)C3)C[C@@H]1C2	ZINC000875194992	GE	On-Demand	Anodyne	ADRA1D	40	36
COC(=O)[C@@]12C[C@@H](NC(=O)NC[C@@H]3CCN(c4ccccc4OC)C3)C[C@@H]1C2	ZINC000875194992	GE	On-Demand	Anodyne	DRD3	48	38
N#Cc1c(NC(=O)C2(F)CCOCC2)sc2c1CCCCCC2	ZINC000875195077	EH	On-Demand	Mild	VIPR1	32	52
C[C@@H]1CN(CCNC(=O)N2CCC(c3nc(C4CCC4)no3)CC2)CCO1	ZINC000875195145	GD	On-Demand	Anodyne	ETHR	53	45
O=CN1CCCN(C(=O)NCCCNC(=O)c2ccccc2)CC1	ZINC000875195167	EC	On-Demand	Anodyne	DRD2	15	41
O=CN1CCCN(C(=O)NCCCNC(=O)c2ccccc2)CC1	ZINC000875195167	EC	On-Demand	Anodyne	DRD3	30	41
O=CN1CCCN(C(=O)NCCCNC(=O)c2ccccc2)CC1	ZINC000875195167	EC	On-Demand	Anodyne	DPP7	25	48
O=C(NC1CCSCC1)NC1CC(Nc2ccccc2)C1	ZINC000875195177	DF	On-Demand	Anodyne	EPHX2	37	49
C[C@@H]1CN(CCNC(=O)N2CCN(Cc3cc4ccccc4[nH]3)CC2)CCO1	ZINC000875195178	GD	On-Demand	Anodyne	PLD1	45	36
COc1ccccc1N1CC[C@@H](CNC(=O)NN=c2cc[nH]c(C)c2)C1	ZINC000875195182	FD	On-Demand	Reactive	HTR1A	51	40
COc1ccccc1N1CC[C@@H](CNC(=O)NN=c2cc[nH]c(C)c2)C1	ZINC000875195182	FD	On-Demand	Reactive	DRD2	42	40
COc1ccccc1N1CC[C@@H](CNC(=O)NN=c2cc[nH]c(C)c2)C1	ZINC000875195182	FD	On-Demand	Reactive	DRD3	47	38
COc1ccccc1N1CC[C@H](CNC(=O)NN=c2cc[nH]c(C)c2)C1	ZINC000875195184	FD	On-Demand	Reactive	HTR1A	51	40
COc1ccccc1N1CC[C@H](CNC(=O)NN=c2cc[nH]c(C)c2)C1	ZINC000875195184	FD	On-Demand	Reactive	DRD2	42	40
COc1ccccc1N1CC[C@H](CNC(=O)NN=c2cc[nH]c(C)c2)C1	ZINC000875195184	FD	On-Demand	Reactive	DRD3	47	38
COc1ccccc1N1CC[C@H](CNC(=O)NCC[C@H](O)C2CCCC2)C1	ZINC000875195200	GF	On-Demand	Anodyne	HTR1A	70	47
COc1ccccc1N1CC[C@H](CNC(=O)NCC[C@H](O)C2CCCC2)C1	ZINC000875195200	GF	On-Demand	Anodyne	DRD2	63	46
COc1ccccc1N1CC[C@H](CNC(=O)NCC[C@H](O)C2CCCC2)C1	ZINC000875195200	GF	On-Demand	Anodyne	DRD4	32	41
COc1ccccc1N1CC[C@H](CNC(=O)NCC[C@H](O)C2CCCC2)C1	ZINC000875195200	GF	On-Demand	Anodyne	ADRA1D	61	38
COc1ccccc1N1CC[C@H](CNC(=O)NCC[C@H](O)C2CCCC2)C1	ZINC000875195200	GF	On-Demand	Anodyne	HTR2A	16	40
COc1ccccc1N1CC[C@H](CNC(=O)NCC[C@H](O)C2CCCC2)C1	ZINC000875195200	GF	On-Demand	Anodyne	ADRA1A	55	38
COc1ccccc1N1CC[C@H](CNC(=O)NCC[C@H](O)C2CCCC2)C1	ZINC000875195200	GF	On-Demand	Anodyne	ADRA1B	46	38
COc1ccccc1N1CC[C@H](CNC(=O)NCC[C@H](O)C2CCCC2)C1	ZINC000875195200	GF	On-Demand	Anodyne	DRD3	63	42
COc1ccccc1N1CC[C@H](CNC(=O)NCC[C@H](O)C2CCCC2)C1	ZINC000875195200	GF	On-Demand	Anodyne	HTR7	44	39
COc1ccccc1N1CC[C@@H](CNC(=O)NCC[C@H](O)C2CCCC2)C1	ZINC000875195202	GF	On-Demand	Anodyne	HTR1A	70	47
COc1ccccc1N1CC[C@@H](CNC(=O)NCC[C@H](O)C2CCCC2)C1	ZINC000875195202	GF	On-Demand	Anodyne	DRD2	63	46
COc1ccccc1N1CC[C@@H](CNC(=O)NCC[C@H](O)C2CCCC2)C1	ZINC000875195202	GF	On-Demand	Anodyne	DRD4	32	41
COc1ccccc1N1CC[C@@H](CNC(=O)NCC[C@H](O)C2CCCC2)C1	ZINC000875195202	GF	On-Demand	Anodyne	ADRA1D	61	38
COc1ccccc1N1CC[C@@H](CNC(=O)NCC[C@H](O)C2CCCC2)C1	ZINC000875195202	GF	On-Demand	Anodyne	HTR2A	16	40
COc1ccccc1N1CC[C@@H](CNC(=O)NCC[C@H](O)C2CCCC2)C1	ZINC000875195202	GF	On-Demand	Anodyne	ADRA1A	55	38
COc1ccccc1N1CC[C@@H](CNC(=O)NCC[C@H](O)C2CCCC2)C1	ZINC000875195202	GF	On-Demand	Anodyne	ADRA1B	46	38
COc1ccccc1N1CC[C@@H](CNC(=O)NCC[C@H](O)C2CCCC2)C1	ZINC000875195202	GF	On-Demand	Anodyne	DRD3	63	42
COc1ccccc1N1CC[C@@H](CNC(=O)NCC[C@H](O)C2CCCC2)C1	ZINC000875195202	GF	On-Demand	Anodyne	HTR7	44	39
COc1ccccc1N1CC[C@@H](CNC(=O)NCC[C@@H](O)C2CCCC2)C1	ZINC000875195203	GF	On-Demand	Anodyne	HTR1A	70	47
COc1ccccc1N1CC[C@@H](CNC(=O)NCC[C@@H](O)C2CCCC2)C1	ZINC000875195203	GF	On-Demand	Anodyne	DRD2	63	46
COc1ccccc1N1CC[C@@H](CNC(=O)NCC[C@@H](O)C2CCCC2)C1	ZINC000875195203	GF	On-Demand	Anodyne	DRD4	32	41
COc1ccccc1N1CC[C@@H](CNC(=O)NCC[C@@H](O)C2CCCC2)C1	ZINC000875195203	GF	On-Demand	Anodyne	ADRA1D	61	38
COc1ccccc1N1CC[C@@H](CNC(=O)NCC[C@@H](O)C2CCCC2)C1	ZINC000875195203	GF	On-Demand	Anodyne	HTR2A	16	40
COc1ccccc1N1CC[C@@H](CNC(=O)NCC[C@@H](O)C2CCCC2)C1	ZINC000875195203	GF	On-Demand	Anodyne	ADRA1A	55	38
COc1ccccc1N1CC[C@@H](CNC(=O)NCC[C@@H](O)C2CCCC2)C1	ZINC000875195203	GF	On-Demand	Anodyne	ADRA1B	46	38
COc1ccccc1N1CC[C@@H](CNC(=O)NCC[C@@H](O)C2CCCC2)C1	ZINC000875195203	GF	On-Demand	Anodyne	DRD3	63	42
COc1ccccc1N1CC[C@@H](CNC(=O)NCC[C@@H](O)C2CCCC2)C1	ZINC000875195203	GF	On-Demand	Anodyne	HTR7	44	39
COc1ccccc1N1CC[C@H](CNC(=O)NCC[C@@H](O)C2CCCC2)C1	ZINC000875195204	GF	On-Demand	Anodyne	HTR1A	70	47
COc1ccccc1N1CC[C@H](CNC(=O)NCC[C@@H](O)C2CCCC2)C1	ZINC000875195204	GF	On-Demand	Anodyne	DRD2	63	46
COc1ccccc1N1CC[C@H](CNC(=O)NCC[C@@H](O)C2CCCC2)C1	ZINC000875195204	GF	On-Demand	Anodyne	DRD4	32	41
COc1ccccc1N1CC[C@H](CNC(=O)NCC[C@@H](O)C2CCCC2)C1	ZINC000875195204	GF	On-Demand	Anodyne	ADRA1D	61	38
COc1ccccc1N1CC[C@H](CNC(=O)NCC[C@@H](O)C2CCCC2)C1	ZINC000875195204	GF	On-Demand	Anodyne	HTR2A	16	40
COc1ccccc1N1CC[C@H](CNC(=O)NCC[C@@H](O)C2CCCC2)C1	ZINC000875195204	GF	On-Demand	Anodyne	ADRA1A	55	38
COc1ccccc1N1CC[C@H](CNC(=O)NCC[C@@H](O)C2CCCC2)C1	ZINC000875195204	GF	On-Demand	Anodyne	ADRA1B	46	38
COc1ccccc1N1CC[C@H](CNC(=O)NCC[C@@H](O)C2CCCC2)C1	ZINC000875195204	GF	On-Demand	Anodyne	DRD3	63	42
COc1ccccc1N1CC[C@H](CNC(=O)NCC[C@@H](O)C2CCCC2)C1	ZINC000875195204	GF	On-Demand	Anodyne	HTR7	44	39
COC(=O)N(C)NC(=O)NCCCNC(=O)c1ccccc1	ZINC000875195208	DC	On-Demand	Reactive	DRD3	27	40
COC(=O)N(C)NC(=O)NCCCNC(=O)c1ccccc1	ZINC000875195208	DC	On-Demand	Reactive	CTSG	17	40
COC(=O)N(C)NC(=O)NCCCNC(=O)c1ccccc1	ZINC000875195208	DC	On-Demand	Reactive	CTRB1	29	40
O=C(NC1CCSCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875195210	EE	On-Demand	Anodyne	DRD4	29	48
O=C(NC1CCSCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875195210	EE	On-Demand	Anodyne	SIGMAR1	37	48
O=C(NC1CCSCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875195210	EE	On-Demand	Anodyne	CCR3	18	43
O=C(NC1CCSCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875195210	EE	On-Demand	Anodyne	EPHX2	15	47
CC[C@@H](NC(=O)NCCCNC(=O)c1ccccc1)[C@@H](O)c1ccccc1	ZINC000875195241	FF	On-Demand	Anodyne	FOLH1	31	41
CC[C@@H](NC(=O)NCCCNC(=O)c1ccccc1)[C@@H](O)c1ccccc1	ZINC000875195241	FF	On-Demand	Anodyne	C3AR1	47	31
CC[C@@H](NC(=O)NCCCNC(=O)c1ccccc1)[C@H](O)c1ccccc1	ZINC000875195248	FF	On-Demand	Anodyne	FOLH1	31	41
CC[C@@H](NC(=O)NCCCNC(=O)c1ccccc1)[C@H](O)c1ccccc1	ZINC000875195248	FF	On-Demand	Anodyne	C3AR1	47	31
O=CN1CCCN(C(=O)NCc2ccc(OC3CCCCC3)cc2)CC1	ZINC000875195276	FF	On-Demand	Anodyne	EPHX2	23	45
CN1CCN(C(=O)NCCCNC(=O)c2ccccc2)Cc2cccnc21	ZINC000875195277	FD	On-Demand	Anodyne	HTR1A	20	49
CN1CCN(C(=O)NCCCNC(=O)c2ccccc2)Cc2cccnc21	ZINC000875195277	FD	On-Demand	Anodyne	DRD2	23	42
CN1CCN(C(=O)NCCCNC(=O)c2ccccc2)Cc2cccnc21	ZINC000875195277	FD	On-Demand	Anodyne	DRD4	40	32
CN1CCN(C(=O)NCCCNC(=O)c2ccccc2)Cc2cccnc21	ZINC000875195277	FD	On-Demand	Anodyne	DRD3	42	45
CC(=O)[C@H]1CCCN(C(=O)NCCNC(=O)c2cccc(Br)c2)C1	ZINC000875195278	GE	On-Demand	Anodyne	DRD4	44	34
CC(=O)[C@H]1CCCN(C(=O)NCCNC(=O)c2cccc(Br)c2)C1	ZINC000875195278	GE	On-Demand	Anodyne	CCR2	19	43
CC(=O)[C@H]1CCCN(C(=O)NCCNC(=O)c2cccc(Br)c2)C1	ZINC000875195278	GE	On-Demand	Anodyne	DPP7	23	42
CC(=O)[C@@H]1CCCN(C(=O)NCCNC(=O)c2cccc(Br)c2)C1	ZINC000875195279	GE	On-Demand	Anodyne	DRD4	44	34
CC(=O)[C@@H]1CCCN(C(=O)NCCNC(=O)c2cccc(Br)c2)C1	ZINC000875195279	GE	On-Demand	Anodyne	CCR2	19	43
CC(=O)[C@@H]1CCCN(C(=O)NCCNC(=O)c2cccc(Br)c2)C1	ZINC000875195279	GE	On-Demand	Anodyne	DPP7	23	42
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875195290	GD	On-Demand	Anodyne	HTR1A	71	45
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875195290	GD	On-Demand	Anodyne	DRD2	50	43
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875195290	GD	On-Demand	Anodyne	DRD4	32	42
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875195290	GD	On-Demand	Anodyne	ADRA1D	52	45
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875195290	GD	On-Demand	Anodyne	ADRA1A	47	45
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875195290	GD	On-Demand	Anodyne	ADRA1B	43	45
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875195290	GD	On-Demand	Anodyne	DRD3	56	40
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875195290	GD	On-Demand	Anodyne	HTR7	47	40
COc1ccccc1N1CC[C@H](CNC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875195291	GD	On-Demand	Anodyne	HTR1A	71	45
COc1ccccc1N1CC[C@H](CNC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875195291	GD	On-Demand	Anodyne	DRD2	50	43
COc1ccccc1N1CC[C@H](CNC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875195291	GD	On-Demand	Anodyne	DRD4	32	42
COc1ccccc1N1CC[C@H](CNC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875195291	GD	On-Demand	Anodyne	ADRA1D	52	45
COc1ccccc1N1CC[C@H](CNC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875195291	GD	On-Demand	Anodyne	ADRA1A	47	45
COc1ccccc1N1CC[C@H](CNC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875195291	GD	On-Demand	Anodyne	ADRA1B	43	45
COc1ccccc1N1CC[C@H](CNC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875195291	GD	On-Demand	Anodyne	DRD3	56	40
COc1ccccc1N1CC[C@H](CNC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875195291	GD	On-Demand	Anodyne	HTR7	47	40
C[C@H](NC(=O)NCCCNC(=O)c1ccccc1)c1ccccc1O	ZINC000875195298	EF	On-Demand	Clean	FOLH1	31	40
C[C@H](NC(=O)NCCCNC(=O)c1ccccc1)c1ccccc1O	ZINC000875195298	EF	On-Demand	Clean	SOAT1	17	40
C[C@@H](NC(=O)NCCCNC(=O)c1ccccc1)c1ccccc1O	ZINC000875195299	EF	On-Demand	Clean	FOLH1	31	40
C[C@@H](NC(=O)NCCCNC(=O)c1ccccc1)c1ccccc1O	ZINC000875195299	EF	On-Demand	Clean	SOAT1	17	40
O=C(NC1CCSCC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875195319	DF	On-Demand	Anodyne	EPHX2	29	46
O=C(NC1CCSCC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875195321	DF	On-Demand	Anodyne	EPHX2	29	46
Cn1nnnc1C1CCN(C(=O)NCc2ccc(OC3CCCCC3)cc2)CC1	ZINC000875195326	GG	On-Demand	Anodyne	PRSS2	42	34
Cn1nnnc1C1CCN(C(=O)NCc2ccc(OC3CCCCC3)cc2)CC1	ZINC000875195326	GG	On-Demand	Anodyne	EPHX2	19	43
COC(=O)N(C)NC(=O)NCC(=O)N1CCN(c2ccc(Cl)cc2)CC1	ZINC000875195334	GC	On-Demand	Reactive	CCR1	23	40
COC(=O)N(C)NC(=O)NCC(=O)N1CCN(c2ccc(Cl)cc2)CC1	ZINC000875195334	GC	On-Demand	Reactive	SSTR1	32	44
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2ccc(F)c(NC(C)=O)c2)cc1OC	ZINC000875195363	JI	On-Demand	Anodyne	F10	18	41
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2ccc(F)c(NC(C)=O)c2)cc1OC	ZINC000875195363	JI	On-Demand	Anodyne	MAPK14	15	48
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2ccc(F)c(NC(C)=O)c2)cc1OC	ZINC000875195363	JI	On-Demand	Anodyne	CPT1A	65	38
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2ccc(F)c(NC(C)=O)c2)cc1OC	ZINC000875195363	JI	On-Demand	Anodyne	CPT2	44	35
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2ccc(F)c(NC(C)=O)c2)cc1OC	ZINC000875195363	JI	On-Demand	Anodyne	PRNP	38	40
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2ccc(F)c(NC(C)=O)c2)cc1OC	ZINC000875195363	JI	On-Demand	Anodyne	ABCB1B	26	43
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2ccc(F)c(NC(C)=O)c2)cc1OC	ZINC000875195363	JI	On-Demand	Anodyne	GRM4	29	45
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2ccc(F)c(NC(C)=O)c2)cc1OC	ZINC000875195363	JI	On-Demand	Anodyne	NR1H4	18	51
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2ccc(F)c(NC(C)=O)c2)cc1OC	ZINC000875195363	JI	On-Demand	Anodyne	HDAC1	17	44
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2ccc(F)c(NC(C)=O)c2)cc1OC	ZINC000875195363	JI	On-Demand	Anodyne	HDAC2	17	44
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2ccc(F)c(NC(C)=O)c2)cc1OC	ZINC000875195363	JI	On-Demand	Anodyne	ABCB1	19	43
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2ccc(F)c(NC(C)=O)c2)cc1OC	ZINC000875195363	JI	On-Demand	Anodyne	TAAR1	25	44
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2ccc(F)c(NC(C)=O)c2)cc1OC	ZINC000875195363	JI	On-Demand	Anodyne	ABCG2	32	41
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2ccc(F)c(NC(C)=O)c2)cc1OC	ZINC000875195363	JI	On-Demand	Anodyne	SMO	30	45
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2ccc(F)c(NC(C)=O)c2)cc1OC	ZINC000875195363	JI	On-Demand	Anodyne	Q25615_ONCVO	49	37
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2ccc(F)c(NC(C)=O)c2)cc1OC	ZINC000875195363	JI	On-Demand	Anodyne	KCNK3	122	53
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2ccc(F)c(NC(C)=O)c2)cc1OC	ZINC000875195363	JI	On-Demand	Anodyne	KCNK9	83	44
CCCCCCCNC(=O)C(=O)NC[C@H]1CCC=CO1	ZINC000875195364	CD	On-Demand	Mild	ASAH1	56	33
CCCCCCCNC(=O)C(=O)NC[C@@H]1CCC=CO1	ZINC000875195365	CD	On-Demand	Mild	ASAH1	56	33
COc1ccc(-c2nnc(S)n2CC(=O)Nc2ccc(F)c(NC(C)=O)c2)cc1	ZINC000875195446	HF	On-Demand	Anodyne	ENPP1	65	30
COc1ccc(-c2nnc(S)n2CC(=O)Nc2ccc(F)c(NC(C)=O)c2)cc1	ZINC000875195446	HF	On-Demand	Anodyne	IMDH_CRYPV	33	41
C[C@@H]1CN(CCNC(=O)NC2CCN(c3ccccc3C#N)CC2)CCO1	ZINC000875195485	FD	On-Demand	Mild	DRD2	21	41
C[C@@H]1CN(CCNC(=O)NC2CCN(c3ccccc3C#N)CC2)CCO1	ZINC000875195485	FD	On-Demand	Mild	DRD3	27	41
C[C@@H]1CN(CCNC(=O)NC2CCN(c3ccccc3C#N)CC2)CCO1	ZINC000875195485	FD	On-Demand	Mild	NPY1R	15	40
C[C@@H]1CN(CCNC(=O)N2CCN(c3cccc(F)c3)CC2)CCO1	ZINC000875195509	FD	On-Demand	Anodyne	HTR1A	20	41
C[C@@H]1CN(CCNC(=O)N2CCN(c3cccc(F)c3)CC2)CCO1	ZINC000875195509	FD	On-Demand	Anodyne	DRD4	42	34
C[C@@H]1CN(CCNC(=O)N2CCN(c3cccc(F)c3)CC2)CCO1	ZINC000875195509	FD	On-Demand	Anodyne	DRD3	15	41
C[C@@H]1CN(CCNC(=O)N2CCN(c3cccc(F)c3)CC2)CCO1	ZINC000875195509	FD	On-Demand	Anodyne	SSTR1	18	40
C[C@]1(C(F)(F)F)CCN(C(=O)NCCCNC(=O)c2ccccc2)C1	ZINC000875195512	FF	On-Demand	Anodyne	DRD2	17	41
C[C@]1(C(F)(F)F)CCN(C(=O)NCCCNC(=O)c2ccccc2)C1	ZINC000875195512	FF	On-Demand	Anodyne	DRD3	34	41
C[C@]1(C(F)(F)F)CCN(C(=O)NCCCNC(=O)c2ccccc2)C1	ZINC000875195512	FF	On-Demand	Anodyne	EPHX2	27	42
O=C(NCCCNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000875195532	FF	On-Demand	Anodyne	DRD2	15	40
O=C(NCCCNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000875195532	FF	On-Demand	Anodyne	DRD3	30	40
O=C(NCCCNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000875195532	FF	On-Demand	Anodyne	PREP	32	43
O=C(NCCCNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000875195532	FF	On-Demand	Anodyne	EPHX2	31	41
O=C(NCCCNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000875195532	FF	On-Demand	Anodyne	DPP7	17	45
O=C(NCCCNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000875195532	FF	On-Demand	Anodyne	SCD1	17	43
O=C(NCCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000875195534	FF	On-Demand	Anodyne	DRD2	15	40
O=C(NCCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000875195534	FF	On-Demand	Anodyne	DRD3	30	40
O=C(NCCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000875195534	FF	On-Demand	Anodyne	PREP	32	43
O=C(NCCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000875195534	FF	On-Demand	Anodyne	EPHX2	31	41
O=C(NCCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000875195534	FF	On-Demand	Anodyne	DPP7	17	45
O=C(NCCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000875195534	FF	On-Demand	Anodyne	SCD1	17	43
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875195556	GF	On-Demand	Anodyne	HTR1A	74	44
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875195556	GF	On-Demand	Anodyne	DRD2	60	43
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875195556	GF	On-Demand	Anodyne	DRD4	30	40
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875195556	GF	On-Demand	Anodyne	ADRA1D	55	42
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875195556	GF	On-Demand	Anodyne	HTR2A	17	40
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875195556	GF	On-Demand	Anodyne	ADRA1A	50	42
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875195556	GF	On-Demand	Anodyne	ADRA1B	43	42
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875195556	GF	On-Demand	Anodyne	DRD3	60	40
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875195556	GF	On-Demand	Anodyne	HTR7	46	40
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875195556	GF	On-Demand	Anodyne	CACNA1I	41	31
COc1ccccc1N1CC[C@H](CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875195557	GF	On-Demand	Anodyne	HTR1A	74	44
COc1ccccc1N1CC[C@H](CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875195557	GF	On-Demand	Anodyne	DRD2	60	43
COc1ccccc1N1CC[C@H](CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875195557	GF	On-Demand	Anodyne	DRD4	30	40
COc1ccccc1N1CC[C@H](CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875195557	GF	On-Demand	Anodyne	ADRA1D	55	42
COc1ccccc1N1CC[C@H](CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875195557	GF	On-Demand	Anodyne	HTR2A	17	40
COc1ccccc1N1CC[C@H](CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875195557	GF	On-Demand	Anodyne	ADRA1A	50	42
COc1ccccc1N1CC[C@H](CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875195557	GF	On-Demand	Anodyne	ADRA1B	43	42
COc1ccccc1N1CC[C@H](CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875195557	GF	On-Demand	Anodyne	DRD3	60	40
COc1ccccc1N1CC[C@H](CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875195557	GF	On-Demand	Anodyne	HTR7	46	40
COc1ccccc1N1CC[C@H](CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875195557	GF	On-Demand	Anodyne	CACNA1I	41	31
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875195558	GF	On-Demand	Anodyne	HTR1A	74	44
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875195558	GF	On-Demand	Anodyne	DRD2	60	43
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875195558	GF	On-Demand	Anodyne	DRD4	30	40
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875195558	GF	On-Demand	Anodyne	ADRA1D	55	42
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875195558	GF	On-Demand	Anodyne	HTR2A	17	40
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875195558	GF	On-Demand	Anodyne	ADRA1A	50	42
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875195558	GF	On-Demand	Anodyne	ADRA1B	43	42
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875195558	GF	On-Demand	Anodyne	DRD3	60	40
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875195558	GF	On-Demand	Anodyne	HTR7	46	40
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875195558	GF	On-Demand	Anodyne	CACNA1I	41	31
COc1ccccc1N1CC[C@H](CNC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875195559	GF	On-Demand	Anodyne	HTR1A	74	44
COc1ccccc1N1CC[C@H](CNC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875195559	GF	On-Demand	Anodyne	DRD2	60	43
COc1ccccc1N1CC[C@H](CNC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875195559	GF	On-Demand	Anodyne	DRD4	30	40
COc1ccccc1N1CC[C@H](CNC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875195559	GF	On-Demand	Anodyne	ADRA1D	55	42
COc1ccccc1N1CC[C@H](CNC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875195559	GF	On-Demand	Anodyne	HTR2A	17	40
COc1ccccc1N1CC[C@H](CNC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875195559	GF	On-Demand	Anodyne	ADRA1A	50	42
COc1ccccc1N1CC[C@H](CNC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875195559	GF	On-Demand	Anodyne	ADRA1B	43	42
COc1ccccc1N1CC[C@H](CNC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875195559	GF	On-Demand	Anodyne	DRD3	60	40
COc1ccccc1N1CC[C@H](CNC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875195559	GF	On-Demand	Anodyne	HTR7	46	40
COc1ccccc1N1CC[C@H](CNC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875195559	GF	On-Demand	Anodyne	CACNA1I	41	31
CC[C@@H]1COCCN1CCNC(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875195565	GD	On-Demand	Anodyne	HTR1A	61	43
CC[C@@H]1COCCN1CCNC(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875195565	GD	On-Demand	Anodyne	DRD2	50	42
CC[C@@H]1COCCN1CCNC(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875195565	GD	On-Demand	Anodyne	DRD4	25	40
CC[C@@H]1COCCN1CCNC(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875195565	GD	On-Demand	Anodyne	ADRA1D	42	36
CC[C@@H]1COCCN1CCNC(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875195565	GD	On-Demand	Anodyne	DRD3	52	41
CC[C@@H]1COCCN1CCNC(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875195567	GD	On-Demand	Anodyne	HTR1A	61	43
CC[C@@H]1COCCN1CCNC(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875195567	GD	On-Demand	Anodyne	DRD2	50	42
CC[C@@H]1COCCN1CCNC(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875195567	GD	On-Demand	Anodyne	DRD4	25	40
CC[C@@H]1COCCN1CCNC(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875195567	GD	On-Demand	Anodyne	ADRA1D	42	36
CC[C@@H]1COCCN1CCNC(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875195567	GD	On-Demand	Anodyne	DRD3	52	41
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCCN(c2cccc(OC)c2)C1	ZINC000875195571	GD	On-Demand	Anodyne	DRD4	48	37
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCCN(c2cccc(OC)c2)C1	ZINC000875195571	GD	On-Demand	Anodyne	DRD3	21	44
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCCN(c2cccc(OC)c2)C1	ZINC000875195571	GD	On-Demand	Anodyne	MTNR1A	23	52
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCCN(c2cccc(OC)c2)C1	ZINC000875195571	GD	On-Demand	Anodyne	MTNR1B	24	52
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCCN(c2cccc(OC)c2)C1	ZINC000875195572	GD	On-Demand	Anodyne	DRD4	48	37
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCCN(c2cccc(OC)c2)C1	ZINC000875195572	GD	On-Demand	Anodyne	DRD3	21	44
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCCN(c2cccc(OC)c2)C1	ZINC000875195572	GD	On-Demand	Anodyne	MTNR1A	23	52
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCCN(c2cccc(OC)c2)C1	ZINC000875195572	GD	On-Demand	Anodyne	MTNR1B	24	52
CC(=O)C1CCN(C(=O)NCc2ccc(OC3CCCCC3)cc2)CC1	ZINC000875195575	FH	On-Demand	Anodyne	PRSS2	63	34
CC(=O)C1CCN(C(=O)NCc2ccc(OC3CCCCC3)cc2)CC1	ZINC000875195575	FH	On-Demand	Anodyne	HRH3	24	50
CC(=O)C1CCN(C(=O)NCc2ccc(OC3CCCCC3)cc2)CC1	ZINC000875195575	FH	On-Demand	Anodyne	EPHX2	33	49
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCN(C)C(C)(C)CC2)C1	ZINC000875195578	FF	On-Demand	Anodyne	HTR1A	72	44
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCN(C)C(C)(C)CC2)C1	ZINC000875195578	FF	On-Demand	Anodyne	DRD2	48	41
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCN(C)C(C)(C)CC2)C1	ZINC000875195578	FF	On-Demand	Anodyne	ADRA1D	47	44
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCN(C)C(C)(C)CC2)C1	ZINC000875195578	FF	On-Demand	Anodyne	ADRA1A	44	44
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCN(C)C(C)(C)CC2)C1	ZINC000875195578	FF	On-Demand	Anodyne	ADRA1B	38	44
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCN(C)C(C)(C)CC2)C1	ZINC000875195578	FF	On-Demand	Anodyne	DRD3	56	39
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCN(C)C(C)(C)CC2)C1	ZINC000875195578	FF	On-Demand	Anodyne	HTR7	48	40
COc1ccccc1N1CC[C@H](CNC(=O)N2CCN(C)C(C)(C)CC2)C1	ZINC000875195579	FF	On-Demand	Anodyne	HTR1A	72	44
COc1ccccc1N1CC[C@H](CNC(=O)N2CCN(C)C(C)(C)CC2)C1	ZINC000875195579	FF	On-Demand	Anodyne	DRD2	48	41
COc1ccccc1N1CC[C@H](CNC(=O)N2CCN(C)C(C)(C)CC2)C1	ZINC000875195579	FF	On-Demand	Anodyne	ADRA1D	47	44
COc1ccccc1N1CC[C@H](CNC(=O)N2CCN(C)C(C)(C)CC2)C1	ZINC000875195579	FF	On-Demand	Anodyne	ADRA1A	44	44
COc1ccccc1N1CC[C@H](CNC(=O)N2CCN(C)C(C)(C)CC2)C1	ZINC000875195579	FF	On-Demand	Anodyne	ADRA1B	38	44
COc1ccccc1N1CC[C@H](CNC(=O)N2CCN(C)C(C)(C)CC2)C1	ZINC000875195579	FF	On-Demand	Anodyne	DRD3	56	39
COc1ccccc1N1CC[C@H](CNC(=O)N2CCN(C)C(C)(C)CC2)C1	ZINC000875195579	FF	On-Demand	Anodyne	HTR7	48	40
COc1ccccc1[C@@H]1CN(C(=O)NCCCNC(=O)c2ccccc2)CCO1	ZINC000875195580	GF	On-Demand	Anodyne	HTR1A	29	49
COc1ccccc1[C@@H]1CN(C(=O)NCCCNC(=O)c2ccccc2)CCO1	ZINC000875195580	GF	On-Demand	Anodyne	DRD2	40	49
COc1ccccc1[C@@H]1CN(C(=O)NCCCNC(=O)c2ccccc2)CCO1	ZINC000875195580	GF	On-Demand	Anodyne	DRD4	42	32
COc1ccccc1[C@@H]1CN(C(=O)NCCCNC(=O)c2ccccc2)CCO1	ZINC000875195580	GF	On-Demand	Anodyne	DRD3	66	49
COc1ccccc1[C@@H]1CN(C(=O)NCCCNC(=O)c2ccccc2)CCO1	ZINC000875195580	GF	On-Demand	Anodyne	KCNA3	41	38
COc1ccccc1[C@H]1CN(C(=O)NCCCNC(=O)c2ccccc2)CCO1	ZINC000875195581	GF	On-Demand	Anodyne	HTR1A	29	49
COc1ccccc1[C@H]1CN(C(=O)NCCCNC(=O)c2ccccc2)CCO1	ZINC000875195581	GF	On-Demand	Anodyne	DRD2	40	49
COc1ccccc1[C@H]1CN(C(=O)NCCCNC(=O)c2ccccc2)CCO1	ZINC000875195581	GF	On-Demand	Anodyne	DRD4	42	32
COc1ccccc1[C@H]1CN(C(=O)NCCCNC(=O)c2ccccc2)CCO1	ZINC000875195581	GF	On-Demand	Anodyne	DRD3	66	49
COc1ccccc1[C@H]1CN(C(=O)NCCCNC(=O)c2ccccc2)CCO1	ZINC000875195581	GF	On-Demand	Anodyne	KCNA3	41	38
C[C@@H](CN(C)C(=O)NCCCNC(=O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000875195603	GE	On-Demand	Anodyne	FPR1	47	49
CC[C@H](C[C@H](C)O)NC(=O)NCCCNC(=O)c1ccccc1	ZINC000875195607	DD	On-Demand	Anodyne	FOLH1	31	41
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NC2CCSCC2)[C@H](O)C1	ZINC000875195634	FD	On-Demand	Anodyne	EPHX2	19	44
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NC2CCSCC2)[C@H](O)C1	ZINC000875195634	FD	On-Demand	Anodyne	GPR119	27	40
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NC2CCSCC2)[C@@H](O)C1	ZINC000875195635	FD	On-Demand	Anodyne	EPHX2	19	44
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NC2CCSCC2)[C@@H](O)C1	ZINC000875195635	FD	On-Demand	Anodyne	GPR119	27	40
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NC2CCSCC2)[C@H](O)C1	ZINC000875195636	FD	On-Demand	Anodyne	EPHX2	19	44
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NC2CCSCC2)[C@H](O)C1	ZINC000875195636	FD	On-Demand	Anodyne	GPR119	27	40
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NC2CCSCC2)[C@@H](O)C1	ZINC000875195637	FD	On-Demand	Anodyne	EPHX2	19	44
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NC2CCSCC2)[C@@H](O)C1	ZINC000875195637	FD	On-Demand	Anodyne	GPR119	27	40
O=CN1CCCN(C(=O)NCCNC(=O)c2cccc(Br)c2)CC1	ZINC000875195638	GD	On-Demand	Anodyne	DRD4	42	33
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NC[C@@H]3CCC=CO3)C2)cc1	ZINC000875195645	FD	On-Demand	Anodyne	DRD4	29	47
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NC[C@@H]3CCC=CO3)C2)cc1	ZINC000875195645	FD	On-Demand	Anodyne	MCHR1	32	43
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NC[C@H]3CCC=CO3)C2)cc1	ZINC000875195651	FD	On-Demand	Anodyne	DRD4	29	47
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NC[C@H]3CCC=CO3)C2)cc1	ZINC000875195651	FD	On-Demand	Anodyne	MCHR1	32	43
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NC[C@@H]3CCC=CO3)C2)cc1	ZINC000875195653	FD	On-Demand	Anodyne	DRD4	29	47
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NC[C@@H]3CCC=CO3)C2)cc1	ZINC000875195653	FD	On-Demand	Anodyne	MCHR1	32	43
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NC[C@H]3CCC=CO3)C2)cc1	ZINC000875195655	FD	On-Demand	Anodyne	DRD4	29	47
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NC[C@H]3CCC=CO3)C2)cc1	ZINC000875195655	FD	On-Demand	Anodyne	MCHR1	32	43
C[C@@H]1CN(CCNC(=O)N[C@H]2[C@@H]3c4ccc(Cl)cc4C[C@H]32)CCO1	ZINC000875195661	ED	On-Demand	Anodyne	CACNA1H	20	41
O=C(NCCCNC(=O)c1ccccc1)NCC[C@H](O)C1CCCC1	ZINC000875195662	EE	On-Demand	Anodyne	EPHX2	18	52
C[C@@H]1CN(CCNC(=O)N[C@@H]2[C@H]3Cc4cc(Cl)ccc4[C@H]32)CCO1	ZINC000875195663	ED	On-Demand	Anodyne	CACNA1H	20	41
O=C(NCCCNC(=O)c1ccccc1)NCC[C@@H](O)C1CCCC1	ZINC000875195664	EE	On-Demand	Anodyne	EPHX2	18	52
C[C@@H]1CN(CCNC(=O)N[C@@H]2[C@@H]3Cc4cc(Cl)ccc4[C@@H]32)CCO1	ZINC000875195665	ED	On-Demand	Anodyne	CACNA1H	20	41
C[C@@H]1CN(CCNC(=O)N[C@@H]2[C@H]3Cc4cc(Cl)ccc4[C@@H]32)CCO1	ZINC000875195667	ED	On-Demand	Anodyne	CACNA1H	20	41
O=C(N[C@H]1CCCOc2ccccc21)N1Cc2cccc(O)c2C1	ZINC000875195673	DG	On-Demand	Clean	BIRC3	45	34
O=C(N[C@@H]1CCCOc2ccccc21)N1Cc2cccc(O)c2C1	ZINC000875195674	DG	On-Demand	Clean	BIRC3	45	34
Cn1nc(Cl)c(C(=O)Nc2sc3c(c2C#N)CCCCCC3)c1Cl	ZINC000875195692	GJ	On-Demand	Mild	VIPR1	29	46
C[C@@H](CCNC(=O)N1CCCCCCNC(=O)CC1)c1ccccc1	ZINC000875195700	EG	On-Demand	Anodyne	DPP7	40	39
N#Cc1c(NC(=O)c2cnc3nccn3c2)sc2c1CCCCCC2	ZINC000875195705	FH	On-Demand	Mild	VIPR1	28	45
C[C@@H]1CN(CCNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CCO1	ZINC000875195737	ED	On-Demand	Anodyne	SLC6A1	45	36
C[C@@H]1CN(CCNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CCO1	ZINC000875195738	ED	On-Demand	Anodyne	SLC6A1	45	36
C[C@@H]1CN(CCNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CCO1	ZINC000875195739	ED	On-Demand	Anodyne	SLC6A1	45	36
C[C@@H]1CN(CCNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CCO1	ZINC000875195740	ED	On-Demand	Anodyne	SLC6A1	45	36
C[C@@H]1CN(CCNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CCO1	ZINC000875195750	FD	On-Demand	Mild	CCR3	32	43
C[C@@H]1CN(CCNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CCO1	ZINC000875195750	FD	On-Demand	Mild	ITK	15	45
C[C@@H]1CN(CCNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CCO1	ZINC000875195750	FD	On-Demand	Mild	PANC	54	37
C[C@@H]1CN(CCNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CCO1	ZINC000875195754	EB	On-Demand	Anodyne	CACNA1H	15	45
COc1ccccc1N1CC[C@H](CNC(=O)N(C)OCC(F)(F)F)C1	ZINC000875195801	FF	On-Demand	Anodyne	HTR1A	66	47
COc1ccccc1N1CC[C@H](CNC(=O)N(C)OCC(F)(F)F)C1	ZINC000875195801	FF	On-Demand	Anodyne	DRD2	49	47
COc1ccccc1N1CC[C@H](CNC(=O)N(C)OCC(F)(F)F)C1	ZINC000875195801	FF	On-Demand	Anodyne	DRD4	26	42
COc1ccccc1N1CC[C@H](CNC(=O)N(C)OCC(F)(F)F)C1	ZINC000875195801	FF	On-Demand	Anodyne	ADRA1D	55	38
COc1ccccc1N1CC[C@H](CNC(=O)N(C)OCC(F)(F)F)C1	ZINC000875195801	FF	On-Demand	Anodyne	ADRA1A	51	38
COc1ccccc1N1CC[C@H](CNC(=O)N(C)OCC(F)(F)F)C1	ZINC000875195801	FF	On-Demand	Anodyne	DRD3	55	42
COc1ccccc1N1CC[C@H](CNC(=O)N(C)OCC(F)(F)F)C1	ZINC000875195801	FF	On-Demand	Anodyne	HTR7	42	42
COc1ccccc1N1CC[C@H](CNC(=O)N(C)OCC(F)(F)F)C1	ZINC000875195801	FF	On-Demand	Anodyne	MBTPS1	47	31
COc1ccccc1N1CC[C@@H](CNC(=O)N(C)OCC(F)(F)F)C1	ZINC000875195803	FF	On-Demand	Anodyne	HTR1A	66	47
COc1ccccc1N1CC[C@@H](CNC(=O)N(C)OCC(F)(F)F)C1	ZINC000875195803	FF	On-Demand	Anodyne	DRD2	49	47
COc1ccccc1N1CC[C@@H](CNC(=O)N(C)OCC(F)(F)F)C1	ZINC000875195803	FF	On-Demand	Anodyne	DRD4	26	42
COc1ccccc1N1CC[C@@H](CNC(=O)N(C)OCC(F)(F)F)C1	ZINC000875195803	FF	On-Demand	Anodyne	ADRA1D	55	38
COc1ccccc1N1CC[C@@H](CNC(=O)N(C)OCC(F)(F)F)C1	ZINC000875195803	FF	On-Demand	Anodyne	ADRA1A	51	38
COc1ccccc1N1CC[C@@H](CNC(=O)N(C)OCC(F)(F)F)C1	ZINC000875195803	FF	On-Demand	Anodyne	DRD3	55	42
COc1ccccc1N1CC[C@@H](CNC(=O)N(C)OCC(F)(F)F)C1	ZINC000875195803	FF	On-Demand	Anodyne	HTR7	42	42
COc1ccccc1N1CC[C@@H](CNC(=O)N(C)OCC(F)(F)F)C1	ZINC000875195803	FF	On-Demand	Anodyne	MBTPS1	47	31
CC[C@@H]1COCCN1CCNC(=O)NCCCNC(=O)c1ccccc1	ZINC000875195807	FD	On-Demand	Anodyne	DRD4	41	32
C[C@@H]1CN(CCNC(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)CCO1	ZINC000875195819	FD	On-Demand	Anodyne	CCR3	26	46
C[C@@H]1CN(CCNC(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)CCO1	ZINC000875195819	FD	On-Demand	Anodyne	MLNR	27	43
C[C@@H]1CN(CCNC(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)CCO1	ZINC000875195819	FD	On-Demand	Anodyne	EPHX2	21	45
Cc1nc(CN2CCC(CNC(=O)C(=O)NCCCCC3CC3)CC2)oc1C	ZINC000875195859	GE	On-Demand	Anodyne	CACNA1I	60	37
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H]1CCCN(c2cccc(OC)c2)C1	ZINC000875195862	GD	On-Demand	Mild	DRD4	43	33
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H]1CCCN(c2cccc(OC)c2)C1	ZINC000875195862	GD	On-Demand	Mild	MTNR1B	15	50
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCCN(c2cccc(OC)c2)C1	ZINC000875195863	GD	On-Demand	Mild	DRD4	43	33
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCCN(c2cccc(OC)c2)C1	ZINC000875195863	GD	On-Demand	Mild	MTNR1B	15	50
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H]1CCCN(c2cccc(OC)c2)C1	ZINC000875195864	GD	On-Demand	Mild	DRD4	43	33
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H]1CCCN(c2cccc(OC)c2)C1	ZINC000875195864	GD	On-Demand	Mild	MTNR1B	15	50
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCCN(c2cccc(OC)c2)C1	ZINC000875195865	GD	On-Demand	Mild	DRD4	43	33
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCCN(c2cccc(OC)c2)C1	ZINC000875195865	GD	On-Demand	Mild	MTNR1B	15	50
CC[C@]1(C(=O)Nc2sc3c(c2C#N)CCCCCC3)CCNC1=O	ZINC000875195870	EG	On-Demand	Mild	VIPR1	30	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccn(-c2ccccc2)n1	ZINC000875195878	FE	On-Demand	Anodyne	SLC6A3	41	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccn(-c2ccccc2)n1	ZINC000875195880	FE	On-Demand	Anodyne	SLC6A3	41	40
CC(=O)C1CCN(C(=O)NCCNC(=O)c2cccc(Br)c2)CC1	ZINC000875195885	GE	On-Demand	Anodyne	DRD4	46	35
CC(=O)C1CCN(C(=O)NCCNC(=O)c2cccc(Br)c2)CC1	ZINC000875195885	GE	On-Demand	Anodyne	CCR2	18	43
C[C@@H](CCNC(=O)N[C@H]1CCN(CC(C)(C)O)C1)c1ccccc1	ZINC000875195892	EE	On-Demand	Anodyne	DRD4	20	40
C[C@@H](CCNC(=O)N[C@H]1CCN(CC(C)(C)O)C1)c1ccccc1	ZINC000875195892	EE	On-Demand	Anodyne	CCR5	19	40
C[C@@H](CCNC(=O)N[C@H]1CCN(CC(C)(C)O)C1)c1ccccc1	ZINC000875195892	EE	On-Demand	Anodyne	BIRC2	40	38
C[C@H](CCNC(=O)N[C@H]1CCN(CC(C)(C)O)C1)c1ccccc1	ZINC000875195894	EE	On-Demand	Anodyne	DRD4	20	40
C[C@H](CCNC(=O)N[C@H]1CCN(CC(C)(C)O)C1)c1ccccc1	ZINC000875195894	EE	On-Demand	Anodyne	CCR5	19	40
C[C@H](CCNC(=O)N[C@H]1CCN(CC(C)(C)O)C1)c1ccccc1	ZINC000875195894	EE	On-Demand	Anodyne	BIRC2	40	38
COC(=O)N(C)NC(=O)NCCNC(=O)c1cccc(Br)c1	ZINC000875195902	FD	On-Demand	Reactive	DRD4	44	33
COC(=O)N(C)NC(=O)NCCNC(=O)c1cccc(Br)c1	ZINC000875195902	FD	On-Demand	Reactive	ECR	23	42
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCCN(C=O)CC2)C1	ZINC000875195928	FD	On-Demand	Anodyne	HTR1A	68	45
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCCN(C=O)CC2)C1	ZINC000875195928	FD	On-Demand	Anodyne	DRD2	52	45
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCCN(C=O)CC2)C1	ZINC000875195928	FD	On-Demand	Anodyne	DRD4	27	41
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCCN(C=O)CC2)C1	ZINC000875195928	FD	On-Demand	Anodyne	ADRA1D	40	40
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCCN(C=O)CC2)C1	ZINC000875195928	FD	On-Demand	Anodyne	ADRA1A	39	40
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCCN(C=O)CC2)C1	ZINC000875195928	FD	On-Demand	Anodyne	ADRA1B	32	40
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCCN(C=O)CC2)C1	ZINC000875195928	FD	On-Demand	Anodyne	DRD3	56	41
COc1ccccc1N1CC[C@@H](CNC(=O)N2CCCN(C=O)CC2)C1	ZINC000875195928	FD	On-Demand	Anodyne	HTR7	46	41
COc1ccccc1N1CC[C@H](CNC(=O)N2CCCN(C=O)CC2)C1	ZINC000875195930	FD	On-Demand	Anodyne	HTR1A	68	45
COc1ccccc1N1CC[C@H](CNC(=O)N2CCCN(C=O)CC2)C1	ZINC000875195930	FD	On-Demand	Anodyne	DRD2	52	45
COc1ccccc1N1CC[C@H](CNC(=O)N2CCCN(C=O)CC2)C1	ZINC000875195930	FD	On-Demand	Anodyne	DRD4	27	41
COc1ccccc1N1CC[C@H](CNC(=O)N2CCCN(C=O)CC2)C1	ZINC000875195930	FD	On-Demand	Anodyne	ADRA1D	40	40
COc1ccccc1N1CC[C@H](CNC(=O)N2CCCN(C=O)CC2)C1	ZINC000875195930	FD	On-Demand	Anodyne	ADRA1A	39	40
COc1ccccc1N1CC[C@H](CNC(=O)N2CCCN(C=O)CC2)C1	ZINC000875195930	FD	On-Demand	Anodyne	ADRA1B	32	40
COc1ccccc1N1CC[C@H](CNC(=O)N2CCCN(C=O)CC2)C1	ZINC000875195930	FD	On-Demand	Anodyne	DRD3	56	41
COc1ccccc1N1CC[C@H](CNC(=O)N2CCCN(C=O)CC2)C1	ZINC000875195930	FD	On-Demand	Anodyne	HTR7	46	41
COC(=O)N(C)NC(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875195937	ED	On-Demand	Reactive	HTR1A	73	47
COC(=O)N(C)NC(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875195937	ED	On-Demand	Reactive	DRD2	59	47
COC(=O)N(C)NC(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875195937	ED	On-Demand	Reactive	DRD4	32	42
COC(=O)N(C)NC(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875195937	ED	On-Demand	Reactive	ADRA1D	60	40
COC(=O)N(C)NC(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875195937	ED	On-Demand	Reactive	ADRA1A	53	40
COC(=O)N(C)NC(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875195937	ED	On-Demand	Reactive	ADRA1B	44	36
COC(=O)N(C)NC(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875195937	ED	On-Demand	Reactive	DRD3	61	42
COC(=O)N(C)NC(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875195937	ED	On-Demand	Reactive	HTR7	50	42
COC(=O)N(C)NC(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875195939	ED	On-Demand	Reactive	HTR1A	73	47
COC(=O)N(C)NC(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875195939	ED	On-Demand	Reactive	DRD2	59	47
COC(=O)N(C)NC(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875195939	ED	On-Demand	Reactive	DRD4	32	42
COC(=O)N(C)NC(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875195939	ED	On-Demand	Reactive	ADRA1D	60	40
COC(=O)N(C)NC(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875195939	ED	On-Demand	Reactive	ADRA1A	53	40
COC(=O)N(C)NC(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875195939	ED	On-Demand	Reactive	ADRA1B	44	36
COC(=O)N(C)NC(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875195939	ED	On-Demand	Reactive	DRD3	61	42
COC(=O)N(C)NC(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875195939	ED	On-Demand	Reactive	HTR7	50	42
O=C(NCc1ccc(OC2CCCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875195940	EF	On-Demand	Anodyne	EPHX2	27	43
CCOC(=O)[C@@H]1CN(C(=O)NCCCNC(=O)c2ccccc2)CCC1(F)F	ZINC000875195945	GE	On-Demand	Anodyne	GHRHR	42	35
CCOC(=O)[C@@H]1CN(C(=O)NCCCNC(=O)c2ccccc2)CCC1(F)F	ZINC000875195945	GE	On-Demand	Anodyne	P2RY12	53	35
N#Cc1c(NC(=O)CN2CCCCC(=O)C2=O)sc2c1-c1ccccc1CC2	ZINC000875195977	GF	On-Demand	Mild	VIPR1	25	43
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875195987	FC	On-Demand	Anodyne	HTR1A	69	43
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875195987	FC	On-Demand	Anodyne	DRD2	53	43
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875195987	FC	On-Demand	Anodyne	DRD4	28	40
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875195987	FC	On-Demand	Anodyne	ADRA1D	46	40
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875195987	FC	On-Demand	Anodyne	ADRA1A	42	40
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875195987	FC	On-Demand	Anodyne	ADRA1B	35	40
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875195987	FC	On-Demand	Anodyne	DRD3	57	40
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875195987	FC	On-Demand	Anodyne	HTR7	46	39
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875195989	FC	On-Demand	Anodyne	HTR1A	69	43
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875195989	FC	On-Demand	Anodyne	DRD2	53	43
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875195989	FC	On-Demand	Anodyne	DRD4	28	40
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875195989	FC	On-Demand	Anodyne	ADRA1D	46	40
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875195989	FC	On-Demand	Anodyne	ADRA1A	42	40
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875195989	FC	On-Demand	Anodyne	ADRA1B	35	40
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875195989	FC	On-Demand	Anodyne	DRD3	57	40
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875195989	FC	On-Demand	Anodyne	HTR7	46	39
CONC(=O)C1CCN(C(=O)NCc2ccc(OC3CCCCC3)cc2)CC1	ZINC000875196014	GF	On-Demand	Anodyne	PRSS2	47	33
CONC(=O)C1CCN(C(=O)NCc2ccc(OC3CCCCC3)cc2)CC1	ZINC000875196014	GF	On-Demand	Anodyne	EPHX2	32	46
C[C@@H]1CN(CCNC(=O)NCC2(c3ccccc3)CCN(C)CC2)CCO1	ZINC000875196066	FD	On-Demand	Anodyne	KCNA3	45	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCCN1CCO[C@H](C)C1)CC2	ZINC000875196068	GE	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCCN1CCO[C@@H](C)C1)CC2	ZINC000875196069	GE	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCCN1CCO[C@H](C)C1)CC2	ZINC000875196070	GE	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCCN1CCO[C@@H](C)C1)CC2	ZINC000875196071	GE	On-Demand	Anodyne	SLC18A2	49	36
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCSCC2)CC1	ZINC000875196133	EH	On-Demand	Anodyne	EPHX2	33	42
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCSCC2)CC1	ZINC000875196133	EH	On-Demand	Anodyne	RBP4	35	41
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCSCC2)CC1	ZINC000875196136	EH	On-Demand	Anodyne	EPHX2	33	42
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCSCC2)CC1	ZINC000875196136	EH	On-Demand	Anodyne	RBP4	35	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875196137	GE	On-Demand	Anodyne	HTR1A	62	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875196137	GE	On-Demand	Anodyne	DRD2	49	42
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875196137	GE	On-Demand	Anodyne	ADRA1D	52	40
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875196137	GE	On-Demand	Anodyne	ADRA1A	46	40
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875196137	GE	On-Demand	Anodyne	ADRA1B	40	40
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875196137	GE	On-Demand	Anodyne	DRD3	49	42
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875196137	GE	On-Demand	Anodyne	HTR7	43	38
C[C@@H](CCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000875196140	EI	On-Demand	Anodyne	EPHX2	31	43
C[C@@H](CCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccc1	ZINC000875196140	EI	On-Demand	Anodyne	SCD1	15	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875196141	GE	On-Demand	Anodyne	HTR1A	62	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875196141	GE	On-Demand	Anodyne	DRD2	49	42
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875196141	GE	On-Demand	Anodyne	ADRA1D	52	40
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875196141	GE	On-Demand	Anodyne	ADRA1A	46	40
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875196141	GE	On-Demand	Anodyne	ADRA1B	40	40
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875196141	GE	On-Demand	Anodyne	DRD3	49	42
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875196141	GE	On-Demand	Anodyne	HTR7	43	38
C[C@@H](CCNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000875196142	EI	On-Demand	Anodyne	EPHX2	31	43
C[C@@H](CCNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccc1	ZINC000875196142	EI	On-Demand	Anodyne	SCD1	15	41
O=C(NCCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)c1ccccc1	ZINC000875196152	GF	On-Demand	Anodyne	ACE	36	43
O=C(NCCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)c1ccccc1	ZINC000875196152	GF	On-Demand	Anodyne	TRY1_BOVIN	42	35
O=C(NCCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)c1ccccc1	ZINC000875196152	GF	On-Demand	Anodyne	PREP	42	47
O=C(NCCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)c1ccccc1	ZINC000875196152	GF	On-Demand	Anodyne	TMPRSS11D	41	36
O=C(NCCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)c1ccccc1	ZINC000875196154	GF	On-Demand	Anodyne	ACE	36	43
O=C(NCCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)c1ccccc1	ZINC000875196154	GF	On-Demand	Anodyne	TRY1_BOVIN	42	35
O=C(NCCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)c1ccccc1	ZINC000875196154	GF	On-Demand	Anodyne	PREP	42	47
O=C(NCCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)c1ccccc1	ZINC000875196154	GF	On-Demand	Anodyne	TMPRSS11D	41	36
O=C(NCCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)c1ccccc1	ZINC000875196156	GF	On-Demand	Anodyne	ACE	36	43
O=C(NCCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)c1ccccc1	ZINC000875196156	GF	On-Demand	Anodyne	TRY1_BOVIN	42	35
O=C(NCCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)c1ccccc1	ZINC000875196156	GF	On-Demand	Anodyne	PREP	42	47
O=C(NCCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)c1ccccc1	ZINC000875196156	GF	On-Demand	Anodyne	TMPRSS11D	41	36
O=C(NCCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)c1ccccc1	ZINC000875196159	GF	On-Demand	Anodyne	ACE	36	43
O=C(NCCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)c1ccccc1	ZINC000875196159	GF	On-Demand	Anodyne	TRY1_BOVIN	42	35
O=C(NCCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)c1ccccc1	ZINC000875196159	GF	On-Demand	Anodyne	PREP	42	47
O=C(NCCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)c1ccccc1	ZINC000875196159	GF	On-Demand	Anodyne	TMPRSS11D	41	36
CONC(=O)C1CCN(C(=O)NCCCNC(=O)c2ccccc2)CC1	ZINC000875196161	FC	On-Demand	Anodyne	HTR1A	18	44
CONC(=O)C1CCN(C(=O)NCCCNC(=O)c2ccccc2)CC1	ZINC000875196161	FC	On-Demand	Anodyne	DRD2	26	44
CONC(=O)C1CCN(C(=O)NCCCNC(=O)c2ccccc2)CC1	ZINC000875196161	FC	On-Demand	Anodyne	DRD4	43	35
CONC(=O)C1CCN(C(=O)NCCCNC(=O)c2ccccc2)CC1	ZINC000875196161	FC	On-Demand	Anodyne	DRD3	48	44
CONC(=O)C1CCN(C(=O)NCCCNC(=O)c2ccccc2)CC1	ZINC000875196161	FC	On-Demand	Anodyne	PREP	16	40
CONC(=O)C1CCN(C(=O)NCCCNC(=O)c2ccccc2)CC1	ZINC000875196161	FC	On-Demand	Anodyne	EPHX2	27	42
CONC(=O)C1CCN(C(=O)NCCCNC(=O)c2ccccc2)CC1	ZINC000875196161	FC	On-Demand	Anodyne	DPP7	15	44
CC(=O)Nc1cc(NC(=O)c2cc(S(=O)(=O)Nc3ccc(F)cc3)ccc2Cl)ccc1F	ZINC000875196200	JJ	On-Demand	Anodyne	CA2	15	41
CC(=O)Nc1cc(NC(=O)c2cc(S(=O)(=O)Nc3ccc(F)cc3)ccc2Cl)ccc1F	ZINC000875196200	JJ	On-Demand	Anodyne	CA4	18	41
CC(=O)Nc1cc(NC(=O)c2cc(S(=O)(=O)Nc3ccc(F)cc3)ccc2Cl)ccc1F	ZINC000875196200	JJ	On-Demand	Anodyne	GRM4	41	47
CC(=O)Nc1cc(NC(=O)c2cc(S(=O)(=O)Nc3ccc(F)cc3)ccc2Cl)ccc1F	ZINC000875196200	JJ	On-Demand	Anodyne	IDO1	30	44
O=C(NC1CCSCC1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875196225	GG	On-Demand	Anodyne	ABL1	15	44
CC(=O)C1CCN(C(=O)NCCCNC(=O)c2ccccc2)CC1	ZINC000875196238	ED	On-Demand	Anodyne	HTR1A	15	46
CC(=O)C1CCN(C(=O)NCCCNC(=O)c2ccccc2)CC1	ZINC000875196238	ED	On-Demand	Anodyne	DRD2	23	42
CC(=O)C1CCN(C(=O)NCCCNC(=O)c2ccccc2)CC1	ZINC000875196238	ED	On-Demand	Anodyne	DRD4	41	33
CC(=O)C1CCN(C(=O)NCCCNC(=O)c2ccccc2)CC1	ZINC000875196238	ED	On-Demand	Anodyne	HTR2A	15	43
CC(=O)C1CCN(C(=O)NCCCNC(=O)c2ccccc2)CC1	ZINC000875196238	ED	On-Demand	Anodyne	DRD3	43	42
CC(=O)C1CCN(C(=O)NCCCNC(=O)c2ccccc2)CC1	ZINC000875196238	ED	On-Demand	Anodyne	PREP	24	44
CC(=O)C1CCN(C(=O)NCCCNC(=O)c2ccccc2)CC1	ZINC000875196238	ED	On-Demand	Anodyne	EPHX2	30	40
CC(=O)C1CCN(C(=O)NCCCNC(=O)c2ccccc2)CC1	ZINC000875196238	ED	On-Demand	Anodyne	L3MBTL3	27	43
N#Cc1c(NC(=O)[C@@H]2[C@H]3CC[C@]4(COC(=O)[C@H]24)O3)sc2c1CCCCCC2	ZINC000875196248	GF	On-Demand	Mild	VIPR1	26	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCOc3ccccc32)C1	ZINC000875196263	EF	On-Demand	Anodyne	BIRC3	53	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCOc3ccccc32)C1	ZINC000875196266	EF	On-Demand	Anodyne	BIRC3	53	38
O=C(NCCCNC(=O)N1Cc2cccc(O)c2C1)c1ccccc1	ZINC000875196301	EE	On-Demand	Clean	DRD4	40	31
O=C(NCCCNC(=O)N1Cc2cccc(O)c2C1)c1ccccc1	ZINC000875196301	EE	On-Demand	Clean	DRD3	28	41
COC(=O)c1ccc(CC(=O)Nc2sc3c(c2C#N)CCCCCC3)cn1	ZINC000875196304	GH	On-Demand	Mild	VIPR1	38	60
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCNC(=O)c1ccccc1	ZINC000875196307	FD	On-Demand	Anodyne	DRD2	17	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCNC(=O)c1ccccc1	ZINC000875196307	FD	On-Demand	Anodyne	SLC6A4	26	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCNC(=O)c1ccccc1	ZINC000875196307	FD	On-Demand	Anodyne	OPRM1	15	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCNC(=O)c1ccccc1	ZINC000875196307	FD	On-Demand	Anodyne	DRD3	30	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCNC(=O)c1ccccc1	ZINC000875196307	FD	On-Demand	Anodyne	SLC6A3	52	46
O=C(NC[C@H]1CCC=CO1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875196311	ED	On-Demand	Anodyne	OXTR	56	36
O=C(NC[C@H]1CCC=CO1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875196313	ED	On-Demand	Anodyne	OXTR	56	36
N#Cc1c(NC(=O)CCCOC2CCOCC2)sc2c1CCCCCC2	ZINC000875196320	GI	On-Demand	Mild	VIPR1	33	52
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1CNC(=O)NCCN1CCO[C@H](C)C1	ZINC000875196342	FD	On-Demand	Anodyne	DRD4	23	45
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1CNC(=O)NCCN1CCO[C@H](C)C1	ZINC000875196342	FD	On-Demand	Anodyne	SIGMAR1	23	42
C[C@@H]1CN(CCNC(=O)NC[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)CCO1	ZINC000875196343	FD	On-Demand	Anodyne	DRD4	23	45
C[C@@H]1CN(CCNC(=O)NC[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)CCO1	ZINC000875196343	FD	On-Demand	Anodyne	SIGMAR1	23	42
C[C@@H]1CN(CCNC(=O)NC[C@H]2CN(Cc3ccccc3)C[C@@H]2C)CCO1	ZINC000875196344	FD	On-Demand	Anodyne	DRD4	23	45
C[C@@H]1CN(CCNC(=O)NC[C@H]2CN(Cc3ccccc3)C[C@@H]2C)CCO1	ZINC000875196344	FD	On-Demand	Anodyne	SIGMAR1	23	42
C[C@@H]1CN(Cc2ccccc2)C[C@H]1CNC(=O)NCCN1CCO[C@H](C)C1	ZINC000875196345	FD	On-Demand	Anodyne	DRD4	23	45
C[C@@H]1CN(Cc2ccccc2)C[C@H]1CNC(=O)NCCN1CCO[C@H](C)C1	ZINC000875196345	FD	On-Demand	Anodyne	SIGMAR1	23	42
COc1cccc([C@H](O)C2CCN(C(=O)NCCN3CCO[C@@H](C)C3)CC2)c1	ZINC000875196353	GD	On-Demand	Anodyne	DRD4	48	38
COc1cccc([C@H](O)C2CCN(C(=O)NCCN3CCO[C@H](C)C3)CC2)c1	ZINC000875196354	GD	On-Demand	Anodyne	DRD4	48	38
O=C(N[C@H]1CCCOc2ccccc21)N1CCC[C@H](OC2CCC2)CC1	ZINC000875196429	FI	On-Demand	Anodyne	EPHX2	20	40
O=C(N[C@@H]1CCCOc2ccccc21)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875196432	FI	On-Demand	Anodyne	EPHX2	20	40
O=C(N[C@H]1CCCOc2ccccc21)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875196433	FI	On-Demand	Anodyne	EPHX2	20	40
O=C(NCCCNC(=O)N1CCC[C@](O)(c2ccccc2)C1)c1ccccc1	ZINC000875196435	GE	On-Demand	Anodyne	CCR1	21	40
O=C(NCCCNC(=O)N1CCC[C@](O)(c2ccccc2)C1)c1ccccc1	ZINC000875196435	GE	On-Demand	Anodyne	EPHX2	17	48
O=C(N[C@@H]1CCCOc2ccccc21)N1CCC[C@H](OC2CCC2)CC1	ZINC000875196436	FI	On-Demand	Anodyne	EPHX2	20	40
O=C(NCCCNC(=O)N1CCC[C@@](O)(c2ccccc2)C1)c1ccccc1	ZINC000875196439	GE	On-Demand	Anodyne	CCR1	21	40
O=C(NCCCNC(=O)N1CCC[C@@](O)(c2ccccc2)C1)c1ccccc1	ZINC000875196439	GE	On-Demand	Anodyne	EPHX2	17	48
COc1ccc(N2CCN(C(=O)NCCN3CCO[C@@H](C)C3)CC2)c(OC)c1	ZINC000875196448	GD	On-Demand	Clean	HTR1A	54	45
COc1ccc(N2CCN(C(=O)NCCN3CCO[C@@H](C)C3)CC2)c(OC)c1	ZINC000875196448	GD	On-Demand	Clean	DRD2	41	47
COc1ccc(N2CCN(C(=O)NCCN3CCO[C@@H](C)C3)CC2)c(OC)c1	ZINC000875196448	GD	On-Demand	Clean	DRD4	50	39
COc1ccc(N2CCN(C(=O)NCCN3CCO[C@@H](C)C3)CC2)c(OC)c1	ZINC000875196448	GD	On-Demand	Clean	HTR1B	17	41
COc1ccc(N2CCN(C(=O)NCCN3CCO[C@@H](C)C3)CC2)c(OC)c1	ZINC000875196448	GD	On-Demand	Clean	DRD3	60	40
COc1ccc(N2CCN(C(=O)NCCN3CCO[C@H](C)C3)CC2)c(OC)c1	ZINC000875196451	GD	On-Demand	Clean	HTR1A	54	45
COc1ccc(N2CCN(C(=O)NCCN3CCO[C@H](C)C3)CC2)c(OC)c1	ZINC000875196451	GD	On-Demand	Clean	DRD2	41	47
COc1ccc(N2CCN(C(=O)NCCN3CCO[C@H](C)C3)CC2)c(OC)c1	ZINC000875196451	GD	On-Demand	Clean	DRD4	50	39
COc1ccc(N2CCN(C(=O)NCCN3CCO[C@H](C)C3)CC2)c(OC)c1	ZINC000875196451	GD	On-Demand	Clean	HTR1B	17	41
COc1ccc(N2CCN(C(=O)NCCN3CCO[C@H](C)C3)CC2)c(OC)c1	ZINC000875196451	GD	On-Demand	Clean	DRD3	60	40
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H]1CCCN(c2cccc(OC)c2)C1	ZINC000875196464	FC	On-Demand	Mild	DRD4	41	31
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H]1CCCN(c2cccc(OC)c2)C1	ZINC000875196464	FC	On-Demand	Mild	MTNR1B	15	50
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H]1CCCN(c2cccc(OC)c2)C1	ZINC000875196466	FC	On-Demand	Mild	DRD4	41	31
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H]1CCCN(c2cccc(OC)c2)C1	ZINC000875196466	FC	On-Demand	Mild	MTNR1B	15	50
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CCCN(c2cccc(OC)c2)C1	ZINC000875196468	FC	On-Demand	Mild	DRD4	41	31
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CCCN(c2cccc(OC)c2)C1	ZINC000875196468	FC	On-Demand	Mild	MTNR1B	15	50
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CCCN(c2cccc(OC)c2)C1	ZINC000875196470	FC	On-Demand	Mild	DRD4	41	31
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CCCN(c2cccc(OC)c2)C1	ZINC000875196470	FC	On-Demand	Mild	MTNR1B	15	50
COc1ccccc1N1CC[C@H](CNC(=O)NNc2nnc(C)n2C)C1	ZINC000875196472	FD	On-Demand	Reactive	HTR1A	73	41
COc1ccccc1N1CC[C@H](CNC(=O)NNc2nnc(C)n2C)C1	ZINC000875196472	FD	On-Demand	Reactive	DRD2	51	41
COc1ccccc1N1CC[C@H](CNC(=O)NNc2nnc(C)n2C)C1	ZINC000875196472	FD	On-Demand	Reactive	ADRA1D	50	39
COc1ccccc1N1CC[C@H](CNC(=O)NNc2nnc(C)n2C)C1	ZINC000875196472	FD	On-Demand	Reactive	ADRA1A	46	39
COc1ccccc1N1CC[C@H](CNC(=O)NNc2nnc(C)n2C)C1	ZINC000875196472	FD	On-Demand	Reactive	DRD3	60	38
COc1ccccc1N1CC[C@H](CNC(=O)NNc2nnc(C)n2C)C1	ZINC000875196472	FD	On-Demand	Reactive	HTR7	48	38
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2nnc(C)n2C)C1	ZINC000875196475	FD	On-Demand	Reactive	HTR1A	73	41
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2nnc(C)n2C)C1	ZINC000875196475	FD	On-Demand	Reactive	DRD2	51	41
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2nnc(C)n2C)C1	ZINC000875196475	FD	On-Demand	Reactive	ADRA1D	50	39
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2nnc(C)n2C)C1	ZINC000875196475	FD	On-Demand	Reactive	ADRA1A	46	39
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2nnc(C)n2C)C1	ZINC000875196475	FD	On-Demand	Reactive	DRD3	60	38
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2nnc(C)n2C)C1	ZINC000875196475	FD	On-Demand	Reactive	HTR7	48	38
COc1ccccc1N1CC[C@H](CNC(=O)NC2(C)CC(F)(F)C2)C1	ZINC000875196484	FG	On-Demand	Anodyne	HTR1A	65	44
COc1ccccc1N1CC[C@H](CNC(=O)NC2(C)CC(F)(F)C2)C1	ZINC000875196484	FG	On-Demand	Anodyne	DRD2	50	43
COc1ccccc1N1CC[C@H](CNC(=O)NC2(C)CC(F)(F)C2)C1	ZINC000875196484	FG	On-Demand	Anodyne	DRD4	29	42
COc1ccccc1N1CC[C@H](CNC(=O)NC2(C)CC(F)(F)C2)C1	ZINC000875196484	FG	On-Demand	Anodyne	ADRA1D	54	36
COc1ccccc1N1CC[C@H](CNC(=O)NC2(C)CC(F)(F)C2)C1	ZINC000875196484	FG	On-Demand	Anodyne	ADRA1A	47	36
COc1ccccc1N1CC[C@H](CNC(=O)NC2(C)CC(F)(F)C2)C1	ZINC000875196484	FG	On-Demand	Anodyne	ADRA1B	41	36
COc1ccccc1N1CC[C@H](CNC(=O)NC2(C)CC(F)(F)C2)C1	ZINC000875196484	FG	On-Demand	Anodyne	DRD3	55	39
COc1ccccc1N1CC[C@H](CNC(=O)NC2(C)CC(F)(F)C2)C1	ZINC000875196484	FG	On-Demand	Anodyne	HTR7	43	39
C[C@@H]1CN(C(=O)N[C@H]2CCCOc3ccccc32)CC[C@@H](C(F)(F)F)O1	ZINC000875196486	FH	On-Demand	Anodyne	RBP4	51	34
COc1ccccc1N1CC[C@@H](CNC(=O)NC2(C)CC(F)(F)C2)C1	ZINC000875196487	FG	On-Demand	Anodyne	HTR1A	65	44
COc1ccccc1N1CC[C@@H](CNC(=O)NC2(C)CC(F)(F)C2)C1	ZINC000875196487	FG	On-Demand	Anodyne	DRD2	50	43
COc1ccccc1N1CC[C@@H](CNC(=O)NC2(C)CC(F)(F)C2)C1	ZINC000875196487	FG	On-Demand	Anodyne	DRD4	29	42
COc1ccccc1N1CC[C@@H](CNC(=O)NC2(C)CC(F)(F)C2)C1	ZINC000875196487	FG	On-Demand	Anodyne	ADRA1D	54	36
COc1ccccc1N1CC[C@@H](CNC(=O)NC2(C)CC(F)(F)C2)C1	ZINC000875196487	FG	On-Demand	Anodyne	ADRA1A	47	36
COc1ccccc1N1CC[C@@H](CNC(=O)NC2(C)CC(F)(F)C2)C1	ZINC000875196487	FG	On-Demand	Anodyne	ADRA1B	41	36
COc1ccccc1N1CC[C@@H](CNC(=O)NC2(C)CC(F)(F)C2)C1	ZINC000875196487	FG	On-Demand	Anodyne	DRD3	55	39
COc1ccccc1N1CC[C@@H](CNC(=O)NC2(C)CC(F)(F)C2)C1	ZINC000875196487	FG	On-Demand	Anodyne	HTR7	43	39
C[C@@H]1CN(C(=O)N[C@H]2CCCOc3ccccc32)CC[C@H](C(F)(F)F)O1	ZINC000875196492	FH	On-Demand	Anodyne	RBP4	51	34
C[C@@H]1CN(C(=O)N[C@@H]2CCCOc3ccccc32)CC[C@H](C(F)(F)F)O1	ZINC000875196494	FH	On-Demand	Anodyne	RBP4	51	34
C[C@@H]1CN(C(=O)N[C@@H]2CCCOc3ccccc32)CC[C@@H](C(F)(F)F)O1	ZINC000875196496	FH	On-Demand	Anodyne	RBP4	51	34
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NC[C@H]1CCC=CO1	ZINC000875196499	EE	On-Demand	Anodyne	ACE	42	38
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NC[C@H]1CCC=CO1	ZINC000875196499	EE	On-Demand	Anodyne	CAPN2	49	38
C[C@]1(C(F)(F)F)CN(C(=O)NCCCNC(=O)c2ccccc2)CCO1	ZINC000875196501	FE	On-Demand	Anodyne	EPHX2	18	42
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NC[C@H]1CCC=CO1	ZINC000875196502	EE	On-Demand	Anodyne	ACE	42	38
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NC[C@H]1CCC=CO1	ZINC000875196502	EE	On-Demand	Anodyne	CAPN2	49	38
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NC[C@@H]1CCC=CO1	ZINC000875196504	EE	On-Demand	Anodyne	ACE	42	38
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NC[C@@H]1CCC=CO1	ZINC000875196504	EE	On-Demand	Anodyne	CAPN2	49	38
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NC[C@@H]1CCC=CO1	ZINC000875196505	EE	On-Demand	Anodyne	ACE	42	38
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NC[C@@H]1CCC=CO1	ZINC000875196505	EE	On-Demand	Anodyne	CAPN2	49	38
C[C@@H](CCNC(=O)N(C)CCN1CC2(CCOCC2)C1)c1ccccc1	ZINC000875196523	FF	On-Demand	Anodyne	CASR	51	41
COCC1CC(NC(=O)NCC(=O)N2CCN(c3ccc(Cl)cc3)CC2)C1	ZINC000875196525	GD	On-Demand	Anodyne	SSTR1	21	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875196533	GE	On-Demand	Anodyne	HTR1A	61	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875196533	GE	On-Demand	Anodyne	DRD2	49	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875196533	GE	On-Demand	Anodyne	ADRA1D	49	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875196533	GE	On-Demand	Anodyne	ADRA1A	43	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875196533	GE	On-Demand	Anodyne	DRD3	54	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875196533	GE	On-Demand	Anodyne	SLC6A3	40	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875196533	GE	On-Demand	Anodyne	HTR7	43	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875196535	GE	On-Demand	Anodyne	HTR1A	61	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875196535	GE	On-Demand	Anodyne	DRD2	49	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875196535	GE	On-Demand	Anodyne	ADRA1D	49	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875196535	GE	On-Demand	Anodyne	ADRA1A	43	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875196535	GE	On-Demand	Anodyne	DRD3	54	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875196535	GE	On-Demand	Anodyne	SLC6A3	40	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875196535	GE	On-Demand	Anodyne	HTR7	43	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875196538	GE	On-Demand	Anodyne	HTR1A	61	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875196538	GE	On-Demand	Anodyne	DRD2	49	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875196538	GE	On-Demand	Anodyne	ADRA1D	49	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875196538	GE	On-Demand	Anodyne	ADRA1A	43	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875196538	GE	On-Demand	Anodyne	DRD3	54	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875196538	GE	On-Demand	Anodyne	SLC6A3	40	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875196538	GE	On-Demand	Anodyne	HTR7	43	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875196540	GE	On-Demand	Anodyne	HTR1A	61	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875196540	GE	On-Demand	Anodyne	DRD2	49	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875196540	GE	On-Demand	Anodyne	ADRA1D	49	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875196540	GE	On-Demand	Anodyne	ADRA1A	43	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875196540	GE	On-Demand	Anodyne	DRD3	54	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875196540	GE	On-Demand	Anodyne	SLC6A3	40	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875196540	GE	On-Demand	Anodyne	HTR7	43	38
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCSCC1	ZINC000875196541	EE	On-Demand	Anodyne	EPHX2	15	48
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCSCC1	ZINC000875196542	EE	On-Demand	Anodyne	EPHX2	15	48
N#Cc1c(NC(=O)[C@@H]2CNC(=O)C[C@H]2C(F)(F)F)sc2c1CCCCCC2	ZINC000875196565	GH	On-Demand	Mild	VIPR1	28	45
N#Cc1c(NC(=O)[C@@H]2CNC(=O)C[C@@H]2C(F)(F)F)sc2c1CCCCCC2	ZINC000875196574	GH	On-Demand	Mild	VIPR1	28	45
N#Cc1c(NC(=O)[C@H]2CNC(=O)C[C@H]2C(F)(F)F)sc2c1CCCCCC2	ZINC000875196575	GH	On-Demand	Mild	VIPR1	28	45
N#Cc1c(NC(=O)[C@H]2CNC(=O)C[C@@H]2C(F)(F)F)sc2c1CCCCCC2	ZINC000875196576	GH	On-Demand	Mild	VIPR1	28	45
O=C(NCC(=O)N1CCN(c2ccc(Cl)cc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875196577	GD	On-Demand	Anodyne	SSTR1	21	41
O=C(N[C@H]1CCCOc2ccccc21)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875196597	EG	On-Demand	Anodyne	BIRC3	44	36
O=C(N[C@@H]1CCCOc2ccccc21)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875196599	EG	On-Demand	Anodyne	BIRC3	44	36
CCOC1CC2(C1)C[C@H]2C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)c(C)s1	ZINC000875196648	GI	On-Demand	Bother	CACNA1C	53	36
CCOC1CC2(C1)C[C@H]2C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)c(C)s1	ZINC000875196648	GI	On-Demand	Bother	CACNA1D	78	33
CCCCCCCNC(=O)C(=O)NCc1cnc(N(C)C)n1C	ZINC000875196681	DD	On-Demand	Mild	ASAH1	88	39
C[C@@H](CCNC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875196762	DF	On-Demand	Anodyne	GRIN2B	15	40
C[C@@H](CCNC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875196763	DF	On-Demand	Anodyne	GRIN2B	15	40
C[C@@H](CCNC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1ccccc1	ZINC000875196765	EH	On-Demand	Anodyne	RBP4	45	34
C[C@@H](CCNC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1ccccc1	ZINC000875196768	EH	On-Demand	Anodyne	RBP4	45	34
COc1ccccc1N1CC[C@@H](CNC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1	ZINC000875196846	GF	On-Demand	Anodyne	HTR1A	60	42
COc1ccccc1N1CC[C@@H](CNC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1	ZINC000875196846	GF	On-Demand	Anodyne	DRD2	51	42
COc1ccccc1N1CC[C@@H](CNC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1	ZINC000875196846	GF	On-Demand	Anodyne	ADRA1D	50	36
COc1ccccc1N1CC[C@@H](CNC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1	ZINC000875196846	GF	On-Demand	Anodyne	ADRA1A	44	36
COc1ccccc1N1CC[C@@H](CNC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1	ZINC000875196846	GF	On-Demand	Anodyne	DRD3	53	39
COc1ccccc1N1CC[C@@H](CNC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1	ZINC000875196846	GF	On-Demand	Anodyne	HTR7	42	38
COc1ccccc1N1CC[C@H](CNC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1	ZINC000875196847	GF	On-Demand	Anodyne	HTR1A	60	42
COc1ccccc1N1CC[C@H](CNC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1	ZINC000875196847	GF	On-Demand	Anodyne	DRD2	51	42
COc1ccccc1N1CC[C@H](CNC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1	ZINC000875196847	GF	On-Demand	Anodyne	ADRA1D	50	36
COc1ccccc1N1CC[C@H](CNC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1	ZINC000875196847	GF	On-Demand	Anodyne	ADRA1A	44	36
COc1ccccc1N1CC[C@H](CNC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1	ZINC000875196847	GF	On-Demand	Anodyne	DRD3	53	39
COc1ccccc1N1CC[C@H](CNC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1	ZINC000875196847	GF	On-Demand	Anodyne	HTR7	42	38
O=C(NCCNC(=O)c1cccc(Br)c1)NC[C@H]1C[C@H](O)C1	ZINC000875196850	FD	On-Demand	Anodyne	DRD4	40	31
COc1ccc([C@@H]2CN(C(=O)NCCCNC(=O)c3ccccc3)CCO2)cc1	ZINC000875196885	GF	On-Demand	Anodyne	HTR1A	15	42
COc1ccc([C@@H]2CN(C(=O)NCCCNC(=O)c3ccccc3)CCO2)cc1	ZINC000875196885	GF	On-Demand	Anodyne	DRD2	22	42
COc1ccc([C@@H]2CN(C(=O)NCCCNC(=O)c3ccccc3)CCO2)cc1	ZINC000875196885	GF	On-Demand	Anodyne	DRD4	46	36
COc1ccc([C@@H]2CN(C(=O)NCCCNC(=O)c3ccccc3)CCO2)cc1	ZINC000875196885	GF	On-Demand	Anodyne	ADRA1A	27	43
COc1ccc([C@@H]2CN(C(=O)NCCCNC(=O)c3ccccc3)CCO2)cc1	ZINC000875196885	GF	On-Demand	Anodyne	DRD3	48	42
COc1ccc([C@@H]2CN(C(=O)NCCCNC(=O)c3ccccc3)CCO2)cc1	ZINC000875196885	GF	On-Demand	Anodyne	EDNRA	23	40
COc1ccc([C@@H]2CN(C(=O)NCCCNC(=O)c3ccccc3)CCO2)cc1	ZINC000875196885	GF	On-Demand	Anodyne	BMP1	23	41
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875196911	EE	On-Demand	Anodyne	HTR1A	57	41
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875196911	EE	On-Demand	Anodyne	DRD2	46	41
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875196911	EE	On-Demand	Anodyne	ADRA1D	51	36
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875196911	EE	On-Demand	Anodyne	ADRA1A	45	36
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875196911	EE	On-Demand	Anodyne	DRD3	48	41
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000875196911	EE	On-Demand	Anodyne	HTR7	40	38
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875196913	EE	On-Demand	Anodyne	HTR1A	57	41
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875196913	EE	On-Demand	Anodyne	DRD2	46	41
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875196913	EE	On-Demand	Anodyne	ADRA1D	51	36
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875196913	EE	On-Demand	Anodyne	ADRA1A	45	36
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875196913	EE	On-Demand	Anodyne	DRD3	48	41
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875196913	EE	On-Demand	Anodyne	HTR7	40	38
NC(=O)CCOC(=O)C1CCN(c2nc3ccccc3o2)CC1	ZINC000875196922	DD	On-Demand	Anodyne	PDE6D	59	42
NC(=O)CCOC(=O)C1CCN(c2nc3ccccc3o2)CC1	ZINC000875196922	DD	On-Demand	Anodyne	PTGES	30	42
CONC(=O)C1CCN(C(=O)N[C@@H](C)c2ccc(OCCC(C)C)cc2)CC1	ZINC000875196967	GG	On-Demand	Anodyne	ACACA	20	48
CONC(=O)C1CCN(C(=O)N[C@@H](C)c2ccc(OCCC(C)C)cc2)CC1	ZINC000875196967	GG	On-Demand	Anodyne	ACACB	22	48
CONC(=O)C1CCN(C(=O)N[C@H](C)c2ccc(OCCC(C)C)cc2)CC1	ZINC000875196968	GG	On-Demand	Anodyne	ACACA	20	48
CONC(=O)C1CCN(C(=O)N[C@H](C)c2ccc(OCCC(C)C)cc2)CC1	ZINC000875196968	GG	On-Demand	Anodyne	ACACB	22	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCC(=O)Nc1cccc(Cl)c1C	ZINC000875197053	GF	On-Demand	Anodyne	SLC6A3	44	39
COCC[C@@H](C)NC(=O)NC[C@H]1CN(Cc2ccccc2C)CCO1	ZINC000875197236	ED	On-Demand	Anodyne	DRD4	16	41
COCC[C@H](C)NC(=O)NC[C@@H]1CN(Cc2ccccc2C)CCO1	ZINC000875197237	ED	On-Demand	Anodyne	DRD4	16	41
COCC[C@@H](C)NC(=O)NC[C@@H]1CN(Cc2ccccc2C)CCO1	ZINC000875197238	ED	On-Demand	Anodyne	DRD4	16	41
COCC[C@H](C)NC(=O)NC[C@H]1CN(Cc2ccccc2C)CCO1	ZINC000875197239	ED	On-Demand	Anodyne	DRD4	16	41
CONC(=O)C1CCN(C(=O)NCCC(=O)Nc2cccc(Cl)c2C)CC1	ZINC000875197244	GE	On-Demand	Anodyne	EPHX2	20	42
COCC[C@@H](C)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875197388	CD	On-Demand	Anodyne	REN	15	45
COCC[C@H](C)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875197389	CD	On-Demand	Anodyne	REN	15	45
COCC[C@H](C)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875197390	CD	On-Demand	Anodyne	REN	15	45
COCC[C@@H](C)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875197391	CD	On-Demand	Anodyne	REN	15	45
CC(=O)[C@H]1CCCN(C(=O)NCCNC(=O)CC2CCCCC2)C1	ZINC000875197404	EE	On-Demand	Anodyne	DPP7	15	40
CC(=O)[C@@H]1CCCN(C(=O)NCCNC(=O)CC2CCCCC2)C1	ZINC000875197405	EE	On-Demand	Anodyne	DPP7	15	40
COCC[C@H](C)NC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875197414	DF	On-Demand	Anodyne	ACE	42	40
COCC[C@H](C)NC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875197414	DF	On-Demand	Anodyne	FKBP1A	50	40
COCC[C@H](C)NC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875197414	DF	On-Demand	Anodyne	SLC6A1	48	38
COCC[C@H](C)NC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875197414	DF	On-Demand	Anodyne	SLC6A3	17	48
COCC[C@H](C)NC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875197414	DF	On-Demand	Anodyne	MME	15	40
COCC[C@H](C)NC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875197414	DF	On-Demand	Anodyne	CPT1A	83	35
COCC[C@H](C)NC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875197414	DF	On-Demand	Anodyne	CPT2	43	34
COCC[C@H](C)NC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875197415	DF	On-Demand	Anodyne	ACE	42	40
COCC[C@H](C)NC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875197415	DF	On-Demand	Anodyne	FKBP1A	50	40
COCC[C@H](C)NC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875197415	DF	On-Demand	Anodyne	SLC6A1	48	38
COCC[C@H](C)NC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875197415	DF	On-Demand	Anodyne	SLC6A3	17	48
COCC[C@H](C)NC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875197415	DF	On-Demand	Anodyne	MME	15	40
COCC[C@H](C)NC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875197415	DF	On-Demand	Anodyne	CPT1A	83	35
COCC[C@H](C)NC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875197415	DF	On-Demand	Anodyne	CPT2	43	34
COCC[C@H](C)NC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875197416	DF	On-Demand	Anodyne	ACE	42	40
COCC[C@H](C)NC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875197416	DF	On-Demand	Anodyne	FKBP1A	50	40
COCC[C@H](C)NC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875197416	DF	On-Demand	Anodyne	SLC6A1	48	38
COCC[C@H](C)NC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875197416	DF	On-Demand	Anodyne	SLC6A3	17	48
COCC[C@H](C)NC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875197416	DF	On-Demand	Anodyne	MME	15	40
COCC[C@H](C)NC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875197416	DF	On-Demand	Anodyne	CPT1A	83	35
COCC[C@H](C)NC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875197416	DF	On-Demand	Anodyne	CPT2	43	34
COCC[C@H](C)NC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875197417	DF	On-Demand	Anodyne	ACE	42	40
COCC[C@H](C)NC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875197417	DF	On-Demand	Anodyne	FKBP1A	50	40
COCC[C@H](C)NC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875197417	DF	On-Demand	Anodyne	SLC6A1	48	38
COCC[C@H](C)NC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875197417	DF	On-Demand	Anodyne	SLC6A3	17	48
COCC[C@H](C)NC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875197417	DF	On-Demand	Anodyne	MME	15	40
COCC[C@H](C)NC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875197417	DF	On-Demand	Anodyne	CPT1A	83	35
COCC[C@H](C)NC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875197417	DF	On-Demand	Anodyne	CPT2	43	34
CC(=O)C1CCN(C(=O)NCCC(=O)Nc2cccc(Cl)c2C)CC1	ZINC000875197425	FF	On-Demand	Anodyne	EPHX2	17	40
COCC[C@@H](C)NC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875197460	DD	On-Demand	Anodyne	MAOB	15	44
COCC[C@@H](C)NC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875197460	DD	On-Demand	Anodyne	CTSL	21	44
COCC[C@@H](C)NC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875197460	DD	On-Demand	Anodyne	CTSV	40	44
COCC[C@H](C)NC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875197461	DD	On-Demand	Anodyne	MAOB	15	44
COCC[C@H](C)NC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875197461	DD	On-Demand	Anodyne	CTSL	21	44
COCC[C@H](C)NC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875197461	DD	On-Demand	Anodyne	CTSV	40	44
COCC[C@@H](C)NC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875197462	DD	On-Demand	Anodyne	MAOB	15	44
COCC[C@@H](C)NC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875197462	DD	On-Demand	Anodyne	CTSL	21	44
COCC[C@@H](C)NC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875197462	DD	On-Demand	Anodyne	CTSV	40	44
COCC[C@H](C)NC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875197463	DD	On-Demand	Anodyne	MAOB	15	44
COCC[C@H](C)NC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875197463	DD	On-Demand	Anodyne	CTSL	21	44
COCC[C@H](C)NC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875197463	DD	On-Demand	Anodyne	CTSV	40	44
CC(=O)Nc1cc(NC(=O)c2cc3ccccc3cc2NS(C)(=O)=O)ccc1F	ZINC000875197500	HH	On-Demand	Anodyne	PLA2G7	27	41
CC(=O)Nc1cc(NC(=O)c2cc3ccccc3cc2NS(C)(=O)=O)ccc1F	ZINC000875197500	HH	On-Demand	Anodyne	KCNK3	43	32
COC(=O)N(C)NC(=O)NCCCNC(=O)c1cccc(Br)c1	ZINC000875197567	GD	On-Demand	Reactive	DRD4	42	32
COCC[C@H](C)NC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875197668	EF	On-Demand	Mild	CTSF	51	33
COCC[C@H](C)NC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875197669	EF	On-Demand	Mild	CTSF	51	33
COCC[C@@H](C)NC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875197670	EF	On-Demand	Mild	CTSF	51	33
COCC[C@@H](C)NC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875197671	EF	On-Demand	Mild	CTSF	51	33
COCC[C@@H](C)NC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875197696	EG	On-Demand	Anodyne	HTR1A	18	40
COCC[C@@H](C)NC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875197696	EG	On-Demand	Anodyne	DRD4	18	47
COCC[C@@H](C)NC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875197696	EG	On-Demand	Anodyne	LIPE	18	41
COCC[C@@H](C)NC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875197696	EG	On-Demand	Anodyne	RBP4	48	40
COCC[C@H](C)NC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875197697	EG	On-Demand	Anodyne	HTR1A	18	40
COCC[C@H](C)NC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875197697	EG	On-Demand	Anodyne	DRD4	18	47
COCC[C@H](C)NC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875197697	EG	On-Demand	Anodyne	LIPE	18	41
COCC[C@H](C)NC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875197697	EG	On-Demand	Anodyne	RBP4	48	40
COCC[C@@H](C)NC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875197698	EG	On-Demand	Anodyne	HTR1A	18	40
COCC[C@@H](C)NC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875197698	EG	On-Demand	Anodyne	DRD4	18	47
COCC[C@@H](C)NC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875197698	EG	On-Demand	Anodyne	LIPE	18	41
COCC[C@@H](C)NC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875197698	EG	On-Demand	Anodyne	RBP4	48	40
COCC[C@H](C)NC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875197699	EG	On-Demand	Anodyne	HTR1A	18	40
COCC[C@H](C)NC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875197699	EG	On-Demand	Anodyne	DRD4	18	47
COCC[C@H](C)NC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875197699	EG	On-Demand	Anodyne	LIPE	18	41
COCC[C@H](C)NC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875197699	EG	On-Demand	Anodyne	RBP4	48	40
CCCCCCCNC(=O)C(=O)N[C@H]1CCOc2ccc(F)cc21	ZINC000875197827	EF	On-Demand	Mild	ASAH1	54	34
CCCCCCCNC(=O)C(=O)N[C@H]1CCOc2ccc(F)cc21	ZINC000875197827	EF	On-Demand	Mild	LASR	52	39
CCCCCCCNC(=O)C(=O)N[C@@H]1CCOc2ccc(F)cc21	ZINC000875197828	EF	On-Demand	Mild	ASAH1	54	34
CCCCCCCNC(=O)C(=O)N[C@@H]1CCOc2ccc(F)cc21	ZINC000875197828	EF	On-Demand	Mild	LASR	52	39
CN1CCN(C2CCN(C(=O)NCCNC(=O)CC3CCCCC3)CC2)CC1	ZINC000875197833	GD	On-Demand	Anodyne	L3MBTL3	44	40
COCC[C@@H](C)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875198033	EF	On-Demand	Anodyne	OPRL1	18	45
COCC[C@H](C)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875198034	EF	On-Demand	Anodyne	OPRL1	18	45
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H]1CCSC1	ZINC000875198066	ED	On-Demand	Anodyne	C3AR1	40	41
O=C(N[C@H]1CCSC1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875198067	ED	On-Demand	Anodyne	C3AR1	40	41
O=C(N[C@@H]1CCSC1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875198068	ED	On-Demand	Anodyne	C3AR1	40	41
O=C(N[C@H]1CCSC1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875198069	ED	On-Demand	Anodyne	C3AR1	40	41
CCCCCCCNC(=O)C(=O)N[C@@H]1CCSC1	ZINC000875198093	CD	On-Demand	Mild	EPHX2	15	48
CCCCCCCNC(=O)C(=O)N[C@@H]1CCSC1	ZINC000875198093	CD	On-Demand	Mild	ASAH1	49	32
CCCCCCCNC(=O)C(=O)N[C@H]1CCSC1	ZINC000875198094	CD	On-Demand	Mild	EPHX2	15	48
CCCCCCCNC(=O)C(=O)N[C@H]1CCSC1	ZINC000875198094	CD	On-Demand	Mild	ASAH1	49	32
O=C(N[C@@H]1CCSC1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875198143	FD	On-Demand	Anodyne	ETHR	55	47
O=C(N[C@H]1CCSC1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875198144	FD	On-Demand	Anodyne	ETHR	55	47
O=C(NCCCCC1CC1)C(=O)N[C@H]1CCN(c2ccccc2)C1=O	ZINC000875198261	ED	On-Demand	Anodyne	HTR1A	15	40
O=C(NCCCCC1CC1)C(=O)N[C@H]1CCN(c2ccccc2)C1=O	ZINC000875198261	ED	On-Demand	Anodyne	DRD2	15	41
O=C(NCCCCC1CC1)C(=O)N[C@H]1CCN(c2ccccc2)C1=O	ZINC000875198261	ED	On-Demand	Anodyne	DRD3	31	41
O=C(NCCCCC1CC1)C(=O)N[C@@H]1CCN(c2ccccc2)C1=O	ZINC000875198262	ED	On-Demand	Anodyne	HTR1A	15	40
O=C(NCCCCC1CC1)C(=O)N[C@@H]1CCN(c2ccccc2)C1=O	ZINC000875198262	ED	On-Demand	Anodyne	DRD2	15	41
O=C(NCCCCC1CC1)C(=O)N[C@@H]1CCN(c2ccccc2)C1=O	ZINC000875198262	ED	On-Demand	Anodyne	DRD3	31	41
COCC[C@H](C)NC(=O)NNc1cccc(C)n1	ZINC000875198327	CD	On-Demand	Reactive	GRM5	17	42
COCC[C@H](C)NC(=O)NNc1cccc(C)n1	ZINC000875198327	CD	On-Demand	Reactive	SORT1	15	41
COCC[C@@H](C)NC(=O)NNc1cccc(C)n1	ZINC000875198328	CD	On-Demand	Reactive	GRM5	17	42
COCC[C@@H](C)NC(=O)NNc1cccc(C)n1	ZINC000875198328	CD	On-Demand	Reactive	SORT1	15	41
COCC[C@H](C)NC(=O)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875198433	FF	On-Demand	Anodyne	P2RY12	48	32
COCC[C@H](C)NC(=O)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875198433	FF	On-Demand	Anodyne	CALCRL	18	41
COCC[C@@H](C)NC(=O)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875198434	FF	On-Demand	Anodyne	P2RY12	48	32
COCC[C@@H](C)NC(=O)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875198434	FF	On-Demand	Anodyne	CALCRL	18	41
COC(=O)N(C)NC(=O)NCCCOc1ccc(C)cc1	ZINC000875198441	CD	On-Demand	Reactive	DRD4	15	43
COc1cc(C)ccc1NC(=O)[C@]1(C#N)CCN(C(=O)OC(C)(C)C)C1	ZINC000875198443	FG	On-Demand	Mild	GPR119	19	40
COc1cc(C)ccc1NC(=O)[C@@]1(C#N)CCN(C(=O)OC(C)(C)C)C1	ZINC000875198444	FG	On-Demand	Mild	GPR119	19	40
COCC[C@@H](C)NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875198453	EE	On-Demand	Mild	ITK	21	52
COCC[C@@H](C)NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875198453	EE	On-Demand	Mild	PANC	54	37
COCC[C@H](C)NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875198454	EE	On-Demand	Mild	ITK	21	52
COCC[C@H](C)NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875198454	EE	On-Demand	Mild	PANC	54	37
COc1cc(C)ccc1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875198498	FG	On-Demand	Anodyne	PAPA1_CARPA	44	33
COc1cc(C)ccc1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875198498	FG	On-Demand	Anodyne	CTSK	22	52
COc1cc(C)ccc1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875198498	FG	On-Demand	Anodyne	CAPNS1	57	35
COc1cc(C)ccc1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875198498	FG	On-Demand	Anodyne	CAPN1	48	35
COc1cc(C)ccc1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875198498	FG	On-Demand	Anodyne	CAPN2	76	38
COc1cc(C)ccc1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875198498	FG	On-Demand	Anodyne	NPR	43	31
COc1cc(C)ccc1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875198498	FG	On-Demand	Anodyne	NAAA	55	38
COc1cc(C)ccc1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875198498	FG	On-Demand	Anodyne	SLC12A5	66	37
O=C(Nc1ccccc1CN1CCOCC1)C(F)(F)c1cc(F)cc(F)c1	ZINC000875198500	GH	On-Demand	Anodyne	CCR3	18	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCSC1	ZINC000875198535	GE	On-Demand	Anodyne	DRD2	26	47
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCSC1	ZINC000875198535	GE	On-Demand	Anodyne	DRD4	49	47
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCSC1	ZINC000875198535	GE	On-Demand	Anodyne	ACHE	62	59
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCSC1	ZINC000875198535	GE	On-Demand	Anodyne	DRD3	25	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCSC1	ZINC000875198535	GE	On-Demand	Anodyne	SLC6A3	15	47
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCSC1	ZINC000875198535	GE	On-Demand	Anodyne	CHRM3	16	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCSC1	ZINC000875198535	GE	On-Demand	Anodyne	LTA4H	21	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCSC1	ZINC000875198535	GE	On-Demand	Anodyne	SIGMAR1	56	48
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCSC1	ZINC000875198535	GE	On-Demand	Anodyne	BCHE	16	48
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCSC1	ZINC000875198535	GE	On-Demand	Anodyne	MCHR1	25	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCSC1	ZINC000875198535	GE	On-Demand	Anodyne	CACNA1G	25	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCSC1	ZINC000875198536	GE	On-Demand	Anodyne	DRD2	26	47
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCSC1	ZINC000875198536	GE	On-Demand	Anodyne	DRD4	49	47
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCSC1	ZINC000875198536	GE	On-Demand	Anodyne	ACHE	62	59
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCSC1	ZINC000875198536	GE	On-Demand	Anodyne	DRD3	25	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCSC1	ZINC000875198536	GE	On-Demand	Anodyne	SLC6A3	15	47
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCSC1	ZINC000875198536	GE	On-Demand	Anodyne	CHRM3	16	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCSC1	ZINC000875198536	GE	On-Demand	Anodyne	LTA4H	21	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCSC1	ZINC000875198536	GE	On-Demand	Anodyne	SIGMAR1	56	48
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCSC1	ZINC000875198536	GE	On-Demand	Anodyne	BCHE	16	48
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCSC1	ZINC000875198536	GE	On-Demand	Anodyne	MCHR1	25	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCSC1	ZINC000875198536	GE	On-Demand	Anodyne	CACNA1G	25	41
COCC[C@H](C)NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875198552	DD	On-Demand	Anodyne	DRD4	21	40
COCC[C@H](C)NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875198552	DD	On-Demand	Anodyne	SIGMAR1	25	40
COCC[C@H](C)NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875198552	DD	On-Demand	Anodyne	FAAH	15	40
COCC[C@@H](C)NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875198553	DD	On-Demand	Anodyne	DRD4	21	40
COCC[C@@H](C)NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875198553	DD	On-Demand	Anodyne	SIGMAR1	25	40
COCC[C@@H](C)NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875198553	DD	On-Demand	Anodyne	FAAH	15	40
COCC[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875198564	EG	On-Demand	Reactive	ALOX5	16	46
COCC[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875198564	EG	On-Demand	Reactive	MAOB	27	45
COCC[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875198564	EG	On-Demand	Reactive	LTA4H	49	52
COCC[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875198564	EG	On-Demand	Reactive	CA1	17	47
COCC[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875198564	EG	On-Demand	Reactive	PTGER3	58	38
COCC[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875198564	EG	On-Demand	Reactive	PAPA1_CARPA	43	34
COCC[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875198564	EG	On-Demand	Reactive	CTSK	28	46
COCC[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875198564	EG	On-Demand	Reactive	CAPN1	42	39
COCC[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875198564	EG	On-Demand	Reactive	CAPN2	46	36
COCC[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875198564	EG	On-Demand	Reactive	ACE2	33	43
COCC[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875198564	EG	On-Demand	Reactive	F7	16	46
COCC[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875198564	EG	On-Demand	Reactive	ADAMTS4	28	40
COCC[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875198564	EG	On-Demand	Reactive	NPR	46	31
COCC[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875198564	EG	On-Demand	Reactive	FFAR1	41	42
COCC[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875198565	EG	On-Demand	Reactive	ALOX5	16	46
COCC[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875198565	EG	On-Demand	Reactive	MAOB	27	45
COCC[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875198565	EG	On-Demand	Reactive	LTA4H	49	52
COCC[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875198565	EG	On-Demand	Reactive	CA1	17	47
COCC[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875198565	EG	On-Demand	Reactive	PTGER3	58	38
COCC[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875198565	EG	On-Demand	Reactive	PAPA1_CARPA	43	34
COCC[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875198565	EG	On-Demand	Reactive	CTSK	28	46
COCC[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875198565	EG	On-Demand	Reactive	CAPN1	42	39
COCC[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875198565	EG	On-Demand	Reactive	CAPN2	46	36
COCC[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875198565	EG	On-Demand	Reactive	ACE2	33	43
COCC[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875198565	EG	On-Demand	Reactive	F7	16	46
COCC[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875198565	EG	On-Demand	Reactive	ADAMTS4	28	40
COCC[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875198565	EG	On-Demand	Reactive	NPR	46	31
COCC[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875198565	EG	On-Demand	Reactive	FFAR1	41	42
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@@](=O)CC	ZINC000875198604	ED	On-Demand	Anodyne	MME	48	39
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@@](=O)CC	ZINC000875198604	ED	On-Demand	Anodyne	MMP2	21	40
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@@](=O)CC	ZINC000875198604	ED	On-Demand	Anodyne	MMP3	41	37
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@@](=O)CC	ZINC000875198604	ED	On-Demand	Anodyne	CAPN1	44	40
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@@](=O)CC	ZINC000875198604	ED	On-Demand	Anodyne	CAPN2	83	40
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@@](=O)CC	ZINC000875198604	ED	On-Demand	Anodyne	NPR	43	33
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@@](=O)CC	ZINC000875198604	ED	On-Demand	Anodyne	AMP1_PLAFQ	33	40
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@](=O)CC	ZINC000875198605	ED	On-Demand	Anodyne	MME	48	39
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@](=O)CC	ZINC000875198605	ED	On-Demand	Anodyne	MMP2	21	40
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@](=O)CC	ZINC000875198605	ED	On-Demand	Anodyne	MMP3	41	37
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@](=O)CC	ZINC000875198605	ED	On-Demand	Anodyne	CAPN1	44	40
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@](=O)CC	ZINC000875198605	ED	On-Demand	Anodyne	CAPN2	83	40
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@](=O)CC	ZINC000875198605	ED	On-Demand	Anodyne	NPR	43	33
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@](=O)CC	ZINC000875198605	ED	On-Demand	Anodyne	AMP1_PLAFQ	33	40
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@](=O)CC	ZINC000875198606	ED	On-Demand	Anodyne	MME	48	39
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@](=O)CC	ZINC000875198606	ED	On-Demand	Anodyne	MMP2	21	40
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@](=O)CC	ZINC000875198606	ED	On-Demand	Anodyne	MMP3	41	37
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@](=O)CC	ZINC000875198606	ED	On-Demand	Anodyne	CAPN1	44	40
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@](=O)CC	ZINC000875198606	ED	On-Demand	Anodyne	CAPN2	83	40
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@](=O)CC	ZINC000875198606	ED	On-Demand	Anodyne	NPR	43	33
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@](=O)CC	ZINC000875198606	ED	On-Demand	Anodyne	AMP1_PLAFQ	33	40
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@@](=O)CC	ZINC000875198607	ED	On-Demand	Anodyne	MME	48	39
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@@](=O)CC	ZINC000875198607	ED	On-Demand	Anodyne	MMP2	21	40
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@@](=O)CC	ZINC000875198607	ED	On-Demand	Anodyne	MMP3	41	37
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@@](=O)CC	ZINC000875198607	ED	On-Demand	Anodyne	CAPN1	44	40
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@@](=O)CC	ZINC000875198607	ED	On-Demand	Anodyne	CAPN2	83	40
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@@](=O)CC	ZINC000875198607	ED	On-Demand	Anodyne	NPR	43	33
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@@](=O)CC	ZINC000875198607	ED	On-Demand	Anodyne	AMP1_PLAFQ	33	40
C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875198668	EE	On-Demand	Anodyne	MC4R	30	40
CC[C@H](C[C@H](C)O)NC(=O)NCCCOc1ccc(C)cc1	ZINC000875198725	DF	On-Demand	Anodyne	ADRB1	20	41
CC[C@H](C[C@H](C)O)NC(=O)NCCCOc1ccc(C)cc1	ZINC000875198725	DF	On-Demand	Anodyne	HRH2	15	42
CCO[C@@H](C(=O)Oc1c(OC)cccc1C(=O)OC)C1CC1	ZINC000875198741	DE	On-Demand	Anodyne	KCNA3	40	37
CCO[C@@H](C(=O)Oc1c(OC)cccc1C(=O)OC)C1CC1	ZINC000875198741	DE	On-Demand	Anodyne	KCNK3	42	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2c(C)cccc2C)C1	ZINC000875198746	DD	On-Demand	Anodyne	SLC6A1	43	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2c(C)cccc2C)C1	ZINC000875198747	DD	On-Demand	Anodyne	SLC6A1	43	34
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccn(C)n3)CC2)c(OC)c1	ZINC000875198749	GC	On-Demand	Clean	HTR1A	42	41
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccn(C)n3)CC2)c(OC)c1	ZINC000875198749	GC	On-Demand	Clean	DRD2	36	45
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccn(C)n3)CC2)c(OC)c1	ZINC000875198749	GC	On-Demand	Clean	DRD4	44	35
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccn(C)n3)CC2)c(OC)c1	ZINC000875198749	GC	On-Demand	Clean	DRD3	57	40
O=C(N[C@H]1CCSC1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875198771	ED	On-Demand	Anodyne	OXTR	40	35
O=C(N[C@@H]1CCSC1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875198772	ED	On-Demand	Anodyne	OXTR	40	35
O=C(N[C@H]1CCSC1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875198773	ED	On-Demand	Anodyne	OXTR	40	35
O=C(N[C@@H]1CCSC1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875198774	ED	On-Demand	Anodyne	OXTR	40	35
COCC[C@H](C)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875198807	DE	On-Demand	Anodyne	ACE	45	43
COCC[C@H](C)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875198807	DE	On-Demand	Anodyne	SLC6A1	49	36
COCC[C@H](C)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875198807	DE	On-Demand	Anodyne	SLC6A3	16	44
COCC[C@H](C)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875198807	DE	On-Demand	Anodyne	MME	15	43
COCC[C@H](C)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875198807	DE	On-Demand	Anodyne	PREP	43	39
COCC[C@H](C)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875198807	DE	On-Demand	Anodyne	XIAP	43	38
COCC[C@H](C)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875198807	DE	On-Demand	Anodyne	BIRC2	40	37
COCC[C@H](C)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875198808	DE	On-Demand	Anodyne	ACE	45	43
COCC[C@H](C)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875198808	DE	On-Demand	Anodyne	SLC6A1	49	36
COCC[C@H](C)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875198808	DE	On-Demand	Anodyne	SLC6A3	16	44
COCC[C@H](C)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875198808	DE	On-Demand	Anodyne	MME	15	43
COCC[C@H](C)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875198808	DE	On-Demand	Anodyne	PREP	43	39
COCC[C@H](C)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875198808	DE	On-Demand	Anodyne	XIAP	43	38
COCC[C@H](C)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875198808	DE	On-Demand	Anodyne	BIRC2	40	37
COCC[C@H](C)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875198809	DE	On-Demand	Anodyne	ACE	45	43
COCC[C@H](C)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875198809	DE	On-Demand	Anodyne	SLC6A1	49	36
COCC[C@H](C)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875198809	DE	On-Demand	Anodyne	SLC6A3	16	44
COCC[C@H](C)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875198809	DE	On-Demand	Anodyne	MME	15	43
COCC[C@H](C)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875198809	DE	On-Demand	Anodyne	PREP	43	39
COCC[C@H](C)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875198809	DE	On-Demand	Anodyne	XIAP	43	38
COCC[C@H](C)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875198809	DE	On-Demand	Anodyne	BIRC2	40	37
COCC[C@H](C)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875198810	DE	On-Demand	Anodyne	ACE	45	43
COCC[C@H](C)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875198810	DE	On-Demand	Anodyne	SLC6A1	49	36
COCC[C@H](C)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875198810	DE	On-Demand	Anodyne	SLC6A3	16	44
COCC[C@H](C)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875198810	DE	On-Demand	Anodyne	MME	15	43
COCC[C@H](C)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875198810	DE	On-Demand	Anodyne	PREP	43	39
COCC[C@H](C)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875198810	DE	On-Demand	Anodyne	XIAP	43	38
COCC[C@H](C)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875198810	DE	On-Demand	Anodyne	BIRC2	40	37
CC(=O)N[C@H](CC(C)C)C(=O)N(C)c1ccc(C)c(C)c1	ZINC000875198824	CF	On-Demand	Anodyne	CAPN1	24	41
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCSC1	ZINC000875198825	EF	On-Demand	Anodyne	SIGMAR1	17	41
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCSC1	ZINC000875198825	EF	On-Demand	Anodyne	MTNR1A	20	40
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCSC1	ZINC000875198825	EF	On-Demand	Anodyne	MTNR1B	20	40
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCSC1	ZINC000875198825	EF	On-Demand	Anodyne	FAAH	32	40
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCSC1	ZINC000875198825	EF	On-Demand	Anodyne	AMP1_PLAFQ	22	44
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCSC1	ZINC000875198826	EF	On-Demand	Anodyne	SIGMAR1	17	41
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCSC1	ZINC000875198826	EF	On-Demand	Anodyne	MTNR1A	20	40
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCSC1	ZINC000875198826	EF	On-Demand	Anodyne	MTNR1B	20	40
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCSC1	ZINC000875198826	EF	On-Demand	Anodyne	FAAH	32	40
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCSC1	ZINC000875198826	EF	On-Demand	Anodyne	AMP1_PLAFQ	22	44
O=C(N[C@H]1CCCCc2ccccc21)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875198932	FF	On-Demand	Anodyne	RBP4	42	35
O=C(N[C@@H]1CCCCc2ccccc21)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875198933	FF	On-Demand	Anodyne	RBP4	42	35
C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875198953	GF	On-Demand	Anodyne	CACNA1H	54	36
C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875198953	GF	On-Demand	Anodyne	UGCG	45	50
C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875198953	GF	On-Demand	Anodyne	MC4R	75	41
C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875198953	GF	On-Demand	Anodyne	CCR1	41	36
C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875198953	GF	On-Demand	Anodyne	EPHX2	17	48
COc1ccc(C(=O)N(C)C)cc1NC(=O)C1(c2ccnc3ccccc23)CC1	ZINC000875199032	GH	On-Demand	Anodyne	PDGFRB	42	36
COc1ccc(C(=O)N(C)C)cc1NC(=O)C1(c2ccnc3ccccc23)CC1	ZINC000875199032	GH	On-Demand	Anodyne	KDR	66	38
COc1ccc(C(=O)N(C)C)cc1NC(=O)C1(c2ccnc3ccccc23)CC1	ZINC000875199032	GH	On-Demand	Anodyne	MET	31	40
COc1ccc(C(=O)N(C)C)cc1NC(=O)C1(c2ccnc3ccccc23)CC1	ZINC000875199032	GH	On-Demand	Anodyne	PDGFRA	52	38
CC(=O)Nc1cc(NC(=O)[C@H](CC(N)=O)NC(=O)c2ccccc2Cl)ccc1F	ZINC000875199042	HE	On-Demand	Anodyne	PYGL	21	44
CC(=O)Nc1cc(NC(=O)[C@H](CC(N)=O)NC(=O)c2ccccc2Cl)ccc1F	ZINC000875199042	HE	On-Demand	Anodyne	GRM4	22	40
CC(=O)Nc1cc(NC(=O)[C@H](CC(N)=O)NC(=O)c2ccccc2Cl)ccc1F	ZINC000875199042	HE	On-Demand	Anodyne	NR2E3	54	35
CC(=O)Nc1cc(NC(=O)[C@@H](CC(N)=O)NC(=O)c2ccccc2Cl)ccc1F	ZINC000875199043	HE	On-Demand	Anodyne	PYGL	21	44
CC(=O)Nc1cc(NC(=O)[C@@H](CC(N)=O)NC(=O)c2ccccc2Cl)ccc1F	ZINC000875199043	HE	On-Demand	Anodyne	GRM4	22	40
CC(=O)Nc1cc(NC(=O)[C@@H](CC(N)=O)NC(=O)c2ccccc2Cl)ccc1F	ZINC000875199043	HE	On-Demand	Anodyne	NR2E3	54	35
CC(=O)C1CCN(C(=O)C(=O)NCC2(N[C@@H](C)c3ccccc3)CCCC2)CC1	ZINC000875199061	GF	On-Demand	Anodyne	HCN1	43	35
CC(=O)C1CCN(C(=O)C(=O)NCC2(N[C@@H](C)c3ccccc3)CCCC2)CC1	ZINC000875199061	GF	On-Demand	Anodyne	HCN4	42	35
CC(=O)C1CCN(C(=O)C(=O)NCC2(N[C@H](C)c3ccccc3)CCCC2)CC1	ZINC000875199062	GF	On-Demand	Anodyne	HCN1	43	35
CC(=O)C1CCN(C(=O)C(=O)NCC2(N[C@H](C)c3ccccc3)CCCC2)CC1	ZINC000875199062	GF	On-Demand	Anodyne	HCN4	42	35
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)N[C@H]3CCSC3)C2)c1	ZINC000875199070	GC	On-Demand	Anodyne	DRD4	31	42
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)N[C@@H]3CCSC3)C2)c1	ZINC000875199071	GC	On-Demand	Anodyne	DRD4	31	42
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)N[C@H]3CCSC3)C2)c1	ZINC000875199072	GC	On-Demand	Anodyne	DRD4	31	42
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)N[C@@H]3CCSC3)C2)c1	ZINC000875199073	GC	On-Demand	Anodyne	DRD4	31	42
C#CC[C@@H](COC)NC(=O)C(=O)NCCc1cccc(OCC)c1	ZINC000875199098	EC	On-Demand	Mild	MTNR1A	31	40
C#CC[C@@H](COC)NC(=O)C(=O)NCCc1cccc(OCC)c1	ZINC000875199098	EC	On-Demand	Mild	MTNR1B	25	40
C#CC[C@@H](COC)NC(=O)C(=O)NCCc1cccc(OCC)c1	ZINC000875199098	EC	On-Demand	Mild	CRTM	44	33
C#CC[C@@H](COC)NC(=O)C(=O)NCCc1cccc(OCC)c1	ZINC000875199098	EC	On-Demand	Mild	PDS	83	38
C#CC[C@H](COC)NC(=O)C(=O)NCCc1cccc(OCC)c1	ZINC000875199100	EC	On-Demand	Mild	MTNR1A	31	40
C#CC[C@H](COC)NC(=O)C(=O)NCCc1cccc(OCC)c1	ZINC000875199100	EC	On-Demand	Mild	MTNR1B	25	40
C#CC[C@H](COC)NC(=O)C(=O)NCCc1cccc(OCC)c1	ZINC000875199100	EC	On-Demand	Mild	CRTM	44	33
C#CC[C@H](COC)NC(=O)C(=O)NCCc1cccc(OCC)c1	ZINC000875199100	EC	On-Demand	Mild	PDS	83	38
C[C@H](NC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1)c1cnn(C)c1	ZINC000875199213	GD	On-Demand	Anodyne	NPY2R	66	43
CCOc1cc(CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)ccc1OC	ZINC000875199219	FD	On-Demand	Anodyne	SSTR5	74	41
CCOc1cc(CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)ccc1OC	ZINC000875199219	FD	On-Demand	Anodyne	PDE6A	42	32
CCOc1cc(CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)ccc1OC	ZINC000875199220	FD	On-Demand	Anodyne	SSTR5	74	41
CCOc1cc(CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)ccc1OC	ZINC000875199220	FD	On-Demand	Anodyne	PDE6A	42	32
O=C(NCc1ccc(Oc2ccccc2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875199229	EG	On-Demand	Anodyne	LTA4H	42	37
O=C(NCc1ccc(Oc2ccccc2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875199229	EG	On-Demand	Anodyne	EPHX2	15	44
O=C(NCc1ccc(Oc2ccccc2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875199229	EG	On-Demand	Anodyne	PDS	49	36
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCCCc3ccccc32)CC1	ZINC000875199233	FD	On-Demand	Anodyne	BDKRB1	49	38
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCCCc3ccccc32)CC1	ZINC000875199233	FD	On-Demand	Anodyne	EPHX2	17	48
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCCCc3ccccc32)CC1	ZINC000875199233	FD	On-Demand	Anodyne	XIAP	22	41
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCCCc3ccccc32)CC1	ZINC000875199233	FD	On-Demand	Anodyne	BIRC2	42	39
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCCCc3ccccc32)CC1	ZINC000875199234	FD	On-Demand	Anodyne	BDKRB1	49	38
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCCCc3ccccc32)CC1	ZINC000875199234	FD	On-Demand	Anodyne	EPHX2	17	48
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCCCc3ccccc32)CC1	ZINC000875199234	FD	On-Demand	Anodyne	XIAP	22	41
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCCCc3ccccc32)CC1	ZINC000875199234	FD	On-Demand	Anodyne	BIRC2	42	39
CCCCCCCNC(=O)C(=O)N[C@@H](CC)c1ccncc1	ZINC000875199240	DF	On-Demand	Mild	ASAH1	92	38
CCCCCCCNC(=O)C(=O)N[C@H](CC)c1ccncc1	ZINC000875199242	DF	On-Demand	Mild	ASAH1	92	38
C[C@H](NC(=O)C(=O)N1C[C@@H]2CN(Cc3ccccc3)C[C@]2(C)C1)c1cnn(C)c1	ZINC000875199262	GD	On-Demand	Anodyne	CTSK	17	42
COC(=O)C1(O)CN(C(=O)N[C@H]2CCCCc3ccccc32)C1	ZINC000875199266	DD	On-Demand	Anodyne	BIRC2	40	39
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCCCc3ccccc32)C1	ZINC000875199268	DD	On-Demand	Anodyne	BIRC2	40	39
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1cnn(C)c1	ZINC000875199324	FF	On-Demand	Anodyne	FAAH	60	39
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1cnn(C)c1	ZINC000875199324	FF	On-Demand	Anodyne	CES1	54	34
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1cnn(C)c1	ZINC000875199324	FF	On-Demand	Anodyne	CAPN2	56	38
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1cnn(C)c1	ZINC000875199324	FF	On-Demand	Anodyne	AMP1_PLAFQ	23	44
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1cnn(C)c1	ZINC000875199324	FF	On-Demand	Anodyne	CES1D	55	34
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875199337	ED	On-Demand	Anodyne	CACNA1I	42	34
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875199338	ED	On-Demand	Anodyne	CACNA1I	42	34
COC(=O)N(C)NC(=O)N[C@@H]1CCCCc2ccccc21	ZINC000875199345	CE	On-Demand	Reactive	BIRC2	49	39
COC(=O)N(C)NC(=O)N[C@H]1CCCCc2ccccc21	ZINC000875199347	CE	On-Demand	Reactive	BIRC2	49	39
O=C(NCCO)C1CCN(C(=O)NCc2ccc(Oc3ccccc3)cc2)CC1	ZINC000875199381	GF	On-Demand	Anodyne	LTA4H	48	47
O=C(NCCO)C1CCN(C(=O)NCc2ccc(Oc3ccccc3)cc2)CC1	ZINC000875199381	GF	On-Demand	Anodyne	MMP13	17	41
O=C(NCCO)C1CCN(C(=O)NCc2ccc(Oc3ccccc3)cc2)CC1	ZINC000875199381	GF	On-Demand	Anodyne	FAAH	15	40
O=C(NCCO)C1CCN(C(=O)NCc2ccc(Oc3ccccc3)cc2)CC1	ZINC000875199381	GF	On-Demand	Anodyne	EPHX2	33	44
O=C(NCCO)C1CCN(C(=O)NCc2ccc(Oc3ccccc3)cc2)CC1	ZINC000875199381	GF	On-Demand	Anodyne	MMP7	15	41
O=C(NCCO)C1CCN(C(=O)NCc2ccc(Oc3ccccc3)cc2)CC1	ZINC000875199381	GF	On-Demand	Anodyne	NAMPT	28	41
CCCCCCCNC(=O)C(=O)NCc1cnn(C)c1C	ZINC000875199389	CD	On-Demand	Mild	ASAH1	95	38
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H](O)[C@H]3CCCC[C@@H]32)CC1	ZINC000875199401	GF	On-Demand	Anodyne	CACNA1I	47	34
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H](O)[C@H]3CCCC[C@@H]32)CC1	ZINC000875199401	GF	On-Demand	Anodyne	GPR119	38	41
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H](O)[C@H]3CCCC[C@H]32)CC1	ZINC000875199402	GF	On-Demand	Anodyne	CACNA1I	47	34
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H](O)[C@H]3CCCC[C@H]32)CC1	ZINC000875199402	GF	On-Demand	Anodyne	GPR119	38	41
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H](O)[C@@H]3CCCC[C@H]32)CC1	ZINC000875199403	GF	On-Demand	Anodyne	CACNA1I	47	34
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H](O)[C@@H]3CCCC[C@H]32)CC1	ZINC000875199403	GF	On-Demand	Anodyne	GPR119	38	41
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H](O)[C@@H]3CCCC[C@@H]32)CC1	ZINC000875199404	GF	On-Demand	Anodyne	CACNA1I	47	34
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H](O)[C@@H]3CCCC[C@@H]32)CC1	ZINC000875199404	GF	On-Demand	Anodyne	GPR119	38	41
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCO[C@@H]3CCC[C@@H]32)CC1	ZINC000875199413	FF	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCO[C@@H]3CCC[C@@H]32)CC1	ZINC000875199413	FF	On-Demand	Anodyne	GPR119	34	41
CC(C)(C)OC(=O)N1CCC(CNC(=O)N(C2CC2)C2CC2)CC1	ZINC000875199418	EF	On-Demand	Anodyne	CACNA1I	48	35
CC(C)(C)OC(=O)N1CCC(CNC(=O)N(C2CC2)C2CC2)CC1	ZINC000875199418	EF	On-Demand	Anodyne	GPR119	39	42
CC(C)(C)OC(=O)N1CCC(CNC(=O)NCCN2CC[C@H](O)C2)CC1	ZINC000875199431	FC	On-Demand	Anodyne	CACNA1H	17	42
CC(C)(C)OC(=O)N1CCC(CNC(=O)NCCN2CC[C@H](O)C2)CC1	ZINC000875199431	FC	On-Demand	Anodyne	CACNA1I	55	39
CC(C)(C)OC(=O)N1CCC(CNC(=O)NCCN2CC[C@@H](O)C2)CC1	ZINC000875199432	FC	On-Demand	Anodyne	CACNA1H	17	42
CC(C)(C)OC(=O)N1CCC(CNC(=O)NCCN2CC[C@@H](O)C2)CC1	ZINC000875199432	FC	On-Demand	Anodyne	CACNA1I	55	39
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N2CC=CC2)C1	ZINC000875199437	DE	On-Demand	Anodyne	CACNA1I	46	33
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)N2CC=CC2)C1	ZINC000875199438	DE	On-Demand	Anodyne	CACNA1I	46	33
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)N2CC(Cc3ccco3)C2)C1	ZINC000875199456	GG	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N2CC(Cc3ccco3)C2)C1	ZINC000875199457	GG	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)NCC2CC(O)C2)C1	ZINC000875199478	ED	On-Demand	Anodyne	CACNA1I	42	34
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)NCC2CC(O)C2)C1	ZINC000875199479	ED	On-Demand	Anodyne	CACNA1I	42	34
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)NC[C@@H]2C[C@H](O)C2)C1	ZINC000875199480	ED	On-Demand	Anodyne	CACNA1I	42	34
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)NC[C@@H]2C[C@H](O)C2)C1	ZINC000875199481	ED	On-Demand	Anodyne	CACNA1I	42	34
C[C@H]1CN(Cc2ccccc2)C[C@H]1CNC(=O)C(=O)NCc1ccn(C)n1	ZINC000875199487	FC	On-Demand	Anodyne	PDE8B	40	31
C[C@@H]1CN(Cc2ccccc2)C[C@H]1CNC(=O)C(=O)NCc1ccn(C)n1	ZINC000875199488	FC	On-Demand	Anodyne	PDE8B	40	31
C[C@H]1CN(Cc2ccccc2)C[C@@H]1CNC(=O)C(=O)NCc1ccn(C)n1	ZINC000875199489	FC	On-Demand	Anodyne	PDE8B	40	31
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1CNC(=O)C(=O)NCc1ccn(C)n1	ZINC000875199490	FC	On-Demand	Anodyne	PDE8B	40	31
CCOc1cc(CNC(=O)C(=O)NCc2ccc(C(C)(C)C)o2)ccc1OC	ZINC000875199512	GF	On-Demand	Anodyne	TRPV1	18	42
CCOc1cc(CNC(=O)C(=O)NCc2ccc(C(C)(C)C)o2)ccc1OC	ZINC000875199512	GF	On-Demand	Anodyne	MT-ND1	26	47
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1cc(C)[nH]n1)CC2	ZINC000875199515	FD	On-Demand	Anodyne	SLC18A2	45	33
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1cc(C)[nH]n1)CC2	ZINC000875199516	FD	On-Demand	Anodyne	SLC18A2	45	33
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)N[C@H]2Cc3cncn3C2)C1	ZINC000875199564	FD	On-Demand	Anodyne	CACNA1I	41	33
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N[C@H]2Cc3cncn3C2)C1	ZINC000875199565	FD	On-Demand	Anodyne	CACNA1I	41	33
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)N[C@@H]2Cc3cncn3C2)C1	ZINC000875199566	FD	On-Demand	Anodyne	CACNA1I	41	33
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N[C@@H]2Cc3cncn3C2)C1	ZINC000875199567	FD	On-Demand	Anodyne	CACNA1I	41	33
C[C@@H](NC(=O)N1Cc2cccc(O)c2C1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000875199610	GG	On-Demand	Clean	GPR119	21	42
C[C@H](NC(=O)N1Cc2cccc(O)c2C1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000875199617	GG	On-Demand	Clean	GPR119	21	42
C[C@@H](NC(=O)N1Cc2cccc(O)c2C1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000875199619	GG	On-Demand	Clean	GPR119	21	42
C[C@H](NC(=O)N1Cc2cccc(O)c2C1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000875199621	GG	On-Demand	Clean	GPR119	21	42
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1ccncc1C)CC2	ZINC000875199680	GE	On-Demand	Anodyne	SLC18A2	44	32
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1ccncc1C)CC2	ZINC000875199680	GE	On-Demand	Anodyne	HCRTR1	15	45
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1ccncc1C)CC2	ZINC000875199682	GE	On-Demand	Anodyne	SLC18A2	44	32
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1ccncc1C)CC2	ZINC000875199682	GE	On-Demand	Anodyne	HCRTR1	15	45
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)CC1	ZINC000875199684	GF	On-Demand	Anodyne	CACNA1I	55	34
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)CC1	ZINC000875199684	GF	On-Demand	Anodyne	GPR119	41	42
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)CC1	ZINC000875199686	GF	On-Demand	Anodyne	CACNA1I	55	34
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)CC1	ZINC000875199686	GF	On-Demand	Anodyne	GPR119	41	42
Cc1nnc(NNC(=O)N[C@H]2CCCCc3ccccc32)n1C	ZINC000875199696	DE	On-Demand	Reactive	BIRC2	40	39
Cc1nnc(NNC(=O)N[C@@H]2CCCCc3ccccc32)n1C	ZINC000875199698	DE	On-Demand	Reactive	BIRC2	40	39
CN(Cc1ccns1)C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875199716	FF	On-Demand	Anodyne	CACNA1I	43	33
CN(Cc1ccns1)C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875199716	FF	On-Demand	Anodyne	GPR119	45	41
C[C@H](NC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1O	ZINC000875199722	GG	On-Demand	Clean	HTR4	45	39
C[C@H](NC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1O	ZINC000875199722	GG	On-Demand	Clean	GRIN2B	25	42
C[C@H](NC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1O	ZINC000875199722	GG	On-Demand	Clean	CACNA1I	64	40
C[C@H](NC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1O	ZINC000875199722	GG	On-Demand	Clean	GPR119	49	48
C[C@@H](NC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1O	ZINC000875199723	GG	On-Demand	Clean	HTR4	45	39
C[C@@H](NC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1O	ZINC000875199723	GG	On-Demand	Clean	GRIN2B	25	42
C[C@@H](NC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1O	ZINC000875199723	GG	On-Demand	Clean	CACNA1I	64	40
C[C@@H](NC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1O	ZINC000875199723	GG	On-Demand	Clean	GPR119	49	48
CCC[C@@H](CCO)NC(=O)NC[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000875199738	FE	On-Demand	Anodyne	CACNA1I	40	32
CCC[C@@H](CCO)NC(=O)NC[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000875199739	FE	On-Demand	Anodyne	CACNA1I	40	32
CCC[C@H](CCO)NC(=O)NC[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000875199740	FE	On-Demand	Anodyne	CACNA1I	40	32
CCC[C@H](CCO)NC(=O)NC[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000875199741	FE	On-Demand	Anodyne	CACNA1I	40	32
CN1CCCC[C@H](N(C)C(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)C1=O	ZINC000875199742	GE	On-Demand	Anodyne	CACNA1I	42	33
CN1CCCC[C@@H](N(C)C(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)C1=O	ZINC000875199743	GE	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCC3(CCNC3=O)CC2)CC1	ZINC000875199753	GD	On-Demand	Anodyne	CACNA1I	41	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCC3(CCNC3=O)CC2)CC1	ZINC000875199753	GD	On-Demand	Anodyne	GPR119	33	45
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC(OCC(F)F)C2)CC1	ZINC000875199766	GE	On-Demand	Anodyne	CACNA1I	41	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC(OCC(F)F)C2)CC1	ZINC000875199766	GE	On-Demand	Anodyne	GPR119	31	40
CC(=O)C1CCN(C(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000875199789	FF	On-Demand	Anodyne	CACNA1I	47	34
CC(=O)C1CCN(C(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000875199789	FF	On-Demand	Anodyne	GPR119	35	41
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)C(=O)N[C@@H](CF)c1ccc(F)cc1	ZINC000875199846	GE	On-Demand	Anodyne	PAPA1_CARPA	28	41
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)C(=O)N[C@H](CF)c1ccc(F)cc1	ZINC000875199847	GE	On-Demand	Anodyne	PAPA1_CARPA	28	41
CC[C@@H](NC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1C)c1ccncc1	ZINC000875199851	GF	On-Demand	Anodyne	SLC18A2	47	35
CC[C@@H](NC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1C)c1ccncc1	ZINC000875199851	GF	On-Demand	Anodyne	MTNR1B	15	46
CC[C@@H](NC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1C)c1ccncc1	ZINC000875199854	GF	On-Demand	Anodyne	SLC18A2	47	35
CC[C@@H](NC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1C)c1ccncc1	ZINC000875199854	GF	On-Demand	Anodyne	MTNR1B	15	46
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N2O[C@H]3C=C[C@H]2CC3)C1	ZINC000875199866	FF	On-Demand	Anodyne	CACNA1I	40	31
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)N2O[C@H]3C=C[C@H]2CC3)C1	ZINC000875199867	FF	On-Demand	Anodyne	CACNA1I	40	31
CCN(C(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)C(C)C	ZINC000875199881	EF	On-Demand	Anodyne	PREP	23	42
CCN(C(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)C(C)C	ZINC000875199881	EF	On-Demand	Anodyne	NPR	52	33
CCN(C(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)C(C)C	ZINC000875199881	EF	On-Demand	Anodyne	Q9NAW4_PLAFA	38	43
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875199886	GF	On-Demand	Anodyne	CACNA1I	53	33
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875199887	GF	On-Demand	Anodyne	CACNA1I	53	33
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875199888	GF	On-Demand	Anodyne	CACNA1I	53	33
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875199889	GF	On-Demand	Anodyne	CACNA1I	53	33
O=C(N[C@H]1CCCCc2ccccc21)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875199912	EH	On-Demand	Anodyne	BDKRB1	46	38
O=C(N[C@H]1CCCCc2ccccc21)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875199912	EH	On-Demand	Anodyne	XIAP	22	42
O=C(N[C@H]1CCCCc2ccccc21)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875199912	EH	On-Demand	Anodyne	BIRC3	32	42
O=C(N[C@H]1CCCCc2ccccc21)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875199912	EH	On-Demand	Anodyne	BIRC2	31	42
O=C(N[C@@H]1CCCCc2ccccc21)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875199913	EH	On-Demand	Anodyne	BDKRB1	46	38
O=C(N[C@@H]1CCCCc2ccccc21)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875199913	EH	On-Demand	Anodyne	XIAP	22	42
O=C(N[C@@H]1CCCCc2ccccc21)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875199913	EH	On-Demand	Anodyne	BIRC3	32	42
O=C(N[C@@H]1CCCCc2ccccc21)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875199913	EH	On-Demand	Anodyne	BIRC2	31	42
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1ccn(C)n1)CC2	ZINC000875199954	FD	On-Demand	Anodyne	HCRTR1	15	42
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1ccn(C)n1)CC2	ZINC000875199955	FD	On-Demand	Anodyne	HCRTR1	15	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCCc3ccccc32)C1	ZINC000875199985	EG	On-Demand	Anodyne	ACE	34	46
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCCc3ccccc32)C1	ZINC000875199985	EG	On-Demand	Anodyne	XIAP	45	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCCc3ccccc32)C1	ZINC000875199985	EG	On-Demand	Anodyne	BIRC3	46	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCCc3ccccc32)C1	ZINC000875199985	EG	On-Demand	Anodyne	BIRC2	60	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCCc3ccccc32)C1	ZINC000875199987	EG	On-Demand	Anodyne	ACE	34	46
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCCc3ccccc32)C1	ZINC000875199987	EG	On-Demand	Anodyne	XIAP	45	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCCc3ccccc32)C1	ZINC000875199987	EG	On-Demand	Anodyne	BIRC3	46	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCCc3ccccc32)C1	ZINC000875199987	EG	On-Demand	Anodyne	BIRC2	60	40
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCCc2cccc(C)n2)C1	ZINC000875200030	DD	On-Demand	Anodyne	HCRTR2	21	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000875200042	GE	On-Demand	Anodyne	GPR119	29	43
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2O[C@H]3C=C[C@H]2CC3)CC1	ZINC000875200045	FF	On-Demand	Anodyne	CACNA1I	43	33
CN1CCO[C@H](CN(C)C(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000875200056	GD	On-Demand	Anodyne	CACNA1I	41	32
CN1CCO[C@H](CN(C)C(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000875200056	GD	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1CCC(CNC(=O)NC[C@H]2C[C@H](O)C2)CC1	ZINC000875200062	ED	On-Demand	Anodyne	CACNA1I	50	38
CC(C)(C)OC(=O)N1CCC(CNC(=O)NC[C@H]2C[C@H](O)C2)CC1	ZINC000875200062	ED	On-Demand	Anodyne	GPR119	39	43
CC(C)(C)OC(=O)N1CCC(CNC(=O)NC[C@@H]2C[C@H](O)C2)CC1	ZINC000875200063	ED	On-Demand	Anodyne	CACNA1I	50	38
CC(C)(C)OC(=O)N1CCC(CNC(=O)NC[C@@H]2C[C@H](O)C2)CC1	ZINC000875200063	ED	On-Demand	Anodyne	GPR119	39	43
CC(C)(C)OC(=O)N1CCC(CNC(=O)NCC2CC(O)C2)CC1	ZINC000875200064	ED	On-Demand	Anodyne	CACNA1I	50	38
CC(C)(C)OC(=O)N1CCC(CNC(=O)NCC2CC(O)C2)CC1	ZINC000875200064	ED	On-Demand	Anodyne	GPR119	39	43
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCCC(F)(F)CC2)CC1	ZINC000875200072	GG	On-Demand	Anodyne	CACNA1I	42	35
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCCC(F)(F)CC2)CC1	ZINC000875200072	GG	On-Demand	Anodyne	GPR119	33	41
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2Cc3cccc(O)c3C2)CC1	ZINC000875200102	GG	On-Demand	Clean	GRIN2B	19	40
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2Cc3cccc(O)c3C2)CC1	ZINC000875200102	GG	On-Demand	Clean	CACNA1I	60	40
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2Cc3cccc(O)c3C2)CC1	ZINC000875200102	GG	On-Demand	Clean	GPR119	46	45
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)C(=O)NCc1cccc(F)c1F	ZINC000875200142	GD	On-Demand	Anodyne	PAPA1_CARPA	28	43
CCOc1cc(CNC(=O)C(=O)NCc2ncc(Cl)s2)ccc1OC	ZINC000875200193	GE	On-Demand	Anodyne	SSTR5	48	39
CCOc1cc(CNC(=O)C(=O)NCc2ncc(Cl)s2)ccc1OC	ZINC000875200193	GE	On-Demand	Anodyne	PDE6A	43	33
CCOc1cc(CNC(=O)C(=O)NCc2ncc(Cl)s2)ccc1OC	ZINC000875200193	GE	On-Demand	Anodyne	DRTS_TRYCR	48	35
CCOc1cc(CNC(=O)C(=O)N[C@@H](C2CCC2)[C@@H]2CCOC2)ccc1OC	ZINC000875200194	GE	On-Demand	Anodyne	SSTR5	40	38
CCOc1cc(CNC(=O)C(=O)N[C@@H](C2CCC2)[C@H]2CCOC2)ccc1OC	ZINC000875200195	GE	On-Demand	Anodyne	SSTR5	40	38
CCn1nc(C)c(CN(C)C(=O)C(=O)NCc2c(C)cccc2C)c1C	ZINC000875200214	FE	On-Demand	Anodyne	P2RX7	15	44
O=C(N[C@H]1CCCCc2ccccc21)N1CCC(CO)(CO)CC1	ZINC000875200217	EE	On-Demand	Anodyne	EPHX2	22	54
O=C(N[C@H]1CCCCc2ccccc21)N1CCC(CO)(CO)CC1	ZINC000875200217	EE	On-Demand	Anodyne	XIAP	22	40
O=C(N[C@H]1CCCCc2ccccc21)N1CCC(CO)(CO)CC1	ZINC000875200217	EE	On-Demand	Anodyne	BIRC2	41	38
O=C(N[C@@H]1CCCCc2ccccc21)N1CCC(CO)(CO)CC1	ZINC000875200218	EE	On-Demand	Anodyne	EPHX2	22	54
O=C(N[C@@H]1CCCCc2ccccc21)N1CCC(CO)(CO)CC1	ZINC000875200218	EE	On-Demand	Anodyne	XIAP	22	40
O=C(N[C@@H]1CCCCc2ccccc21)N1CCC(CO)(CO)CC1	ZINC000875200218	EE	On-Demand	Anodyne	BIRC2	41	38
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCOc3ccc(C)cc3)C[C@@H]1C2	ZINC000875200235	EE	On-Demand	Anodyne	HRH2	19	40
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCOc3ccc(C)cc3)C[C@@H]1C2	ZINC000875200235	EE	On-Demand	Anodyne	EPHX2	26	42
O=CN1CCCN(C(=O)NCc2ccc(Oc3ccccc3)cc2)CC1	ZINC000875200250	FF	On-Demand	Anodyne	LTA4H	43	41
O=CN1CCCN(C(=O)NCc2ccc(Oc3ccccc3)cc2)CC1	ZINC000875200250	FF	On-Demand	Anodyne	MMP2	19	40
O=CN1CCCN(C(=O)NCc2ccc(Oc3ccccc3)cc2)CC1	ZINC000875200250	FF	On-Demand	Anodyne	FAAH	24	45
O=CN1CCCN(C(=O)NCc2ccc(Oc3ccccc3)cc2)CC1	ZINC000875200250	FF	On-Demand	Anodyne	MMP9	21	41
O=CN1CCCN(C(=O)NCc2ccc(Oc3ccccc3)cc2)CC1	ZINC000875200250	FF	On-Demand	Anodyne	NAMPT	22	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCOc1ccc(C)cc1	ZINC000875200252	EE	On-Demand	Anodyne	SLC6A4	27	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCOc1ccc(C)cc1	ZINC000875200252	EE	On-Demand	Anodyne	SLC6A3	53	42
C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875200264	EF	On-Demand	Anodyne	MC4R	45	36
C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875200264	EF	On-Demand	Anodyne	P2RX7	29	40
O=C(NCc1ccc(Oc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875200272	FF	On-Demand	Anodyne	LTA4H	42	40
O=C(NCc1ccc(Oc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875200272	FF	On-Demand	Anodyne	MMP13	26	42
O=C(NCc1ccc(Oc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875200272	FF	On-Demand	Anodyne	MMP2	27	41
O=C(NCc1ccc(Oc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875200272	FF	On-Demand	Anodyne	FAAH	28	44
O=C(NCc1ccc(Oc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875200272	FF	On-Demand	Anodyne	MMP9	31	41
O=C(NCc1ccc(Oc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875200272	FF	On-Demand	Anodyne	EPHX2	22	41
O=C(NCc1ccc(Oc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875200272	FF	On-Demand	Anodyne	NAMPT	33	45
CCO[C@@H](C(=O)Oc1c(OC)cccc1C(=O)OC)C1CCCC1	ZINC000875200291	EF	On-Demand	Anodyne	DRD2	15	40
CCO[C@@H](C(=O)Oc1c(OC)cccc1C(=O)OC)C1CCCC1	ZINC000875200291	EF	On-Demand	Anodyne	HCN1	40	31
CCO[C@@H](C(=O)Oc1c(OC)cccc1C(=O)OC)C1CCCC1	ZINC000875200291	EF	On-Demand	Anodyne	HCN4	40	31
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)CC1	ZINC000875200314	GF	On-Demand	Anodyne	CACNA1I	40	31
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCN(CCC#N)CC2)CC1	ZINC000875200317	GD	On-Demand	Mild	CACNA1I	48	37
C[C@@H]1C[C@H](O)CCN1C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875200319	FE	On-Demand	Anodyne	CACNA1I	41	31
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875200327	GF	On-Demand	Anodyne	GPR119	41	39
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCO[C@H](C(F)F)CC2)CC1	ZINC000875200331	GF	On-Demand	Anodyne	GPR119	29	41
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCO[C@@H](C(F)F)CC2)CC1	ZINC000875200332	GF	On-Demand	Anodyne	GPR119	29	41
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@H]2CCC[C@@H]2O)CC1	ZINC000875200361	ED	On-Demand	Anodyne	CACNA1I	48	36
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@H]2CCC[C@@H]2O)CC1	ZINC000875200361	ED	On-Demand	Anodyne	GPR119	42	41
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2C[C@H]3C(=O)OC[C@H]3C2)CC1	ZINC000875200372	FD	On-Demand	Anodyne	GPR119	28	41
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2OC3CCC2CC3)CC1	ZINC000875200373	FF	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2OC3CCC2CC3)CC1	ZINC000875200373	FF	On-Demand	Anodyne	GPR119	34	40
CN(CCNC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1)CC(F)F	ZINC000875200392	GE	On-Demand	Anodyne	GPR119	29	41
CCOc1cc(CNC(=O)C(=O)N[C@H](C2CCC2)[C@H]2CCOC2)ccc1OC	ZINC000875200396	GE	On-Demand	Anodyne	SSTR5	40	38
CCOc1cc(CNC(=O)C(=O)N[C@H](C2CCC2)[C@@H]2CCOC2)ccc1OC	ZINC000875200397	GE	On-Demand	Anodyne	SSTR5	40	38
CCOc1cc(CNC(=O)C(=O)N2CCC(C(C)=O)CC2)ccc1OC	ZINC000875200420	FD	On-Demand	Anodyne	SSTR5	71	42
CCOc1cc(CNC(=O)C(=O)N2CCC(C(C)=O)CC2)ccc1OC	ZINC000875200420	FD	On-Demand	Anodyne	PDE6A	41	33
CC[C@@H](NC(=O)C(=O)N1CCN(c2ccc(F)cc2C#N)CC1)c1ccncc1	ZINC000875200421	GE	On-Demand	Mild	NPY2R	48	44
CCCCCCCNC(=O)C(=O)NCc1cc(C)[nH]n1	ZINC000875200449	CD	On-Demand	Mild	ASAH1	89	36
CN(C)C[C@@H]1CN(C(=O)N[C@H]2CCCCc3ccccc32)C[C@H]1CN(C)C	ZINC000875200457	FF	On-Demand	Anodyne	XIAP	24	40
CN(C)C[C@@H]1CN(C(=O)N[C@H]2CCCCc3ccccc32)C[C@H]1CN(C)C	ZINC000875200457	FF	On-Demand	Anodyne	BIRC2	49	39
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2CCCCc3ccccc32)C[C@H]1CN(C)C	ZINC000875200459	FF	On-Demand	Anodyne	XIAP	24	40
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2CCCCc3ccccc32)C[C@H]1CN(C)C	ZINC000875200459	FF	On-Demand	Anodyne	BIRC2	49	39
CCOc1cc(CNC(=O)C(=O)NC[C@@H]2c3ccccc3CN2C)ccc1OC	ZINC000875200466	GE	On-Demand	Anodyne	SSTR5	59	41
CCOc1cc(CNC(=O)C(=O)NC[C@@H]2c3ccccc3CN2C)ccc1OC	ZINC000875200466	GE	On-Demand	Anodyne	HCN1	43	34
CCOc1cc(CNC(=O)C(=O)NC[C@H]2c3ccccc3CN2C)ccc1OC	ZINC000875200468	GE	On-Demand	Anodyne	SSTR5	59	41
CCOc1cc(CNC(=O)C(=O)NC[C@H]2c3ccccc3CN2C)ccc1OC	ZINC000875200468	GE	On-Demand	Anodyne	HCN1	43	34
COC(=O)N(C)NC(=O)N[C@H](C)Cc1ccc(Cl)cc1Cl	ZINC000875200476	EF	On-Demand	Reactive	UGCG	20	41
COC(=O)N(C)NC(=O)N[C@H](C)Cc1ccc(Cl)cc1Cl	ZINC000875200476	EF	On-Demand	Reactive	MC4R	40	36
COC(=O)N(C)NC(=O)N[C@@H](C)Cc1ccc(Cl)cc1Cl	ZINC000875200477	EF	On-Demand	Reactive	UGCG	20	41
COC(=O)N(C)NC(=O)N[C@@H](C)Cc1ccc(Cl)cc1Cl	ZINC000875200477	EF	On-Demand	Reactive	MC4R	40	36
C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)N1CCCN(C=O)CC1	ZINC000875200495	FF	On-Demand	Anodyne	UGCG	37	44
C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)N1CCCN(C=O)CC1	ZINC000875200495	FF	On-Demand	Anodyne	MC4R	89	44
C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)N1CCCN(C=O)CC1	ZINC000875200495	FF	On-Demand	Anodyne	MC3R	23	44
C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)N1CCCN(C=O)CC1	ZINC000875200495	FF	On-Demand	Anodyne	MC5R	34	44
C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)N1CCCN(C=O)CC1	ZINC000875200495	FF	On-Demand	Anodyne	EPHX2	15	43
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NCc3cc(C)[nH]n3)C2)c1	ZINC000875200516	GC	On-Demand	Anodyne	PDE8B	51	31
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NCc3cc(C)[nH]n3)C2)c1	ZINC000875200518	GC	On-Demand	Anodyne	PDE8B	51	31
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3ccn(C)n3)C2)cc1	ZINC000875200554	FC	On-Demand	Anodyne	DRD4	30	46
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3ccn(C)n3)C2)cc1	ZINC000875200554	FC	On-Demand	Anodyne	SIGMAR1	19	42
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3ccn(C)n3)C2)cc1	ZINC000875200554	FC	On-Demand	Anodyne	UTS2R	22	40
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3ccn(C)n3)C2)cc1	ZINC000875200554	FC	On-Demand	Anodyne	CCR2	17	46
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3ccn(C)n3)C2)cc1	ZINC000875200554	FC	On-Demand	Anodyne	MCHR1	34	45
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3ccn(C)n3)C2)cc1	ZINC000875200555	FC	On-Demand	Anodyne	DRD4	30	46
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3ccn(C)n3)C2)cc1	ZINC000875200555	FC	On-Demand	Anodyne	SIGMAR1	19	42
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3ccn(C)n3)C2)cc1	ZINC000875200555	FC	On-Demand	Anodyne	UTS2R	22	40
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3ccn(C)n3)C2)cc1	ZINC000875200555	FC	On-Demand	Anodyne	CCR2	17	46
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3ccn(C)n3)C2)cc1	ZINC000875200555	FC	On-Demand	Anodyne	MCHR1	34	45
CCOC(=O)C1=CC[C@H](NC(=O)NC(C)(C)c2ccccc2)C1	ZINC000875200577	DF	On-Demand	Anodyne	AMY2	54	32
CCOc1ccccc1[C@@H](CC)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875200579	DF	On-Demand	Anodyne	HCN1	47	31
CCOc1ccccc1[C@@H](CC)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875200579	DF	On-Demand	Anodyne	HCN4	40	31
CCOc1ccccc1[C@H](CC)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875200580	DF	On-Demand	Anodyne	HCN1	47	31
CCOc1ccccc1[C@H](CC)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875200580	DF	On-Demand	Anodyne	HCN4	40	31
CCOc1ccccc1[C@H](CC)NC(=O)N(CC)OCC	ZINC000875200600	CH	On-Demand	Anodyne	HCN1	46	31
CCOc1ccccc1[C@@H](CC)NC(=O)N(CC)OCC	ZINC000875200601	CH	On-Demand	Anodyne	HCN1	46	31
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2[C@H]3CC[C@H]2CC(F)(F)C3)CC1	ZINC000875200640	GH	On-Demand	Anodyne	CACNA1I	42	32
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2[C@H]3CC[C@H]2CC(F)(F)C3)CC1	ZINC000875200640	GH	On-Demand	Anodyne	GPR119	32	40
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875200643	FE	On-Demand	Anodyne	CACNA1I	57	36
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875200643	FE	On-Demand	Anodyne	GPR119	47	43
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875200644	FE	On-Demand	Anodyne	CACNA1I	57	36
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875200644	FE	On-Demand	Anodyne	GPR119	47	43
C[C@@H]1CC(F)(F)CCN1C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875200650	GG	On-Demand	Anodyne	CACNA1I	41	32
C[C@@H]1CC(F)(F)CCN1C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875200650	GG	On-Demand	Anodyne	GPR119	30	40
C[C@H]1CC(F)(F)CCN1C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875200651	GG	On-Demand	Anodyne	CACNA1I	41	32
C[C@H]1CC(F)(F)CCN1C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875200651	GG	On-Demand	Anodyne	GPR119	30	40
CN(C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1)[C@@H]1CCCC[C@H]1O	ZINC000875200654	FF	On-Demand	Anodyne	CACNA1I	43	33
CN(C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1)[C@@H]1CCCC[C@H]1O	ZINC000875200654	FF	On-Demand	Anodyne	GPR119	37	40
C[C@H](NC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1)[C@@H](O)C(F)(F)F	ZINC000875200656	GE	On-Demand	Anodyne	CACNA1I	43	35
C[C@H](NC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1)[C@@H](O)C(F)(F)F	ZINC000875200656	GE	On-Demand	Anodyne	GPR119	35	41
C[C@H](NC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1)[C@H](O)C(F)(F)F	ZINC000875200657	GE	On-Demand	Anodyne	CACNA1I	43	35
C[C@H](NC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1)[C@H](O)C(F)(F)F	ZINC000875200657	GE	On-Demand	Anodyne	GPR119	35	41
C[C@@H](NC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1)[C@H](O)C(F)(F)F	ZINC000875200658	GE	On-Demand	Anodyne	CACNA1I	43	35
C[C@@H](NC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1)[C@H](O)C(F)(F)F	ZINC000875200658	GE	On-Demand	Anodyne	GPR119	35	41
C[C@@H](NC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1)[C@@H](O)C(F)(F)F	ZINC000875200659	GE	On-Demand	Anodyne	CACNA1I	43	35
C[C@@H](NC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1)[C@@H](O)C(F)(F)F	ZINC000875200659	GE	On-Demand	Anodyne	GPR119	35	41
CC(=O)[C@H]1CCCN(C(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000875200662	FF	On-Demand	Anodyne	CACNA1I	47	33
CC(=O)[C@H]1CCCN(C(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000875200662	FF	On-Demand	Anodyne	GPR119	35	41
CC(=O)[C@@H]1CCCN(C(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000875200663	FF	On-Demand	Anodyne	CACNA1I	47	33
CC(=O)[C@@H]1CCCN(C(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000875200663	FF	On-Demand	Anodyne	GPR119	35	41
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@H]2Cc3cncn3C2)CC1	ZINC000875200704	FD	On-Demand	Anodyne	CACNA1I	48	36
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@H]2Cc3cncn3C2)CC1	ZINC000875200704	FD	On-Demand	Anodyne	GPR119	45	41
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@@H]2Cc3cncn3C2)CC1	ZINC000875200705	FD	On-Demand	Anodyne	CACNA1I	48	36
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@@H]2Cc3cncn3C2)CC1	ZINC000875200705	FD	On-Demand	Anodyne	GPR119	45	41
O=C(OCC(=O)N1CCN(Cc2cccc3ccccc23)CC1)c1ccc(Cn2cccn2)cc1	ZINC000875200720	JH	On-Demand	Anodyne	FAAH	16	42
CN1CCN(C2CCN(C(=O)C(=O)NCc3nn(C)c4ccccc34)CC2)CC1	ZINC000875200731	GC	On-Demand	Anodyne	L3MBTL3	50	38
CCCCCCCNC(=O)C(=O)NCc1cccc(N2CCOCC2)n1	ZINC000875200739	FD	On-Demand	Mild	PIK3CB	59	35
CCCCCCCNC(=O)C(=O)NCc1cccc(N2CCOCC2)n1	ZINC000875200739	FD	On-Demand	Mild	ASAH1	63	44
CN(C[C@@H]1C[C@H](O)C1)C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875200745	FE	On-Demand	Anodyne	CACNA1I	46	34
CCC[C@@H](CCO)NC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875200750	FE	On-Demand	Anodyne	CACNA1I	42	33
CCC[C@H](CCO)NC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875200751	FE	On-Demand	Anodyne	CACNA1I	42	33
CCOc1ccccc1[C@@H](CC)NC(=O)N1CC(O)(C(=O)OC)C1	ZINC000875200783	ED	On-Demand	Anodyne	HCN1	49	32
CCOc1ccccc1[C@@H](CC)NC(=O)N1CC(O)(C(=O)OC)C1	ZINC000875200783	ED	On-Demand	Anodyne	HCN4	40	32
CCOc1ccccc1[C@H](CC)NC(=O)N1CC(O)(C(=O)OC)C1	ZINC000875200784	ED	On-Demand	Anodyne	HCN1	49	32
CCOc1ccccc1[C@H](CC)NC(=O)N1CC(O)(C(=O)OC)C1	ZINC000875200784	ED	On-Demand	Anodyne	HCN4	40	32
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(Oc2ccccc2)cc1	ZINC000875200785	EH	On-Demand	Anodyne	ACACA	33	52
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(Oc2ccccc2)cc1	ZINC000875200785	EH	On-Demand	Anodyne	ACACB	33	52
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(Oc2ccccc2)cc1	ZINC000875200785	EH	On-Demand	Anodyne	F7	15	47
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(Oc2ccccc2)cc1	ZINC000875200786	EH	On-Demand	Anodyne	ACACA	33	52
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(Oc2ccccc2)cc1	ZINC000875200786	EH	On-Demand	Anodyne	ACACB	33	52
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(Oc2ccccc2)cc1	ZINC000875200786	EH	On-Demand	Anodyne	F7	15	47
Cn1nc(CNC(=O)C(=O)N2CCC[C@H](OC3CCC3)CC2)c2ccccc21	ZINC000875200800	GE	On-Demand	Anodyne	HTR4	26	40
Cn1nc(CNC(=O)C(=O)N2CCC[C@@H](OC3CCC3)CC2)c2ccccc21	ZINC000875200801	GE	On-Demand	Anodyne	HTR4	26	40
O=C(NC[C@H]1CC(=O)N(C2CC2)C1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875200803	GD	On-Demand	Anodyne	OXTR	62	37
O=C(NC[C@@H]1CC(=O)N(C2CC2)C1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875200804	GD	On-Demand	Anodyne	OXTR	62	37
O=C(NC[C@@H]1CC(=O)N(C2CC2)C1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875200805	GD	On-Demand	Anodyne	OXTR	62	37
O=C(NC[C@H]1CC(=O)N(C2CC2)C1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875200806	GD	On-Demand	Anodyne	OXTR	62	37
O=C(NCc1cccc2ncccc12)C(=O)NC[C@H]1CC(=O)N(C2CC2)C1	ZINC000875200847	FC	On-Demand	Anodyne	P2RX7	19	41
O=C(NCc1cccc2ncccc12)C(=O)NC[C@@H]1CC(=O)N(C2CC2)C1	ZINC000875200848	FC	On-Demand	Anodyne	P2RX7	19	41
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)NCCN2CC[C@H](O)C2)C1	ZINC000875200860	FC	On-Demand	Anodyne	CACNA1H	18	45
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)NCCN2CC[C@H](O)C2)C1	ZINC000875200860	FC	On-Demand	Anodyne	CACNA1I	51	36
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)NCCN2CC[C@H](O)C2)C1	ZINC000875200862	FC	On-Demand	Anodyne	CACNA1H	18	45
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)NCCN2CC[C@H](O)C2)C1	ZINC000875200862	FC	On-Demand	Anodyne	CACNA1I	51	36
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)NCCN2CC[C@@H](O)C2)C1	ZINC000875200864	FC	On-Demand	Anodyne	CACNA1H	18	45
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)NCCN2CC[C@@H](O)C2)C1	ZINC000875200864	FC	On-Demand	Anodyne	CACNA1I	51	36
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)NCCN2CC[C@@H](O)C2)C1	ZINC000875200866	FC	On-Demand	Anodyne	CACNA1H	18	45
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)NCCN2CC[C@@H](O)C2)C1	ZINC000875200866	FC	On-Demand	Anodyne	CACNA1I	51	36
C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875200889	GF	On-Demand	Anodyne	GPR119	43	38
C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875200891	GF	On-Demand	Anodyne	GPR119	43	38
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875200894	GF	On-Demand	Anodyne	GPR119	43	38
CCCCCCCNC(=O)C(=O)NCCc1cccc(C)n1	ZINC000875200895	DE	On-Demand	Mild	MTNR1A	36	40
CCCCCCCNC(=O)C(=O)NCCc1cccc(C)n1	ZINC000875200895	DE	On-Demand	Mild	ASAH1	90	36
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC(Cc3ccco3)C2)CC1	ZINC000875200900	GG	On-Demand	Anodyne	CACNA1I	56	36
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC(Cc3ccco3)C2)CC1	ZINC000875200900	GG	On-Demand	Anodyne	GPR119	41	41
CN1CC[C@H]2CN(C(=O)NCC3CCN(C(=O)OC(C)(C)C)CC3)CC[C@H]21	ZINC000875200902	GE	On-Demand	Anodyne	CACNA1I	51	37
CN1CC[C@H]2CN(C(=O)NCC3CCN(C(=O)OC(C)(C)C)CC3)CC[C@H]21	ZINC000875200902	GE	On-Demand	Anodyne	GPR119	35	42
CN1CC[C@H]2CN(C(=O)NCC3CCN(C(=O)OC(C)(C)C)CC3)CC[C@@H]21	ZINC000875200905	GE	On-Demand	Anodyne	CACNA1I	51	37
CN1CC[C@H]2CN(C(=O)NCC3CCN(C(=O)OC(C)(C)C)CC3)CC[C@@H]21	ZINC000875200905	GE	On-Demand	Anodyne	GPR119	35	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2cccc(C)n2)C1	ZINC000875200913	DC	On-Demand	Anodyne	GPBAR1	15	45
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2cccc(C)n2)C1	ZINC000875200914	DC	On-Demand	Anodyne	GPBAR1	15	45
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H]3CC[C@@H](C2)[S@@]3=O)CC1	ZINC000875200942	GE	On-Demand	Anodyne	CACNA1I	46	35
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H]3CC[C@@H](C2)[S@@]3=O)CC1	ZINC000875200942	GE	On-Demand	Anodyne	GPR119	40	42
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H]3CC[C@@H](C2)[S@]3=O)CC1	ZINC000875200943	GE	On-Demand	Anodyne	CACNA1I	46	35
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H]3CC[C@@H](C2)[S@]3=O)CC1	ZINC000875200943	GE	On-Demand	Anodyne	GPR119	40	42
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@@H]2C[C@H](CO)C2)CC1	ZINC000875200952	ED	On-Demand	Anodyne	EPHX2	18	47
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@@H]2C[C@H](CO)C2)CC1	ZINC000875200952	ED	On-Demand	Anodyne	CACNA1I	43	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCc1cccc(C)n1)CC2	ZINC000875200959	GE	On-Demand	Anodyne	MTNR1B	22	45
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCc1cccc(C)n1)CC2	ZINC000875200960	GE	On-Demand	Anodyne	MTNR1B	22	45
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccc(Oc2ccccc2)cc1	ZINC000875201003	FG	On-Demand	Anodyne	ACACA	32	51
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccc(Oc2ccccc2)cc1	ZINC000875201003	FG	On-Demand	Anodyne	ACACB	34	51
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccc(Oc2ccccc2)cc1	ZINC000875201003	FG	On-Demand	Anodyne	MMP2	16	40
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccc(Oc2ccccc2)cc1	ZINC000875201003	FG	On-Demand	Anodyne	MMP9	17	46
CCCCCCCNC(=O)C(=O)NCc1cccc(-n2cncn2)c1	ZINC000875201013	ED	On-Demand	Mild	ASAH1	54	33
CC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)c2nc3ccccc3n2C)CC1	ZINC000875201039	GH	On-Demand	Anodyne	PDE6D	60	36
CC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)c2nc3ccccc3n2C)CC1	ZINC000875201039	GH	On-Demand	Anodyne	SMO	25	42
CC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)c2nc3ccccc3n2C)CC1	ZINC000875201040	GH	On-Demand	Anodyne	PDE6D	60	36
CC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)c2nc3ccccc3n2C)CC1	ZINC000875201040	GH	On-Demand	Anodyne	SMO	25	42
COCC(C)(C)CCNC(=O)NC(C)(C)c1ccccc1	ZINC000875201043	CG	On-Demand	Anodyne	IMDH_CRYPV	42	34
CC(C)(C)OC(=O)N1CCC(CNC(=O)NCC[C@@H](O)C(F)F)CC1	ZINC000875201081	FD	On-Demand	Anodyne	CACNA1I	43	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)NCC[C@@H](O)C(F)F)CC1	ZINC000875201081	FD	On-Demand	Anodyne	GPR119	31	42
CC(C)(C)OC(=O)N1CCC(CNC(=O)NCC[C@H](O)C(F)F)CC1	ZINC000875201082	FD	On-Demand	Anodyne	CACNA1I	43	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)NCC[C@H](O)C(F)F)CC1	ZINC000875201082	FD	On-Demand	Anodyne	GPR119	31	42
CN(CC1(C)COC1)C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875201084	FE	On-Demand	Anodyne	CACNA1I	40	31
CC(=O)Nc1cccc2c1CCCN2C(=O)c1sccc1CC#N	ZINC000875201087	EG	On-Demand	Mild	AVPR2	66	38
O=C(NCc1ccc(OC(F)F)cc1F)C(=O)NC[C@@H]1CC(=O)N(C2CC2)C1	ZINC000875201089	GD	On-Demand	Anodyne	P2RX7	29	45
O=C(NCc1ccc(OC(F)F)cc1F)C(=O)NC[C@H]1CC(=O)N(C2CC2)C1	ZINC000875201092	GD	On-Demand	Anodyne	P2RX7	29	45
CCCCCCCNC(=O)C(=O)NCc1ccncc1C	ZINC000875201108	CE	On-Demand	Mild	ASAH1	86	35
CCCCCCCNC(=O)C(=O)NCc1ccn(C)n1	ZINC000875201120	CD	On-Demand	Mild	ASAH1	99	44
CN(Cc1ncc[nH]1)C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875201128	FE	On-Demand	Anodyne	CACNA1I	42	32
CN(Cc1ncc[nH]1)C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875201128	FE	On-Demand	Anodyne	GPR119	45	43
CC(C)(C)OC(=O)N1CCC(CNC(=O)NC2CN(c3ccncn3)C2)CC1	ZINC000875201138	GD	On-Demand	Anodyne	GRIN2B	21	46
CC(C)(C)OC(=O)N1CCC(CNC(=O)NC2CN(c3ccncn3)C2)CC1	ZINC000875201138	GD	On-Demand	Anodyne	GPR119	56	63
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCO[C@@H](CCF)C2)CC1	ZINC000875201145	FE	On-Demand	Anodyne	CACNA1I	46	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCO[C@@H](CCF)C2)CC1	ZINC000875201145	FE	On-Demand	Anodyne	GPR119	32	44
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCO[C@H](CCF)C2)CC1	ZINC000875201146	FE	On-Demand	Anodyne	CACNA1I	46	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCO[C@H](CCF)C2)CC1	ZINC000875201146	FE	On-Demand	Anodyne	GPR119	32	44
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@@H]3CC[C@@H](O)[C@@H]32)CC1	ZINC000875201163	FE	On-Demand	Anodyne	CACNA1I	47	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@@H]3CC[C@@H](O)[C@@H]32)CC1	ZINC000875201163	FE	On-Demand	Anodyne	GPR119	37	45
CCOc1ccccc1[C@H](CC)NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875201226	GE	On-Demand	Anodyne	HCN1	49	32
CCOc1ccccc1[C@H](CC)NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875201226	GE	On-Demand	Anodyne	HCN4	42	32
CCOc1ccccc1[C@@H](CC)NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875201227	GE	On-Demand	Anodyne	HCN1	49	32
CCOc1ccccc1[C@@H](CC)NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875201227	GE	On-Demand	Anodyne	HCN4	42	32
CCOc1ccccc1[C@H](CC)NC(=O)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875201256	GF	On-Demand	Anodyne	HCN1	48	31
CCOc1ccccc1[C@H](CC)NC(=O)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875201256	GF	On-Demand	Anodyne	HCN4	41	31
CCOc1ccccc1[C@@H](CC)NC(=O)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875201257	GF	On-Demand	Anodyne	HCN1	48	31
CCOc1ccccc1[C@@H](CC)NC(=O)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875201257	GF	On-Demand	Anodyne	HCN4	41	31
COCC(C)(C)CCNC(=O)C(=O)NCc1cccc(N2CCOCC2)n1	ZINC000875201262	GC	On-Demand	Anodyne	PIK3CB	42	36
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2C[C@H]3COC[C@H]3C2)CC1	ZINC000875201275	FD	On-Demand	Anodyne	CACNA1I	45	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2C[C@H]3COC[C@H]3C2)CC1	ZINC000875201275	FD	On-Demand	Anodyne	GPR119	37	40
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccncc3C)CC2)c(OC)c1	ZINC000875201276	GD	On-Demand	Clean	DRD2	20	40
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccncc3C)CC2)c(OC)c1	ZINC000875201276	GD	On-Demand	Clean	DRD4	42	32
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccncc3C)CC2)c(OC)c1	ZINC000875201276	GD	On-Demand	Clean	ADRA1D	19	40
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccncc3C)CC2)c(OC)c1	ZINC000875201276	GD	On-Demand	Clean	ADRA1A	17	40
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccncc3C)CC2)c(OC)c1	ZINC000875201276	GD	On-Demand	Clean	HTR7	23	40
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H]3CC[C@@H](C2)S3)CC1	ZINC000875201298	GG	On-Demand	Anodyne	CACNA1I	51	34
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H]3CC[C@@H](C2)S3)CC1	ZINC000875201298	GG	On-Demand	Anodyne	GPR119	40	42
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@@H]3CSC[C@@H]3C2)CC1	ZINC000875201307	GG	On-Demand	Anodyne	CACNA1I	47	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@@H]3CSC[C@@H]3C2)CC1	ZINC000875201307	GG	On-Demand	Anodyne	GPR119	36	43
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H]3CSC[C@@H]3C2)CC1	ZINC000875201308	GG	On-Demand	Anodyne	CACNA1I	47	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H]3CSC[C@@H]3C2)CC1	ZINC000875201308	GG	On-Demand	Anodyne	GPR119	36	43
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@@H]3CSC[C@H]3C2)CC1	ZINC000875201309	GG	On-Demand	Anodyne	CACNA1I	47	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@@H]3CSC[C@H]3C2)CC1	ZINC000875201309	GG	On-Demand	Anodyne	GPR119	36	43
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H]3CSC[C@H]3C2)CC1	ZINC000875201310	GG	On-Demand	Anodyne	CACNA1I	47	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H]3CSC[C@H]3C2)CC1	ZINC000875201310	GG	On-Demand	Anodyne	GPR119	36	43
CC(C)(C)OC(=O)N1CCC(CNC(=O)NC(C)(C)C(C)(C)O)CC1	ZINC000875201311	FE	On-Demand	Anodyne	CACNA1I	48	36
CC(C)(C)OC(=O)N1CCC(CNC(=O)NC(C)(C)C(C)(C)O)CC1	ZINC000875201311	FE	On-Demand	Anodyne	GPR119	35	40
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875201314	FE	On-Demand	Anodyne	CACNA1I	42	34
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875201314	FE	On-Demand	Anodyne	GPR119	28	42
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC=CC2)CC1	ZINC000875201323	DE	On-Demand	Anodyne	CACNA1I	57	37
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC=CC2)CC1	ZINC000875201323	DE	On-Demand	Anodyne	GPR119	46	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC(C)(C)c1ccccc1C	ZINC000875201331	EG	On-Demand	Anodyne	SLC6A3	46	39
O=C(CSCc1nc2ccccc2[nH]1)Nc1ccccc1C(=O)NC1CCCC1	ZINC000875201339	HI	On-Demand	Anodyne	CNR2	22	41
CCC1(N(C)C)CCN(C(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000875201349	GG	On-Demand	Anodyne	CACNA1I	43	33
CCC1(N(C)C)CCN(C(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000875201349	GG	On-Demand	Anodyne	GPR119	37	41
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCCN(C=O)CC2)CC1	ZINC000875201355	FD	On-Demand	Anodyne	CACNA1I	41	31
CC(=O)[C@H]1CCCN(C(=O)NC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)C1	ZINC000875201368	FF	On-Demand	Anodyne	CACNA1I	42	32
CC(=O)[C@H]1CCCN(C(=O)NC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C1	ZINC000875201369	FF	On-Demand	Anodyne	CACNA1I	42	32
CC(=O)[C@@H]1CCCN(C(=O)NC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)C1	ZINC000875201370	FF	On-Demand	Anodyne	CACNA1I	42	32
CC(=O)[C@@H]1CCCN(C(=O)NC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C1	ZINC000875201371	FF	On-Demand	Anodyne	CACNA1I	42	32
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1cnn(C)c1	ZINC000875201398	GE	On-Demand	Anodyne	DRD2	17	40
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1cnn(C)c1	ZINC000875201398	GE	On-Demand	Anodyne	DRD4	36	42
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1cnn(C)c1	ZINC000875201398	GE	On-Demand	Anodyne	ACHE	58	54
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1cnn(C)c1	ZINC000875201398	GE	On-Demand	Anodyne	SLC6A3	18	48
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1cnn(C)c1	ZINC000875201398	GE	On-Demand	Anodyne	HTR4	25	42
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1cnn(C)c1	ZINC000875201398	GE	On-Demand	Anodyne	SIGMAR1	41	41
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1cnn(C)c1	ZINC000875201398	GE	On-Demand	Anodyne	BCHE	18	46
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1cnn(C)c1	ZINC000875201398	GE	On-Demand	Anodyne	MCHR1	23	41
CCOc1cc(CNC(=O)C(=O)N2C[C@H](OC)CC[C@@H]2C)ccc1OC	ZINC000875201401	FD	On-Demand	Anodyne	SSTR5	57	41
CCOc1cc(CNC(=O)C(=O)N2C[C@@H](OC)CC[C@H]2C)ccc1OC	ZINC000875201402	FD	On-Demand	Anodyne	SSTR5	57	41
CCOc1cc(CNC(=O)C(=O)N2C[C@H](OC)CC[C@H]2C)ccc1OC	ZINC000875201403	FD	On-Demand	Anodyne	SSTR5	57	41
CCOc1cc(CNC(=O)C(=O)N2C[C@@H](OC)CC[C@@H]2C)ccc1OC	ZINC000875201404	FD	On-Demand	Anodyne	SSTR5	57	41
CCOc1cc(CNC(=O)C(=O)NCCC[C@H]2C=CCC2)ccc1OC	ZINC000875201413	FF	On-Demand	Anodyne	SSTR5	41	36
CCOc1cc(CNC(=O)C(=O)NCCC[C@@H]2C=CCC2)ccc1OC	ZINC000875201414	FF	On-Demand	Anodyne	SSTR5	41	36
CCOc1ccccc1[C@H](CC)NC(=O)N(C)CCN1CC2(CCOCC2)C1	ZINC000875201466	GG	On-Demand	Anodyne	HCN1	48	37
CCOc1ccccc1[C@H](CC)NC(=O)N(C)CCN1CC2(CCOCC2)C1	ZINC000875201466	GG	On-Demand	Anodyne	HCN4	40	32
CCOc1ccccc1[C@@H](CC)NC(=O)N(C)CCN1CC2(CCOCC2)C1	ZINC000875201468	GG	On-Demand	Anodyne	HCN1	48	37
CCOc1ccccc1[C@@H](CC)NC(=O)N(C)CCN1CC2(CCOCC2)C1	ZINC000875201468	GG	On-Demand	Anodyne	HCN4	40	32
CCOc1ccccc1[C@H](CC)NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1	ZINC000875201473	GF	On-Demand	Anodyne	HCN1	46	30
CCOc1ccccc1[C@@H](CC)NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1	ZINC000875201475	GF	On-Demand	Anodyne	HCN1	46	30
CC(=O)Nc1cccc2c1CCCN2C(=O)c1c(Cl)nn(C)c1Cl	ZINC000875201484	FG	On-Demand	Anodyne	AVPR2	54	39
CC(=O)N(C)c1ccc(CNC(=O)NC(C)(C)c2ccccc2)cc1	ZINC000875201492	EG	On-Demand	Anodyne	IMDH_CRYPV	52	35
CCOc1ccccc1[C@H](CC)NC(=O)N1CCCN(C=O)CC1	ZINC000875201531	EE	On-Demand	Anodyne	HCN1	50	33
CCOc1ccccc1[C@H](CC)NC(=O)N1CCCN(C=O)CC1	ZINC000875201531	EE	On-Demand	Anodyne	HCN4	42	33
CCOc1ccccc1[C@@H](CC)NC(=O)N1CCCN(C=O)CC1	ZINC000875201532	EE	On-Demand	Anodyne	HCN1	50	33
CCOc1ccccc1[C@@H](CC)NC(=O)N1CCCN(C=O)CC1	ZINC000875201532	EE	On-Demand	Anodyne	HCN4	42	33
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CC)c2ccccc2OCC)C1	ZINC000875201549	FG	On-Demand	Anodyne	HCN1	46	31
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CC)c2ccccc2OCC)C1	ZINC000875201550	FG	On-Demand	Anodyne	HCN1	46	31
Cn1nc(CNC(=O)C(=O)NCCCCC2CC2)c2ccccc21	ZINC000875201563	ED	On-Demand	Anodyne	HTR3A	16	44
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(Oc2ccccc2)cc1	ZINC000875201568	GG	On-Demand	Anodyne	CACNA1H	33	42
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(Oc2ccccc2)cc1	ZINC000875201568	GG	On-Demand	Anodyne	ACACA	35	52
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(Oc2ccccc2)cc1	ZINC000875201568	GG	On-Demand	Anodyne	MMP13	18	42
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(Oc2ccccc2)cc1	ZINC000875201568	GG	On-Demand	Anodyne	NPY1R	16	40
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(Oc2ccccc2)cc1	ZINC000875201568	GG	On-Demand	Anodyne	ACACB	38	52
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(Oc2ccccc2)cc1	ZINC000875201568	GG	On-Demand	Anodyne	MMP2	25	41
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(Oc2ccccc2)cc1	ZINC000875201568	GG	On-Demand	Anodyne	S1PR2	27	42
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(Oc2ccccc2)cc1	ZINC000875201568	GG	On-Demand	Anodyne	MMP9	28	42
CCOc1ccccc1[C@@H](CC)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875201571	EH	On-Demand	Anodyne	AMY2	44	30
CCOc1ccccc1[C@@H](CC)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875201571	EH	On-Demand	Anodyne	HCN1	50	33
CCOc1ccccc1[C@@H](CC)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875201571	EH	On-Demand	Anodyne	HCN4	43	33
CCOc1ccccc1[C@@H](CC)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875201572	EH	On-Demand	Anodyne	AMY2	44	30
CCOc1ccccc1[C@@H](CC)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875201572	EH	On-Demand	Anodyne	HCN1	50	33
CCOc1ccccc1[C@@H](CC)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875201572	EH	On-Demand	Anodyne	HCN4	43	33
CCOc1ccccc1[C@H](CC)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875201573	EH	On-Demand	Anodyne	AMY2	44	30
CCOc1ccccc1[C@H](CC)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875201573	EH	On-Demand	Anodyne	HCN1	50	33
CCOc1ccccc1[C@H](CC)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875201573	EH	On-Demand	Anodyne	HCN4	43	33
CCOc1ccccc1[C@H](CC)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875201574	EH	On-Demand	Anodyne	AMY2	44	30
CCOc1ccccc1[C@H](CC)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875201574	EH	On-Demand	Anodyne	HCN1	50	33
CCOc1ccccc1[C@H](CC)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875201574	EH	On-Demand	Anodyne	HCN4	43	33
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875201591	GG	On-Demand	Clean	PREP	15	40
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875201591	GG	On-Demand	Clean	CACNA1I	53	36
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875201591	GG	On-Demand	Clean	GPR119	28	40
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875201593	GG	On-Demand	Clean	PREP	15	40
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875201593	GG	On-Demand	Clean	CACNA1I	53	36
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875201593	GG	On-Demand	Clean	GPR119	28	40
CS[C@@H]1C[C@@H](NC(=O)NC(C)(C)c2ccccc2)C1	ZINC000875201610	CG	On-Demand	Anodyne	IMDH_CRYPV	50	35
CCOc1ccccc1[C@@H](CC)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875201658	EG	On-Demand	Anodyne	HCN1	49	32
CCOc1ccccc1[C@@H](CC)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875201658	EG	On-Demand	Anodyne	HCN4	42	32
CCOc1ccccc1[C@@H](CC)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875201659	EG	On-Demand	Anodyne	HCN1	49	32
CCOc1ccccc1[C@@H](CC)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875201659	EG	On-Demand	Anodyne	HCN4	42	32
CCOc1ccccc1[C@H](CC)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875201661	EG	On-Demand	Anodyne	HCN1	49	32
CCOc1ccccc1[C@H](CC)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875201661	EG	On-Demand	Anodyne	HCN4	42	32
CCOc1ccccc1[C@H](CC)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875201663	EG	On-Demand	Anodyne	HCN1	49	32
CCOc1ccccc1[C@H](CC)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875201663	EG	On-Demand	Anodyne	HCN4	42	32
CC[C@@H](NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)c1ccncc1	ZINC000875201696	FF	On-Demand	Anodyne	OXTR	48	39
CC[C@@H](NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)c1ccncc1	ZINC000875201696	FF	On-Demand	Anodyne	GHRHR	59	41
CC[C@@H](NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)c1ccncc1	ZINC000875201699	FF	On-Demand	Anodyne	OXTR	48	39
CC[C@@H](NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)c1ccncc1	ZINC000875201699	FF	On-Demand	Anodyne	GHRHR	59	41
CC[C@@H](NC(=O)C(=O)N[C@H](CC)c1cccc(OC)c1OC)c1ccncc1	ZINC000875201707	GF	On-Demand	Anodyne	TACR3	44	42
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](c1ccccc1)c1nc2ccccc2n1C	ZINC000875201733	GH	On-Demand	Anodyne	TACR3	40	35
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](c1ccccc1)c1nc2ccccc2n1C	ZINC000875201736	GH	On-Demand	Anodyne	TACR3	40	35
CCCCCCCNC(=O)C(=O)N[C@H](C)c1cnn(C)c1	ZINC000875201750	CD	On-Demand	Mild	ASAH1	98	38
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1cnn(C)c1	ZINC000875201751	CD	On-Demand	Mild	ASAH1	98	38
CCOc1ccccc1[C@@H](CC)NC(=O)N(CCOC)C1CCOCC1	ZINC000875201767	FG	On-Demand	Anodyne	HCN1	40	31
CCOc1ccccc1[C@@H](CC)NC(=O)N(CCOC)C1CCOCC1	ZINC000875201767	FG	On-Demand	Anodyne	HCN4	40	31
CCOc1ccccc1[C@H](CC)NC(=O)N(CCOC)C1CCOCC1	ZINC000875201768	FG	On-Demand	Anodyne	HCN1	40	31
CCOc1ccccc1[C@H](CC)NC(=O)N(CCOC)C1CCOCC1	ZINC000875201768	FG	On-Demand	Anodyne	HCN4	40	31
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NC[C@]1(C)CCCO1)CC2	ZINC000875201778	GD	On-Demand	Anodyne	SLC18A2	41	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NC[C@@]1(C)CCCO1)CC2	ZINC000875201779	GD	On-Demand	Anodyne	SLC18A2	41	37
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NC[C@]1(C)CCCO1)CC2	ZINC000875201780	GD	On-Demand	Anodyne	SLC18A2	41	37
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NC[C@@]1(C)CCCO1)CC2	ZINC000875201781	GD	On-Demand	Anodyne	SLC18A2	41	37
CCCCCCCNC(=O)C(=O)NC[C@H]1CC(=O)N(C2CC2)C1	ZINC000875201782	DD	On-Demand	Mild	ASAH1	82	38
CCCCCCCNC(=O)C(=O)NC[C@@H]1CC(=O)N(C2CC2)C1	ZINC000875201783	DD	On-Demand	Mild	ASAH1	82	38
CC(=O)[C@H]1CCCN(C(=O)N[C@H](c2ccccc2)c2nc3ccccc3n2C)C1	ZINC000875201799	GH	On-Demand	Anodyne	CCR5	23	42
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](c2ccccc2)c2nc3ccccc3n2C)C1	ZINC000875201801	GH	On-Demand	Anodyne	CCR5	23	42
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](c2ccccc2)c2nc3ccccc3n2C)C1	ZINC000875201803	GH	On-Demand	Anodyne	CCR5	23	42
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](c2ccccc2)c2nc3ccccc3n2C)C1	ZINC000875201805	GH	On-Demand	Anodyne	CCR5	23	42
CCCCCCCNC(=O)C(=O)NCc1nn(C)c2ccccc12	ZINC000875201807	EE	On-Demand	Mild	CNR1	22	40
CCCCCCCNC(=O)C(=O)NCc1nn(C)c2ccccc12	ZINC000875201807	EE	On-Demand	Mild	CNR2	29	41
CCCCCCCNC(=O)C(=O)NCc1nn(C)c2ccccc12	ZINC000875201807	EE	On-Demand	Mild	ASAH1	91	38
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(N3CCOCC3)n2)CC1	ZINC000875201810	FC	On-Demand	Anodyne	PIK3CB	48	32
C#CC[C@@H](CCOC)NC(=O)NC(C)(C)c1ccccc1	ZINC000875201830	CF	On-Demand	Mild	AMY2	53	31
C#CC[C@H](CCOC)NC(=O)NC(C)(C)c1ccccc1	ZINC000875201832	CF	On-Demand	Mild	AMY2	53	31
CC[C@@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccncc1	ZINC000875201838	FC	On-Demand	Anodyne	L3MBTL3	51	40
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)N[C@H]2CCC[C@@H]2O)C1	ZINC000875201844	ED	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N[C@H]2CCC[C@@H]2O)C1	ZINC000875201846	ED	On-Demand	Anodyne	CACNA1I	42	33
CCOc1cc(CNC(=O)C(=O)N2CCN(C)c3ncccc3C2)ccc1OC	ZINC000875201878	GD	On-Demand	Anodyne	PDGFRB	18	40
CCOc1cc(CNC(=O)C(=O)N2CCN(C)c3ncccc3C2)ccc1OC	ZINC000875201878	GD	On-Demand	Anodyne	SSTR5	56	40
COCC1CC(NC(=O)NC(C)(C)c2ccccc2)C1	ZINC000875201954	CF	On-Demand	Anodyne	AMY2	51	29
COCC1CC(NC(=O)NC(C)(C)c2ccccc2)C1	ZINC000875201954	CF	On-Demand	Anodyne	IMDH_CRYPV	45	35
CCOc1ccccc1[C@H](CC)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875201958	FE	On-Demand	Anodyne	GHRHR	45	31
CCOc1ccccc1[C@H](CC)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875201958	FE	On-Demand	Anodyne	HCN1	58	36
CCOc1ccccc1[C@H](CC)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875201958	FE	On-Demand	Anodyne	HCN4	45	36
CCOc1ccccc1[C@@H](CC)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875201959	FE	On-Demand	Anodyne	GHRHR	45	31
CCOc1ccccc1[C@@H](CC)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875201959	FE	On-Demand	Anodyne	HCN1	58	36
CCOc1ccccc1[C@@H](CC)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875201959	FE	On-Demand	Anodyne	HCN4	45	36
CCOC1CC2(C1)C[C@@H]2NC(=O)NC(C)(C)c1ccccc1	ZINC000875201977	DG	On-Demand	Anodyne	TIMP3	64	32
CCOC1CC2(C1)C[C@H]2NC(=O)NC(C)(C)c1ccccc1	ZINC000875201978	DG	On-Demand	Anodyne	TIMP3	64	32
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccc(OC)c(OC(F)F)c1	ZINC000875201992	GF	On-Demand	Anodyne	SLC6A4	20	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccc(OC)c(OC(F)F)c1	ZINC000875201992	GF	On-Demand	Anodyne	SLC6A3	46	40
O=C(NCCCCC1CC1)C(=O)NCc1cccc(N2CCOCC2)n1	ZINC000875202021	FD	On-Demand	Anodyne	PIK3CB	41	33
O=C(NCc1cccc(N2CCOCC2)n1)C(=O)NCc1ncc(Cl)s1	ZINC000875202031	GC	On-Demand	Anodyne	PIK3CB	49	38
O=C(NCc1cccc(N2CCOCC2)n1)C(=O)NCc1ncc(Cl)s1	ZINC000875202031	GC	On-Demand	Anodyne	STAT6	52	35
CCOc1cc(CNC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)ccc1OC	ZINC000875202084	FE	On-Demand	Anodyne	SSTR5	48	38
CCOc1cc(CNC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)ccc1OC	ZINC000875202084	FE	On-Demand	Anodyne	PDE6A	40	30
CCOc1cc(CNC(=O)C(=O)NC2CCC(C)(N(C)C)CC2)ccc1OC	ZINC000875202085	GE	On-Demand	Anodyne	SSTR5	65	38
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N2CC[C@H](O)[C@@H]3CCCC[C@@H]32)C1	ZINC000875202098	GF	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N2CC[C@H](O)[C@H]3CCCC[C@@H]32)C1	ZINC000875202099	GF	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N2CC[C@H](O)[C@@H]3CCCC[C@H]32)C1	ZINC000875202100	GF	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N2CC[C@H](O)[C@H]3CCCC[C@H]32)C1	ZINC000875202101	GF	On-Demand	Anodyne	CACNA1I	41	32
CCOc1cc(CNC(=O)C(=O)N2CC[C@@H]3CSC[C@@H]3C2)ccc1OC	ZINC000875202123	GD	On-Demand	Anodyne	SSTR5	56	40
CCOc1cc(CNC(=O)C(=O)N2CC[C@H]3CSC[C@@H]3C2)ccc1OC	ZINC000875202124	GD	On-Demand	Anodyne	SSTR5	56	40
CCOc1cc(CNC(=O)C(=O)N2CC[C@@H]3CSC[C@H]3C2)ccc1OC	ZINC000875202125	GD	On-Demand	Anodyne	SSTR5	56	40
CCOc1cc(CNC(=O)C(=O)N2CC[C@H]3CSC[C@H]3C2)ccc1OC	ZINC000875202126	GD	On-Demand	Anodyne	SSTR5	56	40
CCOc1cc(CNC(=O)C(=O)NCC2(OC(C)C)CCC2)ccc1OC	ZINC000875202134	GE	On-Demand	Anodyne	HCN1	50	32
CCOc1cc(CNC(=O)C(=O)NCC2(OC(C)C)CCC2)ccc1OC	ZINC000875202134	GE	On-Demand	Anodyne	HCN4	47	32
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)NC2CN(c3ccncn3)C2)C1	ZINC000875202141	GD	On-Demand	Anodyne	GPR119	36	54
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)NC2CN(c3ccncn3)C2)C1	ZINC000875202142	GD	On-Demand	Anodyne	GPR119	36	54
CC[C@@H](NC(=O)C(=O)NCc1cn(C(F)F)c2ccccc12)c1ccncc1	ZINC000875202157	GG	On-Demand	Anodyne	TACR3	40	34
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000875202158	FF	On-Demand	Anodyne	RIR1_HHV11	42	34
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000875202159	FF	On-Demand	Anodyne	RIR1_HHV11	42	34
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000875202160	FF	On-Demand	Anodyne	RIR1_HHV11	42	34
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000875202161	FF	On-Demand	Anodyne	RIR1_HHV11	42	34
COCC(C)(C)CCNC(=O)C(=O)NCc1cccc(-n2cncn2)c1	ZINC000875202194	FD	On-Demand	Anodyne	CARM1	43	32
Cc1ccc2nc(C(=O)Nc3cc(C#N)cn3C(C)(C)C)cn2c1	ZINC000875202205	DG	On-Demand	Mild	MAP3K5	42	42
CCCCCCCNC(=O)C(=O)NCc1cc(CC)no1	ZINC000875202216	CD	On-Demand	Mild	ASAH1	94	37
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1cccc(N2CCOCC2)n1	ZINC000875202227	FC	On-Demand	Mild	PIK3CB	48	34
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1cccc(N2CCOCC2)n1	ZINC000875202228	FC	On-Demand	Mild	PIK3CB	48	34
CCOc1cc(CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)ccc1OC	ZINC000875202254	FD	On-Demand	Anodyne	FKBP1A	36	40
CCOc1cc(CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)ccc1OC	ZINC000875202254	FD	On-Demand	Anodyne	SSTR5	60	41
CCOc1cc(CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)ccc1OC	ZINC000875202255	FD	On-Demand	Anodyne	FKBP1A	36	40
CCOc1cc(CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)ccc1OC	ZINC000875202255	FD	On-Demand	Anodyne	SSTR5	60	41
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000875202270	FE	On-Demand	Anodyne	RIR1_HHV11	40	33
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000875202271	FE	On-Demand	Anodyne	RIR1_HHV11	40	33
CCOc1cc(CNC(=O)C(=O)N2CC[C@H]3[C@H](CCN3C)C2)ccc1OC	ZINC000875202281	GD	On-Demand	Anodyne	SSTR5	58	39
CCOc1cc(CNC(=O)C(=O)N2CC[C@H]3[C@@H](CCN3C)C2)ccc1OC	ZINC000875202282	GD	On-Demand	Anodyne	SSTR5	58	39
CCOc1cc(CNC(=O)C(=O)N2CC[C@@H]3[C@H](CCN3C)C2)ccc1OC	ZINC000875202283	GD	On-Demand	Anodyne	SSTR5	58	39
CCOc1cc(CNC(=O)C(=O)N2CC[C@@H]3[C@@H](CCN3C)C2)ccc1OC	ZINC000875202284	GD	On-Demand	Anodyne	SSTR5	58	39
CCOc1cc(CNC(=O)C(=O)N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)ccc1OC	ZINC000875202332	GD	On-Demand	Anodyne	SSTR5	58	37
CCOc1cc(CNC(=O)C(=O)N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)ccc1OC	ZINC000875202332	GD	On-Demand	Anodyne	HCN4	40	31
COc1ccc(N2CCN(C(=O)C(=O)NCc3cc(C)[nH]n3)CC2)c(OC)c1	ZINC000875202337	GC	On-Demand	Clean	HTR1A	50	39
COc1ccc(N2CCN(C(=O)C(=O)NCc3cc(C)[nH]n3)CC2)c(OC)c1	ZINC000875202337	GC	On-Demand	Clean	DRD2	42	41
COc1ccc(N2CCN(C(=O)C(=O)NCc3cc(C)[nH]n3)CC2)c(OC)c1	ZINC000875202337	GC	On-Demand	Clean	DRD4	43	34
COc1ccc(N2CCN(C(=O)C(=O)NCc3cc(C)[nH]n3)CC2)c(OC)c1	ZINC000875202337	GC	On-Demand	Clean	DRD3	61	38
C[C@@H](NC(=O)NC[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccccc1O	ZINC000875202338	GG	On-Demand	Clean	SSTR2	54	35
C[C@@H](NC(=O)NC[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccccc1O	ZINC000875202338	GG	On-Demand	Clean	REN	40	35
C[C@@H](NC(=O)NC[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccccc1O	ZINC000875202338	GG	On-Demand	Clean	CACNA1I	62	35
C[C@@H](NC(=O)NC[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccccc1O	ZINC000875202338	GG	On-Demand	Clean	GPR119	28	42
C[C@@H](NC(=O)NC[C@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccccc1O	ZINC000875202340	GG	On-Demand	Clean	SSTR2	54	35
C[C@@H](NC(=O)NC[C@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccccc1O	ZINC000875202340	GG	On-Demand	Clean	REN	40	35
C[C@@H](NC(=O)NC[C@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccccc1O	ZINC000875202340	GG	On-Demand	Clean	CACNA1I	62	35
C[C@@H](NC(=O)NC[C@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccccc1O	ZINC000875202340	GG	On-Demand	Clean	GPR119	28	42
C[C@H](NC(=O)NC[C@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccccc1O	ZINC000875202341	GG	On-Demand	Clean	SSTR2	54	35
C[C@H](NC(=O)NC[C@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccccc1O	ZINC000875202341	GG	On-Demand	Clean	REN	40	35
C[C@H](NC(=O)NC[C@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccccc1O	ZINC000875202341	GG	On-Demand	Clean	CACNA1I	62	35
C[C@H](NC(=O)NC[C@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccccc1O	ZINC000875202341	GG	On-Demand	Clean	GPR119	28	42
CCOc1cc(CNC(=O)C(=O)NCC[C@@H]2CCSC2)ccc1OC	ZINC000875202344	FD	On-Demand	Anodyne	SSTR5	41	36
CCOc1cc(CNC(=O)C(=O)NCC[C@H]2CCSC2)ccc1OC	ZINC000875202345	FD	On-Demand	Anodyne	SSTR5	41	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@H](C)c1cnn(C)c1)CC2	ZINC000875202348	GD	On-Demand	Anodyne	SLC18A2	47	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H](C)c1cnn(C)c1)CC2	ZINC000875202349	GD	On-Demand	Anodyne	SLC18A2	47	37
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@@H](C)c1cnn(C)c1)CC2	ZINC000875202350	GD	On-Demand	Anodyne	SLC18A2	47	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H](C)c1cnn(C)c1)CC2	ZINC000875202351	GD	On-Demand	Anodyne	SLC18A2	47	37
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)N[C@@H]2CCCC[C@@H]2O)C1	ZINC000875202360	FE	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875202372	FE	On-Demand	Anodyne	CACNA1I	45	33
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875202373	FE	On-Demand	Anodyne	CACNA1I	45	33
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875202374	FE	On-Demand	Anodyne	CACNA1I	45	33
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875202375	FE	On-Demand	Anodyne	CACNA1I	45	33
CCOc1cc(CNC(=O)C(=O)N2CCN(C)C(C)(C)CC2)ccc1OC	ZINC000875202380	GD	On-Demand	Anodyne	SSTR5	41	37
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)NC(C)(C)C(C)(C)O)C1	ZINC000875202384	FE	On-Demand	Anodyne	CACNA1I	41	33
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)NC(C)(C)C(C)(C)O)C1	ZINC000875202385	FE	On-Demand	Anodyne	CACNA1I	41	33
CCOc1cc(CNC(=O)C(=O)N2CCC[C@@H]2c2cncc(C)c2)ccc1OC	ZINC000875202476	GF	On-Demand	Anodyne	FKBP1A	40	36
CCOc1cc(CNC(=O)C(=O)N2CCC[C@@H]2c2cncc(C)c2)ccc1OC	ZINC000875202476	GF	On-Demand	Anodyne	SSTR5	69	49
CCOc1cc(CNC(=O)C(=O)N2CCC[C@H]2c2cncc(C)c2)ccc1OC	ZINC000875202477	GF	On-Demand	Anodyne	FKBP1A	40	36
CCOc1cc(CNC(=O)C(=O)N2CCC[C@H]2c2cncc(C)c2)ccc1OC	ZINC000875202477	GF	On-Demand	Anodyne	SSTR5	69	49
CC(=O)N1CCN(c2ccccc2CNC(=O)N[C@@H](C)c2ccns2)CC1	ZINC000875202587	GE	On-Demand	Anodyne	MC4R	50	39
CC(=O)N1CCN(c2ccccc2CNC(=O)N[C@H](C)c2ccns2)CC1	ZINC000875202588	GE	On-Demand	Anodyne	MC4R	50	39
COCC1CC(NC(=O)NCc2ccccc2N2CCN(C(C)=O)CC2)C1	ZINC000875202589	FD	On-Demand	Anodyne	HTR1A	25	41
COCC1CC(NC(=O)NCc2ccccc2N2CCN(C(C)=O)CC2)C1	ZINC000875202589	FD	On-Demand	Anodyne	HTR7	23	41
C#CC[C@H](COC)NC(=O)NCc1ccccc1N1CCN(C(C)=O)CC1	ZINC000875202592	FD	On-Demand	Mild	HTR7	18	40
C#CC[C@H](COC)NC(=O)NCc1ccccc1N1CCN(C(C)=O)CC1	ZINC000875202592	FD	On-Demand	Mild	MC4R	33	42
C#CC[C@@H](COC)NC(=O)NCc1ccccc1N1CCN(C(C)=O)CC1	ZINC000875202593	FD	On-Demand	Mild	HTR7	18	40
C#CC[C@@H](COC)NC(=O)NCc1ccccc1N1CCN(C(C)=O)CC1	ZINC000875202593	FD	On-Demand	Mild	MC4R	33	42
CNC(=O)[C@@H](C)NC(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875202594	ED	On-Demand	Anodyne	KCNK3	49	34
CC[C@@H](NC(=O)C(=O)NC[C@@]1(C)CCCO1)c1cccc(OC)c1OC	ZINC000875202614	FD	On-Demand	Anodyne	HCN1	49	31
CC[C@@H](NC(=O)C(=O)NC[C@@]1(C)CCCO1)c1cccc(OC)c1OC	ZINC000875202614	FD	On-Demand	Anodyne	HCN4	47	31
CC[C@@H](NC(=O)C(=O)NC[C@]1(C)CCCO1)c1cccc(OC)c1OC	ZINC000875202616	FD	On-Demand	Anodyne	HCN1	49	31
CC[C@@H](NC(=O)C(=O)NC[C@]1(C)CCCO1)c1cccc(OC)c1OC	ZINC000875202616	FD	On-Demand	Anodyne	HCN4	47	31
CC(=O)N1CCN(c2ccccc2CNC(=O)NCc2ccnc(F)c2)CC1	ZINC000875202618	GD	On-Demand	Anodyne	MC4R	34	40
CC(=O)N1CCN(c2ccccc2CNC(=O)NNc2cccc(C)n2)CC1	ZINC000875202673	GD	On-Demand	Reactive	HTR1D	46	32
CC(=O)N1CCN(c2ccccc2CNC(=O)NNc2cccc(C)n2)CC1	ZINC000875202673	GD	On-Demand	Reactive	HTR2A	19	41
CC(=O)N1CCN(c2ccccc2CNC(=O)NNc2cccc(C)n2)CC1	ZINC000875202673	GD	On-Demand	Reactive	HTR7	21	41
CC[C@H](NC(=O)c1c(C(F)(F)F)coc1C)c1ccc2c(c1)OCCO2	ZINC000875202683	FI	On-Demand	Anodyne	TACR3	42	35
CC(=O)N1CCN(c2ccccc2CNC(=O)N2Cc3cccc(O)c3C2)CC1	ZINC000875202735	GE	On-Demand	Clean	HTR1A	16	41
CC(=O)N1CCN(c2ccccc2CNC(=O)N2Cc3cccc(O)c3C2)CC1	ZINC000875202735	GE	On-Demand	Clean	HTR7	18	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1N1CCN(C(C)=O)CC1	ZINC000875202758	GD	On-Demand	Anodyne	MC4R	53	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1N1CCN(C(C)=O)CC1	ZINC000875202758	GD	On-Demand	Anodyne	KCNQ2	61	37
C[C@H](NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1)C1CCCC1	ZINC000875202781	FF	On-Demand	Anodyne	ETHR	61	51
CC(=O)N1CCN(c2ccccc2CNC(=O)NCC(C)(C)C(C)(F)F)CC1	ZINC000875202814	GF	On-Demand	Anodyne	KCNQ2	44	33
CS[C@@H]1C[C@@H](NC(=O)NCc2ccccc2N2CCN(C(C)=O)CC2)C1	ZINC000875202860	GE	On-Demand	Anodyne	MC4R	29	42
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000875202872	GE	On-Demand	Anodyne	NAMPT	46	50
CCOCCCNC(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875202880	EG	On-Demand	Anodyne	DRD4	40	31
CC(=O)N1CCN(c2ccccc2CNC(=O)N[C@@H](C)c2ccccc2O)CC1	ZINC000875202919	GF	On-Demand	Clean	HTR7	22	41
CC(=O)N1CCN(c2ccccc2CNC(=O)N[C@@H](C)c2ccccc2O)CC1	ZINC000875202919	GF	On-Demand	Clean	MC4R	71	40
CC(=O)N1CCN(c2ccccc2CNC(=O)N[C@@H](C)c2ccccc2O)CC1	ZINC000875202919	GF	On-Demand	Clean	KCNQ2	47	34
CC(=O)N1CCN(c2ccccc2CNC(=O)N[C@H](C)c2ccccc2O)CC1	ZINC000875202920	GF	On-Demand	Clean	HTR7	22	41
CC(=O)N1CCN(c2ccccc2CNC(=O)N[C@H](C)c2ccccc2O)CC1	ZINC000875202920	GF	On-Demand	Clean	MC4R	71	40
CC(=O)N1CCN(c2ccccc2CNC(=O)N[C@H](C)c2ccccc2O)CC1	ZINC000875202920	GF	On-Demand	Clean	KCNQ2	47	34
CC(=O)[C@H]1CCCN(C(=O)NCc2ccccc2N2CCN(C(C)=O)CC2)C1	ZINC000875202932	GD	On-Demand	Anodyne	HTR1A	21	40
CC(=O)[C@H]1CCCN(C(=O)NCc2ccccc2N2CCN(C(C)=O)CC2)C1	ZINC000875202932	GD	On-Demand	Anodyne	SLC6A1	50	33
CC(=O)[C@H]1CCCN(C(=O)NCc2ccccc2N2CCN(C(C)=O)CC2)C1	ZINC000875202932	GD	On-Demand	Anodyne	MC4R	31	46
CC(=O)[C@H]1CCCN(C(=O)NCc2ccccc2N2CCN(C(C)=O)CC2)C1	ZINC000875202932	GD	On-Demand	Anodyne	KCNQ2	66	37
CC(=O)[C@H]1CCCN(C(=O)NCc2ccccc2N2CCN(C(C)=O)CC2)C1	ZINC000875202932	GD	On-Demand	Anodyne	SCN2A	17	40
CC(=O)[C@H]1CCCN(C(=O)NCc2ccccc2N2CCN(C(C)=O)CC2)C1	ZINC000875202932	GD	On-Demand	Anodyne	EPHX2	18	42
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccccc2N2CCN(C(C)=O)CC2)C1	ZINC000875202933	GD	On-Demand	Anodyne	HTR1A	21	40
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccccc2N2CCN(C(C)=O)CC2)C1	ZINC000875202933	GD	On-Demand	Anodyne	SLC6A1	50	33
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccccc2N2CCN(C(C)=O)CC2)C1	ZINC000875202933	GD	On-Demand	Anodyne	MC4R	31	46
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccccc2N2CCN(C(C)=O)CC2)C1	ZINC000875202933	GD	On-Demand	Anodyne	KCNQ2	66	37
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccccc2N2CCN(C(C)=O)CC2)C1	ZINC000875202933	GD	On-Demand	Anodyne	SCN2A	17	40
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccccc2N2CCN(C(C)=O)CC2)C1	ZINC000875202933	GD	On-Demand	Anodyne	EPHX2	18	42
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccccc1Oc1ccccc1	ZINC000875202952	GG	On-Demand	Anodyne	S1PR2	26	41
CCOC(=O)N1CCC(NC(=O)c2cc3ncc(Br)cn3n2)CC1	ZINC000875202965	GD	On-Demand	Anodyne	P2RY12	43	37
CCOC(=O)N1CCC(NC(=O)c2cc3ncc(Br)cn3n2)CC1	ZINC000875202965	GD	On-Demand	Anodyne	SSTR5	42	40
CCOC(=O)N1CCC(NC(=O)c2cc3ncc(Br)cn3n2)CC1	ZINC000875202965	GD	On-Demand	Anodyne	CCR8	17	41
C#C[C@@H]1CC[C@@H](NC(=O)NCc2ccccc2N2CCN(C(C)=O)CC2)CC1	ZINC000875203014	GE	On-Demand	Mild	MC4R	27	40
C#C[C@@H]1CC[C@@H](NC(=O)NCc2ccccc2N2CCN(C(C)=O)CC2)CC1	ZINC000875203014	GE	On-Demand	Mild	EPHX2	30	42
CC(=O)N1CCN(c2ccccc2CNC(=O)N[C@@H](C)c2ccnn2C)CC1	ZINC000875203025	GD	On-Demand	Anodyne	MC4R	55	39
CC(=O)N1CCN(c2ccccc2CNC(=O)N[C@H](C)c2ccnn2C)CC1	ZINC000875203026	GD	On-Demand	Anodyne	MC4R	55	39
CC(=O)N1CCN(c2ccccc2CNC(=O)N[C@@H]2CCCC[C@@H]2F)CC1	ZINC000875203058	GE	On-Demand	Anodyne	KCNQ2	42	34
CC(=O)N1CCN(c2ccccc2CNC(=O)N[C@@H]2CCCC[C@@H]2F)CC1	ZINC000875203058	GE	On-Demand	Anodyne	EPHX2	17	40
CC(=O)C1CCN(C(=O)NCc2ccccc2N2CCN(C(C)=O)CC2)CC1	ZINC000875203099	GD	On-Demand	Anodyne	MC4R	36	44
CC(=O)C1CCN(C(=O)NCc2ccccc2N2CCN(C(C)=O)CC2)CC1	ZINC000875203099	GD	On-Demand	Anodyne	KCNQ2	64	37
CC(=O)C1CCN(C(=O)NCc2ccccc2N2CCN(C(C)=O)CC2)CC1	ZINC000875203099	GD	On-Demand	Anodyne	SCN2A	17	40
CC(=O)C1CCN(C(=O)NCc2ccccc2N2CCN(C(C)=O)CC2)CC1	ZINC000875203099	GD	On-Demand	Anodyne	EPHX2	33	46
CC(=O)N1CCN(c2ccccc2CNC(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875203107	GD	On-Demand	Anodyne	MC4R	30	40
CC(=O)N1CCN(c2ccccc2CNC(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875203107	GD	On-Demand	Anodyne	EPHX2	21	42
CC(=O)N1CCN(c2ccccc2CNC(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875203108	GD	On-Demand	Anodyne	MC4R	30	40
CC(=O)N1CCN(c2ccccc2CNC(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875203108	GD	On-Demand	Anodyne	EPHX2	21	42
CCOCCNC(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875203155	DF	On-Demand	Anodyne	DRD4	41	31
CC[C@H](NC(=O)c1c(Cl)nn(C)c1Cl)c1ccc2c(c1)OCCO2	ZINC000875203184	FG	On-Demand	Anodyne	TACR3	44	37
CC(=O)N1CCN(c2ccccc2CNC(=O)NCc2cc(C)ccc2O)CC1	ZINC000875203197	GE	On-Demand	Clean	HTR7	23	40
CC(=O)N1CCN(c2ccccc2CNC(=O)N2CCCN(C=O)CC2)CC1	ZINC000875203200	GC	On-Demand	Anodyne	KCNQ2	58	36
CC(=O)N1CCN(c2ccccc2CNC(=O)N[C@H](C)[C@]23CCCC[C@H]2C3)CC1	ZINC000875203212	GG	On-Demand	Anodyne	MC4R	68	40
CC(=O)N1CCN(c2ccccc2CNC(=O)N[C@H](C)[C@]23CCCC[C@@H]2C3)CC1	ZINC000875203213	GG	On-Demand	Anodyne	MC4R	68	40
CC(=O)N1CCN(c2ccccc2CNC(=O)N[C@H](C)[C@@]23CCCC[C@@H]2C3)CC1	ZINC000875203214	GG	On-Demand	Anodyne	MC4R	68	40
CC(=O)N1CCN(c2ccccc2CNC(=O)N[C@H](C)[C@@]23CCCC[C@H]2C3)CC1	ZINC000875203215	GG	On-Demand	Anodyne	MC4R	68	40
C[C@H](NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)C1CCCC1	ZINC000875203303	EE	On-Demand	Anodyne	ACE	39	41
C[C@H](NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)C1CCCC1	ZINC000875203303	EE	On-Demand	Anodyne	XIAP	50	42
C[C@H](NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)C1CCCC1	ZINC000875203304	EE	On-Demand	Anodyne	ACE	39	41
C[C@H](NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)C1CCCC1	ZINC000875203304	EE	On-Demand	Anodyne	XIAP	50	42
C[C@H](NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)C1CCCC1	ZINC000875203305	EE	On-Demand	Anodyne	ACE	39	41
C[C@H](NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)C1CCCC1	ZINC000875203305	EE	On-Demand	Anodyne	XIAP	50	42
C[C@H](NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)C1CCCC1	ZINC000875203306	EE	On-Demand	Anodyne	ACE	39	41
C[C@H](NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)C1CCCC1	ZINC000875203306	EE	On-Demand	Anodyne	XIAP	50	42
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2coc(-c3ccccc3)n2)CC1	ZINC000875203321	GE	On-Demand	Anodyne	DRD4	19	52
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2coc(-c3ccccc3)n2)CC1	ZINC000875203321	GE	On-Demand	Anodyne	SIGMAR1	20	40
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2coc(-c3ccccc3)n2)CC1	ZINC000875203321	GE	On-Demand	Anodyne	PDE8B	61	37
CC(=O)N1CCN(c2ccccc2CNC(=O)N[C@@H]2CC23CCC3)CC1	ZINC000875203343	FE	On-Demand	Anodyne	KCNQ2	41	34
CC(=O)N1CCN(c2ccccc2CNC(=O)N[C@H]2CC23CCC3)CC1	ZINC000875203344	FE	On-Demand	Anodyne	KCNQ2	41	34
O=C(NCc1cccc(S(=O)(=O)N2CCCCC2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875203385	GD	On-Demand	Anodyne	NAMPT	62	53
O=C(NCc1ccc2c(c1)CCO2)N1Cc2cccc(O)c2C1	ZINC000875203396	DF	On-Demand	Clean	NAMPT	22	42
COc1ccccc1[C@H]1CN(C(=O)C(=O)NC[C@]2(C)CCCO2)CCO1	ZINC000875203414	FD	On-Demand	Anodyne	HCN1	43	35
COc1ccccc1[C@H]1CN(C(=O)C(=O)NC[C@]2(C)CCCO2)CCO1	ZINC000875203414	FD	On-Demand	Anodyne	HCN4	41	33
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NC[C@]2(C)CCCO2)CCO1	ZINC000875203415	FD	On-Demand	Anodyne	HCN1	43	35
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NC[C@]2(C)CCCO2)CCO1	ZINC000875203415	FD	On-Demand	Anodyne	HCN4	41	33
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NC[C@@]2(C)CCCO2)CCO1	ZINC000875203416	FD	On-Demand	Anodyne	HCN1	43	35
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NC[C@@]2(C)CCCO2)CCO1	ZINC000875203416	FD	On-Demand	Anodyne	HCN4	41	33
COc1ccccc1[C@H]1CN(C(=O)C(=O)NC[C@@]2(C)CCCO2)CCO1	ZINC000875203417	FD	On-Demand	Anodyne	HCN1	43	35
COc1ccccc1[C@H]1CN(C(=O)C(=O)NC[C@@]2(C)CCCO2)CCO1	ZINC000875203417	FD	On-Demand	Anodyne	HCN4	41	33
O=C(CCc1ncc(-c2ccccc2)o1)OCC(=O)N1CCN(Cc2cccc3ccccc23)CC1	ZINC000875203474	JI	On-Demand	Anodyne	FAAH	22	42
CN1CCN(C2CCN(C(=O)C(=O)NCCc3cc(F)ccc3F)CC2)CC1	ZINC000875203503	GC	On-Demand	Anodyne	L3MBTL3	53	38
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2cc(F)ccc2F)C1	ZINC000875203512	ED	On-Demand	Anodyne	SLC6A1	43	36
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2cc(F)ccc2F)C1	ZINC000875203513	ED	On-Demand	Anodyne	SLC6A1	43	36
C[C@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)C1CCCC1	ZINC000875203548	FC	On-Demand	Anodyne	L3MBTL3	56	44
C#CC[C@@H](CCOC)NC(=O)NCc1ccccc1N1CCN(C(C)=O)CC1	ZINC000875203556	GD	On-Demand	Mild	MC4R	31	40
C#CC[C@H](CCOC)NC(=O)NCc1ccccc1N1CCN(C(C)=O)CC1	ZINC000875203557	GD	On-Demand	Mild	MC4R	31	40
CCCCCCCNC(=O)C(=O)NCC(C)(C)c1ccncc1	ZINC000875203562	DF	On-Demand	Mild	ASAH1	87	36
COCC1CC(NC(=O)NC(C)(C)c2ccc(Cl)c(Cl)c2)C1	ZINC000875203673	EH	On-Demand	Anodyne	IMDH_CRYPV	53	41
O=C(NCc1ccc2c(c1)CCO2)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875203689	FF	On-Demand	Anodyne	NOS2	66	34
O=C(NCCCCCN1CCCCC1)C(=O)NCc1ncc(Cl)s1	ZINC000875203717	FE	On-Demand	Anodyne	DRD3	40	38
O=C(NCCCCCN1CCCCC1)C(=O)NCc1ncc(Cl)s1	ZINC000875203717	FE	On-Demand	Anodyne	HRH3	20	42
O=C(NCCCCCN1CCCCC1)C(=O)NCc1ncc(Cl)s1	ZINC000875203717	FE	On-Demand	Anodyne	HNMT	51	38
C=CC[C@H](NC(=O)C(=O)N[C@@H]1CCN(Cc2ccc(C)cc2)C1)c1ccncc1	ZINC000875203733	GF	On-Demand	Mild	DRD4	22	43
C=CC[C@H](NC(=O)C(=O)N[C@@H]1CCN(Cc2ccc(C)cc2)C1)c1ccncc1	ZINC000875203733	GF	On-Demand	Mild	MCHR1	22	40
C=CC[C@H](NC(=O)C(=O)N[C@H]1CCN(Cc2ccc(C)cc2)C1)c1ccncc1	ZINC000875203734	GF	On-Demand	Mild	DRD4	22	43
C=CC[C@H](NC(=O)C(=O)N[C@H]1CCN(Cc2ccc(C)cc2)C1)c1ccncc1	ZINC000875203734	GF	On-Demand	Mild	MCHR1	22	40
CC(=O)N[C@H](CC(C)C)C(=O)N(C)c1ccc(C(N)=O)cc1	ZINC000875203764	DD	On-Demand	Anodyne	CAPN1	31	43
CC(=O)N[C@H](CC(C)C)C(=O)N(C)c1ccc(C(N)=O)cc1	ZINC000875203764	DD	On-Demand	Anodyne	HPN	41	33
CC(=O)N1CCN(c2ccccc2CNC(=O)N[C@@H](C)c2nccnc2C)CC1	ZINC000875203774	GE	On-Demand	Anodyne	MC4R	52	41
CC(=O)N1CCN(c2ccccc2CNC(=O)N[C@H](C)c2nccnc2C)CC1	ZINC000875203780	GE	On-Demand	Anodyne	MC4R	52	41
CC(=O)N1CCN(c2ccccc2CNC(=O)NC2(C)CC(F)(F)C2)CC1	ZINC000875203781	GE	On-Demand	Anodyne	MC4R	34	40
CC(=O)N1CCN(c2ccccc2CNC(=O)NC2(C)CC(F)(F)C2)CC1	ZINC000875203781	GE	On-Demand	Anodyne	KCNQ2	41	33
CN1CCN(C2CCN(C(=O)C(=O)NCC(C)(C)c3ccncc3)CC2)CC1	ZINC000875203784	GC	On-Demand	Anodyne	L3MBTL3	52	40
CC(=O)N1CCN(c2ccccc2CNC(=O)NN=c2cc[nH]cc2C)CC1	ZINC000875203786	GD	On-Demand	Reactive	HTR1A	15	40
CC(=O)N1CCN(c2ccccc2CNC(=O)NN=c2cc[nH]cc2C)CC1	ZINC000875203786	GD	On-Demand	Reactive	HTR7	16	40
CO[C@@H]1CC[C@@H](C)N(C(=O)NCc2ccccc2N2CCN(C(C)=O)CC2)C1	ZINC000875203815	GE	On-Demand	Anodyne	HTR1A	28	40
CO[C@@H]1CC[C@@H](C)N(C(=O)NCc2ccccc2N2CCN(C(C)=O)CC2)C1	ZINC000875203815	GE	On-Demand	Anodyne	AVPR2	15	41
CC(=O)N1CCN(c2ccccc2CNC(=O)N2C[C@H]3CC=CC[C@H]3C2)CC1	ZINC000875203821	GE	On-Demand	Anodyne	MC4R	28	41
CC(=O)N1CCN(c2ccccc2CNC(=O)N(C)OCC(F)(F)F)CC1	ZINC000875203847	GD	On-Demand	Anodyne	HTR1A	19	40
CC(=O)N1CCN(c2ccccc2CNC(=O)N(C)OCC(F)(F)F)CC1	ZINC000875203847	GD	On-Demand	Anodyne	HTR7	17	40
COC(=O)N(C)NC(=O)NCc1ccccc1N1CCN(C(C)=O)CC1	ZINC000875203887	FC	On-Demand	Reactive	HTR1A	30	44
COC(=O)N(C)NC(=O)NCc1ccccc1N1CCN(C(C)=O)CC1	ZINC000875203887	FC	On-Demand	Reactive	DRD2	26	40
COC(=O)N(C)NC(=O)NCc1ccccc1N1CCN(C(C)=O)CC1	ZINC000875203887	FC	On-Demand	Reactive	HTR7	29	44
CC(=O)N1CCN(c2ccccc2CNC(=O)NCCCCC2CC2)CC1	ZINC000875203920	FF	On-Demand	Anodyne	HTR1A	26	41
CC(=O)N1CCN(c2ccccc2CNC(=O)NCCCCC2CC2)CC1	ZINC000875203920	FF	On-Demand	Anodyne	DRD2	37	41
CC(=O)N1CCN(c2ccccc2CNC(=O)NCCCCC2CC2)CC1	ZINC000875203920	FF	On-Demand	Anodyne	DRD3	63	40
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(CC)CC1	ZINC000875203947	CD	On-Demand	Anodyne	CACNA1I	55	39
CN1CCC(CNC(=O)N[C@H]2CCCNC2=O)(c2ccccc2)CC1	ZINC000875203979	ED	On-Demand	Anodyne	KCNA3	48	41
CN1CCC(CNC(=O)N[C@H]2CCCNC2=O)(c2ccccc2)CC1	ZINC000875203979	ED	On-Demand	Anodyne	GHRL	63	33
CN1CCC(CNC(=O)N[C@@H]2CCCNC2=O)(c2ccccc2)CC1	ZINC000875203981	ED	On-Demand	Anodyne	KCNA3	48	41
CN1CCC(CNC(=O)N[C@@H]2CCCNC2=O)(c2ccccc2)CC1	ZINC000875203981	ED	On-Demand	Anodyne	GHRL	63	33
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2CCN(CC)CC2)C1	ZINC000875204038	ED	On-Demand	Anodyne	CACNA1I	45	35
C[C@H](NC(=O)C(=O)NCCCCCN1CCCCC1)c1ccnn1C	ZINC000875204048	ED	On-Demand	Anodyne	DRD2	29	41
C[C@H](NC(=O)C(=O)NCCCCCN1CCCCC1)c1ccnn1C	ZINC000875204048	ED	On-Demand	Anodyne	DRD3	54	41
C[C@H](NC(=O)C(=O)NCCCCCN1CCCCC1)c1ccnn1C	ZINC000875204048	ED	On-Demand	Anodyne	CHRNA7	20	43
C[C@H](NC(=O)C(=O)NCCCCCN1CCCCC1)c1ccnn1C	ZINC000875204048	ED	On-Demand	Anodyne	HNMT	61	37
CC[C@@H]1COCCN1CCNC(=O)NCC1CCN(CC)CC1	ZINC000875204102	ED	On-Demand	Anodyne	CACNA1I	51	34
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)N[C@@H]1CCCNC1=O	ZINC000875204117	ED	On-Demand	Anodyne	C3AR1	39	40
O=C(N[C@H]1CCCNC1=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875204118	ED	On-Demand	Anodyne	C3AR1	39	40
O=C(N[C@@H]1CCCNC1=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875204119	ED	On-Demand	Anodyne	C3AR1	39	40
O=C(N[C@H]1CCCNC1=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875204120	ED	On-Demand	Anodyne	C3AR1	39	40
O=C(NCCCCCN1CCCCC1)C(=O)NCc1cccc2ncccc12	ZINC000875204160	GF	On-Demand	Anodyne	HTR1A	49	49
O=C(NCCCCCN1CCCCC1)C(=O)NCc1cccc2ncccc12	ZINC000875204160	GF	On-Demand	Anodyne	DRD2	49	49
O=C(NCCCCCN1CCCCC1)C(=O)NCc1cccc2ncccc12	ZINC000875204160	GF	On-Demand	Anodyne	DRD4	21	49
O=C(NCCCCCN1CCCCC1)C(=O)NCc1cccc2ncccc12	ZINC000875204160	GF	On-Demand	Anodyne	ACHE	26	44
O=C(NCCCCCN1CCCCC1)C(=O)NCc1cccc2ncccc12	ZINC000875204160	GF	On-Demand	Anodyne	HTR2A	37	43
O=C(NCCCCCN1CCCCC1)C(=O)NCc1cccc2ncccc12	ZINC000875204160	GF	On-Demand	Anodyne	DRD3	65	49
O=C(NCCCCCN1CCCCC1)C(=O)NCc1cccc2ncccc12	ZINC000875204160	GF	On-Demand	Anodyne	HTR7	51	38
O=C(NCCCCCN1CCCCC1)C(=O)NCc1cccc2ncccc12	ZINC000875204160	GF	On-Demand	Anodyne	HRH3	26	55
O=C(NCCCCCN1CCCCC1)C(=O)NCc1cccc2ncccc12	ZINC000875204160	GF	On-Demand	Anodyne	CHRNA7	16	45
O=C(NCCCCCN1CCCCC1)C(=O)NCc1cccc2ncccc12	ZINC000875204160	GF	On-Demand	Anodyne	HNMT	127	55
O=C(NCCO)C1CCN(C(=O)NCc2ccc(F)c(Cl)c2)CC1	ZINC000875204233	FD	On-Demand	Anodyne	MAPK1	21	44
O=C(NCCO)C1CCN(C(=O)NCc2ccc(F)c(Cl)c2)CC1	ZINC000875204233	FD	On-Demand	Anodyne	EPHX2	28	56
CCCCCCCNC(=O)C(=O)NCc1cc(CC)[nH]n1	ZINC000875204315	CD	On-Demand	Mild	ASAH1	85	37
CC[C@@H](NC(=O)NCC1CCN(CC)CC1)[C@@H](O)c1ccccc1	ZINC000875204332	EF	On-Demand	Anodyne	HTR4	58	38
CC[C@@H](NC(=O)NCC1CCN(CC)CC1)[C@@H](O)c1ccccc1	ZINC000875204332	EF	On-Demand	Anodyne	CACNA1I	64	38
CC[C@@H](NC(=O)NCC1CCN(CC)CC1)[C@H](O)c1ccccc1	ZINC000875204333	EF	On-Demand	Anodyne	HTR4	58	38
CC[C@@H](NC(=O)NCC1CCN(CC)CC1)[C@H](O)c1ccccc1	ZINC000875204333	EF	On-Demand	Anodyne	CACNA1I	64	38
CCCN(CC(=O)N(C)C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204362	FD	On-Demand	Anodyne	MME	76	37
CCCN(CC(=O)N(C)C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204362	FD	On-Demand	Anodyne	ANPEP	47	35
CCCN(CC(=O)N(C)C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204362	FD	On-Demand	Anodyne	TACR1	17	45
CCCN(CC(=O)N(C)C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204362	FD	On-Demand	Anodyne	CTRA_BOVIN	16	42
CCCN(CC(=O)N(C)C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204362	FD	On-Demand	Anodyne	FCER2	43	32
CCCN(CC(=O)N(C)C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204362	FD	On-Demand	Anodyne	KLK3	83	36
CCCN(CC(=O)N(C)C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204362	FD	On-Demand	Anodyne	CTSB	65	50
CCCN(CC(=O)N(C)C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204362	FD	On-Demand	Anodyne	PAPA1_CARPA	78	51
CCCN(CC(=O)N(C)C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204362	FD	On-Demand	Anodyne	CYSP_TRYCR	61	45
CCCN(CC(=O)N(C)C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204362	FD	On-Demand	Anodyne	CTSK	43	50
CCCN(CC(=O)N(C)C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204362	FD	On-Demand	Anodyne	CTSL	50	50
CCCN(CC(=O)N(C)C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204362	FD	On-Demand	Anodyne	TIMP3	78	36
CCCN(CC(=O)N(C)C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204362	FD	On-Demand	Anodyne	CAPNS1	75	44
CCCN(CC(=O)N(C)C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204362	FD	On-Demand	Anodyne	HLA-DRB1	94	45
CCCN(CC(=O)N(C)C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204362	FD	On-Demand	Anodyne	CTSS	21	50
CCCN(CC(=O)N(C)C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204362	FD	On-Demand	Anodyne	CAPN1	102	41
CCCN(CC(=O)N(C)C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204362	FD	On-Demand	Anodyne	CAPN2	123	44
CCCN(CC(=O)N(C)C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204362	FD	On-Demand	Anodyne	ACE2	50	37
CCCN(CC(=O)N(C)C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204362	FD	On-Demand	Anodyne	FPR1	55	35
CCCN(CC(=O)N(C)C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204362	FD	On-Demand	Anodyne	CTRB_BOVIN	52	42
CCCN(CC(=O)N(C)C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204362	FD	On-Demand	Anodyne	NPR	54	37
CCCN(CC(=O)N(C)C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204363	FD	On-Demand	Anodyne	MME	76	37
CCCN(CC(=O)N(C)C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204363	FD	On-Demand	Anodyne	ANPEP	47	35
CCCN(CC(=O)N(C)C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204363	FD	On-Demand	Anodyne	TACR1	17	45
CCCN(CC(=O)N(C)C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204363	FD	On-Demand	Anodyne	CTRA_BOVIN	16	42
CCCN(CC(=O)N(C)C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204363	FD	On-Demand	Anodyne	FCER2	43	32
CCCN(CC(=O)N(C)C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204363	FD	On-Demand	Anodyne	KLK3	83	36
CCCN(CC(=O)N(C)C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204363	FD	On-Demand	Anodyne	CTSB	65	50
CCCN(CC(=O)N(C)C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204363	FD	On-Demand	Anodyne	PAPA1_CARPA	78	51
CCCN(CC(=O)N(C)C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204363	FD	On-Demand	Anodyne	CYSP_TRYCR	61	45
CCCN(CC(=O)N(C)C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204363	FD	On-Demand	Anodyne	CTSK	43	50
CCCN(CC(=O)N(C)C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204363	FD	On-Demand	Anodyne	CTSL	50	50
CCCN(CC(=O)N(C)C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204363	FD	On-Demand	Anodyne	TIMP3	78	36
CCCN(CC(=O)N(C)C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204363	FD	On-Demand	Anodyne	CAPNS1	75	44
CCCN(CC(=O)N(C)C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204363	FD	On-Demand	Anodyne	HLA-DRB1	94	45
CCCN(CC(=O)N(C)C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204363	FD	On-Demand	Anodyne	CTSS	21	50
CCCN(CC(=O)N(C)C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204363	FD	On-Demand	Anodyne	CAPN1	102	41
CCCN(CC(=O)N(C)C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204363	FD	On-Demand	Anodyne	CAPN2	123	44
CCCN(CC(=O)N(C)C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204363	FD	On-Demand	Anodyne	ACE2	50	37
CCCN(CC(=O)N(C)C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204363	FD	On-Demand	Anodyne	FPR1	55	35
CCCN(CC(=O)N(C)C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204363	FD	On-Demand	Anodyne	CTRB_BOVIN	52	42
CCCN(CC(=O)N(C)C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OCC	ZINC000875204363	FD	On-Demand	Anodyne	NPR	54	37
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCCCCCN2CCCCC2)c1	ZINC000875204428	GF	On-Demand	Anodyne	HNMT	44	38
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCCCCCN2CCCCC2)c1	ZINC000875204430	GF	On-Demand	Anodyne	HNMT	44	38
COc1cccc(C(C)(C)C(=O)N(C)c2ccc(C(N)=O)cc2)c1	ZINC000875204538	EF	On-Demand	Anodyne	HSD17B2	23	43
CC[C@H](C)NC(=O)CCNC(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875204553	GG	On-Demand	Anodyne	DRD4	40	31
C[C@H](NC(=O)C(=O)NCCCCCN1CCCCC1)c1cc2cnccc2o1	ZINC000875204567	GF	On-Demand	Anodyne	DRD3	45	38
C[C@H](NC(=O)C(=O)NCCCCCN1CCCCC1)c1cc2cnccc2o1	ZINC000875204567	GF	On-Demand	Anodyne	CHRNA7	23	43
C[C@H](NC(=O)C(=O)NCCCCCN1CCCCC1)c1cc2cnccc2o1	ZINC000875204567	GF	On-Demand	Anodyne	HNMT	40	33
C[C@H](NC(=O)C(=O)NCCCCCN1CCCCC1)c1cc2cnccc2o1	ZINC000875204567	GF	On-Demand	Anodyne	NAMPT	15	40
CN(C(=O)[C@H](c1cccnc1)C1CCCCC1)c1ccc(C(N)=O)cc1	ZINC000875204591	FH	On-Demand	Anodyne	C3AR1	40	38
CC(=O)C1CCN(C(=O)C(=O)NCC2(Sc3ccccc3)CCCC2)CC1	ZINC000875204593	GG	On-Demand	Anodyne	HCN1	52	32
CC(=O)C1CCN(C(=O)C(=O)NCC2(Sc3ccccc3)CCCC2)CC1	ZINC000875204593	GG	On-Demand	Anodyne	HCN4	50	32
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(F)c(Cl)c1	ZINC000875204716	FF	On-Demand	Anodyne	UL54	67	33
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(F)c(Cl)c1	ZINC000875204716	FF	On-Demand	Anodyne	CACNA1I	57	39
C[C@H](NC(=O)C(=O)N(C)C[C@@H](C)NC(=O)OC(C)(C)C)C1CCCC1	ZINC000875204736	FE	On-Demand	Anodyne	REN	18	40
C[C@@H](CN(C)C(=O)C(=O)N[C@H](C)C1CCCC1)NC(=O)OC(C)(C)C	ZINC000875204737	FE	On-Demand	Anodyne	REN	18	40
C[C@@H](CN(C)C(=O)C(=O)N[C@@H](C)C1CCCC1)NC(=O)OC(C)(C)C	ZINC000875204738	FE	On-Demand	Anodyne	REN	18	40
COC(=O)N(C)NC(=O)NC1CCN(Cc2coc(-c3ccccc3)n2)CC1	ZINC000875204741	GE	On-Demand	Reactive	DRD4	23	52
COC(=O)N(C)NC(=O)NC1CCN(Cc2coc(-c3ccccc3)n2)CC1	ZINC000875204741	GE	On-Demand	Reactive	SIGMAR1	20	42
COC(=O)N(C)NC(=O)NC1CCN(Cc2coc(-c3ccccc3)n2)CC1	ZINC000875204741	GE	On-Demand	Reactive	PDK1	45	35
COC(=O)N(C)NC(=O)NC1CCN(Cc2coc(-c3ccccc3)n2)CC1	ZINC000875204741	GE	On-Demand	Reactive	MCHR1	29	42
COC(=O)N(C)NC(=O)NC1CCN(Cc2coc(-c3ccccc3)n2)CC1	ZINC000875204741	GE	On-Demand	Reactive	PDE8B	51	32
NC(=O)CCOC(=O)CCc1ncc(-c2ccccc2)o1	ZINC000875204751	CD	On-Demand	Anodyne	FAAH	70	42
NC(=O)CCOC(=O)CCc1ncc(-c2ccccc2)o1	ZINC000875204751	CD	On-Demand	Anodyne	CES1	49	43
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCCCCN1CCCCC1	ZINC000875204757	GE	On-Demand	Anodyne	HTR1A	47	41
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCCCCN1CCCCC1	ZINC000875204757	GE	On-Demand	Anodyne	DRD2	54	41
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCCCCN1CCCCC1	ZINC000875204757	GE	On-Demand	Anodyne	DRD3	86	40
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCCCCN1CCCCC1	ZINC000875204757	GE	On-Demand	Anodyne	CHRNA7	20	47
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCCCCCN1CCCCC1	ZINC000875204757	GE	On-Demand	Anodyne	HNMT	47	38
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCCCCN1CCCCC1	ZINC000875204758	GE	On-Demand	Anodyne	HTR1A	47	41
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCCCCN1CCCCC1	ZINC000875204758	GE	On-Demand	Anodyne	DRD2	54	41
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCCCCN1CCCCC1	ZINC000875204758	GE	On-Demand	Anodyne	DRD3	86	40
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCCCCN1CCCCC1	ZINC000875204758	GE	On-Demand	Anodyne	CHRNA7	20	47
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCCCCCN1CCCCC1	ZINC000875204758	GE	On-Demand	Anodyne	HNMT	47	38
C[C@H](NC(=O)C(=O)NCC1(Sc2ccccc2)CCCC1)c1ccnn1C	ZINC000875204821	GF	On-Demand	Anodyne	HCN1	62	34
C[C@H](NC(=O)C(=O)NCC1(Sc2ccccc2)CCCC1)c1ccnn1C	ZINC000875204821	GF	On-Demand	Anodyne	HCN4	49	34
CN(C)C[C@@H]1CN(C(=O)NCc2ccc(F)c(Cl)c2)C[C@H]1CN(C)C	ZINC000875204871	FE	On-Demand	Anodyne	MAPK1	20	46
CC(=O)C1CCN(C(=O)C(=O)NCC2(Sc3ccccc3)CC2)CC1	ZINC000875204900	FE	On-Demand	Anodyne	HCN1	40	31
CC(=O)C1CCN(C(=O)N[C@@H](C)c2cc(F)ccc2N2CCN(C)CC2)CC1	ZINC000875204975	GF	On-Demand	Anodyne	MC4R	36	41
Cc1ccccc1[C@@H](NC(=O)C(=O)N[C@H](C)c1ccnn1C)C(C)C	ZINC000875204979	EE	On-Demand	Anodyne	CTSA	43	32
Cc1ccccc1[C@H](NC(=O)C(=O)N[C@H](C)c1ccnn1C)C(C)C	ZINC000875204980	EE	On-Demand	Anodyne	CTSA	43	32
Cc1ccccc1[C@H](NC(=O)C(=O)N[C@@H](C)c1ccnn1C)C(C)C	ZINC000875204981	EE	On-Demand	Anodyne	CTSA	43	32
Cc1ccccc1[C@@H](NC(=O)C(=O)N[C@@H](C)c1ccnn1C)C(C)C	ZINC000875204982	EE	On-Demand	Anodyne	CTSA	43	32
CCOC(=O)[C@@H]1CN(C(=O)NCC2CCN(CC)CC2)CCC1(F)F	ZINC000875205051	FD	On-Demand	Anodyne	CACNA1I	45	32
NC(=O)N[C@@H](CC(=O)OCC(=O)N1CCN(Cc2cccc3ccccc23)CC1)c1ccccc1	ZINC000875205063	JF	On-Demand	Anodyne	Q6PRC7_IXORI	46	33
NC(=O)N[C@H](CC(=O)OCC(=O)N1CCN(Cc2cccc3ccccc23)CC1)c1ccccc1	ZINC000875205064	JF	On-Demand	Anodyne	Q6PRC7_IXORI	46	33
CC(=O)C1CCN(C(=O)C(=O)NCCc2cc(F)ccc2F)CC1	ZINC000875205069	ED	On-Demand	Anodyne	DPP4	15	47
CCCN(CC(=O)N(C)C)C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875205075	FD	On-Demand	Anodyne	CTSB	40	36
CCCN(CC(=O)N(C)C)C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875205075	FD	On-Demand	Anodyne	CTSK	20	45
CCCN(CC(=O)N(C)C)C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875205075	FD	On-Demand	Anodyne	CAPNS1	49	35
CCCN(CC(=O)N(C)C)C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875205075	FD	On-Demand	Anodyne	CAPN1	42	35
CCCN(CC(=O)N(C)C)C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875205075	FD	On-Demand	Anodyne	CAPN2	63	34
CCCN(CC(=O)N(C)C)C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875205075	FD	On-Demand	Anodyne	NPR	55	35
CCCN(CC(=O)N(C)C)C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875205075	FD	On-Demand	Anodyne	SLC12A5	42	33
CC(=O)C1CCN(C(=O)N[C@H](C)c2cc(F)ccc2N2CCN(C)CC2)CC1	ZINC000875205128	GF	On-Demand	Anodyne	MC4R	36	41
O=C(NCc1nc(-c2ccncc2)cs1)N[C@@H]1CCCNC1=O	ZINC000875205172	ED	On-Demand	Anodyne	ROCK1	21	42
O=C(NCc1nc(-c2ccncc2)cs1)N[C@H]1CCCNC1=O	ZINC000875205173	ED	On-Demand	Anodyne	ROCK1	21	42
O=C(Cc1cccc2cccnc12)OCC(=O)N1CCN(Cc2cccc3ccccc23)CC1	ZINC000875205228	JH	On-Demand	Anodyne	HTR1B	15	42
CC[C@@H](NC(=O)NC1CCC(NC(C)=O)CC1)[C@@H](O)c1ccccc1	ZINC000875205260	EE	On-Demand	Anodyne	XIAP	41	40
CC[C@@H](NC(=O)NC1CCC(NC(C)=O)CC1)[C@H](O)c1ccccc1	ZINC000875205262	EE	On-Demand	Anodyne	XIAP	41	40
CCc1cccc2c1OCC[C@H]2NC(=O)NN(C)C(=O)OC	ZINC000875205269	DD	On-Demand	Reactive	TRAR	45	33
CCc1cccc2c1OCC[C@@H]2NC(=O)NN(C)C(=O)OC	ZINC000875205270	DD	On-Demand	Reactive	TRAR	45	33
O=C(c1cccn(C2CC2)c1=O)N(c1ccccc1)C1CCCCC1	ZINC000875205273	EI	On-Demand	Anodyne	ACE	35	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(F)c(Cl)c2)C1	ZINC000875205283	EF	On-Demand	Anodyne	MAPK1	20	47
O=C(NC1(C(=O)N2C[C@H]3CC[C@H]2C3)CC1)OCc1ccccc1	ZINC000875205342	DE	On-Demand	Anodyne	CTRA_BOVIN	40	29
O=C(NC1(C(=O)N2C[C@H]3CC[C@H]2C3)CC1)OCc1ccccc1	ZINC000875205342	DE	On-Demand	Anodyne	CTSK	22	46
O=C(NC1(C(=O)N2C[C@H]3CC[C@H]2C3)CC1)OCc1ccccc1	ZINC000875205342	DE	On-Demand	Anodyne	CTSL	25	46
O=C(NC1(C(=O)N2C[C@H]3CC[C@H]2C3)CC1)OCc1ccccc1	ZINC000875205342	DE	On-Demand	Anodyne	SLC12A5	53	38
COc1cccc(C(C)(C)C(=O)N2C[C@H]3CC[C@H]2C3)c1	ZINC000875205434	CF	On-Demand	Anodyne	GLRA1	41	31
O=C(NCCCCCCc1ccccc1)N[C@H]1CCCNC1=O	ZINC000875205465	DE	On-Demand	Anodyne	FKBP1A	23	41
O=C(NCCCCCCc1ccccc1)N[C@@H]1CCCNC1=O	ZINC000875205467	DE	On-Demand	Anodyne	FKBP1A	23	41
COC(=O)N(C)NC(=O)NCc1ccc(OC)c(Br)c1	ZINC000875205518	ED	On-Demand	Reactive	TRPV1	15	42
COC(=O)N(C)NC(=O)NCc1ccc(OC)c(Br)c1	ZINC000875205518	ED	On-Demand	Reactive	MT-ND1	23	40
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCc2ccccc21	ZINC000875205630	DC	On-Demand	Mild	MTNR1B	24	40
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCc2ccccc21	ZINC000875205631	DC	On-Demand	Mild	MTNR1B	24	40
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCc2ccccc21	ZINC000875205632	DC	On-Demand	Mild	MTNR1B	24	40
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCc2ccccc21	ZINC000875205633	DC	On-Demand	Mild	MTNR1B	24	40
CCN(CCNC(=O)N1CCC(c2nccc(-c3cccnc3)n2)CC1)C1CC1	ZINC000875205677	GF	On-Demand	Anodyne	ABL1	15	44
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCc2ccccc21	ZINC000875205700	ED	On-Demand	Mild	MTNR1A	17	40
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCc2ccccc21	ZINC000875205700	ED	On-Demand	Mild	MTNR1B	22	40
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCc2ccccc21	ZINC000875205701	ED	On-Demand	Mild	MTNR1A	17	40
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCc2ccccc21	ZINC000875205701	ED	On-Demand	Mild	MTNR1B	22	40
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCc2ccccc21	ZINC000875205702	ED	On-Demand	Mild	MTNR1A	17	40
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCc2ccccc21	ZINC000875205702	ED	On-Demand	Mild	MTNR1B	22	40
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCc2ccccc21	ZINC000875205703	ED	On-Demand	Mild	MTNR1A	17	40
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCc2ccccc21	ZINC000875205703	ED	On-Demand	Mild	MTNR1B	22	40
O=C(Cc1cccc2cccnc12)OCC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1	ZINC000875205733	JI	On-Demand	Anodyne	PTAFR	38	42
C[C@H](NC(=O)C(=O)NCC1(Sc2ccccc2)CC1)c1ccnn1C	ZINC000875205768	FE	On-Demand	Anodyne	HCN1	40	35
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(F)c(Cl)c1	ZINC000875205808	EF	On-Demand	Anodyne	SLC6A2	15	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(F)c(Cl)c1	ZINC000875205808	EF	On-Demand	Anodyne	SLC6A4	39	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(F)c(Cl)c1	ZINC000875205808	EF	On-Demand	Anodyne	SLC6A3	69	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(F)c(Cl)c1	ZINC000875205810	EF	On-Demand	Anodyne	SLC6A2	15	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(F)c(Cl)c1	ZINC000875205810	EF	On-Demand	Anodyne	SLC6A4	39	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(F)c(Cl)c1	ZINC000875205810	EF	On-Demand	Anodyne	SLC6A3	69	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)c(Br)c1	ZINC000875205816	GF	On-Demand	Anodyne	SLC6A4	28	50
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)c(Br)c1	ZINC000875205816	GF	On-Demand	Anodyne	SLC6A3	48	50
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)c(Br)c1	ZINC000875205818	GF	On-Demand	Anodyne	SLC6A4	28	50
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)c(Br)c1	ZINC000875205818	GF	On-Demand	Anodyne	SLC6A3	48	50
CCc1cccc2c1OCC[C@H]2NC(=O)N1CC(O)(C(=O)OC)C1	ZINC000875205900	ED	On-Demand	Anodyne	TRAR	40	32
CCc1cccc2c1OCC[C@@H]2NC(=O)N1CC(O)(C(=O)OC)C1	ZINC000875205901	ED	On-Demand	Anodyne	TRAR	40	32
Cc1ccccc1[C@@H](CC(C)C)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875205924	GD	On-Demand	Anodyne	CTSA	50	35
Cc1ccccc1[C@H](CC(C)C)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875205925	GD	On-Demand	Anodyne	CTSA	50	35
COC(=O)C1(O)CN(C(=O)NCc2ccc(F)c(Cl)c2)C1	ZINC000875205984	DC	On-Demand	Anodyne	MAPK1	27	50
O=C(N[C@@H](CC1CCCCC1)c1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875205987	FG	On-Demand	Anodyne	REN	36	41
O=C(N[C@H](CC1CCCCC1)c1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875205990	FG	On-Demand	Anodyne	REN	36	41
Cc1ccccc1[C@H](CC(C)C)NC(=O)C(=O)NCc1nn(C)cc1C(F)F	ZINC000875206048	GG	On-Demand	Anodyne	CTSA	54	34
Cc1ccccc1[C@@H](CC(C)C)NC(=O)C(=O)NCc1nn(C)cc1C(F)F	ZINC000875206049	GG	On-Demand	Anodyne	CTSA	54	34
C[C@@H]1CN(C(=O)NCc2ccc([C@@]3(C)NC(=O)NC3=O)cc2)Cc2ccccc21	ZINC000875206066	GF	On-Demand	Anodyne	NPSR1	27	41
C[C@@H]1CN(C(=O)NCc2ccc([C@@]3(C)NC(=O)NC3=O)cc2)Cc2ccccc21	ZINC000875206066	GF	On-Demand	Anodyne	NAMPT	22	40
C[C@@H]1CN(C(=O)NCc2ccc([C@]3(C)NC(=O)NC3=O)cc2)Cc2ccccc21	ZINC000875206069	GF	On-Demand	Anodyne	NPSR1	27	41
C[C@@H]1CN(C(=O)NCc2ccc([C@]3(C)NC(=O)NC3=O)cc2)Cc2ccccc21	ZINC000875206069	GF	On-Demand	Anodyne	NAMPT	22	40
Cc1ccccc1[C@@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)C1CC1	ZINC000875206091	GD	On-Demand	Anodyne	L3MBTL3	59	40
Cc1ccccc1[C@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)C1CC1	ZINC000875206096	GD	On-Demand	Anodyne	L3MBTL3	59	40
O=C(NCc1ccc(F)c(Cl)c1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875206125	FE	On-Demand	Anodyne	CACNA1I	45	33
CCN(CCNC(=O)N(CC)[C@H](C)[C@@H](O)c1ccccc1)C1CC1	ZINC000875206194	EF	On-Demand	Anodyne	NPY5R	21	40
CCN(CCNC(=O)N(CC)[C@@H](C)[C@@H](O)c1ccccc1)C1CC1	ZINC000875206195	EF	On-Demand	Anodyne	NPY5R	21	40
CCN(CCNC(=O)N(CC)[C@H](C)[C@H](O)c1ccccc1)C1CC1	ZINC000875206196	EF	On-Demand	Anodyne	NPY5R	21	40
CCN(CCNC(=O)N(CC)[C@@H](C)[C@H](O)c1ccccc1)C1CC1	ZINC000875206198	EF	On-Demand	Anodyne	NPY5R	21	40
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000875206203	GD	On-Demand	Mild	DRD2	24	47
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000875206203	GD	On-Demand	Mild	DRD3	16	45
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000875206203	GD	On-Demand	Mild	SLC6A3	33	43
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000875206203	GD	On-Demand	Mild	SIGMAR1	15	45
C#CC[C@H](CCOC)NC(=O)C(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000875206204	GD	On-Demand	Mild	DRD2	24	47
C#CC[C@H](CCOC)NC(=O)C(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000875206204	GD	On-Demand	Mild	DRD3	16	45
C#CC[C@H](CCOC)NC(=O)C(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000875206204	GD	On-Demand	Mild	SLC6A3	33	43
C#CC[C@H](CCOC)NC(=O)C(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000875206204	GD	On-Demand	Mild	SIGMAR1	15	45
Cc1ccccc1[C@@H](CC(C)C)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875206261	FF	On-Demand	Anodyne	CTSA	58	37
Cc1ccccc1[C@@H](CC(C)C)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875206266	FF	On-Demand	Anodyne	CTSA	58	37
Cc1ccccc1[C@H](CC(C)C)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875206268	FF	On-Demand	Anodyne	CTSA	58	37
Cc1ccccc1[C@H](CC(C)C)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875206269	FF	On-Demand	Anodyne	CTSA	58	37
CCCCCCCNC(=O)C(=O)N[C@H](c1ncccc1C)C(C)C	ZINC000875206286	EG	On-Demand	Mild	ASAH1	65	34
CCCCCCCNC(=O)C(=O)N[C@@H](c1ncccc1C)C(C)C	ZINC000875206292	EG	On-Demand	Mild	ASAH1	65	34
CN(C(=O)[C@H](F)[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1c(F)cccc1F	ZINC000875206339	FH	On-Demand	Anodyne	GPR119	42	52
CN(C(=O)[C@H](F)[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1c(F)cccc1F	ZINC000875206345	FH	On-Demand	Anodyne	GPR119	42	52
O=C(NCc1ccc(OCCN2CCCC2)cc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875206379	FD	On-Demand	Anodyne	ESR1	81	36
O=C(NCc1ccc(OCCN2CCCC2)cc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875206379	FD	On-Demand	Anodyne	ESR2	56	38
O=C(NCc1ccc(OCCN2CCCC2)cc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875206379	FD	On-Demand	Anodyne	LTA4H	57	47
O=C(NCc1ccc(OCCN2CCCC2)cc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875206379	FD	On-Demand	Anodyne	HRH3	55	46
O=C(NCc1ccc(OCCN2CCCC2)cc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875206379	FD	On-Demand	Anodyne	PSMB2	44	45
O=C(NCc1ccc(OCCN2CCCC2)cc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875206379	FD	On-Demand	Anodyne	PSMB1	48	45
O=C(NCc1ccc(OCCN2CCCC2)cc1)C(=O)N[C@H]1CC12CCC2	ZINC000875206382	FD	On-Demand	Anodyne	ESR1	81	36
O=C(NCc1ccc(OCCN2CCCC2)cc1)C(=O)N[C@H]1CC12CCC2	ZINC000875206382	FD	On-Demand	Anodyne	ESR2	56	38
O=C(NCc1ccc(OCCN2CCCC2)cc1)C(=O)N[C@H]1CC12CCC2	ZINC000875206382	FD	On-Demand	Anodyne	LTA4H	57	47
O=C(NCc1ccc(OCCN2CCCC2)cc1)C(=O)N[C@H]1CC12CCC2	ZINC000875206382	FD	On-Demand	Anodyne	HRH3	55	46
O=C(NCc1ccc(OCCN2CCCC2)cc1)C(=O)N[C@H]1CC12CCC2	ZINC000875206382	FD	On-Demand	Anodyne	PSMB2	44	45
O=C(NCc1ccc(OCCN2CCCC2)cc1)C(=O)N[C@H]1CC12CCC2	ZINC000875206382	FD	On-Demand	Anodyne	PSMB1	48	45
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2(Sc3ccccc3)CC2)C1	ZINC000875206383	FE	On-Demand	Anodyne	HCN1	42	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2(Sc3ccccc3)CC2)C1	ZINC000875206383	FE	On-Demand	Anodyne	HCN4	42	33
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@@H]1CCCNC1=O	ZINC000875206386	FD	On-Demand	Anodyne	CHRM2	16	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@@H]1CCCNC1=O	ZINC000875206386	FD	On-Demand	Anodyne	DRD2	19	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@@H]1CCCNC1=O	ZINC000875206386	FD	On-Demand	Anodyne	DRD4	41	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@@H]1CCCNC1=O	ZINC000875206386	FD	On-Demand	Anodyne	ACHE	61	59
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@@H]1CCCNC1=O	ZINC000875206386	FD	On-Demand	Anodyne	HRH2	25	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@@H]1CCCNC1=O	ZINC000875206386	FD	On-Demand	Anodyne	DRD3	15	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@@H]1CCCNC1=O	ZINC000875206386	FD	On-Demand	Anodyne	CHRM3	21	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@@H]1CCCNC1=O	ZINC000875206386	FD	On-Demand	Anodyne	SIGMAR1	51	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@@H]1CCCNC1=O	ZINC000875206386	FD	On-Demand	Anodyne	CCR3	45	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@@H]1CCCNC1=O	ZINC000875206386	FD	On-Demand	Anodyne	CACNA1G	25	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2(Sc3ccccc3)CC2)C1	ZINC000875206387	FE	On-Demand	Anodyne	HCN1	42	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2(Sc3ccccc3)CC2)C1	ZINC000875206387	FE	On-Demand	Anodyne	HCN4	42	33
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@H]1CCCNC1=O	ZINC000875206389	FD	On-Demand	Anodyne	CHRM2	16	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@H]1CCCNC1=O	ZINC000875206389	FD	On-Demand	Anodyne	DRD2	19	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@H]1CCCNC1=O	ZINC000875206389	FD	On-Demand	Anodyne	DRD4	41	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@H]1CCCNC1=O	ZINC000875206389	FD	On-Demand	Anodyne	ACHE	61	59
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@H]1CCCNC1=O	ZINC000875206389	FD	On-Demand	Anodyne	HRH2	25	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@H]1CCCNC1=O	ZINC000875206389	FD	On-Demand	Anodyne	DRD3	15	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@H]1CCCNC1=O	ZINC000875206389	FD	On-Demand	Anodyne	CHRM3	21	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@H]1CCCNC1=O	ZINC000875206389	FD	On-Demand	Anodyne	SIGMAR1	51	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@H]1CCCNC1=O	ZINC000875206389	FD	On-Demand	Anodyne	CCR3	45	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@H]1CCCNC1=O	ZINC000875206389	FD	On-Demand	Anodyne	CACNA1G	25	40
O=C(N[C@@H](CC1CCCCC1)c1ccccc1)N1CCC2(CCNC2=O)CC1	ZINC000875206419	GI	On-Demand	Anodyne	CACNA1H	26	41
O=C(N[C@@H](CC1CCCCC1)c1ccccc1)N1CCC2(CCNC2=O)CC1	ZINC000875206419	GI	On-Demand	Anodyne	CTSS	17	44
O=C(N[C@H](CC1CCCCC1)c1ccccc1)N1CCC2(CCNC2=O)CC1	ZINC000875206421	GI	On-Demand	Anodyne	CACNA1H	26	41
O=C(N[C@H](CC1CCCCC1)c1ccccc1)N1CCC2(CCNC2=O)CC1	ZINC000875206421	GI	On-Demand	Anodyne	CTSS	17	44
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H](C)c2nc(C)no2)CC1	ZINC000875206439	FG	On-Demand	Anodyne	SMO	35	41
COc1ccccc1[C@H]1CCCN(C(=O)N[C@H](C)c2nc(C)no2)CC1	ZINC000875206442	FG	On-Demand	Anodyne	SMO	35	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H](C)c2nc(C)no2)CC1	ZINC000875206445	FG	On-Demand	Anodyne	SMO	35	41
COc1ccccc1[C@H]1CCCN(C(=O)N[C@@H](C)c2nc(C)no2)CC1	ZINC000875206449	FG	On-Demand	Anodyne	SMO	35	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)CC(=O)Nc1cccc(N2CCCC2)c1	ZINC000875206508	GF	On-Demand	Anodyne	KCNQ2	44	36
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)CC(=O)Nc1cccc(N2CCCC2)c1	ZINC000875206509	GF	On-Demand	Anodyne	KCNQ2	44	36
CCc1cccc2c1OCC[C@H]2NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875206623	DD	On-Demand	Anodyne	TRAR	45	33
O=C(NCc1ccc(F)c(Cl)c1)N1CCC(CO)(CO)CC1	ZINC000875206625	ED	On-Demand	Anodyne	CACNA1H	68	36
O=C(NCc1ccc(F)c(Cl)c1)N1CCC(CO)(CO)CC1	ZINC000875206625	ED	On-Demand	Anodyne	MAPK1	24	47
O=C(NCc1ccc(F)c(Cl)c1)N1CCC(CO)(CO)CC1	ZINC000875206625	ED	On-Demand	Anodyne	EPHX2	21	49
Cn1nc(Cl)c(C(=O)Nc2cccnc2N2CCCCC2)c1Cl	ZINC000875206685	FG	On-Demand	Anodyne	G2YM83_BOTF4	74	39
CCc1cccc2c1OCC[C@@H]2NC(=O)NC1CC(C(=O)OC)C1	ZINC000875206697	EE	On-Demand	Anodyne	LUXR	44	35
CCc1cccc2c1OCC[C@@H]2NC(=O)NC1CC(C(=O)OC)C1	ZINC000875206697	EE	On-Demand	Anodyne	TRAR	46	35
CCc1cccc2c1OCC[C@H]2NC(=O)NC1CC(C(=O)OC)C1	ZINC000875206699	EE	On-Demand	Anodyne	LUXR	44	35
CCc1cccc2c1OCC[C@H]2NC(=O)NC1CC(C(=O)OC)C1	ZINC000875206699	EE	On-Demand	Anodyne	TRAR	46	35
CCO[C@H](C(=O)N(C)c1c(F)cccc1F)C1CCCC1	ZINC000875206814	CH	On-Demand	Anodyne	AMY2	44	30
CCO[C@@H](C(=O)N(C)c1c(F)cccc1F)C1CCCC1	ZINC000875206815	CH	On-Demand	Anodyne	AMY2	44	30
O=C(NCCCN1CCCS1(=O)=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875206828	GC	On-Demand	Anodyne	HRH2	23	40
O=C(NCCCN1CCCS1(=O)=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875206831	GC	On-Demand	Anodyne	HRH2	23	40
CCc1cccc2c1OCC[C@H]2NC(=O)NC1(C)CC(F)(F)C1	ZINC000875206833	DH	On-Demand	Anodyne	LUXR	46	34
CCc1cccc2c1OCC[C@@H]2NC(=O)NC1(C)CC(F)(F)C1	ZINC000875206835	DH	On-Demand	Anodyne	LUXR	46	34
O=C(NCc1ccc(F)c(Cl)c1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875206843	FG	On-Demand	Anodyne	EPHX2	19	46
C[C@H](NC(=O)C(=O)NC[C@@H](C)N(C)Cc1ccccc1)c1ccnn1C	ZINC000875206844	FD	On-Demand	Anodyne	FCER2	50	33
O=C(NCc1ccc(F)c(Cl)c1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875206845	FG	On-Demand	Anodyne	EPHX2	19	46
C[C@H](NC(=O)C(=O)NC[C@H](C)N(C)Cc1ccccc1)c1ccnn1C	ZINC000875206846	FD	On-Demand	Anodyne	FCER2	50	33
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OC)c(Br)c1	ZINC000875206847	FF	On-Demand	Anodyne	ANPEP	18	43
CCN(CCNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)C1CC1	ZINC000875206861	FE	On-Demand	Mild	CCR3	15	41
CCN(CCNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)C1CC1	ZINC000875206861	FE	On-Demand	Mild	ITK	17	47
CCN(CCNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)C1CC1	ZINC000875206861	FE	On-Demand	Mild	PANC	53	36
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1nnc2ccccn12)C(C)C	ZINC000875206874	FE	On-Demand	Anodyne	SLC6A4	20	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1nnc2ccccn12)C(C)C	ZINC000875206874	FE	On-Demand	Anodyne	SLC6A3	44	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1nnc2ccccn12)C(C)C	ZINC000875206876	FE	On-Demand	Anodyne	SLC6A4	20	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1nnc2ccccn12)C(C)C	ZINC000875206876	FE	On-Demand	Anodyne	SLC6A3	44	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1nnc2ccccn12)C(C)C	ZINC000875206877	FE	On-Demand	Anodyne	SLC6A4	20	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1nnc2ccccn12)C(C)C	ZINC000875206877	FE	On-Demand	Anodyne	SLC6A3	44	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1nnc2ccccn12)C(C)C	ZINC000875206879	FE	On-Demand	Anodyne	SLC6A4	20	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1nnc2ccccn12)C(C)C	ZINC000875206879	FE	On-Demand	Anodyne	SLC6A3	44	40
O=C(N[C@@H](CC1CCCCC1)c1ccccc1)N[C@@H]1CCOC[C@H]1O	ZINC000875206882	EG	On-Demand	Anodyne	PGA5	42	32
COc1ccc(N2CCN(C(=O)C(=O)NCC3(C)COC3)CC2)c(OC)c1	ZINC000875206941	GC	On-Demand	Clean	DRD2	26	40
COc1ccc(N2CCN(C(=O)C(=O)NCC3(C)COC3)CC2)c(OC)c1	ZINC000875206941	GC	On-Demand	Clean	DRD4	41	32
COc1ccc(N2CCN(C(=O)C(=O)NCC3(C)COC3)CC2)c(OC)c1	ZINC000875206941	GC	On-Demand	Clean	DRD3	40	37
O=C(CCCOC1CCOCC1)N(c1ccccc1)C1CCCCC1	ZINC000875207040	EI	On-Demand	Anodyne	AMY2	47	32
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCC1(C)COC1)CC2	ZINC000875207076	FD	On-Demand	Anodyne	SLC18A2	47	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCC1(C)COC1)CC2	ZINC000875207077	FD	On-Demand	Anodyne	SLC18A2	47	36
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(F)c(Cl)c1	ZINC000875207085	DF	On-Demand	Anodyne	PDS	45	35
COc1ccccc1[C@H]1CCCN(C(=O)NCCSC)CC1	ZINC000875207106	DG	On-Demand	Anodyne	DRD2	24	45
COc1ccccc1[C@H]1CCCN(C(=O)NCCSC)CC1	ZINC000875207106	DG	On-Demand	Anodyne	DRD4	15	45
COc1ccccc1[C@H]1CCCN(C(=O)NCCSC)CC1	ZINC000875207106	DG	On-Demand	Anodyne	RBP4	34	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCCSC)CC1	ZINC000875207108	DG	On-Demand	Anodyne	DRD2	24	45
COc1ccccc1[C@@H]1CCCN(C(=O)NCCSC)CC1	ZINC000875207108	DG	On-Demand	Anodyne	DRD4	15	45
COc1ccccc1[C@@H]1CCCN(C(=O)NCCSC)CC1	ZINC000875207108	DG	On-Demand	Anodyne	RBP4	34	41
CCO[C@H](C(=O)N(c1ccccc1)C1CCCCC1)[C@@H]1CCOC1	ZINC000875207128	EH	On-Demand	Anodyne	AMY2	52	37
CCO[C@H](C(=O)N(c1ccccc1)C1CCCCC1)[C@H]1CCOC1	ZINC000875207129	EH	On-Demand	Anodyne	AMY2	52	37
CCO[C@@H](C(=O)N(c1ccccc1)C1CCCCC1)[C@H]1CCOC1	ZINC000875207130	EH	On-Demand	Anodyne	AMY2	52	37
CCO[C@@H](C(=O)N(c1ccccc1)C1CCCCC1)[C@@H]1CCOC1	ZINC000875207132	EH	On-Demand	Anodyne	AMY2	52	37
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCC(NC(C)=O)CC2)CC1	ZINC000875207142	GG	On-Demand	Anodyne	KCNA3	22	41
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCC(NC(C)=O)CC2)CC1	ZINC000875207142	GG	On-Demand	Anodyne	EPHX2	29	42
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCC(NC(C)=O)CC2)CC1	ZINC000875207142	GG	On-Demand	Anodyne	RBP4	36	42
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCC(NC(C)=O)CC2)CC1	ZINC000875207143	GG	On-Demand	Anodyne	KCNA3	22	41
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCC(NC(C)=O)CC2)CC1	ZINC000875207143	GG	On-Demand	Anodyne	EPHX2	29	42
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCC(NC(C)=O)CC2)CC1	ZINC000875207143	GG	On-Demand	Anodyne	RBP4	36	42
CCC(CC)(CNC(=O)N1CCC(CO)(CO)CC1)c1ccc(Cl)cc1	ZINC000875207210	GG	On-Demand	Anodyne	CACNA1G	35	40
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](CC(C)C)c2ccccc2C)CC1	ZINC000875207218	FG	On-Demand	Anodyne	CTSA	43	32
CC(=O)C1CCN(C(=O)C(=O)N[C@H](CC(C)C)c2ccccc2C)CC1	ZINC000875207219	FG	On-Demand	Anodyne	CTSA	43	32
C#CC[C@@H](COC)NC(=O)C(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000875207413	GD	On-Demand	Mild	DRD2	19	46
C#CC[C@@H](COC)NC(=O)C(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000875207413	GD	On-Demand	Mild	SLC6A3	35	44
C#CC[C@H](COC)NC(=O)C(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000875207414	GD	On-Demand	Mild	DRD2	19	46
C#CC[C@H](COC)NC(=O)C(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000875207414	GD	On-Demand	Mild	SLC6A3	35	44
C[C@@H](CC(=O)N(C)c1c(F)cccc1F)NC(=O)OC(C)(C)C	ZINC000875207429	EG	On-Demand	Anodyne	PAPA1_CARPA	32	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(COC(C)(C)C)c1	ZINC000875207484	FG	On-Demand	Anodyne	SLC6A4	25	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(COC(C)(C)C)c1	ZINC000875207484	FG	On-Demand	Anodyne	SLC6A3	47	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(COC(C)(C)C)c1	ZINC000875207485	FG	On-Demand	Anodyne	SLC6A4	25	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(COC(C)(C)C)c1	ZINC000875207485	FG	On-Demand	Anodyne	SLC6A3	47	37
C[C@@H](NC(=O)NCCn1cncn1)[C@@H](O)C(F)(F)F	ZINC000875207540	CB	On-Demand	Anodyne	HIS3	50	35
C[C@@H](NC(=O)NCCn1cncn1)[C@H](O)C(F)(F)F	ZINC000875207541	CB	On-Demand	Anodyne	HIS3	50	35
C[C@@H](CNC(=O)N1CCC(c2nnnn2C)CC1)c1c(Cl)cccc1Cl	ZINC000875207555	GG	On-Demand	Anodyne	IL2RA	54	42
CCCCCCCNC(=O)C(=O)NCC1(C)COC1	ZINC000875207622	CD	On-Demand	Mild	ASAH1	68	34
CCOC(=O)[C@H](C)C1CN(C(=O)NCC(=O)N2CCc3ccccc32)C1	ZINC000875207626	FD	On-Demand	Anodyne	ACE	22	47
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(COC(C)(C)C)c1	ZINC000875207642	EG	On-Demand	Anodyne	ANPEP	17	44
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(COC(C)(C)C)c1	ZINC000875207642	EG	On-Demand	Anodyne	PDS	53	34
CCC[C@@H](CCO)NC(=O)NCCn1cncn1	ZINC000875207645	CC	On-Demand	Anodyne	HIS3	77	38
CCC[C@H](CCO)NC(=O)NCCn1cncn1	ZINC000875207646	CC	On-Demand	Anodyne	HIS3	77	38
O=C(NCCn1cncn1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875207749	ED	On-Demand	Anodyne	HIS3	47	35
O=C(NCCn1cncn1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875207750	ED	On-Demand	Anodyne	HIS3	47	35
O=C(NCCn1cncn1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875207751	ED	On-Demand	Anodyne	HIS3	47	35
O=C(NCCn1cncn1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875207752	ED	On-Demand	Anodyne	HIS3	47	35
O=C(NCCn1cncn1)N1Cc2cccc(O)c2C1	ZINC000875207899	CC	On-Demand	Clean	HIS3	48	32
O=C1CCN(C(=O)NCC(=O)N2CCc3ccccc32)CCCCCCN1	ZINC000875207940	FD	On-Demand	Anodyne	AVPR2	32	42
O=C(NCCn1cncn1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875207946	EC	On-Demand	Anodyne	FAAH	18	41
O=C(NCCn1cncn1)N[C@H](CCO)c1cc(Cl)cc(Cl)c1	ZINC000875207953	FE	On-Demand	Anodyne	HIS3	59	34
O=C(NCCn1cncn1)N[C@@H](CCO)c1cc(Cl)cc(Cl)c1	ZINC000875207954	FE	On-Demand	Anodyne	HIS3	59	34
CC(=O)C1CCN(C(=O)NC[C@@H](C)c2c(Cl)cccc2Cl)CC1	ZINC000875208020	FI	On-Demand	Anodyne	EPHX2	22	43
CC(=O)C1CCN(C(=O)NC[C@H](C)c2c(Cl)cccc2Cl)CC1	ZINC000875208021	FI	On-Demand	Anodyne	EPHX2	22	43
COc1ccccc1[C@H]1CCCN(C(=O)NCCn2cncn2)CC1	ZINC000875208036	EE	On-Demand	Anodyne	DRD2	18	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCCn2cncn2)CC1	ZINC000875208037	EE	On-Demand	Anodyne	DRD2	18	42
O=C(NCC[C@H](O)C1CCCC1)NCC(=O)N1CCc2ccccc21	ZINC000875208074	ED	On-Demand	Anodyne	AVPR2	32	41
O=C(NCC[C@@H](O)C1CCCC1)NCC(=O)N1CCc2ccccc21	ZINC000875208075	ED	On-Demand	Anodyne	AVPR2	32	41
O=C(NCCn1cncn1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875208095	DD	On-Demand	Anodyne	HIS3	52	35
O=C(NCCn1cncn1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875208096	DD	On-Demand	Anodyne	HIS3	52	35
O=C(NCCn1cncn1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875208097	DD	On-Demand	Anodyne	HIS3	52	35
O=C(NCCn1cncn1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875208098	DD	On-Demand	Anodyne	HIS3	52	35
CN1CCN(C)[C@@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)C1	ZINC000875208182	FD	On-Demand	Anodyne	HTR1A	20	43
CN1CCN(C)[C@@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)C1	ZINC000875208182	FD	On-Demand	Anodyne	ACE	37	40
CN1CCN(C)[C@@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)C1	ZINC000875208182	FD	On-Demand	Anodyne	FKBP1A	20	41
CN1CCN(C)[C@@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)C1	ZINC000875208182	FD	On-Demand	Anodyne	DRD3	41	39
CN1CCN(C)[C@@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)C1	ZINC000875208182	FD	On-Demand	Anodyne	SIGMAR1	25	44
CN1CCN(C)[C@@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)C1	ZINC000875208182	FD	On-Demand	Anodyne	FAAH	53	38
CN1CCN(C)[C@@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)C1	ZINC000875208182	FD	On-Demand	Anodyne	CES1	48	33
CN1CCN(C)[C@@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)C1	ZINC000875208182	FD	On-Demand	Anodyne	AMP1_PLAFQ	22	43
CN1CCN(C)[C@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)C1	ZINC000875208183	FD	On-Demand	Anodyne	HTR1A	20	43
CN1CCN(C)[C@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)C1	ZINC000875208183	FD	On-Demand	Anodyne	ACE	37	40
CN1CCN(C)[C@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)C1	ZINC000875208183	FD	On-Demand	Anodyne	FKBP1A	20	41
CN1CCN(C)[C@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)C1	ZINC000875208183	FD	On-Demand	Anodyne	DRD3	41	39
CN1CCN(C)[C@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)C1	ZINC000875208183	FD	On-Demand	Anodyne	SIGMAR1	25	44
CN1CCN(C)[C@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)C1	ZINC000875208183	FD	On-Demand	Anodyne	FAAH	53	38
CN1CCN(C)[C@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)C1	ZINC000875208183	FD	On-Demand	Anodyne	CES1	48	33
CN1CCN(C)[C@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)C1	ZINC000875208183	FD	On-Demand	Anodyne	AMP1_PLAFQ	22	43
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H]1CCN(C)[C@@H](C)C1)CC2	ZINC000875208252	GD	On-Demand	Anodyne	SLC18A2	46	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H]1CCN(C)[C@H](C)C1)CC2	ZINC000875208253	GD	On-Demand	Anodyne	SLC18A2	46	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H]1CCN(C)[C@@H](C)C1)CC2	ZINC000875208254	GD	On-Demand	Anodyne	SLC18A2	46	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H]1CCN(C)[C@H](C)C1)CC2	ZINC000875208255	GD	On-Demand	Anodyne	SLC18A2	46	35
CC[C@@](C)(NC(=O)NCCn1cncn1)c1ccc(F)cc1	ZINC000875208307	DE	On-Demand	Anodyne	HIS3	42	31
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)NCCn1cncn1	ZINC000875208352	CC	On-Demand	Anodyne	HIS3	64	33
CN1CCN(C)[C@@H](CNC(=O)C(=O)N2CCN(c3ccc(F)cc3F)CC2)C1	ZINC000875208369	GB	On-Demand	Anodyne	SSTR1	20	40
CN1CCN(C)[C@H](CNC(=O)C(=O)N2CCN(c3ccc(F)cc3F)CC2)C1	ZINC000875208370	GB	On-Demand	Anodyne	SSTR1	20	40
CC[C@@H](NC(=O)NCCn1cncn1)[C@@H](O)c1ccccc1	ZINC000875208389	DD	On-Demand	Anodyne	HIS3	69	37
CC[C@@H](NC(=O)NCCn1cncn1)[C@H](O)c1ccccc1	ZINC000875208391	DD	On-Demand	Anodyne	HIS3	69	37
O=C(NCC1CC=CC1)C(=O)NCC1CCN(S(=O)(=O)C(F)(F)F)CC1	ZINC000875208401	GC	On-Demand	Anodyne	CACNA1I	56	34
CC(C)(C)OC(=O)N1CCC(N(C(=O)c2sccc2CC#N)C2CC2)CC1	ZINC000875208420	GH	On-Demand	Mild	GPR119	44	40
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)NCCn1cncn1	ZINC000875208433	EF	On-Demand	Anodyne	MDM2	59	31
O=C(NCC(=O)N1CCc2ccccc21)NC[C@H]1C[C@H](O)C1	ZINC000875208453	DC	On-Demand	Anodyne	AVPR2	35	42
CONC(=O)C1CCN(C(=O)NC[C@@H](C)c2c(Cl)cccc2Cl)CC1	ZINC000875208498	GG	On-Demand	Anodyne	EPHX2	26	45
CONC(=O)C1CCN(C(=O)NC[C@H](C)c2c(Cl)cccc2Cl)CC1	ZINC000875208499	GG	On-Demand	Anodyne	EPHX2	26	45
O=C(N[C@H](c1ccccc1)[C@@H]1CCCO1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875208547	FG	On-Demand	Anodyne	RBP4	48	34
O=C(N[C@H](c1ccccc1)[C@H]1CCCO1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875208548	FG	On-Demand	Anodyne	RBP4	48	34
O=C(N[C@H](c1ccccc1)[C@@H]1CCCO1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875208549	FG	On-Demand	Anodyne	RBP4	48	34
O=C(N[C@H](c1ccccc1)[C@H]1CCCO1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875208550	FG	On-Demand	Anodyne	RBP4	48	34
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@H](c1ccccc1)[C@H]1CCCO1	ZINC000875208559	EG	On-Demand	Anodyne	TIMP3	73	35
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@@H](c1ccccc1)[C@H]1CCCO1	ZINC000875208560	EG	On-Demand	Anodyne	TIMP3	73	35
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@@H](c1ccccc1)[C@@H]1CCCO1	ZINC000875208561	EG	On-Demand	Anodyne	TIMP3	73	35
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@H](c1ccccc1)[C@@H]1CCCO1	ZINC000875208562	EG	On-Demand	Anodyne	TIMP3	73	35
CC[C@H](C[C@H](C)O)NC(=O)NCCn1cncn1	ZINC000875208580	CC	On-Demand	Anodyne	HIS3	78	38
O=C(NCCn1cncn1)N1O[C@H]2C=C[C@H]1CC2	ZINC000875208595	BC	On-Demand	Anodyne	HIS3	44	35
O=C(N[C@H](c1ccccc1)[C@H]1CCCO1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875208630	GF	On-Demand	Anodyne	SMO	41	41
O=C(N[C@H](c1ccccc1)[C@H]1CCCO1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875208630	GF	On-Demand	Anodyne	ETHR	48	36
O=C(N[C@H](c1ccccc1)[C@H]1CCCO1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875208631	GF	On-Demand	Anodyne	SMO	41	41
O=C(N[C@H](c1ccccc1)[C@H]1CCCO1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875208631	GF	On-Demand	Anodyne	ETHR	48	36
O=C(N[C@H](c1ccccc1)[C@@H]1CCCO1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875208632	GF	On-Demand	Anodyne	SMO	41	41
O=C(N[C@H](c1ccccc1)[C@@H]1CCCO1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875208632	GF	On-Demand	Anodyne	ETHR	48	36
O=C(N[C@H](c1ccccc1)[C@@H]1CCCO1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875208633	GF	On-Demand	Anodyne	SMO	41	41
O=C(N[C@H](c1ccccc1)[C@@H]1CCCO1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875208633	GF	On-Demand	Anodyne	ETHR	48	36
C[C@@H](CNC(=O)N1CCC2(CCNC2=O)CC1)c1c(Cl)cccc1Cl	ZINC000875208669	GG	On-Demand	Anodyne	CACNA1H	63	36
CC[C@H](C[C@H](C)O)NC(=O)NCC(=O)N1CCc2ccccc21	ZINC000875208684	DD	On-Demand	Anodyne	AVPR2	24	40
C[C@H](CNC(=O)N1CCC(CO)(CO)CC1)c1c(Cl)cccc1Cl	ZINC000875208726	GF	On-Demand	Anodyne	CACNA1H	43	34
C[C@@H](CNC(=O)N1CCC(CO)(CO)CC1)c1c(Cl)cccc1Cl	ZINC000875208727	GF	On-Demand	Anodyne	CACNA1H	43	34
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1coc(-c2ccc(C)cc2)n1	ZINC000875208768	GF	On-Demand	Anodyne	SLC6A3	41	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1coc(-c2ccc(C)cc2)n1	ZINC000875208769	GF	On-Demand	Anodyne	SLC6A3	41	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)[C@H]1CCCO1	ZINC000875208823	FF	On-Demand	Anodyne	SLC6A4	20	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)[C@H]1CCCO1	ZINC000875208823	FF	On-Demand	Anodyne	SLC6A3	45	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)[C@@H]1CCCO1	ZINC000875208824	FF	On-Demand	Anodyne	SLC6A4	20	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)[C@@H]1CCCO1	ZINC000875208824	FF	On-Demand	Anodyne	SLC6A3	45	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)[C@@H]1CCCO1	ZINC000875208825	FF	On-Demand	Anodyne	SLC6A4	20	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)[C@@H]1CCCO1	ZINC000875208825	FF	On-Demand	Anodyne	SLC6A3	45	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)[C@H]1CCCO1	ZINC000875208826	FF	On-Demand	Anodyne	SLC6A4	20	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)[C@H]1CCCO1	ZINC000875208826	FF	On-Demand	Anodyne	SLC6A3	45	43
CCCCCCCNC(=O)C(=O)N[C@H]1CCN(C)[C@@H](C)C1	ZINC000875208863	CD	On-Demand	Mild	TPP2	19	40
CCCCCCCNC(=O)C(=O)N[C@H]1CCN(C)[C@@H](C)C1	ZINC000875208863	CD	On-Demand	Mild	ASAH1	50	33
CCCCCCCNC(=O)C(=O)N[C@H]1CCN(C)[C@H](C)C1	ZINC000875208864	CD	On-Demand	Mild	TPP2	19	40
CCCCCCCNC(=O)C(=O)N[C@H]1CCN(C)[C@H](C)C1	ZINC000875208864	CD	On-Demand	Mild	ASAH1	50	33
CCCCCCCNC(=O)C(=O)N[C@@H]1CCN(C)[C@@H](C)C1	ZINC000875208865	CD	On-Demand	Mild	TPP2	19	40
CCCCCCCNC(=O)C(=O)N[C@@H]1CCN(C)[C@@H](C)C1	ZINC000875208865	CD	On-Demand	Mild	ASAH1	50	33
CCCCCCCNC(=O)C(=O)N[C@@H]1CCN(C)[C@H](C)C1	ZINC000875208866	CD	On-Demand	Mild	TPP2	19	40
CCCCCCCNC(=O)C(=O)N[C@@H]1CCN(C)[C@H](C)C1	ZINC000875208866	CD	On-Demand	Mild	ASAH1	50	33
NC(=O)Cc1cccc2c1CCN(C(=O)N[C@H](c1ccccc1)[C@H]1CCCO1)C2	ZINC000875208991	GF	On-Demand	Anodyne	Q6PRC7_IXORI	59	38
NC(=O)Cc1cccc2c1CCN(C(=O)N[C@@H](c1ccccc1)[C@H]1CCCO1)C2	ZINC000875208992	GF	On-Demand	Anodyne	Q6PRC7_IXORI	59	38
NC(=O)Cc1cccc2c1CCN(C(=O)N[C@H](c1ccccc1)[C@@H]1CCCO1)C2	ZINC000875208993	GF	On-Demand	Anodyne	Q6PRC7_IXORI	59	38
NC(=O)Cc1cccc2c1CCN(C(=O)N[C@@H](c1ccccc1)[C@@H]1CCCO1)C2	ZINC000875208994	GF	On-Demand	Anodyne	Q6PRC7_IXORI	59	38
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NCCn1cncn1	ZINC000875209040	FD	On-Demand	Anodyne	SIGMAR1	16	43
CN1CCN(C2CCN(C(=O)N[C@H](c3ccccc3)[C@@H]3CCCO3)CC2)CC1	ZINC000875209145	GE	On-Demand	Anodyne	L3MBTL3	90	47
CN1CCN(C2CCN(C(=O)N[C@H](c3ccccc3)[C@H]3CCCO3)CC2)CC1	ZINC000875209146	GE	On-Demand	Anodyne	L3MBTL3	90	47
CN1CCN(C2CCN(C(=O)N[C@@H](c3ccccc3)[C@H]3CCCO3)CC2)CC1	ZINC000875209147	GE	On-Demand	Anodyne	L3MBTL3	90	47
CN1CCN(C2CCN(C(=O)N[C@@H](c3ccccc3)[C@@H]3CCCO3)CC2)CC1	ZINC000875209148	GE	On-Demand	Anodyne	L3MBTL3	90	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nccn1C(F)F	ZINC000875209232	ED	On-Demand	Anodyne	SLC6A3	52	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nccn1C(F)F	ZINC000875209233	ED	On-Demand	Anodyne	SLC6A3	52	39
O=C(NCCn1cncn1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875209303	DC	On-Demand	Anodyne	HIS3	40	35
O=C(NCCn1cncn1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875209304	DC	On-Demand	Anodyne	HIS3	40	35
O=C([C@@H](Cc1cccnc1)C1CCCC1)N(CC(F)(F)F)c1ccccn1	ZINC000875209363	GI	On-Demand	Anodyne	C3AR1	40	37
O=C([C@H](Cc1cccnc1)C1CCCC1)N(CC(F)(F)F)c1ccccn1	ZINC000875209364	GI	On-Demand	Anodyne	C3AR1	40	37
COC(=O)N1CCC[C@@H](NC(=O)NC[C@H]2c3ccccc3C(=O)N2C)C1	ZINC000875209365	FD	On-Demand	Anodyne	BIRC2	18	41
COC(=O)N1CCC[C@@H](NC(=O)NC[C@@H]2c3ccccc3C(=O)N2C)C1	ZINC000875209367	FD	On-Demand	Anodyne	BIRC2	18	41
COC(=O)N1CCC[C@H](NC(=O)NC[C@@H]2c3ccccc3C(=O)N2C)C1	ZINC000875209369	FD	On-Demand	Anodyne	BIRC2	18	41
COC(=O)N1CCC[C@H](NC(=O)NC[C@H]2c3ccccc3C(=O)N2C)C1	ZINC000875209370	FD	On-Demand	Anodyne	BIRC2	18	41
COC(=O)N1CCC[C@H](NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000875209410	FD	On-Demand	Anodyne	EPHX2	25	45
COC(=O)N1CCC[C@H](NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000875209410	FD	On-Demand	Anodyne	BIRC2	20	42
COC(=O)N1CCC[C@@H](NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000875209412	FD	On-Demand	Anodyne	EPHX2	25	45
COC(=O)N1CCC[C@@H](NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000875209412	FD	On-Demand	Anodyne	BIRC2	20	42
COC(=O)N1CCC[C@H](NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000875209414	FD	On-Demand	Anodyne	EPHX2	25	45
COC(=O)N1CCC[C@H](NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000875209414	FD	On-Demand	Anodyne	BIRC2	20	42
COc1ccccc1[C@H]1CCCN(C(=O)NCC[C@@H](C)OC)CC1	ZINC000875209432	EG	On-Demand	Anodyne	DRD2	22	44
COc1ccccc1[C@H]1CCCN(C(=O)NCC[C@@H](C)OC)CC1	ZINC000875209432	EG	On-Demand	Anodyne	DRD4	15	44
COc1ccccc1[C@H]1CCCN(C(=O)NCC[C@@H](C)OC)CC1	ZINC000875209432	EG	On-Demand	Anodyne	RBP4	36	40
COc1ccccc1[C@H]1CCCN(C(=O)NCC[C@H](C)OC)CC1	ZINC000875209434	EG	On-Demand	Anodyne	DRD2	22	44
COc1ccccc1[C@H]1CCCN(C(=O)NCC[C@H](C)OC)CC1	ZINC000875209434	EG	On-Demand	Anodyne	DRD4	15	44
COc1ccccc1[C@H]1CCCN(C(=O)NCC[C@H](C)OC)CC1	ZINC000875209434	EG	On-Demand	Anodyne	RBP4	36	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCC[C@@H](C)OC)CC1	ZINC000875209436	EG	On-Demand	Anodyne	DRD2	22	44
COc1ccccc1[C@@H]1CCCN(C(=O)NCC[C@@H](C)OC)CC1	ZINC000875209436	EG	On-Demand	Anodyne	DRD4	15	44
COc1ccccc1[C@@H]1CCCN(C(=O)NCC[C@@H](C)OC)CC1	ZINC000875209436	EG	On-Demand	Anodyne	RBP4	36	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCC[C@H](C)OC)CC1	ZINC000875209438	EG	On-Demand	Anodyne	DRD2	22	44
COc1ccccc1[C@@H]1CCCN(C(=O)NCC[C@H](C)OC)CC1	ZINC000875209438	EG	On-Demand	Anodyne	DRD4	15	44
COc1ccccc1[C@@H]1CCCN(C(=O)NCC[C@H](C)OC)CC1	ZINC000875209438	EG	On-Demand	Anodyne	RBP4	36	40
O=C1CCN(C(=O)NCc2cccc(OCC(F)F)c2)CCCCCCN1	ZINC000875209464	GF	On-Demand	Anodyne	HRH2	28	40
O=C1CCN(C(=O)NCc2cccc(OCC(F)F)c2)CCCCCCN1	ZINC000875209464	GF	On-Demand	Anodyne	DPP7	35	40
O=C1CCN(C(=O)NCc2cccc(OCC(F)F)c2)CCCCCCN1	ZINC000875209464	GF	On-Demand	Anodyne	PDS	64	37
O=C(NCCn1cncn1)N1OC2CCC1CC2	ZINC000875209472	CC	On-Demand	Anodyne	HIS3	44	33
CN(C)C[C@@H]1CN(C(=O)NCc2cccc(OCC(F)F)c2)C[C@H]1CN(C)C	ZINC000875209473	GE	On-Demand	Anodyne	PDS	94	41
COCCN(CC1CCN(C)CC1)C(=O)NCc1cccc(OCC(F)F)c1	ZINC000875209482	GF	On-Demand	Anodyne	ACKR3	50	30
COCCN(CC1CCN(C)CC1)C(=O)NCc1cccc(OCC(F)F)c1	ZINC000875209482	GF	On-Demand	Anodyne	PDS	72	36
O=C(NCCCNC(=O)c1ccc(Br)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875209518	GD	On-Demand	Anodyne	HDAC9	16	47
O=C(NCc1cccc(OCC(F)F)c1)N1CCC(CO)(CO)CC1	ZINC000875209537	FD	On-Demand	Anodyne	HRH2	25	40
O=C(NCc1cccc(OCC(F)F)c1)N1CCC(CO)(CO)CC1	ZINC000875209537	FD	On-Demand	Anodyne	PDS	96	42
COC(=O)N1CCC[C@@H](NC(=O)N[C@@](C)(CO)Cc2ccc(F)cc2)C1	ZINC000875209545	FD	On-Demand	Anodyne	CCR3	57	39
COC(=O)N1CCC[C@H](NC(=O)N[C@@](C)(CO)Cc2ccc(F)cc2)C1	ZINC000875209547	FD	On-Demand	Anodyne	CCR3	57	39
COC(=O)N1CCC[C@@H](NC(=O)N[C@](C)(CO)Cc2ccc(F)cc2)C1	ZINC000875209549	FD	On-Demand	Anodyne	CCR3	57	39
COC(=O)N1CCC[C@H](NC(=O)N[C@](C)(CO)Cc2ccc(F)cc2)C1	ZINC000875209550	FD	On-Demand	Anodyne	CCR3	57	39
CN1CCN(C2CCN(C(=O)C(=O)N[C@H]3CSc4ccccc43)CC2)CC1	ZINC000875209614	GD	On-Demand	Anodyne	L3MBTL3	76	42
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3CSc4ccccc43)CC2)CC1	ZINC000875209615	GD	On-Demand	Anodyne	L3MBTL3	76	42
CCN(CCNC(=O)N[C@@H](C)[C@@H](O)c1cc(OC)ccc1OC)C(C)C	ZINC000875209616	FE	On-Demand	Anodyne	MTNR1A	41	40
CCN(CCNC(=O)N[C@@H](C)[C@@H](O)c1cc(OC)ccc1OC)C(C)C	ZINC000875209616	FE	On-Demand	Anodyne	MTNR1B	34	40
CCN(CCNC(=O)N[C@H](C)[C@H](O)c1cc(OC)ccc1OC)C(C)C	ZINC000875209617	FE	On-Demand	Anodyne	MTNR1A	41	40
CCN(CCNC(=O)N[C@H](C)[C@H](O)c1cc(OC)ccc1OC)C(C)C	ZINC000875209617	FE	On-Demand	Anodyne	MTNR1B	34	40
CCN(CCNC(=O)N[C@@H](C)[C@H](O)c1cc(OC)ccc1OC)C(C)C	ZINC000875209618	FE	On-Demand	Anodyne	MTNR1A	41	40
CCN(CCNC(=O)N[C@@H](C)[C@H](O)c1cc(OC)ccc1OC)C(C)C	ZINC000875209618	FE	On-Demand	Anodyne	MTNR1B	34	40
CCN(CCNC(=O)N[C@H](C)[C@@H](O)c1cc(OC)ccc1OC)C(C)C	ZINC000875209619	FE	On-Demand	Anodyne	MTNR1A	41	40
CCN(CCNC(=O)N[C@H](C)[C@@H](O)c1cc(OC)ccc1OC)C(C)C	ZINC000875209619	FE	On-Demand	Anodyne	MTNR1B	34	40
Cc1c(NC(=O)C2([C@@H]3CCCCO3)CCC2)cccc1C(=O)N1CCOCC1	ZINC000875209634	GG	On-Demand	Anodyne	BTK	33	41
Cc1c(NC(=O)C2([C@H]3CCCCO3)CCC2)cccc1C(=O)N1CCOCC1	ZINC000875209635	GG	On-Demand	Anodyne	BTK	33	41
COc1ccc(N2CCC(NC(=O)N3CC[C@@H](c4ccc(O)cc4)C3)CC2)cc1	ZINC000875209656	GH	On-Demand	Clean	EPHX2	19	42
COc1ccc(N2CCC(NC(=O)N3CC[C@@H](c4ccc(O)cc4)C3)CC2)cc1	ZINC000875209656	GH	On-Demand	Clean	NPBWR1	49	31
COc1ccc(N2CCC(NC(=O)N3CC[C@H](c4ccc(O)cc4)C3)CC2)cc1	ZINC000875209657	GH	On-Demand	Clean	EPHX2	19	42
COc1ccc(N2CCC(NC(=O)N3CC[C@H](c4ccc(O)cc4)C3)CC2)cc1	ZINC000875209657	GH	On-Demand	Clean	NPBWR1	49	31
COc1ccc(N2CCC(NC(=O)NCCN3CC[C@H](O)C3)CC2)cc1	ZINC000875209663	FD	On-Demand	Clean	DRD4	50	42
COc1ccc(N2CCC(NC(=O)NCCN3CC[C@H](O)C3)CC2)cc1	ZINC000875209663	FD	On-Demand	Clean	DRD3	24	41
COc1ccc(N2CCC(NC(=O)NCCN3CC[C@H](O)C3)CC2)cc1	ZINC000875209663	FD	On-Demand	Clean	SIGMAR1	15	44
COc1ccc(N2CCC(NC(=O)NCCN3CC[C@H](O)C3)CC2)cc1	ZINC000875209663	FD	On-Demand	Clean	EPHX2	20	44
COc1ccc(N2CCC(NC(=O)NCCN3CC[C@H](O)C3)CC2)cc1	ZINC000875209663	FD	On-Demand	Clean	PDK1	41	34
COc1ccc(N2CCC(NC(=O)NCCN3CC[C@H](O)C3)CC2)cc1	ZINC000875209663	FD	On-Demand	Clean	MCHR1	26	47
COc1ccc(N2CCC(NC(=O)NCCN3CC[C@@H](O)C3)CC2)cc1	ZINC000875209664	FD	On-Demand	Clean	DRD4	50	42
COc1ccc(N2CCC(NC(=O)NCCN3CC[C@@H](O)C3)CC2)cc1	ZINC000875209664	FD	On-Demand	Clean	DRD3	24	41
COc1ccc(N2CCC(NC(=O)NCCN3CC[C@@H](O)C3)CC2)cc1	ZINC000875209664	FD	On-Demand	Clean	SIGMAR1	15	44
COc1ccc(N2CCC(NC(=O)NCCN3CC[C@@H](O)C3)CC2)cc1	ZINC000875209664	FD	On-Demand	Clean	EPHX2	20	44
COc1ccc(N2CCC(NC(=O)NCCN3CC[C@@H](O)C3)CC2)cc1	ZINC000875209664	FD	On-Demand	Clean	PDK1	41	34
COc1ccc(N2CCC(NC(=O)NCCN3CC[C@@H](O)C3)CC2)cc1	ZINC000875209664	FD	On-Demand	Clean	MCHR1	26	47
COc1ccc(N2CCC(NC(=O)N[C@]34C[C@@H]3COC4(C)C)CC2)cc1	ZINC000875209665	FF	On-Demand	Clean	EPHX2	23	42
COc1ccc(N2CCC(NC(=O)N[C@]34C[C@H]3COC4(C)C)CC2)cc1	ZINC000875209666	FF	On-Demand	Clean	EPHX2	23	42
COc1ccc(N2CCC(NC(=O)N[C@@]34C[C@@H]3COC4(C)C)CC2)cc1	ZINC000875209667	FF	On-Demand	Clean	EPHX2	23	42
COc1ccc(N2CCC(NC(=O)N[C@@]34C[C@H]3COC4(C)C)CC2)cc1	ZINC000875209668	FF	On-Demand	Clean	EPHX2	23	42
COc1ccc(N2CCC(NC(=O)N3CCN(c4nccnn4)CC3)CC2)cc1	ZINC000875209669	GD	On-Demand	Clean	NPBWR1	40	32
O=C(NCC(=O)N1CCc2ccccc2C1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875209687	GF	On-Demand	Anodyne	DPP8	18	44
CC[C@@H](NC(=O)NCC(=O)N1CCc2ccccc2C1)[C@@H](O)c1ccccc1	ZINC000875209697	GE	On-Demand	Anodyne	DPP8	19	44
CC[C@@H](NC(=O)NCC(=O)N1CCc2ccccc2C1)[C@H](O)c1ccccc1	ZINC000875209700	GE	On-Demand	Anodyne	DPP8	19	44
COc1ccc(N2CCC(NC(=O)N[C@H](CO)CCC(C)C)CC2)cc1	ZINC000875209706	FF	On-Demand	Clean	EPHX2	32	46
COc1ccc(N2CCC(NC(=O)N[C@@H](CO)CCC(C)C)CC2)cc1	ZINC000875209707	FF	On-Demand	Clean	EPHX2	32	46
COc1ccc(N2CCC(NC(=O)N3C[C@H]4C(=O)N(C)C(=O)[C@H]4C3)CC2)cc1	ZINC000875209726	GC	On-Demand	Clean	NPBWR1	45	31
O=C(CNC(=O)N1CCC[C@H](OC2CCC2)CC1)N1CCc2ccccc2C1	ZINC000875209740	GF	On-Demand	Anodyne	PREP	53	40
O=C(CNC(=O)N1CCC[C@H](OC2CCC2)CC1)N1CCc2ccccc2C1	ZINC000875209740	GF	On-Demand	Anodyne	DPP8	20	45
O=C(CNC(=O)N1CCC[C@@H](OC2CCC2)CC1)N1CCc2ccccc2C1	ZINC000875209741	GF	On-Demand	Anodyne	PREP	53	40
O=C(CNC(=O)N1CCC[C@@H](OC2CCC2)CC1)N1CCc2ccccc2C1	ZINC000875209741	GF	On-Demand	Anodyne	DPP8	20	45
CCO[C@H](C(=O)N(CC(F)(F)F)c1ccccn1)C1CCCC1	ZINC000875209742	EH	On-Demand	Anodyne	AMY2	47	33
CCO[C@@H](C(=O)N(CC(F)(F)F)c1ccccn1)C1CCCC1	ZINC000875209743	EH	On-Demand	Anodyne	AMY2	47	33
COc1ccc(N2CCC(NC(=O)NNc3cccc(C)n3)CC2)cc1	ZINC000875209750	FF	On-Demand	Reactive	EPHX2	18	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(C(=O)OC)C2)C1	ZINC000875209788	ED	On-Demand	Anodyne	BIRC2	20	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(C(=O)OC)C2)C1	ZINC000875209790	ED	On-Demand	Anodyne	BIRC2	20	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](c2ccccc2)[C@@H]2CCCO2)C1	ZINC000875209814	FF	On-Demand	Anodyne	Q6PRC7_IXORI	62	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](c2ccccc2)[C@@H]2CCCO2)C1	ZINC000875209816	FF	On-Demand	Anodyne	Q6PRC7_IXORI	62	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](c2ccccc2)[C@H]2CCCO2)C1	ZINC000875209817	FF	On-Demand	Anodyne	Q6PRC7_IXORI	62	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](c2ccccc2)[C@H]2CCCO2)C1	ZINC000875209818	FF	On-Demand	Anodyne	Q6PRC7_IXORI	62	34
CO[C@@H](C)CCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875209853	EG	On-Demand	Reactive	TSHR	42	33
CO[C@@H](C)CCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875209853	EG	On-Demand	Reactive	MAOB	22	45
CO[C@@H](C)CCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875209853	EG	On-Demand	Reactive	LTA4H	39	51
CO[C@@H](C)CCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875209853	EG	On-Demand	Reactive	CTSK	19	46
CO[C@@H](C)CCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875209853	EG	On-Demand	Reactive	SCN2A	16	44
CO[C@@H](C)CCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875209853	EG	On-Demand	Reactive	CAPN2	45	35
CO[C@@H](C)CCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875209853	EG	On-Demand	Reactive	ACE2	20	40
CO[C@@H](C)CCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875209853	EG	On-Demand	Reactive	FFAR1	35	40
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCN(c3cc(Cl)ccc3C)C2)C1	ZINC000875209886	GD	On-Demand	Anodyne	CACNA1I	51	35
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCN(c3cc(Cl)ccc3C)C2)C1	ZINC000875209887	GD	On-Demand	Anodyne	CACNA1I	51	35
CN1CCN(C)[C@H](CNC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000875209900	FC	On-Demand	Anodyne	OXTR	64	40
CN1CCN(C)[C@@H](CNC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000875209903	FC	On-Demand	Anodyne	OXTR	64	40
CN1CCN(C)[C@H](CNC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000875209905	FC	On-Demand	Anodyne	OXTR	64	40
CN1CCN(C)[C@@H](CNC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000875209907	FC	On-Demand	Anodyne	OXTR	64	40
CCN(CCNC(=O)Nc1cnn(C2CCN(C)CC2)c1)C(C)C	ZINC000875209918	EE	On-Demand	Anodyne	DOT1L	40	30
O=C(N[C@H](c1ccccc1)[C@@H]1CCCO1)N1CCC(CO)(CO)CC1	ZINC000875209919	ED	On-Demand	Anodyne	SMO	20	40
CCCCCCCNC(=O)C(=O)NCc1ccn(C(C)C)n1	ZINC000875209920	DE	On-Demand	Mild	ASAH1	99	40
O=C(N[C@H](c1ccccc1)[C@H]1CCCO1)N1CCC(CO)(CO)CC1	ZINC000875209921	ED	On-Demand	Anodyne	SMO	20	40
O=C(N[C@@H](c1ccccc1)[C@@H]1CCCO1)N1CCC(CO)(CO)CC1	ZINC000875209923	ED	On-Demand	Anodyne	SMO	20	40
O=C(N[C@@H](c1ccccc1)[C@H]1CCCO1)N1CCC(CO)(CO)CC1	ZINC000875209925	ED	On-Demand	Anodyne	SMO	20	40
CCN(CCNC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O)C(C)C	ZINC000875209990	FD	On-Demand	Anodyne	GPR119	28	41
CCN(CCNC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O)C(C)C	ZINC000875209992	FD	On-Demand	Anodyne	GPR119	28	41
CCN(CCNC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O)C(C)C	ZINC000875209994	FD	On-Demand	Anodyne	GPR119	28	41
CCN(CCNC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O)C(C)C	ZINC000875209996	FD	On-Demand	Anodyne	GPR119	28	41
COc1cccc(C(C)(C)C(=O)Nc2cccc(C(=O)N3CCOCC3)c2C)c1	ZINC000875209998	GG	On-Demand	Anodyne	NPY2R	25	41
CC[C@@H](NC(=O)NCc1nc(C)c2ccccc2n1)[C@@H](O)c1ccccc1	ZINC000875210060	FG	On-Demand	Anodyne	TACR3	62	41
CC[C@@H](NC(=O)NCc1nc(C)c2ccccc2n1)[C@H](O)c1ccccc1	ZINC000875210061	FG	On-Demand	Anodyne	TACR3	62	41
COc1ccc(N2CCC(NC(=O)N3CCCC(F)(F)CC3)CC2)cc1	ZINC000875210062	FG	On-Demand	Clean	NPBWR1	42	28
COc1ccc(N2CCC(NC(=O)N3CC[C@H]4CC[C@@H](C3)S4)CC2)cc1	ZINC000875210081	GG	On-Demand	Clean	EPHX2	20	43
COc1ccc(N2CCC(NC(=O)N3OC4CCC3CC4)CC2)cc1	ZINC000875210082	EF	On-Demand	Clean	SIGMAR1	20	47
COc1ccc(N2CCC(NC(=O)N3OC4CCC3CC4)CC2)cc1	ZINC000875210082	EF	On-Demand	Clean	PDK1	40	35
COc1ccc(N2CCC(NC(=O)N3OC4CCC3CC4)CC2)cc1	ZINC000875210082	EF	On-Demand	Clean	MCHR1	21	43
COc1ccc(N2CCC(NC(=O)N(C)OCC(F)(F)F)CC2)cc1	ZINC000875210100	FF	On-Demand	Clean	MCHR1	21	41
Cc1nc(CNC(=O)N2CCC(CO)(CO)CC2)nc2ccccc12	ZINC000875210101	ED	On-Demand	Anodyne	SMO	29	41
O=C(CNC(=O)N1CC(CNC(=O)C(F)(F)F)C1)N1CCc2ccccc2C1	ZINC000875210114	GC	On-Demand	Anodyne	DPP8	18	43
COc1ccc(N2CCC(NC(=O)N3CCC(C(C)=O)CC3)CC2)cc1	ZINC000875210127	FF	On-Demand	Clean	EPHX2	35	46
COC(=O)N(C)NC(=O)NC[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875210128	ED	On-Demand	Reactive	DRD4	44	35
COC(=O)N(C)NC(=O)NC[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875210128	ED	On-Demand	Reactive	CCR3	18	40
COC(=O)N(C)NC(=O)NC[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875210128	ED	On-Demand	Reactive	MTNR1A	39	49
COC(=O)N(C)NC(=O)NC[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875210128	ED	On-Demand	Reactive	MTNR1B	33	49
COC(=O)N(C)NC(=O)NC[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875210129	ED	On-Demand	Reactive	DRD4	44	35
COC(=O)N(C)NC(=O)NC[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875210129	ED	On-Demand	Reactive	CCR3	18	40
COC(=O)N(C)NC(=O)NC[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875210129	ED	On-Demand	Reactive	MTNR1A	39	49
COC(=O)N(C)NC(=O)NC[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875210129	ED	On-Demand	Reactive	MTNR1B	33	49
COc1ccc(N2CCC(NC(=O)N3CCC(SC)CC3)CC2)cc1	ZINC000875210148	FG	On-Demand	Clean	EPHX2	26	45
COc1ccc(N2CCC(NC(=O)NC[C@@H](O)[C@@H]3CCCO3)CC2)cc1	ZINC000875210150	FD	On-Demand	Clean	EPHX2	17	41
COC(=O)N1CCC[C@@H](NC(=O)N[C@@H](CCO)c2ccc(Cl)c(F)c2)C1	ZINC000875210191	GE	On-Demand	Anodyne	MAPK1	60	38
COC(=O)N1CCC[C@@H](NC(=O)N[C@H](CCO)c2ccc(Cl)c(F)c2)C1	ZINC000875210192	GE	On-Demand	Anodyne	MAPK1	60	38
COC(=O)N1CCC[C@H](NC(=O)N[C@H](CCO)c2ccc(Cl)c(F)c2)C1	ZINC000875210193	GE	On-Demand	Anodyne	MAPK1	60	38
COC(=O)N1CCC[C@H](NC(=O)N[C@@H](CCO)c2ccc(Cl)c(F)c2)C1	ZINC000875210194	GE	On-Demand	Anodyne	MAPK1	60	38
O=C(NCc1nccn1C(F)F)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875210277	EF	On-Demand	Anodyne	EPHX2	18	41
O=C(NCc1nccn1C(F)F)N1CCC[C@H](OC2CCC2)CC1	ZINC000875210279	EF	On-Demand	Anodyne	EPHX2	18	41
CC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)[C@H]2CCCO2)CC1	ZINC000875210348	EF	On-Demand	Anodyne	L3MBTL3	48	33
CC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)[C@H]2CCCO2)CC1	ZINC000875210351	EF	On-Demand	Anodyne	L3MBTL3	48	33
CC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)[C@@H]2CCCO2)CC1	ZINC000875210353	EF	On-Demand	Anodyne	L3MBTL3	48	33
CC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)[C@@H]2CCCO2)CC1	ZINC000875210356	EF	On-Demand	Anodyne	L3MBTL3	48	33
CN1CCN(C)[C@H](CNC(=O)C(=O)N2CCN(c3ccc(C#N)cc3)CC2)C1	ZINC000875210386	GB	On-Demand	Mild	CTSK	16	53
CN1CCN(C)[C@H](CNC(=O)C(=O)N2CCN(c3ccc(C#N)cc3)CC2)C1	ZINC000875210386	GB	On-Demand	Mild	SSTR1	37	43
CN1CCN(C)[C@@H](CNC(=O)C(=O)N2CCN(c3ccc(C#N)cc3)CC2)C1	ZINC000875210387	GB	On-Demand	Mild	CTSK	16	53
CN1CCN(C)[C@@H](CNC(=O)C(=O)N2CCN(c3ccc(C#N)cc3)CC2)C1	ZINC000875210387	GB	On-Demand	Mild	SSTR1	37	43
COc1ccccc1[C@H]1CCCN(C(=O)NCc2nccn2C(F)F)CC1	ZINC000875210393	GH	On-Demand	Anodyne	EPHX2	17	43
CCN(CCNC(=O)NCCc1ccc(OC)c(O)c1)C(C)C	ZINC000875210396	DD	On-Demand	Anodyne	INHA	76	35
CCN(CCNC(=O)NCCc1ccc(OC)c(O)c1)C(C)C	ZINC000875210396	DD	On-Demand	Anodyne	MTNR1A	17	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2nccn2C(F)F)CC1	ZINC000875210398	GH	On-Demand	Anodyne	EPHX2	17	43
COc1ccc(N2CCC(NC(=O)NC[C@@H](O)[C@H]3CCCO3)CC2)cc1	ZINC000875210439	FD	On-Demand	Clean	EPHX2	17	41
COc1ccc(N2CCC(NC(=O)NC[C@H](O)[C@@H]3CCCO3)CC2)cc1	ZINC000875210442	FD	On-Demand	Clean	EPHX2	17	41
COc1ccc(N2CCC(NC(=O)NC[C@H](O)[C@H]3CCCO3)CC2)cc1	ZINC000875210444	FD	On-Demand	Clean	EPHX2	17	41
COc1ccc(N2CCC(NC(=O)N[C@H]3CCN(CC(C)(C)O)C3)CC2)cc1	ZINC000875210445	GD	On-Demand	Clean	DRD4	25	45
COc1ccc(N2CCC(NC(=O)N[C@H]3CCN(CC(C)(C)O)C3)CC2)cc1	ZINC000875210445	GD	On-Demand	Clean	SIGMAR1	21	47
COc1ccc(N2CCC(NC(=O)N[C@H]3CCN(CC(C)(C)O)C3)CC2)cc1	ZINC000875210445	GD	On-Demand	Clean	CCR3	24	42
COc1ccc(N2CCC(NC(=O)N[C@H]3CCN(CC(C)(C)O)C3)CC2)cc1	ZINC000875210445	GD	On-Demand	Clean	PDK1	40	33
COc1ccc(N2CCC(NC(=O)N[C@H]3CCN(CC(C)(C)O)C3)CC2)cc1	ZINC000875210445	GD	On-Demand	Clean	MCHR1	23	42
COc1ccc(N2CCC(NC(=O)N3CCN([S@@](C)(=N)=O)CC3)CC2)cc1	ZINC000875210447	GD	On-Demand	Clean	EPHX2	20	42
COc1ccc(N2CCC(NC(=O)N3CCN([S@@](C)(=N)=O)CC3)CC2)cc1	ZINC000875210447	GD	On-Demand	Clean	NPBWR1	59	32
COc1ccc(N2CCC(NC(=O)N3CCN([S@](C)(=N)=O)CC3)CC2)cc1	ZINC000875210448	GD	On-Demand	Clean	EPHX2	20	42
COc1ccc(N2CCC(NC(=O)N3CCN([S@](C)(=N)=O)CC3)CC2)cc1	ZINC000875210448	GD	On-Demand	Clean	NPBWR1	59	32
CN1CCN(C(=O)NCC(=O)N2CCc3ccccc3C2)CCC1(C)C	ZINC000875210449	FD	On-Demand	Anodyne	DPP8	19	45
COc1ccc(N2CCC(NC(=O)N3C[C@H]4COC[C@H]4C3)CC2)cc1	ZINC000875210450	ED	On-Demand	Clean	EPHX2	16	42
C=CC[C@H]1CCN(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000875210477	EG	On-Demand	Mild	EPHX2	17	44
C=CC[C@@H]1CCN(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000875210478	EG	On-Demand	Mild	EPHX2	17	44
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875210483	EE	On-Demand	Anodyne	DRD4	42	32
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875210483	EE	On-Demand	Anodyne	MTNR1A	20	48
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875210483	EE	On-Demand	Anodyne	MTNR1B	21	48
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875210485	EE	On-Demand	Anodyne	DRD4	42	32
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875210485	EE	On-Demand	Anodyne	MTNR1A	20	48
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875210485	EE	On-Demand	Anodyne	MTNR1B	21	48
COc1ccc(N2CCC(NC(=O)N3CCC[C@@H]3c3cncc(C)c3)CC2)cc1	ZINC000875210516	GH	On-Demand	Clean	SSTR5	28	40
COc1ccc(N2CCC(NC(=O)N3CCC[C@H]3c3cncc(C)c3)CC2)cc1	ZINC000875210517	GH	On-Demand	Clean	SSTR5	28	40
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCN(c3cccc(OC)c3)C2)C1	ZINC000875210530	GE	On-Demand	Anodyne	DRD4	42	34
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCN(c3cccc(OC)c3)C2)C1	ZINC000875210530	GE	On-Demand	Anodyne	CCKAR	49	33
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCN(c3cccc(OC)c3)C2)C1	ZINC000875210530	GE	On-Demand	Anodyne	MTNR1A	17	49
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCN(c3cccc(OC)c3)C2)C1	ZINC000875210530	GE	On-Demand	Anodyne	MTNR1B	22	49
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCN(c3cccc(OC)c3)C2)C1	ZINC000875210532	GE	On-Demand	Anodyne	DRD4	42	34
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCN(c3cccc(OC)c3)C2)C1	ZINC000875210532	GE	On-Demand	Anodyne	CCKAR	49	33
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCN(c3cccc(OC)c3)C2)C1	ZINC000875210532	GE	On-Demand	Anodyne	MTNR1A	17	49
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCN(c3cccc(OC)c3)C2)C1	ZINC000875210532	GE	On-Demand	Anodyne	MTNR1B	22	49
CCCCCCCNC(=O)C(=O)N[C@@H]1CCN(CC(F)(F)F)C1=O	ZINC000875210534	FD	On-Demand	Mild	ASAH1	90	36
CCCCCCCNC(=O)C(=O)N[C@@H]1CCN(CC(F)(F)F)C1=O	ZINC000875210534	FD	On-Demand	Mild	LASR	46	32
CCCCCCCNC(=O)C(=O)N[C@H]1CCN(CC(F)(F)F)C1=O	ZINC000875210535	FD	On-Demand	Mild	ASAH1	90	36
CCCCCCCNC(=O)C(=O)N[C@H]1CCN(CC(F)(F)F)C1=O	ZINC000875210535	FD	On-Demand	Mild	LASR	46	32
Cc1nc(CNC(=O)N2CCC3(CCN(C)CC3)CC2)nc2ccccc12	ZINC000875210543	FF	On-Demand	Anodyne	HTR3A	17	42
CC[C@H](C[C@H](C)O)NC(=O)NCc1nc(C)c2ccccc2n1	ZINC000875210551	DE	On-Demand	Anodyne	ANPEP	16	40
CC[C@H](C[C@H](C)O)NC(=O)NCc1nc(C)c2ccccc2n1	ZINC000875210551	DE	On-Demand	Anodyne	TACR3	49	37
COc1ccc(N2CCC(NC(=O)N(C3CC3)C3CC3)CC2)cc1	ZINC000875210556	EG	On-Demand	Clean	MCHR1	16	42
CCCCCCCNC(=O)C(=O)NC[C@H]1CN(C)CCN1C	ZINC000875210560	DC	On-Demand	Mild	ASAH1	55	33
CCCCCCCNC(=O)C(=O)NC[C@@H]1CN(C)CCN1C	ZINC000875210561	DC	On-Demand	Mild	ASAH1	55	33
COC(=O)N(C)NC(=O)NCCCNC(=O)c1ccc(Br)cc1	ZINC000875210568	GD	On-Demand	Reactive	HDAC9	15	44
CCN(CCNC(=O)NC1CN(c2ccncn2)C1)C(C)C	ZINC000875210574	DC	On-Demand	Anodyne	DOT1L	40	30
CO[C@@H](C)CCNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875210642	EF	On-Demand	Mild	CTSK	22	40
CO[C@@H](C)CCNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875210642	EF	On-Demand	Mild	CTSL	23	41
CO[C@@H](C)CCNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875210642	EF	On-Demand	Mild	CTSS	16	41
CO[C@@H](C)CCNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875210643	EF	On-Demand	Mild	CTSK	22	40
CO[C@@H](C)CCNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875210643	EF	On-Demand	Mild	CTSL	23	41
CO[C@@H](C)CCNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875210643	EF	On-Demand	Mild	CTSS	16	41
CO[C@@H](C)CCNC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875210657	DE	On-Demand	Anodyne	EPHX2	15	47
CO[C@@H](C)CCNC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875210658	DE	On-Demand	Anodyne	EPHX2	15	47
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCn1cncn1	ZINC000875210683	CC	On-Demand	Anodyne	SLC6A3	40	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCn1cncn1	ZINC000875210686	CC	On-Demand	Anodyne	SLC6A3	40	38
Cc1nc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)nc2ccccc12	ZINC000875210717	FH	On-Demand	Anodyne	EPHX2	28	41
Cc1nc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)nc2ccccc12	ZINC000875210717	FH	On-Demand	Anodyne	SMO	40	41
Cc1nc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)nc2ccccc12	ZINC000875210725	FH	On-Demand	Anodyne	EPHX2	28	41
Cc1nc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)nc2ccccc12	ZINC000875210725	FH	On-Demand	Anodyne	SMO	40	41
O=C(NCc1nc(-c2ccncc2)cs1)N[C@H](c1ccccc1)[C@@H]1CCCO1	ZINC000875210731	GH	On-Demand	Anodyne	ROCK1	23	45
O=C(NCc1nc(-c2ccncc2)cs1)N[C@H](c1ccccc1)[C@@H]1CCCO1	ZINC000875210731	GH	On-Demand	Anodyne	ROCK2	16	45
O=C(NCc1nc(-c2ccncc2)cs1)N[C@@H](c1ccccc1)[C@@H]1CCCO1	ZINC000875210734	GH	On-Demand	Anodyne	ROCK1	23	45
O=C(NCc1nc(-c2ccncc2)cs1)N[C@@H](c1ccccc1)[C@@H]1CCCO1	ZINC000875210734	GH	On-Demand	Anodyne	ROCK2	16	45
O=C(NCc1nc(-c2ccncc2)cs1)N[C@@H](c1ccccc1)[C@H]1CCCO1	ZINC000875210737	GH	On-Demand	Anodyne	ROCK1	23	45
O=C(NCc1nc(-c2ccncc2)cs1)N[C@@H](c1ccccc1)[C@H]1CCCO1	ZINC000875210737	GH	On-Demand	Anodyne	ROCK2	16	45
O=C(NCc1nc(-c2ccncc2)cs1)N[C@H](c1ccccc1)[C@H]1CCCO1	ZINC000875210741	GH	On-Demand	Anodyne	ROCK1	23	45
O=C(NCc1nc(-c2ccncc2)cs1)N[C@H](c1ccccc1)[C@H]1CCCO1	ZINC000875210741	GH	On-Demand	Anodyne	ROCK2	16	45
CN1CCN(C)[C@@H](CNC(=O)C(=O)NCC2(c3cccc(Cl)c3)CCC2)C1	ZINC000875210799	GD	On-Demand	Anodyne	CACNA1I	28	41
CN1CCN(C)[C@H](CNC(=O)C(=O)NCC2(c3cccc(Cl)c3)CCC2)C1	ZINC000875210807	GD	On-Demand	Anodyne	CACNA1I	28	41
COC(=O)C1=NO[C@]2(CCN(C(=O)NCc3cccc(OCC(F)F)c3)C2)C1	ZINC000875210814	GD	On-Demand	Anodyne	PDS	59	35
COC(=O)C1=NO[C@@]2(CCN(C(=O)NCc3cccc(OCC(F)F)c3)C2)C1	ZINC000875210826	GD	On-Demand	Anodyne	PDS	59	35
O=C(NCc1cccc(OCC(F)F)c1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875210829	FG	On-Demand	Anodyne	PDS	65	37
O=C(NCc1cccc(OCC(F)F)c1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875210831	GE	On-Demand	Anodyne	PDS	75	40
Cn1nc(Cl)c(C(=O)Nc2cccnc2N2CCOCC2)c1Cl	ZINC000875210839	FE	On-Demand	Anodyne	SCN10A	17	40
Cn1nc(Cl)c(C(=O)Nc2cccnc2N2CCOCC2)c1Cl	ZINC000875210839	FE	On-Demand	Anodyne	G2YM83_BOTF4	74	38
O=C(NCc1nccn1C(F)F)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875210845	FG	On-Demand	Anodyne	CPT1A	43	34
O=C(NCc1nccn1C(F)F)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875210846	FG	On-Demand	Anodyne	CPT1A	43	34
O=C(NCc1nccn1C(F)F)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875210847	FG	On-Demand	Anodyne	CPT1A	43	34
O=C(NCc1nccn1C(F)F)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875210848	FG	On-Demand	Anodyne	CPT1A	43	34
CC[C@@H]1COCCN1CCNC(=O)NC[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875210852	GD	On-Demand	Anodyne	DRD4	46	37
CC[C@@H]1COCCN1CCNC(=O)NC[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875210852	GD	On-Demand	Anodyne	MTNR1A	15	46
CC[C@@H]1COCCN1CCNC(=O)NC[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875210854	GD	On-Demand	Anodyne	DRD4	46	37
CC[C@@H]1COCCN1CCNC(=O)NC[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875210854	GD	On-Demand	Anodyne	MTNR1A	15	46
COc1ccc(N2CCC(NC(=O)NC[C@@H]3C[C@H](O)C3)CC2)cc1	ZINC000875210876	ED	On-Demand	Clean	EPHX2	52	47
COc1ccc(N2CCC(NC(=O)NC[C@H]3C[C@H](O)C3)CC2)cc1	ZINC000875210877	ED	On-Demand	Clean	EPHX2	52	47
COc1ccc(N2CCC(NC(=O)NCC3CC(O)C3)CC2)cc1	ZINC000875210878	ED	On-Demand	Clean	EPHX2	52	47
O=C(NCc1nc(-c2ccncc2)cs1)NC1(c2ccccc2)CCC1	ZINC000875210891	FI	On-Demand	Anodyne	ROCK1	24	50
O=C(NCc1nc(-c2ccncc2)cs1)NC1(c2ccccc2)CCC1	ZINC000875210891	FI	On-Demand	Anodyne	ROCK2	17	50
COc1ccc(N2CCC(NC(=O)N[C@@]34CCCC[C@@H]3C4)CC2)cc1	ZINC000875210893	EG	On-Demand	Clean	EPHX2	32	43
COc1ccc(N2CCC(NC(=O)N[C@@]34CCCC[C@H]3C4)CC2)cc1	ZINC000875210894	EG	On-Demand	Clean	EPHX2	32	43
COc1ccc(N2CCC(NC(=O)N[C@]34CCCC[C@@H]3C4)CC2)cc1	ZINC000875210895	EG	On-Demand	Clean	EPHX2	32	43
COc1ccc(N2CCC(NC(=O)N[C@]34CCCC[C@H]3C4)CC2)cc1	ZINC000875210896	EG	On-Demand	Clean	EPHX2	32	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(c2ccc(OC)cc2)CC1	ZINC000875210902	GE	On-Demand	Clean	SLC6A4	25	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(c2ccc(OC)cc2)CC1	ZINC000875210902	GE	On-Demand	Clean	SLC6A3	47	44
COc1ccc(N2CCC(NC(=O)N3Cc4cccc(O)c4C3)CC2)cc1	ZINC000875210903	FG	On-Demand	Clean	SSTR1	45	39
COc1ccc(N2CCC(NC(=O)N[C@@H]3COC[C@@H]3O)CC2)cc1	ZINC000875210908	EC	On-Demand	Clean	EPHX2	30	48
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(c4ccc(OC)cc4)CC3)C[C@@H]1C2	ZINC000875210914	GE	On-Demand	Clean	EPHX2	31	43
COc1ccc(N2CCC(NC(=O)N[C@@H]3COCC[C@H]3O)CC2)cc1	ZINC000875210929	ED	On-Demand	Clean	EPHX2	28	46
COc1ccc(N2CCC(NC(=O)N[C@@H]3COCC[C@H]3O)CC2)cc1	ZINC000875210929	ED	On-Demand	Clean	PDK1	44	31
COc1ccc(N2CCC(NC(=O)N[C@H]3CCOC[C@H]3O)CC2)cc1	ZINC000875210936	ED	On-Demand	Clean	EPHX2	22	46
COc1ccc(N2CCC(NC(=O)N[C@H]3CCOC[C@H]3O)CC2)cc1	ZINC000875210936	ED	On-Demand	Clean	PDK1	44	31
COc1ccc(N2CCC(NC(=O)N[C@@H]3CCOC[C@H]3O)CC2)cc1	ZINC000875210937	ED	On-Demand	Clean	EPHX2	22	46
COc1ccc(N2CCC(NC(=O)N[C@@H]3CCOC[C@H]3O)CC2)cc1	ZINC000875210937	ED	On-Demand	Clean	PDK1	44	31
COc1ccc(N2CCC(NC(=O)N[C@H]3CCOC[C@@H]3O)CC2)cc1	ZINC000875210938	ED	On-Demand	Clean	EPHX2	22	46
COc1ccc(N2CCC(NC(=O)N[C@H]3CCOC[C@@H]3O)CC2)cc1	ZINC000875210938	ED	On-Demand	Clean	PDK1	44	31
COc1ccc(N2CCC(NC(=O)N[C@@H]3CCOC[C@@H]3O)CC2)cc1	ZINC000875210939	ED	On-Demand	Clean	EPHX2	22	46
COc1ccc(N2CCC(NC(=O)N[C@@H]3CCOC[C@@H]3O)CC2)cc1	ZINC000875210939	ED	On-Demand	Clean	PDK1	44	31
O=C(NCC(=O)N1CCc2ccccc2C1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875210948	ED	On-Demand	Anodyne	DPP8	17	45
O=C(NCC(=O)N1CCc2ccccc2C1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875210949	ED	On-Demand	Anodyne	DPP8	17	45
O=C(NCC(=O)N1CCc2ccccc2C1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875210950	ED	On-Demand	Anodyne	DPP8	17	45
CN1CCN(C)[C@H](CNC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875210965	GC	On-Demand	Anodyne	CHRNA7	40	35
O=C(NCc1cccc(OCC(F)F)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875210966	GH	On-Demand	Anodyne	EPHX2	23	43
O=C(NCc1cccc(OCC(F)F)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875210966	GH	On-Demand	Anodyne	PDS	74	38
O=C(NCc1cccc(OCC(F)F)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875210967	GH	On-Demand	Anodyne	EPHX2	23	43
O=C(NCc1cccc(OCC(F)F)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875210967	GH	On-Demand	Anodyne	PDS	74	38
CN1CCN(C)[C@@H](CNC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875210970	GC	On-Demand	Anodyne	CHRNA7	40	35
CN1CCN(C)[C@@H](CNC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875210972	GC	On-Demand	Anodyne	CHRNA7	40	35
CN1CCN(C)[C@H](CNC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875210975	GC	On-Demand	Anodyne	CHRNA7	40	35
CN1CCN(c2ccncc2NC(=O)c2sccc2CC#N)CC1	ZINC000875210978	EE	On-Demand	Mild	CSF1R	23	40
CN1CCN(c2ccncc2NC(=O)c2sccc2CC#N)CC1	ZINC000875210978	EE	On-Demand	Mild	PIM3	16	44
CO[C@@H](C)CCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875211001	DD	On-Demand	Anodyne	ADRB1	25	42
CO[C@@H](C)CCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875211001	DD	On-Demand	Anodyne	ADRB3	27	42
CO[C@@H](C)CCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875211001	DD	On-Demand	Anodyne	CTSV	29	40
CO[C@@H](C)CCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875211003	DD	On-Demand	Anodyne	ADRB1	25	42
CO[C@@H](C)CCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875211003	DD	On-Demand	Anodyne	ADRB3	27	42
CO[C@@H](C)CCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875211003	DD	On-Demand	Anodyne	CTSV	29	40
COc1ccc(-c2noc(CCC(=O)OCCC(N)=O)n2)cc1	ZINC000875211013	DD	On-Demand	Anodyne	LUCI_PHOPE	15	40
O=C(NCc1cccc(OCC(F)F)c1)N1Cc2cccc(O)c2C1	ZINC000875211032	EG	On-Demand	Clean	PDS	82	39
Cn1nc(Cl)c(C(=O)Nc2ccccc2C(=O)NC(C)(C)C)c1Cl	ZINC000875211060	FH	On-Demand	Anodyne	G2YM83_BOTF4	46	34
COC(=O)N1CCC[C@H](NC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875211062	GF	On-Demand	Mild	LGMN	59	34
COC(=O)N1CCC[C@@H](NC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875211065	GF	On-Demand	Mild	LGMN	59	34
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1cnn(C(C)C)c1	ZINC000875211067	DF	On-Demand	Mild	ASAH1	97	39
COC(=O)N1CCC[C@H](NC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875211069	GF	On-Demand	Mild	LGMN	59	34
CCCCCCCNC(=O)C(=O)N[C@H](C)c1cnn(C(C)C)c1	ZINC000875211070	DF	On-Demand	Mild	ASAH1	97	39
COC(=O)N1CCC[C@@H](NC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875211071	GF	On-Demand	Mild	LGMN	59	34
COC(=O)N1CCC[C@H](NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)C1	ZINC000875211098	FD	On-Demand	Anodyne	EPHX2	21	44
COC(=O)N1CCC[C@H](NC(=O)N2CCC[C@](O)(c3ccccc3)C2)C1	ZINC000875211100	FD	On-Demand	Anodyne	EPHX2	21	44
O=C(NCc1cccc(OCC(F)F)c1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875211103	GF	On-Demand	Anodyne	PDS	76	40
O=C(NCc1cccc(OCC(F)F)c1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875211104	GF	On-Demand	Anodyne	PDS	76	40
O=C(NCC(=O)N1CCc2ccccc2C1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875211239	ED	On-Demand	Anodyne	DPP8	17	45
Cc1nc(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)nc2ccccc12	ZINC000875211240	DF	On-Demand	Anodyne	TNKS	40	31
Cc1nc(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)nc2ccccc12	ZINC000875211241	DF	On-Demand	Anodyne	TNKS	40	31
Cc1nc(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)nc2ccccc12	ZINC000875211242	DF	On-Demand	Anodyne	TNKS	40	31
Cc1nc(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)nc2ccccc12	ZINC000875211243	DF	On-Demand	Anodyne	TNKS	40	31
COc1ccc(N2CCC(NC(=O)N3CCC(C)(F)CC3)CC2)cc1	ZINC000875211252	EG	On-Demand	Clean	EPHX2	21	42
CCC1(N(C)C)CCN(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)CC1	ZINC000875211253	GG	On-Demand	Clean	EPHX2	17	44
COc1ccc(N2CCC(NC(=O)N3CC[C@@H]4CC[C@@H](O)[C@@H]43)CC2)cc1	ZINC000875211254	FE	On-Demand	Clean	EPHX2	15	42
O=C(CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)N1CCc2ccccc2C1	ZINC000875211263	GE	On-Demand	Anodyne	PREP	61	38
O=C(CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)N1CCc2ccccc2C1	ZINC000875211263	GE	On-Demand	Anodyne	DPP8	29	46
O=C(CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)N1CCc2ccccc2C1	ZINC000875211264	GE	On-Demand	Anodyne	PREP	61	38
O=C(CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)N1CCc2ccccc2C1	ZINC000875211264	GE	On-Demand	Anodyne	DPP8	29	46
O=C(CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)N1CCc2ccccc2C1	ZINC000875211265	GE	On-Demand	Anodyne	PREP	61	38
O=C(CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)N1CCc2ccccc2C1	ZINC000875211265	GE	On-Demand	Anodyne	DPP8	29	46
O=C(CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)N1CCc2ccccc2C1	ZINC000875211266	GE	On-Demand	Anodyne	PREP	61	38
O=C(CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)N1CCc2ccccc2C1	ZINC000875211266	GE	On-Demand	Anodyne	DPP8	29	46
O=C(CNC(=O)N1CCC[C@](O)(c2ccccc2)C1)N1CCc2ccccc2C1	ZINC000875211267	GE	On-Demand	Anodyne	DPP8	15	44
O=C(CNC(=O)N1CCC[C@@](O)(c2ccccc2)C1)N1CCc2ccccc2C1	ZINC000875211268	GE	On-Demand	Anodyne	DPP8	15	44
O=C(CNC(=O)N1Cc2cccc(O)c2C1)N1CCc2ccccc2C1	ZINC000875211273	FE	On-Demand	Clean	DRD5	21	41
O=C(CNC(=O)N1Cc2cccc(O)c2C1)N1CCc2ccccc2C1	ZINC000875211273	FE	On-Demand	Clean	PREP	21	44
O=C(CNC(=O)N1Cc2cccc(O)c2C1)N1CCc2ccccc2C1	ZINC000875211273	FE	On-Demand	Clean	DPP8	26	49
O=C(CNC(=O)N1CCO[C@H](C(F)(F)F)CC1)N1CCc2ccccc2C1	ZINC000875211277	GD	On-Demand	Anodyne	DPP8	16	42
O=C(CNC(=O)N1CCO[C@@H](C(F)(F)F)CC1)N1CCc2ccccc2C1	ZINC000875211278	GD	On-Demand	Anodyne	DPP8	16	42
COc1ccc(N2CCC(NC(=O)N3C[C@H]4CC=CC[C@H]4C3)CC2)cc1	ZINC000875211283	FG	On-Demand	Clean	EPHX2	15	42
COc1ccc(N2CCC(NC(=O)N3CCC(CCF)CC3)CC2)cc1	ZINC000875211288	FG	On-Demand	Clean	EPHX2	39	46
COc1ccc(N2CCC(NC(=O)N3CCC(CCF)CC3)CC2)cc1	ZINC000875211288	FG	On-Demand	Clean	MCHR1	17	45
CCOC1CC2(C1)C[C@@H]2NC(=O)NC1(c2ccccc2)CCC1	ZINC000875211289	DG	On-Demand	Anodyne	TIMP3	70	35
CCOC1CC2(C1)C[C@H]2NC(=O)NC1(c2ccccc2)CCC1	ZINC000875211290	DG	On-Demand	Anodyne	TIMP3	70	35
COc1ccc(N2CCC(NC(=O)N[C@@H]3CC=CC[C@H]3C(F)(F)F)CC2)cc1	ZINC000875211292	GH	On-Demand	Clean	EPHX2	41	38
O=C(NCc1cccc(OCC(F)F)c1)NC[C@H]1C[C@H](O)C1	ZINC000875211320	DD	On-Demand	Anodyne	PDS	98	43
COC(=O)C1(O)CN(C(=O)NCc2cccc(OCC(F)F)c2)C1	ZINC000875211321	EC	On-Demand	Anodyne	PDS	95	42
O=C(CNC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1)N1CCc2ccccc2C1	ZINC000875211337	GE	On-Demand	Anodyne	DPP8	20	44
CN1C[C@H](NC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CCC1=O	ZINC000875211390	FC	On-Demand	Anodyne	OXTR	57	36
CCCCCCCNC(=O)C(=O)N[C@H](C)c1csc(CC)n1	ZINC000875211391	EF	On-Demand	Mild	ASAH1	71	36
CN1C[C@@H](NC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CCC1=O	ZINC000875211392	FC	On-Demand	Anodyne	OXTR	57	36
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1csc(CC)n1	ZINC000875211393	EF	On-Demand	Mild	ASAH1	71	36
CN1C[C@H](NC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CCC1=O	ZINC000875211395	FC	On-Demand	Anodyne	OXTR	57	36
CN1C[C@@H](NC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CCC1=O	ZINC000875211397	FC	On-Demand	Anodyne	OXTR	57	36
COC(=O)N(C)NC(=O)NC1CCN(c2ccc(OC)cc2)CC1	ZINC000875211431	ED	On-Demand	Reactive	EPHX2	31	46
COC(=O)N(C)NC(=O)NC1CCN(c2ccc(OC)cc2)CC1	ZINC000875211431	ED	On-Demand	Reactive	MCHR1	15	42
COc1ccc(N2CCC(NC(=O)N3CCc4c(O)cccc4C3)CC2)cc1	ZINC000875211433	GG	On-Demand	Clean	DRD4	43	37
O=C1CCN(C(=O)NCC(=O)N2CCc3ccccc3C2)CCCCCCN1	ZINC000875211473	GD	On-Demand	Anodyne	DPP8	17	44
COc1ccc(N2CCC(NC(=O)N3C[C@@](C)(CO)[C@@](C)(CO)C3)CC2)cc1	ZINC000875211475	GD	On-Demand	Clean	EPHX2	21	44
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(OCC(F)F)c1	ZINC000875211495	EF	On-Demand	Anodyne	ANPEP	18	48
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(OCC(F)F)c1	ZINC000875211495	EF	On-Demand	Anodyne	ROCK2	20	40
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(OCC(F)F)c1	ZINC000875211495	EF	On-Demand	Anodyne	PDS	107	47
CCCOc1ccc(COC(=O)COCc2ccnc(O)c2)cc1	ZINC000875211524	EF	On-Demand	Anodyne	PLA2G4B	58	42
COc1ccc(N2CCC(NC(=O)N[C@@H]3C[C@H](CO)C3)CC2)cc1	ZINC000875211556	ED	On-Demand	Clean	SIGMAR1	15	46
COc1ccc(N2CCC(NC(=O)N[C@@H]3C[C@H](CO)C3)CC2)cc1	ZINC000875211556	ED	On-Demand	Clean	MTNR1A	15	41
COc1ccc(N2CCC(NC(=O)N[C@@H]3C[C@H](CO)C3)CC2)cc1	ZINC000875211556	ED	On-Demand	Clean	EPHX2	46	48
COc1ccc(N2CCC(NC(=O)NC3(C)COC3)CC2)cc1	ZINC000875211559	DD	On-Demand	Clean	EPHX2	37	44
COc1ccc(N2CCC(NC(=O)NC3(C)COC3)CC2)cc1	ZINC000875211559	DD	On-Demand	Clean	PDK1	44	31
COc1ccc(N2CCC(NC(=O)N3CC[C@H](C(C)(C)O)C3)CC2)cc1	ZINC000875211566	FE	On-Demand	Clean	EPHX2	27	44
CN1CCN(c2ccncc2NC(=O)c2c(Cl)nn(C)c2Cl)CC1	ZINC000875211567	FE	On-Demand	Anodyne	PIM3	17	46
COc1ccc(N2CCC(NC(=O)N3CC[C@@H](C(C)(C)O)C3)CC2)cc1	ZINC000875211568	FE	On-Demand	Clean	EPHX2	27	44
Cc1nc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)nc2ccccc12	ZINC000875211593	GG	On-Demand	Anodyne	TRY1_BOVIN	57	34
Cc1nc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)nc2ccccc12	ZINC000875211593	GG	On-Demand	Anodyne	PREP	28	40
COc1ccc(N2CCC(NC(=O)N[C@H](C)[C@H](O)C(F)(F)F)CC2)cc1	ZINC000875211594	GE	On-Demand	Clean	EPHX2	43	42
Cc1nc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)nc2ccccc12	ZINC000875211595	GG	On-Demand	Anodyne	TRY1_BOVIN	57	34
Cc1nc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)nc2ccccc12	ZINC000875211595	GG	On-Demand	Anodyne	PREP	28	40
COc1ccc(N2CCC(NC(=O)N[C@H](C)[C@@H](O)C(F)(F)F)CC2)cc1	ZINC000875211596	GE	On-Demand	Clean	EPHX2	43	42
Cc1nc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)nc2ccccc12	ZINC000875211597	GG	On-Demand	Anodyne	TRY1_BOVIN	57	34
Cc1nc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)nc2ccccc12	ZINC000875211597	GG	On-Demand	Anodyne	PREP	28	40
COc1ccc(N2CCC(NC(=O)N[C@@H](C)[C@H](O)C(F)(F)F)CC2)cc1	ZINC000875211598	GE	On-Demand	Clean	EPHX2	43	42
COc1ccc(N2CCC(NC(=O)N[C@@H](C)[C@@H](O)C(F)(F)F)CC2)cc1	ZINC000875211599	GE	On-Demand	Clean	EPHX2	43	42
Cc1nc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)nc2ccccc12	ZINC000875211600	GG	On-Demand	Anodyne	TRY1_BOVIN	57	34
Cc1nc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)nc2ccccc12	ZINC000875211600	GG	On-Demand	Anodyne	PREP	28	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nc(C)c2ccccc2n1	ZINC000875211616	FE	On-Demand	Anodyne	SLC6A3	50	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nc(C)c2ccccc2n1	ZINC000875211619	FE	On-Demand	Anodyne	SLC6A3	50	39
C[C@@H]1CN(C(=O)NCc2cccc(OCC(F)F)c2)CC[C@H](C(F)(F)F)O1	ZINC000875211622	GH	On-Demand	Anodyne	PDS	73	39
COc1ccc(N2CCC(NC(=O)N3Cc4cccc(OC)c4C3)CC2)cc1	ZINC000875211630	GG	On-Demand	Clean	SSTR1	67	43
C[C@@H]1CN(C(=O)NCc2cccc(OCC(F)F)c2)CC[C@@H](C(F)(F)F)O1	ZINC000875211636	GH	On-Demand	Anodyne	PDS	73	39
CN1C[C@H](NC(=O)C(=O)NCc2cccc3ncccc23)CCC1=O	ZINC000875211649	EC	On-Demand	Anodyne	P2RX7	44	44
CN1C[C@@H](NC(=O)C(=O)NCc2cccc3ncccc23)CCC1=O	ZINC000875211651	EC	On-Demand	Anodyne	P2RX7	44	44
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3cccc(OCC(F)F)c3)C[C@@H]1C2	ZINC000875211703	FE	On-Demand	Anodyne	PDS	75	39
COc1ccc(N2CCC(NC(=O)N(C)Cc3ccc4cc[nH]c4c3)CC2)cc1	ZINC000875211706	GH	On-Demand	Clean	MCHR1	16	41
COC(=O)N(C)NC(=O)NC[C@H]1CCN(c2cc(Cl)ccc2C)C1	ZINC000875211750	FE	On-Demand	Reactive	CACNA1I	66	36
COC(=O)N(C)NC(=O)NC[C@@H]1CCN(c2cc(Cl)ccc2C)C1	ZINC000875211752	FE	On-Demand	Reactive	CACNA1I	66	36
COC(=O)N(C)NC(=O)NCc1ccc(OC)cc1C(F)(F)F	ZINC000875211779	EE	On-Demand	Reactive	MTNR1A	54	37
COc1ccc(N2CCC(NC(=O)N3CCCN(C=O)CC3)CC2)cc1	ZINC000875211853	FD	On-Demand	Clean	NPBWR1	69	31
CC[C@H](C[C@H](C)O)NC(=O)NCC(=O)N1CCc2ccccc2C1	ZINC000875211859	ED	On-Demand	Anodyne	DPP8	19	45
COc1ccc(N2CCC(NC(=O)N3CC(c4ccccc4)C3)CC2)cc1	ZINC000875211875	FG	On-Demand	Clean	SIGMAR1	21	46
COc1ccc(N2CCC(NC(=O)N3CC(c4ccccc4)C3)CC2)cc1	ZINC000875211875	FG	On-Demand	Clean	EPHX2	33	48
COc1ccc(N2CCC(NC(=O)N3CC(c4ccccc4)C3)CC2)cc1	ZINC000875211875	FG	On-Demand	Clean	MCHR1	20	43
COc1ccc(N2CCC(NC(=O)N3CC(c4ccccc4)C3)CC2)cc1	ZINC000875211875	FG	On-Demand	Clean	NPBWR1	46	31
Cc1nnc(NNC(=O)NCc2cccc(OCC(F)F)c2)n1C	ZINC000875211877	ED	On-Demand	Reactive	PDS	88	40
O=C(NCC[C@@H](O)C1CCCC1)NCC(=O)N1CCc2ccccc2C1	ZINC000875211899	FD	On-Demand	Anodyne	DPP8	21	44
O=C(NCC[C@H](O)C1CCCC1)NCC(=O)N1CCc2ccccc2C1	ZINC000875211901	FD	On-Demand	Anodyne	DPP8	21	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(OCC(F)F)c1	ZINC000875211925	FF	On-Demand	Anodyne	SLC6A4	30	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(OCC(F)F)c1	ZINC000875211925	FF	On-Demand	Anodyne	SLC6A3	61	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(OCC(F)F)c1	ZINC000875211925	FF	On-Demand	Anodyne	PDS	78	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(OCC(F)F)c1	ZINC000875211926	FF	On-Demand	Anodyne	SLC6A4	30	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(OCC(F)F)c1	ZINC000875211926	FF	On-Demand	Anodyne	SLC6A3	61	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(OCC(F)F)c1	ZINC000875211926	FF	On-Demand	Anodyne	PDS	78	39
CC(=O)C1CCN(C(=O)C(=O)N[C@H](Cn2cccn2)c2ccccc2)CC1	ZINC000875211945	FD	On-Demand	Anodyne	CCR5	26	41
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](Cn2cccn2)c2ccccc2)CC1	ZINC000875211946	FD	On-Demand	Anodyne	CCR5	26	41
Cc1nc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)nc2ccccc12	ZINC000875211947	GH	On-Demand	Anodyne	CPT1A	40	33
Cc1nc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)nc2ccccc12	ZINC000875211949	GH	On-Demand	Anodyne	CPT1A	40	33
Cc1nc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)nc2ccccc12	ZINC000875211954	GH	On-Demand	Anodyne	CPT1A	40	33
Cc1nc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)nc2ccccc12	ZINC000875211956	GH	On-Demand	Anodyne	CPT1A	40	33
COC(=O)N1CCC[C@H](NC(=O)N[C@@](C)(CO)Cc2ccccc2F)C1	ZINC000875211970	FD	On-Demand	Anodyne	BIRC2	29	40
COC(=O)N1CCC[C@@H](NC(=O)N[C@](C)(CO)Cc2ccccc2F)C1	ZINC000875211971	FD	On-Demand	Anodyne	BIRC2	29	40
COC(=O)N1CCC[C@H](NC(=O)N[C@](C)(CO)Cc2ccccc2F)C1	ZINC000875211972	FD	On-Demand	Anodyne	BIRC2	29	40
COC(=O)N1CCC[C@@H](NC(=O)N[C@@](C)(CO)Cc2ccccc2F)C1	ZINC000875211973	FD	On-Demand	Anodyne	BIRC2	29	40
COc1ccc(N2CCC(NC(=O)N3CCO[C@H](CCF)C3)CC2)cc1	ZINC000875211999	FE	On-Demand	Clean	PDK1	40	33
COc1ccc(N2CCC(NC(=O)N3CCO[C@@H](CCF)C3)CC2)cc1	ZINC000875212003	FE	On-Demand	Clean	PDK1	40	33
CO[C@@H](C)CCNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875212009	EE	On-Demand	Mild	ITK	17	50
CO[C@@H](C)CCNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875212009	EE	On-Demand	Mild	PANC	41	36
COc1ccc(N2CCC(NC(=O)N[C@@H]3CCO[C@H]3c3cc[nH]n3)CC2)cc1	ZINC000875212040	GE	On-Demand	Clean	PDK1	44	33
CCN(CCNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)C(C)C	ZINC000875212042	FF	On-Demand	Mild	ITK	16	51
CC(C)n1ccc(CNC(=O)C(=O)N2CCN(c3ccc(F)cc3F)CC2)n1	ZINC000875212070	GD	On-Demand	Anodyne	NPY2R	71	37
CC(C)n1ccc(CNC(=O)C(=O)N[C@H](C)c2ccc(C(F)(F)F)nc2)n1	ZINC000875212122	GE	On-Demand	Anodyne	TRPV1	41	31
CC(C)n1ccc(CNC(=O)C(=O)N[C@@H](C)c2ccc(C(F)(F)F)nc2)n1	ZINC000875212123	GE	On-Demand	Anodyne	TRPV1	41	31
CCOC(=O)[C@H](C)C1CN(C(=O)NCC(=O)N2CCc3ccccc3C2)C1	ZINC000875212180	FD	On-Demand	Anodyne	ACE	21	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCC(=O)N2CCc3ccccc3C2)C1	ZINC000875212180	FD	On-Demand	Anodyne	DPP8	25	45
CCOC(=O)[C@H](C)C1CN(C(=O)NCC(=O)N2CCc3ccccc3C2)C1	ZINC000875212180	FD	On-Demand	Anodyne	NOD2	40	39
COc1ccc(N2CCC(NC(=O)NCc3conc3C)CC2)cc1	ZINC000875212188	EE	On-Demand	Clean	EPHX2	20	42
COC(=O)C1(O)CN(C(=O)NCC(=O)N2CCc3ccccc3C2)C1	ZINC000875212202	EB	On-Demand	Anodyne	DPP8	18	45
Cc1nc(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)nc2ccccc12	ZINC000875212204	GF	On-Demand	Anodyne	PDS	56	38
Cc1nc(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)nc2ccccc12	ZINC000875212205	GF	On-Demand	Anodyne	PDS	56	38
COc1ccc(N2CCC(NC(=O)N3CC(NS(C)(=O)=O)C3)CC2)cc1	ZINC000875212215	GC	On-Demand	Clean	MMP13	36	43
COc1ccc(N2CCC(NC(=O)N3CC(NS(C)(=O)=O)C3)CC2)cc1	ZINC000875212215	GC	On-Demand	Clean	MMP2	17	43
COc1ccc(N2CCC(NC(=O)N3CC(NS(C)(=O)=O)C3)CC2)cc1	ZINC000875212215	GC	On-Demand	Clean	MMP3	36	43
COc1ccc(N2CCC(NC(=O)N3CC(NS(C)(=O)=O)C3)CC2)cc1	ZINC000875212215	GC	On-Demand	Clean	MMP1	31	43
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccc(OCC(F)F)c2)C1	ZINC000875212221	FF	On-Demand	Anodyne	PDS	96	43
COc1ccc(N2CCC(NC(=O)N3CCN(CCC#N)CC3)CC2)cc1	ZINC000875212231	FD	On-Demand	Mild	DRD4	47	39
O=CN1CCCN(C(=O)NCC(=O)N2CCc3ccccc3C2)CC1	ZINC000875212242	EC	On-Demand	Anodyne	DPP8	25	47
COc1ccc(N2CCC(NC(=O)NCc3ccc(O)c(Cl)c3)CC2)cc1	ZINC000875212245	GH	On-Demand	Clean	DRD4	43	36
COc1ccc(N2CCC(NC(=O)NCc3ccc(O)c(Cl)c3)CC2)cc1	ZINC000875212245	GH	On-Demand	Clean	SIGMAR1	15	45
COc1ccc(N2CCC(NC(=O)NCc3ccc(O)c(Cl)c3)CC2)cc1	ZINC000875212245	GH	On-Demand	Clean	EPHX2	24	42
COc1ccc(N2CCC(NC(=O)NCc3ccc(O)c(Cl)c3)CC2)cc1	ZINC000875212245	GH	On-Demand	Clean	PDK1	56	43
COc1ccc(N2CCC(NC(=O)NCc3ccc(O)c(Cl)c3)CC2)cc1	ZINC000875212245	GH	On-Demand	Clean	MCHR1	24	51
COc1ccc(N2CCC(NC(=O)NC3(C)CC(F)(F)C3)CC2)cc1	ZINC000875212271	FG	On-Demand	Clean	EPHX2	43	43
COc1ccc(N2CCC(NC(=O)N3CC=CC3)CC2)cc1	ZINC000875212280	DE	On-Demand	Clean	EPHX2	23	45
COC(=O)N1CCC[C@@H](NC(=O)Nc2cnn(C3CCN(C)CC3)c2)C1	ZINC000875212283	FD	On-Demand	Anodyne	MTOR	25	41
COC(=O)N1CCC[C@H](NC(=O)Nc2cnn(C3CCN(C)CC3)c2)C1	ZINC000875212284	FD	On-Demand	Anodyne	MTOR	25	41
COc1ccc(N2CCC(NC(=O)NCc3cc(C)ccc3O)CC2)cc1	ZINC000875212301	FG	On-Demand	Clean	EPHX2	26	42
COc1ccc(N2CCC(NC(=O)NCc3cc(C)ccc3O)CC2)cc1	ZINC000875212301	FG	On-Demand	Clean	PDK1	40	33
COC(=O)N1CCC[C@H](NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)C1	ZINC000875212302	GE	On-Demand	Anodyne	BIRC2	21	41
CONC(=O)C1CCN(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)CC1	ZINC000875212303	GD	On-Demand	Clean	EPHX2	33	44
COc1ccc(N2CCC(NC(=O)N3CCC(CO)(CO)CC3)CC2)cc1	ZINC000875212322	GD	On-Demand	Clean	EPHX2	23	43
COc1ccc(N2CCC(NC(=O)N3CC[C@H]4[C@@H](CCN4C)C3)CC2)cc1	ZINC000875212332	FE	On-Demand	Clean	EPHX2	20	44
COc1ccc(N2CCC(NC(=O)N3CC[C@@H]4[C@@H](CCN4C)C3)CC2)cc1	ZINC000875212333	FE	On-Demand	Clean	EPHX2	20	44
CCOC1CC2(C1)C[C@H]2C(=O)Nc1ccc(C)cc1-c1nc2ccccc2[nH]1	ZINC000875212334	GJ	On-Demand	Anodyne	STK33	47	34
COc1ccc(N2CCC(NC(=O)N3CC[C@@H]4[C@H](CCN4C)C3)CC2)cc1	ZINC000875212335	FE	On-Demand	Clean	EPHX2	20	44
COc1ccc(N2CCC(NC(=O)N3CC[C@H]4[C@H](CCN4C)C3)CC2)cc1	ZINC000875212337	FE	On-Demand	Clean	EPHX2	20	44
COc1ccc(N2CCC(NC(=O)NCCc3ccc(OC)c(O)c3)CC2)cc1	ZINC000875212344	GF	On-Demand	Clean	SSTR5	41	33
COc1ccc(N2CCC(NC(=O)NCCc3ccc(OC)c(O)c3)CC2)cc1	ZINC000875212344	GF	On-Demand	Clean	CCR3	23	42
COc1ccc(N2CCC(NC(=O)NCCc3ccc(OC)c(O)c3)CC2)cc1	ZINC000875212344	GF	On-Demand	Clean	MTNR1A	42	38
COc1ccc(N2CCC(NC(=O)NCCc3ccc(OC)c(O)c3)CC2)cc1	ZINC000875212344	GF	On-Demand	Clean	EPHX2	16	41
COc1ccc(N2CCC(NC(=O)NCCc3ccc(OC)c(O)c3)CC2)cc1	ZINC000875212344	GF	On-Demand	Clean	PDK1	42	37
COc1ccc(N2CCC(NC(=O)NCCc3ccc(OC)c(O)c3)CC2)cc1	ZINC000875212344	GF	On-Demand	Clean	MCHR1	22	46
O=C(NCc1cccc(OCC(F)F)c1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875212350	GG	On-Demand	Anodyne	PDS	69	39
O=C(NCc1cccc(OCC(F)F)c1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875212351	GG	On-Demand	Anodyne	PDS	69	39
COc1ccc(N2CCC(NC(=O)N3CCO[C@H](C(F)F)CC3)CC2)cc1	ZINC000875212368	GF	On-Demand	Clean	EPHX2	19	40
COc1ccc(N2CCC(NC(=O)N3CCO[C@@H](C(F)F)CC3)CC2)cc1	ZINC000875212369	GF	On-Demand	Clean	EPHX2	19	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC(=O)N1CCc2ccccc2C1	ZINC000875212377	FD	On-Demand	Anodyne	SLC6A3	43	40
COc1ccc(N2CCC(NC(=O)N[C@@H](C)c3ccccc3O)CC2)cc1	ZINC000875212379	FG	On-Demand	Clean	EPHX2	30	44
COc1ccc(N2CCC(NC(=O)N[C@@H](C)c3ccccc3O)CC2)cc1	ZINC000875212379	FG	On-Demand	Clean	PDK1	41	35
COc1ccc(N2CCC(NC(=O)N[C@@H](C)c3ccccc3O)CC2)cc1	ZINC000875212379	FG	On-Demand	Clean	MCHR1	17	40
COc1ccc(N2CCC(NC(=O)N[C@H](C)c3ccccc3O)CC2)cc1	ZINC000875212380	FG	On-Demand	Clean	EPHX2	30	44
COc1ccc(N2CCC(NC(=O)N[C@H](C)c3ccccc3O)CC2)cc1	ZINC000875212380	FG	On-Demand	Clean	PDK1	41	35
COc1ccc(N2CCC(NC(=O)N[C@H](C)c3ccccc3O)CC2)cc1	ZINC000875212380	FG	On-Demand	Clean	MCHR1	17	40
COc1ccc(N2CCC(NC(=O)N3[C@H]4CC[C@H]3[C@H](C)[C@H](O)C4)CC2)cc1	ZINC000875212397	FF	On-Demand	Clean	SLC6A3	27	41
COc1ccc(N2CCC(NC(=O)N3[C@H]4CC[C@H]3[C@H](C)[C@@H](O)C4)CC2)cc1	ZINC000875212398	FF	On-Demand	Clean	SLC6A3	27	41
COc1ccc(N2CCC(NC(=O)N3[C@H]4CC[C@H]3[C@@H](C)[C@H](O)C4)CC2)cc1	ZINC000875212403	FF	On-Demand	Clean	SLC6A3	27	41
COc1ccc(N2CCC(NC(=O)N3[C@H]4CC[C@H]3[C@@H](C)[C@@H](O)C4)CC2)cc1	ZINC000875212410	FF	On-Demand	Clean	SLC6A3	27	41
O=C(NCC(=O)N1CCc2ccccc2C1)NC[C@H]1C[C@H](O)C1	ZINC000875212416	DC	On-Demand	Anodyne	DPP8	23	47
COC(=O)N1CCC[C@H](NC(=O)N2CC(c3ccccc3)C2)C1	ZINC000875212422	DE	On-Demand	Anodyne	EPHX2	31	56
COC(=O)N1CCC[C@H](NC(=O)N2CC(c3ccccc3)C2)C1	ZINC000875212422	DE	On-Demand	Anodyne	ADAM10	28	40
COC(=O)N1CCC[C@H](NC(=O)N2CC(c3ccccc3)C2)C1	ZINC000875212422	DE	On-Demand	Anodyne	BIRC2	35	43
COC(=O)N(C)NC(=O)NCC(=O)N1CCc2ccccc2C1	ZINC000875212433	DC	On-Demand	Reactive	DPP8	23	46
COC(=O)N1CCC[C@H](NC(=O)NC2CC(Nc3ccccc3)C2)C1	ZINC000875212434	EE	On-Demand	Anodyne	EPHX2	35	43
COC(=O)N1CCC[C@H](NC(=O)NC2CC(Nc3ccccc3)C2)C1	ZINC000875212434	EE	On-Demand	Anodyne	BIRC2	26	46
COC(=O)N1CCC[C@H](NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)C1	ZINC000875212436	FE	On-Demand	Anodyne	BIRC2	26	41
COC(=O)N1CCC[C@H](NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)C1	ZINC000875212437	FE	On-Demand	Anodyne	BIRC2	26	41
COC(=O)N1CCC[C@H](NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)C1	ZINC000875212438	FE	On-Demand	Anodyne	BIRC2	26	41
COC(=O)N1CCC[C@H](NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)C1	ZINC000875212439	FE	On-Demand	Anodyne	BIRC2	26	41
CO[C@@H](C)CCNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875212441	EF	On-Demand	Anodyne	OPRL1	19	45
O=CN1CCCN(C(=O)NCc2cccc(OCC(F)F)c2)CC1	ZINC000875212450	ED	On-Demand	Anodyne	DPP7	32	41
O=CN1CCCN(C(=O)NCc2cccc(OCC(F)F)c2)CC1	ZINC000875212450	ED	On-Demand	Anodyne	PDS	94	41
O=C(NCCO)C1CCN(C(=O)NCc2cccc(OCC(F)F)c2)CC1	ZINC000875212454	GD	On-Demand	Anodyne	EPHX2	17	42
O=C(NCCO)C1CCN(C(=O)NCc2cccc(OCC(F)F)c2)CC1	ZINC000875212454	GD	On-Demand	Anodyne	PDS	65	37
COC(=O)N(C)NC(=O)NCc1nc(C)c2ccccc2n1	ZINC000875212477	DD	On-Demand	Reactive	TACR3	41	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875212522	GE	On-Demand	Anodyne	DRD4	41	32
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875212522	GE	On-Demand	Anodyne	SLC6A4	23	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875212522	GE	On-Demand	Anodyne	SLC6A3	40	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875212523	GE	On-Demand	Anodyne	DRD4	41	32
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875212523	GE	On-Demand	Anodyne	SLC6A4	23	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875212523	GE	On-Demand	Anodyne	SLC6A3	40	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875212524	GE	On-Demand	Anodyne	DRD4	41	32
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875212524	GE	On-Demand	Anodyne	SLC6A4	23	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875212524	GE	On-Demand	Anodyne	SLC6A3	40	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875212525	GE	On-Demand	Anodyne	DRD4	41	32
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875212525	GE	On-Demand	Anodyne	SLC6A4	23	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875212525	GE	On-Demand	Anodyne	SLC6A3	40	40
COc1ccc(N2CCC(NC(=O)N3CC[C@@](C)(C(F)(F)F)C3)CC2)cc1	ZINC000875212530	GH	On-Demand	Clean	EPHX2	47	37
COc1ccc(N2CCC(NC(=O)N3CC[C@](C)(C(F)(F)F)C3)CC2)cc1	ZINC000875212531	GH	On-Demand	Clean	EPHX2	47	37
COc1ccc(N2CCC(NC(=O)N3CC4(CCCO4)C3)CC2)cc1	ZINC000875212539	EE	On-Demand	Clean	NPBWR1	45	30
O=C(CNC(=O)N1CCC(CO)(CO)CC1)N1CCc2ccccc2C1	ZINC000875212541	FC	On-Demand	Anodyne	DPP8	21	48
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H]1CCC(=O)N(C)C1)CC2	ZINC000875212542	GC	On-Demand	Anodyne	SLC18A2	47	38
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H]1CCC(=O)N(C)C1)CC2	ZINC000875212543	GC	On-Demand	Anodyne	SLC18A2	47	38
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@H]1CCC(=O)N(C)C1)CC2	ZINC000875212544	GC	On-Demand	Anodyne	SLC18A2	47	38
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@@H]1CCC(=O)N(C)C1)CC2	ZINC000875212545	GC	On-Demand	Anodyne	SLC18A2	47	38
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCN(c3cccc(OC)c3)C2)C1	ZINC000875212558	FC	On-Demand	Anodyne	DRD4	43	34
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCN(c3cccc(OC)c3)C2)C1	ZINC000875212558	FC	On-Demand	Anodyne	MTNR1A	20	48
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCN(c3cccc(OC)c3)C2)C1	ZINC000875212558	FC	On-Demand	Anodyne	MTNR1B	22	48
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCN(c3cccc(OC)c3)C2)C1	ZINC000875212559	FC	On-Demand	Anodyne	DRD4	43	34
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCN(c3cccc(OC)c3)C2)C1	ZINC000875212559	FC	On-Demand	Anodyne	MTNR1A	20	48
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCN(c3cccc(OC)c3)C2)C1	ZINC000875212559	FC	On-Demand	Anodyne	MTNR1B	22	48
CCCCCCn1nc(C(=O)N2CCC(C(=O)NCCC)CC2)c2ccccc2c1=O	ZINC000875212566	IG	On-Demand	Anodyne	CNR2	17	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCCN(C(=O)OC)C1	ZINC000875212574	DD	On-Demand	Anodyne	RIR1_HHV11	45	35
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCCN(C(=O)OC)C1	ZINC000875212575	DD	On-Demand	Anodyne	RIR1_HHV11	45	35
CCO[C@@H](C(=O)Nc1ccc(C)cc1-c1nc2ccccc2[nH]1)C1CCOCC1	ZINC000875212582	GI	On-Demand	Anodyne	SHH	15	40
CCO[C@@H](C(=O)Nc1ccc(C)cc1-c1nc2ccccc2[nH]1)C1CCOCC1	ZINC000875212582	GI	On-Demand	Anodyne	STK33	41	36
COC(=O)N(C)NC(=O)NCc1cccc(OCC(F)F)c1	ZINC000875212589	DD	On-Demand	Reactive	ROCK1	22	40
COC(=O)N(C)NC(=O)NCc1cccc(OCC(F)F)c1	ZINC000875212589	DD	On-Demand	Reactive	ROCK2	29	40
COC(=O)N(C)NC(=O)NCc1cccc(OCC(F)F)c1	ZINC000875212589	DD	On-Demand	Reactive	PDS	101	44
NC(=O)c1cccc(CCNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875212661	FE	On-Demand	Anodyne	F2	49	39
NC(=O)c1cccc(CCNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875212661	FE	On-Demand	Anodyne	PLG	40	36
NC(=O)c1cccc(CCNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875212661	FE	On-Demand	Anodyne	PRSS1	40	38
NC(=O)c1cccc(CCNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875212661	FE	On-Demand	Anodyne	TRY1_BOVIN	53	37
NC(=O)c1cccc(CCNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875212661	FE	On-Demand	Anodyne	PREP	48	37
NC(=O)c1cccc(CCNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875212661	FE	On-Demand	Anodyne	ST14	42	36
NC(=O)c1cccc(CCNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875212661	FE	On-Demand	Anodyne	TMPRSS11D	65	36
NC(=O)c1cccc(CCNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875212662	FE	On-Demand	Anodyne	F2	49	39
NC(=O)c1cccc(CCNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875212662	FE	On-Demand	Anodyne	PLG	40	36
NC(=O)c1cccc(CCNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875212662	FE	On-Demand	Anodyne	PRSS1	40	38
NC(=O)c1cccc(CCNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875212662	FE	On-Demand	Anodyne	TRY1_BOVIN	53	37
NC(=O)c1cccc(CCNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875212662	FE	On-Demand	Anodyne	PREP	48	37
NC(=O)c1cccc(CCNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875212662	FE	On-Demand	Anodyne	ST14	42	36
NC(=O)c1cccc(CCNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875212662	FE	On-Demand	Anodyne	TMPRSS11D	65	36
NC(=O)c1cccc(CCNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875212663	FE	On-Demand	Anodyne	F2	49	39
NC(=O)c1cccc(CCNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875212663	FE	On-Demand	Anodyne	PLG	40	36
NC(=O)c1cccc(CCNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875212663	FE	On-Demand	Anodyne	PRSS1	40	38
NC(=O)c1cccc(CCNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875212663	FE	On-Demand	Anodyne	TRY1_BOVIN	53	37
NC(=O)c1cccc(CCNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875212663	FE	On-Demand	Anodyne	PREP	48	37
NC(=O)c1cccc(CCNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875212663	FE	On-Demand	Anodyne	ST14	42	36
NC(=O)c1cccc(CCNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875212663	FE	On-Demand	Anodyne	TMPRSS11D	65	36
NC(=O)c1cccc(CCNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875212664	FE	On-Demand	Anodyne	F2	49	39
NC(=O)c1cccc(CCNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875212664	FE	On-Demand	Anodyne	PLG	40	36
NC(=O)c1cccc(CCNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875212664	FE	On-Demand	Anodyne	PRSS1	40	38
NC(=O)c1cccc(CCNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875212664	FE	On-Demand	Anodyne	TRY1_BOVIN	53	37
NC(=O)c1cccc(CCNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875212664	FE	On-Demand	Anodyne	PREP	48	37
NC(=O)c1cccc(CCNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875212664	FE	On-Demand	Anodyne	ST14	42	36
NC(=O)c1cccc(CCNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875212664	FE	On-Demand	Anodyne	TMPRSS11D	65	36
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NCc3cc(C)ncn3)C2)c1	ZINC000875212812	GC	On-Demand	Anodyne	PDE8B	53	30
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NCc3cc(C)ncn3)C2)c1	ZINC000875212813	GC	On-Demand	Anodyne	PDE8B	53	30
CN1C[C@@H](NC(=O)C(=O)NCc2ccc(OC(F)F)cc2F)CCC1=O	ZINC000875212887	FC	On-Demand	Anodyne	P2RX7	57	41
CN1C[C@H](NC(=O)C(=O)NCc2ccc(OC(F)F)cc2F)CCC1=O	ZINC000875212888	FC	On-Demand	Anodyne	P2RX7	57	41
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@](=O)C(C)(C)C	ZINC000875212926	FE	On-Demand	Anodyne	MME	40	37
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@](=O)C(C)(C)C	ZINC000875212926	FE	On-Demand	Anodyne	MMP3	47	38
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@](=O)C(C)(C)C	ZINC000875212926	FE	On-Demand	Anodyne	CAPN2	72	39
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@@](=O)C(C)(C)C	ZINC000875212927	FE	On-Demand	Anodyne	MME	40	37
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@@](=O)C(C)(C)C	ZINC000875212927	FE	On-Demand	Anodyne	MMP3	47	38
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@@](=O)C(C)(C)C	ZINC000875212927	FE	On-Demand	Anodyne	CAPN2	72	39
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@](=O)C(C)(C)C	ZINC000875212928	FE	On-Demand	Anodyne	MME	40	37
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@](=O)C(C)(C)C	ZINC000875212928	FE	On-Demand	Anodyne	MMP3	47	38
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@](=O)C(C)(C)C	ZINC000875212928	FE	On-Demand	Anodyne	CAPN2	72	39
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@@](=O)C(C)(C)C	ZINC000875212929	FE	On-Demand	Anodyne	MME	40	37
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@@](=O)C(C)(C)C	ZINC000875212929	FE	On-Demand	Anodyne	MMP3	47	38
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCC[S@@](=O)C(C)(C)C	ZINC000875212929	FE	On-Demand	Anodyne	CAPN2	72	39
COCCN(CC1CCN(C)CC1)C(=O)NCCc1cccc(C(N)=O)c1	ZINC000875213189	GD	On-Demand	Anodyne	ACKR3	57	32
COc1ccc(N2CCN(C(=O)C(=O)NCc3cc(C)ncn3)CC2)c(OC)c1	ZINC000875213191	GC	On-Demand	Clean	PDGFRB	64	38
CCCCCCCNC(=O)C(=O)N[C@@H]1CCC(=O)N(C)C1	ZINC000875213248	CC	On-Demand	Mild	ASAH1	92	38
CCCCCCCNC(=O)C(=O)N[C@@H]1CCC(=O)N(C)C1	ZINC000875213248	CC	On-Demand	Mild	LASR	46	32
CCCCCCCNC(=O)C(=O)N[C@H]1CCC(=O)N(C)C1	ZINC000875213249	CC	On-Demand	Mild	ASAH1	92	38
CCCCCCCNC(=O)C(=O)N[C@H]1CCC(=O)N(C)C1	ZINC000875213249	CC	On-Demand	Mild	LASR	46	32
CN1C[C@@H](NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)CCC1=O	ZINC000875213309	FD	On-Demand	Anodyne	C3AR1	40	40
CN1C[C@H](NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)CCC1=O	ZINC000875213310	FD	On-Demand	Anodyne	C3AR1	40	40
CN1C[C@@H](NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)CCC1=O	ZINC000875213311	FD	On-Demand	Anodyne	C3AR1	40	40
CN1C[C@H](NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)CCC1=O	ZINC000875213312	FD	On-Demand	Anodyne	C3AR1	40	40
CCOC1CC2(C1)C[C@@H]2NC(=O)NC1(c2ccccc2)CC1	ZINC000875213321	DF	On-Demand	Anodyne	TIMP3	71	34
CCOC1CC2(C1)C[C@H]2NC(=O)NC1(c2ccccc2)CC1	ZINC000875213322	DF	On-Demand	Anodyne	TIMP3	71	34
O=C(NCCc1cccc(O)c1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875213328	FG	On-Demand	Anodyne	SMO	39	44
O=C(NCCc1cccc(O)c1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875213328	FG	On-Demand	Anodyne	ETHR	64	45
CCC1(CC)CCCN1C(=O)NCCc1cccc(C(N)=O)c1	ZINC000875213338	DF	On-Demand	Anodyne	SLC12A5	57	34
COc1cccc(C(C)(C)C(=O)Nc2cccc(Cl)c2OC)c1	ZINC000875213342	EI	On-Demand	Anodyne	TAAR1	21	40
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCCc1cccc(O)c1)CC2	ZINC000875213363	FF	On-Demand	Anodyne	P2RY14	42	32
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000875213365	GD	On-Demand	Mild	HCN1	56	36
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000875213365	GD	On-Demand	Mild	HCN4	53	36
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000875213366	GD	On-Demand	Mild	HCN1	56	36
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000875213366	GD	On-Demand	Mild	HCN4	53	36
CCC[C@H](NC(=O)N1C[C@H]2C(=O)N(C)C(=O)[C@H]2C1)c1cccc(C(F)(F)F)c1	ZINC000875213368	GF	On-Demand	Anodyne	TACR1	24	42
CCC[C@H](NC(=O)N1C[C@H]2C(=O)N(C)C(=O)[C@H]2C1)c1cccc(C(F)(F)F)c1	ZINC000875213368	GF	On-Demand	Anodyne	CCR2	41	38
CN1CCN(C(=O)NCCc2cccc(C(N)=O)c2)CCC1(C)C	ZINC000875213376	ED	On-Demand	Anodyne	TRY2_BOVIN	56	33
COc1ccccc1[C@@H]1CN(C(=O)NCCc2cccc(O)c2)CCO1	ZINC000875213395	FF	On-Demand	Anodyne	DRD2	18	40
COc1ccccc1[C@@H]1CN(C(=O)NCCc2cccc(O)c2)CCO1	ZINC000875213395	FF	On-Demand	Anodyne	DRD4	25	40
COc1ccccc1[C@H]1CN(C(=O)NCCc2cccc(O)c2)CCO1	ZINC000875213396	FF	On-Demand	Anodyne	DRD2	18	40
COc1ccccc1[C@H]1CN(C(=O)NCCc2cccc(O)c2)CCO1	ZINC000875213396	FF	On-Demand	Anodyne	DRD4	25	40
CCC[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1cccc(C(F)(F)F)c1	ZINC000875213422	EH	On-Demand	Anodyne	CCR2	42	38
CCC[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1cccc(C(F)(F)F)c1	ZINC000875213422	EH	On-Demand	Anodyne	PDS	44	35
CN(C)C[C@@H]1CN(C(=O)NCCc2cccc(O)c2)C[C@H]1CN(C)C	ZINC000875213424	ED	On-Demand	Anodyne	OPRM1	22	42
CN(C)C[C@@H]1CN(C(=O)NCCc2cccc(O)c2)C[C@H]1CN(C)C	ZINC000875213424	ED	On-Demand	Anodyne	OPRD1	18	42
CN(C)C[C@@H]1CN(C(=O)NCCc2cccc(O)c2)C[C@H]1CN(C)C	ZINC000875213424	ED	On-Demand	Anodyne	OPRK1	21	42
NC(=O)CCOC(=O)COc1ccc(Oc2ccccc2)cc1	ZINC000875213439	DE	On-Demand	Anodyne	LTA4H	64	51
NC(=O)CCOC(=O)COc1ccc(Oc2ccccc2)cc1	ZINC000875213439	DE	On-Demand	Anodyne	PLA2G4B	90	38
NC(=O)CCOC(=O)COc1ccc(Oc2ccccc2)cc1	ZINC000875213439	DE	On-Demand	Anodyne	FAAH	24	40
NC(=O)CCOC(=O)COc1ccc(Oc2ccccc2)cc1	ZINC000875213439	DE	On-Demand	Anodyne	ACR	21	43
NC(=O)CCOC(=O)COc1ccc(Oc2ccccc2)cc1	ZINC000875213439	DE	On-Demand	Anodyne	SCN4A	22	40
NC(=O)CCOC(=O)COc1ccc(Oc2ccccc2)cc1	ZINC000875213439	DE	On-Demand	Anodyne	TAAR1	21	50
CN1CCN(C(=O)NCCc2cccc(O)c2)CCC1(C)C	ZINC000875213527	DE	On-Demand	Anodyne	OPRM1	32	43
CN1CCN(C(=O)NCCc2cccc(O)c2)CCC1(C)C	ZINC000875213527	DE	On-Demand	Anodyne	OPRD1	24	43
CN1CCN(C(=O)NCCc2cccc(O)c2)CCC1(C)C	ZINC000875213527	DE	On-Demand	Anodyne	OPRK1	32	43
C[C@@H](NC(=O)NCCc1cccc(O)c1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875213529	FE	On-Demand	Anodyne	GPR119	15	43
COCC1CC(NC(=O)NCc2cc(-c3ccccc3)on2)C1	ZINC000875213537	DF	On-Demand	Anodyne	EPHX2	19	40
COCC1CC(NC(=O)NCc2cc(-c3ccccc3)on2)C1	ZINC000875213537	DF	On-Demand	Anodyne	PDE8B	42	38
O=C(NCC[C@H]1CCSC1)C(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000875213538	GE	On-Demand	Anodyne	HCN1	53	34
O=C(NCC[C@H]1CCSC1)C(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000875213538	GE	On-Demand	Anodyne	HCN4	51	34
O=C(NCC[C@@H]1CCSC1)C(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000875213539	GE	On-Demand	Anodyne	HCN1	53	34
O=C(NCC[C@@H]1CCSC1)C(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000875213539	GE	On-Demand	Anodyne	HCN4	51	34
COc1ccccc1[C@@H]1CCCN(C(=O)NCCc2cccc(C(N)=O)c2)CC1	ZINC000875213556	GG	On-Demand	Anodyne	HTR1A	20	45
COc1ccccc1[C@@H]1CCCN(C(=O)NCCc2cccc(C(N)=O)c2)CC1	ZINC000875213556	GG	On-Demand	Anodyne	DRD2	22	48
COc1ccccc1[C@@H]1CCCN(C(=O)NCCc2cccc(C(N)=O)c2)CC1	ZINC000875213556	GG	On-Demand	Anodyne	DRD4	20	48
COc1ccccc1[C@@H]1CCCN(C(=O)NCCc2cccc(C(N)=O)c2)CC1	ZINC000875213556	GG	On-Demand	Anodyne	ST14	50	33
COc1ccccc1[C@@H]1CCCN(C(=O)NCCc2cccc(C(N)=O)c2)CC1	ZINC000875213556	GG	On-Demand	Anodyne	ACKR3	62	32
COc1ccccc1[C@H]1CCCN(C(=O)NCCc2cccc(C(N)=O)c2)CC1	ZINC000875213557	GG	On-Demand	Anodyne	HTR1A	20	45
COc1ccccc1[C@H]1CCCN(C(=O)NCCc2cccc(C(N)=O)c2)CC1	ZINC000875213557	GG	On-Demand	Anodyne	DRD2	22	48
COc1ccccc1[C@H]1CCCN(C(=O)NCCc2cccc(C(N)=O)c2)CC1	ZINC000875213557	GG	On-Demand	Anodyne	DRD4	20	48
COc1ccccc1[C@H]1CCCN(C(=O)NCCc2cccc(C(N)=O)c2)CC1	ZINC000875213557	GG	On-Demand	Anodyne	ST14	50	33
COc1ccccc1[C@H]1CCCN(C(=O)NCCc2cccc(C(N)=O)c2)CC1	ZINC000875213557	GG	On-Demand	Anodyne	ACKR3	62	32
CCOC(=O)[C@@H]1CN(C(=O)NCCc2cccc(O)c2)CCC1(F)F	ZINC000875213558	FE	On-Demand	Anodyne	OPRM1	23	40
CCOC(=O)[C@@H]1CN(C(=O)NCCc2cccc(O)c2)CCC1(F)F	ZINC000875213558	FE	On-Demand	Anodyne	OPRD1	20	40
CCOC(=O)[C@@H]1CN(C(=O)NCCc2cccc(O)c2)CCC1(F)F	ZINC000875213558	FE	On-Demand	Anodyne	OPRK1	23	40
CCC[C@H](NC(=O)N1CCC(C(C)=O)CC1)c1cccc(C(F)(F)F)c1	ZINC000875213574	FJ	On-Demand	Anodyne	CACNA1B	52	34
CCC[C@H](NC(=O)N1CCC(C(C)=O)CC1)c1cccc(C(F)(F)F)c1	ZINC000875213574	FJ	On-Demand	Anodyne	CCR2	70	39
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cc(-c3ccccc3)on2)C1	ZINC000875213592	FF	On-Demand	Anodyne	P2RY12	80	36
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cc(-c3ccccc3)on2)C1	ZINC000875213592	FF	On-Demand	Anodyne	PDE8B	49	35
CC(=O)[C@H]1CCCN(C(=O)NCCc2cccc(O)c2)C1	ZINC000875213609	CD	On-Demand	Anodyne	DPP7	44	38
CC(=O)[C@@H]1CCCN(C(=O)NCCc2cccc(O)c2)C1	ZINC000875213611	CD	On-Demand	Anodyne	DPP7	44	38
CN1CCC(N2CC[C@H](NC(=O)C(=O)NC3CCC(C)(N(C)C)CC3)C2)CC1	ZINC000875213612	GC	On-Demand	Anodyne	SLC6A5	18	42
CN1CCC(N2CC[C@@H](NC(=O)C(=O)NC3CCC(C)(N(C)C)CC3)C2)CC1	ZINC000875213615	GC	On-Demand	Anodyne	SLC6A5	18	42
C#CC[C@@H](CCOC)NC(=O)NCc1cc(-c2ccccc2)on1	ZINC000875213619	EF	On-Demand	Mild	NPPA	42	39
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCC[S@@](=O)C(C)(C)C)C2)cc1	ZINC000875213621	GD	On-Demand	Anodyne	DRD4	32	51
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCC[S@@](=O)C(C)(C)C)C2)cc1	ZINC000875213621	GD	On-Demand	Anodyne	SIGMAR1	18	41
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCC[S@@](=O)C(C)(C)C)C2)cc1	ZINC000875213621	GD	On-Demand	Anodyne	CCR3	23	40
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCC[S@@](=O)C(C)(C)C)C2)cc1	ZINC000875213621	GD	On-Demand	Anodyne	CCR2	18	47
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCC[S@@](=O)C(C)(C)C)C2)cc1	ZINC000875213621	GD	On-Demand	Anodyne	MCHR1	33	44
C#CC[C@H](CCOC)NC(=O)NCc1cc(-c2ccccc2)on1	ZINC000875213622	EF	On-Demand	Mild	NPPA	42	39
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCC[S@](=O)C(C)(C)C)C2)cc1	ZINC000875213624	GD	On-Demand	Anodyne	DRD4	32	51
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCC[S@](=O)C(C)(C)C)C2)cc1	ZINC000875213624	GD	On-Demand	Anodyne	SIGMAR1	18	41
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCC[S@](=O)C(C)(C)C)C2)cc1	ZINC000875213624	GD	On-Demand	Anodyne	CCR3	23	40
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCC[S@](=O)C(C)(C)C)C2)cc1	ZINC000875213624	GD	On-Demand	Anodyne	CCR2	18	47
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCC[S@](=O)C(C)(C)C)C2)cc1	ZINC000875213624	GD	On-Demand	Anodyne	MCHR1	33	44
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCC[S@](=O)C(C)(C)C)C2)cc1	ZINC000875213625	GD	On-Demand	Anodyne	DRD4	32	51
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCC[S@](=O)C(C)(C)C)C2)cc1	ZINC000875213625	GD	On-Demand	Anodyne	SIGMAR1	18	41
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCC[S@](=O)C(C)(C)C)C2)cc1	ZINC000875213625	GD	On-Demand	Anodyne	CCR3	23	40
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCC[S@](=O)C(C)(C)C)C2)cc1	ZINC000875213625	GD	On-Demand	Anodyne	CCR2	18	47
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCC[S@](=O)C(C)(C)C)C2)cc1	ZINC000875213625	GD	On-Demand	Anodyne	MCHR1	33	44
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCC[S@@](=O)C(C)(C)C)C2)cc1	ZINC000875213627	GD	On-Demand	Anodyne	DRD4	32	51
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCC[S@@](=O)C(C)(C)C)C2)cc1	ZINC000875213627	GD	On-Demand	Anodyne	SIGMAR1	18	41
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCC[S@@](=O)C(C)(C)C)C2)cc1	ZINC000875213627	GD	On-Demand	Anodyne	CCR3	23	40
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCC[S@@](=O)C(C)(C)C)C2)cc1	ZINC000875213627	GD	On-Demand	Anodyne	CCR2	18	47
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCC[S@@](=O)C(C)(C)C)C2)cc1	ZINC000875213627	GD	On-Demand	Anodyne	MCHR1	33	44
O=C(NCCc1cccc(O)c1)N1CCC(CO)(CO)CC1	ZINC000875213667	DC	On-Demand	Anodyne	OPRM1	23	41
O=C(NCCc1cccc(O)c1)N1CCC(CO)(CO)CC1	ZINC000875213667	DC	On-Demand	Anodyne	OPRD1	21	41
O=C(NCCc1cccc(O)c1)N1CCC(CO)(CO)CC1	ZINC000875213667	DC	On-Demand	Anodyne	OPRK1	25	41
C[C@@H](CN(C)C(=O)NCc1cc(-c2ccccc2)on1)NC(=O)OC(C)(C)C	ZINC000875213695	GG	On-Demand	Anodyne	PGC	50	34
C[C@@H](CN(C)C(=O)NCc1cc(-c2ccccc2)on1)NC(=O)OC(C)(C)C	ZINC000875213695	GG	On-Demand	Anodyne	PAPA1_CARPA	35	40
C[C@@H](CN(C)C(=O)NCc1cc(-c2ccccc2)on1)NC(=O)OC(C)(C)C	ZINC000875213695	GG	On-Demand	Anodyne	REN	69	37
C[C@@H](CN(C)C(=O)NCc1cc(-c2ccccc2)on1)NC(=O)OC(C)(C)C	ZINC000875213695	GG	On-Demand	Anodyne	FPR1	47	37
O=C(NCCc1cccc(O)c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875213697	EF	On-Demand	Anodyne	OPRM1	36	42
O=C(NCCc1cccc(O)c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875213697	EF	On-Demand	Anodyne	OPRD1	25	42
O=C(NCCc1cccc(O)c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875213697	EF	On-Demand	Anodyne	OPRK1	20	42
O=C(NCCc1cccc(O)c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875213697	EF	On-Demand	Anodyne	PREP	56	38
O=C(NCCc1cccc(O)c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875213697	EF	On-Demand	Anodyne	Q8WSF8_APLCA	18	40
O=C(NCCc1cccc(O)c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875213698	EF	On-Demand	Anodyne	OPRM1	36	42
O=C(NCCc1cccc(O)c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875213698	EF	On-Demand	Anodyne	OPRD1	25	42
O=C(NCCc1cccc(O)c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875213698	EF	On-Demand	Anodyne	OPRK1	20	42
O=C(NCCc1cccc(O)c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875213698	EF	On-Demand	Anodyne	PREP	56	38
O=C(NCCc1cccc(O)c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875213698	EF	On-Demand	Anodyne	Q8WSF8_APLCA	18	40
O=C(NCCc1cccc(O)c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875213699	EF	On-Demand	Anodyne	OPRM1	36	42
O=C(NCCc1cccc(O)c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875213699	EF	On-Demand	Anodyne	OPRD1	25	42
O=C(NCCc1cccc(O)c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875213699	EF	On-Demand	Anodyne	OPRK1	20	42
O=C(NCCc1cccc(O)c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875213699	EF	On-Demand	Anodyne	PREP	56	38
O=C(NCCc1cccc(O)c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875213699	EF	On-Demand	Anodyne	Q8WSF8_APLCA	18	40
COC[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)c1ccccc1	ZINC000875213762	GH	On-Demand	Anodyne	OPRL1	20	50
COC[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)c1ccccc1	ZINC000875213763	GH	On-Demand	Anodyne	OPRL1	20	50
C[C@@H](CCc1ccc(F)cc1)C(=O)N(C)c1ccc(S(C)(=O)=O)cc1	ZINC000875213766	FG	On-Demand	Anodyne	PTGS2	34	41
C[C@H](CCc1ccc(F)cc1)C(=O)N(C)c1ccc(S(C)(=O)=O)cc1	ZINC000875213767	FG	On-Demand	Anodyne	PTGS2	34	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](COC)c1ccccc1	ZINC000875213769	CE	On-Demand	Anodyne	TACR3	42	38
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](COC)c1ccccc1	ZINC000875213769	CE	On-Demand	Anodyne	ACE2	44	34
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](COC)c1ccccc1	ZINC000875213770	CE	On-Demand	Anodyne	TACR3	42	38
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](COC)c1ccccc1	ZINC000875213770	CE	On-Demand	Anodyne	ACE2	44	34
Cn1nc2c(c1NC(=O)c1ccc(OC(F)(F)F)cc1C(F)(F)F)CCC2	ZINC000875213800	GI	On-Demand	Anodyne	SHH	42	33
COC[C@H](NC(=O)N[C@@H](C)[C@@H](O)c1cc(OC)ccc1OC)c1ccccc1	ZINC000875213814	GF	On-Demand	Anodyne	SOAT1	37	44
COC[C@H](NC(=O)N[C@@H](C)[C@H](O)c1cc(OC)ccc1OC)c1ccccc1	ZINC000875213815	GF	On-Demand	Anodyne	SOAT1	37	44
COC[C@H](NC(=O)N[C@H](C)[C@@H](O)c1cc(OC)ccc1OC)c1ccccc1	ZINC000875213816	GF	On-Demand	Anodyne	SOAT1	37	44
COC[C@H](NC(=O)N[C@H](C)[C@H](O)c1cc(OC)ccc1OC)c1ccccc1	ZINC000875213817	GF	On-Demand	Anodyne	SOAT1	37	44
O=C(NCCc1cccc(O)c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875213845	EF	On-Demand	Anodyne	OPRM1	36	42
O=C(NCCc1cccc(O)c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875213845	EF	On-Demand	Anodyne	OPRD1	25	42
O=C(NCCc1cccc(O)c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875213845	EF	On-Demand	Anodyne	OPRK1	20	42
O=C(NCCc1cccc(O)c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875213845	EF	On-Demand	Anodyne	PREP	56	38
O=C(NCCc1cccc(O)c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875213845	EF	On-Demand	Anodyne	Q8WSF8_APLCA	18	40
CC(C)(C)OC(=O)N1CCC2(CC1)CN(C(=O)NCCc1cccc(O)c1)C2	ZINC000875213878	GF	On-Demand	Anodyne	EPHX2	17	46
CC(C)(C)OC(=O)N1CCC2(CC1)CN(C(=O)NCCc1cccc(O)c1)C2	ZINC000875213878	GF	On-Demand	Anodyne	GPR119	28	41
Cc1cncc([C@H]2CCCN2C(=O)NCCc2cccc(O)c2)c1	ZINC000875213887	EG	On-Demand	Anodyne	PREP	45	36
Cc1cncc([C@@H]2CCCN2C(=O)NCCc2cccc(O)c2)c1	ZINC000875213888	EG	On-Demand	Anodyne	PREP	45	36
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)N[C@@H]2CCN(C3CCN(C)CC3)C2)C1	ZINC000875213898	FC	On-Demand	Anodyne	SLC6A5	18	43
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)N[C@H]2CCN(C3CCN(C)CC3)C2)C1	ZINC000875213915	FC	On-Demand	Anodyne	SLC6A5	18	43
NC(=O)c1cccc(CCNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)c1	ZINC000875213916	FE	On-Demand	Anodyne	OPRK1	15	43
NC(=O)c1cccc(CCNC(=O)N2CCC[C@](O)(c3ccccc3)C2)c1	ZINC000875213918	FE	On-Demand	Anodyne	OPRK1	15	43
CN1CCC(N2CC[C@H](NC(=O)C(=O)N3CC[C@@H](C(C)(C)O)C3)C2)CC1	ZINC000875213948	FB	On-Demand	Anodyne	SLC6A5	17	42
CN1CCC(N2CC[C@H](NC(=O)C(=O)N3CC[C@H](C(C)(C)O)C3)C2)CC1	ZINC000875213950	FB	On-Demand	Anodyne	SLC6A5	17	42
CN1CCC(N2CC[C@@H](NC(=O)C(=O)N3CC[C@@H](C(C)(C)O)C3)C2)CC1	ZINC000875213953	FB	On-Demand	Anodyne	SLC6A5	17	42
CN1CCC(N2CC[C@@H](NC(=O)C(=O)N3CC[C@H](C(C)(C)O)C3)C2)CC1	ZINC000875213955	FB	On-Demand	Anodyne	SLC6A5	17	42
NC(=O)c1cccc(CCNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875213958	FE	On-Demand	Anodyne	ST14	68	32
NC(=O)c1cccc(CCNC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875213960	FE	On-Demand	Anodyne	ST14	68	32
O=C(NCCc1cccc(O)c1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875213968	EE	On-Demand	Anodyne	ADRB1	30	43
O=C(NCCc1cccc(O)c1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875213968	EE	On-Demand	Anodyne	ADRB3	23	43
O=C(NCCc1cccc(O)c1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875213970	EE	On-Demand	Anodyne	ADRB1	30	43
O=C(NCCc1cccc(O)c1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875213970	EE	On-Demand	Anodyne	ADRB3	23	43
CCOC1CC2(C1)C[C@@H]2NC(=O)NCc1cc(-c2ccccc2)on1	ZINC000875214006	EG	On-Demand	Anodyne	TIMP3	66	36
CCOC1CC2(C1)C[C@H]2NC(=O)NCc1cc(-c2ccccc2)on1	ZINC000875214007	EG	On-Demand	Anodyne	TIMP3	66	36
COc1c(Cl)cccc1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875214012	FH	On-Demand	Anodyne	CTSK	15	52
COc1c(Cl)cccc1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875214012	FH	On-Demand	Anodyne	CAPN2	60	36
COc1c(Cl)cccc1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875214012	FH	On-Demand	Anodyne	SLC12A5	61	37
CC(=O)C1CCN(C(=O)C(=O)NCC2(N3CCSCC3)CCCCC2)CC1	ZINC000875214013	GD	On-Demand	Anodyne	HCN1	58	36
CC(=O)C1CCN(C(=O)C(=O)NCC2(N3CCSCC3)CCCCC2)CC1	ZINC000875214013	GD	On-Demand	Anodyne	HCN4	56	36
CN1CCC(N2CC[C@H](NC(=O)C(=O)NCC[C@@H]3CCSC3)C2)CC1	ZINC000875214016	FC	On-Demand	Anodyne	SLC6A5	17	41
CN1CCC(N2CC[C@H](NC(=O)C(=O)NCC[C@H]3CCSC3)C2)CC1	ZINC000875214017	FC	On-Demand	Anodyne	SLC6A5	17	41
CN1CCC(N2CC[C@@H](NC(=O)C(=O)NCC[C@@H]3CCSC3)C2)CC1	ZINC000875214018	FC	On-Demand	Anodyne	SLC6A5	17	41
CN1CCC(N2CC[C@@H](NC(=O)C(=O)NCC[C@H]3CCSC3)C2)CC1	ZINC000875214019	FC	On-Demand	Anodyne	SLC6A5	17	41
Cc1cncc([C@@H]2CCCN2C(=O)NCc2cc(-c3ccccc3)on2)c1	ZINC000875214024	FI	On-Demand	Anodyne	CPT1A	84	37
Cc1cncc([C@@H]2CCCN2C(=O)NCc2cc(-c3ccccc3)on2)c1	ZINC000875214024	FI	On-Demand	Anodyne	PREP	35	41
Cc1cncc([C@H]2CCCN2C(=O)NCc2cc(-c3ccccc3)on2)c1	ZINC000875214025	FI	On-Demand	Anodyne	CPT1A	84	37
Cc1cncc([C@H]2CCCN2C(=O)NCc2cc(-c3ccccc3)on2)c1	ZINC000875214025	FI	On-Demand	Anodyne	PREP	35	41
COC[C@H](NC(=O)N[C@H]1CCN(CC(C)(C)O)C1)c1ccccc1	ZINC000875214027	ED	On-Demand	Anodyne	CCR5	29	41
COC[C@@H](NC(=O)N[C@H]1CCN(CC(C)(C)O)C1)c1ccccc1	ZINC000875214028	ED	On-Demand	Anodyne	CCR5	29	41
CC(C)(C)NS(=O)(=O)c1ccccc1NC(=O)c1cccn(C2CC2)c1=O	ZINC000875214055	GF	On-Demand	Anodyne	CCR8	77	37
C=CC(C)(C)CCCNC(=O)C(=O)NCCC(=O)Nc1ccccc1	ZINC000875214075	EE	On-Demand	Mild	HDAC10	27	45
C=CC(C)(C)CCCNC(=O)C(=O)NCCC(=O)Nc1ccccc1	ZINC000875214075	EE	On-Demand	Mild	HDAC2	20	45
C=CC(C)(C)CCCNC(=O)C(=O)NCCC(=O)Nc1ccccc1	ZINC000875214075	EE	On-Demand	Mild	HDAC3	21	45
C=CC(C)(C)CCCNC(=O)C(=O)NCCC(=O)Nc1ccccc1	ZINC000875214075	EE	On-Demand	Mild	HDAC6	20	45
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1cc(C)ncn1)CC2	ZINC000875214098	GD	On-Demand	Anodyne	SLC18A2	45	33
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1cc(C)ncn1)CC2	ZINC000875214100	GD	On-Demand	Anodyne	SLC18A2	45	33
CC[C@H](C)N(C)CCNC(=O)N[C@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875214124	FE	On-Demand	Anodyne	MTNR1A	40	40
CC[C@H](C)N(C)CCNC(=O)N[C@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875214124	FE	On-Demand	Anodyne	MTNR1B	34	40
CC[C@H](C)N(C)CCNC(=O)N[C@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875214126	FE	On-Demand	Anodyne	MTNR1A	40	40
CC[C@H](C)N(C)CCNC(=O)N[C@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875214126	FE	On-Demand	Anodyne	MTNR1B	34	40
CCOC(=O)[C@@H]1CC[C@H](C(=O)N(C)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000875214140	FE	On-Demand	Anodyne	FASN	35	43
CC(C)(C)OC(=O)CN1CCC(NC(=O)NC2(c3ccccc3)CC2)CC1	ZINC000875214150	FF	On-Demand	Anodyne	DRD4	16	40
CC(C)(C)OC(=O)CN1CCC(NC(=O)NC2(c3ccccc3)CC2)CC1	ZINC000875214150	FF	On-Demand	Anodyne	EPHX2	39	43
CN1C[C@@H](NC(=O)C(=O)NCCCCCCc2ccccc2)CCC1=O	ZINC000875214160	FD	On-Demand	Anodyne	FKBP1A	22	40
CN1C[C@@H](NC(=O)C(=O)NCCCCCCc2ccccc2)CCC1=O	ZINC000875214160	FD	On-Demand	Anodyne	DRD4	15	41
CN1C[C@@H](NC(=O)C(=O)NCCCCCCc2ccccc2)CCC1=O	ZINC000875214160	FD	On-Demand	Anodyne	SIGMAR1	30	40
CN1C[C@@H](NC(=O)C(=O)NCCCCCCc2ccccc2)CCC1=O	ZINC000875214160	FD	On-Demand	Anodyne	FAAH	49	41
CN1C[C@@H](NC(=O)C(=O)NCCCCCCc2ccccc2)CCC1=O	ZINC000875214160	FD	On-Demand	Anodyne	CES1	48	35
CN1C[C@@H](NC(=O)C(=O)NCCCCCCc2ccccc2)CCC1=O	ZINC000875214160	FD	On-Demand	Anodyne	AMP1_PLAFQ	21	42
CN1C[C@H](NC(=O)C(=O)NCCCCCCc2ccccc2)CCC1=O	ZINC000875214162	FD	On-Demand	Anodyne	FKBP1A	22	40
CN1C[C@H](NC(=O)C(=O)NCCCCCCc2ccccc2)CCC1=O	ZINC000875214162	FD	On-Demand	Anodyne	DRD4	15	41
CN1C[C@H](NC(=O)C(=O)NCCCCCCc2ccccc2)CCC1=O	ZINC000875214162	FD	On-Demand	Anodyne	SIGMAR1	30	40
CN1C[C@H](NC(=O)C(=O)NCCCCCCc2ccccc2)CCC1=O	ZINC000875214162	FD	On-Demand	Anodyne	FAAH	49	41
CN1C[C@H](NC(=O)C(=O)NCCCCCCc2ccccc2)CCC1=O	ZINC000875214162	FD	On-Demand	Anodyne	CES1	48	35
CN1C[C@H](NC(=O)C(=O)NCCCCCCc2ccccc2)CCC1=O	ZINC000875214162	FD	On-Demand	Anodyne	AMP1_PLAFQ	21	42
NC(=O)c1cccc(CCNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)c1	ZINC000875214167	GD	On-Demand	Anodyne	FAAH	20	42
NC(=O)c1cccc(CCNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)c1	ZINC000875214167	GD	On-Demand	Anodyne	NPFFR1	44	38
C=CC(C)(C)CCCNC(=O)C(=O)N[C@H]1CCN(C2CCN(C)CC2)C1	ZINC000875214219	FD	On-Demand	Mild	SLC6A5	18	43
C=CC(C)(C)CCCNC(=O)C(=O)N[C@@H]1CCN(C2CCN(C)CC2)C1	ZINC000875214220	FD	On-Demand	Mild	SLC6A5	18	43
O=C(NCCc1cccc(O)c1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875214221	FG	On-Demand	Anodyne	OPRM1	35	42
O=C(NCCc1cccc(O)c1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875214221	FG	On-Demand	Anodyne	OPRK1	30	40
O=C(NCCc1cccc(O)c1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875214221	FG	On-Demand	Anodyne	Q8WSF8_APLCA	17	42
CONC(=O)C1CCN(C(=O)NCCc2cccc(O)c2)CC1	ZINC000875214223	DD	On-Demand	Anodyne	EPHX2	15	41
O=C(NCCc1cccc(O)c1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875214234	EG	On-Demand	Anodyne	GHRHR	23	41
O=C(NCCc1cccc(O)c1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875214235	EG	On-Demand	Anodyne	GHRHR	23	41
CO[C@@H]1CC[C@@H](C)N(C(=O)NCc2cc(-c3ccccc3)on2)C1	ZINC000875214253	EG	On-Demand	Anodyne	GRM7	45	31
NC(=O)c1cccc(CCNC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)c1	ZINC000875214278	GF	On-Demand	Anodyne	OPRM1	18	42
NC(=O)c1cccc(CCNC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)c1	ZINC000875214278	GF	On-Demand	Anodyne	OPRK1	16	45
NC(=O)c1cccc(CCNC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)c1	ZINC000875214278	GF	On-Demand	Anodyne	KCNH2	41	42
CC(=O)Nc1cccc2c1CN(C(=O)NCCc1cccc(O)c1)CC2	ZINC000875214281	FF	On-Demand	Anodyne	P2RY14	42	32
Cc1cncc([C@H]2CCCN2C(=O)C(=O)N[C@H]2CCN(C3CCN(C)CC3)C2)c1	ZINC000875214287	GD	On-Demand	Anodyne	SLC6A5	17	40
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)N[C@H]2CCN(C3CCN(C)CC3)C2)c1	ZINC000875214288	GD	On-Demand	Anodyne	SLC6A5	17	40
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)N[C@@H]2CCN(C3CCN(C)CC3)C2)c1	ZINC000875214289	GD	On-Demand	Anodyne	SLC6A5	17	40
Cc1cncc([C@H]2CCCN2C(=O)C(=O)N[C@@H]2CCN(C3CCN(C)CC3)C2)c1	ZINC000875214290	GD	On-Demand	Anodyne	SLC6A5	17	40
CN1CCC(N2CC[C@H](NC(=O)C(=O)NCCCCC3CC3)C2)CC1	ZINC000875214300	FC	On-Demand	Anodyne	SLC6A5	20	44
CN1CCC(N2CC[C@@H](NC(=O)C(=O)NCCCCC3CC3)C2)CC1	ZINC000875214301	FC	On-Demand	Anodyne	SLC6A5	20	44
COC[C@@H](NC(=O)NC(C)(C)[C@@H]1CCCCO1)c1ccccc1	ZINC000875214335	DG	On-Demand	Anodyne	AMY2	49	33
COC[C@H](NC(=O)NC(C)(C)[C@@H]1CCCCO1)c1ccccc1	ZINC000875214336	DG	On-Demand	Anodyne	AMY2	49	33
COC[C@@H](NC(=O)NC(C)(C)[C@H]1CCCCO1)c1ccccc1	ZINC000875214337	DG	On-Demand	Anodyne	AMY2	49	33
COC[C@H](NC(=O)NC(C)(C)[C@H]1CCCCO1)c1ccccc1	ZINC000875214338	DG	On-Demand	Anodyne	AMY2	49	33
O=C(CCNC(=O)C(=O)NCCCCC1CC1)Nc1ccccc1	ZINC000875214377	ED	On-Demand	Anodyne	CCR3	20	44
O=C(CCNC(=O)C(=O)NCCCCC1CC1)Nc1ccccc1	ZINC000875214377	ED	On-Demand	Anodyne	HDAC8	16	44
O=C(CCNC(=O)C(=O)NCCCCC1CC1)Nc1ccccc1	ZINC000875214377	ED	On-Demand	Anodyne	HDAC10	34	44
O=C(CCNC(=O)C(=O)NCCCCC1CC1)Nc1ccccc1	ZINC000875214377	ED	On-Demand	Anodyne	HDAC2	25	44
O=C(CCNC(=O)C(=O)NCCCCC1CC1)Nc1ccccc1	ZINC000875214377	ED	On-Demand	Anodyne	HDAC3	23	44
O=C(CCNC(=O)C(=O)NCCCCC1CC1)Nc1ccccc1	ZINC000875214377	ED	On-Demand	Anodyne	HDAC6	27	44
O=C(CCNC(=O)C(=O)NCCCCC1CC1)Nc1ccccc1	ZINC000875214377	ED	On-Demand	Anodyne	HDAC11	28	44
CC[C@H](C)N(C)CCNC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O	ZINC000875214380	FD	On-Demand	Anodyne	GPR119	26	41
CC[C@H](C)N(C)CCNC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O	ZINC000875214382	FD	On-Demand	Anodyne	GPR119	26	41
CN1CCC(N2CC[C@H](NC(=O)C(=O)N3CC[C@H]4[C@@H](CCN4C)C3)C2)CC1	ZINC000875214405	GB	On-Demand	Anodyne	SLC6A5	17	41
CN1CCC(N2CC[C@H](NC(=O)C(=O)N3CC[C@H]4[C@H](CCN4C)C3)C2)CC1	ZINC000875214406	GB	On-Demand	Anodyne	SLC6A5	17	41
CN1CCC(N2CC[C@H](NC(=O)C(=O)N3CC[C@@H]4[C@H](CCN4C)C3)C2)CC1	ZINC000875214407	GB	On-Demand	Anodyne	SLC6A5	17	41
CN1CCC(N2CC[C@H](NC(=O)C(=O)N3CC[C@@H]4[C@@H](CCN4C)C3)C2)CC1	ZINC000875214408	GB	On-Demand	Anodyne	SLC6A5	17	41
CN1CCC(N2CC[C@H](NC(=O)C(=O)NCc3ccc(C(C)(C)C)o3)C2)CC1	ZINC000875214414	GD	On-Demand	Anodyne	SLC6A5	21	49
CN1CCC(N2CC[C@@H](NC(=O)C(=O)NCc3ccc(C(C)(C)C)o3)C2)CC1	ZINC000875214415	GD	On-Demand	Anodyne	SLC6A5	21	49
NC(=O)c1cccc(CCNC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)c1	ZINC000875214432	ED	On-Demand	Anodyne	KCNH2	42	40
NC(=O)c1cccc(CCNC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)c1	ZINC000875214432	ED	On-Demand	Anodyne	ST14	53	34
COc1cccc([C@H](O)C2CCN(C(=O)NCCc3cccc(O)c3)CC2)c1	ZINC000875214437	GG	On-Demand	Anodyne	DRD4	43	35
COc1cccc([C@H](O)C2CCN(C(=O)NCCc3cccc(O)c3)CC2)c1	ZINC000875214437	GG	On-Demand	Anodyne	OPRD1	26	45
COc1cccc([C@H](O)C2CCN(C(=O)NCCc3cccc(O)c3)CC2)c1	ZINC000875214437	GG	On-Demand	Anodyne	MTNR1A	53	41
COc1cccc([C@H](O)C2CCN(C(=O)NCCc3cccc(O)c3)CC2)c1	ZINC000875214437	GG	On-Demand	Anodyne	MTNR1B	50	41
O=C(NC1CCN(C(=O)NCCc2cccc(O)c2)CC1)OCc1ccccc1	ZINC000875214444	GG	On-Demand	Anodyne	DRD4	19	40
O=C(NC1CCN(C(=O)NCCc2cccc(O)c2)CC1)OCc1ccccc1	ZINC000875214444	GG	On-Demand	Anodyne	OPRM1	23	41
O=C(NC1CCN(C(=O)NCCc2cccc(O)c2)CC1)OCc1ccccc1	ZINC000875214444	GG	On-Demand	Anodyne	OPRD1	22	41
O=C(NC1CCN(C(=O)NCCc2cccc(O)c2)CC1)OCc1ccccc1	ZINC000875214444	GG	On-Demand	Anodyne	GRIN2B	44	38
O=C(NC1CCN(C(=O)NCCc2cccc(O)c2)CC1)OCc1ccccc1	ZINC000875214444	GG	On-Demand	Anodyne	SIGMAR1	16	41
O=C(NC1CCN(C(=O)NCCc2cccc(O)c2)CC1)OCc1ccccc1	ZINC000875214444	GG	On-Demand	Anodyne	CTSB	25	51
O=C(NC1CCN(C(=O)NCCc2cccc(O)c2)CC1)OCc1ccccc1	ZINC000875214444	GG	On-Demand	Anodyne	CTSK	27	51
O=C(NC1CCN(C(=O)NCCc2cccc(O)c2)CC1)OCc1ccccc1	ZINC000875214444	GG	On-Demand	Anodyne	FAAH	29	40
O=C(NC1CCN(C(=O)NCCc2cccc(O)c2)CC1)OCc1ccccc1	ZINC000875214444	GG	On-Demand	Anodyne	CAPN2	52	35
O=C(NC1CCN(C(=O)NCCc2cccc(O)c2)CC1)OCc1ccccc1	ZINC000875214444	GG	On-Demand	Anodyne	EPHX2	39	46
O=C(NC1CCN(C(=O)NCCc2cccc(O)c2)CC1)OCc1ccccc1	ZINC000875214444	GG	On-Demand	Anodyne	TGM2	47	44
O=C(NC1CCN(C(=O)NCCc2cccc(O)c2)CC1)OCc1ccccc1	ZINC000875214444	GG	On-Demand	Anodyne	F13A1	24	44
N#Cc1ccc(N2CCN(C(=O)NCCc3cccc(O)c3)CC2)cn1	ZINC000875214445	FD	On-Demand	Mild	CTSK	25	43
N#Cc1ccc(N2CCN(C(=O)NCCc3cccc(O)c3)CC2)cn1	ZINC000875214445	FD	On-Demand	Mild	CTSL	15	43
N#Cc1ccc(N2CCN(C(=O)NCCc3cccc(O)c3)CC2)cn1	ZINC000875214445	FD	On-Demand	Mild	GPBAR1	15	40
CC(=O)[C@H]1CCCN(C(=O)NCc2cc(-c3ccccc3)on2)C1	ZINC000875214459	EF	On-Demand	Anodyne	SLC6A1	87	33
CC(=O)[C@H]1CCCN(C(=O)NCc2cc(-c3ccccc3)on2)C1	ZINC000875214459	EF	On-Demand	Anodyne	PDE8B	47	31
CC(=O)[C@@H]1CCCN(C(=O)NCc2cc(-c3ccccc3)on2)C1	ZINC000875214461	EF	On-Demand	Anodyne	SLC6A1	87	33
CC(=O)[C@@H]1CCCN(C(=O)NCc2cc(-c3ccccc3)on2)C1	ZINC000875214461	EF	On-Demand	Anodyne	PDE8B	47	31
C=CC(C)(C)CCCNC(=O)C(=O)N[C@H]1CCCc2nc(C)ncc21	ZINC000875214474	EE	On-Demand	Mild	TBK1	44	31
C=CC(C)(C)CCCNC(=O)C(=O)N[C@@H]1CCCc2nc(C)ncc21	ZINC000875214476	EE	On-Demand	Mild	TBK1	44	31
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cccc(O)c1	ZINC000875214491	DD	On-Demand	Anodyne	SLC6A4	25	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cccc(O)c1	ZINC000875214491	DD	On-Demand	Anodyne	SLC6A3	47	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cccc(O)c1	ZINC000875214491	DD	On-Demand	Anodyne	Q8WSF8_APLCA	18	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cccc(O)c1	ZINC000875214493	DD	On-Demand	Anodyne	SLC6A4	25	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cccc(O)c1	ZINC000875214493	DD	On-Demand	Anodyne	SLC6A3	47	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cccc(O)c1	ZINC000875214493	DD	On-Demand	Anodyne	Q8WSF8_APLCA	18	43
CCC[C@H](NC(=O)N1CCC(CO)(CO)CC1)c1cccc(C(F)(F)F)c1	ZINC000875214500	GG	On-Demand	Anodyne	CACNA1H	28	40
CCC[C@H](NC(=O)N1CCC(CO)(CO)CC1)c1cccc(C(F)(F)F)c1	ZINC000875214500	GG	On-Demand	Anodyne	CCR2	46	36
CCC[C@H](NC(=O)N1CCC(CO)(CO)CC1)c1cccc(C(F)(F)F)c1	ZINC000875214500	GG	On-Demand	Anodyne	PDS	41	33
CN1CCC(N2CC[C@H](NC(=O)C(=O)N3C[C@H]4CC=CC[C@H]4C3)C2)CC1	ZINC000875214518	FC	On-Demand	Anodyne	SLC6A5	18	42
CN1CCC(N2CC[C@@H](NC(=O)C(=O)N3C[C@H]4CC=CC[C@H]4C3)C2)CC1	ZINC000875214520	FC	On-Demand	Anodyne	SLC6A5	18	42
CCO[C@H](C(=O)N(C)c1ccc(S(C)(=O)=O)cc1)C1CCCC1	ZINC000875214526	EF	On-Demand	Anodyne	AMY2	43	29
CCO[C@@H](C(=O)N(C)c1ccc(S(C)(=O)=O)cc1)C1CCCC1	ZINC000875214528	EF	On-Demand	Anodyne	AMY2	43	29
C[C@@H](CN(C)C(=O)NCCc1cccc(O)c1)NC(=O)OC(C)(C)C	ZINC000875214529	FE	On-Demand	Anodyne	FPR1	43	34
CONC(=O)C1CCN(C(=O)NCC2(c3cccc(C)c3)CCCC2)CC1	ZINC000875214620	FF	On-Demand	Anodyne	KCNA3	40	34
CONC(=O)C1CCN(C(=O)NCC2(c3cccc(C)c3)CCCC2)CC1	ZINC000875214620	FF	On-Demand	Anodyne	EPHX2	22	42
COC(=O)C1(O)CN(C(=O)NCCc2c(C)[nH]c3ccccc23)C1	ZINC000875214647	EC	On-Demand	Anodyne	MTNR1A	18	40
COC(=O)C1(O)CN(C(=O)NCCc2c(C)[nH]c3ccccc23)C1	ZINC000875214647	EC	On-Demand	Anodyne	MTNR1B	20	40
O=C(NCC1(c2ccc(Cl)cc2)CCC1)N1CCC2(CCNC2=O)CC1	ZINC000875214681	GG	On-Demand	Anodyne	CACNA1H	47	34
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN(C(=O)CC(F)(F)F)CC1	ZINC000875214699	GF	On-Demand	Anodyne	EPHX2	41	52
CN1CCC(N2CC[C@H](NC(=O)C(=O)N[C@@H]3CC34CCC4)C2)CC1	ZINC000875214707	EC	On-Demand	Anodyne	SLC6A5	17	40
CN1CCC(N2CC[C@@H](NC(=O)C(=O)N[C@H]3CC34CCC4)C2)CC1	ZINC000875214708	EC	On-Demand	Anodyne	SLC6A5	17	40
CN1CCC(N2CC[C@@H](NC(=O)C(=O)N[C@@H]3CC34CCC4)C2)CC1	ZINC000875214709	EC	On-Demand	Anodyne	SLC6A5	17	40
CN1CCC(N2CC[C@H](NC(=O)C(=O)N[C@H]3CC34CCC4)C2)CC1	ZINC000875214710	EC	On-Demand	Anodyne	SLC6A5	17	40
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(C2CCN(C)CC2)C1	ZINC000875214711	FC	On-Demand	Anodyne	SLC6A5	21	46
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(C2CCN(C)CC2)C1	ZINC000875214712	FC	On-Demand	Anodyne	SLC6A5	21	46
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875214718	FH	On-Demand	Anodyne	TYR	25	40
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875214718	FH	On-Demand	Anodyne	MME	83	36
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875214718	FH	On-Demand	Anodyne	ANPEP	62	36
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875214718	FH	On-Demand	Anodyne	TACR1	16	44
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875214718	FH	On-Demand	Anodyne	CMA1	47	33
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875214718	FH	On-Demand	Anodyne	CTRA_BOVIN	24	42
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875214718	FH	On-Demand	Anodyne	CTSB	44	36
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875214718	FH	On-Demand	Anodyne	PAPA1_CARPA	58	42
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875214718	FH	On-Demand	Anodyne	CYSP_TRYCR	54	39
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875214718	FH	On-Demand	Anodyne	CTSG	21	41
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875214718	FH	On-Demand	Anodyne	TIMP3	54	33
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875214718	FH	On-Demand	Anodyne	CAPNS1	54	34
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875214718	FH	On-Demand	Anodyne	HLA-DRB1	44	36
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875214718	FH	On-Demand	Anodyne	CELA2A	21	41
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875214718	FH	On-Demand	Anodyne	CAPN1	50	43
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875214718	FH	On-Demand	Anodyne	CAPN2	44	37
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875214718	FH	On-Demand	Anodyne	ACE2	53	36
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875214718	FH	On-Demand	Anodyne	FPR1	59	35
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875214718	FH	On-Demand	Anodyne	CTRB_BOVIN	59	45
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875214718	FH	On-Demand	Anodyne	NPR	23	40
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875214718	FH	On-Demand	Anodyne	BLA1_STEMA	40	32
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(C2CCN(C)CC2)C1	ZINC000875214720	FB	On-Demand	Mild	SLC6A5	18	41
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(C2CCN(C)CC2)C1	ZINC000875214721	FB	On-Demand	Mild	SLC6A5	18	41
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(C2CCN(C)CC2)C1	ZINC000875214722	FB	On-Demand	Mild	SLC6A5	18	41
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(C2CCN(C)CC2)C1	ZINC000875214723	FB	On-Demand	Mild	SLC6A5	18	41
COC(=O)N(C)NC(=O)NCCc1cccc(O)c1	ZINC000875214742	CC	On-Demand	Reactive	MTNR1A	45	39
COC(=O)N(C)NC(=O)NCCc1cccc(O)c1	ZINC000875214742	CC	On-Demand	Reactive	HSD17B2	30	42
CN1CCN(C2CCN(C(=O)NCCc3cccc(O)c3)CC2)CC1	ZINC000875214748	ED	On-Demand	Anodyne	L3MBTL3	103	41
C#CC[C@@H](COC)NC(=O)C(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000875214750	GD	On-Demand	Mild	HCN1	53	34
C#CC[C@@H](COC)NC(=O)C(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000875214750	GD	On-Demand	Mild	HCN4	51	34
C#CC[C@H](COC)NC(=O)C(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000875214751	GD	On-Demand	Mild	HCN1	53	34
C#CC[C@H](COC)NC(=O)C(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000875214751	GD	On-Demand	Mild	HCN4	51	34
C[C@H](NC(=O)C(=O)NCC1(N2CCSCC2)CCCCC1)c1ccnn1C	ZINC000875214752	GD	On-Demand	Anodyne	HCN1	78	41
C[C@H](NC(=O)C(=O)NCC1(N2CCSCC2)CCCCC1)c1ccnn1C	ZINC000875214752	GD	On-Demand	Anodyne	HCN4	60	41
NC(=O)c1cccc(CCNC(=O)N2CCCN(C=O)CC2)c1	ZINC000875214758	DC	On-Demand	Anodyne	TRY2_BOVIN	71	41
CONC(=O)C1CCN(C(=O)NCc2cc(-c3ccccc3)on2)CC1	ZINC000875214759	FD	On-Demand	Anodyne	EPHX2	36	41
CONC(=O)C1CCN(C(=O)NCc2cc(-c3ccccc3)on2)CC1	ZINC000875214759	FD	On-Demand	Anodyne	PDE8B	57	34
N#Cc1ccc(N2CCN(C(=O)NCCc3cccc(O)c3)CC2)cc1	ZINC000875214781	FE	On-Demand	Mild	CTSK	18	41
COC(=O)N(C)NC(=O)N[C@@H]1CCN(c2cc(Cl)ccc2OC)C1	ZINC000875214782	FD	On-Demand	Reactive	CPT2	40	34
COC(=O)N(C)NC(=O)N[C@H]1CCN(c2cc(Cl)ccc2OC)C1	ZINC000875214784	FD	On-Demand	Reactive	CPT2	40	34
CN1CCC(N2CC[C@H](NC(=O)C(=O)NC[C@@H]3c4ccccc4CN3C)C2)CC1	ZINC000875214785	GC	On-Demand	Anodyne	SLC6A5	21	49
CN1CCC(N2CC[C@H](NC(=O)C(=O)NC[C@H]3c4ccccc4CN3C)C2)CC1	ZINC000875214787	GC	On-Demand	Anodyne	SLC6A5	21	49
CN1CCC(N2CC[C@@H](NC(=O)C(=O)NC[C@H]3c4ccccc4CN3C)C2)CC1	ZINC000875214789	GC	On-Demand	Anodyne	SLC6A5	21	49
CN1CCC(N2CC[C@@H](NC(=O)C(=O)NC[C@@H]3c4ccccc4CN3C)C2)CC1	ZINC000875214791	GC	On-Demand	Anodyne	SLC6A5	21	49
O=C(NCC[C@@H]1CCSC1)NCc1cc(-c2ccccc2)on1	ZINC000875214797	EG	On-Demand	Anodyne	VCP	44	33
O=C(NCC[C@H]1CCSC1)NCc1cc(-c2ccccc2)on1	ZINC000875214798	EG	On-Demand	Anodyne	VCP	44	33
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCN(C3CCN(C)CC3)C2)CC1	ZINC000875214806	FC	On-Demand	Anodyne	SLC6A5	17	41
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCN(C3CCN(C)CC3)C2)CC1	ZINC000875214807	FC	On-Demand	Anodyne	SLC6A5	17	41
COC[C@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875214817	DE	On-Demand	Anodyne	AMY2	47	32
COC[C@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875214819	DE	On-Demand	Anodyne	AMY2	47	32
COC[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875214821	DE	On-Demand	Anodyne	AMY2	47	32
COC[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875214823	DE	On-Demand	Anodyne	AMY2	47	32
COC[C@H](NC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1ccccc1	ZINC000875214833	EF	On-Demand	Anodyne	CCR5	16	42
COC[C@@H](NC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1ccccc1	ZINC000875214835	EF	On-Demand	Anodyne	CCR5	16	42
COC[C@H](NC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1ccccc1	ZINC000875214836	EF	On-Demand	Anodyne	CCR5	16	42
COC[C@@H](NC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1ccccc1	ZINC000875214837	EF	On-Demand	Anodyne	CCR5	16	42
COC[C@@H](NC(=O)N[C@](C)(CO)Cc1ccc(OC)cc1)c1ccccc1	ZINC000875214861	FF	On-Demand	Anodyne	TACR3	28	40
COC[C@@H](NC(=O)N[C@](C)(CO)Cc1ccc(OC)cc1)c1ccccc1	ZINC000875214861	FF	On-Demand	Anodyne	MMP1	16	40
COC[C@H](NC(=O)N[C@](C)(CO)Cc1ccc(OC)cc1)c1ccccc1	ZINC000875214862	FF	On-Demand	Anodyne	TACR3	28	40
COC[C@H](NC(=O)N[C@](C)(CO)Cc1ccc(OC)cc1)c1ccccc1	ZINC000875214862	FF	On-Demand	Anodyne	MMP1	16	40
COC[C@H](NC(=O)N[C@@](C)(CO)Cc1ccc(OC)cc1)c1ccccc1	ZINC000875214863	FF	On-Demand	Anodyne	TACR3	28	40
COC[C@H](NC(=O)N[C@@](C)(CO)Cc1ccc(OC)cc1)c1ccccc1	ZINC000875214863	FF	On-Demand	Anodyne	MMP1	16	40
COC[C@@H](NC(=O)N[C@@](C)(CO)Cc1ccc(OC)cc1)c1ccccc1	ZINC000875214864	FF	On-Demand	Anodyne	TACR3	28	40
COC[C@@H](NC(=O)N[C@@](C)(CO)Cc1ccc(OC)cc1)c1ccccc1	ZINC000875214864	FF	On-Demand	Anodyne	MMP1	16	40
COC[C@@H](NC(=O)N1CCC[C@@H](CCC(=O)OC)C1)c1ccccc1	ZINC000875214896	EF	On-Demand	Anodyne	REN	20	42
COC[C@@H](NC(=O)N1CCC[C@H](CCC(=O)OC)C1)c1ccccc1	ZINC000875214897	EF	On-Demand	Anodyne	REN	20	42
COC[C@H](NC(=O)N1CCC[C@@H](CCC(=O)OC)C1)c1ccccc1	ZINC000875214898	EF	On-Demand	Anodyne	REN	20	42
COC[C@H](NC(=O)N1CCC[C@H](CCC(=O)OC)C1)c1ccccc1	ZINC000875214899	EF	On-Demand	Anodyne	REN	20	42
O=CN1CCCN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CC1	ZINC000875214912	EF	On-Demand	Anodyne	EPHX2	16	45
COC(=O)N(C)NC(=O)NCC1(c2ccc(Cl)cc2)CCC1	ZINC000875214929	EF	On-Demand	Reactive	KCNA3	40	34
CC[C@@H](NC(=O)NC1CCN(CCCOC)CC1)[C@@H](O)c1ccccc1	ZINC000875214949	FE	On-Demand	Anodyne	DRD4	20	40
CC[C@@H](NC(=O)NC1CCN(CCCOC)CC1)[C@@H](O)c1ccccc1	ZINC000875214949	FE	On-Demand	Anodyne	HTR4	57	39
CC[C@@H](NC(=O)NC1CCN(CCCOC)CC1)[C@@H](O)c1ccccc1	ZINC000875214949	FE	On-Demand	Anodyne	CCR5	43	42
CC[C@@H](NC(=O)NC1CCN(CCCOC)CC1)[C@@H](O)c1ccccc1	ZINC000875214949	FE	On-Demand	Anodyne	MCHR1	15	47
CC[C@@H](NC(=O)NC1CCN(CCCOC)CC1)[C@H](O)c1ccccc1	ZINC000875214952	FE	On-Demand	Anodyne	DRD4	20	40
CC[C@@H](NC(=O)NC1CCN(CCCOC)CC1)[C@H](O)c1ccccc1	ZINC000875214952	FE	On-Demand	Anodyne	HTR4	57	39
CC[C@@H](NC(=O)NC1CCN(CCCOC)CC1)[C@H](O)c1ccccc1	ZINC000875214952	FE	On-Demand	Anodyne	CCR5	43	42
CC[C@@H](NC(=O)NC1CCN(CCCOC)CC1)[C@H](O)c1ccccc1	ZINC000875214952	FE	On-Demand	Anodyne	MCHR1	15	47
CC(=O)C1CCN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CC1	ZINC000875214972	EH	On-Demand	Anodyne	CCR1	70	39
CC(=O)C1CCN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CC1	ZINC000875214972	EH	On-Demand	Anodyne	EPHX2	25	42
CC(=O)C1CCN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CC1	ZINC000875214972	EH	On-Demand	Anodyne	SMO	15	41
O=C(NC1CCN(C(=O)CC(F)(F)F)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875214975	FE	On-Demand	Anodyne	EPHX2	30	50
O=C(NC1CCN(C(=O)CC(F)(F)F)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875214976	FE	On-Demand	Anodyne	EPHX2	30	50
O=C(NC1CCN(C(=O)CC(F)(F)F)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875214977	FE	On-Demand	Anodyne	EPHX2	30	50
O=C(NC1CCN(C(=O)CC(F)(F)F)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875214978	FE	On-Demand	Anodyne	EPHX2	30	50
O=CN1CCCN(C(=O)NCc2ccccc2-c2ccc(Cl)cc2)CC1	ZINC000875214979	FG	On-Demand	Anodyne	EPHX2	18	42
O=C(NCCc1cccc(O)c1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875215055	EF	On-Demand	Anodyne	OPRM1	33	46
O=C(NCCc1cccc(O)c1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875215055	EF	On-Demand	Anodyne	OPRD1	27	46
O=C(NCCc1cccc(O)c1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875215055	EF	On-Demand	Anodyne	OPRK1	33	46
O=C(NCCc1cccc(O)c1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875215055	EF	On-Demand	Anodyne	SLC12A5	42	33
O=C(NCCc1cccc(O)c1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875215056	EF	On-Demand	Anodyne	OPRM1	33	46
O=C(NCCc1cccc(O)c1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875215056	EF	On-Demand	Anodyne	OPRD1	27	46
O=C(NCCc1cccc(O)c1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875215056	EF	On-Demand	Anodyne	OPRK1	33	46
O=C(NCCc1cccc(O)c1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875215056	EF	On-Demand	Anodyne	SLC12A5	42	33
NC(=O)c1cccc(CCNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875215057	GF	On-Demand	Anodyne	FKBP1A	53	39
NC(=O)c1cccc(CCNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875215057	GF	On-Demand	Anodyne	OPRK1	15	40
NC(=O)c1cccc(CCNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875215057	GF	On-Demand	Anodyne	TRY1_BOVIN	45	35
NC(=O)c1cccc(CCNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875215057	GF	On-Demand	Anodyne	ST14	49	36
NC(=O)c1cccc(CCNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875215057	GF	On-Demand	Anodyne	TMPRSS11D	60	34
NC(=O)c1cccc(CCNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875215058	GF	On-Demand	Anodyne	FKBP1A	53	39
NC(=O)c1cccc(CCNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875215058	GF	On-Demand	Anodyne	OPRK1	15	40
NC(=O)c1cccc(CCNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875215058	GF	On-Demand	Anodyne	TRY1_BOVIN	45	35
NC(=O)c1cccc(CCNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875215058	GF	On-Demand	Anodyne	ST14	49	36
NC(=O)c1cccc(CCNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875215058	GF	On-Demand	Anodyne	TMPRSS11D	60	34
NC(=O)c1cccc(CCNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875215059	GF	On-Demand	Anodyne	FKBP1A	53	39
NC(=O)c1cccc(CCNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875215059	GF	On-Demand	Anodyne	OPRK1	15	40
NC(=O)c1cccc(CCNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875215059	GF	On-Demand	Anodyne	TRY1_BOVIN	45	35
NC(=O)c1cccc(CCNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875215059	GF	On-Demand	Anodyne	ST14	49	36
NC(=O)c1cccc(CCNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875215059	GF	On-Demand	Anodyne	TMPRSS11D	60	34
NC(=O)c1cccc(CCNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875215060	GF	On-Demand	Anodyne	FKBP1A	53	39
NC(=O)c1cccc(CCNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875215060	GF	On-Demand	Anodyne	OPRK1	15	40
NC(=O)c1cccc(CCNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875215060	GF	On-Demand	Anodyne	TRY1_BOVIN	45	35
NC(=O)c1cccc(CCNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875215060	GF	On-Demand	Anodyne	ST14	49	36
NC(=O)c1cccc(CCNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875215060	GF	On-Demand	Anodyne	TMPRSS11D	60	34
CC(=O)C1CCN(C(=O)NCc2cc(-c3ccccc3)on2)CC1	ZINC000875215073	EF	On-Demand	Anodyne	EPHX2	36	42
CC(=O)C1CCN(C(=O)NCc2cc(-c3ccccc3)on2)CC1	ZINC000875215073	EF	On-Demand	Anodyne	PDE8B	43	31
CCCCCCCNC(=O)C(=O)NCc1cc(C)ncn1	ZINC000875215075	CD	On-Demand	Mild	ASAH1	81	34
O=C(NCCc1cccc(O)c1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875215081	EG	On-Demand	Anodyne	OPRD1	16	41
COCCN(CC1CCN(C)CC1)C(=O)NCc1cc(-c2ccccc2)on1	ZINC000875215084	GF	On-Demand	Anodyne	PDE8B	47	33
CCC[C@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1cccc(C(F)(F)F)c1	ZINC000875215098	GH	On-Demand	Anodyne	CACNA1H	44	42
CN(C(=O)c1ccc(Cl)cc1)c1ccc(NC(=O)C2(F)CCOCC2)cc1	ZINC000875215104	GI	On-Demand	Anodyne	GPBAR1	24	40
COc1ccc([C@@H]2CN(C(=O)NCCc3cccc(O)c3)CCO2)cc1	ZINC000875215130	FF	On-Demand	Anodyne	MTNR1A	55	36
COc1ccc([C@@H]2CN(C(=O)NCCc3cccc(O)c3)CCO2)cc1	ZINC000875215130	FF	On-Demand	Anodyne	MTNR1B	46	36
CN1CCC(N2CC[C@@H](NC(=O)C(=O)NCCC[C@H]3C=CCC3)C2)CC1	ZINC000875215132	FD	On-Demand	Anodyne	SLC6A5	18	41
CN1CCC(N2CC[C@@H](NC(=O)C(=O)NCCC[C@@H]3C=CCC3)C2)CC1	ZINC000875215133	FD	On-Demand	Anodyne	SLC6A5	18	41
CN1CCC(N2CC[C@H](NC(=O)C(=O)NCCC[C@H]3C=CCC3)C2)CC1	ZINC000875215136	FD	On-Demand	Anodyne	SLC6A5	18	41
CN1CCC(N2CC[C@H](NC(=O)C(=O)NCCC[C@@H]3C=CCC3)C2)CC1	ZINC000875215138	FD	On-Demand	Anodyne	SLC6A5	18	41
C[C@]1(C(F)(F)F)CCN(C(=O)NCCc2cccc(O)c2)C1	ZINC000875215143	DF	On-Demand	Anodyne	EPHX2	17	46
COC(=O)c1cc(C(=O)N(CC(F)(F)F)C2CC2)ccc1C	ZINC000875215177	DF	On-Demand	Anodyne	HSD11B1	15	49
CC[C@H](C[C@H](C)O)NC(=O)NCc1cc(-c2ccccc2)on1	ZINC000875215189	DF	On-Demand	Anodyne	GRPR	42	29
CN(C(=O)c1ccc2c(c1)OC(C)(C)C2)c1ccc(S(C)(=O)=O)cc1	ZINC000875215218	FG	On-Demand	Anodyne	LOX1.1	42	33
CN(C(=O)c1ccc2c(c1)OC(C)(C)C2)c1ccc(S(C)(=O)=O)cc1	ZINC000875215218	FG	On-Demand	Anodyne	O49150_SOLTU	50	33
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(-c2ccccc2)on1	ZINC000875215241	FF	On-Demand	Anodyne	SLC6A4	35	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(-c2ccccc2)on1	ZINC000875215241	FF	On-Demand	Anodyne	SLC6A3	69	44
O=C(CCNC(=O)C(=O)NCCC[C@H]1C=CCC1)Nc1ccccc1	ZINC000875215286	ED	On-Demand	Anodyne	HDAC11	15	40
O=C(CCNC(=O)C(=O)NCCC[C@@H]1C=CCC1)Nc1ccccc1	ZINC000875215287	ED	On-Demand	Anodyne	HDAC11	15	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCc2cnn(C)c2)CC1	ZINC000875215394	FG	On-Demand	Anodyne	DRD2	27	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCc2cnn(C)c2)CC1	ZINC000875215394	FG	On-Demand	Anodyne	DRD4	16	40
COc1ccccc1[C@H]1CCCN(C(=O)NCCCc2cnn(C)c2)CC1	ZINC000875215395	FG	On-Demand	Anodyne	DRD2	27	41
COc1ccccc1[C@H]1CCCN(C(=O)NCCCc2cnn(C)c2)CC1	ZINC000875215395	FG	On-Demand	Anodyne	DRD4	16	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(-c2ccccc2)on1	ZINC000875215430	FF	On-Demand	Anodyne	SLC6A4	35	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(-c2ccccc2)on1	ZINC000875215430	FF	On-Demand	Anodyne	SLC6A3	69	44
O=C(Cc1ccc(OCc2ccncc2)cc1)N(CC(F)(F)F)C1CC1	ZINC000875215439	FH	On-Demand	Anodyne	SLC6A5	32	40
CCCCCCCNC(=O)C(=O)N[C@H]1CCN(C2CCN(C)CC2)C1	ZINC000875215458	FD	On-Demand	Mild	SLC6A5	19	44
CCCCCCCNC(=O)C(=O)N[C@@H]1CCN(C2CCN(C)CC2)C1	ZINC000875215459	FD	On-Demand	Mild	SLC6A5	19	44
COCC(C)(C)CCNC(=O)C(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000875215464	GE	On-Demand	Anodyne	HCN1	55	34
COCC(C)(C)CCNC(=O)C(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000875215464	GE	On-Demand	Anodyne	HCN4	52	34
CN1CCC(N2CC[C@@H](NC(=O)C(=O)NCc3ncc(Cl)s3)C2)CC1	ZINC000875215485	GC	On-Demand	Anodyne	SLC6A5	19	46
CN1CCC(N2CC[C@H](NC(=O)C(=O)NCc3ncc(Cl)s3)C2)CC1	ZINC000875215487	GC	On-Demand	Anodyne	SLC6A5	19	46
CN1CCN(C2CCN(C(=O)NCc3cc(-c4ccccc4)on3)CC2)CC1	ZINC000875215489	GE	On-Demand	Anodyne	EPHX2	28	40
CN1CCN(C2CCN(C(=O)NCc3cc(-c4ccccc4)on3)CC2)CC1	ZINC000875215489	GE	On-Demand	Anodyne	CALCRL	52	37
CN1CCN(C2CCN(C(=O)NCc3cc(-c4ccccc4)on3)CC2)CC1	ZINC000875215489	GE	On-Demand	Anodyne	L3MBTL3	67	42
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1sccc1CC#N	ZINC000875215511	EF	On-Demand	Mild	MME	59	35
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1sccc1CC#N	ZINC000875215511	EF	On-Demand	Mild	CTRA_BOVIN	15	44
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1sccc1CC#N	ZINC000875215511	EF	On-Demand	Mild	CTSB	55	41
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1sccc1CC#N	ZINC000875215511	EF	On-Demand	Mild	PAPA1_CARPA	70	45
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1sccc1CC#N	ZINC000875215511	EF	On-Demand	Mild	CYSP_TRYCR	44	37
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1sccc1CC#N	ZINC000875215511	EF	On-Demand	Mild	CTSG	15	44
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1sccc1CC#N	ZINC000875215511	EF	On-Demand	Mild	CTSK	20	43
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1sccc1CC#N	ZINC000875215511	EF	On-Demand	Mild	CTSL	56	45
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1sccc1CC#N	ZINC000875215511	EF	On-Demand	Mild	TIMP3	75	33
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1sccc1CC#N	ZINC000875215511	EF	On-Demand	Mild	CAPNS1	58	34
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1sccc1CC#N	ZINC000875215511	EF	On-Demand	Mild	HLA-DRB1	41	35
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1sccc1CC#N	ZINC000875215511	EF	On-Demand	Mild	CTSS	37	45
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1sccc1CC#N	ZINC000875215511	EF	On-Demand	Mild	CAPN1	48	39
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1sccc1CC#N	ZINC000875215511	EF	On-Demand	Mild	CAPN2	40	36
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1sccc1CC#N	ZINC000875215511	EF	On-Demand	Mild	ACE2	53	35
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1sccc1CC#N	ZINC000875215511	EF	On-Demand	Mild	CTSC	48	38
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1sccc1CC#N	ZINC000875215511	EF	On-Demand	Mild	CTSV	55	39
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1sccc1CC#N	ZINC000875215511	EF	On-Demand	Mild	CTRB_BOVIN	70	45
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1sccc1CC#N	ZINC000875215511	EF	On-Demand	Mild	NPR	59	38
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1sccc1CC#N	ZINC000875215511	EF	On-Demand	Mild	NPFFR1	41	31
COc1ccc([C@@H]2CN(C(=O)NCc3cc(-c4ccccc4)on3)CCO2)cc1	ZINC000875215527	GH	On-Demand	Anodyne	MMP13	15	40
COc1ccc([C@@H]2CN(C(=O)NCc3cc(-c4ccccc4)on3)CCO2)cc1	ZINC000875215527	GH	On-Demand	Anodyne	PDE8B	44	31
NC(=O)c1cccc(CCNC(=O)N2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000875215607	FD	On-Demand	Anodyne	ST14	62	33
NC(=O)c1cccc(CCNC(=O)N2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000875215610	FD	On-Demand	Anodyne	ST14	62	33
COc1cccc(C(C)(C)C(=O)N(C)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000875215611	FG	On-Demand	Anodyne	HSD17B2	22	40
Cc1cc(C(F)(F)F)nc(C(=O)N(C)c2ccc(S(C)(=O)=O)cc2)n1	ZINC000875215618	FE	On-Demand	Anodyne	PTGS2	48	51
COC[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccccc1	ZINC000875215652	CD	On-Demand	Anodyne	MAN1B1	44	32
COC[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccccc1	ZINC000875215653	CD	On-Demand	Anodyne	MAN1B1	44	32
CN(C(=O)[C@H](Cc1cccnc1)C1CCCC1)c1ccc(S(C)(=O)=O)cc1	ZINC000875215667	GG	On-Demand	Anodyne	C3AR1	37	40
COC[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1ccccc1	ZINC000875215684	EF	On-Demand	Anodyne	CHRM1	15	40
COC[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1ccccc1	ZINC000875215684	EF	On-Demand	Anodyne	SLC6A3	26	45
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875215685	FF	On-Demand	Anodyne	ACE	43	37
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875215685	FF	On-Demand	Anodyne	MME	86	37
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875215685	FF	On-Demand	Anodyne	ANPEP	56	35
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875215685	FF	On-Demand	Anodyne	CTSB	40	37
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875215685	FF	On-Demand	Anodyne	PAPA1_CARPA	50	42
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875215685	FF	On-Demand	Anodyne	CYSP_TRYCR	56	40
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875215685	FF	On-Demand	Anodyne	CTSL	44	43
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875215685	FF	On-Demand	Anodyne	TIMP3	61	33
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875215685	FF	On-Demand	Anodyne	PYGL	15	41
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875215685	FF	On-Demand	Anodyne	TACR3	43	38
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875215685	FF	On-Demand	Anodyne	CAPNS1	55	34
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875215685	FF	On-Demand	Anodyne	HLA-DRB1	51	36
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875215685	FF	On-Demand	Anodyne	CTSS	22	43
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875215685	FF	On-Demand	Anodyne	CAPN1	70	46
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875215685	FF	On-Demand	Anodyne	CAPN2	68	38
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875215685	FF	On-Demand	Anodyne	ACE2	56	37
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875215685	FF	On-Demand	Anodyne	CTSV	53	39
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875215685	FF	On-Demand	Anodyne	FPR1	49	35
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875215685	FF	On-Demand	Anodyne	CTRB_BOVIN	56	42
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875215685	FF	On-Demand	Anodyne	BLA1_STEMA	42	37
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875215685	FF	On-Demand	Anodyne	NPFFR1	40	31
COC[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1ccccc1	ZINC000875215686	EF	On-Demand	Anodyne	CHRM1	15	40
COC[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1ccccc1	ZINC000875215686	EF	On-Demand	Anodyne	SLC6A3	26	45
COC[C@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875215696	DF	On-Demand	Anodyne	AMY2	50	34
COC[C@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875215696	DF	On-Demand	Anodyne	REN	20	49
CN1CCC(N2CC[C@H](NC(=O)C(=O)NCc3cccc4ncccc34)C2)CC1	ZINC000875215697	GD	On-Demand	Anodyne	SLC6A5	20	44
COC[C@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875215698	DF	On-Demand	Anodyne	AMY2	50	34
COC[C@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875215698	DF	On-Demand	Anodyne	REN	20	49
CN1CCC(N2CC[C@@H](NC(=O)C(=O)NCc3cccc4ncccc34)C2)CC1	ZINC000875215699	GD	On-Demand	Anodyne	SLC6A5	20	44
COC[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875215700	DF	On-Demand	Anodyne	AMY2	50	34
COC[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875215700	DF	On-Demand	Anodyne	REN	20	49
COC[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875215701	DF	On-Demand	Anodyne	AMY2	50	34
COC[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875215701	DF	On-Demand	Anodyne	REN	20	49
COC[C@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1	ZINC000875215713	EC	On-Demand	Anodyne	CCR5	25	40
COC[C@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1	ZINC000875215713	EC	On-Demand	Anodyne	EPHX2	15	45
COC[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1	ZINC000875215714	EC	On-Demand	Anodyne	CCR5	25	40
COC[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1	ZINC000875215714	EC	On-Demand	Anodyne	EPHX2	15	45
CONC(=O)C1CCN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CC1	ZINC000875215728	GF	On-Demand	Anodyne	EPHX2	24	44
O=C(NCC1(c2ccc(Cl)cc2)CCC1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875215729	GF	On-Demand	Anodyne	EPHX2	17	40
O=C(NCC1(c2ccc(Cl)cc2)CCC1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875215730	GF	On-Demand	Anodyne	EPHX2	17	40
O=C(NCC1(c2ccc(Cl)cc2)CCC1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875215731	GF	On-Demand	Anodyne	EPHX2	17	40
O=C(NCC1(c2ccc(Cl)cc2)CCC1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875215732	GF	On-Demand	Anodyne	EPHX2	17	40
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(C(=O)CC(F)(F)F)CC3)C[C@@H]1C2	ZINC000875215804	GD	On-Demand	Anodyne	EPHX2	36	47
CC[C@@H]1COCCN1CCNC(=O)NC1CCN(CCCOC)CC1	ZINC000875215816	FC	On-Demand	Anodyne	HTR4	16	41
O=C([C@@H](Cc1cccnc1)C1CCCC1)N(CC(F)(F)F)C1CC1	ZINC000875215878	EH	On-Demand	Anodyne	C3AR1	40	40
O=C([C@H](Cc1cccnc1)C1CCCC1)N(CC(F)(F)F)C1CC1	ZINC000875215879	EH	On-Demand	Anodyne	C3AR1	40	40
CCOC1CC2(C1)C[C@H]2C(=O)Nc1ccccc1S(=O)(=O)NC(C)(C)C	ZINC000875215901	GF	On-Demand	Anodyne	TIMP3	55	30
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H](COC)c1ccccc1	ZINC000875215945	FE	On-Demand	Anodyne	AMY2	45	31
COCCN(CC1CCN(C)CC1)C(=O)N[C@H](COC)c1ccccc1	ZINC000875215946	FE	On-Demand	Anodyne	AMY2	45	31
CC(=O)NCC1CCN(C(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)CC1	ZINC000875215980	GG	On-Demand	Anodyne	GRIN2B	41	36
CC(=O)NCC1CCN(C(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)CC1	ZINC000875215980	GG	On-Demand	Anodyne	CACNA1I	56	39
COC[C@H](NC(=O)N[C@H](C)C1CN(C(=O)OC(C)(C)C)C1)c1ccccc1	ZINC000875215995	GF	On-Demand	Anodyne	FPR1	40	32
COC[C@@H](NC(=O)N[C@H](C)C1CN(C(=O)OC(C)(C)C)C1)c1ccccc1	ZINC000875215996	GF	On-Demand	Anodyne	FPR1	40	32
COC[C@@H](NC(=O)N[C@@H](C)C1CN(C(=O)OC(C)(C)C)C1)c1ccccc1	ZINC000875215997	GF	On-Demand	Anodyne	FPR1	40	32
COC[C@H](NC(=O)N[C@@H](C)C1CN(C(=O)OC(C)(C)C)C1)c1ccccc1	ZINC000875215998	GF	On-Demand	Anodyne	FPR1	40	32
COC(=O)N(C)NC(=O)NCCc1c(C)[nH]c2ccccc12	ZINC000875216038	DD	On-Demand	Reactive	MTNR1A	37	43
COC(=O)N(C)NC(=O)NCCc1c(C)[nH]c2ccccc12	ZINC000875216038	DD	On-Demand	Reactive	MTNR1B	31	43
CC(=O)C1CCN(C(=O)NCC2(c3cccc(C)c3)CCCC2)CC1	ZINC000875216051	EH	On-Demand	Anodyne	EPHX2	19	41
CC(=O)C1CCN(C(=O)NCC2(c3cccc(C)c3)CCCC2)CC1	ZINC000875216051	EH	On-Demand	Anodyne	SMO	16	43
CCC1(CC)CCCN1C(=O)NC1CCN(CCCOC)CC1	ZINC000875216128	EF	On-Demand	Anodyne	HTR4	17	40
O=C(NCC1(c2ccc(Cl)cc2)CCC1)N1CCC(CO)(CO)CC1	ZINC000875216158	FF	On-Demand	Anodyne	EPHX2	15	46
Cn1nc2c(c1NC(=O)c1cnn(-c3cccc(F)c3)c1C(F)(F)F)CCC2	ZINC000875216205	GH	On-Demand	Anodyne	MST1R	40	38
O=C(NCCO)C1CCN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CC1	ZINC000875216383	GE	On-Demand	Anodyne	EPHX2	23	48
CC[C@@H]1CCCCN1CCNC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875216408	GC	On-Demand	Anodyne	L3MBTL3	42	39
CC[C@H]1CCCCN1CCNC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875216409	GC	On-Demand	Anodyne	L3MBTL3	42	39
COC[C@@H](NC(=O)NN(C)C(=O)OC)c1ccccc1	ZINC000875216483	CD	On-Demand	Reactive	UTS2	45	38
COC[C@H](NC(=O)NN(C)C(=O)OC)c1ccccc1	ZINC000875216484	CD	On-Demand	Reactive	UTS2	45	38
CN(C(=O)[C@@H]1c2ccccc2C(=O)OC1(C)C)c1ccc(S(C)(=O)=O)cc1	ZINC000875216527	GF	On-Demand	Anodyne	PTGS2	27	41
CC[C@H](C)N(C)CCNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875216533	FF	On-Demand	Mild	ITK	15	49
COC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccccc1	ZINC000875216566	EE	On-Demand	Anodyne	SLC6A4	30	45
COC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccccc1	ZINC000875216566	EE	On-Demand	Anodyne	SLC6A3	73	45
COC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccccc1	ZINC000875216569	EE	On-Demand	Anodyne	SLC6A4	30	45
COC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccccc1	ZINC000875216569	EE	On-Demand	Anodyne	SLC6A3	73	45
COC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccccc1	ZINC000875216572	EE	On-Demand	Anodyne	SLC6A4	30	45
COC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccccc1	ZINC000875216572	EE	On-Demand	Anodyne	SLC6A3	73	45
COC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccccc1	ZINC000875216575	EE	On-Demand	Anodyne	SLC6A4	30	45
COC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccccc1	ZINC000875216575	EE	On-Demand	Anodyne	SLC6A3	73	45
COC[C@@H](NC(=O)N(C)CCN1CC2(CCOCC2)C1)c1ccccc1	ZINC000875216596	FE	On-Demand	Anodyne	CASR	49	38
COC[C@H](NC(=O)N(C)CCN1CC2(CCOCC2)C1)c1ccccc1	ZINC000875216599	FE	On-Demand	Anodyne	CASR	49	38
O=C(NCc1ccccc1-c1ccc(Cl)cc1)N1CCC(CO)(CO)CC1	ZINC000875216602	GG	On-Demand	Anodyne	CACNA1H	53	33
O=C(NCc1ccccc1-c1ccc(Cl)cc1)N1CCC(CO)(CO)CC1	ZINC000875216602	GG	On-Demand	Anodyne	EPHX2	25	53
O=C(NCc1ccccc1-c1ccc(Cl)cc1)N1CCC(CO)(CO)CC1	ZINC000875216602	GG	On-Demand	Anodyne	ADAMTS5	22	44
CN(C(=O)c1cccc(OC(C)(C)C)c1)c1ccc(S(C)(=O)=O)cc1	ZINC000875216643	FH	On-Demand	Anodyne	HSD17B2	19	44
CCOC(=O)[C@@H]1CN(C(=O)NC2CCN(CCCOC)CC2)CCC1(F)F	ZINC000875216646	GD	On-Demand	Anodyne	HTR4	27	41
COC[C@@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccccc1	ZINC000875216657	FD	On-Demand	Anodyne	UTS2	53	39
COC[C@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccccc1	ZINC000875216658	FD	On-Demand	Anodyne	UTS2	53	39
COC(=O)N(C)NC(=O)NCC1(c2cccc(C)c2)CCCC1	ZINC000875216705	DF	On-Demand	Reactive	KCNA3	43	35
COC[C@@H](NC(=O)N[C@@H]1CC(C)(C)CC[C@H]1O)c1ccccc1	ZINC000875216723	DF	On-Demand	Anodyne	TIMP3	47	33
COC[C@H](NC(=O)N[C@@H]1CC(C)(C)CC[C@H]1O)c1ccccc1	ZINC000875216724	DF	On-Demand	Anodyne	TIMP3	47	33
COC[C@H](NC(=O)N1Cc2cccnc2N2CCC[C@H]2C1)c1ccccc1	ZINC000875216733	FF	On-Demand	Anodyne	PTAFR	20	40
COC[C@@H](NC(=O)N1Cc2cccnc2N2CCC[C@H]2C1)c1ccccc1	ZINC000875216735	FF	On-Demand	Anodyne	PTAFR	20	40
O=C(CCNC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)Nc1ccccc1	ZINC000875216762	GD	On-Demand	Anodyne	ACE	21	45
O=C(CCNC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)Nc1ccccc1	ZINC000875216764	GD	On-Demand	Anodyne	ACE	21	45
O=C(CCNC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)Nc1ccccc1	ZINC000875216765	GD	On-Demand	Anodyne	ACE	21	45
O=C(CCNC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)Nc1ccccc1	ZINC000875216766	GD	On-Demand	Anodyne	ACE	21	45
COc1ccccc1[C@H]1CCCN(C(=O)NCc2nc(C)no2)CC1	ZINC000875216843	EF	On-Demand	Anodyne	EPHX2	16	43
COc1ccccc1[C@H]1CCCN(C(=O)NCc2nc(C)no2)CC1	ZINC000875216843	EF	On-Demand	Anodyne	SMO	36	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2nc(C)no2)CC1	ZINC000875216844	EF	On-Demand	Anodyne	EPHX2	16	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2nc(C)no2)CC1	ZINC000875216844	EF	On-Demand	Anodyne	SMO	36	40
O=C(NCc1cn2c(n1)CCCC2)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875216962	FG	On-Demand	Anodyne	CPT1A	50	33
O=C(NCc1cn2c(n1)CCCC2)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875216963	FG	On-Demand	Anodyne	CPT1A	50	33
O=C(NCc1cn2c(n1)CCCC2)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875216964	FG	On-Demand	Anodyne	CPT1A	50	33
O=C(NCc1cn2c(n1)CCCC2)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875216965	FG	On-Demand	Anodyne	CPT1A	50	33
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2c(C)[nH]c3ccccc23)C1	ZINC000875216967	FF	On-Demand	Anodyne	SSTR4	50	36
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2c(C)[nH]c3ccccc23)C1	ZINC000875216967	FF	On-Demand	Anodyne	SSTR5	40	36
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2c(C)[nH]c3ccccc23)C1	ZINC000875216967	FF	On-Demand	Anodyne	MTNR1A	17	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2c(C)[nH]c3ccccc23)C1	ZINC000875216967	FF	On-Demand	Anodyne	MTNR1B	20	42
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CCN(CCCOC)CC2)C1	ZINC000875216997	FD	On-Demand	Anodyne	HTR4	25	42
Cc1nnc(NNC(=O)NCC2(c3ccc(Cl)cc3)CCC2)n1C	ZINC000875217007	EF	On-Demand	Reactive	HSD11B1	31	41
O=C(C(=O)N(CC(F)(F)F)C1CC1)c1cc(Cl)cc(Cl)c1	ZINC000875217302	EH	On-Demand	Anodyne	CACNA1I	47	33
COC(=O)C1(O)CN(C(=O)NCCCOCc2ccc(OC)cc2)C1	ZINC000875217362	FC	On-Demand	Anodyne	UGCG	17	41
COC(=O)C1(O)CN(C(=O)NCCCOCc2ccc(OC)cc2)C1	ZINC000875217362	FC	On-Demand	Anodyne	GBA2	23	41
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCOCc3ccc(OC)cc3)C[C@@H]1C2	ZINC000875217370	GE	On-Demand	Anodyne	EPHX2	18	41
O=C(OCc1ccccc1)c1cccc(CNC(=O)N2C[C@H]3C(=O)OC[C@H]3C2)c1	ZINC000875217411	GE	On-Demand	Anodyne	NAAA	16	41
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccc(C)cc3)CC2)C1	ZINC000875217435	FF	On-Demand	Anodyne	EPHX2	31	62
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccc(C)cc3)CC2)C1	ZINC000875217435	FF	On-Demand	Anodyne	L3MBTL3	95	46
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccc(C)cc3)CC2)C1	ZINC000875217436	FF	On-Demand	Anodyne	EPHX2	31	62
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccc(C)cc3)CC2)C1	ZINC000875217436	FF	On-Demand	Anodyne	L3MBTL3	95	46
COC(=O)N(C)NC(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000875217481	ED	On-Demand	Reactive	EPHX2	44	49
COC(=O)N(C)NC(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000875217481	ED	On-Demand	Reactive	L3MBTL3	72	40
CCOC(=O)C1=CC[C@H](NC(=O)NC2CCN(C(=O)c3ccc(C)cc3)CC2)C1	ZINC000875217488	GF	On-Demand	Anodyne	EPHX2	41	45
CCOC(=O)C1=CC[C@H](NC(=O)NC2CCN(C(=O)c3ccc(C)cc3)CC2)C1	ZINC000875217488	GF	On-Demand	Anodyne	L3MBTL3	45	33
COc1ccccc1[C@H]1CCCN(C(=O)NCCCc2nc(C)no2)CC1	ZINC000875217509	FG	On-Demand	Anodyne	DRD2	15	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCc2nc(C)no2)CC1	ZINC000875217510	FG	On-Demand	Anodyne	DRD2	15	41
CC(=O)C1CCN(C(=O)C(=O)NCC(C)(C)c2ccc(F)cc2Cl)CC1	ZINC000875217520	GF	On-Demand	Anodyne	P2RX7	47	38
CC(=O)C1CCN(C(=O)C(=O)NCC(C)(C)c2ccc(F)cc2Cl)CC1	ZINC000875217520	GF	On-Demand	Anodyne	SFRP1	40	32
C#CC[C@H](CCOC)NC(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000875217537	FE	On-Demand	Mild	EPHX2	27	43
C#CC[C@H](CCOC)NC(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000875217537	FE	On-Demand	Mild	L3MBTL3	53	34
C#CC[C@@H](CCOC)NC(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000875217538	FE	On-Demand	Mild	EPHX2	27	43
C#CC[C@@H](CCOC)NC(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000875217538	FE	On-Demand	Mild	L3MBTL3	53	34
O=C(NCCCc1nnc2n1CCCCC2)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875217560	GF	On-Demand	Anodyne	TRY1_BOVIN	44	34
O=C(NCCCc1nnc2n1CCCCC2)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875217561	GF	On-Demand	Anodyne	TRY1_BOVIN	44	34
O=C(NCCCc1nnc2n1CCCCC2)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875217562	GF	On-Demand	Anodyne	TRY1_BOVIN	44	34
O=C(NCCCc1nnc2n1CCCCC2)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875217563	GF	On-Demand	Anodyne	TRY1_BOVIN	44	34
COC(=O)C1(O)CN(C(=O)NC2CCN(C(=O)c3ccc(C)cc3)CC2)C1	ZINC000875217571	GC	On-Demand	Anodyne	EPHX2	23	52
COC(=O)C1(O)CN(C(=O)NC2CCN(C(=O)c3ccc(C)cc3)CC2)C1	ZINC000875217571	GC	On-Demand	Anodyne	L3MBTL3	63	37
CO[C@@H]1CC[C@@H](C)N(C(=O)NC2CCN(C(=O)c3ccc(C)cc3)CC2)C1	ZINC000875217583	FF	On-Demand	Anodyne	EPHX2	15	49
CO[C@@H]1CC[C@@H](C)N(C(=O)NC2CCN(C(=O)c3ccc(C)cc3)CC2)C1	ZINC000875217583	FF	On-Demand	Anodyne	L3MBTL3	46	35
C[C@H](NC(=O)C(=O)NCCCSc1nccs1)c1ccnn1C	ZINC000875217616	FD	On-Demand	Clean	HPN	49	32
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCOCc1ccc(OC)cc1	ZINC000875217666	GE	On-Demand	Anodyne	SLC6A4	21	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCOCc1ccc(OC)cc1	ZINC000875217666	GE	On-Demand	Anodyne	SLC6A3	39	41
COC(=O)N(C)NC(=O)NCCCOCc1ccc(OC)cc1	ZINC000875217669	ED	On-Demand	Reactive	SCNN1A	15	41
COC(=O)N(C)NC(=O)NCCCOCc1ccc(OC)cc1	ZINC000875217669	ED	On-Demand	Reactive	MTNR1A	43	40
COC(=O)N(C)NC(=O)NCCCOCc1ccc(OC)cc1	ZINC000875217669	ED	On-Demand	Reactive	MTNR1B	33	40
O=C(NCCN1CC[C@H](O)C1)NCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000875217683	GD	On-Demand	Anodyne	DRD4	41	32
O=C(NCCN1CC[C@H](O)C1)NCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000875217683	GD	On-Demand	Anodyne	HRH2	29	43
O=C(NCCN1CC[C@H](O)C1)NCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000875217683	GD	On-Demand	Anodyne	OPRK1	24	41
O=C(NCCN1CC[C@H](O)C1)NCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000875217683	GD	On-Demand	Anodyne	CCR3	34	43
O=C(NCCN1CC[C@H](O)C1)NCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000875217683	GD	On-Demand	Anodyne	SLC12A5	62	35
O=C(NCCN1CC[C@@H](O)C1)NCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000875217684	GD	On-Demand	Anodyne	DRD4	41	32
O=C(NCCN1CC[C@@H](O)C1)NCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000875217684	GD	On-Demand	Anodyne	HRH2	29	43
O=C(NCCN1CC[C@@H](O)C1)NCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000875217684	GD	On-Demand	Anodyne	OPRK1	24	41
O=C(NCCN1CC[C@@H](O)C1)NCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000875217684	GD	On-Demand	Anodyne	CCR3	34	43
O=C(NCCN1CC[C@@H](O)C1)NCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000875217684	GD	On-Demand	Anodyne	SLC12A5	62	35
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000875217740	FE	On-Demand	Anodyne	EPHX2	36	42
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000875217740	FE	On-Demand	Anodyne	L3MBTL3	50	35
CC(=O)C1CCN(C(=O)NCc2cccc(C(=O)OCc3ccccc3)c2)CC1	ZINC000875217761	GH	On-Demand	Anodyne	FKBP1A	22	40
CC(=O)C1CCN(C(=O)NCc2cccc(C(=O)OCc3ccccc3)c2)CC1	ZINC000875217761	GH	On-Demand	Anodyne	GRIN2B	38	41
CC(=O)C1CCN(C(=O)NCc2cccc(C(=O)OCc3ccccc3)c2)CC1	ZINC000875217761	GH	On-Demand	Anodyne	TRY2_BOVIN	40	34
CC(=O)C1CCN(C(=O)NCc2cccc(C(=O)OCc3ccccc3)c2)CC1	ZINC000875217761	GH	On-Demand	Anodyne	ST14	43	35
CC(=O)C1CCN(C(=O)NCc2cccc(C(=O)OCc3ccccc3)c2)CC1	ZINC000875217761	GH	On-Demand	Anodyne	SLC12A5	65	34
O=C(NCc1cccc(C(=O)OCc2ccccc2)c1)NC[C@@H]1C[C@H](O)C1	ZINC000875217762	FF	On-Demand	Anodyne	GRIN2B	17	41
O=C(NCc1cccc(C(=O)OCc2ccccc2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875217763	FF	On-Demand	Anodyne	GRIN2B	17	41
O=C(NCc1cccc(C(=O)OCc2ccccc2)c1)NCC1CC(O)C1	ZINC000875217764	FF	On-Demand	Anodyne	GRIN2B	17	41
CCOC1CC2(C1)C[C@H]2NC(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000875217792	GF	On-Demand	Anodyne	EPHX2	53	47
CCOC1CC2(C1)C[C@H]2NC(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000875217792	GF	On-Demand	Anodyne	L3MBTL3	46	33
CCOC1CC2(C1)C[C@@H]2NC(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000875217793	GF	On-Demand	Anodyne	EPHX2	53	47
CCOC1CC2(C1)C[C@@H]2NC(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000875217793	GF	On-Demand	Anodyne	L3MBTL3	46	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000875217794	GE	On-Demand	Anodyne	SLC6A4	17	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000875217794	GE	On-Demand	Anodyne	SLC6A3	38	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000875217794	GE	On-Demand	Anodyne	L3MBTL3	58	36
CCCCCCCNC(=O)C(=O)N[C@@H]1CCN(C(C)C)C1=O	ZINC000875217846	DD	On-Demand	Mild	ASAH1	87	36
CCCCCCCNC(=O)C(=O)N[C@@H]1CCN(C(C)C)C1=O	ZINC000875217846	DD	On-Demand	Mild	LASR	51	39
CCCCCCCNC(=O)C(=O)N[C@H]1CCN(C(C)C)C1=O	ZINC000875217847	DD	On-Demand	Mild	ASAH1	87	36
CCCCCCCNC(=O)C(=O)N[C@H]1CCN(C(C)C)C1=O	ZINC000875217847	DD	On-Demand	Mild	LASR	51	39
CC(=O)C1CCN(C(=O)NC2CCN(C(=O)c3ccc(C)cc3)CC2)CC1	ZINC000875217848	FF	On-Demand	Anodyne	EPHX2	45	64
CC(=O)C1CCN(C(=O)NC2CCN(C(=O)c3ccc(C)cc3)CC2)CC1	ZINC000875217848	FF	On-Demand	Anodyne	L3MBTL3	92	43
COCC1CC(NC(=O)NC2CCN(C(=O)c3ccc(C)cc3)CC2)C1	ZINC000875217866	FE	On-Demand	Anodyne	EPHX2	52	52
COCC1CC(NC(=O)NC2CCN(C(=O)c3ccc(C)cc3)CC2)C1	ZINC000875217866	FE	On-Demand	Anodyne	L3MBTL3	69	37
C#C[C@@H]1CC[C@@H](NC(=O)NC2CCN(C(=O)c3ccc(C)cc3)CC2)CC1	ZINC000875217875	FG	On-Demand	Mild	EPHX2	44	46
C#C[C@@H]1CC[C@@H](NC(=O)NC2CCN(C(=O)c3ccc(C)cc3)CC2)CC1	ZINC000875217875	FG	On-Demand	Mild	L3MBTL3	89	42
C[C@H](NC(=O)C(=O)NCC(C)(C)c1ccc(F)cc1Cl)c1ccnn1C	ZINC000875217898	GE	On-Demand	Anodyne	P2RX7	27	42
C[C@@H]1C[C@H](O)CCN1C(=O)NCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000875217904	GG	On-Demand	Anodyne	FKBP1A	22	41
C[C@@H]1C[C@H](O)CCN1C(=O)NCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000875217904	GG	On-Demand	Anodyne	SLC12A5	65	35
CN(CC1(C)COC1)C(=O)NCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000875217921	GG	On-Demand	Anodyne	NPR	44	30
CN(C[C@@H]1C[C@H](O)C1)C(=O)NCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000875217931	GF	On-Demand	Anodyne	PDS	36	40
C#CC[C@H](COC)NC(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000875217955	FD	On-Demand	Mild	EPHX2	29	43
C#CC[C@H](COC)NC(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000875217955	FD	On-Demand	Mild	L3MBTL3	55	34
C#CC[C@@H](COC)NC(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000875217956	FD	On-Demand	Mild	EPHX2	29	43
C#CC[C@@H](COC)NC(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000875217956	FD	On-Demand	Mild	L3MBTL3	55	34
CS[C@@H]1C[C@@H](NC(=O)NC2CCN(C(=O)c3ccc(C)cc3)CC2)C1	ZINC000875217957	FF	On-Demand	Anodyne	EPHX2	46	49
CS[C@@H]1C[C@@H](NC(=O)NC2CCN(C(=O)c3ccc(C)cc3)CC2)C1	ZINC000875217957	FF	On-Demand	Anodyne	L3MBTL3	75	39
COCC(C)(C)CCNC(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000875218056	GF	On-Demand	Anodyne	EPHX2	46	48
COCC(C)(C)CCNC(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000875218056	GF	On-Demand	Anodyne	L3MBTL3	47	34
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(C(=O)c4ccc(C)cc4)CC3)C[C@@H]1C2	ZINC000875218059	GE	On-Demand	Anodyne	EPHX2	47	53
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(C(=O)c4ccc(C)cc4)CC3)C[C@@H]1C2	ZINC000875218059	GE	On-Demand	Anodyne	L3MBTL3	49	35
O=C(NCc1cccc(C(=O)OCc2ccccc2)c1)N[C@@H]1C[C@H](CO)C1	ZINC000875218063	FF	On-Demand	Anodyne	EPHX2	17	41
COCCOc1ccccc1NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875218067	EH	On-Demand	Anodyne	RBP4	15	41
CC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875218166	DF	On-Demand	Anodyne	ACE	25	41
CC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875218166	DF	On-Demand	Anodyne	OPRD1	19	43
CC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875218166	DF	On-Demand	Anodyne	MME	43	44
CC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875218166	DF	On-Demand	Anodyne	CASP3	17	42
CC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875218166	DF	On-Demand	Anodyne	BMP1	20	44
CC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875218166	DF	On-Demand	Anodyne	KLK3	75	37
CC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875218166	DF	On-Demand	Anodyne	CTSB	70	43
CC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875218166	DF	On-Demand	Anodyne	PAPA1_CARPA	81	41
CC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875218166	DF	On-Demand	Anodyne	CYSP_TRYCR	49	41
CC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875218166	DF	On-Demand	Anodyne	CTSK	50	54
CC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875218166	DF	On-Demand	Anodyne	CTSL	46	43
CC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875218166	DF	On-Demand	Anodyne	PGA	32	42
CC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875218166	DF	On-Demand	Anodyne	TIMP3	47	33
CC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875218166	DF	On-Demand	Anodyne	CAPNS1	69	41
CC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875218166	DF	On-Demand	Anodyne	ECE1	39	41
CC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875218166	DF	On-Demand	Anodyne	HLA-DRB1	49	34
CC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875218166	DF	On-Demand	Anodyne	CTSS	23	48
CC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875218166	DF	On-Demand	Anodyne	CAPN1	89	44
CC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875218166	DF	On-Demand	Anodyne	CASP1	25	43
CC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875218166	DF	On-Demand	Anodyne	CAPN2	140	44
CC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875218166	DF	On-Demand	Anodyne	ACE2	45	36
CC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875218166	DF	On-Demand	Anodyne	CASP9	30	40
CC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875218166	DF	On-Demand	Anodyne	NPR	79	39
CC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875218166	DF	On-Demand	Anodyne	NAAA	54	38
CC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875218166	DF	On-Demand	Anodyne	PSMB5	47	40
CC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875218166	DF	On-Demand	Anodyne	SLC12A5	66	35
CC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875218166	DF	On-Demand	Anodyne	PDS	44	34
O=C(NCc1cccc2ncccc12)C(=O)N[C@@H](CC1CC1)c1ccccc1	ZINC000875218172	FH	On-Demand	Anodyne	TACR3	45	35
O=C(NCc1cccc2ncccc12)C(=O)N[C@H](CC1CC1)c1ccccc1	ZINC000875218173	FH	On-Demand	Anodyne	TACR3	45	35
O=C(NCCCCCc1ccccc1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875218266	FF	On-Demand	Anodyne	FAAH	31	43
O=C(NCCCCCc1ccccc1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875218266	FF	On-Demand	Anodyne	CES1	42	43
CCOc1ccccc1CCNC(=O)N1CCC(CO)(CO)CC1	ZINC000875218308	ED	On-Demand	Anodyne	HCN1	66	40
CCOc1ccccc1CCNC(=O)N1CCC(CO)(CO)CC1	ZINC000875218308	ED	On-Demand	Anodyne	HCN4	47	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCC#N)cc1	ZINC000875218324	ED	On-Demand	Mild	SLC6A4	22	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCC#N)cc1	ZINC000875218324	ED	On-Demand	Mild	SLC6A3	43	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCC#N)cc1	ZINC000875218325	ED	On-Demand	Mild	SLC6A4	22	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCC#N)cc1	ZINC000875218325	ED	On-Demand	Mild	SLC6A3	43	42
CCn1nc(C)c(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)c1C	ZINC000875218347	FF	On-Demand	Anodyne	P2RX7	27	46
CCn1nc(C)c(CNC(=O)NC2CC(Nc3ccccc3)C2)c1C	ZINC000875218367	EF	On-Demand	Anodyne	P2RX7	15	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](CC2CC2)c2ccccc2)C1	ZINC000875218402	EE	On-Demand	Anodyne	SLC6A1	76	38
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](CC2CC2)c2ccccc2)C1	ZINC000875218402	EE	On-Demand	Anodyne	CCR5	33	45
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](CC2CC2)c2ccccc2)C1	ZINC000875218403	EE	On-Demand	Anodyne	SLC6A1	76	38
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](CC2CC2)c2ccccc2)C1	ZINC000875218403	EE	On-Demand	Anodyne	CCR5	33	45
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](CC2CC2)c2ccccc2)C1	ZINC000875218404	EE	On-Demand	Anodyne	SLC6A1	76	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](CC2CC2)c2ccccc2)C1	ZINC000875218404	EE	On-Demand	Anodyne	CCR5	33	45
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](CC2CC2)c2ccccc2)C1	ZINC000875218405	EE	On-Demand	Anodyne	SLC6A1	76	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](CC2CC2)c2ccccc2)C1	ZINC000875218405	EE	On-Demand	Anodyne	CCR5	33	45
CC[C@@H](NC(=O)[C@@H](NC=O)C(C)C)C(C)C	ZINC000875218421	BD	On-Demand	Anodyne	PGA	56	35
CC[C@H](NC(=O)[C@@H](NC=O)C(C)C)C(C)C	ZINC000875218422	BD	On-Demand	Anodyne	PGA	56	35
CC[C@@H](CN1CCCC1)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875218445	GD	On-Demand	Anodyne	ROCK1	24	41
CC[C@@H](CN1CCCC1)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875218445	GD	On-Demand	Anodyne	ROCK2	17	41
CC[C@H](CN1CCCC1)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875218446	GD	On-Demand	Anodyne	ROCK1	24	41
CC[C@H](CN1CCCC1)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875218446	GD	On-Demand	Anodyne	ROCK2	17	41
N#Cc1ccc(N2CCC(NC(=O)N[C@@H]3CC=CC[C@H]3C(F)(F)F)CC2)nc1	ZINC000875218447	GG	On-Demand	Mild	HPGDS	15	40
O=C(NCc1ccc2c(c1)OCCCO2)N1Cc2cccc(O)c2C1	ZINC000875218448	EF	On-Demand	Clean	NOS2	72	34
O=C(NCc1ccc2c(c1)OCCCO2)N1Cc2cccc(O)c2C1	ZINC000875218448	EF	On-Demand	Clean	NAMPT	23	42
COCC1CC(NC(=O)NC2(c3cccc(C(F)(F)F)c3)CC2)C1	ZINC000875218475	EG	On-Demand	Anodyne	CCR2	40	36
COCC1CC(NC(=O)NC2(c3cccc(C(F)(F)F)c3)CC2)C1	ZINC000875218475	EG	On-Demand	Anodyne	EPHX2	16	41
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)N2CCC[C@H](C(C)=O)C2)c1	ZINC000875218483	FD	On-Demand	Anodyne	SFRP1	51	33
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)N2CCC[C@H](C(C)=O)C2)c1	ZINC000875218483	FD	On-Demand	Anodyne	WNT3	54	33
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)N2CCC[C@@H](C(C)=O)C2)c1	ZINC000875218484	FD	On-Demand	Anodyne	SFRP1	51	33
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)N2CCC[C@@H](C(C)=O)C2)c1	ZINC000875218484	FD	On-Demand	Anodyne	WNT3	54	33
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)N2CCC[C@@H](C(C)=O)C2)c1	ZINC000875218485	FD	On-Demand	Anodyne	SFRP1	51	33
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)N2CCC[C@@H](C(C)=O)C2)c1	ZINC000875218485	FD	On-Demand	Anodyne	WNT3	54	33
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)N2CCC[C@H](C(C)=O)C2)c1	ZINC000875218486	FD	On-Demand	Anodyne	SFRP1	51	33
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)N2CCC[C@H](C(C)=O)C2)c1	ZINC000875218486	FD	On-Demand	Anodyne	WNT3	54	33
CCC[C@H](NC(=O)NCc1ccc(F)cc1)C(=O)OCCC(N)=O	ZINC000875218495	ED	On-Demand	Anodyne	ANPEP	18	51
O=C(NCc1ccc2c(c1)OCCCO2)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875218502	GD	On-Demand	Anodyne	NOS2	75	34
CCCCCCCNC(=O)C(=O)N[C@@H]1CCc2c[nH]nc2C1	ZINC000875218503	DD	On-Demand	Mild	ASAH1	47	31
CCCCCCCNC(=O)C(=O)N[C@H]1CCc2c[nH]nc2C1	ZINC000875218504	DD	On-Demand	Mild	ASAH1	47	31
N#Cc1ccc(N2CCC(NC(=O)N3CCO[C@H](C(F)(F)F)CC3)CC2)nc1	ZINC000875218512	GE	On-Demand	Mild	HPGDS	21	42
N#Cc1ccc(N2CCC(NC(=O)N3CCO[C@@H](C(F)(F)F)CC3)CC2)nc1	ZINC000875218513	GE	On-Demand	Mild	HPGDS	21	42
CCOc1ccccc1CCNC(=O)N1CC[C@]2(CC(C(=O)OC)=NO2)C1	ZINC000875218528	GD	On-Demand	Anodyne	HCN1	49	33
CCOc1ccccc1CCNC(=O)N1CC[C@]2(CC(C(=O)OC)=NO2)C1	ZINC000875218528	GD	On-Demand	Anodyne	HCN4	40	31
CCOc1ccccc1CCNC(=O)N1CC[C@@]2(CC(C(=O)OC)=NO2)C1	ZINC000875218529	GD	On-Demand	Anodyne	HCN1	49	33
CCOc1ccccc1CCNC(=O)N1CC[C@@]2(CC(C(=O)OC)=NO2)C1	ZINC000875218529	GD	On-Demand	Anodyne	HCN4	40	31
O=C(NCCCCCc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875218531	EE	On-Demand	Anodyne	FKBP1A	16	42
O=C(NCCCCCc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875218531	EE	On-Demand	Anodyne	GHRHR	43	36
O=C(NCCCCCc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875218531	EE	On-Demand	Anodyne	SIGMAR1	29	43
O=C(NCCCCCc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875218531	EE	On-Demand	Anodyne	FAAH	46	45
O=C(NCCCCCc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875218531	EE	On-Demand	Anodyne	CES1	53	37
O=C(NCCCCCc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875218531	EE	On-Demand	Anodyne	AMP1_PLAFQ	22	43
CCOc1ccccc1CCNC(=O)N1CCN(C)C(C)(C)CC1	ZINC000875218545	EF	On-Demand	Anodyne	HCN1	64	40
CCOc1ccccc1CCNC(=O)N1CCN(C)C(C)(C)CC1	ZINC000875218545	EF	On-Demand	Anodyne	HCN4	45	35
CCOc1ccccc1CCNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875218590	ED	On-Demand	Anodyne	SSTR5	55	36
CCOc1ccccc1CCNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875218590	ED	On-Demand	Anodyne	CCR3	23	40
CCOc1ccccc1CCNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875218590	ED	On-Demand	Anodyne	EPHX2	19	40
CCOc1ccccc1CCNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875218590	ED	On-Demand	Anodyne	BIRC2	34	42
CCOc1ccccc1CCNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875218590	ED	On-Demand	Anodyne	HCN1	58	36
CCOc1ccccc1CCNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875218590	ED	On-Demand	Anodyne	HCN4	47	36
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCCc2ccccc2)C1	ZINC000875218606	EG	On-Demand	Anodyne	ACE	65	44
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCCc2ccccc2)C1	ZINC000875218606	EG	On-Demand	Anodyne	OPRM1	20	43
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCCc2ccccc2)C1	ZINC000875218606	EG	On-Demand	Anodyne	GHRHR	43	35
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCCc2ccccc2)C1	ZINC000875218606	EG	On-Demand	Anodyne	CTSK	26	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCCc2ccccc2)C1	ZINC000875218606	EG	On-Demand	Anodyne	SCN2A	25	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCCc2ccccc2)C1	ZINC000875218606	EG	On-Demand	Anodyne	MMP3	40	38
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCCc2ccccc2)C1	ZINC000875218606	EG	On-Demand	Anodyne	FAAH	36	47
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCCc2ccccc2)C1	ZINC000875218606	EG	On-Demand	Anodyne	CFTR	40	34
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCCc2ccccc2)C1	ZINC000875218606	EG	On-Demand	Anodyne	CAPN2	46	37
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCCc2ccccc2)C1	ZINC000875218606	EG	On-Demand	Anodyne	AMP1_PLAFQ	35	45
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCCCc2ccccc2)C1	ZINC000875218606	EG	On-Demand	Anodyne	ASAH1	80	35
Cc1nccnc1[C@H](C)NC(=O)NC(C)(C)c1cccc(C(F)(F)F)c1	ZINC000875218619	FI	On-Demand	Anodyne	IMDH_CRYPV	54	36
CCOc1ccccc1CCNC(=O)N1CC(O)(C(=O)OC)C1	ZINC000875218626	DC	On-Demand	Anodyne	HCN1	56	36
CCOc1ccccc1CCNC(=O)N1CC(O)(C(=O)OC)C1	ZINC000875218626	DC	On-Demand	Anodyne	HCN4	42	33
CCOc1ccccc1CCNC(=O)N1CCCCCCNC(=O)CC1	ZINC000875218630	FF	On-Demand	Anodyne	HCN1	52	38
CCOc1ccccc1CCNC(=O)N1CCCCCCNC(=O)CC1	ZINC000875218630	FF	On-Demand	Anodyne	HCN4	44	34
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)c1	ZINC000875218687	GD	On-Demand	Anodyne	WNT3	40	31
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)c1	ZINC000875218690	GD	On-Demand	Anodyne	WNT3	40	31
C[C@@H](NC(=O)NC(C)(C)c1cccc(C(F)(F)F)c1)c1ccnn1C	ZINC000875218712	FH	On-Demand	Anodyne	IMDH_CRYPV	55	36
C[C@H](NC(=O)NC(C)(C)c1cccc(C(F)(F)F)c1)c1ccnn1C	ZINC000875218715	FH	On-Demand	Anodyne	IMDH_CRYPV	55	36
CC(=O)C1CCN(C(=O)C(=O)N[C@H](CC2CC2)c2ccccc2)CC1	ZINC000875218721	EE	On-Demand	Anodyne	CCR5	27	42
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](CC2CC2)c2ccccc2)CC1	ZINC000875218723	EE	On-Demand	Anodyne	CCR5	27	42
N#CCOc1ccc(CNC(=O)NC2CC(Nc3ccccc3)C2)cc1	ZINC000875218749	FG	On-Demand	Mild	LTA4H	24	41
N#CCOc1ccc(CNC(=O)NC2CC(Nc3ccccc3)C2)cc1	ZINC000875218749	FG	On-Demand	Mild	EPHX2	18	40
O=C(NCC1(c2ccc(Cl)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875218766	FE	On-Demand	Anodyne	CCR1	41	38
O=C(NCC1(c2ccc(Cl)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875218766	FE	On-Demand	Anodyne	EPHX2	15	43
CC[C@@H](CN1CCCC1)NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875218781	GC	On-Demand	Anodyne	L3MBTL3	49	40
CC[C@H](CN1CCCC1)NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875218783	GC	On-Demand	Anodyne	L3MBTL3	49	40
CCOc1cc(CCCNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)ccc1OC	ZINC000875218795	GD	On-Demand	Anodyne	SSTR5	70	39
CCOc1cc(CCCNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)ccc1OC	ZINC000875218798	GD	On-Demand	Anodyne	SSTR5	70	39
N#CCOc1ccc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)cc1	ZINC000875218896	GF	On-Demand	Mild	FAAH	23	41
Cc1nnc(NNC(=O)NCCCCCc2ccccc2)n1C	ZINC000875218897	DE	On-Demand	Reactive	FAAH	63	41
Cc1nnc(NNC(=O)NCCCCCc2ccccc2)n1C	ZINC000875218897	DE	On-Demand	Reactive	CES1	61	36
Cc1nnc(NNC(=O)NCCCCCc2ccccc2)n1C	ZINC000875218897	DE	On-Demand	Reactive	AMP1_PLAFQ	21	41
Cc1nnc(NNC(=O)NCCCCCc2ccccc2)n1C	ZINC000875218897	DE	On-Demand	Reactive	ASAH1	44	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccccc2OCC2CC2)C1	ZINC000875218906	FD	On-Demand	Anodyne	HCN1	50	31
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccccc2OCC2CC2)C1	ZINC000875218906	FD	On-Demand	Anodyne	HCN4	48	31
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccccc2OCC2CC2)C1	ZINC000875218907	FD	On-Demand	Anodyne	HCN1	50	31
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccccc2OCC2CC2)C1	ZINC000875218907	FD	On-Demand	Anodyne	HCN4	48	31
CC(=O)NC[C@@H]1CCCCN1C(=O)NCc1ccc(OCC#N)cc1	ZINC000875218908	ED	On-Demand	Mild	LGMN	51	33
CC(C)[C@H](CNC(=O)C(=O)NCC1CC=CC1)NC(=O)OC(C)(C)C	ZINC000875218910	FD	On-Demand	Anodyne	ECE1	30	40
CCOc1cc(CCCNC(=O)C(=O)N[C@@H](C)c2ccnn2C)ccc1OC	ZINC000875218959	GD	On-Demand	Anodyne	MTNR1B	15	43
CCOc1cc(CCCNC(=O)C(=O)N[C@H](C)c2ccnn2C)ccc1OC	ZINC000875218963	GD	On-Demand	Anodyne	MTNR1B	15	43
CC[C@@H](NC(=O)NCc1ccc(OCC#N)cc1)[C@@H](O)c1ccccc1	ZINC000875218977	FF	On-Demand	Mild	PDS	56	42
CC[C@@H](NC(=O)NCc1ccc(OCC#N)cc1)[C@H](O)c1ccccc1	ZINC000875218983	FF	On-Demand	Mild	PDS	56	42
O=C1CCN(C(=O)NCc2ccc3c(c2)OCCCO3)CCCCCCN1	ZINC000875218987	GE	On-Demand	Anodyne	NOS2	87	35
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc3c(c2)OCCCO3)C1	ZINC000875218992	FE	On-Demand	Anodyne	NOS2	78	36
N#CCOc1ccc(CNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)cc1	ZINC000875218997	FF	On-Demand	Mild	EPHX2	15	49
N#CCOc1ccc(CNC(=O)N2CCC[C@](O)(c3ccccc3)C2)cc1	ZINC000875219001	FF	On-Demand	Mild	EPHX2	15	49
CCOc1ccccc1CCNC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875219003	DE	On-Demand	Anodyne	TACR1	17	41
CCOc1ccccc1CCNC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875219003	DE	On-Demand	Anodyne	HCN1	53	35
CCOc1ccccc1CCNC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875219003	DE	On-Demand	Anodyne	HCN4	45	35
CCOc1ccccc1CCNC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875219005	DE	On-Demand	Anodyne	TACR1	17	41
CCOc1ccccc1CCNC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875219005	DE	On-Demand	Anodyne	HCN1	53	35
CCOc1ccccc1CCNC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875219005	DE	On-Demand	Anodyne	HCN4	45	35
CCOc1ccccc1CCNC(=O)N(CCOC)CC1CCN(C)CC1	ZINC000875219029	GF	On-Demand	Anodyne	CACNA1I	41	33
CCOc1ccccc1CCNC(=O)N(CCOC)CC1CCN(C)CC1	ZINC000875219029	GF	On-Demand	Anodyne	MBTPS1	50	33
CCOc1ccccc1CCNC(=O)N(CCOC)CC1CCN(C)CC1	ZINC000875219029	GF	On-Demand	Anodyne	HCN1	60	36
CCOc1ccccc1CCNC(=O)N(CCOC)CC1CCN(C)CC1	ZINC000875219029	GF	On-Demand	Anodyne	HCN4	42	33
CCOc1ccccc1CCNC(=O)N(CCOC)CC1CCN(C)CC1	ZINC000875219029	GF	On-Demand	Anodyne	ACKR3	63	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc2c(c1)OCCCO2	ZINC000875219061	FE	On-Demand	Anodyne	NOS2	76	35
CCOc1cc(CCCNC(=O)C(=O)N2C[C@H](OC)CC[C@@H]2C)ccc1OC	ZINC000875219063	GE	On-Demand	Anodyne	FKBP1A	45	39
CCOc1cc(CCCNC(=O)C(=O)N2C[C@H](OC)CC[C@@H]2C)ccc1OC	ZINC000875219063	GE	On-Demand	Anodyne	SSTR5	59	39
CCOc1cc(CCCNC(=O)C(=O)N2C[C@H](OC)CC[C@@H]2C)ccc1OC	ZINC000875219063	GE	On-Demand	Anodyne	MTNR1B	19	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc2c(c1)OCCCO2	ZINC000875219064	FE	On-Demand	Anodyne	NOS2	76	35
N#CCOc1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875219066	FF	On-Demand	Mild	DPP4	24	41
N#CCOc1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875219066	FF	On-Demand	Mild	PREP	41	42
N#CCOc1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875219066	FF	On-Demand	Mild	LGMN	66	36
N#CCOc1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875219066	FF	On-Demand	Mild	TMPRSS11D	61	36
CCOc1cc(CCCNC(=O)C(=O)N2C[C@H](OC)CC[C@H]2C)ccc1OC	ZINC000875219067	GE	On-Demand	Anodyne	FKBP1A	45	39
CCOc1cc(CCCNC(=O)C(=O)N2C[C@H](OC)CC[C@H]2C)ccc1OC	ZINC000875219067	GE	On-Demand	Anodyne	SSTR5	59	39
CCOc1cc(CCCNC(=O)C(=O)N2C[C@H](OC)CC[C@H]2C)ccc1OC	ZINC000875219067	GE	On-Demand	Anodyne	MTNR1B	19	43
N#CCOc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875219069	FF	On-Demand	Mild	DPP4	24	41
N#CCOc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875219069	FF	On-Demand	Mild	PREP	41	42
N#CCOc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875219069	FF	On-Demand	Mild	LGMN	66	36
N#CCOc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875219069	FF	On-Demand	Mild	TMPRSS11D	61	36
CCOc1cc(CCCNC(=O)C(=O)N2C[C@@H](OC)CC[C@@H]2C)ccc1OC	ZINC000875219071	GE	On-Demand	Anodyne	FKBP1A	45	39
CCOc1cc(CCCNC(=O)C(=O)N2C[C@@H](OC)CC[C@@H]2C)ccc1OC	ZINC000875219071	GE	On-Demand	Anodyne	SSTR5	59	39
CCOc1cc(CCCNC(=O)C(=O)N2C[C@@H](OC)CC[C@@H]2C)ccc1OC	ZINC000875219071	GE	On-Demand	Anodyne	MTNR1B	19	43
N#CCOc1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875219072	FF	On-Demand	Mild	DPP4	24	41
N#CCOc1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875219072	FF	On-Demand	Mild	PREP	41	42
N#CCOc1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875219072	FF	On-Demand	Mild	LGMN	66	36
N#CCOc1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875219072	FF	On-Demand	Mild	TMPRSS11D	61	36
N#CCOc1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875219074	FF	On-Demand	Mild	DPP4	24	41
N#CCOc1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875219074	FF	On-Demand	Mild	PREP	41	42
N#CCOc1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875219074	FF	On-Demand	Mild	LGMN	66	36
N#CCOc1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875219074	FF	On-Demand	Mild	TMPRSS11D	61	36
CCOc1cc(CCCNC(=O)C(=O)N2C[C@@H](OC)CC[C@H]2C)ccc1OC	ZINC000875219075	GE	On-Demand	Anodyne	FKBP1A	45	39
CCOc1cc(CCCNC(=O)C(=O)N2C[C@@H](OC)CC[C@H]2C)ccc1OC	ZINC000875219075	GE	On-Demand	Anodyne	SSTR5	59	39
CCOc1cc(CCCNC(=O)C(=O)N2C[C@@H](OC)CC[C@H]2C)ccc1OC	ZINC000875219075	GE	On-Demand	Anodyne	MTNR1B	19	43
CC[C@@H](CN1CCCC1)NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875219076	GE	On-Demand	Anodyne	FKBP1A	15	40
CC[C@@H](CN1CCCC1)NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875219076	GE	On-Demand	Anodyne	CHRNA7	40	35
CC[C@@H](CN1CCCC1)NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875219076	GE	On-Demand	Anodyne	C3AR1	41	41
CC[C@H](CN1CCCC1)NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875219079	GE	On-Demand	Anodyne	FKBP1A	15	40
CC[C@H](CN1CCCC1)NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875219079	GE	On-Demand	Anodyne	CHRNA7	40	35
CC[C@H](CN1CCCC1)NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875219079	GE	On-Demand	Anodyne	C3AR1	41	41
CC[C@@H](CN1CCCC1)NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875219081	GE	On-Demand	Anodyne	FKBP1A	15	40
CC[C@@H](CN1CCCC1)NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875219081	GE	On-Demand	Anodyne	CHRNA7	40	35
CC[C@@H](CN1CCCC1)NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875219081	GE	On-Demand	Anodyne	C3AR1	41	41
CC[C@H](CN1CCCC1)NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875219084	GE	On-Demand	Anodyne	FKBP1A	15	40
CC[C@H](CN1CCCC1)NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875219084	GE	On-Demand	Anodyne	CHRNA7	40	35
CC[C@H](CN1CCCC1)NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875219084	GE	On-Demand	Anodyne	C3AR1	41	41
O=C(NCc1ccc2c(c1)OCCCO2)N1CCC(CO)(CO)CC1	ZINC000875219145	FD	On-Demand	Anodyne	NOS2	91	36
CCOc1ccccc1CCNC(=O)N1Cc2cccc(O)c2C1	ZINC000875219147	EG	On-Demand	Clean	HCN1	49	37
N#CCOc1ccc(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875219157	FF	On-Demand	Mild	MAOB	27	47
N#CCOc1ccc(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875219157	FF	On-Demand	Mild	ADRB3	19	41
N#CCOc1ccc(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875219157	FF	On-Demand	Mild	CTSL	15	41
N#CCOc1ccc(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875219157	FF	On-Demand	Mild	CTSV	30	41
N#CCOc1ccc(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875219157	FF	On-Demand	Mild	PDS	75	41
N#CCOc1ccc(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875219161	FF	On-Demand	Mild	MAOB	27	47
N#CCOc1ccc(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875219161	FF	On-Demand	Mild	ADRB3	19	41
N#CCOc1ccc(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875219161	FF	On-Demand	Mild	CTSL	15	41
N#CCOc1ccc(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875219161	FF	On-Demand	Mild	CTSV	30	41
N#CCOc1ccc(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875219161	FF	On-Demand	Mild	PDS	75	41
N#CCOc1ccc(CNC(=O)N2Cc3cccnc3N3CCC[C@H]3C2)cc1	ZINC000875219165	GF	On-Demand	Mild	NAMPT	23	41
CCOc1ccccc1CCNC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875219173	EE	On-Demand	Anodyne	SLC6A4	25	40
CCOc1ccccc1CCNC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875219173	EE	On-Demand	Anodyne	SLC6A3	50	40
CCOc1ccccc1CCNC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875219173	EE	On-Demand	Anodyne	HCN1	47	35
CCOc1ccccc1CCNC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875219173	EE	On-Demand	Anodyne	HCN4	42	35
CCOc1ccccc1CCNC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875219174	EE	On-Demand	Anodyne	SLC6A4	25	40
CCOc1ccccc1CCNC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875219174	EE	On-Demand	Anodyne	SLC6A3	50	40
CCOc1ccccc1CCNC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875219174	EE	On-Demand	Anodyne	HCN1	47	35
CCOc1ccccc1CCNC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875219174	EE	On-Demand	Anodyne	HCN4	42	35
CCOc1ccccc1CCNC(=O)N[C@@H]1C[C@H]2C[C@@]2(C(=O)OC)C1	ZINC000875219191	EE	On-Demand	Anodyne	HCN1	48	32
CCOc1ccccc1CCNC(=O)N[C@@H]1C[C@H]2C[C@@]2(C(=O)OC)C1	ZINC000875219191	EE	On-Demand	Anodyne	HCN4	41	31
CCOc1cc(CCCNC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)ccc1OC	ZINC000875219216	GF	On-Demand	Anodyne	SSTR5	47	36
CN(C)C[C@@H]1CN(C(=O)NCc2ccc3c(c2)OCCCO3)C[C@H]1CN(C)C	ZINC000875219266	GD	On-Demand	Anodyne	NOS2	85	35
N#CCOc1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875219280	GG	On-Demand	Mild	CPT1A	66	38
N#CCOc1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875219280	GG	On-Demand	Mild	PREP	33	40
N#CCOc1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875219280	GG	On-Demand	Mild	LGMN	65	36
N#CCOc1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875219280	GG	On-Demand	Mild	TMPRSS11D	56	34
N#CCOc1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875219281	GG	On-Demand	Mild	CPT1A	66	38
N#CCOc1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875219281	GG	On-Demand	Mild	PREP	33	40
N#CCOc1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875219281	GG	On-Demand	Mild	LGMN	65	36
N#CCOc1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875219281	GG	On-Demand	Mild	TMPRSS11D	56	34
N#CCOc1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875219282	GG	On-Demand	Mild	CPT1A	66	38
N#CCOc1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875219282	GG	On-Demand	Mild	PREP	33	40
N#CCOc1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875219282	GG	On-Demand	Mild	LGMN	65	36
N#CCOc1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875219282	GG	On-Demand	Mild	TMPRSS11D	56	34
N#CCOc1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875219283	GG	On-Demand	Mild	CPT1A	66	38
N#CCOc1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875219283	GG	On-Demand	Mild	PREP	33	40
N#CCOc1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875219283	GG	On-Demand	Mild	LGMN	65	36
N#CCOc1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875219283	GG	On-Demand	Mild	TMPRSS11D	56	34
O=CN1CCCN(C(=O)NCCCCCc2ccccc2)CC1	ZINC000875219285	DE	On-Demand	Anodyne	FKBP1A	21	43
O=CN1CCCN(C(=O)NCCCCCc2ccccc2)CC1	ZINC000875219285	DE	On-Demand	Anodyne	SIGMAR1	23	44
O=CN1CCCN(C(=O)NCCCCCc2ccccc2)CC1	ZINC000875219285	DE	On-Demand	Anodyne	PREP	37	42
O=CN1CCCN(C(=O)NCCCCCc2ccccc2)CC1	ZINC000875219285	DE	On-Demand	Anodyne	FAAH	41	43
O=CN1CCCN(C(=O)NCCCCCc2ccccc2)CC1	ZINC000875219285	DE	On-Demand	Anodyne	CES1	40	38
O=CN1CCCN(C(=O)NCCCCCc2ccccc2)CC1	ZINC000875219285	DE	On-Demand	Anodyne	DPP7	25	44
O=CN1CCCN(C(=O)NCCCCCc2ccccc2)CC1	ZINC000875219285	DE	On-Demand	Anodyne	AMP1_PLAFQ	23	44
CCCCCCCNC(=O)C(=O)N[C@@H](c1ccccc1)[C@@H]1CCOC1	ZINC000875219308	EF	On-Demand	Mild	SOAT1	41	36
CCCCCCCNC(=O)C(=O)N[C@H](c1ccccc1)[C@@H]1CCOC1	ZINC000875219309	EF	On-Demand	Mild	SOAT1	41	36
CCCCCCCNC(=O)C(=O)N[C@@H](c1ccccc1)[C@H]1CCOC1	ZINC000875219310	EF	On-Demand	Mild	SOAT1	41	36
CCCCCCCNC(=O)C(=O)N[C@H](c1ccccc1)[C@H]1CCOC1	ZINC000875219311	EF	On-Demand	Mild	SOAT1	41	36
CCOc1cc(CCCNC(=O)C(=O)N2CCC(C(C)=O)CC2)ccc1OC	ZINC000875219314	GD	On-Demand	Anodyne	FKBP1A	44	38
CCOc1cc(CCCNC(=O)C(=O)N2CCC(C(C)=O)CC2)ccc1OC	ZINC000875219314	GD	On-Demand	Anodyne	SSTR5	67	40
CCOc1cc(CCCNC(=O)C(=O)N2CCC(C(C)=O)CC2)ccc1OC	ZINC000875219314	GD	On-Demand	Anodyne	MTNR1B	17	44
O=CN1CCCN(C(=O)NCc2ccc3c(c2)OCCCO3)CC1	ZINC000875219328	ED	On-Demand	Anodyne	NOS2	88	39
N#Cc1ccc(N2CCC(NC(=O)NC3CC(Nc4ccccc4)C3)CC2)nc1	ZINC000875219329	GF	On-Demand	Mild	SMO	16	44
CCOc1ccc(C(F)(F)F)cc1NC(=O)c1sccc1CC#N	ZINC000875219330	FI	On-Demand	Mild	DHODH	15	42
N#CCOc1ccc(CNC(=O)N2C[C@H](O)C[C@@H]2C2CC2)cc1	ZINC000875219390	DD	On-Demand	Mild	VHL	40	31
N#CCOc1ccc(CNC(=O)N2C[C@@H](O)C[C@@H]2C2CC2)cc1	ZINC000875219393	DD	On-Demand	Mild	VHL	40	31
N#CCOc1ccc(CNC(=O)N2C[C@@H](O)C[C@H]2C2CC2)cc1	ZINC000875219396	DD	On-Demand	Mild	VHL	40	31
N#CCOc1ccc(CNC(=O)N2C[C@H](O)C[C@H]2C2CC2)cc1	ZINC000875219398	DD	On-Demand	Mild	VHL	40	31
O=C(NCCO)C1CCN(C(=O)NCCCCCc2ccccc2)CC1	ZINC000875219404	FD	On-Demand	Anodyne	FKBP1A	35	51
O=C(NCCO)C1CCN(C(=O)NCCCCCc2ccccc2)CC1	ZINC000875219404	FD	On-Demand	Anodyne	SCNN1A	42	38
O=C(NCCO)C1CCN(C(=O)NCCCCCc2ccccc2)CC1	ZINC000875219404	FD	On-Demand	Anodyne	SIGMAR1	21	44
O=C(NCCO)C1CCN(C(=O)NCCCCCc2ccccc2)CC1	ZINC000875219404	FD	On-Demand	Anodyne	MTNR1A	27	45
O=C(NCCO)C1CCN(C(=O)NCCCCCc2ccccc2)CC1	ZINC000875219404	FD	On-Demand	Anodyne	MTNR1B	29	45
O=C(NCCO)C1CCN(C(=O)NCCCCCc2ccccc2)CC1	ZINC000875219404	FD	On-Demand	Anodyne	FAAH	23	53
O=C(NCCO)C1CCN(C(=O)NCCCCCc2ccccc2)CC1	ZINC000875219404	FD	On-Demand	Anodyne	EPHX2	25	44
O=C(NCCO)C1CCN(C(=O)NCCCCCc2ccccc2)CC1	ZINC000875219404	FD	On-Demand	Anodyne	AMP1_PLAFQ	23	40
O=C(NCCO)C1CCN(C(=O)NCCCCCc2ccccc2)CC1	ZINC000875219404	FD	On-Demand	Anodyne	CACNA1G	31	43
CCOc1ccccc1CCNC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875219440	EF	On-Demand	Anodyne	HCN1	44	35
CCOc1ccccc1CCNC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875219440	EF	On-Demand	Anodyne	HCN4	43	35
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1cccc(S(=O)(=O)N(C)C)c1	ZINC000875219459	GE	On-Demand	Anodyne	SFRP1	44	33
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1cccc(S(=O)(=O)N(C)C)c1	ZINC000875219459	GE	On-Demand	Anodyne	WNT3	49	33
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1cccc(S(=O)(=O)N(C)C)c1	ZINC000875219469	GE	On-Demand	Anodyne	SFRP1	44	33
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1cccc(S(=O)(=O)N(C)C)c1	ZINC000875219469	GE	On-Demand	Anodyne	WNT3	49	33
O=C(NCC[C@H](O)C1CCCC1)NCc1ccc2c(c1)OCCCO2	ZINC000875219473	EF	On-Demand	Anodyne	NOS2	45	33
O=C(NCC[C@@H](O)C1CCCC1)NCc1ccc2c(c1)OCCCO2	ZINC000875219476	EF	On-Demand	Anodyne	NOS2	45	33
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OCC#N)cc1	ZINC000875219477	DD	On-Demand	Mild	PDS	49	39
C[C@@H]1CN(C(=O)NCc2ccc3c(c2)OCCCO3)CC[C@H](C(F)(F)F)O1	ZINC000875219507	GG	On-Demand	Anodyne	NOS2	83	34
C[C@@H]1CN(C(=O)NCc2ccc3c(c2)OCCCO3)CC[C@@H](C(F)(F)F)O1	ZINC000875219509	GG	On-Demand	Anodyne	NOS2	83	34
O=C(NCCCCCc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000875219515	CE	On-Demand	Anodyne	SIGMAR1	17	44
O=C(NCCCCCc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000875219515	CE	On-Demand	Anodyne	MTNR1A	27	41
O=C(NCCCCCc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000875219515	CE	On-Demand	Anodyne	MTNR1B	29	41
O=C(NCCCCCc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000875219515	CE	On-Demand	Anodyne	FAAH	57	43
O=C(NCCCCCc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000875219515	CE	On-Demand	Anodyne	CES1	60	38
O=C(NCCCCCc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000875219515	CE	On-Demand	Anodyne	EPHX2	20	50
O=C(NCCCCCc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000875219515	CE	On-Demand	Anodyne	AMP1_PLAFQ	22	43
Cc1noc(C)c1[C@H](C)NC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875219518	FG	On-Demand	Anodyne	FAAH	60	41
Cc1noc(C)c1[C@H](C)NC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875219518	FG	On-Demand	Anodyne	CES1	57	37
Cc1noc(C)c1[C@H](C)NC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875219518	FG	On-Demand	Anodyne	AMP1_PLAFQ	25	44
Cc1noc(C)c1[C@H](C)NC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875219518	FG	On-Demand	Anodyne	CES1D	53	32
Cc1noc(C)c1[C@@H](C)NC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875219525	FG	On-Demand	Anodyne	FAAH	60	41
Cc1noc(C)c1[C@@H](C)NC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875219525	FG	On-Demand	Anodyne	CES1	57	37
Cc1noc(C)c1[C@@H](C)NC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875219525	FG	On-Demand	Anodyne	AMP1_PLAFQ	25	44
Cc1noc(C)c1[C@@H](C)NC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875219525	FG	On-Demand	Anodyne	CES1D	53	32
O=C(NCc1ccc2c(c1)OCCCO2)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875219528	FF	On-Demand	Anodyne	NOS2	42	33
O=C(NCCC[C@@H]1CCOC1=O)NC1(c2cccc(C(F)(F)F)c2)CC1	ZINC000875219557	FG	On-Demand	Anodyne	LUXR	30	44
O=C(NCCC[C@H]1CCOC1=O)NC1(c2cccc(C(F)(F)F)c2)CC1	ZINC000875219561	FG	On-Demand	Anodyne	LUXR	30	44
CCOc1ccccc1CCNC(=O)NC1CC(C(=O)OC)C1	ZINC000875219566	DD	On-Demand	Anodyne	MTNR1A	50	39
CCOc1ccccc1CCNC(=O)NC1CC(C(=O)OC)C1	ZINC000875219566	DD	On-Demand	Anodyne	HCN1	47	31
CCOc1ccccc1CCNC(=O)NC1CC(C(=O)OC)C1	ZINC000875219566	DD	On-Demand	Anodyne	HCN4	40	31
CCOc1ccccc1CCNC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1	ZINC000875219571	GE	On-Demand	Anodyne	MBTPS1	43	31
CCOc1ccccc1CCNC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1	ZINC000875219571	GE	On-Demand	Anodyne	HCN1	49	33
CCOc1ccccc1CCNC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1	ZINC000875219571	GE	On-Demand	Anodyne	HCN4	41	31
CCOc1ccccc1CCNC(=O)NN(C)C(=O)OC	ZINC000875219638	CD	On-Demand	Reactive	MTNR1A	65	44
CCOc1ccccc1CCNC(=O)NN(C)C(=O)OC	ZINC000875219638	CD	On-Demand	Reactive	MTNR1B	41	39
CCOc1ccccc1CCNC(=O)NN(C)C(=O)OC	ZINC000875219638	CD	On-Demand	Reactive	HCN1	42	30
COc1ccccc1[C@H]1CCCN(C(=O)NCCS(C)(=O)=O)CC1	ZINC000875219645	FE	On-Demand	Anodyne	HTR1A	22	40
COc1ccccc1[C@H]1CCCN(C(=O)NCCS(C)(=O)=O)CC1	ZINC000875219645	FE	On-Demand	Anodyne	DRD2	26	45
COc1ccccc1[C@H]1CCCN(C(=O)NCCS(C)(=O)=O)CC1	ZINC000875219645	FE	On-Demand	Anodyne	DRD4	17	45
COc1ccccc1[C@H]1CCCN(C(=O)NCCS(C)(=O)=O)CC1	ZINC000875219645	FE	On-Demand	Anodyne	RBP4	35	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCCS(C)(=O)=O)CC1	ZINC000875219646	FE	On-Demand	Anodyne	HTR1A	22	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCCS(C)(=O)=O)CC1	ZINC000875219646	FE	On-Demand	Anodyne	DRD2	26	45
COc1ccccc1[C@@H]1CCCN(C(=O)NCCS(C)(=O)=O)CC1	ZINC000875219646	FE	On-Demand	Anodyne	DRD4	17	45
COc1ccccc1[C@@H]1CCCN(C(=O)NCCS(C)(=O)=O)CC1	ZINC000875219646	FE	On-Demand	Anodyne	RBP4	35	40
O=C(NCCCCCc1ccccc1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875219665	EH	On-Demand	Anodyne	FKBP1A	20	41
O=C(NCCCCCc1ccccc1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875219665	EH	On-Demand	Anodyne	SLC18A2	43	36
CCOc1ccccc1CCNC(=O)N(C)CCN1CC2(CCOCC2)C1	ZINC000875219670	GE	On-Demand	Anodyne	HCN1	49	37
CCOc1ccccc1CCNC(=O)N(C)CCN1CC2(CCOCC2)C1	ZINC000875219670	GE	On-Demand	Anodyne	HCN4	40	32
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875219717	FD	On-Demand	Anodyne	ST14	59	32
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875219717	FD	On-Demand	Anodyne	SFRP1	78	36
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875219717	FD	On-Demand	Anodyne	WNT3	62	36
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875219718	FD	On-Demand	Anodyne	ST14	59	32
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875219718	FD	On-Demand	Anodyne	SFRP1	78	36
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875219718	FD	On-Demand	Anodyne	WNT3	62	36
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875219719	FD	On-Demand	Anodyne	ST14	59	32
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875219719	FD	On-Demand	Anodyne	SFRP1	78	36
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875219719	FD	On-Demand	Anodyne	WNT3	62	36
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875219720	FD	On-Demand	Anodyne	ST14	59	32
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875219720	FD	On-Demand	Anodyne	SFRP1	78	36
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875219720	FD	On-Demand	Anodyne	WNT3	62	36
CN(C)C[C@@H]1CN(C(=O)NCCCCCc2ccccc2)C[C@H]1CN(C)C	ZINC000875219740	FF	On-Demand	Anodyne	FKBP1A	19	40
CN(C)C[C@@H]1CN(C(=O)NCCCCCc2ccccc2)C[C@H]1CN(C)C	ZINC000875219740	FF	On-Demand	Anodyne	OPRM1	16	44
CN(C)C[C@@H]1CN(C(=O)NCCCCCc2ccccc2)C[C@H]1CN(C)C	ZINC000875219740	FF	On-Demand	Anodyne	SIGMAR1	23	41
CN(C)C[C@@H]1CN(C(=O)NCCCCCc2ccccc2)C[C@H]1CN(C)C	ZINC000875219740	FF	On-Demand	Anodyne	FAAH	37	40
CN(C)C[C@@H]1CN(C(=O)NCCCCCc2ccccc2)C[C@H]1CN(C)C	ZINC000875219740	FF	On-Demand	Anodyne	AMP1_PLAFQ	26	43
COC(=O)C1(O)CN(C(=O)NCCCCCc2ccccc2)C1	ZINC000875219757	DD	On-Demand	Anodyne	SIGMAR1	22	40
COC(=O)C1(O)CN(C(=O)NCCCCCc2ccccc2)C1	ZINC000875219757	DD	On-Demand	Anodyne	KCNA3	19	41
COC(=O)C1(O)CN(C(=O)NCCCCCc2ccccc2)C1	ZINC000875219757	DD	On-Demand	Anodyne	SCN2A	20	42
COC(=O)C1(O)CN(C(=O)NCCCCCc2ccccc2)C1	ZINC000875219757	DD	On-Demand	Anodyne	FAAH	68	42
COC(=O)C1(O)CN(C(=O)NCCCCCc2ccccc2)C1	ZINC000875219757	DD	On-Demand	Anodyne	CES1	62	41
COC(=O)C1(O)CN(C(=O)NCCCCCc2ccccc2)C1	ZINC000875219757	DD	On-Demand	Anodyne	AMP1_PLAFQ	22	43
COC(=O)C1(O)CN(C(=O)NCCCCCc2ccccc2)C1	ZINC000875219757	DD	On-Demand	Anodyne	CES1D	53	35
CC[C@@H](CN1CCCC1)NC(=O)C(=O)NCc1cccc2ncccc12	ZINC000875219806	FD	On-Demand	Anodyne	HNMT	42	35
CC[C@H](CN1CCCC1)NC(=O)C(=O)NCc1cccc2ncccc12	ZINC000875219808	FD	On-Demand	Anodyne	HNMT	42	35
Cc1nccnc1[C@H](C)NC(=O)NC(C)(C)CCc1ccccc1	ZINC000875219824	EH	On-Demand	Anodyne	HAO2	59	36
CCOc1ccccc1CCNC(=O)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875219831	FD	On-Demand	Anodyne	HCN1	45	34
CCOc1ccccc1CCNC(=O)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875219831	FD	On-Demand	Anodyne	HCN4	41	32
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H](CC3CC3)c3ccccc3)CC2)CC1	ZINC000875219971	GD	On-Demand	Anodyne	CCR5	29	42
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H](CC3CC3)c3ccccc3)CC2)CC1	ZINC000875219971	GD	On-Demand	Anodyne	L3MBTL3	62	40
CN1CCN(C2CCN(C(=O)C(=O)N[C@H](CC3CC3)c3ccccc3)CC2)CC1	ZINC000875219972	GD	On-Demand	Anodyne	CCR5	29	42
CN1CCN(C2CCN(C(=O)C(=O)N[C@H](CC3CC3)c3ccccc3)CC2)CC1	ZINC000875219972	GD	On-Demand	Anodyne	L3MBTL3	62	40
CCOc1ccccc1CCNC(=O)NNc1cccc(C)n1	ZINC000875220085	DF	On-Demand	Reactive	MTNR1A	56	43
CCOc1ccccc1CCNC(=O)NNc1cccc(C)n1	ZINC000875220085	DF	On-Demand	Reactive	MTNR1B	42	37
CCOc1ccccc1CCNC(=O)NNc1cccc(C)n1	ZINC000875220085	DF	On-Demand	Reactive	GRM5	16	47
COC(=O)N(C)NC(=O)NCCc1ccc(OC)c(OC)c1OC	ZINC000875220114	ED	On-Demand	Reactive	NQO2	44	40
COC(=O)N(C)NC(=O)NCCc1ccc(OC)c(OC)c1OC	ZINC000875220114	ED	On-Demand	Reactive	MTNR1A	66	44
COC(=O)N(C)NC(=O)NCCc1ccc(OC)c(OC)c1OC	ZINC000875220114	ED	On-Demand	Reactive	MTNR1B	41	40
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875220214	GD	On-Demand	Anodyne	SFRP1	83	34
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875220214	GD	On-Demand	Anodyne	WNT3	70	34
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875220216	GD	On-Demand	Anodyne	SFRP1	83	34
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875220216	GD	On-Demand	Anodyne	WNT3	70	34
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875220218	GD	On-Demand	Anodyne	SFRP1	83	34
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875220218	GD	On-Demand	Anodyne	WNT3	70	34
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875220220	GD	On-Demand	Anodyne	SFRP1	83	34
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875220220	GD	On-Demand	Anodyne	WNT3	70	34
CCOc1ccccc1CCNC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875220225	EF	On-Demand	Anodyne	BIRC2	26	40
CCOc1ccccc1CCNC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875220225	EF	On-Demand	Anodyne	MBTPS1	43	33
CCOc1ccccc1CCNC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875220225	EF	On-Demand	Anodyne	HCN1	53	36
CCOc1ccccc1CCNC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875220225	EF	On-Demand	Anodyne	HCN4	46	36
CC[C@@H]1COCCN1CCNC(=O)NCc1ccc2c(c1)OCCCO2	ZINC000875220226	FD	On-Demand	Anodyne	NOS2	72	39
CCOc1ccccc1CCNC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875220228	EF	On-Demand	Anodyne	BIRC2	26	40
CCOc1ccccc1CCNC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875220228	EF	On-Demand	Anodyne	MBTPS1	43	33
CCOc1ccccc1CCNC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875220228	EF	On-Demand	Anodyne	HCN1	53	36
CCOc1ccccc1CCNC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875220228	EF	On-Demand	Anodyne	HCN4	46	36
N#CCOc1ccc(CNC(=O)N2CCC[C@@H](C3CCC3)CC2)cc1	ZINC000875220235	EH	On-Demand	Mild	EPHX2	16	43
N#CCOc1ccc(CNC(=O)N2CCC[C@H](C3CCC3)CC2)cc1	ZINC000875220244	EH	On-Demand	Mild	EPHX2	16	43
C#CC[C@@H](COC)NC(=O)NC(C)(C)CCc1ccccc1	ZINC000875220258	DF	On-Demand	Mild	PAPA1_CARPA	40	37
N#CCOc1ccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000875220259	FG	On-Demand	Mild	EPHX2	20	46
C#CC[C@H](COC)NC(=O)NC(C)(C)CCc1ccccc1	ZINC000875220262	DF	On-Demand	Mild	PAPA1_CARPA	40	37
N#CCOc1ccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000875220272	FG	On-Demand	Mild	EPHX2	20	46
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCC1(C)OCCO1)CC2	ZINC000875220309	GD	On-Demand	Anodyne	SLC18A2	47	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCC1(C)OCCO1)CC2	ZINC000875220310	GD	On-Demand	Anodyne	SLC18A2	47	37
CCCCCCCNC(=O)C(=O)NCCC1(C)OCCO1	ZINC000875220315	DD	On-Demand	Mild	ASAH1	70	34
CCOc1ccccc1CCNC(=O)N(CC)OCC	ZINC000875220385	CF	On-Demand	Anodyne	MTNR1A	36	40
CCOc1ccccc1CCNC(=O)N(CC)OCC	ZINC000875220385	CF	On-Demand	Anodyne	HCN1	47	31
COC(=O)N(C)NC(=O)NCCCCCc1ccccc1	ZINC000875220389	CE	On-Demand	Reactive	SIGMAR1	17	44
COC(=O)N(C)NC(=O)NCCCCCc1ccccc1	ZINC000875220389	CE	On-Demand	Reactive	SCN2A	20	45
COC(=O)N(C)NC(=O)NCCCCCc1ccccc1	ZINC000875220389	CE	On-Demand	Reactive	S1PR3	17	41
COC(=O)N(C)NC(=O)NCCCCCc1ccccc1	ZINC000875220389	CE	On-Demand	Reactive	MTNR1A	42	40
COC(=O)N(C)NC(=O)NCCCCCc1ccccc1	ZINC000875220389	CE	On-Demand	Reactive	MTNR1B	38	40
COC(=O)N(C)NC(=O)NCCCCCc1ccccc1	ZINC000875220389	CE	On-Demand	Reactive	FAAH	62	45
COC(=O)N(C)NC(=O)NCCCCCc1ccccc1	ZINC000875220389	CE	On-Demand	Reactive	S1PR2	21	41
COC(=O)N(C)NC(=O)NCCCCCc1ccccc1	ZINC000875220389	CE	On-Demand	Reactive	CES1	62	39
COC(=O)N(C)NC(=O)NCCCCCc1ccccc1	ZINC000875220389	CE	On-Demand	Reactive	AMP1_PLAFQ	24	46
COC(=O)N(C)NC(=O)NCCCCCc1ccccc1	ZINC000875220389	CE	On-Demand	Reactive	CRTM	48	39
COc1nc(C)cc(C)c1CNC(=O)N(C)CCN1CC2(CCOCC2)C1	ZINC000875220390	GD	On-Demand	Anodyne	BDKRB2	42	33
CCOc1ccccc1CCNC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875220392	CD	On-Demand	Anodyne	HCN1	48	32
CCOc1ccccc1CCNC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875220392	CD	On-Demand	Anodyne	HCN4	41	31
COCC1CC(NC(=O)NC(C)(C)c2cccc(C(F)(F)F)c2)C1	ZINC000875220397	EH	On-Demand	Anodyne	CCR2	46	36
COCC1CC(NC(=O)NC(C)(C)c2cccc(C(F)(F)F)c2)C1	ZINC000875220397	EH	On-Demand	Anodyne	IMDH_CRYPV	63	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2ccccc2OCC)C1	ZINC000875220412	EE	On-Demand	Anodyne	HCN1	49	32
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2ccccc2OCC)C1	ZINC000875220412	EE	On-Demand	Anodyne	HCN4	41	32
CCOc1ccccc1CCNC(=O)N(CCOC)C1CCOCC1	ZINC000875220424	FE	On-Demand	Anodyne	MBTPS1	62	36
CCOc1ccccc1CCNC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875220454	FF	On-Demand	Anodyne	HCN1	49	32
CCOc1ccccc1CCNC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875220454	FF	On-Demand	Anodyne	HCN4	41	32
CCOc1ccccc1CCNC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875220455	FF	On-Demand	Anodyne	HCN1	49	32
CCOc1ccccc1CCNC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875220455	FF	On-Demand	Anodyne	HCN4	41	32
CCOc1ccccc1CCNC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875220465	FD	On-Demand	Anodyne	MTNR1A	26	46
CCOc1ccccc1CCNC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875220465	FD	On-Demand	Anodyne	MTNR1B	20	40
CCOc1ccccc1CCNC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875220465	FD	On-Demand	Anodyne	EPHX2	20	42
CCOc1ccccc1CCNC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875220465	FD	On-Demand	Anodyne	CACNA1G	36	44
CCOc1ccccc1CCNC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875220465	FD	On-Demand	Anodyne	HCN1	50	34
CCOc1ccccc1CCNC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875220465	FD	On-Demand	Anodyne	HCN4	43	33
N#CCOc1ccc(CNC(=O)N2CCCC[C@@H]2[C@H]2CCCC[C@@H]2O)cc1	ZINC000875220512	FG	On-Demand	Mild	LGMN	45	33
N#CCOc1ccc(CNC(=O)N2CCCC[C@@H]2[C@H]2CCCC[C@H]2O)cc1	ZINC000875220514	FG	On-Demand	Mild	LGMN	45	33
N#CCOc1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H]2CCCC[C@H]2O)cc1	ZINC000875220516	FG	On-Demand	Mild	LGMN	45	33
N#CCOc1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H]2CCCC[C@@H]2O)cc1	ZINC000875220518	FG	On-Demand	Mild	LGMN	45	33
COC(=O)C1(O)CN(C(=O)NCC2(c3ccc(Cl)cc3)CC2)C1	ZINC000875220536	ED	On-Demand	Anodyne	CCR1	45	34
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3ccc4c(c3)OCCCO4)C[C@@H]1C2	ZINC000875220537	FD	On-Demand	Anodyne	NOS2	77	34
O=C(NCc1ccnc(F)c1)NC1(c2cccc(C(F)(F)F)c2)CC1	ZINC000875220586	FH	On-Demand	Anodyne	CCR2	40	33
O=C(NCc1ccc2c(c1)OCCCO2)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875220610	FG	On-Demand	Anodyne	NOS2	87	37
O=C(NCc1ccc2c(c1)OCCCO2)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875220610	FG	On-Demand	Anodyne	EPHX2	18	45
O=C(NCc1ccc2c(c1)OCCCO2)N1CCC[C@H](OC2CCC2)CC1	ZINC000875220612	FG	On-Demand	Anodyne	NOS2	87	37
O=C(NCc1ccc2c(c1)OCCCO2)N1CCC[C@H](OC2CCC2)CC1	ZINC000875220612	FG	On-Demand	Anodyne	EPHX2	18	45
O=C(NCCO)C1CCN(C(=O)NCC2(c3ccc(Cl)cc3)CC2)CC1	ZINC000875220698	GD	On-Demand	Anodyne	EPHX2	23	47
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)NCCS(C)(=O)=O	ZINC000875220744	FF	On-Demand	Anodyne	EPHX2	15	48
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)NCCS(C)(=O)=O	ZINC000875220744	FF	On-Demand	Anodyne	MDM2	129	37
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NCCS(C)(=O)=O	ZINC000875220791	FD	On-Demand	Anodyne	SIGMAR1	21	47
N#CCOc1ccc(CNC(=O)NCCN2CC[C@H](O)C2)cc1	ZINC000875220831	DC	On-Demand	Mild	CCR3	23	40
N#CCOc1ccc(CNC(=O)NCCN2CC[C@@H](O)C2)cc1	ZINC000875220833	DC	On-Demand	Mild	CCR3	23	40
CCOc1ccccc1CCNC(=O)N1CCCN(C=O)CC1	ZINC000875220860	DD	On-Demand	Anodyne	HCN1	57	37
CCOc1ccccc1CCNC(=O)N1CCCN(C=O)CC1	ZINC000875220860	DD	On-Demand	Anodyne	HCN4	44	34
CCOc1ccccc1CCNC(=O)NC1(C)CC(F)(F)C1	ZINC000875220880	DG	On-Demand	Anodyne	HCN1	50	34
CCOc1ccccc1CCNC(=O)NC1(C)CC(F)(F)C1	ZINC000875220880	DG	On-Demand	Anodyne	HCN4	42	33
COC(=O)C1=NO[C@@]2(CCN(C(=O)NCc3ccc4c(c3)OCCCO4)C2)C1	ZINC000875220943	GD	On-Demand	Anodyne	NOS2	57	32
COC(=O)C1=NO[C@]2(CCN(C(=O)NCc3ccc4c(c3)OCCCO4)C2)C1	ZINC000875220946	GD	On-Demand	Anodyne	NOS2	57	32
CCOC1CC2(C1)C[C@@H]2NC(=O)NC(C)(C)CCc1ccccc1	ZINC000875220948	EH	On-Demand	Anodyne	TIMP3	77	39
CCOC1CC2(C1)C[C@H]2NC(=O)NC(C)(C)CCc1ccccc1	ZINC000875220950	EH	On-Demand	Anodyne	TIMP3	77	39
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc2c(c1)OCCCO2	ZINC000875220970	GE	On-Demand	Anodyne	NOS2	68	34
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc2c(c1)OCCCO2	ZINC000875220970	GE	On-Demand	Anodyne	MCHR1	16	41
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)N2CC[C@](C)(C(F)(F)F)C2)c1	ZINC000875220986	GF	On-Demand	Anodyne	SFRP1	59	33
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)N2CC[C@](C)(C(F)(F)F)C2)c1	ZINC000875220986	GF	On-Demand	Anodyne	WNT3	45	33
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)N2CC[C@@](C)(C(F)(F)F)C2)c1	ZINC000875220988	GF	On-Demand	Anodyne	SFRP1	59	33
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)N2CC[C@@](C)(C(F)(F)F)C2)c1	ZINC000875220988	GF	On-Demand	Anodyne	WNT3	45	33
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)N2CC[C@](C)(C(F)(F)F)C2)c1	ZINC000875220990	GF	On-Demand	Anodyne	SFRP1	59	33
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)N2CC[C@](C)(C(F)(F)F)C2)c1	ZINC000875220990	GF	On-Demand	Anodyne	WNT3	45	33
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)N2CC[C@@](C)(C(F)(F)F)C2)c1	ZINC000875220992	GF	On-Demand	Anodyne	SFRP1	59	33
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)N2CC[C@@](C)(C(F)(F)F)C2)c1	ZINC000875220992	GF	On-Demand	Anodyne	WNT3	45	33
COC(=O)C1(O)CN(C(=O)NCc2ccc3c(c2)OCCCO3)C1	ZINC000875221008	EC	On-Demand	Anodyne	NOS2	48	33
COC(=O)[C@@]12C[C@@H](NC(=O)NC(C)(C)CCc3ccccc3)C[C@@H]1C2	ZINC000875221030	EG	On-Demand	Anodyne	EPHX2	17	40
O=C(NCc1ccc2c(c1)OCCCO2)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875221051	FF	On-Demand	Anodyne	NOS2	82	35
O=C(NCc1ccc2c(c1)OCCCO2)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875221053	FF	On-Demand	Anodyne	NOS2	82	35
CN1CCN(C(=O)NCc2ccc3c(c2)OCCCO3)CCC1(C)C	ZINC000875221058	EE	On-Demand	Anodyne	NOS2	80	34
Cn1nccc1C(NC(=O)NC(C)(C)CCc1ccccc1)c1ccnn1C	ZINC000875221084	GF	On-Demand	Anodyne	CES1D	43	31
C[C@H](NC(=O)NC(C)(C)CCc1ccccc1)c1ccnn1C	ZINC000875221264	DG	On-Demand	Anodyne	CYSP_TRYCR	40	33
C[C@H](NC(=O)NC(C)(C)CCc1ccccc1)c1ccnn1C	ZINC000875221264	DG	On-Demand	Anodyne	CTSV	40	31
C[C@@H](NC(=O)NC(C)(C)CCc1ccccc1)c1ccnn1C	ZINC000875221274	DG	On-Demand	Anodyne	CYSP_TRYCR	40	33
C[C@@H](NC(=O)NC(C)(C)CCc1ccccc1)c1ccnn1C	ZINC000875221274	DG	On-Demand	Anodyne	CTSV	40	31
Cc1noc(C)c1[C@@H](C)NC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875221286	GE	On-Demand	Anodyne	NPY2R	60	40
Cc1noc(C)c1[C@H](C)NC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875221287	GE	On-Demand	Anodyne	NPY2R	60	40
CCOc1cc(CCCNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)ccc1OC	ZINC000875221336	GD	On-Demand	Anodyne	FKBP1A	51	45
CCOc1cc(CCCNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)ccc1OC	ZINC000875221336	GD	On-Demand	Anodyne	SSTR5	59	39
CCOc1cc(CCCNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)ccc1OC	ZINC000875221336	GD	On-Demand	Anodyne	MTNR1B	18	42
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)N2CCC(C(C)=O)CC2)c1	ZINC000875221337	FD	On-Demand	Anodyne	SFRP1	56	33
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)N2CCC(C(C)=O)CC2)c1	ZINC000875221337	FD	On-Demand	Anodyne	WNT3	48	33
CCOc1cc(CCCNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)ccc1OC	ZINC000875221338	GD	On-Demand	Anodyne	FKBP1A	51	45
CCOc1cc(CCCNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)ccc1OC	ZINC000875221338	GD	On-Demand	Anodyne	SSTR5	59	39
CCOc1cc(CCCNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)ccc1OC	ZINC000875221338	GD	On-Demand	Anodyne	MTNR1B	18	42
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)N2CCC(C(C)=O)CC2)c1	ZINC000875221339	FD	On-Demand	Anodyne	SFRP1	56	33
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)N2CCC(C(C)=O)CC2)c1	ZINC000875221339	FD	On-Demand	Anodyne	WNT3	48	33
O=C(NCc1ccc2c(c1)OCCCO2)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875221355	GF	On-Demand	Anodyne	NOS2	99	39
COC(=O)N(C)NC(=O)NCC1(c2ccc(Cl)cc2)CC1	ZINC000875221413	DE	On-Demand	Reactive	KCNA3	41	35
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NCCCCC2CC2)c1	ZINC000875221541	FF	On-Demand	Anodyne	FBP1	15	42
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NCCCCC2CC2)c1	ZINC000875221543	FF	On-Demand	Anodyne	FBP1	15	42
Cc1cc(CNC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)no1	ZINC000875221545	EG	On-Demand	Anodyne	PANC	44	32
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCC3(C)OCCO3)C2)cc1	ZINC000875221856	GC	On-Demand	Anodyne	DRD4	31	46
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCC3(C)OCCO3)C2)cc1	ZINC000875221856	GC	On-Demand	Anodyne	SIGMAR1	17	40
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCC3(C)OCCO3)C2)cc1	ZINC000875221856	GC	On-Demand	Anodyne	CCR3	24	40
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCC3(C)OCCO3)C2)cc1	ZINC000875221856	GC	On-Demand	Anodyne	CCR2	17	47
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCC3(C)OCCO3)C2)cc1	ZINC000875221856	GC	On-Demand	Anodyne	MCHR1	31	45
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCC3(C)OCCO3)C2)cc1	ZINC000875221857	GC	On-Demand	Anodyne	DRD4	31	46
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCC3(C)OCCO3)C2)cc1	ZINC000875221857	GC	On-Demand	Anodyne	SIGMAR1	17	40
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCC3(C)OCCO3)C2)cc1	ZINC000875221857	GC	On-Demand	Anodyne	CCR3	24	40
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCC3(C)OCCO3)C2)cc1	ZINC000875221857	GC	On-Demand	Anodyne	CCR2	17	47
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCC3(C)OCCO3)C2)cc1	ZINC000875221857	GC	On-Demand	Anodyne	MCHR1	31	45
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCC1(C)OCCO1	ZINC000875221937	ED	On-Demand	Anodyne	MME	41	38
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCC1(C)OCCO1	ZINC000875221937	ED	On-Demand	Anodyne	CAPN2	47	36
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCC1(C)OCCO1	ZINC000875221938	ED	On-Demand	Anodyne	MME	41	38
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCC1(C)OCCO1	ZINC000875221938	ED	On-Demand	Anodyne	CAPN2	47	36
Cc1noc(C)c1[C@@H](C)NC(=O)C(=O)NCc1cccc2ncccc12	ZINC000875221952	FE	On-Demand	Anodyne	P2RX7	15	43
Cc1noc(C)c1[C@H](C)NC(=O)C(=O)NCc1cccc2ncccc12	ZINC000875221953	FE	On-Demand	Anodyne	P2RX7	15	43
CN1CC[C@H]2CN(C(=O)C(=O)NCC(C)(C)c3cccs3)CC[C@@H]21	ZINC000875222053	ED	On-Demand	Anodyne	CHRM1	15	40
CN1CC[C@H]2CN(C(=O)C(=O)NCC(C)(C)c3cccs3)CC[C@H]21	ZINC000875222055	ED	On-Demand	Anodyne	CHRM1	15	40
Cc1ccccc1CN1CCO[C@@H](CNC(=O)C(=O)NCc2ccon2)C1	ZINC000875222057	FC	On-Demand	Anodyne	PDE8B	42	31
CCc1noc(-c2ccc(CCNC(=O)N3CCC[C@H](C(C)(C)O)C3)cc2)n1	ZINC000875222065	GG	On-Demand	Anodyne	S1PR4	22	40
CCc1noc(-c2ccc(CCNC(=O)N3CCC[C@H](C(C)(C)O)C3)cc2)n1	ZINC000875222065	GG	On-Demand	Anodyne	SPHK1	16	41
CCc1noc(-c2ccc(CCNC(=O)N3CCC[C@@H](C(C)(C)O)C3)cc2)n1	ZINC000875222066	GG	On-Demand	Anodyne	S1PR4	22	40
CCc1noc(-c2ccc(CCNC(=O)N3CCC[C@@H](C(C)(C)O)C3)cc2)n1	ZINC000875222066	GG	On-Demand	Anodyne	SPHK1	16	41
CCOC(=O)CCN(Cc1cccnc1)C(=O)c1c(Cl)nn(C)c1Cl	ZINC000875222090	GF	On-Demand	Anodyne	GPBAR1	16	51
CCC[C@H](Cc1ccccc1)NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1	ZINC000875222158	FF	On-Demand	Anodyne	MME	62	42
CCC[C@H](Cc1ccccc1)NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1	ZINC000875222158	FF	On-Demand	Anodyne	ACE2	40	32
CCC[C@@H](Cc1ccccc1)NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1	ZINC000875222159	FF	On-Demand	Anodyne	MME	62	42
CCC[C@@H](Cc1ccccc1)NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1	ZINC000875222159	FF	On-Demand	Anodyne	ACE2	40	32
CCc1noc(-c2ccc(CCNC(=O)N3CC[C@H](C(C)(C)O)C3)cc2)n1	ZINC000875222199	FF	On-Demand	Anodyne	S1PR4	23	41
CCc1noc(-c2ccc(CCNC(=O)N3CC[C@H](C(C)(C)O)C3)cc2)n1	ZINC000875222199	FF	On-Demand	Anodyne	SPHK1	16	42
CCc1noc(-c2ccc(CCNC(=O)N3CC[C@@H](C(C)(C)O)C3)cc2)n1	ZINC000875222200	FF	On-Demand	Anodyne	S1PR4	23	41
CCc1noc(-c2ccc(CCNC(=O)N3CC[C@@H](C(C)(C)O)C3)cc2)n1	ZINC000875222200	FF	On-Demand	Anodyne	SPHK1	16	42
CCC[C@@H](Cc1ccccc1)NC(=O)N1CCCN(C=O)CC1	ZINC000875222275	DE	On-Demand	Anodyne	ACE	32	41
CCC[C@@H](Cc1ccccc1)NC(=O)N1CCCN(C=O)CC1	ZINC000875222275	DE	On-Demand	Anodyne	MME	56	41
CCC[C@@H](Cc1ccccc1)NC(=O)N1CCCN(C=O)CC1	ZINC000875222275	DE	On-Demand	Anodyne	CYSP_TRYCR	15	42
CCC[C@@H](Cc1ccccc1)NC(=O)N1CCCN(C=O)CC1	ZINC000875222275	DE	On-Demand	Anodyne	CAPN1	60	37
CCC[C@@H](Cc1ccccc1)NC(=O)N1CCCN(C=O)CC1	ZINC000875222275	DE	On-Demand	Anodyne	CAPN2	45	32
CCC[C@H](Cc1ccccc1)NC(=O)N1CCCN(C=O)CC1	ZINC000875222276	DE	On-Demand	Anodyne	ACE	32	41
CCC[C@H](Cc1ccccc1)NC(=O)N1CCCN(C=O)CC1	ZINC000875222276	DE	On-Demand	Anodyne	MME	56	41
CCC[C@H](Cc1ccccc1)NC(=O)N1CCCN(C=O)CC1	ZINC000875222276	DE	On-Demand	Anodyne	CYSP_TRYCR	15	42
CCC[C@H](Cc1ccccc1)NC(=O)N1CCCN(C=O)CC1	ZINC000875222276	DE	On-Demand	Anodyne	CAPN1	60	37
CCC[C@H](Cc1ccccc1)NC(=O)N1CCCN(C=O)CC1	ZINC000875222276	DE	On-Demand	Anodyne	CAPN2	45	32
CCC[C@@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875222290	EG	On-Demand	Anodyne	ACE	40	36
CCC[C@@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875222290	EG	On-Demand	Anodyne	SLC6A4	30	44
CCC[C@@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875222290	EG	On-Demand	Anodyne	SLC6A3	65	44
CCC[C@@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875222290	EG	On-Demand	Anodyne	MME	41	37
CCC[C@@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875222290	EG	On-Demand	Anodyne	TIMP3	79	36
CCC[C@@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875222290	EG	On-Demand	Anodyne	CAPNS1	52	32
CCC[C@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875222291	EG	On-Demand	Anodyne	ACE	40	36
CCC[C@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875222291	EG	On-Demand	Anodyne	SLC6A4	30	44
CCC[C@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875222291	EG	On-Demand	Anodyne	SLC6A3	65	44
CCC[C@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875222291	EG	On-Demand	Anodyne	MME	41	37
CCC[C@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875222291	EG	On-Demand	Anodyne	TIMP3	79	36
CCC[C@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875222291	EG	On-Demand	Anodyne	CAPNS1	52	32
CCC[C@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875222292	EG	On-Demand	Anodyne	ACE	40	36
CCC[C@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875222292	EG	On-Demand	Anodyne	SLC6A4	30	44
CCC[C@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875222292	EG	On-Demand	Anodyne	SLC6A3	65	44
CCC[C@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875222292	EG	On-Demand	Anodyne	MME	41	37
CCC[C@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875222292	EG	On-Demand	Anodyne	TIMP3	79	36
CCC[C@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875222292	EG	On-Demand	Anodyne	CAPNS1	52	32
CCC[C@@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875222293	EG	On-Demand	Anodyne	ACE	40	36
CCC[C@@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875222293	EG	On-Demand	Anodyne	SLC6A4	30	44
CCC[C@@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875222293	EG	On-Demand	Anodyne	SLC6A3	65	44
CCC[C@@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875222293	EG	On-Demand	Anodyne	MME	41	37
CCC[C@@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875222293	EG	On-Demand	Anodyne	TIMP3	79	36
CCC[C@@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875222293	EG	On-Demand	Anodyne	CAPNS1	52	32
CCC[C@H](Cc1ccccc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875222294	DG	On-Demand	Anodyne	ACE	54	39
CCC[C@H](Cc1ccccc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875222294	DG	On-Demand	Anodyne	GHRHR	51	32
CCC[C@H](Cc1ccccc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875222294	DG	On-Demand	Anodyne	GRIN2B	40	37
CCC[C@H](Cc1ccccc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875222294	DG	On-Demand	Anodyne	MME	71	39
CCC[C@H](Cc1ccccc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875222294	DG	On-Demand	Anodyne	TIMP3	40	32
CCC[C@H](Cc1ccccc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875222294	DG	On-Demand	Anodyne	CAPNS1	48	34
CCC[C@H](Cc1ccccc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875222294	DG	On-Demand	Anodyne	REN	34	41
CCC[C@H](Cc1ccccc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875222294	DG	On-Demand	Anodyne	CAPN1	44	40
CCC[C@H](Cc1ccccc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875222294	DG	On-Demand	Anodyne	ACE2	45	34
CCC[C@H](Cc1ccccc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875222294	DG	On-Demand	Anodyne	CTRB_BOVIN	44	33
CCC[C@H](Cc1ccccc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875222294	DG	On-Demand	Anodyne	AMP1_PLAFQ	17	41
CCC[C@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875222295	DG	On-Demand	Anodyne	ACE	54	39
CCC[C@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875222295	DG	On-Demand	Anodyne	GHRHR	51	32
CCC[C@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875222295	DG	On-Demand	Anodyne	GRIN2B	40	37
CCC[C@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875222295	DG	On-Demand	Anodyne	MME	71	39
CCC[C@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875222295	DG	On-Demand	Anodyne	TIMP3	40	32
CCC[C@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875222295	DG	On-Demand	Anodyne	CAPNS1	48	34
CCC[C@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875222295	DG	On-Demand	Anodyne	REN	34	41
CCC[C@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875222295	DG	On-Demand	Anodyne	CAPN1	44	40
CCC[C@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875222295	DG	On-Demand	Anodyne	ACE2	45	34
CCC[C@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875222295	DG	On-Demand	Anodyne	CTRB_BOVIN	44	33
CCC[C@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875222295	DG	On-Demand	Anodyne	AMP1_PLAFQ	17	41
CCC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875222296	DG	On-Demand	Anodyne	ACE	54	39
CCC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875222296	DG	On-Demand	Anodyne	GHRHR	51	32
CCC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875222296	DG	On-Demand	Anodyne	GRIN2B	40	37
CCC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875222296	DG	On-Demand	Anodyne	MME	71	39
CCC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875222296	DG	On-Demand	Anodyne	TIMP3	40	32
CCC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875222296	DG	On-Demand	Anodyne	CAPNS1	48	34
CCC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875222296	DG	On-Demand	Anodyne	REN	34	41
CCC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875222296	DG	On-Demand	Anodyne	CAPN1	44	40
CCC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875222296	DG	On-Demand	Anodyne	ACE2	45	34
CCC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875222296	DG	On-Demand	Anodyne	CTRB_BOVIN	44	33
CCC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875222296	DG	On-Demand	Anodyne	AMP1_PLAFQ	17	41
CCC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875222297	DG	On-Demand	Anodyne	ACE	54	39
CCC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875222297	DG	On-Demand	Anodyne	GHRHR	51	32
CCC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875222297	DG	On-Demand	Anodyne	GRIN2B	40	37
CCC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875222297	DG	On-Demand	Anodyne	MME	71	39
CCC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875222297	DG	On-Demand	Anodyne	TIMP3	40	32
CCC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875222297	DG	On-Demand	Anodyne	CAPNS1	48	34
CCC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875222297	DG	On-Demand	Anodyne	REN	34	41
CCC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875222297	DG	On-Demand	Anodyne	CAPN1	44	40
CCC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875222297	DG	On-Demand	Anodyne	ACE2	45	34
CCC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875222297	DG	On-Demand	Anodyne	CTRB_BOVIN	44	33
CCC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875222297	DG	On-Demand	Anodyne	AMP1_PLAFQ	17	41
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccon3)CC2)c(OC)c1	ZINC000875222300	FC	On-Demand	Clean	DRD4	40	32
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccon3)CC2)c(OC)c1	ZINC000875222300	FC	On-Demand	Clean	DRD3	42	38
CCc1noc(-c2ccc(CCNC(=O)N3[C@H]4CC[C@H]3CC(CCO)C4)cc2)n1	ZINC000875222355	GG	On-Demand	Anodyne	S1PR4	26	40
CCc1noc(-c2ccc(CCNC(=O)N3[C@H]4CC[C@H]3CC(CCO)C4)cc2)n1	ZINC000875222355	GG	On-Demand	Anodyne	S1PR1	22	40
CCc1noc(-c2ccc(CCNC(=O)N3[C@H]4CC[C@H]3CC(CCO)C4)cc2)n1	ZINC000875222355	GG	On-Demand	Anodyne	SPHK1	17	43
CCc1noc(-c2ccc(CCNC(=O)N3[C@H]4CC[C@H]3CC(CCO)C4)cc2)n1	ZINC000875222355	GG	On-Demand	Anodyne	S1PR5	32	40
CCC[C@@H](Cc1ccccc1)NC(=O)N1CC(O)(C(=O)OC)C1	ZINC000875222358	DD	On-Demand	Anodyne	MME	53	41
CCC[C@@H](Cc1ccccc1)NC(=O)N1CC(O)(C(=O)OC)C1	ZINC000875222358	DD	On-Demand	Anodyne	TIMP3	47	32
CCC[C@@H](Cc1ccccc1)NC(=O)N1CC(O)(C(=O)OC)C1	ZINC000875222358	DD	On-Demand	Anodyne	CAPNS1	42	31
CCC[C@@H](Cc1ccccc1)NC(=O)N1CC(O)(C(=O)OC)C1	ZINC000875222358	DD	On-Demand	Anodyne	CTRB_BOVIN	44	31
CCC[C@H](Cc1ccccc1)NC(=O)N1CC(O)(C(=O)OC)C1	ZINC000875222359	DD	On-Demand	Anodyne	MME	53	41
CCC[C@H](Cc1ccccc1)NC(=O)N1CC(O)(C(=O)OC)C1	ZINC000875222359	DD	On-Demand	Anodyne	TIMP3	47	32
CCC[C@H](Cc1ccccc1)NC(=O)N1CC(O)(C(=O)OC)C1	ZINC000875222359	DD	On-Demand	Anodyne	CAPNS1	42	31
CCC[C@H](Cc1ccccc1)NC(=O)N1CC(O)(C(=O)OC)C1	ZINC000875222359	DD	On-Demand	Anodyne	CTRB_BOVIN	44	31
CCc1noc(-c2ccc(CCNC(=O)N3[C@H]4CC[C@H]3[C@H](C(=O)OC)C4)cc2)n1	ZINC000875222383	GF	On-Demand	Anodyne	SPHK1	16	42
CCc1noc(-c2ccc(CCNC(=O)N3[C@H]4CC[C@H]3[C@@H](C(=O)OC)C4)cc2)n1	ZINC000875222384	GF	On-Demand	Anodyne	SPHK1	16	42
O=C(NCc1ncc(Cl)s1)C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000875222390	GE	On-Demand	Anodyne	DRD2	30	44
O=C(NCc1ncc(Cl)s1)C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000875222390	GE	On-Demand	Anodyne	SIGMAR1	16	45
O=C(NCc1ncc(Cl)s1)C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000875222391	GE	On-Demand	Anodyne	DRD2	30	44
O=C(NCc1ncc(Cl)s1)C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000875222391	GE	On-Demand	Anodyne	SIGMAR1	16	45
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCCN2Cc2ccccc2)CC1	ZINC000875222397	FD	On-Demand	Anodyne	DRD2	40	49
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCCN2Cc2ccccc2)CC1	ZINC000875222397	FD	On-Demand	Anodyne	SIGMAR1	27	49
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCCN2Cc2ccccc2)CC1	ZINC000875222398	FD	On-Demand	Anodyne	DRD2	40	49
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCCN2Cc2ccccc2)CC1	ZINC000875222398	FD	On-Demand	Anodyne	SIGMAR1	27	49
CCC[C@H](Cc1ccccc1)NC(=O)N(CCOC)C1CCOCC1	ZINC000875222410	EG	On-Demand	Anodyne	CYP3A4	16	40
CCC[C@@H](Cc1ccccc1)NC(=O)N(CCOC)C1CCOCC1	ZINC000875222411	EG	On-Demand	Anodyne	CYP3A4	16	40
CCCCCCCNC(=O)C(=O)NCc1ccon1	ZINC000875222419	CD	On-Demand	Mild	ASAH1	88	37
CCOC1CC2(C1)C[C@H]2C(=O)N(C)c1ccccc1-c1ccccc1	ZINC000875222430	EJ	On-Demand	Anodyne	TIMP3	49	31
O=C(NCc1ccon1)C(=O)N1CCC(CCF)CC1	ZINC000875222431	CC	On-Demand	Anodyne	ETHR	52	33
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)C(=O)NCc1ccon1	ZINC000875222441	FF	On-Demand	Anodyne	MDM2	55	31
O=C(NC[C@H]1CCCN1Cc1ccccc1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875222442	GC	On-Demand	Anodyne	DRD2	36	47
O=C(NC[C@H]1CCCN1Cc1ccccc1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875222442	GC	On-Demand	Anodyne	SIGMAR1	31	48
CCC[C@@H](Cc1ccccc1)NC(=O)N(C)CCN1CC2(CCOCC2)C1	ZINC000875222470	FG	On-Demand	Anodyne	CASR	41	35
CCC[C@@H](Cc1ccccc1)NC(=O)N(C)CCN1CC2(CCOCC2)C1	ZINC000875222470	FG	On-Demand	Anodyne	TACR2	51	38
CCC[C@@H](Cc1ccccc1)NC(=O)N(C)CCN1CC2(CCOCC2)C1	ZINC000875222470	FG	On-Demand	Anodyne	CYP3A4	17	40
CCC[C@H](Cc1ccccc1)NC(=O)N(C)CCN1CC2(CCOCC2)C1	ZINC000875222471	FG	On-Demand	Anodyne	CASR	41	35
CCC[C@H](Cc1ccccc1)NC(=O)N(C)CCN1CC2(CCOCC2)C1	ZINC000875222471	FG	On-Demand	Anodyne	TACR2	51	38
CCC[C@H](Cc1ccccc1)NC(=O)N(C)CCN1CC2(CCOCC2)C1	ZINC000875222471	FG	On-Demand	Anodyne	CYP3A4	17	40
CCC[C@H](Cc1ccccc1)NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875222510	FD	On-Demand	Anodyne	MME	46	38
CCC[C@H](Cc1ccccc1)NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875222510	FD	On-Demand	Anodyne	CAPN1	39	43
CCC[C@@H](Cc1ccccc1)NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875222511	FD	On-Demand	Anodyne	MME	46	38
CCC[C@@H](Cc1ccccc1)NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875222511	FD	On-Demand	Anodyne	CAPN1	39	43
CCC[C@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875222512	EH	On-Demand	Anodyne	ACE	40	36
CCC[C@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875222512	EH	On-Demand	Anodyne	MME	51	42
CCC[C@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875222512	EH	On-Demand	Anodyne	TIMP3	47	32
CCC[C@@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875222513	EH	On-Demand	Anodyne	ACE	40	36
CCC[C@@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875222513	EH	On-Demand	Anodyne	MME	51	42
CCC[C@@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875222513	EH	On-Demand	Anodyne	TIMP3	47	32
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)C(=O)NCCCCC1CC1	ZINC000875222524	GD	On-Demand	Anodyne	HTR1A	34	48
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)C(=O)NCCCCC1CC1	ZINC000875222524	GD	On-Demand	Anodyne	DRD2	38	51
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)C(=O)NCCCCC1CC1	ZINC000875222524	GD	On-Demand	Anodyne	DRD4	34	41
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)C(=O)NCCCCC1CC1	ZINC000875222524	GD	On-Demand	Anodyne	HTR2A	15	48
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)C(=O)NCCCCC1CC1	ZINC000875222524	GD	On-Demand	Anodyne	DRD3	48	48
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)C(=O)NCCCCC1CC1	ZINC000875222524	GD	On-Demand	Anodyne	SCD1	17	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccon1	ZINC000875222528	FD	On-Demand	Anodyne	DRD2	18	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccon1	ZINC000875222528	FD	On-Demand	Anodyne	DRD4	41	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccon1	ZINC000875222528	FD	On-Demand	Anodyne	ACHE	62	58
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccon1	ZINC000875222528	FD	On-Demand	Anodyne	DRD3	15	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccon1	ZINC000875222528	FD	On-Demand	Anodyne	SIGMAR1	56	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccon1	ZINC000875222528	FD	On-Demand	Anodyne	BCHE	17	50
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccon1	ZINC000875222528	FD	On-Demand	Anodyne	CCR3	24	40
O=C(NCCCCCCc1ccccc1)C(=O)NCc1ccon1	ZINC000875222531	EE	On-Demand	Anodyne	S1PR3	17	42
O=C(NCCCCCCc1ccccc1)C(=O)NCc1ccon1	ZINC000875222531	EE	On-Demand	Anodyne	FAAH	70	44
O=C(NCCCCCCc1ccccc1)C(=O)NCc1ccon1	ZINC000875222531	EE	On-Demand	Anodyne	S1PR2	17	42
O=C(NCCCCCCc1ccccc1)C(=O)NCc1ccon1	ZINC000875222531	EE	On-Demand	Anodyne	CES1	73	44
O=C(NCCCCCCc1ccccc1)C(=O)NCc1ccon1	ZINC000875222531	EE	On-Demand	Anodyne	AMP1_PLAFQ	25	45
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875222534	GC	On-Demand	Anodyne	HTR1A	17	47
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875222534	GC	On-Demand	Anodyne	DRD4	28	41
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875222534	GC	On-Demand	Anodyne	P2RX3	32	46
C[C@H](NC(=O)C(=O)NC[C@H]1CCCN1Cc1ccccc1)c1ccnn1C	ZINC000875222548	FD	On-Demand	Anodyne	DRD2	29	45
C[C@H](NC(=O)C(=O)NC[C@@H]1CCCN1Cc1ccccc1)c1ccnn1C	ZINC000875222550	FD	On-Demand	Anodyne	DRD2	29	45
O=C(NCc1ccon1)C(=O)N1CCc2ccc(C(F)(F)F)cc2C1	ZINC000875222563	FD	On-Demand	Anodyne	CCR2	20	40
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875222597	GD	On-Demand	Anodyne	DRD4	26	40
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875222597	GD	On-Demand	Anodyne	P2RX3	30	40
C[C@@H](CN(C)C(=O)C(=O)NCC(C)(C)c1cccs1)NC(=O)OC(C)(C)C	ZINC000875222618	GF	On-Demand	Anodyne	PAPA1_CARPA	26	40
O=C(NCc1ccon1)C(=O)N[C@@H]1CCCCCN(Cc2ccccc2)C1	ZINC000875222627	FD	On-Demand	Anodyne	DRD4	31	43
O=C(NCc1ccon1)C(=O)N[C@@H]1CCCCCN(Cc2ccccc2)C1	ZINC000875222627	FD	On-Demand	Anodyne	SIGMAR1	29	48
O=C(NCc1ccon1)C(=O)N[C@@H]1CCCCCN(Cc2ccccc2)C1	ZINC000875222627	FD	On-Demand	Anodyne	CCR3	17	40
O=C(NCc1ccon1)C(=O)N[C@@H]1CCCCCN(Cc2ccccc2)C1	ZINC000875222627	FD	On-Demand	Anodyne	BIRC2	28	49
O=C(NCc1ccon1)C(=O)N[C@H]1CCCCCN(Cc2ccccc2)C1	ZINC000875222628	FD	On-Demand	Anodyne	DRD4	31	43
O=C(NCc1ccon1)C(=O)N[C@H]1CCCCCN(Cc2ccccc2)C1	ZINC000875222628	FD	On-Demand	Anodyne	SIGMAR1	29	48
O=C(NCc1ccon1)C(=O)N[C@H]1CCCCCN(Cc2ccccc2)C1	ZINC000875222628	FD	On-Demand	Anodyne	CCR3	17	40
O=C(NCc1ccon1)C(=O)N[C@H]1CCCCCN(Cc2ccccc2)C1	ZINC000875222628	FD	On-Demand	Anodyne	BIRC2	28	49
O=C(NCc1nccn1CC(F)(F)F)N1CCC[C@H](OC2CCC2)CC1	ZINC000875222642	FG	On-Demand	Anodyne	EPHX2	17	43
O=C(NCc1nccn1CC(F)(F)F)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875222643	FG	On-Demand	Anodyne	EPHX2	17	43
CCC[C@@H](Cc1ccccc1)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875222648	EE	On-Demand	Anodyne	GHRHR	60	37
CCC[C@@H](Cc1ccccc1)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875222648	EE	On-Demand	Anodyne	MME	74	47
CCC[C@@H](Cc1ccccc1)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875222648	EE	On-Demand	Anodyne	TACR2	52	33
CCC[C@@H](Cc1ccccc1)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875222648	EE	On-Demand	Anodyne	TIMP3	70	35
CCC[C@@H](Cc1ccccc1)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875222648	EE	On-Demand	Anodyne	CAPNS1	47	31
CCC[C@H](Cc1ccccc1)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875222649	EE	On-Demand	Anodyne	GHRHR	60	37
CCC[C@H](Cc1ccccc1)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875222649	EE	On-Demand	Anodyne	MME	74	47
CCC[C@H](Cc1ccccc1)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875222649	EE	On-Demand	Anodyne	TACR2	52	33
CCC[C@H](Cc1ccccc1)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875222649	EE	On-Demand	Anodyne	TIMP3	70	35
CCC[C@H](Cc1ccccc1)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875222649	EE	On-Demand	Anodyne	CAPNS1	47	31
C[C@@H]1CN(Cc2ccccc2)C[C@H]1CNC(=O)C(=O)NCc1ccon1	ZINC000875222705	FD	On-Demand	Anodyne	PDE8B	50	33
C[C@H]1CN(Cc2ccccc2)C[C@H]1CNC(=O)C(=O)NCc1ccon1	ZINC000875222706	FD	On-Demand	Anodyne	PDE8B	50	33
C[C@H]1CN(Cc2ccccc2)C[C@@H]1CNC(=O)C(=O)NCc1ccon1	ZINC000875222707	FD	On-Demand	Anodyne	PDE8B	50	33
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1CNC(=O)C(=O)NCc1ccon1	ZINC000875222708	FD	On-Demand	Anodyne	PDE8B	50	33
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3ccon3)C2)cc1	ZINC000875222709	EC	On-Demand	Anodyne	DRD4	29	46
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3ccon3)C2)cc1	ZINC000875222709	EC	On-Demand	Anodyne	SIGMAR1	17	42
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3ccon3)C2)cc1	ZINC000875222709	EC	On-Demand	Anodyne	CCR2	15	45
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3ccon3)C2)cc1	ZINC000875222709	EC	On-Demand	Anodyne	MCHR1	35	45
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3ccon3)C2)cc1	ZINC000875222710	EC	On-Demand	Anodyne	DRD4	29	46
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3ccon3)C2)cc1	ZINC000875222710	EC	On-Demand	Anodyne	SIGMAR1	17	42
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3ccon3)C2)cc1	ZINC000875222710	EC	On-Demand	Anodyne	CCR2	15	45
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3ccon3)C2)cc1	ZINC000875222710	EC	On-Demand	Anodyne	MCHR1	35	45
CCC[C@@H](Cc1ccccc1)NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875222714	DD	On-Demand	Anodyne	MME	46	40
O=C(NC[C@H]1CCCN1Cc1ccccc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875222784	ED	On-Demand	Anodyne	DRD2	33	46
O=C(NC[C@H]1CCCN1Cc1ccccc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875222784	ED	On-Demand	Anodyne	SIGMAR1	27	46
O=C(NC[C@H]1CCCN1Cc1ccccc1)C(=O)N[C@H]1CC12CCC2	ZINC000875222786	ED	On-Demand	Anodyne	DRD2	33	46
O=C(NC[C@H]1CCCN1Cc1ccccc1)C(=O)N[C@H]1CC12CCC2	ZINC000875222786	ED	On-Demand	Anodyne	SIGMAR1	27	46
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CC)Cc2ccccc2)C1	ZINC000875222850	EF	On-Demand	Anodyne	ACE	77	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CC)Cc2ccccc2)C1	ZINC000875222850	EF	On-Demand	Anodyne	MME	100	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CC)Cc2ccccc2)C1	ZINC000875222850	EF	On-Demand	Anodyne	ANPEP	60	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CC)Cc2ccccc2)C1	ZINC000875222850	EF	On-Demand	Anodyne	CTSB	40	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CC)Cc2ccccc2)C1	ZINC000875222850	EF	On-Demand	Anodyne	PAPA1_CARPA	43	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CC)Cc2ccccc2)C1	ZINC000875222850	EF	On-Demand	Anodyne	CYSP_TRYCR	48	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CC)Cc2ccccc2)C1	ZINC000875222850	EF	On-Demand	Anodyne	TIMP3	68	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CC)Cc2ccccc2)C1	ZINC000875222850	EF	On-Demand	Anodyne	CAPNS1	75	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CC)Cc2ccccc2)C1	ZINC000875222850	EF	On-Demand	Anodyne	HLA-DRB1	42	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CC)Cc2ccccc2)C1	ZINC000875222850	EF	On-Demand	Anodyne	REN	43	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CC)Cc2ccccc2)C1	ZINC000875222850	EF	On-Demand	Anodyne	CAPN1	68	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CC)Cc2ccccc2)C1	ZINC000875222850	EF	On-Demand	Anodyne	CAPN2	73	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CC)Cc2ccccc2)C1	ZINC000875222850	EF	On-Demand	Anodyne	ACE2	76	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CC)Cc2ccccc2)C1	ZINC000875222850	EF	On-Demand	Anodyne	CTRB_BOVIN	49	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CC)Cc2ccccc2)C1	ZINC000875222850	EF	On-Demand	Anodyne	Q6PRC7_IXORI	44	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CC)Cc2ccccc2)C1	ZINC000875222851	EF	On-Demand	Anodyne	ACE	77	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CC)Cc2ccccc2)C1	ZINC000875222851	EF	On-Demand	Anodyne	MME	100	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CC)Cc2ccccc2)C1	ZINC000875222851	EF	On-Demand	Anodyne	ANPEP	60	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CC)Cc2ccccc2)C1	ZINC000875222851	EF	On-Demand	Anodyne	CTSB	40	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CC)Cc2ccccc2)C1	ZINC000875222851	EF	On-Demand	Anodyne	PAPA1_CARPA	43	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CC)Cc2ccccc2)C1	ZINC000875222851	EF	On-Demand	Anodyne	CYSP_TRYCR	48	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CC)Cc2ccccc2)C1	ZINC000875222851	EF	On-Demand	Anodyne	TIMP3	68	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CC)Cc2ccccc2)C1	ZINC000875222851	EF	On-Demand	Anodyne	CAPNS1	75	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CC)Cc2ccccc2)C1	ZINC000875222851	EF	On-Demand	Anodyne	HLA-DRB1	42	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CC)Cc2ccccc2)C1	ZINC000875222851	EF	On-Demand	Anodyne	REN	43	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CC)Cc2ccccc2)C1	ZINC000875222851	EF	On-Demand	Anodyne	CAPN1	68	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CC)Cc2ccccc2)C1	ZINC000875222851	EF	On-Demand	Anodyne	CAPN2	73	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CC)Cc2ccccc2)C1	ZINC000875222851	EF	On-Demand	Anodyne	ACE2	76	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CC)Cc2ccccc2)C1	ZINC000875222851	EF	On-Demand	Anodyne	CTRB_BOVIN	49	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CC)Cc2ccccc2)C1	ZINC000875222851	EF	On-Demand	Anodyne	Q6PRC7_IXORI	44	35
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)CN1CCN(c2ccccn2)CC1	ZINC000875222856	GB	On-Demand	Mild	DRD4	30	41
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)CN1CCN(c2ccccn2)CC1	ZINC000875222857	GB	On-Demand	Mild	DRD4	30	41
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](C)CN1CCN(c2ccccn2)CC1	ZINC000875222858	GB	On-Demand	Mild	DRD4	30	41
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](C)CN1CCN(c2ccccn2)CC1	ZINC000875222859	GB	On-Demand	Mild	DRD4	30	41
CC(=O)C1CCN(C(=O)C(=O)NCC(C)(C)c2cccs2)CC1	ZINC000875222865	ED	On-Demand	Anodyne	CHRM1	20	40
CN1CCN(C2CCN(C(=O)C(=O)NCC(C)(C)c3cccs3)CC2)CC1	ZINC000875222895	GD	On-Demand	Anodyne	L3MBTL3	54	39
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000875222897	GD	On-Demand	Anodyne	DRD2	44	51
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000875222897	GD	On-Demand	Anodyne	LTA4H	15	41
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000875222897	GD	On-Demand	Anodyne	SIGMAR1	24	51
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000875222897	GD	On-Demand	Anodyne	MBTPS1	31	41
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000875222898	GD	On-Demand	Anodyne	DRD2	44	51
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000875222898	GD	On-Demand	Anodyne	LTA4H	15	41
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000875222898	GD	On-Demand	Anodyne	SIGMAR1	24	51
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000875222898	GD	On-Demand	Anodyne	MBTPS1	31	41
CCC[C@H](Cc1ccccc1)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875222954	CE	On-Demand	Anodyne	MME	76	40
CCC[C@H](Cc1ccccc1)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875222954	CE	On-Demand	Anodyne	TIMP3	46	31
CCC[C@H](Cc1ccccc1)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875222954	CE	On-Demand	Anodyne	CAPNS1	42	32
CCC[C@H](Cc1ccccc1)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875222954	CE	On-Demand	Anodyne	ACE2	45	32
CCC[C@@H](Cc1ccccc1)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875222955	CE	On-Demand	Anodyne	MME	76	40
CCC[C@@H](Cc1ccccc1)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875222955	CE	On-Demand	Anodyne	TIMP3	46	31
CCC[C@@H](Cc1ccccc1)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875222955	CE	On-Demand	Anodyne	CAPNS1	42	32
CCC[C@@H](Cc1ccccc1)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875222955	CE	On-Demand	Anodyne	ACE2	45	32
CCC[C@H](Cc1ccccc1)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875222958	EF	On-Demand	Anodyne	ACE	27	42
CCC[C@H](Cc1ccccc1)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875222958	EF	On-Demand	Anodyne	DRD4	22	41
CCC[C@H](Cc1ccccc1)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875222958	EF	On-Demand	Anodyne	CHRM3	21	41
CCC[C@H](Cc1ccccc1)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875222958	EF	On-Demand	Anodyne	MME	36	42
CCC[C@H](Cc1ccccc1)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875222958	EF	On-Demand	Anodyne	SIGMAR1	23	40
CCC[C@H](Cc1ccccc1)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875222958	EF	On-Demand	Anodyne	BIRC2	41	40
CCC[C@@H](Cc1ccccc1)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875222959	EF	On-Demand	Anodyne	ACE	27	42
CCC[C@@H](Cc1ccccc1)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875222959	EF	On-Demand	Anodyne	DRD4	22	41
CCC[C@@H](Cc1ccccc1)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875222959	EF	On-Demand	Anodyne	CHRM3	21	41
CCC[C@@H](Cc1ccccc1)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875222959	EF	On-Demand	Anodyne	MME	36	42
CCC[C@@H](Cc1ccccc1)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875222959	EF	On-Demand	Anodyne	SIGMAR1	23	40
CCC[C@@H](Cc1ccccc1)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875222959	EF	On-Demand	Anodyne	BIRC2	41	40
CCC[C@H](Cc1ccccc1)NC(=O)NN(C)C(=O)OC	ZINC000875222962	CE	On-Demand	Reactive	MME	80	40
CCC[C@H](Cc1ccccc1)NC(=O)NN(C)C(=O)OC	ZINC000875222962	CE	On-Demand	Reactive	ANPEP	46	33
CCC[C@H](Cc1ccccc1)NC(=O)NN(C)C(=O)OC	ZINC000875222962	CE	On-Demand	Reactive	PAPA1_CARPA	48	35
CCC[C@H](Cc1ccccc1)NC(=O)NN(C)C(=O)OC	ZINC000875222962	CE	On-Demand	Reactive	CTRB1	42	36
CCC[C@H](Cc1ccccc1)NC(=O)NN(C)C(=O)OC	ZINC000875222962	CE	On-Demand	Reactive	CAPNS1	53	33
CCC[C@H](Cc1ccccc1)NC(=O)NN(C)C(=O)OC	ZINC000875222962	CE	On-Demand	Reactive	CAPN1	47	35
CCC[C@H](Cc1ccccc1)NC(=O)NN(C)C(=O)OC	ZINC000875222962	CE	On-Demand	Reactive	CAPN2	46	33
CCC[C@H](Cc1ccccc1)NC(=O)NN(C)C(=O)OC	ZINC000875222962	CE	On-Demand	Reactive	ACE2	50	36
CCC[C@H](Cc1ccccc1)NC(=O)NN(C)C(=O)OC	ZINC000875222962	CE	On-Demand	Reactive	CTRB_BOVIN	55	35
CCC[C@@H](Cc1ccccc1)NC(=O)NN(C)C(=O)OC	ZINC000875222963	CE	On-Demand	Reactive	MME	80	40
CCC[C@@H](Cc1ccccc1)NC(=O)NN(C)C(=O)OC	ZINC000875222963	CE	On-Demand	Reactive	ANPEP	46	33
CCC[C@@H](Cc1ccccc1)NC(=O)NN(C)C(=O)OC	ZINC000875222963	CE	On-Demand	Reactive	PAPA1_CARPA	48	35
CCC[C@@H](Cc1ccccc1)NC(=O)NN(C)C(=O)OC	ZINC000875222963	CE	On-Demand	Reactive	CTRB1	42	36
CCC[C@@H](Cc1ccccc1)NC(=O)NN(C)C(=O)OC	ZINC000875222963	CE	On-Demand	Reactive	CAPNS1	53	33
CCC[C@@H](Cc1ccccc1)NC(=O)NN(C)C(=O)OC	ZINC000875222963	CE	On-Demand	Reactive	CAPN1	47	35
CCC[C@@H](Cc1ccccc1)NC(=O)NN(C)C(=O)OC	ZINC000875222963	CE	On-Demand	Reactive	CAPN2	46	33
CCC[C@@H](Cc1ccccc1)NC(=O)NN(C)C(=O)OC	ZINC000875222963	CE	On-Demand	Reactive	ACE2	50	36
CCC[C@@H](Cc1ccccc1)NC(=O)NN(C)C(=O)OC	ZINC000875222963	CE	On-Demand	Reactive	CTRB_BOVIN	55	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCCN2Cc2ccccc2)C1	ZINC000875222965	FD	On-Demand	Anodyne	DRD2	39	47
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCCN2Cc2ccccc2)C1	ZINC000875222965	FD	On-Demand	Anodyne	SLC6A1	60	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCCN2Cc2ccccc2)C1	ZINC000875222965	FD	On-Demand	Anodyne	SIGMAR1	24	48
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCCN2Cc2ccccc2)C1	ZINC000875222966	FD	On-Demand	Anodyne	DRD2	39	47
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCCN2Cc2ccccc2)C1	ZINC000875222966	FD	On-Demand	Anodyne	SLC6A1	60	32
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCCN2Cc2ccccc2)C1	ZINC000875222966	FD	On-Demand	Anodyne	SIGMAR1	24	48
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCCN2Cc2ccccc2)C1	ZINC000875222967	FD	On-Demand	Anodyne	DRD2	39	47
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCCN2Cc2ccccc2)C1	ZINC000875222967	FD	On-Demand	Anodyne	SLC6A1	60	32
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCCN2Cc2ccccc2)C1	ZINC000875222967	FD	On-Demand	Anodyne	SIGMAR1	24	48
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCCN2Cc2ccccc2)C1	ZINC000875222968	FD	On-Demand	Anodyne	DRD2	39	47
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCCN2Cc2ccccc2)C1	ZINC000875222968	FD	On-Demand	Anodyne	SLC6A1	60	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCCN2Cc2ccccc2)C1	ZINC000875222968	FD	On-Demand	Anodyne	SIGMAR1	24	48
COC(=O)C1(O)CN(C(=O)NCc2cccc(CN3CCC(C)CC3)c2)C1	ZINC000875223041	GD	On-Demand	Anodyne	ACHE	23	42
COC(=O)C1(O)CN(C(=O)NCc2cccc(CN3CCC(C)CC3)c2)C1	ZINC000875223041	GD	On-Demand	Anodyne	SIGMAR1	28	40
COC(=O)C1(O)CN(C(=O)NCc2cccc(CN3CCC(C)CC3)c2)C1	ZINC000875223041	GD	On-Demand	Anodyne	CXCR3	33	41
COC(=O)C1(O)CN(C(=O)NCc2cccc(CN3CCC(C)CC3)c2)C1	ZINC000875223041	GD	On-Demand	Anodyne	MCHR1	18	43
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1cc(C(C)C)no1	ZINC000875223062	DC	On-Demand	Mild	SLC5A7	24	42
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1cc(C(C)C)no1	ZINC000875223063	DC	On-Demand	Mild	SLC5A7	24	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2cc(C(C)C)no2)C1	ZINC000875223079	DD	On-Demand	Anodyne	SLC5A7	26	47
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2cc(C(C)C)no2)C1	ZINC000875223080	DD	On-Demand	Anodyne	SLC5A7	26	47
C[C@@H](NC(=O)N(C)OCC(F)(F)F)C(C)(C)c1ccccc1	ZINC000875223124	DG	On-Demand	Anodyne	AMY2	56	33
COc1ccccc1[C@H]1CN(C(=O)C(=O)NCc2cc(C(C)C)no2)CCO1	ZINC000875223126	GE	On-Demand	Anodyne	SLC5A7	30	47
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NCc2cc(C(C)C)no2)CCO1	ZINC000875223127	GE	On-Demand	Anodyne	SLC5A7	30	47
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCN(c3ccccc3)C2)C1	ZINC000875223128	FD	On-Demand	Anodyne	SLC6A1	44	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCCN(c3ccccc3)C2)C1	ZINC000875223129	FD	On-Demand	Anodyne	SLC6A1	44	32
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H]2CCCN(c3ccccc3)C2)C1	ZINC000875223130	FD	On-Demand	Anodyne	SLC6A1	44	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCCN(c3ccccc3)C2)C1	ZINC000875223131	FD	On-Demand	Anodyne	SLC6A1	44	32
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@@H](C)C(C)(C)c1ccccc1	ZINC000875223138	EH	On-Demand	Anodyne	TIMP3	71	35
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@@H](C)C(C)(C)c1ccccc1	ZINC000875223138	EH	On-Demand	Anodyne	AMY2	54	33
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@H](C)C(C)(C)c1ccccc1	ZINC000875223140	EH	On-Demand	Anodyne	TIMP3	71	35
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@H](C)C(C)(C)c1ccccc1	ZINC000875223140	EH	On-Demand	Anodyne	AMY2	54	33
CCOC1CC2(C1)C[C@H]2NC(=O)N[C@@H](C)C(C)(C)c1ccccc1	ZINC000875223141	EH	On-Demand	Anodyne	TIMP3	71	35
CCOC1CC2(C1)C[C@H]2NC(=O)N[C@@H](C)C(C)(C)c1ccccc1	ZINC000875223141	EH	On-Demand	Anodyne	AMY2	54	33
CCCN(CCC)CCCNC(=O)N1Cc2cccc(O)c2C1	ZINC000875223149	DF	On-Demand	Clean	ASAH1	47	32
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2cc(C(C)C)no2)C1	ZINC000875223173	DD	On-Demand	Anodyne	SLC5A7	27	47
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)C(C)(C)c1ccccc1	ZINC000875223177	EH	On-Demand	Anodyne	CHRM2	27	40
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)C(C)(C)c1ccccc1	ZINC000875223177	EH	On-Demand	Anodyne	CHRM3	45	40
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)C(C)(C)c1ccccc1	ZINC000875223177	EH	On-Demand	Anodyne	AMY2	53	38
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)C(C)(C)c1ccccc1	ZINC000875223179	EH	On-Demand	Anodyne	CHRM2	27	40
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)C(C)(C)c1ccccc1	ZINC000875223179	EH	On-Demand	Anodyne	CHRM3	45	40
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)C(C)(C)c1ccccc1	ZINC000875223179	EH	On-Demand	Anodyne	AMY2	53	38
C[C@@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)C(C)(C)c1ccccc1	ZINC000875223195	FF	On-Demand	Anodyne	AMY2	58	35
C[C@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)C(C)(C)c1ccccc1	ZINC000875223196	FF	On-Demand	Anodyne	AMY2	58	35
CC(=O)C1CCN(C(=O)C(=O)NCc2cc(C(C)C)no2)CC1	ZINC000875223197	DD	On-Demand	Anodyne	SLC5A7	31	51
C[C@@H](NC(=O)NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O)C(C)(C)c1ccccc1	ZINC000875223210	GG	On-Demand	Anodyne	AMY2	48	34
C[C@H](NC(=O)NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O)C(C)(C)c1ccccc1	ZINC000875223211	GG	On-Demand	Anodyne	AMY2	48	34
C[S@](=N)(=O)N1CCN(C(=O)C(=O)N[C@H]2CCCN(c3ccccc3)C2)CC1	ZINC000875223212	GC	On-Demand	Anodyne	SFRP1	66	32
C[S@](=N)(=O)N1CCN(C(=O)C(=O)N[C@H]2CCCN(c3ccccc3)C2)CC1	ZINC000875223212	GC	On-Demand	Anodyne	WNT3	47	31
C[S@](=N)(=O)N1CCN(C(=O)C(=O)N[C@@H]2CCCN(c3ccccc3)C2)CC1	ZINC000875223215	GC	On-Demand	Anodyne	SFRP1	66	32
C[S@](=N)(=O)N1CCN(C(=O)C(=O)N[C@@H]2CCCN(c3ccccc3)C2)CC1	ZINC000875223215	GC	On-Demand	Anodyne	WNT3	47	31
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000875223240	GE	On-Demand	Anodyne	DRD2	28	44
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000875223240	GE	On-Demand	Anodyne	ACHE	17	42
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000875223241	GE	On-Demand	Anodyne	DRD2	28	44
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000875223241	GE	On-Demand	Anodyne	ACHE	17	42
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000875223242	GE	On-Demand	Anodyne	DRD2	28	44
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000875223242	GE	On-Demand	Anodyne	ACHE	17	42
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000875223243	GE	On-Demand	Anodyne	DRD2	28	44
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000875223243	GE	On-Demand	Anodyne	ACHE	17	42
CC(C)(C)NC(=O)CCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875223277	FF	On-Demand	Anodyne	FKBP1A	41	45
CC(C)(C)NC(=O)CCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875223277	FF	On-Demand	Anodyne	AMY2	42	29
CC(C)(C)NC(=O)CCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875223278	FF	On-Demand	Anodyne	FKBP1A	41	45
CC(C)(C)NC(=O)CCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875223278	FF	On-Demand	Anodyne	AMY2	42	29
CC(C)(C)NC(=O)CCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875223279	FF	On-Demand	Anodyne	FKBP1A	41	45
CC(C)(C)NC(=O)CCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875223279	FF	On-Demand	Anodyne	AMY2	42	29
CC(C)(C)NC(=O)CCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875223280	FF	On-Demand	Anodyne	FKBP1A	41	45
CC(C)(C)NC(=O)CCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875223280	FF	On-Demand	Anodyne	AMY2	42	29
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)C(C)(C)c1ccccc1	ZINC000875223326	FD	On-Demand	Anodyne	AMY2	46	33
C[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)C(C)(C)c1ccccc1	ZINC000875223327	FF	On-Demand	Anodyne	L3MBTL3	73	44
CCCCCCCNC(=O)C(=O)N[C@@H]1CCCc2c[nH]nc21	ZINC000875223335	DD	On-Demand	Mild	ASAH1	48	32
CCCCCCCNC(=O)C(=O)N[C@H]1CCCc2c[nH]nc21	ZINC000875223336	DD	On-Demand	Mild	ASAH1	48	32
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCc2cc(C(C)C)no2)c1	ZINC000875223362	FE	On-Demand	Anodyne	SLC5A7	24	41
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCc2cc(C(C)C)no2)c1	ZINC000875223363	FE	On-Demand	Anodyne	SLC5A7	24	41
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000875223378	FD	On-Demand	Mild	DRD2	41	49
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000875223378	FD	On-Demand	Mild	SLC6A1	48	33
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000875223378	FD	On-Demand	Mild	SIGMAR1	15	50
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000875223379	FD	On-Demand	Mild	DRD2	41	49
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000875223379	FD	On-Demand	Mild	SLC6A1	48	33
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000875223379	FD	On-Demand	Mild	SIGMAR1	15	50
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000875223380	FD	On-Demand	Mild	DRD2	41	49
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000875223380	FD	On-Demand	Mild	SLC6A1	48	33
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000875223380	FD	On-Demand	Mild	SIGMAR1	15	50
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000875223381	FD	On-Demand	Mild	DRD2	41	49
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000875223381	FD	On-Demand	Mild	SLC6A1	48	33
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000875223381	FD	On-Demand	Mild	SIGMAR1	15	50
C[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)C(C)(C)c1ccccc1	ZINC000875223411	EF	On-Demand	Anodyne	CACNA1H	43	35
C[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)C(C)(C)c1ccccc1	ZINC000875223411	EF	On-Demand	Anodyne	GHRHR	63	35
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)C(C)(C)c1ccccc1	ZINC000875223416	EE	On-Demand	Anodyne	GHRHR	62	36
CC[C@]1(C(=O)Nc2ccc(C(=O)NC3CCCC3)cc2C)CCNC1=O	ZINC000875223439	FF	On-Demand	Anodyne	CNR2	16	43
CC[C@]1(C(=O)Nc2ccc(C(=O)NC3CCCC3)cc2C)CCNC1=O	ZINC000875223439	FF	On-Demand	Anodyne	MAPK14	43	42
CC[C@]1(C(=O)Nc2ccc(C(=O)NC3CCCC3)cc2C)CCNC1=O	ZINC000875223439	FF	On-Demand	Anodyne	MAPK13	41	32
CC(=O)C1CCN(C(=O)N[C@@H](C)C(C)(C)c2ccccc2)CC1	ZINC000875223450	DG	On-Demand	Anodyne	AMY2	46	32
CC(=O)C1CCN(C(=O)N[C@H](C)C(C)(C)c2ccccc2)CC1	ZINC000875223451	DG	On-Demand	Anodyne	AMY2	46	32
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000875223454	FC	On-Demand	Mild	DRD2	39	48
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000875223454	FC	On-Demand	Mild	SIGMAR1	15	49
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000875223455	FC	On-Demand	Mild	DRD2	39	48
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000875223455	FC	On-Demand	Mild	SIGMAR1	15	49
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000875223456	FC	On-Demand	Mild	DRD2	39	48
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000875223456	FC	On-Demand	Mild	SIGMAR1	15	49
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000875223457	FC	On-Demand	Mild	DRD2	39	48
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000875223457	FC	On-Demand	Mild	SIGMAR1	15	49
CONC(=O)C1CCN(C(=O)N[C@@H](C)C(C)(C)c2ccccc2)CC1	ZINC000875223462	EE	On-Demand	Anodyne	CHRM2	16	40
CONC(=O)C1CCN(C(=O)N[C@@H](C)C(C)(C)c2ccccc2)CC1	ZINC000875223462	EE	On-Demand	Anodyne	CHRM1	18	40
CONC(=O)C1CCN(C(=O)N[C@@H](C)C(C)(C)c2ccccc2)CC1	ZINC000875223462	EE	On-Demand	Anodyne	CHRM3	37	40
CONC(=O)C1CCN(C(=O)N[C@@H](C)C(C)(C)c2ccccc2)CC1	ZINC000875223462	EE	On-Demand	Anodyne	AMY2	66	40
CONC(=O)C1CCN(C(=O)N[C@H](C)C(C)(C)c2ccccc2)CC1	ZINC000875223463	EE	On-Demand	Anodyne	CHRM2	16	40
CONC(=O)C1CCN(C(=O)N[C@H](C)C(C)(C)c2ccccc2)CC1	ZINC000875223463	EE	On-Demand	Anodyne	CHRM1	18	40
CONC(=O)C1CCN(C(=O)N[C@H](C)C(C)(C)c2ccccc2)CC1	ZINC000875223463	EE	On-Demand	Anodyne	CHRM3	37	40
CONC(=O)C1CCN(C(=O)N[C@H](C)C(C)(C)c2ccccc2)CC1	ZINC000875223463	EE	On-Demand	Anodyne	AMY2	66	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)C(C)(C)c2ccccc2)C1	ZINC000875223466	EG	On-Demand	Anodyne	GHRHR	40	33
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)C(C)(C)c2ccccc2)C1	ZINC000875223466	EG	On-Demand	Anodyne	AMY2	62	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)C(C)(C)c2ccccc2)C1	ZINC000875223466	EG	On-Demand	Anodyne	CTRB_BOVIN	56	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)C(C)(C)c2ccccc2)C1	ZINC000875223468	EG	On-Demand	Anodyne	GHRHR	40	33
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)C(C)(C)c2ccccc2)C1	ZINC000875223468	EG	On-Demand	Anodyne	AMY2	62	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)C(C)(C)c2ccccc2)C1	ZINC000875223468	EG	On-Demand	Anodyne	CTRB_BOVIN	56	34
C[C@@H](NC(=O)N(C)CCS(N)(=O)=O)C(C)(C)c1ccccc1	ZINC000875223482	ED	On-Demand	Anodyne	AMY2	59	35
COc1ccc([C@@H]2CN(C(=O)C(=O)NCc3cc(C(C)C)no3)CCO2)cc1	ZINC000875223492	GE	On-Demand	Anodyne	SLC5A7	26	45
COCC1CC(NC(=O)N[C@@H](C)C(C)(C)c2ccccc2)C1	ZINC000875223493	DG	On-Demand	Anodyne	AMY2	55	33
COCC1CC(NC(=O)N[C@H](C)C(C)(C)c2ccccc2)C1	ZINC000875223494	DG	On-Demand	Anodyne	AMY2	55	33
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)C(C)(C)c1ccccc1	ZINC000875223498	EG	On-Demand	Anodyne	SLC6A4	25	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)C(C)(C)c1ccccc1	ZINC000875223498	EG	On-Demand	Anodyne	SLC6A3	53	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)C(C)(C)c1ccccc1	ZINC000875223498	EG	On-Demand	Anodyne	AMY2	46	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)C(C)(C)c1ccccc1	ZINC000875223499	EG	On-Demand	Anodyne	SLC6A4	25	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)C(C)(C)c1ccccc1	ZINC000875223499	EG	On-Demand	Anodyne	SLC6A3	53	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)C(C)(C)c1ccccc1	ZINC000875223499	EG	On-Demand	Anodyne	AMY2	46	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)C(C)(C)c1ccccc1	ZINC000875223500	EG	On-Demand	Anodyne	SLC6A4	25	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)C(C)(C)c1ccccc1	ZINC000875223500	EG	On-Demand	Anodyne	SLC6A3	53	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)C(C)(C)c1ccccc1	ZINC000875223500	EG	On-Demand	Anodyne	AMY2	46	33
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)C(C)(C)c1ccccc1	ZINC000875223501	EG	On-Demand	Anodyne	SLC6A4	25	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)C(C)(C)c1ccccc1	ZINC000875223501	EG	On-Demand	Anodyne	SLC6A3	53	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)C(C)(C)c1ccccc1	ZINC000875223501	EG	On-Demand	Anodyne	AMY2	46	33
C#CC[C@H](COC)NC(=O)N[C@H](C)C(C)(C)c1ccccc1	ZINC000875223530	DF	On-Demand	Mild	AMY2	54	33
C#CC[C@H](COC)NC(=O)N[C@@H](C)C(C)(C)c1ccccc1	ZINC000875223531	DF	On-Demand	Mild	AMY2	54	33
C#CC[C@@H](COC)NC(=O)N[C@@H](C)C(C)(C)c1ccccc1	ZINC000875223532	DF	On-Demand	Mild	AMY2	54	33
C#CC[C@@H](COC)NC(=O)N[C@H](C)C(C)(C)c1ccccc1	ZINC000875223533	DF	On-Demand	Mild	AMY2	54	33
CN(CCOc1cccc(CNC(=O)NC[C@H]2C[C@H](O)C2)c1)C1CCOCC1	ZINC000875223540	GD	On-Demand	Anodyne	PDS	41	32
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)C(C)(C)c1ccccc1	ZINC000875223541	CE	On-Demand	Anodyne	AMY2	54	33
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)C(C)(C)c1ccccc1	ZINC000875223542	CE	On-Demand	Anodyne	AMY2	54	33
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)C1(F)CCOCC1	ZINC000875223553	EG	On-Demand	Anodyne	CNR2	16	44
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)C1(F)CCOCC1	ZINC000875223553	EG	On-Demand	Anodyne	MAPK14	50	43
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)C1(F)CCOCC1	ZINC000875223553	EG	On-Demand	Anodyne	MAPK13	59	37
COC(=O)N(C)NC(=O)NCC(C)(C)c1ccccc1Cl	ZINC000875223555	DF	On-Demand	Reactive	ECR	55	37
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)[C@@H](NC=O)C(C)C	ZINC000875223571	EE	On-Demand	Anodyne	MAPK14	47	38
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)[C@@H](NC=O)C(C)C	ZINC000875223571	EE	On-Demand	Anodyne	MAPK13	53	38
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)C(C)(C)c1ccccc1	ZINC000875223573	EH	On-Demand	Anodyne	CHRM3	15	44
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)C(C)(C)c1ccccc1	ZINC000875223573	EH	On-Demand	Anodyne	AMY2	44	32
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)C(C)(C)c1ccccc1	ZINC000875223574	EH	On-Demand	Anodyne	CHRM3	15	44
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)C(C)(C)c1ccccc1	ZINC000875223574	EH	On-Demand	Anodyne	AMY2	44	32
CN(C)[C@@H]1CCC[C@@H](NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875223580	GE	On-Demand	Anodyne	C3AR1	41	39
CN(C)[C@@H]1CCC[C@@H](NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875223581	GE	On-Demand	Anodyne	C3AR1	41	39
CN(C)[C@@H]1CCC[C@H](NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875223582	GE	On-Demand	Anodyne	C3AR1	41	39
CN(C)[C@@H]1CCC[C@H](NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875223583	GE	On-Demand	Anodyne	C3AR1	41	39
CCCCCCCNC(=O)C(=O)NCc1nc2ccc(C)cc2[nH]1	ZINC000875223622	EF	On-Demand	Mild	ASAH1	79	36
Cc1cncc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)c1	ZINC000875223653	ED	On-Demand	Anodyne	SIRT3	49	30
Cc1cncc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)c1	ZINC000875223653	ED	On-Demand	Anodyne	SIRT2	51	33
Cc1cncc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)c1	ZINC000875223653	ED	On-Demand	Anodyne	SIRT1	50	33
Cc1cncc(CNC(=O)C(=O)N2CCN(c3ccc(F)cc3F)CC2)c1	ZINC000875223658	FD	On-Demand	Anodyne	NPY2R	47	34
COC(=O)N(C)NC(=O)NCc1cccc(CN2CCC(C)CC2)c1	ZINC000875223735	EE	On-Demand	Reactive	DRD2	15	42
COC(=O)N(C)NC(=O)NCc1cccc(CN2CCC(C)CC2)c1	ZINC000875223735	EE	On-Demand	Reactive	DRD4	33	43
COC(=O)N(C)NC(=O)NCc1cccc(CN2CCC(C)CC2)c1	ZINC000875223735	EE	On-Demand	Reactive	ACHE	28	43
COC(=O)N(C)NC(=O)NCc1cccc(CN2CCC(C)CC2)c1	ZINC000875223735	EE	On-Demand	Reactive	HRH2	26	40
COC(=O)N(C)NC(=O)NCc1cccc(CN2CCC(C)CC2)c1	ZINC000875223735	EE	On-Demand	Reactive	CHRM3	27	41
COC(=O)N(C)NC(=O)NCc1cccc(CN2CCC(C)CC2)c1	ZINC000875223735	EE	On-Demand	Reactive	SIGMAR1	32	41
COC(=O)N(C)NC(=O)NCc1cccc(CN2CCC(C)CC2)c1	ZINC000875223735	EE	On-Demand	Reactive	MCHR1	33	49
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)c1sccc1CC#N	ZINC000875223744	FI	On-Demand	Mild	MAPK11	34	42
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)c1sccc1CC#N	ZINC000875223744	FI	On-Demand	Mild	MAPK14	35	42
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875223766	GH	On-Demand	Anodyne	CNR1	22	43
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875223766	GH	On-Demand	Anodyne	CNR2	20	43
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875223766	GH	On-Demand	Anodyne	MAPK11	41	44
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875223766	GH	On-Demand	Anodyne	MAPK14	67	44
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875223766	GH	On-Demand	Anodyne	MAPK13	85	39
CCn1ncnc1-c1ccc(C(=O)Nc2sccc2C(=O)NC2CC2)cc1	ZINC000875223795	GG	On-Demand	Anodyne	TTK	42	31
CCCCCCCNC(=O)C(=O)NCc1cccnn1	ZINC000875223802	CD	On-Demand	Mild	FAAH	15	42
CCCCCCCNC(=O)C(=O)NCc1cccnn1	ZINC000875223802	CD	On-Demand	Mild	ASAH1	90	36
O=C(NCc1cccnn1)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875223814	FC	On-Demand	Anodyne	NPY2R	43	33
O=C(NCc1cccnn1)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875223814	FC	On-Demand	Anodyne	FAAH	20	40
O=C(NC1CC1)c1ccsc1NC(=O)[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000875223825	GF	On-Demand	Anodyne	EPHX2	15	53
O=C(NC1CC1)c1ccsc1NC(=O)[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000875223825	GF	On-Demand	Anodyne	L3MBTL3	48	34
O=C(NC1CC1)c1ccsc1NC(=O)[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000875223826	GF	On-Demand	Anodyne	EPHX2	15	53
O=C(NC1CC1)c1ccsc1NC(=O)[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000875223826	GF	On-Demand	Anodyne	L3MBTL3	48	34
CCc1ccc(F)cc1C(=O)Nc1sccc1C(=O)NC1CC1	ZINC000875223863	EH	On-Demand	Anodyne	CNR2	16	41
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1cncc(C)c1)CC2	ZINC000875223933	GE	On-Demand	Anodyne	SLC18A2	45	33
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1cncc(C)c1)CC2	ZINC000875223933	GE	On-Demand	Anodyne	HCRTR1	16	46
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1cncc(C)c1)CC2	ZINC000875223933	GE	On-Demand	Anodyne	HCRTR2	17	41
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1cncc(C)c1)CC2	ZINC000875223934	GE	On-Demand	Anodyne	SLC18A2	45	33
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1cncc(C)c1)CC2	ZINC000875223934	GE	On-Demand	Anodyne	HCRTR1	16	46
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1cncc(C)c1)CC2	ZINC000875223934	GE	On-Demand	Anodyne	HCRTR2	17	41
C[C@@H](NC(=O)N1CCc2c(CC(N)=O)cccc2C1)C(C)(C)c1ccccc1	ZINC000875223989	GG	On-Demand	Anodyne	Q6PRC7_IXORI	74	38
CN(C)C[C@@H]1CN(C(=O)NCC(C)(C)c2ccccc2Cl)C[C@H]1CN(C)C	ZINC000875223990	GF	On-Demand	Anodyne	ECR	45	35
C[C@H](NC(=O)NC1CC(C(N)=O)C1)C(C)(C)c1ccccc1	ZINC000875223991	DD	On-Demand	Anodyne	AMY2	54	33
C[C@@H](NC(=O)NC1CC(C(N)=O)C1)C(C)(C)c1ccccc1	ZINC000875223992	DD	On-Demand	Anodyne	AMY2	54	33
C[C@@H](NC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)C(C)(C)c1ccccc1	ZINC000875223993	GG	On-Demand	Anodyne	ETHR	60	37
C[C@@H](NC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)C(C)(C)c1ccccc1	ZINC000875223994	GG	On-Demand	Anodyne	ETHR	60	37
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)C1(OC(C)C)CCC1	ZINC000875223997	FH	On-Demand	Anodyne	MAPK14	47	39
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)C1(OC(C)C)CCC1	ZINC000875223997	FH	On-Demand	Anodyne	MAPK13	43	35
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)C1(C)CC(F)(F)C1	ZINC000875223998	FI	On-Demand	Anodyne	MAPK11	37	41
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)C1(C)CC(F)(F)C1	ZINC000875223998	FI	On-Demand	Anodyne	MAPK14	52	41
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)C1(C)CC(F)(F)C1	ZINC000875223998	FI	On-Demand	Anodyne	MAPK13	59	35
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCCN(c2ccccc2)C1	ZINC000875224029	FD	On-Demand	Anodyne	DRD2	16	40
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCCN(c2ccccc2)C1	ZINC000875224029	FD	On-Demand	Anodyne	DRD3	20	40
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCCN(c2ccccc2)C1	ZINC000875224030	FD	On-Demand	Anodyne	DRD2	16	40
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCCN(c2ccccc2)C1	ZINC000875224030	FD	On-Demand	Anodyne	DRD3	20	40
COCC(C)(C)CCNC(=O)C(=O)NCc1cc(C(C)C)no1	ZINC000875224049	ED	On-Demand	Anodyne	SLC5A7	24	40
CCCCCCCNC(=O)C(=O)NCc1cc(C(C)C)no1	ZINC000875224069	DF	On-Demand	Mild	SLC5A7	24	41
CCCCCCCNC(=O)C(=O)NCc1cc(C(C)C)no1	ZINC000875224069	DF	On-Demand	Mild	ASAH1	86	34
CCCCCCCNC(=O)C(=O)NCc1cc(F)cc(OC)c1	ZINC000875224117	DF	On-Demand	Mild	LPAR2	40	32
CCCCCCCNC(=O)C(=O)NCc1cc(F)cc(OC)c1	ZINC000875224117	DF	On-Demand	Mild	S1PR2	40	32
CCCCCCCNC(=O)C(=O)NCc1cc(F)cc(OC)c1	ZINC000875224117	DF	On-Demand	Mild	ASAH1	92	38
O=C(Cn1ncc2cccnc21)Nc1sccc1C(=O)NC1CC1	ZINC000875224157	EE	On-Demand	Anodyne	CNR2	17	44
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(c3cccc(OC)c3)C2)C1	ZINC000875224222	EC	On-Demand	Anodyne	DRD4	40	32
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(c3cccc(OC)c3)C2)C1	ZINC000875224222	EC	On-Demand	Anodyne	MTNR1A	22	60
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(c3cccc(OC)c3)C2)C1	ZINC000875224222	EC	On-Demand	Anodyne	MTNR1B	24	60
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(c3cccc(OC)c3)C2)C1	ZINC000875224223	EC	On-Demand	Anodyne	DRD4	40	32
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(c3cccc(OC)c3)C2)C1	ZINC000875224223	EC	On-Demand	Anodyne	MTNR1A	22	60
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(c3cccc(OC)c3)C2)C1	ZINC000875224223	EC	On-Demand	Anodyne	MTNR1B	24	60
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875224230	FE	On-Demand	Anodyne	SLC6A4	24	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875224230	FE	On-Demand	Anodyne	SLC6A3	42	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875224230	FE	On-Demand	Anodyne	MTNR1A	15	56
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875224230	FE	On-Demand	Anodyne	MTNR1B	15	56
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875224231	FE	On-Demand	Anodyne	SLC6A4	24	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875224231	FE	On-Demand	Anodyne	SLC6A3	42	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875224231	FE	On-Demand	Anodyne	MTNR1A	15	56
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875224231	FE	On-Demand	Anodyne	MTNR1B	15	56
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875224232	FE	On-Demand	Anodyne	SLC6A4	24	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875224232	FE	On-Demand	Anodyne	SLC6A3	42	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875224232	FE	On-Demand	Anodyne	MTNR1A	15	56
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875224232	FE	On-Demand	Anodyne	MTNR1B	15	56
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875224233	FE	On-Demand	Anodyne	SLC6A4	24	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875224233	FE	On-Demand	Anodyne	SLC6A3	42	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875224233	FE	On-Demand	Anodyne	MTNR1A	15	56
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875224233	FE	On-Demand	Anodyne	MTNR1B	15	56
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875224299	GJ	On-Demand	Anodyne	MAPK11	35	43
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875224299	GJ	On-Demand	Anodyne	MAPK14	53	44
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875224299	GJ	On-Demand	Anodyne	MAPK13	69	39
CC(C)(C)NC(=O)CCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875224306	EE	On-Demand	Anodyne	ACE	41	38
CC(C)(C)NC(=O)CCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875224306	EE	On-Demand	Anodyne	FKBP1A	32	41
CC(C)(C)NC(=O)CCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875224306	EE	On-Demand	Anodyne	TRY1_BOVIN	42	33
CC(C)(C)NC(=O)CCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875224306	EE	On-Demand	Anodyne	WNT3	40	32
CC(C)(C)NC(=O)CCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875224307	EE	On-Demand	Anodyne	ACE	41	38
CC(C)(C)NC(=O)CCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875224307	EE	On-Demand	Anodyne	FKBP1A	32	41
CC(C)(C)NC(=O)CCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875224307	EE	On-Demand	Anodyne	TRY1_BOVIN	42	33
CC(C)(C)NC(=O)CCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875224307	EE	On-Demand	Anodyne	WNT3	40	32
CC(C)(C)NC(=O)CCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875224308	EE	On-Demand	Anodyne	ACE	41	38
CC(C)(C)NC(=O)CCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875224308	EE	On-Demand	Anodyne	FKBP1A	32	41
CC(C)(C)NC(=O)CCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875224308	EE	On-Demand	Anodyne	TRY1_BOVIN	42	33
CC(C)(C)NC(=O)CCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875224308	EE	On-Demand	Anodyne	WNT3	40	32
CC(C)(C)NC(=O)CCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875224309	EE	On-Demand	Anodyne	ACE	41	38
CC(C)(C)NC(=O)CCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875224309	EE	On-Demand	Anodyne	FKBP1A	32	41
CC(C)(C)NC(=O)CCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875224309	EE	On-Demand	Anodyne	TRY1_BOVIN	42	33
CC(C)(C)NC(=O)CCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875224309	EE	On-Demand	Anodyne	WNT3	40	32
CC(C)(C)NC(=O)CCNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875224321	FF	On-Demand	Mild	CTSF	46	32
CC(C)(C)NC(=O)CCNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875224322	FF	On-Demand	Mild	CTSF	46	32
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCCN(c3ccccc3)C2)CC1	ZINC000875224351	FD	On-Demand	Anodyne	SFRP1	41	31
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCCN(c3ccccc3)C2)CC1	ZINC000875224352	FD	On-Demand	Anodyne	SFRP1	41	31
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)c1scnc1C(F)F	ZINC000875224353	GI	On-Demand	Anodyne	MAPK11	36	41
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)c1scnc1C(F)F	ZINC000875224353	GI	On-Demand	Anodyne	MAPK14	51	41
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)c1scnc1C(F)F	ZINC000875224353	GI	On-Demand	Anodyne	MAPK13	73	35
C[C@@H](NC(=O)NCCC[C@H]1CCOC1=O)C(C)(C)c1ccccc1	ZINC000875224356	EF	On-Demand	Anodyne	AMY2	45	30
C[C@H](NC(=O)NCCC[C@H]1CCOC1=O)C(C)(C)c1ccccc1	ZINC000875224357	EF	On-Demand	Anodyne	AMY2	45	30
C[C@@H](NC(=O)NCCC[C@@H]1CCOC1=O)C(C)(C)c1ccccc1	ZINC000875224358	EF	On-Demand	Anodyne	AMY2	45	30
C[C@H](NC(=O)NCCC[C@@H]1CCOC1=O)C(C)(C)c1ccccc1	ZINC000875224359	EF	On-Demand	Anodyne	AMY2	45	30
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NC[C@@H]3CSCCS3)C2)cc1	ZINC000875224464	GD	On-Demand	Anodyne	DRD4	26	47
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NC[C@@H]3CSCCS3)C2)cc1	ZINC000875224464	GD	On-Demand	Anodyne	MCHR1	22	43
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NC[C@@H]3CSCCS3)C2)cc1	ZINC000875224465	GD	On-Demand	Anodyne	DRD4	26	47
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NC[C@@H]3CSCCS3)C2)cc1	ZINC000875224465	GD	On-Demand	Anodyne	MCHR1	22	43
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NC[C@H]3CSCCS3)C2)cc1	ZINC000875224466	GD	On-Demand	Anodyne	DRD4	26	47
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NC[C@H]3CSCCS3)C2)cc1	ZINC000875224466	GD	On-Demand	Anodyne	MCHR1	22	43
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NC[C@H]3CSCCS3)C2)cc1	ZINC000875224467	GD	On-Demand	Anodyne	DRD4	26	47
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NC[C@H]3CSCCS3)C2)cc1	ZINC000875224467	GD	On-Demand	Anodyne	MCHR1	22	43
COc1ccc(N2CCN(C(=O)C(=O)NCc3cccnn3)CC2)c(OC)c1	ZINC000875224471	GC	On-Demand	Clean	HTR1A	41	39
COc1ccc(N2CCN(C(=O)C(=O)NCc3cccnn3)CC2)c(OC)c1	ZINC000875224471	GC	On-Demand	Clean	DRD2	34	40
COc1ccc(N2CCN(C(=O)C(=O)NCc3cccnn3)CC2)c(OC)c1	ZINC000875224471	GC	On-Demand	Clean	DRD4	42	33
COc1ccc(N2CCN(C(=O)C(=O)NCc3cccnn3)CC2)c(OC)c1	ZINC000875224471	GC	On-Demand	Clean	ADRA1D	29	40
COc1ccc(N2CCN(C(=O)C(=O)NCc3cccnn3)CC2)c(OC)c1	ZINC000875224471	GC	On-Demand	Clean	ADRA1A	26	40
COc1ccc(N2CCN(C(=O)C(=O)NCc3cccnn3)CC2)c(OC)c1	ZINC000875224471	GC	On-Demand	Clean	DRD3	54	37
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)C(C)(C)c2ccccc2)C1	ZINC000875224493	DG	On-Demand	Anodyne	AMY2	49	35
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)C(C)(C)c2ccccc2)C1	ZINC000875224494	DG	On-Demand	Anodyne	AMY2	49	35
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)C(C)(C)c2ccccc2)C1	ZINC000875224495	DG	On-Demand	Anodyne	AMY2	49	35
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)C(C)(C)c2ccccc2)C1	ZINC000875224496	DG	On-Demand	Anodyne	AMY2	49	35
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)[C@@]12CCCC[C@H]1C2	ZINC000875224508	EI	On-Demand	Anodyne	MAPK14	44	46
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)[C@]12CCCC[C@@H]1C2	ZINC000875224509	EI	On-Demand	Anodyne	MAPK14	44	46
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)[C@@]12CCCC[C@@H]1C2	ZINC000875224510	EI	On-Demand	Anodyne	MAPK14	44	46
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)[C@]12CCCC[C@H]1C2	ZINC000875224511	EI	On-Demand	Anodyne	MAPK14	44	46
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)[C@]1(C)CCC(=O)N1	ZINC000875224560	EE	On-Demand	Anodyne	MAPK14	43	42
COC(=O)N(C)NC(=O)N[C@H](C)C(C)(C)c1ccccc1	ZINC000875224573	CE	On-Demand	Reactive	AMY2	55	32
COC(=O)N(C)NC(=O)N[C@@H](C)C(C)(C)c1ccccc1	ZINC000875224575	CE	On-Demand	Reactive	AMY2	55	32
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)C(C)(C)c1ccccc1	ZINC000875224587	DG	On-Demand	Anodyne	CHRM3	42	38
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)C(C)(C)c1ccccc1	ZINC000875224587	DG	On-Demand	Anodyne	AMY2	49	34
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)C(C)(C)c1ccccc1	ZINC000875224587	DG	On-Demand	Anodyne	CYP2J2	47	35
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)C(C)(C)c1ccccc1	ZINC000875224587	DG	On-Demand	Anodyne	LYPLA2	23	41
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)C(C)(C)c1ccccc1	ZINC000875224591	DG	On-Demand	Anodyne	CHRM3	42	38
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)C(C)(C)c1ccccc1	ZINC000875224591	DG	On-Demand	Anodyne	AMY2	49	34
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)C(C)(C)c1ccccc1	ZINC000875224591	DG	On-Demand	Anodyne	CYP2J2	47	35
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)C(C)(C)c1ccccc1	ZINC000875224591	DG	On-Demand	Anodyne	LYPLA2	23	41
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NCc3cccnn3)C2)c1	ZINC000875224661	GC	On-Demand	Anodyne	PDE8B	58	32
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NCc3cccnn3)C2)c1	ZINC000875224662	GC	On-Demand	Anodyne	PDE8B	58	32
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCCc1c(C)noc1C	ZINC000875224772	FF	On-Demand	Anodyne	CAPN2	46	39
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCCc1c(C)noc1C	ZINC000875224772	FF	On-Demand	Anodyne	AMP1_PLAFQ	26	41
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCCc1c(C)noc1C	ZINC000875224773	FF	On-Demand	Anodyne	CAPN2	46	39
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCCc1c(C)noc1C	ZINC000875224773	FF	On-Demand	Anodyne	AMP1_PLAFQ	26	41
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCCc3c(C)noc3C)C2)cc1	ZINC000875224796	GE	On-Demand	Anodyne	DRD4	25	43
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCCc3c(C)noc3C)C2)cc1	ZINC000875224796	GE	On-Demand	Anodyne	MCHR1	26	41
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCCc3c(C)noc3C)C2)cc1	ZINC000875224797	GE	On-Demand	Anodyne	DRD4	25	43
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCCc3c(C)noc3C)C2)cc1	ZINC000875224797	GE	On-Demand	Anodyne	MCHR1	26	41
Cc1noc(C)c1CCCNC(=O)C(=O)NCc1ccc2cccnc2c1	ZINC000875224830	FE	On-Demand	Anodyne	SUCNR1	45	36
CN(C)[C@@H]1CCC[C@@H](NC(=O)C(=O)N[C@@H](c2ccccn2)C2CCC2)C1	ZINC000875224845	FE	On-Demand	Anodyne	TTK	28	40
CN(C)[C@@H]1CCC[C@H](NC(=O)C(=O)N[C@H](c2ccccn2)C2CCC2)C1	ZINC000875224846	FE	On-Demand	Anodyne	TTK	28	40
CN(C)[C@@H]1CCC[C@H](NC(=O)C(=O)N[C@@H](c2ccccn2)C2CCC2)C1	ZINC000875224847	FE	On-Demand	Anodyne	TTK	28	40
CN(C)[C@@H]1CCC[C@@H](NC(=O)C(=O)N[C@H](c2ccccn2)C2CCC2)C1	ZINC000875224848	FE	On-Demand	Anodyne	TTK	28	40
CCCCCCCNC(=O)C(=O)N[C@H](C)Cc1cc(C)[nH]n1	ZINC000875224859	DD	On-Demand	Mild	ASAH1	71	32
CCCCCCCNC(=O)C(=O)N[C@@H](C)Cc1cc(C)[nH]n1	ZINC000875224860	DD	On-Demand	Mild	ASAH1	71	32
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cccnn1	ZINC000875224861	GD	On-Demand	Anodyne	DRD2	20	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cccnn1	ZINC000875224861	GD	On-Demand	Anodyne	DRD4	42	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cccnn1	ZINC000875224861	GD	On-Demand	Anodyne	ACHE	62	61
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cccnn1	ZINC000875224861	GD	On-Demand	Anodyne	DRD3	15	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cccnn1	ZINC000875224861	GD	On-Demand	Anodyne	SIGMAR1	50	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cccnn1	ZINC000875224861	GD	On-Demand	Anodyne	BCHE	17	48
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cccnn1	ZINC000875224861	GD	On-Demand	Anodyne	SIRT3	45	33
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cccnn1	ZINC000875224861	GD	On-Demand	Anodyne	SIRT2	47	33
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1cccnn1	ZINC000875224861	GD	On-Demand	Anodyne	SIRT1	48	40
COC(=O)c1ccc(CC(=O)Nc2sccc2C(=O)NC2CC2)cn1	ZINC000875224874	FE	On-Demand	Anodyne	FAS	24	40
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)C(=O)NCc1cccnn1	ZINC000875224919	FF	On-Demand	Anodyne	MDM2	44	31
Cc1noc(C)c1CCCNC(=O)C(=O)NCc1cccc(F)c1F	ZINC000875225008	FD	On-Demand	Anodyne	P2RX7	31	59
Cc1noc(C)c1CCCNC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875225013	GD	On-Demand	Anodyne	ADAMTS4	28	41
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1ccc[nH]1	ZINC000875225087	EG	On-Demand	Anodyne	FAAH	31	41
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1ccc[nH]1	ZINC000875225087	EG	On-Demand	Anodyne	AMP1_PLAFQ	31	47
N#Cc1cccc([C@@H](NC(=O)NCCCN2CCOC2=O)C(F)(F)F)c1	ZINC000875225147	FE	On-Demand	Mild	CCR3	17	42
N#Cc1cccc([C@H](NC(=O)NCCCN2CCOC2=O)C(F)(F)F)c1	ZINC000875225148	FE	On-Demand	Mild	CCR3	17	42
O=C(NCCCCCCc1ccccc1)C(=O)NCc1cccnn1	ZINC000875225175	EE	On-Demand	Anodyne	SCNN1A	44	40
O=C(NCCCCCCc1ccccc1)C(=O)NCc1cccnn1	ZINC000875225175	EE	On-Demand	Anodyne	S1PR3	17	42
O=C(NCCCCCCc1ccccc1)C(=O)NCc1cccnn1	ZINC000875225175	EE	On-Demand	Anodyne	FAAH	67	42
O=C(NCCCCCCc1ccccc1)C(=O)NCc1cccnn1	ZINC000875225175	EE	On-Demand	Anodyne	S1PR2	18	42
O=C(NCCCCCCc1ccccc1)C(=O)NCc1cccnn1	ZINC000875225175	EE	On-Demand	Anodyne	CES1	70	42
O=C(NCCCCCCc1ccccc1)C(=O)NCc1cccnn1	ZINC000875225175	EE	On-Demand	Anodyne	AMP1_PLAFQ	25	45
COCC(C)(C)CCNC(=O)C(=O)NCCc1ccc(C)c(OC)c1	ZINC000875225183	FD	On-Demand	Anodyne	TRPV1	19	44
COCC(C)(C)CCNC(=O)C(=O)NCCc1ccc(C)c(OC)c1	ZINC000875225183	FD	On-Demand	Anodyne	MTNR1A	20	40
COCC(C)(C)CCNC(=O)C(=O)NCCc1ccc(C)c(OC)c1	ZINC000875225183	FD	On-Demand	Anodyne	MTNR1B	16	40
O=C(NC1CC1)c1ccsc1NC(=O)[C@@H]1C[C@H]1c1ccsc1	ZINC000875225197	EG	On-Demand	Anodyne	NPBWR1	83	35
O=C(Nc1sccc1C(=O)NC1CC1)c1ccc(C(=O)N2CCOCC2)cc1	ZINC000875225199	GE	On-Demand	Anodyne	L3MBTL3	44	33
CCCCCCCNC(=O)C(=O)NCc1cncc(C)c1	ZINC000875225337	CE	On-Demand	Mild	ASAH1	81	34
Cc1noc(C)c1CCCNC(=O)C(=O)NCc1ccc(OC(F)F)cc1F	ZINC000875225408	GE	On-Demand	Anodyne	P2RX7	18	53
C[C@H](NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)c1ccc[nH]1	ZINC000875225565	EE	On-Demand	Anodyne	OXTR	49	35
C[C@H](NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)c1ccc[nH]1	ZINC000875225569	EE	On-Demand	Anodyne	OXTR	49	35
O=C(CCS(=O)(=O)c1ccc(F)cc1)Nc1cc(Cl)ccc1F	ZINC000875225597	FG	On-Demand	Anodyne	CA2	19	45
O=C(CCS(=O)(=O)c1ccc(F)cc1)Nc1cc(Cl)ccc1F	ZINC000875225597	FG	On-Demand	Anodyne	CA1	20	45
Cc1ccccc1CC(C)(C)NC(=O)NCc1nc(O)c2c(n1)CCOC2	ZINC000875225602	FE	On-Demand	Anodyne	WNT3A	50	35
Cc1noc(C)c1CCCNC(=O)C(=O)N1CCC(CCF)CC1	ZINC000875225741	ED	On-Demand	Anodyne	ADAMTS4	30	42
Cc1ccccc1CN1CCO[C@@H](CNC(=O)C(=O)NCc2cccnn2)C1	ZINC000875225814	GC	On-Demand	Anodyne	PDE8B	58	33
Cc1cncc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000875225825	GE	On-Demand	Anodyne	DRD2	26	42
Cc1cncc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000875225825	GE	On-Demand	Anodyne	DRD4	52	45
Cc1cncc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000875225825	GE	On-Demand	Anodyne	ACHE	67	59
Cc1cncc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000875225825	GE	On-Demand	Anodyne	HRH1	15	41
Cc1cncc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000875225825	GE	On-Demand	Anodyne	DRD3	22	45
Cc1cncc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000875225825	GE	On-Demand	Anodyne	HTR4	29	42
Cc1cncc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000875225825	GE	On-Demand	Anodyne	CHRM3	20	40
Cc1cncc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000875225825	GE	On-Demand	Anodyne	SIGMAR1	52	49
Cc1cncc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000875225825	GE	On-Demand	Anodyne	SSTR5	48	44
Cc1cncc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000875225825	GE	On-Demand	Anodyne	BCHE	19	49
Cc1cncc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000875225825	GE	On-Demand	Anodyne	CXCR3	23	40
Cc1cncc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000875225825	GE	On-Demand	Anodyne	MCHR1	33	41
Cc1cncc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000875225825	GE	On-Demand	Anodyne	CACNA1I	47	40
Cc1cncc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000875225825	GE	On-Demand	Anodyne	SIRT3	40	31
Cc1cncc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000875225825	GE	On-Demand	Anodyne	SIRT2	45	31
Cc1cncc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000875225825	GE	On-Demand	Anodyne	SIRT1	41	35
Cc1cncc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000875225825	GE	On-Demand	Anodyne	NAMPT	25	42
CCC1(N(C)C)CCN(C(=O)C(=O)NCCCc2c(C)noc2C)CC1	ZINC000875225840	FD	On-Demand	Anodyne	ADAMTS4	24	40
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N[C@@H](C)c3ccc[nH]3)C2)cc1	ZINC000875225861	FD	On-Demand	Anodyne	DRD4	31	48
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N[C@@H](C)c3ccc[nH]3)C2)cc1	ZINC000875225861	FD	On-Demand	Anodyne	CHRM3	15	42
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N[C@@H](C)c3ccc[nH]3)C2)cc1	ZINC000875225861	FD	On-Demand	Anodyne	SIGMAR1	21	40
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N[C@@H](C)c3ccc[nH]3)C2)cc1	ZINC000875225861	FD	On-Demand	Anodyne	CCR3	24	40
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N[C@@H](C)c3ccc[nH]3)C2)cc1	ZINC000875225861	FD	On-Demand	Anodyne	MLNR	41	35
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N[C@@H](C)c3ccc[nH]3)C2)cc1	ZINC000875225861	FD	On-Demand	Anodyne	CCR2	15	45
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N[C@@H](C)c3ccc[nH]3)C2)cc1	ZINC000875225861	FD	On-Demand	Anodyne	MCHR1	31	43
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N[C@@H](C)c3ccc[nH]3)C2)cc1	ZINC000875225861	FD	On-Demand	Anodyne	BIRC2	45	42
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N[C@H](C)c3ccc[nH]3)C2)cc1	ZINC000875225862	FD	On-Demand	Anodyne	DRD4	31	48
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N[C@H](C)c3ccc[nH]3)C2)cc1	ZINC000875225862	FD	On-Demand	Anodyne	CHRM3	15	42
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N[C@H](C)c3ccc[nH]3)C2)cc1	ZINC000875225862	FD	On-Demand	Anodyne	SIGMAR1	21	40
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N[C@H](C)c3ccc[nH]3)C2)cc1	ZINC000875225862	FD	On-Demand	Anodyne	CCR3	24	40
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N[C@H](C)c3ccc[nH]3)C2)cc1	ZINC000875225862	FD	On-Demand	Anodyne	MLNR	41	35
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N[C@H](C)c3ccc[nH]3)C2)cc1	ZINC000875225862	FD	On-Demand	Anodyne	CCR2	15	45
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N[C@H](C)c3ccc[nH]3)C2)cc1	ZINC000875225862	FD	On-Demand	Anodyne	MCHR1	31	43
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N[C@H](C)c3ccc[nH]3)C2)cc1	ZINC000875225862	FD	On-Demand	Anodyne	BIRC2	45	42
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N[C@@H](C)c3ccc[nH]3)C2)cc1	ZINC000875225863	FD	On-Demand	Anodyne	DRD4	31	48
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N[C@@H](C)c3ccc[nH]3)C2)cc1	ZINC000875225863	FD	On-Demand	Anodyne	CHRM3	15	42
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N[C@@H](C)c3ccc[nH]3)C2)cc1	ZINC000875225863	FD	On-Demand	Anodyne	SIGMAR1	21	40
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N[C@@H](C)c3ccc[nH]3)C2)cc1	ZINC000875225863	FD	On-Demand	Anodyne	CCR3	24	40
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N[C@@H](C)c3ccc[nH]3)C2)cc1	ZINC000875225863	FD	On-Demand	Anodyne	MLNR	41	35
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N[C@@H](C)c3ccc[nH]3)C2)cc1	ZINC000875225863	FD	On-Demand	Anodyne	CCR2	15	45
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N[C@@H](C)c3ccc[nH]3)C2)cc1	ZINC000875225863	FD	On-Demand	Anodyne	MCHR1	31	43
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N[C@@H](C)c3ccc[nH]3)C2)cc1	ZINC000875225863	FD	On-Demand	Anodyne	BIRC2	45	42
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N[C@H](C)c3ccc[nH]3)C2)cc1	ZINC000875225864	FD	On-Demand	Anodyne	DRD4	31	48
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N[C@H](C)c3ccc[nH]3)C2)cc1	ZINC000875225864	FD	On-Demand	Anodyne	CHRM3	15	42
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N[C@H](C)c3ccc[nH]3)C2)cc1	ZINC000875225864	FD	On-Demand	Anodyne	SIGMAR1	21	40
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N[C@H](C)c3ccc[nH]3)C2)cc1	ZINC000875225864	FD	On-Demand	Anodyne	CCR3	24	40
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N[C@H](C)c3ccc[nH]3)C2)cc1	ZINC000875225864	FD	On-Demand	Anodyne	MLNR	41	35
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N[C@H](C)c3ccc[nH]3)C2)cc1	ZINC000875225864	FD	On-Demand	Anodyne	CCR2	15	45
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N[C@H](C)c3ccc[nH]3)C2)cc1	ZINC000875225864	FD	On-Demand	Anodyne	MCHR1	31	43
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N[C@H](C)c3ccc[nH]3)C2)cc1	ZINC000875225864	FD	On-Demand	Anodyne	BIRC2	45	42
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1cccnn1)CC2	ZINC000875225924	FD	On-Demand	Anodyne	HCRTR1	15	49
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1cccnn1)CC2	ZINC000875225926	FD	On-Demand	Anodyne	HCRTR1	15	49
C[C@H](NC(=O)C(=O)N1CCc2cc(C(F)(F)F)ccc2C1)c1ccc[nH]1	ZINC000875225955	FF	On-Demand	Anodyne	CCR2	15	43
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225958	GJ	On-Demand	Anodyne	ELANE	36	41
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225958	GJ	On-Demand	Anodyne	MME	34	41
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225958	GJ	On-Demand	Anodyne	NPR1	42	34
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225958	GJ	On-Demand	Anodyne	PTGER1	60	41
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225958	GJ	On-Demand	Anodyne	CASP3	24	57
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225958	GJ	On-Demand	Anodyne	BMP1	31	58
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225958	GJ	On-Demand	Anodyne	KLK3	85	38
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225958	GJ	On-Demand	Anodyne	CTSB	90	51
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225958	GJ	On-Demand	Anodyne	PAPA1_CARPA	87	45
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225958	GJ	On-Demand	Anodyne	CYSP_TRYCR	54	42
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225958	GJ	On-Demand	Anodyne	CTSK	44	55
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225958	GJ	On-Demand	Anodyne	CTSL	66	51
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225958	GJ	On-Demand	Anodyne	PGA	23	43
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225958	GJ	On-Demand	Anodyne	CAPNS1	70	42
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225958	GJ	On-Demand	Anodyne	HLA-DRB1	42	33
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225958	GJ	On-Demand	Anodyne	MMP11	60	34
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225958	GJ	On-Demand	Anodyne	CTSS	27	55
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225958	GJ	On-Demand	Anodyne	CAPN1	102	55
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225958	GJ	On-Demand	Anodyne	CASP1	26	49
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225958	GJ	On-Demand	Anodyne	CTRC	16	42
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225958	GJ	On-Demand	Anodyne	CAPN2	154	48
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225958	GJ	On-Demand	Anodyne	ACE2	48	36
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225958	GJ	On-Demand	Anodyne	CASP6	23	49
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225958	GJ	On-Demand	Anodyne	CASP9	51	49
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225958	GJ	On-Demand	Anodyne	NPR	79	45
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225958	GJ	On-Demand	Anodyne	CASP10	25	41
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225958	GJ	On-Demand	Anodyne	PSMB5	53	45
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225958	GJ	On-Demand	Anodyne	F2RL1	44	32
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225958	GJ	On-Demand	Anodyne	PDS	81	38
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225962	GJ	On-Demand	Anodyne	ELANE	36	41
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225962	GJ	On-Demand	Anodyne	MME	34	41
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225962	GJ	On-Demand	Anodyne	NPR1	42	34
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225962	GJ	On-Demand	Anodyne	PTGER1	60	41
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225962	GJ	On-Demand	Anodyne	CASP3	24	57
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225962	GJ	On-Demand	Anodyne	BMP1	31	58
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225962	GJ	On-Demand	Anodyne	KLK3	85	38
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225962	GJ	On-Demand	Anodyne	CTSB	90	51
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225962	GJ	On-Demand	Anodyne	PAPA1_CARPA	87	45
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225962	GJ	On-Demand	Anodyne	CYSP_TRYCR	54	42
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225962	GJ	On-Demand	Anodyne	CTSK	44	55
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225962	GJ	On-Demand	Anodyne	CTSL	66	51
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225962	GJ	On-Demand	Anodyne	PGA	23	43
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225962	GJ	On-Demand	Anodyne	CAPNS1	70	42
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225962	GJ	On-Demand	Anodyne	HLA-DRB1	42	33
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225962	GJ	On-Demand	Anodyne	MMP11	60	34
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225962	GJ	On-Demand	Anodyne	CTSS	27	55
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225962	GJ	On-Demand	Anodyne	CAPN1	102	55
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225962	GJ	On-Demand	Anodyne	CASP1	26	49
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225962	GJ	On-Demand	Anodyne	CTRC	16	42
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225962	GJ	On-Demand	Anodyne	CAPN2	154	48
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225962	GJ	On-Demand	Anodyne	ACE2	48	36
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225962	GJ	On-Demand	Anodyne	CASP6	23	49
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225962	GJ	On-Demand	Anodyne	CASP9	51	49
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225962	GJ	On-Demand	Anodyne	NPR	79	45
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225962	GJ	On-Demand	Anodyne	CASP10	25	41
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225962	GJ	On-Demand	Anodyne	PSMB5	53	45
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225962	GJ	On-Demand	Anodyne	F2RL1	44	32
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875225962	GJ	On-Demand	Anodyne	PDS	81	38
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)C(=O)NCc1cccc(F)c1F	ZINC000875225975	GE	On-Demand	Anodyne	PAPA1_CARPA	32	43
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)C(=O)NCc1cccc(F)c1F	ZINC000875225976	GE	On-Demand	Anodyne	PAPA1_CARPA	32	43
CCOC1CC2(C1)C[C@@H]2NC(=O)NC(C)(C)Cc1ccccc1C	ZINC000875226057	EH	On-Demand	Anodyne	TIMP3	64	34
CCOC1CC2(C1)C[C@H]2NC(=O)NC(C)(C)Cc1ccccc1C	ZINC000875226058	EH	On-Demand	Anodyne	TIMP3	64	34
Cc1cncc(CNC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875226117	FE	On-Demand	Anodyne	C3AR1	39	41
Cc1cncc(CNC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875226117	FE	On-Demand	Anodyne	NAMPT	43	38
Cc1cncc(CNC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875226119	FE	On-Demand	Anodyne	C3AR1	39	41
Cc1cncc(CNC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)c1	ZINC000875226119	FE	On-Demand	Anodyne	NAMPT	43	38
Cc1cncc(CNC(=O)C(=O)N[C@H](C)c2ccc(C(F)(F)F)nc2)c1	ZINC000875226148	FE	On-Demand	Anodyne	TRPV1	49	33
Cc1cncc(CNC(=O)C(=O)N[C@@H](C)c2ccc(C(F)(F)F)nc2)c1	ZINC000875226149	FE	On-Demand	Anodyne	TRPV1	49	33
C[C@H](NC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1)c1ccc[nH]1	ZINC000875226159	FD	On-Demand	Anodyne	NPY2R	69	38
C[C@H](NC(=O)C(=O)N1CCc2ccc(C(F)(F)F)cc2C1)c1ccc[nH]1	ZINC000875226186	FF	On-Demand	Anodyne	CCR2	17	47
NC(=O)CCOC(=O)CCc1c(-c2ccccc2)[nH]c2ccc(F)cc12	ZINC000875226441	FG	On-Demand	Anodyne	TSPO	34	48
NC(=O)CCOC(=O)CCc1c(-c2ccccc2)[nH]c2ccc(F)cc12	ZINC000875226441	FG	On-Demand	Anodyne	MPO	32	43
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875226448	EE	On-Demand	Anodyne	DRD4	40	32
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875226448	EE	On-Demand	Anodyne	MTNR1A	26	62
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875226448	EE	On-Demand	Anodyne	MTNR1B	31	62
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875226449	EE	On-Demand	Anodyne	DRD4	40	32
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875226449	EE	On-Demand	Anodyne	MTNR1A	26	62
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875226449	EE	On-Demand	Anodyne	MTNR1B	31	62
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)C(=O)N[C@@H](CF)c1ccc(F)cc1	ZINC000875226522	GE	On-Demand	Anodyne	PAPA1_CARPA	32	41
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)C(=O)N[C@H](CF)c1ccc(F)cc1	ZINC000875226523	GE	On-Demand	Anodyne	PAPA1_CARPA	32	41
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)C(=O)N[C@H](CF)c1ccc(F)cc1	ZINC000875226524	GE	On-Demand	Anodyne	PAPA1_CARPA	32	41
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)C(=O)N[C@@H](CF)c1ccc(F)cc1	ZINC000875226525	GE	On-Demand	Anodyne	PAPA1_CARPA	32	41
CCCCCCCNC(=O)C(=O)N[C@H](C)c1ccc[nH]1	ZINC000875226533	CE	On-Demand	Mild	GRIA1	40	34
CCCCCCCNC(=O)C(=O)N[C@H](C)c1ccc[nH]1	ZINC000875226533	CE	On-Demand	Mild	ASAH1	95	37
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1ccc[nH]1	ZINC000875226534	CE	On-Demand	Mild	GRIA1	40	34
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1ccc[nH]1	ZINC000875226534	CE	On-Demand	Mild	ASAH1	95	37
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(c4cccc(OC)c4)C3)C[C@@H]1C2	ZINC000875226699	FD	On-Demand	Anodyne	MTNR1A	17	58
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(c4cccc(OC)c4)C3)C[C@@H]1C2	ZINC000875226699	FD	On-Demand	Anodyne	MTNR1B	17	58
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(c4cccc(OC)c4)C3)C[C@@H]1C2	ZINC000875226700	FD	On-Demand	Anodyne	MTNR1A	17	58
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(c4cccc(OC)c4)C3)C[C@@H]1C2	ZINC000875226700	FD	On-Demand	Anodyne	MTNR1B	17	58
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3CCC[C@H](N(C)C)C3)CC2)CC1	ZINC000875226730	GC	On-Demand	Anodyne	L3MBTL3	34	41
CN1CCN(C2CCN(C(=O)C(=O)N[C@H]3CCC[C@@H](N(C)C)C3)CC2)CC1	ZINC000875226732	GC	On-Demand	Anodyne	L3MBTL3	34	41
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3CCC[C@@H](N(C)C)C3)CC2)CC1	ZINC000875226733	GC	On-Demand	Anodyne	L3MBTL3	34	41
CN1CCN(C2CCN(C(=O)C(=O)N[C@H]3CCC[C@H](N(C)C)C3)CC2)CC1	ZINC000875226734	GC	On-Demand	Anodyne	L3MBTL3	34	41
COC(=O)N(C)NC(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875226771	DD	On-Demand	Reactive	DRD4	41	32
COC(=O)N(C)NC(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875226771	DD	On-Demand	Reactive	MTNR1A	34	63
COC(=O)N(C)NC(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875226771	DD	On-Demand	Reactive	MTNR1B	33	63
COC(=O)N(C)NC(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000875226771	DD	On-Demand	Reactive	MCHR1	15	42
COC(=O)N(C)NC(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875226772	DD	On-Demand	Reactive	DRD4	41	32
COC(=O)N(C)NC(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875226772	DD	On-Demand	Reactive	MTNR1A	34	63
COC(=O)N(C)NC(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875226772	DD	On-Demand	Reactive	MTNR1B	33	63
COC(=O)N(C)NC(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000875226772	DD	On-Demand	Reactive	MCHR1	15	42
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1ccc[nH]1	ZINC000875226787	GF	On-Demand	Anodyne	DRD2	19	43
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1ccc[nH]1	ZINC000875226787	GF	On-Demand	Anodyne	DRD4	41	41
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1ccc[nH]1	ZINC000875226787	GF	On-Demand	Anodyne	ACHE	60	56
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1ccc[nH]1	ZINC000875226787	GF	On-Demand	Anodyne	SLC6A3	16	47
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1ccc[nH]1	ZINC000875226787	GF	On-Demand	Anodyne	HTR4	27	42
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1ccc[nH]1	ZINC000875226787	GF	On-Demand	Anodyne	SIGMAR1	46	44
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1ccc[nH]1	ZINC000875226787	GF	On-Demand	Anodyne	MCHR1	21	43
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1ccc[nH]1	ZINC000875226787	GF	On-Demand	Anodyne	CACNA1G	30	41
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1ccc[nH]1	ZINC000875226787	GF	On-Demand	Anodyne	CACNA1I	50	36
Cc1noc(C)c1CCCNC(=O)C(=O)NCc1cccc2ncccc12	ZINC000875226794	FE	On-Demand	Anodyne	P2RX7	20	51
Cc1noc(C)c1CCCNC(=O)C(=O)NCc1cccc2ncccc12	ZINC000875226794	FE	On-Demand	Anodyne	MTNR1A	26	43
Cc1noc(C)c1CCCNC(=O)C(=O)NCc1cccc2ncccc12	ZINC000875226794	FE	On-Demand	Anodyne	MTNR1B	26	43
COc1ccc(N2CCN(C(=O)C(=O)NCc3cncc(C)c3)CC2)c(OC)c1	ZINC000875226848	GD	On-Demand	Clean	DRD3	41	39
Cc1noc(C)c1CCCNC(=O)C(=O)NCc1ccccc1CC(F)(F)F	ZINC000875226866	GF	On-Demand	Anodyne	P2RX7	15	51
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(c3cccc(OC)c3)C2)C1	ZINC000875226887	GE	On-Demand	Anodyne	DRD4	40	33
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(c3cccc(OC)c3)C2)C1	ZINC000875226887	GE	On-Demand	Anodyne	MTNR1A	26	63
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(c3cccc(OC)c3)C2)C1	ZINC000875226887	GE	On-Demand	Anodyne	MTNR1B	34	63
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(c3cccc(OC)c3)C2)C1	ZINC000875226890	GE	On-Demand	Anodyne	DRD4	40	33
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(c3cccc(OC)c3)C2)C1	ZINC000875226890	GE	On-Demand	Anodyne	MTNR1A	26	63
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(c3cccc(OC)c3)C2)C1	ZINC000875226890	GE	On-Demand	Anodyne	MTNR1B	34	63
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@H](C)c1ccc[nH]1)CC2	ZINC000875226921	FE	On-Demand	Anodyne	SLC18A2	47	33
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H](C)c1ccc[nH]1)CC2	ZINC000875226922	FE	On-Demand	Anodyne	SLC18A2	47	33
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@@H](C)c1ccc[nH]1)CC2	ZINC000875226923	FE	On-Demand	Anodyne	SLC18A2	47	33
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H](C)c1ccc[nH]1)CC2	ZINC000875226924	FE	On-Demand	Anodyne	SLC18A2	47	33
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccc[nH]1	ZINC000875226964	EF	On-Demand	Anodyne	MME	52	39
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccc[nH]1	ZINC000875226964	EF	On-Demand	Anodyne	CAPN2	56	34
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccc[nH]1	ZINC000875226964	EF	On-Demand	Anodyne	ACE2	49	37
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccc[nH]1	ZINC000875226965	EF	On-Demand	Anodyne	MME	52	39
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccc[nH]1	ZINC000875226965	EF	On-Demand	Anodyne	CAPN2	56	34
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccc[nH]1	ZINC000875226965	EF	On-Demand	Anodyne	ACE2	49	37
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccc[nH]1	ZINC000875226966	EF	On-Demand	Anodyne	MME	52	39
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccc[nH]1	ZINC000875226966	EF	On-Demand	Anodyne	CAPN2	56	34
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccc[nH]1	ZINC000875226966	EF	On-Demand	Anodyne	ACE2	49	37
COc1ccccc1[C@H]1CCCN(C(=O)NCCCN2CCOC2=O)CC1	ZINC000875227159	GF	On-Demand	Anodyne	DRD2	27	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCN2CCOC2=O)CC1	ZINC000875227160	GF	On-Demand	Anodyne	DRD2	27	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccc(OC)c(F)c1	ZINC000875227227	FE	On-Demand	Anodyne	SLC6A4	18	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccc(OC)c(F)c1	ZINC000875227227	FE	On-Demand	Anodyne	SLC6A3	36	47
COC(=O)C1=NO[C@]2(CCN(C(=O)NC3CC(c4ccccc4)C3)C2)C1	ZINC000875227228	FE	On-Demand	Anodyne	EPHX2	29	44
COC(=O)C1=NO[C@@]2(CCN(C(=O)NC3CC(c4ccccc4)C3)C2)C1	ZINC000875227229	FE	On-Demand	Anodyne	EPHX2	29	44
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NC2CC(c3ccccc3)C2)C1	ZINC000875227271	GF	On-Demand	Anodyne	EPHX2	38	47
O=C(N[C@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NC2CC(c3ccccc3)C2)C1	ZINC000875227272	GF	On-Demand	Anodyne	EPHX2	38	47
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NC2CC(c3ccccc3)C2)C1	ZINC000875227273	GF	On-Demand	Anodyne	EPHX2	38	47
O=C(N[C@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NC2CC(c3ccccc3)C2)C1	ZINC000875227274	GF	On-Demand	Anodyne	EPHX2	38	47
O=C(NC1CC(c2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875227332	EG	On-Demand	Anodyne	SLC18A3	31	41
O=C(NCCCN1CCOC1=O)N1CC(c2ccccc2)C1	ZINC000875227382	DD	On-Demand	Anodyne	ADRA1D	15	41
O=C(NCCCN1CCOC1=O)N1CC(c2ccccc2)C1	ZINC000875227382	DD	On-Demand	Anodyne	ADRA1A	23	41
O=C(NCCCN1CCOC1=O)N1CC(c2ccccc2)C1	ZINC000875227382	DD	On-Demand	Anodyne	ADRA1B	20	41
C[C@@H](NC(=O)N1CCc2nc(C3CC3)ncc2C1)c1ccc2c(c1)CC(=O)N2C	ZINC000875227383	GF	On-Demand	Anodyne	MAPK1	53	43
CCCCCCCNC(=O)C(=O)NCCc1cn2cccc(C)c2n1	ZINC000875227435	EE	On-Demand	Mild	ASAH1	87	36
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CC(c2ccccc2)C1	ZINC000875227440	EF	On-Demand	Anodyne	SLC6A4	37	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CC(c2ccccc2)C1	ZINC000875227440	EF	On-Demand	Anodyne	SLC6A3	72	47
O=C(NC1CC(c2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875227460	EG	On-Demand	Anodyne	EPHX2	33	45
O=C(NC1CC(c2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875227460	EG	On-Demand	Anodyne	RBP4	61	38
O=C(NC1CC(c2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875227461	EG	On-Demand	Anodyne	EPHX2	33	45
O=C(NC1CC(c2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875227461	EG	On-Demand	Anodyne	RBP4	61	38
O=C1CCN(C(=O)NC2CC(c3ccccc3)C2)CCCCCCN1	ZINC000875227485	EG	On-Demand	Anodyne	EPHX2	23	50
CCCCCCCNC(=O)C(=O)NCCc1ccc2[nH]ccc2c1	ZINC000875227597	EF	On-Demand	Mild	INHA	61	33
CCCCCCCNC(=O)C(=O)NCCc1ccc2[nH]ccc2c1	ZINC000875227597	EF	On-Demand	Mild	ASAH1	79	36
COCC(C)(C)CCNC(=O)C(=O)NCCc1cccc2[nH]ccc12	ZINC000875227708	EE	On-Demand	Anodyne	HPGDS	17	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2cccc3[nH]ccc23)C1	ZINC000875227723	ED	On-Demand	Anodyne	SSTR2	45	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2cccc3[nH]ccc23)C1	ZINC000875227724	ED	On-Demand	Anodyne	SSTR2	45	35
CONC(=O)C1CCN(C(=O)N[C@@H]2COc3c(cccc3OC)C2)CC1	ZINC000875227727	FD	On-Demand	Anodyne	SSTR1	46	34
CONC(=O)C1CCN(C(=O)N[C@H]2COc3c(cccc3OC)C2)CC1	ZINC000875227728	FD	On-Demand	Anodyne	SSTR1	46	34
Cc1nnc(NNC(=O)N[C@H]2CCCC[C@@H]2Cc2ccccc2)n1C	ZINC000875227774	EF	On-Demand	Reactive	CCR3	51	41
Cc1nnc(NNC(=O)N[C@H]2CCCC[C@H]2Cc2ccccc2)n1C	ZINC000875227775	EF	On-Demand	Reactive	CCR3	51	41
Cc1nnc(NNC(=O)N[C@@H]2CCCC[C@@H]2Cc2ccccc2)n1C	ZINC000875227776	EF	On-Demand	Reactive	CCR3	51	41
Cc1nnc(NNC(=O)N[C@@H]2CCCC[C@H]2Cc2ccccc2)n1C	ZINC000875227777	EF	On-Demand	Reactive	CCR3	51	41
CN1CCN(C(=O)NC2CC(c3ccccc3)C2)CCC1(C)C	ZINC000875227782	DG	On-Demand	Anodyne	EPHX2	29	49
Cn1c2ccccc2c2cc(C(=O)Nc3cc(Cl)ccc3F)sc21	ZINC000875227809	FK	On-Demand	Anodyne	KCNMA1	25	45
COC(=O)N(C)NC(=O)N[C@H]1CCCC[C@@H]1Cc1ccccc1	ZINC000875227842	DF	On-Demand	Reactive	CCR3	32	45
COC(=O)N(C)NC(=O)N[C@H]1CCCC[C@H]1Cc1ccccc1	ZINC000875227843	DF	On-Demand	Reactive	CCR3	32	45
COC(=O)N(C)NC(=O)N[C@@H]1CCCC[C@@H]1Cc1ccccc1	ZINC000875227844	DF	On-Demand	Reactive	CCR3	32	45
COC(=O)N(C)NC(=O)N[C@@H]1CCCC[C@H]1Cc1ccccc1	ZINC000875227845	DF	On-Demand	Reactive	CCR3	32	45
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCCC[C@H]2Cc2ccccc2)CC1	ZINC000875227873	GE	On-Demand	Anodyne	EPHX2	30	40
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCCC[C@@H]2Cc2ccccc2)CC1	ZINC000875227874	GE	On-Demand	Anodyne	EPHX2	30	40
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCCC[C@H]2Cc2ccccc2)CC1	ZINC000875227875	GE	On-Demand	Anodyne	EPHX2	30	40
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCCC[C@@H]2Cc2ccccc2)CC1	ZINC000875227876	GE	On-Demand	Anodyne	EPHX2	30	40
O=C(NC1CC(c2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875227900	DD	On-Demand	Anodyne	EPHX2	33	48
CCOC(=O)[C@H](C)C1CN(C(=O)NC2CC(c3ccccc3)C2)C1	ZINC000875228047	EF	On-Demand	Anodyne	ACE	34	41
O=C(NCCO)C1CCN(C(=O)NC2CC(c3ccccc3)C2)CC1	ZINC000875228058	ED	On-Demand	Anodyne	EPHX2	48	42
CC[C@H](C[C@H](C)O)NC(=O)NCCc1ccc(OC)c(F)c1	ZINC000875228065	DE	On-Demand	Anodyne	MTNR1A	15	41
O=C(NCC[C@H](O)C1CCCC1)NC1CC(c2ccccc2)C1	ZINC000875228079	DG	On-Demand	Anodyne	EPHX2	18	49
O=C(NCC[C@@H](O)C1CCCC1)NC1CC(c2ccccc2)C1	ZINC000875228080	DG	On-Demand	Anodyne	EPHX2	18	49
COCCN(CC1CCN(C)CC1)C(=O)NCCc1ccc(OC)c(F)c1	ZINC000875228196	GE	On-Demand	Anodyne	ACKR3	70	36
O=C(NC1CC(c2ccccc2)C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875228223	EI	On-Demand	Anodyne	EPHX2	41	54
O=C(NC1CC(c2ccccc2)C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875228224	EI	On-Demand	Anodyne	EPHX2	41	54
O=C(NC1CC(c2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875228261	FE	On-Demand	Anodyne	RBP4	59	39
O=C(NC1CC(c2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875228309	DG	On-Demand	Clean	EPHX2	20	41
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccc(OCc2ccc(F)cc2)cc1	ZINC000875228357	GG	On-Demand	Anodyne	ACACA	22	41
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccc(OCc2ccc(F)cc2)cc1	ZINC000875228357	GG	On-Demand	Anodyne	ACACB	23	41
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccc(OCc2ccc(F)cc2)cc1	ZINC000875228357	GG	On-Demand	Anodyne	ACE2	21	43
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccc(OCc2ccc(F)cc2)cc1	ZINC000875228357	GG	On-Demand	Anodyne	Q9N6S8_PLAFA	18	43
Cc1ccc(C(C)(C)CNC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875228372	EE	On-Demand	Anodyne	GHRHR	42	30
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(OCc2ccc(F)cc2)cc1	ZINC000875228375	FH	On-Demand	Anodyne	ACE2	21	44
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(OCc2ccc(F)cc2)cc1	ZINC000875228375	FH	On-Demand	Anodyne	FFAR1	17	47
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(OCc2ccc(F)cc2)cc1	ZINC000875228376	FH	On-Demand	Anodyne	ACE2	21	44
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(OCc2ccc(F)cc2)cc1	ZINC000875228376	FH	On-Demand	Anodyne	FFAR1	17	47
CN1CCN(C2CCN(C(=O)C(=O)NCCc3ccc(Cl)nc3)CC2)CC1	ZINC000875228449	GC	On-Demand	Anodyne	L3MBTL3	44	38
CCC1(N(C)C)CCN(C(=O)C(=O)NCCc2ccc(Cl)nc2)CC1	ZINC000875228475	FD	On-Demand	Anodyne	NACHRBETA2	45	32
C=CCCC[C@H](C)NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875228482	FF	On-Demand	Mild	ETHR	54	45
C=CCCC[C@@H](C)NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875228483	FF	On-Demand	Mild	ETHR	54	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC(C)(C)c1ccc(C)cc1	ZINC000875228528	EG	On-Demand	Anodyne	SLC6A4	25	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC(C)(C)c1ccc(C)cc1	ZINC000875228528	EG	On-Demand	Anodyne	SLC6A3	49	41
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCc1ccncc1C)CC2	ZINC000875228566	GE	On-Demand	Anodyne	MTNR1B	15	41
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCc1ccncc1C)CC2	ZINC000875228567	GE	On-Demand	Anodyne	MTNR1B	15	41
O=C(NCCc1ccc(Cl)nc1)C(=O)N[C@@H]1CCCn2nccc21	ZINC000875228599	ED	On-Demand	Anodyne	GPBAR1	17	41
O=C(NCCc1ccc(Cl)nc1)C(=O)N[C@H]1CCCn2nccc21	ZINC000875228600	ED	On-Demand	Anodyne	GPBAR1	17	41
O=C(NCCc1ccc(Cl)nc1)C(=O)NC[C@H]1CCCN1CC(F)F	ZINC000875228614	FD	On-Demand	Anodyne	GPBAR1	19	42
O=C(NCCc1ccc(Cl)nc1)C(=O)NC[C@@H]1CCCN1CC(F)F	ZINC000875228615	FD	On-Demand	Anodyne	GPBAR1	19	42
CCCCCCCNC(=O)C(=O)NCCc1cccc2[nH]ccc12	ZINC000875228632	EF	On-Demand	Mild	MTNR1A	57	45
CCCCCCCNC(=O)C(=O)NCCc1cccc2[nH]ccc12	ZINC000875228632	EF	On-Demand	Mild	MMP8	15	42
CCCCCCCNC(=O)C(=O)NCCc1cccc2[nH]ccc12	ZINC000875228632	EF	On-Demand	Mild	GRIA1	47	33
CCCCCCCNC(=O)C(=O)NCCc1cccc2[nH]ccc12	ZINC000875228632	EF	On-Demand	Mild	ASAH1	83	36
CCCCCCCNC(=O)C(=O)NCCc1cccc2[nH]ccc12	ZINC000875228632	EF	On-Demand	Mild	HPGDS	24	41
C[C@H]1C[C@H](CO)CCN1C(=O)C(=O)NCCc1ccc(Cl)nc1	ZINC000875228655	ED	On-Demand	Anodyne	NACHRBETA2	40	34
Cc1ccc(C(C)(C)CNC(=O)N2CCC(C(=O)NCCO)CC2)cc1	ZINC000875228658	FD	On-Demand	Anodyne	EPHX2	29	41
O=C(NCCc1ccc(Cl)nc1)C(=O)NC[C@@H]1CCN1C1CCCC1	ZINC000875228663	FD	On-Demand	Anodyne	CXCR3	40	35
O=C(NCCc1ccc(Cl)nc1)C(=O)NC[C@@H]1CCN1C1CCCC1	ZINC000875228663	FD	On-Demand	Anodyne	GPBAR1	15	41
O=C(NCCc1ccc(Cl)nc1)C(=O)NC[C@H]1CCN1C1CCCC1	ZINC000875228664	FD	On-Demand	Anodyne	CXCR3	40	35
O=C(NCCc1ccc(Cl)nc1)C(=O)NC[C@H]1CCN1C1CCCC1	ZINC000875228664	FD	On-Demand	Anodyne	GPBAR1	15	41
O=C(NCCc1ccc(Cl)nc1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875228676	ED	On-Demand	Anodyne	NACHRBETA2	47	36
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCc1ccc(Cl)nc1	ZINC000875228705	FF	On-Demand	Anodyne	CTSB	23	41
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCc1ccc(Cl)nc1	ZINC000875228705	FF	On-Demand	Anodyne	CAPN1	36	43
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCc1ccc(Cl)nc1	ZINC000875228705	FF	On-Demand	Anodyne	CAPN2	80	43
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCc1ccc(Cl)nc1	ZINC000875228705	FF	On-Demand	Anodyne	AMP1_PLAFQ	29	41
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCc1ccc(Cl)nc1	ZINC000875228706	FF	On-Demand	Anodyne	CTSB	23	41
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCc1ccc(Cl)nc1	ZINC000875228706	FF	On-Demand	Anodyne	CAPN1	36	43
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCc1ccc(Cl)nc1	ZINC000875228706	FF	On-Demand	Anodyne	CAPN2	80	43
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCc1ccc(Cl)nc1	ZINC000875228706	FF	On-Demand	Anodyne	AMP1_PLAFQ	29	41
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H](c3ccccc3)c3cccnc3)C[C@@H]1C2	ZINC000875228731	FF	On-Demand	Anodyne	KCNA5	23	42
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H](c3ccccc3)c3cccnc3)C[C@@H]1C2	ZINC000875228732	FF	On-Demand	Anodyne	KCNA5	23	42
N#CCCN1CCN(C(=O)C(=O)NCCc2ccc(Cl)nc2)CC1	ZINC000875228738	EC	On-Demand	Mild	NACHRBETA2	47	35
O=C(NCCc1ccc(Cl)nc1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875228771	FD	On-Demand	Anodyne	NACHRBETA2	40	35
O=C(NCCc1ccc(Cl)nc1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875228772	FD	On-Demand	Anodyne	NACHRBETA2	40	35
O=C(NCCc1ccc(Cl)nc1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875228773	FD	On-Demand	Anodyne	NACHRBETA2	40	35
O=C(NCCc1ccc(Cl)nc1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875228774	FD	On-Demand	Anodyne	NACHRBETA2	40	35
CCCC[C@H](NC(=O)N(CCOC)C1CCOCC1)c1ccc(OC)cc1	ZINC000875228797	GH	On-Demand	Anodyne	UTS2	30	40
CCCC[C@@H](NC(=O)N(CCOC)C1CCOCC1)c1ccc(OC)cc1	ZINC000875228799	GH	On-Demand	Anodyne	UTS2	30	40
CCCC[C@H](NC(=O)N1C[C@H]2C(=O)N(C)C(=O)[C@H]2C1)c1ccc(OC)cc1	ZINC000875228830	FE	On-Demand	Anodyne	EDNRB	18	42
CCCC[C@H](NC(=O)N1C[C@H]2C(=O)N(C)C(=O)[C@H]2C1)c1ccc(OC)cc1	ZINC000875228830	FE	On-Demand	Anodyne	EDNRA	17	42
CCCC[C@@H](NC(=O)N1C[C@H]2C(=O)N(C)C(=O)[C@H]2C1)c1ccc(OC)cc1	ZINC000875228831	FE	On-Demand	Anodyne	EDNRB	18	42
CCCC[C@@H](NC(=O)N1C[C@H]2C(=O)N(C)C(=O)[C@H]2C1)c1ccc(OC)cc1	ZINC000875228831	FE	On-Demand	Anodyne	EDNRA	17	42
COC(=O)N(C)NC(=O)NCCc1c[nH]c2cccc(C)c12	ZINC000875228836	DD	On-Demand	Reactive	NQO2	18	41
COC(=O)N(C)NC(=O)NCCc1c[nH]c2cccc(C)c12	ZINC000875228836	DD	On-Demand	Reactive	MTNR1A	28	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nccn1C	ZINC000875228853	CC	On-Demand	Anodyne	SLC6A4	28	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nccn1C	ZINC000875228853	CC	On-Demand	Anodyne	SLC6A3	61	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nccn1C	ZINC000875228854	CC	On-Demand	Anodyne	SLC6A4	28	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nccn1C	ZINC000875228854	CC	On-Demand	Anodyne	SLC6A3	61	41
C[C@H](NC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1)c1cccc(-n2cccn2)c1	ZINC000875228864	FE	On-Demand	Anodyne	AMP1_PLAFQ	53	37
COC(=O)N(C)NC(=O)NCc1ccc(OC)c(OC2CCCC2)c1	ZINC000875228873	FE	On-Demand	Reactive	PDE4A	56	48
COC(=O)N(C)NC(=O)NCc1ccc(OC)c(OC2CCCC2)c1	ZINC000875228873	FE	On-Demand	Reactive	PDE4B	32	48
COC(=O)N(C)NC(=O)NCc1ccc(OC)c(OC2CCCC2)c1	ZINC000875228873	FE	On-Demand	Reactive	PDE4D	40	48
COC(=O)N(C)NC(=O)NCc1ccc(OC)c(OC2CCCC2)c1	ZINC000875228873	FE	On-Demand	Reactive	PDE4C	21	48
COC(=O)N(C)NC(=O)NCc1ccc(OC)c(OC2CCCC2)c1	ZINC000875228873	FE	On-Demand	Reactive	MT-ND1	23	40
CN(C)CCCOc1ccc(CNC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875228879	GD	On-Demand	Anodyne	LTA4H	29	41
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1ccn(C)c1)CC2	ZINC000875228894	FD	On-Demand	Anodyne	SLC18A2	45	33
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1ccn(C)c1)CC2	ZINC000875228894	FD	On-Demand	Anodyne	HCRTR1	15	44
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1ccn(C)c1)CC2	ZINC000875228895	FD	On-Demand	Anodyne	SLC18A2	45	33
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1ccn(C)c1)CC2	ZINC000875228895	FD	On-Demand	Anodyne	HCRTR1	15	44
C[C@H](NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21)c1cccc(-n2cccn2)c1	ZINC000875228904	GE	On-Demand	Anodyne	ADAM17	15	45
C[C@H](NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21)c1cccc(-n2cccn2)c1	ZINC000875228904	GE	On-Demand	Anodyne	AMP1_PLAFQ	52	37
N#Cc1ccc(N2CCN(C(=O)C(=O)NCCc3ccc(Cl)nc3)CC2)cc1	ZINC000875228961	GD	On-Demand	Mild	CTSK	24	42
N#Cc1ccc(N2CCN(C(=O)C(=O)NCCc3ccc(Cl)nc3)CC2)cc1	ZINC000875228961	GD	On-Demand	Mild	NACHRBETA2	47	34
COc1ccccc1[C@H]1CCCN(C(=O)NCc2nccn2C)CC1	ZINC000875228988	EF	On-Demand	Anodyne	HTR1A	30	42
COc1ccccc1[C@H]1CCCN(C(=O)NCc2nccn2C)CC1	ZINC000875228988	EF	On-Demand	Anodyne	DRD2	22	43
COc1ccccc1[C@H]1CCCN(C(=O)NCc2nccn2C)CC1	ZINC000875228988	EF	On-Demand	Anodyne	EPHX2	21	45
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2nccn2C)CC1	ZINC000875228989	EF	On-Demand	Anodyne	HTR1A	30	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2nccn2C)CC1	ZINC000875228989	EF	On-Demand	Anodyne	DRD2	22	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2nccn2C)CC1	ZINC000875228989	EF	On-Demand	Anodyne	EPHX2	21	45
O=C(NCCc1ccc(Cl)nc1)C(=O)N1CCCC2(CC1)CC2	ZINC000875229019	EE	On-Demand	Anodyne	NACHRBETA2	41	35
C[C@H](NC(=O)C(=O)NCC[C@H]1CCSC1)c1cccc(-n2cccn2)c1	ZINC000875229028	FE	On-Demand	Anodyne	AMP1_PLAFQ	41	35
C[C@H](NC(=O)C(=O)NCC[C@@H]1CCSC1)c1cccc(-n2cccn2)c1	ZINC000875229030	FE	On-Demand	Anodyne	AMP1_PLAFQ	41	35
C[C@H](NC(=O)C(=O)N1CC[C@H]2CSC[C@H]2C1)c1cccc(-n2cccn2)c1	ZINC000875229044	GE	On-Demand	Anodyne	AMP1_PLAFQ	46	36
C[C@H](NC(=O)C(=O)N1CC[C@@H]2CSC[C@@H]2C1)c1cccc(-n2cccn2)c1	ZINC000875229045	GE	On-Demand	Anodyne	AMP1_PLAFQ	46	36
C[C@H](NC(=O)C(=O)N1CC[C@@H]2CSC[C@H]2C1)c1cccc(-n2cccn2)c1	ZINC000875229046	GE	On-Demand	Anodyne	AMP1_PLAFQ	46	36
C[C@H](NC(=O)C(=O)N1CC[C@H]2CSC[C@@H]2C1)c1cccc(-n2cccn2)c1	ZINC000875229047	GE	On-Demand	Anodyne	AMP1_PLAFQ	46	36
C[C@H](NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)c1cccc(-n2cccn2)c1	ZINC000875229074	FD	On-Demand	Anodyne	AMP1_PLAFQ	52	37
C[C@H](NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)c1cccc(-n2cccn2)c1	ZINC000875229075	FD	On-Demand	Anodyne	AMP1_PLAFQ	52	37
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)N[C@H](C)c2cccc(-n3cccn3)c2)C1	ZINC000875229095	FE	On-Demand	Anodyne	AMP1_PLAFQ	50	36
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)N[C@@H](C)c2cccc(-n3cccn3)c2)C1	ZINC000875229097	FE	On-Demand	Anodyne	AMP1_PLAFQ	50	36
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC(C)(C)c1ccc(F)cc1	ZINC000875229152	EF	On-Demand	Anodyne	SLC6A4	23	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC(C)(C)c1ccc(F)cc1	ZINC000875229152	EF	On-Demand	Anodyne	SLC6A3	48	44
C=CCCC[C@@H](C)NC(=O)C(=O)N[C@@H]1CC[C@@H](NC(=O)OC(C)(C)C)CC1	ZINC000875229157	GF	On-Demand	Mild	CTSK	17	40
C=CCCC[C@H](C)NC(=O)C(=O)N[C@@H]1CC[C@@H](NC(=O)OC(C)(C)C)CC1	ZINC000875229158	GF	On-Demand	Mild	CTSK	17	40
O=C(NCCc1ccc(Cl)nc1)C(=O)N1CCC(CCF)CC1	ZINC000875229176	ED	On-Demand	Anodyne	NACHRBETA2	40	35
CCCCCCCNC(=O)C(=O)NCCc1ccncc1C	ZINC000875229183	DE	On-Demand	Mild	ASAH1	86	35
COc1ccc(O[C@@H](C)C(=O)OCC(=O)N2CCN(Cc3c(F)cccc3Cl)CC2)cc1	ZINC000875229190	JG	On-Demand	Anodyne	CACNA1G	15	43
COc1ccc(O[C@H](C)C(=O)OCC(=O)N2CCN(Cc3c(F)cccc3Cl)CC2)cc1	ZINC000875229191	JG	On-Demand	Anodyne	CACNA1G	15	43
CN(C)CCCOc1ccc(CNC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875229198	FD	On-Demand	Anodyne	HRH3	18	46
CCCCCCCNC(=O)C(=O)NCCc1ccc(Cl)nc1	ZINC000875229213	EE	On-Demand	Mild	S1PR4	24	41
CCCCCCCNC(=O)C(=O)NCCc1ccc(Cl)nc1	ZINC000875229213	EE	On-Demand	Mild	LPAR2	41	35
CCCCCCCNC(=O)C(=O)NCCc1ccc(Cl)nc1	ZINC000875229213	EE	On-Demand	Mild	S1PR3	35	41
CCCCCCCNC(=O)C(=O)NCCc1ccc(Cl)nc1	ZINC000875229213	EE	On-Demand	Mild	GRIA1	43	35
CCCCCCCNC(=O)C(=O)NCCc1ccc(Cl)nc1	ZINC000875229213	EE	On-Demand	Mild	S1PR2	69	42
CCCCCCCNC(=O)C(=O)NCCc1ccc(Cl)nc1	ZINC000875229213	EE	On-Demand	Mild	S1PR1	16	41
CCCCCCCNC(=O)C(=O)NCCc1ccc(Cl)nc1	ZINC000875229213	EE	On-Demand	Mild	ASAH1	85	39
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCCc2ccc(Cl)nc2)c1	ZINC000875229218	FE	On-Demand	Anodyne	SSTR5	27	40
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCCc2ccc(Cl)nc2)c1	ZINC000875229220	FE	On-Demand	Anodyne	SSTR5	27	40
O=C1CCN(C(=O)C(=O)NCCc2ccc(Cl)nc2)CCCCCCN1	ZINC000875229226	GD	On-Demand	Anodyne	NACHRBETA2	41	40
CN(C)CCCOc1ccc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875229247	GF	On-Demand	Anodyne	HRH3	30	44
CN(C)CCCOc1ccc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875229247	GF	On-Demand	Anodyne	AMY2	40	39
CN(C)CCCOc1ccc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875229250	GF	On-Demand	Anodyne	HRH3	30	44
CN(C)CCCOc1ccc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875229250	GF	On-Demand	Anodyne	AMY2	40	39
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccn(C)c3)CC2)c(OC)c1	ZINC000875229253	GD	On-Demand	Clean	HTR1A	37	40
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccn(C)c3)CC2)c(OC)c1	ZINC000875229253	GD	On-Demand	Clean	DRD2	36	41
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccn(C)c3)CC2)c(OC)c1	ZINC000875229253	GD	On-Demand	Clean	DRD4	43	34
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccn(C)c3)CC2)c(OC)c1	ZINC000875229253	GD	On-Demand	Clean	DRD3	55	38
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccn(C)c3)CC2)c(OC)c1	ZINC000875229253	GD	On-Demand	Clean	HTR7	34	40
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccn(C)c3)CC2)c(OC)c1	ZINC000875229253	GD	On-Demand	Clean	MTNR1B	15	40
CCCC[C@@H](NC(=O)N1CCC(C(=O)NOC)CC1)c1ccc(OC)cc1	ZINC000875229259	GG	On-Demand	Anodyne	P2RY12	40	33
CCCC[C@H](NC(=O)N1CCC(C(=O)NOC)CC1)c1ccc(OC)cc1	ZINC000875229260	GG	On-Demand	Anodyne	P2RY12	40	33
CN(C)CCCOc1ccc(CNC(=O)NC2(C)CC(F)(F)C2)cc1	ZINC000875229263	FG	On-Demand	Anodyne	LTA4H	18	41
C[C@H](NC(=O)C(=O)N1CCN(C)C(C)(C)CC1)c1cccc(-n2cccn2)c1	ZINC000875229279	GD	On-Demand	Anodyne	AMP1_PLAFQ	50	35
C[C@@H](CNC(=O)NC(C)(C)c1ccc(F)cc1)c1ccc(S(C)(=O)=O)cc1	ZINC000875229281	GH	On-Demand	Anodyne	PTGS2	25	44
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)c2cccc(-n3cccn3)c2)C1	ZINC000875229321	FD	On-Demand	Anodyne	AMP1_PLAFQ	50	36
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)c2cccc(-n3cccn3)c2)C1	ZINC000875229322	FD	On-Demand	Anodyne	AMP1_PLAFQ	50	36
CN(C)C[C@@H]1CN(C(=O)C(=O)NCCc2ccc(Cl)nc2)C[C@H]1CN(C)C	ZINC000875229339	GC	On-Demand	Anodyne	NACHRBETA2	46	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2ccc(Cl)nc2)C1	ZINC000875229360	ED	On-Demand	Anodyne	GPBAR1	21	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCc2ccc(Cl)nc2)C1	ZINC000875229360	ED	On-Demand	Anodyne	NACHRBETA2	45	32
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2ccc(Cl)nc2)C1	ZINC000875229361	ED	On-Demand	Anodyne	GPBAR1	21	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCc2ccc(Cl)nc2)C1	ZINC000875229361	ED	On-Demand	Anodyne	NACHRBETA2	45	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)c2cccc(-n3cccn3)c2)C1	ZINC000875229363	FD	On-Demand	Anodyne	AMP1_PLAFQ	50	36
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)c2cccc(-n3cccn3)c2)C1	ZINC000875229364	FD	On-Demand	Anodyne	AMP1_PLAFQ	50	36
C[C@H](NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)C1CCC1	ZINC000875229369	EE	On-Demand	Anodyne	ACE	38	41
C[C@H](NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)C1CCC1	ZINC000875229369	EE	On-Demand	Anodyne	XIAP	50	42
C[C@H](NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)C1CCC1	ZINC000875229370	EE	On-Demand	Anodyne	ACE	38	41
C[C@H](NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)C1CCC1	ZINC000875229370	EE	On-Demand	Anodyne	XIAP	50	42
C[C@H](NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)C1CCC1	ZINC000875229371	EE	On-Demand	Anodyne	ACE	38	41
C[C@H](NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)C1CCC1	ZINC000875229371	EE	On-Demand	Anodyne	XIAP	50	42
C[C@H](NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)C1CCC1	ZINC000875229372	EE	On-Demand	Anodyne	ACE	38	41
C[C@H](NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)C1CCC1	ZINC000875229372	EE	On-Demand	Anodyne	XIAP	50	42
CC(=O)C1CCN(C(=O)C(=O)NCCc2ccc(Cl)nc2)CC1	ZINC000875229413	ED	On-Demand	Anodyne	Q8WSF8_APLCA	40	38
CC(=O)C1CCN(C(=O)C(=O)NCCc2ccc(Cl)nc2)CC1	ZINC000875229413	ED	On-Demand	Anodyne	NACHRBETA2	51	38
C[C@H](NC(=O)C(=O)N1CC[C@H]2[C@@H](CCN2C)C1)c1cccc(-n2cccn2)c1	ZINC000875229445	GD	On-Demand	Anodyne	AMP1_PLAFQ	50	35
C[C@H](NC(=O)C(=O)N1CC[C@@H]2[C@H](CCN2C)C1)c1cccc(-n2cccn2)c1	ZINC000875229446	GD	On-Demand	Anodyne	AMP1_PLAFQ	50	35
C[C@H](NC(=O)C(=O)N1CC[C@@H]2[C@@H](CCN2C)C1)c1cccc(-n2cccn2)c1	ZINC000875229447	GD	On-Demand	Anodyne	AMP1_PLAFQ	50	35
C[C@H](NC(=O)C(=O)N1CC[C@H]2[C@H](CCN2C)C1)c1cccc(-n2cccn2)c1	ZINC000875229448	GD	On-Demand	Anodyne	AMP1_PLAFQ	50	35
CN(C)CCCOc1ccc(CNC(=O)NC[C@H]2C[C@H](O)C2)cc1	ZINC000875229456	ED	On-Demand	Anodyne	LTA4H	21	40
C[C@H](NC(=O)C(=O)NCCCCC1CC1)c1cccc(-n2cccn2)c1	ZINC000875229472	FF	On-Demand	Anodyne	AMP1_PLAFQ	52	37
C[C@H](NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)C1CCC1	ZINC000875229496	EE	On-Demand	Anodyne	OXTR	61	39
C[C@H](NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)C1CCC1	ZINC000875229496	EE	On-Demand	Anodyne	GHRHR	34	40
C[C@H](NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)C1CCC1	ZINC000875229498	EE	On-Demand	Anodyne	OXTR	61	39
C[C@H](NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)C1CCC1	ZINC000875229498	EE	On-Demand	Anodyne	GHRHR	34	40
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](C)c1cccc(-n2cccn2)c1	ZINC000875229506	FD	On-Demand	Mild	AMP1_PLAFQ	52	34
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](C)c1cccc(-n2cccn2)c1	ZINC000875229507	FD	On-Demand	Mild	AMP1_PLAFQ	52	34
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H](C)c1cccc(-n2cccn2)c1	ZINC000875229508	FD	On-Demand	Mild	AMP1_PLAFQ	52	34
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H](C)c1cccc(-n2cccn2)c1	ZINC000875229509	FD	On-Demand	Mild	AMP1_PLAFQ	52	34
O=C(NCCc1ccc(Cl)nc1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875229559	GE	On-Demand	Anodyne	PREP	42	32
O=C(NCCc1ccc(Cl)nc1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875229560	GE	On-Demand	Anodyne	PREP	42	32
O=C(NCCc1ccc(Cl)nc1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875229561	GE	On-Demand	Anodyne	PREP	42	32
O=C(NCCc1ccc(Cl)nc1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875229562	GE	On-Demand	Anodyne	PREP	42	32
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCc1ccc(OC)cc1Cl	ZINC000875229574	FD	On-Demand	Mild	MTNR1A	63	38
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCc1ccc(OC)cc1Cl	ZINC000875229574	FD	On-Demand	Mild	MTNR1B	49	36
C#CC[C@H](CCOC)NC(=O)C(=O)NCCc1ccc(OC)cc1Cl	ZINC000875229575	FD	On-Demand	Mild	MTNR1A	63	38
C#CC[C@H](CCOC)NC(=O)C(=O)NCCc1ccc(OC)cc1Cl	ZINC000875229575	FD	On-Demand	Mild	MTNR1B	49	36
C[C@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)C1CCC1	ZINC000875229601	EC	On-Demand	Anodyne	L3MBTL3	56	44
CN(C)CCCOc1ccc(CNC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875229610	FF	On-Demand	Clean	LTA4H	26	41
CN(C)CCCOc1ccc(CNC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875229610	FF	On-Demand	Clean	ESRRG	43	31
CN(C)CCCOc1ccc(CNC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875229610	FF	On-Demand	Clean	NAMPT	23	43
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)c1cccc(-n2cccn2)c1	ZINC000875229611	FD	On-Demand	Mild	AMP1_PLAFQ	52	35
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)c1cccc(-n2cccn2)c1	ZINC000875229612	FD	On-Demand	Mild	AMP1_PLAFQ	52	35
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](C)c1cccc(-n2cccn2)c1	ZINC000875229613	FD	On-Demand	Mild	AMP1_PLAFQ	52	35
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](C)c1cccc(-n2cccn2)c1	ZINC000875229614	FD	On-Demand	Mild	AMP1_PLAFQ	52	35
CN(C)CCCOc1ccc(CNC(=O)N(C)OCC(F)(F)F)cc1	ZINC000875229641	FF	On-Demand	Anodyne	LTA4H	23	40
COC[C@H](NC(=O)C(=O)NCc1ccn(C)c1)c1cccc(Br)c1	ZINC000875229647	GD	On-Demand	Anodyne	PDS	42	39
COC[C@@H](NC(=O)C(=O)NCc1ccn(C)c1)c1cccc(Br)c1	ZINC000875229648	GD	On-Demand	Anodyne	PDS	42	39
CN(C)CCCOc1ccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875229678	GD	On-Demand	Anodyne	LTA4H	32	44
CN(C)CCCOc1ccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875229678	GD	On-Demand	Anodyne	HRH3	20	41
CN(C)CCCOc1ccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875229678	GD	On-Demand	Anodyne	CCR3	15	45
CN(C)CCCOc1ccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875229678	GD	On-Demand	Anodyne	UTS2R	16	56
CN(C)CCCOc1ccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875229678	GD	On-Demand	Anodyne	SLC6A5	35	47
COC(=O)C1(O)CN(C(=O)NCc2ccc(OC)c(OC3CCCC3)c2)C1	ZINC000875229679	GD	On-Demand	Anodyne	PDE4A	52	46
COC(=O)C1(O)CN(C(=O)NCc2ccc(OC)c(OC3CCCC3)c2)C1	ZINC000875229679	GD	On-Demand	Anodyne	PDE4B	30	46
COC(=O)C1(O)CN(C(=O)NCc2ccc(OC)c(OC3CCCC3)c2)C1	ZINC000875229679	GD	On-Demand	Anodyne	PDE4D	36	46
COC(=O)C1(O)CN(C(=O)NCc2ccc(OC)c(OC3CCCC3)c2)C1	ZINC000875229679	GD	On-Demand	Anodyne	PDE4C	17	46
C[C@H](NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1)C1CCC1	ZINC000875229702	FE	On-Demand	Anodyne	ETHR	61	49
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCCCN(C)C)cc1	ZINC000875229777	GE	On-Demand	Anodyne	SLC6A4	21	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCCCN(C)C)cc1	ZINC000875229777	GE	On-Demand	Anodyne	SLC6A3	40	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCCCN(C)C)cc1	ZINC000875229777	GE	On-Demand	Anodyne	LTA4H	26	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCCCN(C)C)cc1	ZINC000875229778	GE	On-Demand	Anodyne	SLC6A4	21	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCCCN(C)C)cc1	ZINC000875229778	GE	On-Demand	Anodyne	SLC6A3	40	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OCCCN(C)C)cc1	ZINC000875229778	GE	On-Demand	Anodyne	LTA4H	26	41
CN(C)CCCOc1ccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875229784	FE	On-Demand	Anodyne	HRH3	25	44
CN(C)CCCOc1ccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875229785	FE	On-Demand	Anodyne	HRH3	25	44
CCCCCCCNC(=O)C(=O)N[C@H](C)C1CCC1	ZINC000875229792	CE	On-Demand	Mild	EPHX2	19	49
CCCCCCCNC(=O)C(=O)N[C@H](C)C1CCC1	ZINC000875229792	CE	On-Demand	Mild	ASAH1	60	33
CCCCCCCNC(=O)C(=O)N[C@@H](C)C1CCC1	ZINC000875229793	CE	On-Demand	Mild	EPHX2	19	49
CCCCCCCNC(=O)C(=O)N[C@@H](C)C1CCC1	ZINC000875229793	CE	On-Demand	Mild	ASAH1	60	33
COC(=O)N(C)NC(=O)NCc1ccc(OCCCN(C)C)cc1	ZINC000875229830	ED	On-Demand	Reactive	LTA4H	23	43
COCC(C)(C)CCNC(=O)C(=O)N[C@@H](C)c1cccc(-n2cccn2)c1	ZINC000875229836	FE	On-Demand	Anodyne	AMP1_PLAFQ	55	41
COCC(C)(C)CCNC(=O)C(=O)N[C@H](C)c1cccc(-n2cccn2)c1	ZINC000875229837	FE	On-Demand	Anodyne	AMP1_PLAFQ	55	41
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)c2cccc(-n3cccn3)c2)CC1	ZINC000875229906	FD	On-Demand	Anodyne	AMP1_PLAFQ	53	38
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)c2cccc(-n3cccn3)c2)CC1	ZINC000875229907	FD	On-Demand	Anodyne	AMP1_PLAFQ	53	38
C[C@H](NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1)c1cccc(-n2cccn2)c1	ZINC000875229909	GE	On-Demand	Anodyne	AMP1_PLAFQ	50	37
CCCC[C@H](NC(=O)N1CCC[C@H](C(C)=O)C1)c1ccc(OC)cc1	ZINC000875229912	EH	On-Demand	Anodyne	MMP13	15	42
CCCC[C@H](NC(=O)N1CCC[C@H](C(C)=O)C1)c1ccc(OC)cc1	ZINC000875229912	EH	On-Demand	Anodyne	CCR5	16	42
CCCC[C@H](NC(=O)N1CCC[C@H](C(C)=O)C1)c1ccc(OC)cc1	ZINC000875229912	EH	On-Demand	Anodyne	MMP3	15	42
CCCC[C@@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)c1ccc(OC)cc1	ZINC000875229913	EH	On-Demand	Anodyne	MMP13	15	42
CCCC[C@@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)c1ccc(OC)cc1	ZINC000875229913	EH	On-Demand	Anodyne	CCR5	16	42
CCCC[C@@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)c1ccc(OC)cc1	ZINC000875229913	EH	On-Demand	Anodyne	MMP3	15	42
CCCC[C@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)c1ccc(OC)cc1	ZINC000875229914	EH	On-Demand	Anodyne	MMP13	15	42
CCCC[C@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)c1ccc(OC)cc1	ZINC000875229914	EH	On-Demand	Anodyne	CCR5	16	42
CCCC[C@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)c1ccc(OC)cc1	ZINC000875229914	EH	On-Demand	Anodyne	MMP3	15	42
CCCC[C@@H](NC(=O)N1CCC[C@H](C(C)=O)C1)c1ccc(OC)cc1	ZINC000875229915	EH	On-Demand	Anodyne	MMP13	15	42
CCCC[C@@H](NC(=O)N1CCC[C@H](C(C)=O)C1)c1ccc(OC)cc1	ZINC000875229915	EH	On-Demand	Anodyne	CCR5	16	42
CCCC[C@@H](NC(=O)N1CCC[C@H](C(C)=O)C1)c1ccc(OC)cc1	ZINC000875229915	EH	On-Demand	Anodyne	MMP3	15	42
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)N[C@H](C)C3CCC3)C2)c1	ZINC000875229924	FD	On-Demand	Anodyne	DRD4	26	40
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)N[C@@H](C)C3CCC3)C2)c1	ZINC000875229925	FD	On-Demand	Anodyne	DRD4	26	40
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)N[C@@H](C)C3CCC3)C2)c1	ZINC000875229926	FD	On-Demand	Anodyne	DRD4	26	40
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)N[C@H](C)C3CCC3)C2)c1	ZINC000875229927	FD	On-Demand	Anodyne	DRD4	26	40
CN1CCN(C2CCN(C(=O)C(=O)NCc3ccn(C)c3)CC2)CC1	ZINC000875229953	EB	On-Demand	Anodyne	L3MBTL3	70	42
CCCC[C@H](NC(=O)NN(C)C(=O)OC)c1ccc(OC)cc1	ZINC000875229967	DF	On-Demand	Reactive	UTS2	66	44
CCCC[C@@H](NC(=O)NN(C)C(=O)OC)c1ccc(OC)cc1	ZINC000875229968	DF	On-Demand	Reactive	UTS2	66	44
C#CC[C@H](COC)NC(=O)C(=O)NCCc1ccc(OC)cc1Cl	ZINC000875229993	FD	On-Demand	Mild	MTNR1A	66	40
C#CC[C@H](COC)NC(=O)C(=O)NCCc1ccc(OC)cc1Cl	ZINC000875229993	FD	On-Demand	Mild	MTNR1B	51	37
C#CC[C@@H](COC)NC(=O)C(=O)NCCc1ccc(OC)cc1Cl	ZINC000875229994	FD	On-Demand	Mild	MTNR1A	66	40
C#CC[C@@H](COC)NC(=O)C(=O)NCCc1ccc(OC)cc1Cl	ZINC000875229994	FD	On-Demand	Mild	MTNR1B	51	37
CCCC[C@@H](NC(=O)N1C[C@H]2C(=O)OC[C@H]2C1)c1ccc(OC)cc1	ZINC000875230016	EF	On-Demand	Anodyne	EDNRB	17	41
CCCC[C@@H](NC(=O)N1C[C@H]2C(=O)OC[C@H]2C1)c1ccc(OC)cc1	ZINC000875230016	EF	On-Demand	Anodyne	EDNRA	15	41
CCCC[C@H](NC(=O)N1C[C@H]2C(=O)OC[C@H]2C1)c1ccc(OC)cc1	ZINC000875230017	EF	On-Demand	Anodyne	EDNRB	17	41
CCCC[C@H](NC(=O)N1C[C@H]2C(=O)OC[C@H]2C1)c1ccc(OC)cc1	ZINC000875230017	EF	On-Demand	Anodyne	EDNRA	15	41
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H](C)C3CCC3)CC2)c(OC)c1	ZINC000875230034	GD	On-Demand	Clean	DRD2	21	45
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H](C)C3CCC3)CC2)c(OC)c1	ZINC000875230034	GD	On-Demand	Clean	ADRA1D	30	45
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H](C)C3CCC3)CC2)c(OC)c1	ZINC000875230034	GD	On-Demand	Clean	ADRA1A	25	45
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H](C)C3CCC3)CC2)c(OC)c1	ZINC000875230034	GD	On-Demand	Clean	ADRA1B	23	45
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H](C)C3CCC3)CC2)c(OC)c1	ZINC000875230034	GD	On-Demand	Clean	MTNR1B	18	40
COc1ccc(N2CCN(C(=O)C(=O)N[C@H](C)C3CCC3)CC2)c(OC)c1	ZINC000875230035	GD	On-Demand	Clean	DRD2	21	45
COc1ccc(N2CCN(C(=O)C(=O)N[C@H](C)C3CCC3)CC2)c(OC)c1	ZINC000875230035	GD	On-Demand	Clean	ADRA1D	30	45
COc1ccc(N2CCN(C(=O)C(=O)N[C@H](C)C3CCC3)CC2)c(OC)c1	ZINC000875230035	GD	On-Demand	Clean	ADRA1A	25	45
COc1ccc(N2CCN(C(=O)C(=O)N[C@H](C)C3CCC3)CC2)c(OC)c1	ZINC000875230035	GD	On-Demand	Clean	ADRA1B	23	45
COc1ccc(N2CCN(C(=O)C(=O)N[C@H](C)C3CCC3)CC2)c(OC)c1	ZINC000875230035	GD	On-Demand	Clean	MTNR1B	18	40
CCCCCCCNC(=O)C(=O)NCc1ccn(C)c1	ZINC000875230062	CD	On-Demand	Mild	ASAH1	108	45
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875230132	GF	On-Demand	Anodyne	DRD4	16	40
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875230132	GF	On-Demand	Anodyne	HTR4	39	42
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875230132	GF	On-Demand	Anodyne	SIGMAR1	25	41
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875230133	GF	On-Demand	Anodyne	DRD4	16	40
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875230133	GF	On-Demand	Anodyne	HTR4	39	42
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875230133	GF	On-Demand	Anodyne	SIGMAR1	25	41
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875230134	GF	On-Demand	Anodyne	DRD4	16	40
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875230134	GF	On-Demand	Anodyne	HTR4	39	42
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875230134	GF	On-Demand	Anodyne	SIGMAR1	25	41
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875230135	GF	On-Demand	Anodyne	DRD4	16	40
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875230135	GF	On-Demand	Anodyne	HTR4	39	42
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875230135	GF	On-Demand	Anodyne	SIGMAR1	25	41
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875230151	FC	On-Demand	Anodyne	DRD2	16	46
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875230151	FC	On-Demand	Anodyne	DRD4	23	46
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875230151	FC	On-Demand	Anodyne	ACHE	26	40
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875230151	FC	On-Demand	Anodyne	OPRM1	19	44
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875230151	FC	On-Demand	Anodyne	SLC6A3	18	43
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875230151	FC	On-Demand	Anodyne	HTR4	53	48
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875230151	FC	On-Demand	Anodyne	LTA4H	15	45
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875230151	FC	On-Demand	Anodyne	SIGMAR1	48	43
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875230151	FC	On-Demand	Anodyne	CCR3	30	40
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875230151	FC	On-Demand	Anodyne	CACNA1I	57	36
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875230152	FC	On-Demand	Anodyne	DRD2	16	46
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875230152	FC	On-Demand	Anodyne	DRD4	23	46
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875230152	FC	On-Demand	Anodyne	ACHE	26	40
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875230152	FC	On-Demand	Anodyne	OPRM1	19	44
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875230152	FC	On-Demand	Anodyne	SLC6A3	18	43
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875230152	FC	On-Demand	Anodyne	HTR4	53	48
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875230152	FC	On-Demand	Anodyne	LTA4H	15	45
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875230152	FC	On-Demand	Anodyne	SIGMAR1	48	43
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875230152	FC	On-Demand	Anodyne	CCR3	30	40
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875230152	FC	On-Demand	Anodyne	CACNA1I	57	36
CCCCCCCNC(=O)C(=O)NCc1csc(N(C)C)n1	ZINC000875230270	ED	On-Demand	Mild	ASAH1	81	36
COC(=O)[C@@]12C[C@@H](NC(=O)NC[C@H]3CCN(CCc4ccccc4)C3)C[C@@H]1C2	ZINC000875230389	GE	On-Demand	Anodyne	DRD4	19	42
COC(=O)[C@@]12C[C@@H](NC(=O)NC[C@H]3CCN(CCc4ccccc4)C3)C[C@@H]1C2	ZINC000875230389	GE	On-Demand	Anodyne	HTR4	41	44
COC(=O)[C@@]12C[C@@H](NC(=O)NC[C@H]3CCN(CCc4ccccc4)C3)C[C@@H]1C2	ZINC000875230389	GE	On-Demand	Anodyne	SIGMAR1	34	43
COC(=O)[C@@]12C[C@@H](NC(=O)NC[C@H]3CCN(CCc4ccccc4)C3)C[C@@H]1C2	ZINC000875230389	GE	On-Demand	Anodyne	CCR3	33	41
COC(=O)[C@@]12C[C@@H](NC(=O)NC[C@H]3CCN(CCc4ccccc4)C3)C[C@@H]1C2	ZINC000875230389	GE	On-Demand	Anodyne	BIRC2	46	39
COC(=O)[C@@]12C[C@@H](NC(=O)NC[C@@H]3CCN(CCc4ccccc4)C3)C[C@@H]1C2	ZINC000875230390	GE	On-Demand	Anodyne	DRD4	19	42
COC(=O)[C@@]12C[C@@H](NC(=O)NC[C@@H]3CCN(CCc4ccccc4)C3)C[C@@H]1C2	ZINC000875230390	GE	On-Demand	Anodyne	HTR4	41	44
COC(=O)[C@@]12C[C@@H](NC(=O)NC[C@@H]3CCN(CCc4ccccc4)C3)C[C@@H]1C2	ZINC000875230390	GE	On-Demand	Anodyne	SIGMAR1	34	43
COC(=O)[C@@]12C[C@@H](NC(=O)NC[C@@H]3CCN(CCc4ccccc4)C3)C[C@@H]1C2	ZINC000875230390	GE	On-Demand	Anodyne	CCR3	33	41
COC(=O)[C@@]12C[C@@H](NC(=O)NC[C@@H]3CCN(CCc4ccccc4)C3)C[C@@H]1C2	ZINC000875230390	GE	On-Demand	Anodyne	BIRC2	46	39
CCCCCCCNC(=O)C(=O)NC1COC(C)(C)OC1	ZINC000875230464	DD	On-Demand	Mild	ASAH1	52	31
COC(=O)N(C)NC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875230801	ED	On-Demand	Reactive	DRD2	19	44
COC(=O)N(C)NC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875230801	ED	On-Demand	Reactive	DRD4	29	44
COC(=O)N(C)NC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875230801	ED	On-Demand	Reactive	ACHE	29	41
COC(=O)N(C)NC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875230801	ED	On-Demand	Reactive	OPRM1	21	46
COC(=O)N(C)NC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875230801	ED	On-Demand	Reactive	OPRD1	18	42
COC(=O)N(C)NC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875230801	ED	On-Demand	Reactive	HTR4	54	49
COC(=O)N(C)NC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875230801	ED	On-Demand	Reactive	LTA4H	18	43
COC(=O)N(C)NC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875230801	ED	On-Demand	Reactive	SIGMAR1	50	43
COC(=O)N(C)NC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875230801	ED	On-Demand	Reactive	CCR3	60	44
COC(=O)N(C)NC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875230801	ED	On-Demand	Reactive	CCR5	32	43
COC(=O)N(C)NC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875230801	ED	On-Demand	Reactive	CACNA1I	66	38
COC(=O)N(C)NC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875230801	ED	On-Demand	Reactive	BIRC2	34	41
COC(=O)N(C)NC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875230802	ED	On-Demand	Reactive	DRD2	19	44
COC(=O)N(C)NC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875230802	ED	On-Demand	Reactive	DRD4	29	44
COC(=O)N(C)NC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875230802	ED	On-Demand	Reactive	ACHE	29	41
COC(=O)N(C)NC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875230802	ED	On-Demand	Reactive	OPRM1	21	46
COC(=O)N(C)NC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875230802	ED	On-Demand	Reactive	OPRD1	18	42
COC(=O)N(C)NC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875230802	ED	On-Demand	Reactive	HTR4	54	49
COC(=O)N(C)NC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875230802	ED	On-Demand	Reactive	LTA4H	18	43
COC(=O)N(C)NC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875230802	ED	On-Demand	Reactive	SIGMAR1	50	43
COC(=O)N(C)NC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875230802	ED	On-Demand	Reactive	CCR3	60	44
COC(=O)N(C)NC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875230802	ED	On-Demand	Reactive	CCR5	32	43
COC(=O)N(C)NC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875230802	ED	On-Demand	Reactive	CACNA1I	66	38
COC(=O)N(C)NC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875230802	ED	On-Demand	Reactive	BIRC2	34	41
O=C(/C=C/c1ccc2ccccc2n1)Nc1cc(Cl)ccc1F	ZINC000875230854	EJ	On-Demand	Anodyne	CYSLTR1	35	42
O=C(/C=C\c1ccc2ccccc2n1)Nc1cc(Cl)ccc1F	ZINC000875230855	EJ	On-Demand	Anodyne	CYSLTR1	35	42
O=C(NCc1nc(O)c2c(n1)CCOC2)NC1(c2ccc(F)cc2)CCC1	ZINC000875230972	FE	On-Demand	Anodyne	WNT3A	53	37
Cc1nnc(NNC(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)n1C	ZINC000875230993	FD	On-Demand	Reactive	DRD4	17	41
Cc1nnc(NNC(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)n1C	ZINC000875230993	FD	On-Demand	Reactive	OPRM1	15	41
Cc1nnc(NNC(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)n1C	ZINC000875230993	FD	On-Demand	Reactive	HTR4	35	49
Cc1nnc(NNC(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)n1C	ZINC000875230993	FD	On-Demand	Reactive	SIGMAR1	26	41
Cc1nnc(NNC(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)n1C	ZINC000875230993	FD	On-Demand	Reactive	CCR3	36	48
Cc1nnc(NNC(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)n1C	ZINC000875230993	FD	On-Demand	Reactive	CACNA1I	42	35
Cc1nnc(NNC(=O)NC[C@H]2CCN(CCc3ccccc3)C2)n1C	ZINC000875230994	FD	On-Demand	Reactive	DRD4	17	41
Cc1nnc(NNC(=O)NC[C@H]2CCN(CCc3ccccc3)C2)n1C	ZINC000875230994	FD	On-Demand	Reactive	OPRM1	15	41
Cc1nnc(NNC(=O)NC[C@H]2CCN(CCc3ccccc3)C2)n1C	ZINC000875230994	FD	On-Demand	Reactive	HTR4	35	49
Cc1nnc(NNC(=O)NC[C@H]2CCN(CCc3ccccc3)C2)n1C	ZINC000875230994	FD	On-Demand	Reactive	SIGMAR1	26	41
Cc1nnc(NNC(=O)NC[C@H]2CCN(CCc3ccccc3)C2)n1C	ZINC000875230994	FD	On-Demand	Reactive	CCR3	36	48
Cc1nnc(NNC(=O)NC[C@H]2CCN(CCc3ccccc3)C2)n1C	ZINC000875230994	FD	On-Demand	Reactive	CACNA1I	42	35
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875231014	ED	On-Demand	Anodyne	DRD4	16	41
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875231014	ED	On-Demand	Anodyne	HTR4	41	43
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875231014	ED	On-Demand	Anodyne	SIGMAR1	29	44
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875231014	ED	On-Demand	Anodyne	CCR3	31	41
CN1CCN(C2CCN(C(=O)C(=O)N[C@H]3CC(C)(C)c4ccccc43)CC2)CC1	ZINC000875231059	GD	On-Demand	Anodyne	L3MBTL3	62	40
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3CC(C)(C)c4ccccc43)CC2)CC1	ZINC000875231060	GD	On-Demand	Anodyne	L3MBTL3	62	40
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875231069	GD	On-Demand	Anodyne	DRD4	17	42
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875231069	GD	On-Demand	Anodyne	ACHE	27	40
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875231069	GD	On-Demand	Anodyne	OPRM1	23	41
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875231069	GD	On-Demand	Anodyne	OPRD1	17	40
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875231069	GD	On-Demand	Anodyne	HTR4	37	46
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875231069	GD	On-Demand	Anodyne	SIGMAR1	48	45
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875231069	GD	On-Demand	Anodyne	CCR3	30	41
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875231070	GD	On-Demand	Anodyne	DRD4	17	42
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875231070	GD	On-Demand	Anodyne	ACHE	27	40
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875231070	GD	On-Demand	Anodyne	OPRM1	23	41
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875231070	GD	On-Demand	Anodyne	OPRD1	17	40
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875231070	GD	On-Demand	Anodyne	HTR4	37	46
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875231070	GD	On-Demand	Anodyne	SIGMAR1	48	45
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875231070	GD	On-Demand	Anodyne	CCR3	30	41
CC[C@@H]1COCCN1CCNC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231191	GD	On-Demand	Anodyne	HTR4	53	44
CC[C@@H]1COCCN1CCNC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231191	GD	On-Demand	Anodyne	CCR3	34	42
CC[C@@H]1COCCN1CCNC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231192	GD	On-Demand	Anodyne	HTR4	53	44
CC[C@@H]1COCCN1CCNC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231192	GD	On-Demand	Anodyne	CCR3	34	42
O=CN1CCCN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875231210	FD	On-Demand	Anodyne	DRD4	16	41
O=CN1CCCN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875231210	FD	On-Demand	Anodyne	ACHE	23	41
O=CN1CCCN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875231210	FD	On-Demand	Anodyne	SLC6A1	58	34
O=CN1CCCN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875231210	FD	On-Demand	Anodyne	HTR4	37	45
O=CN1CCCN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875231210	FD	On-Demand	Anodyne	SIGMAR1	39	44
O=CN1CCCN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875231210	FD	On-Demand	Anodyne	CCR3	29	41
O=CN1CCCN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875231210	FD	On-Demand	Anodyne	CACNA1I	40	33
O=CN1CCCN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875231211	FD	On-Demand	Anodyne	DRD4	16	41
O=CN1CCCN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875231211	FD	On-Demand	Anodyne	ACHE	23	41
O=CN1CCCN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875231211	FD	On-Demand	Anodyne	SLC6A1	58	34
O=CN1CCCN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875231211	FD	On-Demand	Anodyne	HTR4	37	45
O=CN1CCCN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875231211	FD	On-Demand	Anodyne	SIGMAR1	39	44
O=CN1CCCN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875231211	FD	On-Demand	Anodyne	CCR3	29	41
O=CN1CCCN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)CC1	ZINC000875231211	FD	On-Demand	Anodyne	CACNA1I	40	33
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231214	ED	On-Demand	Anodyne	DRD2	18	46
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231214	ED	On-Demand	Anodyne	DRD4	22	44
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231214	ED	On-Demand	Anodyne	ACHE	30	43
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231214	ED	On-Demand	Anodyne	HTR1D	15	42
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231214	ED	On-Demand	Anodyne	OPRM1	21	46
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231214	ED	On-Demand	Anodyne	OPRD1	17	44
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231214	ED	On-Demand	Anodyne	OPRK1	17	44
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231214	ED	On-Demand	Anodyne	HTR4	44	48
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231214	ED	On-Demand	Anodyne	SIGMAR1	54	48
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231214	ED	On-Demand	Anodyne	CCR3	53	46
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231214	ED	On-Demand	Anodyne	CACNA1I	54	38
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231214	ED	On-Demand	Anodyne	BIRC2	44	40
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231215	ED	On-Demand	Anodyne	DRD2	18	46
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231215	ED	On-Demand	Anodyne	DRD4	22	44
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231215	ED	On-Demand	Anodyne	ACHE	30	43
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231215	ED	On-Demand	Anodyne	HTR1D	15	42
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231215	ED	On-Demand	Anodyne	OPRM1	21	46
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231215	ED	On-Demand	Anodyne	OPRD1	17	44
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231215	ED	On-Demand	Anodyne	OPRK1	17	44
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231215	ED	On-Demand	Anodyne	HTR4	44	48
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231215	ED	On-Demand	Anodyne	SIGMAR1	54	48
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231215	ED	On-Demand	Anodyne	CCR3	53	46
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231215	ED	On-Demand	Anodyne	CACNA1I	54	38
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231215	ED	On-Demand	Anodyne	BIRC2	44	40
CN1CCN(C2CCN(C(=O)C(=O)NCc3csc(N(C)C)n3)CC2)CC1	ZINC000875231219	GC	On-Demand	Anodyne	L3MBTL3	40	38
O=C(NCc1nc(-c2ccncc2)cs1)NC1(c2ccc(F)cc2)CCC1	ZINC000875231302	GI	On-Demand	Anodyne	ROCK1	22	52
O=C(NCc1nc(-c2ccncc2)cs1)NC1(c2ccc(F)cc2)CCC1	ZINC000875231302	GI	On-Demand	Anodyne	ROCK2	15	52
NC(=O)CCOC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000875231339	HD	On-Demand	Anodyne	FKBP1A	50	52
NC(=O)CCOC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000875231339	HD	On-Demand	Anodyne	MMP13	49	43
NC(=O)CCOC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000875231339	HD	On-Demand	Anodyne	MMP2	24	40
NC(=O)CCOC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000875231339	HD	On-Demand	Anodyne	MMP3	54	43
NC(=O)CCOC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000875231339	HD	On-Demand	Anodyne	MMP9	24	40
NC(=O)CCOC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000875231339	HD	On-Demand	Anodyne	MMP7	62	43
NC(=O)CCOC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000875231339	HD	On-Demand	Anodyne	MMP1	52	46
NC(=O)CCOC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000875231340	HD	On-Demand	Anodyne	FKBP1A	50	52
NC(=O)CCOC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000875231340	HD	On-Demand	Anodyne	MMP13	49	43
NC(=O)CCOC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000875231340	HD	On-Demand	Anodyne	MMP2	24	40
NC(=O)CCOC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000875231340	HD	On-Demand	Anodyne	MMP3	54	43
NC(=O)CCOC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000875231340	HD	On-Demand	Anodyne	MMP9	24	40
NC(=O)CCOC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000875231340	HD	On-Demand	Anodyne	MMP7	62	43
NC(=O)CCOC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000875231340	HD	On-Demand	Anodyne	MMP1	52	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231443	GE	On-Demand	Anodyne	DRD4	19	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231443	GE	On-Demand	Anodyne	SLC6A4	30	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231443	GE	On-Demand	Anodyne	OPRM1	18	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231443	GE	On-Demand	Anodyne	SLC6A3	59	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231443	GE	On-Demand	Anodyne	HTR4	47	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231443	GE	On-Demand	Anodyne	LTA4H	16	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231443	GE	On-Demand	Anodyne	SIGMAR1	33	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231443	GE	On-Demand	Anodyne	CCR3	30	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231443	GE	On-Demand	Anodyne	CACNA1I	46	34
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231443	GE	On-Demand	Anodyne	BIRC2	49	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231444	GE	On-Demand	Anodyne	DRD4	19	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231444	GE	On-Demand	Anodyne	SLC6A4	30	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231444	GE	On-Demand	Anodyne	OPRM1	18	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231444	GE	On-Demand	Anodyne	SLC6A3	59	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231444	GE	On-Demand	Anodyne	HTR4	47	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231444	GE	On-Demand	Anodyne	LTA4H	16	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231444	GE	On-Demand	Anodyne	SIGMAR1	33	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231444	GE	On-Demand	Anodyne	CCR3	30	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231444	GE	On-Demand	Anodyne	CACNA1I	46	34
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231444	GE	On-Demand	Anodyne	BIRC2	49	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231445	GE	On-Demand	Anodyne	DRD4	19	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231445	GE	On-Demand	Anodyne	SLC6A4	30	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231445	GE	On-Demand	Anodyne	OPRM1	18	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231445	GE	On-Demand	Anodyne	SLC6A3	59	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231445	GE	On-Demand	Anodyne	HTR4	47	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231445	GE	On-Demand	Anodyne	LTA4H	16	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231445	GE	On-Demand	Anodyne	SIGMAR1	33	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231445	GE	On-Demand	Anodyne	CCR3	30	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231445	GE	On-Demand	Anodyne	CACNA1I	46	34
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231445	GE	On-Demand	Anodyne	BIRC2	49	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231446	GE	On-Demand	Anodyne	DRD4	19	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231446	GE	On-Demand	Anodyne	SLC6A4	30	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231446	GE	On-Demand	Anodyne	OPRM1	18	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231446	GE	On-Demand	Anodyne	SLC6A3	59	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231446	GE	On-Demand	Anodyne	HTR4	47	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231446	GE	On-Demand	Anodyne	LTA4H	16	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231446	GE	On-Demand	Anodyne	SIGMAR1	33	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231446	GE	On-Demand	Anodyne	CCR3	30	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231446	GE	On-Demand	Anodyne	CACNA1I	46	34
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231446	GE	On-Demand	Anodyne	BIRC2	49	39
CCCCCCCNC(=O)C(=O)NCc1nc2cc(OC)ccc2n1C	ZINC000875231451	FE	On-Demand	Mild	MTNR1A	56	37
CCCCCCCNC(=O)C(=O)NCc1nc2cc(OC)ccc2n1C	ZINC000875231451	FE	On-Demand	Mild	MTNR1B	46	37
CCCCCCCNC(=O)C(=O)NCc1nc2cc(OC)ccc2n1C	ZINC000875231451	FE	On-Demand	Mild	ASAH1	69	36
C[C@@H](NC(=O)NC1(c2ccc(Cl)cc2)CCC1)c1ccnn1C	ZINC000875231517	EH	On-Demand	Anodyne	CCR1	47	34
C[C@H](NC(=O)NC1(c2ccc(Cl)cc2)CCC1)c1ccnn1C	ZINC000875231518	EH	On-Demand	Anodyne	CCR1	47	34
O=C(NOCc1ccccc1)N(C1CC1)C1CC1	ZINC000875231608	BE	On-Demand	Anodyne	CELA1	18	40
O=C(NOCc1ccccc1)N(C1CC1)C1CC1	ZINC000875231608	BE	On-Demand	Anodyne	PREP	34	40
O=C(NOCc1ccccc1)N(C1CC1)C1CC1	ZINC000875231608	BE	On-Demand	Anodyne	NPR	40	32
O=C(NOCc1ccccc1)N(C1CC1)C1CC1	ZINC000875231608	BE	On-Demand	Anodyne	NAAA	24	40
CS(=O)(=O)NC1CN(C(=O)NOCc2ccccc2)C1	ZINC000875231624	CC	On-Demand	Anodyne	CAPN2	45	33
CS(=O)(=O)NC1CN(C(=O)NOCc2ccccc2)C1	ZINC000875231624	CC	On-Demand	Anodyne	TGM2	29	40
CS(=O)(=O)NC1CN(C(=O)NOCc2ccccc2)C1	ZINC000875231624	CC	On-Demand	Anodyne	F13A1	29	40
CN1CCC(CCNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)CC1	ZINC000875231630	EE	On-Demand	Anodyne	ACHE	18	40
CN1CCC(CCNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)CC1	ZINC000875231630	EE	On-Demand	Anodyne	EPHX2	18	47
CN1CCC(CCNC(=O)N2CCC[C@](O)(c3ccccc3)C2)CC1	ZINC000875231631	EE	On-Demand	Anodyne	ACHE	18	40
CN1CCC(CCNC(=O)N2CCC[C@](O)(c3ccccc3)C2)CC1	ZINC000875231631	EE	On-Demand	Anodyne	EPHX2	18	47
O=C(NCCC1(O)CCN(c2ccccc2)CC1)NOCc1ccccc1	ZINC000875231650	FF	On-Demand	Anodyne	SLC12A5	66	35
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231663	EE	On-Demand	Anodyne	OPRM1	16	42
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231663	EE	On-Demand	Anodyne	HTR4	49	49
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231663	EE	On-Demand	Anodyne	SIGMAR1	27	43
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231663	EE	On-Demand	Anodyne	CCR3	37	44
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231663	EE	On-Demand	Anodyne	CACNA1I	49	37
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231663	EE	On-Demand	Anodyne	BIRC2	54	43
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231665	EE	On-Demand	Anodyne	OPRM1	16	42
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231665	EE	On-Demand	Anodyne	HTR4	49	49
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231665	EE	On-Demand	Anodyne	SIGMAR1	27	43
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231665	EE	On-Demand	Anodyne	CCR3	37	44
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231665	EE	On-Demand	Anodyne	CACNA1I	49	37
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000875231665	EE	On-Demand	Anodyne	BIRC2	54	43
O=C(NOCc1ccccc1)N1CCCC(F)(F)CC1	ZINC000875231682	CF	On-Demand	Anodyne	GHRHR	56	33
O=C(NOCc1ccccc1)N1CCCC(F)(F)CC1	ZINC000875231682	CF	On-Demand	Anodyne	TGM2	20	45
O=C(NOCc1ccccc1)N1CCCC(F)(F)CC1	ZINC000875231682	CF	On-Demand	Anodyne	SLC12A5	79	42
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231699	GF	On-Demand	Anodyne	HTR4	29	45
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231699	GF	On-Demand	Anodyne	SIGMAR1	17	40
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000875231699	GF	On-Demand	Anodyne	CCR3	30	41
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875231701	GF	On-Demand	Anodyne	HTR4	29	45
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875231701	GF	On-Demand	Anodyne	SIGMAR1	17	40
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875231701	GF	On-Demand	Anodyne	CCR3	30	41
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875231703	GF	On-Demand	Anodyne	HTR4	29	45
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875231703	GF	On-Demand	Anodyne	SIGMAR1	17	40
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875231703	GF	On-Demand	Anodyne	CCR3	30	41
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875231705	GF	On-Demand	Anodyne	HTR4	29	45
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875231705	GF	On-Demand	Anodyne	SIGMAR1	17	40
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875231705	GF	On-Demand	Anodyne	CCR3	30	41
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875231707	GF	On-Demand	Anodyne	DRD4	15	40
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875231707	GF	On-Demand	Anodyne	HTR4	29	44
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875231707	GF	On-Demand	Anodyne	SIGMAR1	33	46
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875231707	GF	On-Demand	Anodyne	BIRC2	46	41
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875231708	GF	On-Demand	Anodyne	DRD4	15	40
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875231708	GF	On-Demand	Anodyne	HTR4	29	44
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875231708	GF	On-Demand	Anodyne	SIGMAR1	33	46
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875231708	GF	On-Demand	Anodyne	BIRC2	46	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875231725	GE	On-Demand	Anodyne	ACE	42	42
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875231725	GE	On-Demand	Anodyne	DRD4	18	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875231725	GE	On-Demand	Anodyne	ACHE	23	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875231725	GE	On-Demand	Anodyne	OPRM1	22	44
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875231725	GE	On-Demand	Anodyne	OPRD1	18	43
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875231725	GE	On-Demand	Anodyne	SLC6A3	17	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875231725	GE	On-Demand	Anodyne	HTR4	72	51
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875231725	GE	On-Demand	Anodyne	SIGMAR1	30	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875231725	GE	On-Demand	Anodyne	CCR3	31	43
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875231725	GE	On-Demand	Anodyne	CCR5	44	39
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875231725	GE	On-Demand	Anodyne	CACNA1I	50	35
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875231725	GE	On-Demand	Anodyne	BIRC2	54	43
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875231727	GE	On-Demand	Anodyne	ACE	42	42
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875231727	GE	On-Demand	Anodyne	DRD4	18	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875231727	GE	On-Demand	Anodyne	ACHE	23	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875231727	GE	On-Demand	Anodyne	OPRM1	22	44
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875231727	GE	On-Demand	Anodyne	OPRD1	18	43
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875231727	GE	On-Demand	Anodyne	SLC6A3	17	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875231727	GE	On-Demand	Anodyne	HTR4	72	51
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875231727	GE	On-Demand	Anodyne	SIGMAR1	30	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875231727	GE	On-Demand	Anodyne	CCR3	31	43
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875231727	GE	On-Demand	Anodyne	CCR5	44	39
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875231727	GE	On-Demand	Anodyne	CACNA1I	50	35
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000875231727	GE	On-Demand	Anodyne	BIRC2	54	43
CN1CCC(CCNC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)CC1	ZINC000875231736	FF	On-Demand	Anodyne	ACHE	19	41
CN1CCC(CCNC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)CC1	ZINC000875231736	FF	On-Demand	Anodyne	OPRL1	15	42
Cn1nccc1C(NC(=O)NC1(c2ccc(Cl)cc2)CCC1)c1ccnn1C	ZINC000875231847	GG	On-Demand	Anodyne	CCR1	44	36
CCOC1CC2(C1)C[C@H]2NC(=O)NCCCOCCOC	ZINC000875231860	DD	On-Demand	Anodyne	EPHX2	22	49
CCOC1CC2(C1)C[C@@H]2NC(=O)NCCCOCCOC	ZINC000875231861	DD	On-Demand	Anodyne	EPHX2	22	49
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875231897	FF	On-Demand	Clean	DRD4	18	42
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875231897	FF	On-Demand	Clean	OPRM1	23	40
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875231897	FF	On-Demand	Clean	OPRD1	19	40
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875231897	FF	On-Demand	Clean	HTR4	26	44
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875231897	FF	On-Demand	Clean	SIGMAR1	34	43
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875231898	FF	On-Demand	Clean	DRD4	18	42
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875231898	FF	On-Demand	Clean	OPRM1	23	40
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875231898	FF	On-Demand	Clean	OPRD1	19	40
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875231898	FF	On-Demand	Clean	HTR4	26	44
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875231898	FF	On-Demand	Clean	SIGMAR1	34	43
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875231899	GH	On-Demand	Anodyne	DRD4	15	40
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875231899	GH	On-Demand	Anodyne	ACHE	21	42
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875231899	GH	On-Demand	Anodyne	SLC6A1	50	37
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875231899	GH	On-Demand	Anodyne	HTR4	51	46
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875231899	GH	On-Demand	Anodyne	GRIN2B	49	39
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875231899	GH	On-Demand	Anodyne	LTA4H	16	41
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875231899	GH	On-Demand	Anodyne	SIGMAR1	33	42
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875231899	GH	On-Demand	Anodyne	CCR3	37	42
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875231899	GH	On-Demand	Anodyne	BIRC2	48	41
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875231900	GH	On-Demand	Anodyne	DRD4	15	40
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875231900	GH	On-Demand	Anodyne	ACHE	21	42
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875231900	GH	On-Demand	Anodyne	SLC6A1	50	37
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875231900	GH	On-Demand	Anodyne	HTR4	51	46
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875231900	GH	On-Demand	Anodyne	GRIN2B	49	39
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875231900	GH	On-Demand	Anodyne	LTA4H	16	41
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875231900	GH	On-Demand	Anodyne	SIGMAR1	33	42
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875231900	GH	On-Demand	Anodyne	CCR3	37	42
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875231900	GH	On-Demand	Anodyne	BIRC2	48	41
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875231901	GH	On-Demand	Anodyne	DRD4	15	40
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875231901	GH	On-Demand	Anodyne	ACHE	21	42
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875231901	GH	On-Demand	Anodyne	SLC6A1	50	37
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875231901	GH	On-Demand	Anodyne	HTR4	51	46
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875231901	GH	On-Demand	Anodyne	GRIN2B	49	39
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875231901	GH	On-Demand	Anodyne	LTA4H	16	41
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875231901	GH	On-Demand	Anodyne	SIGMAR1	33	42
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875231901	GH	On-Demand	Anodyne	CCR3	37	42
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875231901	GH	On-Demand	Anodyne	BIRC2	48	41
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875231902	GH	On-Demand	Anodyne	DRD4	15	40
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875231902	GH	On-Demand	Anodyne	ACHE	21	42
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875231902	GH	On-Demand	Anodyne	SLC6A1	50	37
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875231902	GH	On-Demand	Anodyne	HTR4	51	46
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875231902	GH	On-Demand	Anodyne	GRIN2B	49	39
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875231902	GH	On-Demand	Anodyne	LTA4H	16	41
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875231902	GH	On-Demand	Anodyne	SIGMAR1	33	42
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875231902	GH	On-Demand	Anodyne	CCR3	37	42
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875231902	GH	On-Demand	Anodyne	BIRC2	48	41
C[C@@H](NC(=O)NC1(c2ccc(Cl)cc2)CCCC1)c1ccnn1C	ZINC000875231910	EH	On-Demand	Anodyne	CCR1	46	34
C[C@H](NC(=O)NC1(c2ccc(Cl)cc2)CCCC1)c1ccnn1C	ZINC000875231911	EH	On-Demand	Anodyne	CCR1	46	34
O=C(NOCc1ccccc1)N[C@@H]1CCOC[C@@H]1O	ZINC000875231926	CC	On-Demand	Anodyne	NAAA	41	42
O=C(NOCc1ccccc1)N[C@H]1CCOC[C@H]1O	ZINC000875231927	CC	On-Demand	Anodyne	NAAA	41	42
O=C(NOCc1ccccc1)N[C@H]1CCOC[C@@H]1O	ZINC000875231928	CC	On-Demand	Anodyne	NAAA	41	42
O=C(NOCc1ccccc1)N[C@@H]1CCOC[C@H]1O	ZINC000875231929	CC	On-Demand	Anodyne	NAAA	41	42
CO[C@H]1CCN([C@@H]2CCC[C@@H]2N(C)C(=O)NOCc2ccccc2)C1	ZINC000875231934	EE	On-Demand	Anodyne	SLC12A5	46	35
O=C(NCc1ccc(F)cn1)C(=O)NCc1nc(C(F)(F)F)n2c1CCCC2	ZINC000875231949	GD	On-Demand	Anodyne	SLC27A1	44	36
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)NOCc1ccccc1	ZINC000875231961	DE	On-Demand	Anodyne	LUCI_PHOPY	50	32
O=C(NC[C@H]1CC(C(F)(F)F)=NO1)NOCc1ccccc1	ZINC000875231962	DE	On-Demand	Anodyne	LUCI_PHOPY	50	32
O=C(NOCc1ccccc1)N1CC[C@H]2CC[C@@H](C1)S2(=O)=O	ZINC000875232007	DD	On-Demand	Anodyne	GRIN2B	34	41
O=C(NOCc1ccccc1)N1CC[C@H]2CC[C@@H](C1)S2(=O)=O	ZINC000875232007	DD	On-Demand	Anodyne	PREP	43	40
O=C(NOCc1ccccc1)N1CC[C@H]2CC[C@@H](C1)S2(=O)=O	ZINC000875232007	DD	On-Demand	Anodyne	SLC12A5	49	35
O=C(NCc1nc(O)c2c(n1)CCOC2)NC1(c2ccc(F)cc2)CCCC1	ZINC000875232022	GF	On-Demand	Anodyne	WNT3A	53	37
CN1CCN(C(=O)NOCc2ccccc2)CCC1(C)C	ZINC000875232184	CE	On-Demand	Anodyne	GHRHR	53	34
CN1CCN(C(=O)NOCc2ccccc2)CCC1(C)C	ZINC000875232184	CE	On-Demand	Anodyne	SLC12A5	77	40
COCC1CC(NC(=O)NC2(c3ccc(OC)cc3)CCCC2)C1	ZINC000875232207	EG	On-Demand	Anodyne	NPBWR1	54	31
CCOC(=O)[C@@]1(C)CN(C(=O)NOCc2ccccc2)CCO1	ZINC000875232209	DD	On-Demand	Anodyne	SLC12A5	76	39
O=C(NOCc1ccccc1)N1CC=CC1	ZINC000875232212	BD	On-Demand	Anodyne	SLC12A5	58	36
CCC[C@H](CCO)NC(=O)NOCc1ccccc1	ZINC000875232213	CD	On-Demand	Anodyne	MME	47	39
CCC[C@H](CCO)NC(=O)NOCc1ccccc1	ZINC000875232213	CD	On-Demand	Anodyne	ANPEP	40	31
CCC[C@H](CCO)NC(=O)NOCc1ccccc1	ZINC000875232213	CD	On-Demand	Anodyne	KLK3	78	38
CCC[C@H](CCO)NC(=O)NOCc1ccccc1	ZINC000875232213	CD	On-Demand	Anodyne	CTSB	50	39
CCC[C@H](CCO)NC(=O)NOCc1ccccc1	ZINC000875232213	CD	On-Demand	Anodyne	PAPA1_CARPA	57	37
CCC[C@H](CCO)NC(=O)NOCc1ccccc1	ZINC000875232213	CD	On-Demand	Anodyne	CTSK	40	45
CCC[C@H](CCO)NC(=O)NOCc1ccccc1	ZINC000875232213	CD	On-Demand	Anodyne	CAPNS1	63	41
CCC[C@H](CCO)NC(=O)NOCc1ccccc1	ZINC000875232213	CD	On-Demand	Anodyne	CAPN1	76	45
CCC[C@H](CCO)NC(=O)NOCc1ccccc1	ZINC000875232213	CD	On-Demand	Anodyne	CAPN2	106	42
CCC[C@H](CCO)NC(=O)NOCc1ccccc1	ZINC000875232213	CD	On-Demand	Anodyne	CTRB_BOVIN	54	32
CCC[C@H](CCO)NC(=O)NOCc1ccccc1	ZINC000875232213	CD	On-Demand	Anodyne	NPR	70	40
CCC[C@@H](CCO)NC(=O)NOCc1ccccc1	ZINC000875232214	CD	On-Demand	Anodyne	MME	47	39
CCC[C@@H](CCO)NC(=O)NOCc1ccccc1	ZINC000875232214	CD	On-Demand	Anodyne	ANPEP	40	31
CCC[C@@H](CCO)NC(=O)NOCc1ccccc1	ZINC000875232214	CD	On-Demand	Anodyne	KLK3	78	38
CCC[C@@H](CCO)NC(=O)NOCc1ccccc1	ZINC000875232214	CD	On-Demand	Anodyne	CTSB	50	39
CCC[C@@H](CCO)NC(=O)NOCc1ccccc1	ZINC000875232214	CD	On-Demand	Anodyne	PAPA1_CARPA	57	37
CCC[C@@H](CCO)NC(=O)NOCc1ccccc1	ZINC000875232214	CD	On-Demand	Anodyne	CTSK	40	45
CCC[C@@H](CCO)NC(=O)NOCc1ccccc1	ZINC000875232214	CD	On-Demand	Anodyne	CAPNS1	63	41
CCC[C@@H](CCO)NC(=O)NOCc1ccccc1	ZINC000875232214	CD	On-Demand	Anodyne	CAPN1	76	45
CCC[C@@H](CCO)NC(=O)NOCc1ccccc1	ZINC000875232214	CD	On-Demand	Anodyne	CAPN2	106	42
CCC[C@@H](CCO)NC(=O)NOCc1ccccc1	ZINC000875232214	CD	On-Demand	Anodyne	CTRB_BOVIN	54	32
CCC[C@@H](CCO)NC(=O)NOCc1ccccc1	ZINC000875232214	CD	On-Demand	Anodyne	NPR	70	40
O=C(NOCc1ccccc1)N[C@H]1COC[C@H]1O	ZINC000875232219	CC	On-Demand	Anodyne	NAAA	61	45
COC(=O)C1=NO[C@@]2(CCN(C(=O)NOCc3ccccc3)C2)C1	ZINC000875232220	ED	On-Demand	Anodyne	SLC12A5	65	37
COC(=O)C1=NO[C@]2(CCN(C(=O)NOCc3ccccc3)C2)C1	ZINC000875232221	ED	On-Demand	Anodyne	SLC12A5	65	37
COC(=O)N(C)NC(=O)NOCc1ccccc1	ZINC000875232228	CD	On-Demand	Reactive	CTSB	45	36
COC(=O)N(C)NC(=O)NOCc1ccccc1	ZINC000875232228	CD	On-Demand	Reactive	NPR	57	33
O=C(NOCc1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875232229	DG	On-Demand	Anodyne	CELA1	19	41
O=C(NOCc1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875232229	DG	On-Demand	Anodyne	GRIN2B	47	41
O=C(NOCc1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875232229	DG	On-Demand	Anodyne	PREP	61	45
O=C(NOCc1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875232229	DG	On-Demand	Anodyne	EPHX2	27	40
O=C(NOCc1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875232229	DG	On-Demand	Anodyne	SLC12A5	49	35
O=C(NOCc1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875232230	DG	On-Demand	Anodyne	CELA1	19	41
O=C(NOCc1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875232230	DG	On-Demand	Anodyne	GRIN2B	47	41
O=C(NOCc1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875232230	DG	On-Demand	Anodyne	PREP	61	45
O=C(NOCc1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875232230	DG	On-Demand	Anodyne	EPHX2	27	40
O=C(NOCc1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875232230	DG	On-Demand	Anodyne	SLC12A5	49	35
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(F)cn1	ZINC000875232231	GE	On-Demand	Anodyne	DRD2	22	48
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(F)cn1	ZINC000875232231	GE	On-Demand	Anodyne	DRD4	42	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(F)cn1	ZINC000875232231	GE	On-Demand	Anodyne	ACHE	60	62
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(F)cn1	ZINC000875232231	GE	On-Demand	Anodyne	SLC6A3	23	53
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(F)cn1	ZINC000875232231	GE	On-Demand	Anodyne	SIGMAR1	54	51
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(F)cn1	ZINC000875232231	GE	On-Demand	Anodyne	BCHE	16	49
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(F)cn1	ZINC000875232231	GE	On-Demand	Anodyne	CCR3	59	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(F)cn1	ZINC000875232231	GE	On-Demand	Anodyne	SCN5A	24	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(F)cn1	ZINC000875232231	GE	On-Demand	Anodyne	CXCR3	15	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(F)cn1	ZINC000875232231	GE	On-Demand	Anodyne	MCHR1	31	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(F)cn1	ZINC000875232231	GE	On-Demand	Anodyne	CACNA1G	41	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(F)cn1	ZINC000875232231	GE	On-Demand	Anodyne	SIRT3	40	32
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(F)cn1	ZINC000875232231	GE	On-Demand	Anodyne	SIRT2	45	33
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCc1ccc(F)cn1	ZINC000875232231	GE	On-Demand	Anodyne	SIRT1	41	35
O=C(NOCc1ccccc1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875232244	GH	On-Demand	Anodyne	GRIN2B	21	46
O=C(NOCc1ccccc1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875232244	GH	On-Demand	Anodyne	CHRNA7	45	38
O=C(NOCc1ccccc1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875232244	GH	On-Demand	Anodyne	CPT1A	24	40
CN1CCN(C2CCN(C(=O)C(=O)NCc3ccc(Cl)cn3)CC2)CC1	ZINC000875232257	GC	On-Demand	Anodyne	L3MBTL3	52	39
O=C(NOCc1ccccc1)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875232295	DD	On-Demand	Anodyne	GRIN2B	35	41
O=C(NOCc1ccccc1)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875232295	DD	On-Demand	Anodyne	CTSL	17	40
O=C(NOCc1ccccc1)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875232296	DD	On-Demand	Anodyne	GRIN2B	35	41
O=C(NOCc1ccccc1)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875232296	DD	On-Demand	Anodyne	CTSL	17	40
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NOCc1ccccc1	ZINC000875232313	CE	On-Demand	Anodyne	SLC6A4	19	41
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NOCc1ccccc1	ZINC000875232313	CE	On-Demand	Anodyne	SLC6A3	44	44
C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NOCc1ccccc1	ZINC000875232314	CE	On-Demand	Anodyne	SLC6A4	19	41
C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NOCc1ccccc1	ZINC000875232314	CE	On-Demand	Anodyne	SLC6A3	44	44
C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)NOCc1ccccc1	ZINC000875232315	CE	On-Demand	Anodyne	SLC6A4	19	41
C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)NOCc1ccccc1	ZINC000875232315	CE	On-Demand	Anodyne	SLC6A3	44	44
O=C(NCCN1CC[C@@H](O)C1)NOCc1ccccc1	ZINC000875232321	CC	On-Demand	Anodyne	ACHE	20	42
O=C(NCCN1CC[C@@H](O)C1)NOCc1ccccc1	ZINC000875232321	CC	On-Demand	Anodyne	SLC6A1	52	33
O=C(NCCN1CC[C@@H](O)C1)NOCc1ccccc1	ZINC000875232321	CC	On-Demand	Anodyne	LTA4H	15	47
O=C(NCCN1CC[C@@H](O)C1)NOCc1ccccc1	ZINC000875232321	CC	On-Demand	Anodyne	CTSK	21	41
O=C(NCCN1CC[C@@H](O)C1)NOCc1ccccc1	ZINC000875232321	CC	On-Demand	Anodyne	CTSL	22	41
O=C(NCCN1CC[C@@H](O)C1)NOCc1ccccc1	ZINC000875232321	CC	On-Demand	Anodyne	CCR3	34	42
O=C(NCCN1CC[C@@H](O)C1)NOCc1ccccc1	ZINC000875232321	CC	On-Demand	Anodyne	PLD1	42	36
O=C(NCCN1CC[C@@H](O)C1)NOCc1ccccc1	ZINC000875232321	CC	On-Demand	Anodyne	PLD2	41	36
O=C(NCCN1CC[C@@H](O)C1)NOCc1ccccc1	ZINC000875232321	CC	On-Demand	Anodyne	SLC12A5	56	37
O=C(NCCN1CC[C@H](O)C1)NOCc1ccccc1	ZINC000875232322	CC	On-Demand	Anodyne	ACHE	20	42
O=C(NCCN1CC[C@H](O)C1)NOCc1ccccc1	ZINC000875232322	CC	On-Demand	Anodyne	SLC6A1	52	33
O=C(NCCN1CC[C@H](O)C1)NOCc1ccccc1	ZINC000875232322	CC	On-Demand	Anodyne	LTA4H	15	47
O=C(NCCN1CC[C@H](O)C1)NOCc1ccccc1	ZINC000875232322	CC	On-Demand	Anodyne	CTSK	21	41
O=C(NCCN1CC[C@H](O)C1)NOCc1ccccc1	ZINC000875232322	CC	On-Demand	Anodyne	CTSL	22	41
O=C(NCCN1CC[C@H](O)C1)NOCc1ccccc1	ZINC000875232322	CC	On-Demand	Anodyne	CCR3	34	42
O=C(NCCN1CC[C@H](O)C1)NOCc1ccccc1	ZINC000875232322	CC	On-Demand	Anodyne	PLD1	42	36
O=C(NCCN1CC[C@H](O)C1)NOCc1ccccc1	ZINC000875232322	CC	On-Demand	Anodyne	PLD2	41	36
O=C(NCCN1CC[C@H](O)C1)NOCc1ccccc1	ZINC000875232322	CC	On-Demand	Anodyne	SLC12A5	56	37
O=C(NCC[C@H](O)C(F)F)NOCc1ccccc1	ZINC000875232325	CD	On-Demand	Anodyne	PAPA1_CARPA	43	33
O=C(NCC[C@H](O)C(F)F)NOCc1ccccc1	ZINC000875232325	CD	On-Demand	Anodyne	CAPNS1	48	36
O=C(NCC[C@H](O)C(F)F)NOCc1ccccc1	ZINC000875232325	CD	On-Demand	Anodyne	CAPN1	48	36
O=C(NCC[C@H](O)C(F)F)NOCc1ccccc1	ZINC000875232325	CD	On-Demand	Anodyne	CAPN2	78	36
O=C(NCC[C@H](O)C(F)F)NOCc1ccccc1	ZINC000875232325	CD	On-Demand	Anodyne	LAP3	21	41
O=C(NCC[C@H](O)C(F)F)NOCc1ccccc1	ZINC000875232325	CD	On-Demand	Anodyne	NPR	62	40
O=C(NCC[C@@H](O)C(F)F)NOCc1ccccc1	ZINC000875232326	CD	On-Demand	Anodyne	PAPA1_CARPA	43	33
O=C(NCC[C@@H](O)C(F)F)NOCc1ccccc1	ZINC000875232326	CD	On-Demand	Anodyne	CAPNS1	48	36
O=C(NCC[C@@H](O)C(F)F)NOCc1ccccc1	ZINC000875232326	CD	On-Demand	Anodyne	CAPN1	48	36
O=C(NCC[C@@H](O)C(F)F)NOCc1ccccc1	ZINC000875232326	CD	On-Demand	Anodyne	CAPN2	78	36
O=C(NCC[C@@H](O)C(F)F)NOCc1ccccc1	ZINC000875232326	CD	On-Demand	Anodyne	LAP3	21	41
O=C(NCC[C@@H](O)C(F)F)NOCc1ccccc1	ZINC000875232326	CD	On-Demand	Anodyne	NPR	62	40
O=C(NOCc1ccccc1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875232327	DF	On-Demand	Anodyne	SLC12A5	71	40
O=C(NOCc1ccccc1)NC1([C@H]2CCCCO2)CCC1	ZINC000875232328	DF	On-Demand	Anodyne	SLC12A5	71	40
CN(CCNC(=O)NOCc1ccccc1)CC(F)F	ZINC000875232329	CD	On-Demand	Anodyne	CTSB	53	38
CN(CCNC(=O)NOCc1ccccc1)CC(F)F	ZINC000875232329	CD	On-Demand	Anodyne	PAPA1_CARPA	42	37
CN(CCNC(=O)NOCc1ccccc1)CC(F)F	ZINC000875232329	CD	On-Demand	Anodyne	CAPNS1	59	37
CN(CCNC(=O)NOCc1ccccc1)CC(F)F	ZINC000875232329	CD	On-Demand	Anodyne	CAPN1	52	39
CN(CCNC(=O)NOCc1ccccc1)CC(F)F	ZINC000875232329	CD	On-Demand	Anodyne	CAPN2	77	36
CN(CCNC(=O)NOCc1ccccc1)CC(F)F	ZINC000875232329	CD	On-Demand	Anodyne	NPR	70	38
CN(C[C@@H]1C[C@H](O)C1)C(=O)NOCc1ccccc1	ZINC000875232330	CD	On-Demand	Anodyne	SLC12A5	48	35
O=C(NOCc1ccccc1)N[C@@H]1COCC[C@H]1O	ZINC000875232331	CC	On-Demand	Anodyne	NAAA	43	42
CO[C@H]1CN(C(=O)NOCc2ccccc2)[C@](C)(CO)C1	ZINC000875232341	CD	On-Demand	Anodyne	SLC12A5	61	37
CO[C@H]1CN(C(=O)NOCc2ccccc2)[C@@](C)(CO)C1	ZINC000875232342	CD	On-Demand	Anodyne	SLC12A5	61	37
O=C(NCC[C@@H](O)COCc1ccccc1)NOCc1ccccc1	ZINC000875232350	EE	On-Demand	Anodyne	CTSK	19	40
O=C(NCC[C@@H](O)COCc1ccccc1)NOCc1ccccc1	ZINC000875232350	EE	On-Demand	Anodyne	CAPNS1	43	35
O=C(NCC[C@@H](O)COCc1ccccc1)NOCc1ccccc1	ZINC000875232350	EE	On-Demand	Anodyne	CAPN1	50	40
O=C(NCC[C@@H](O)COCc1ccccc1)NOCc1ccccc1	ZINC000875232350	EE	On-Demand	Anodyne	CAPN2	74	35
O=C(NCC[C@@H](O)COCc1ccccc1)NOCc1ccccc1	ZINC000875232350	EE	On-Demand	Anodyne	NPR	57	39
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)NOCc1ccccc1	ZINC000875232360	CE	On-Demand	Anodyne	SLC6A3	20	40
CS(=O)(=O)N[C@@H]1CCCC[C@H]1NC(=O)NOCc1ccccc1	ZINC000875232404	ED	On-Demand	Anodyne	CTSK	21	41
CS(=O)(=O)N[C@@H]1CCCC[C@H]1NC(=O)NOCc1ccccc1	ZINC000875232404	ED	On-Demand	Anodyne	SLC12A5	59	36
O=C(NCc1ccc(Cl)cn1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875232426	FE	On-Demand	Anodyne	NPY5R	26	44
O=C(NCc1ccc(Cl)cn1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875232427	FE	On-Demand	Anodyne	NPY5R	26	44
O=C(NOCc1ccccc1)N(Cc1cccc(O)c1)[C@@H]1CC[C@@H](O)CC1	ZINC000875232445	FG	On-Demand	Anodyne	HSD17B2	17	40
CN1CCC(CCNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875232456	EF	On-Demand	Anodyne	FKBP1A	17	40
CN1CCC(CCNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875232457	EF	On-Demand	Anodyne	FKBP1A	17	40
CN1CCC(CCNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875232458	EF	On-Demand	Anodyne	FKBP1A	17	40
CN1CCC(CCNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875232459	EF	On-Demand	Anodyne	FKBP1A	17	40
NC(=O)CCOC(=O)c1cnc2c(cnn2Cc2ccccc2)c1	ZINC000875232465	DD	On-Demand	Anodyne	PLA2G2A	65	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1ccc(F)cn1)CC2	ZINC000875232489	GD	On-Demand	Anodyne	SLC18A2	45	32
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1ccc(F)cn1)CC2	ZINC000875232489	GD	On-Demand	Anodyne	HCRTR1	16	45
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1ccc(F)cn1)CC2	ZINC000875232490	GD	On-Demand	Anodyne	SLC18A2	45	32
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1ccc(F)cn1)CC2	ZINC000875232490	GD	On-Demand	Anodyne	HCRTR1	16	45
CCCCCCCNC(=O)C(=O)NCc1ccc(OC)cn1	ZINC000875232502	DD	On-Demand	Mild	PLA2G4B	63	33
CCCCCCCNC(=O)C(=O)NCc1ccc(OC)cn1	ZINC000875232502	DD	On-Demand	Mild	FAAH	22	41
CCCCCCCNC(=O)C(=O)NCc1ccc(OC)cn1	ZINC000875232502	DD	On-Demand	Mild	ASAH1	87	35
COC(=O)[C@@]1(C)CN(C(=O)NOCc2ccccc2)C[C@@H]1C	ZINC000875232503	DD	On-Demand	Anodyne	SLC12A5	62	37
CO[C@H]1CCN([C@@H]2CCC[C@@H]2NC(=O)NOCc2ccccc2)C1	ZINC000875232512	EE	On-Demand	Anodyne	SLC12A5	47	34
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CN(C(=O)C(=O)NCc1ccc(F)cn1)C2	ZINC000875232515	GD	On-Demand	Anodyne	GPR119	34	40
CN1CCC(CCNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875232528	FG	On-Demand	Anodyne	FKBP1A	28	43
CN1CCC(CCNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875232528	FG	On-Demand	Anodyne	SLC6A3	16	42
CN1CCC(CCNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875232529	FG	On-Demand	Anodyne	FKBP1A	28	43
CN1CCC(CCNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875232529	FG	On-Demand	Anodyne	SLC6A3	16	42
CN1CCC(CCNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875232530	FG	On-Demand	Anodyne	FKBP1A	28	43
CN1CCC(CCNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875232530	FG	On-Demand	Anodyne	SLC6A3	16	42
CN1CCC(CCNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875232531	FG	On-Demand	Anodyne	FKBP1A	28	43
CN1CCC(CCNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875232531	FG	On-Demand	Anodyne	SLC6A3	16	42
O=C(NCc1ccc(Cl)cn1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875232541	GF	On-Demand	Anodyne	C3AR1	38	43
O=C(NCc1ccc(Cl)cn1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875232542	GF	On-Demand	Anodyne	C3AR1	38	43
O=C(NOCc1ccccc1)N[C@@]12CCCC[C@H]1C2	ZINC000875232561	CF	On-Demand	Anodyne	FKBP1A	16	41
O=C(NOCc1ccccc1)N[C@@]12CCCC[C@H]1C2	ZINC000875232561	CF	On-Demand	Anodyne	SLC12A5	65	38
O=C(NOCc1ccccc1)N[C@]12CCCC[C@@H]1C2	ZINC000875232562	CF	On-Demand	Anodyne	FKBP1A	16	41
O=C(NOCc1ccccc1)N[C@]12CCCC[C@@H]1C2	ZINC000875232562	CF	On-Demand	Anodyne	SLC12A5	65	38
O=C(NOCc1ccccc1)N[C@@]12CCCC[C@@H]1C2	ZINC000875232563	CF	On-Demand	Anodyne	FKBP1A	16	41
O=C(NOCc1ccccc1)N[C@@]12CCCC[C@@H]1C2	ZINC000875232563	CF	On-Demand	Anodyne	SLC12A5	65	38
O=C(NOCc1ccccc1)N[C@]12CCCC[C@H]1C2	ZINC000875232564	CF	On-Demand	Anodyne	FKBP1A	16	41
O=C(NOCc1ccccc1)N[C@]12CCCC[C@H]1C2	ZINC000875232564	CF	On-Demand	Anodyne	SLC12A5	65	38
C[C@@]1(CO)CN(C(=O)NOCc2ccccc2)C[C@]1(C)CO	ZINC000875232577	DD	On-Demand	Anodyne	SLC12A5	69	38
CN1CCCC[C@H](N(C)C(=O)NOCc2ccccc2)C1=O	ZINC000875232601	DD	On-Demand	Anodyne	FKBP1A	52	45
CN1CCCC[C@H](N(C)C(=O)NOCc2ccccc2)C1=O	ZINC000875232601	DD	On-Demand	Anodyne	CELA1	19	40
CN1CCCC[C@H](N(C)C(=O)NOCc2ccccc2)C1=O	ZINC000875232601	DD	On-Demand	Anodyne	SIGMAR1	15	49
CN1CCCC[C@H](N(C)C(=O)NOCc2ccccc2)C1=O	ZINC000875232601	DD	On-Demand	Anodyne	CTSK	23	40
CN1CCCC[C@H](N(C)C(=O)NOCc2ccccc2)C1=O	ZINC000875232601	DD	On-Demand	Anodyne	PREP	45	42
CN1CCCC[C@H](N(C)C(=O)NOCc2ccccc2)C1=O	ZINC000875232601	DD	On-Demand	Anodyne	SLC12A5	68	39
CN1CCCC[C@@H](N(C)C(=O)NOCc2ccccc2)C1=O	ZINC000875232602	DD	On-Demand	Anodyne	FKBP1A	52	45
CN1CCCC[C@@H](N(C)C(=O)NOCc2ccccc2)C1=O	ZINC000875232602	DD	On-Demand	Anodyne	CELA1	19	40
CN1CCCC[C@@H](N(C)C(=O)NOCc2ccccc2)C1=O	ZINC000875232602	DD	On-Demand	Anodyne	SIGMAR1	15	49
CN1CCCC[C@@H](N(C)C(=O)NOCc2ccccc2)C1=O	ZINC000875232602	DD	On-Demand	Anodyne	CTSK	23	40
CN1CCCC[C@@H](N(C)C(=O)NOCc2ccccc2)C1=O	ZINC000875232602	DD	On-Demand	Anodyne	PREP	45	42
CN1CCCC[C@@H](N(C)C(=O)NOCc2ccccc2)C1=O	ZINC000875232602	DD	On-Demand	Anodyne	SLC12A5	68	39
O=C(NOCc1ccccc1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875232622	EF	On-Demand	Anodyne	GRIN2B	20	40
O=C(NOCc1ccccc1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875232622	EF	On-Demand	Anodyne	PREP	42	34
CN(C[C@H](O)CN(C)C(=O)OC(C)(C)C)C(=O)NOCc1ccccc1	ZINC000875232650	FD	On-Demand	Anodyne	CTSB	37	40
CN(C[C@H](O)CN(C)C(=O)OC(C)(C)C)C(=O)NOCc1ccccc1	ZINC000875232650	FD	On-Demand	Anodyne	PAPA1_CARPA	45	37
CN(C[C@H](O)CN(C)C(=O)OC(C)(C)C)C(=O)NOCc1ccccc1	ZINC000875232650	FD	On-Demand	Anodyne	CTSK	17	40
CN(C[C@H](O)CN(C)C(=O)OC(C)(C)C)C(=O)NOCc1ccccc1	ZINC000875232650	FD	On-Demand	Anodyne	CTSL	20	40
CN(C[C@H](O)CN(C)C(=O)OC(C)(C)C)C(=O)NOCc1ccccc1	ZINC000875232650	FD	On-Demand	Anodyne	CAPNS1	47	35
CN(C[C@H](O)CN(C)C(=O)OC(C)(C)C)C(=O)NOCc1ccccc1	ZINC000875232650	FD	On-Demand	Anodyne	CAPN2	44	33
CN(C[C@H](O)CN(C)C(=O)OC(C)(C)C)C(=O)NOCc1ccccc1	ZINC000875232650	FD	On-Demand	Anodyne	NPR	63	34
O=C(NCC1(OCCO)CCC(F)(F)CC1)NOCc1ccccc1	ZINC000875232665	FE	On-Demand	Anodyne	SLC12A5	44	33
O=C(NOCc1ccccc1)N1CCC(CCO)(CCO)CC1	ZINC000875232677	DD	On-Demand	Anodyne	GRIN2B	18	40
O=C(NOCc1ccccc1)N1CCC(CCO)(CCO)CC1	ZINC000875232677	DD	On-Demand	Anodyne	SLC12A5	68	38
O=CN1CCCN(C(=O)NOCc2ccccc2)CC1	ZINC000875232693	CC	On-Demand	Anodyne	PREP	36	40
O=CN1CCCN(C(=O)NOCc2ccccc2)CC1	ZINC000875232693	CC	On-Demand	Anodyne	TGM2	36	41
O=CN1CCCN(C(=O)NOCc2ccccc2)CC1	ZINC000875232693	CC	On-Demand	Anodyne	F13A1	29	41
O=CN1CCCN(C(=O)NOCc2ccccc2)CC1	ZINC000875232693	CC	On-Demand	Anodyne	SLC12A5	59	36
O=C(NCc1ccc(F)cn1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875232695	FE	On-Demand	Anodyne	C3AR1	36	43
O=C(NCc1ccc(F)cn1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875232696	FE	On-Demand	Anodyne	C3AR1	36	43
CC(C)(C)OC(=O)NCC1(NC(=O)NOCc2ccccc2)CCOCC1	ZINC000875232727	GE	On-Demand	Anodyne	SLC12A5	61	35
O=C(NOCc1ccccc1)N1CC2(CCCO2)C1	ZINC000875232728	CD	On-Demand	Anodyne	SLC12A5	73	37
CCCCCCCNC(=O)C(=O)NCc1ccc(Cl)cn1	ZINC000875232771	DE	On-Demand	Mild	ASAH1	91	36
O=C(NCCO)C1CCN(C(=O)NOCc2ccccc2)CC1	ZINC000875232779	DC	On-Demand	Anodyne	FKBP1A	17	40
O=C(NCCO)C1CCN(C(=O)NOCc2ccccc2)CC1	ZINC000875232779	DC	On-Demand	Anodyne	EPHX2	24	41
COCCN(CC1CCN(C)CC1)C(=O)NOCc1ccccc1	ZINC000875232791	EE	On-Demand	Anodyne	SIGMAR1	18	42
CC(=O)NC[C@@H]1CCCCN1C(=O)NOCc1ccccc1	ZINC000875232794	DD	On-Demand	Anodyne	F2	30	42
CC(=O)NC[C@@H]1CCCCN1C(=O)NOCc1ccccc1	ZINC000875232794	DD	On-Demand	Anodyne	NA	39	43
CC(=O)NC[C@@H]1CCCCN1C(=O)NOCc1ccccc1	ZINC000875232794	DD	On-Demand	Anodyne	ACE	38	42
CC(=O)NC[C@@H]1CCCCN1C(=O)NOCc1ccccc1	ZINC000875232794	DD	On-Demand	Anodyne	FKBP1A	62	52
CC(=O)NC[C@@H]1CCCCN1C(=O)NOCc1ccccc1	ZINC000875232794	DD	On-Demand	Anodyne	OPRM1	35	44
CC(=O)NC[C@@H]1CCCCN1C(=O)NOCc1ccccc1	ZINC000875232794	DD	On-Demand	Anodyne	OPRD1	18	44
CC(=O)NC[C@@H]1CCCCN1C(=O)NOCc1ccccc1	ZINC000875232794	DD	On-Demand	Anodyne	OPRK1	17	44
CC(=O)NC[C@@H]1CCCCN1C(=O)NOCc1ccccc1	ZINC000875232794	DD	On-Demand	Anodyne	CELA1	24	43
CC(=O)NC[C@@H]1CCCCN1C(=O)NOCc1ccccc1	ZINC000875232794	DD	On-Demand	Anodyne	HCRTR1	20	43
CC(=O)NC[C@@H]1CCCCN1C(=O)NOCc1ccccc1	ZINC000875232794	DD	On-Demand	Anodyne	CTRA_BOVIN	62	34
CC(=O)NC[C@@H]1CCCCN1C(=O)NOCc1ccccc1	ZINC000875232794	DD	On-Demand	Anodyne	TRY1_BOVIN	45	34
CC(=O)NC[C@@H]1CCCCN1C(=O)NOCc1ccccc1	ZINC000875232794	DD	On-Demand	Anodyne	CTSG	43	34
CC(=O)NC[C@@H]1CCCCN1C(=O)NOCc1ccccc1	ZINC000875232794	DD	On-Demand	Anodyne	CTSK	19	42
CC(=O)NC[C@@H]1CCCCN1C(=O)NOCc1ccccc1	ZINC000875232794	DD	On-Demand	Anodyne	DPP4	17	42
CC(=O)NC[C@@H]1CCCCN1C(=O)NOCc1ccccc1	ZINC000875232794	DD	On-Demand	Anodyne	PREP	66	45
CC(=O)NC[C@@H]1CCCCN1C(=O)NOCc1ccccc1	ZINC000875232794	DD	On-Demand	Anodyne	CELA2A	51	34
CC(=O)NC[C@@H]1CCCCN1C(=O)NOCc1ccccc1	ZINC000875232794	DD	On-Demand	Anodyne	LGMN	43	38
CC(=O)NC[C@@H]1CCCCN1C(=O)NOCc1ccccc1	ZINC000875232794	DD	On-Demand	Anodyne	SLC12A5	71	38
COC(=O)[C@@]1(OC)CCN(C(=O)NOCc2ccccc2)C1	ZINC000875232798	DD	On-Demand	Anodyne	SLC12A5	80	45
O=C(NOCc1ccccc1)N1C[C@@H]2CCC[C@]2(CO)C1	ZINC000875232801	CD	On-Demand	Anodyne	SLC12A5	59	36
O=C(NOCc1ccccc1)N[C@@H]1C[C@H](CO)C1	ZINC000875232802	CD	On-Demand	Anodyne	NAAA	32	40
O=C(NOCc1ccccc1)N[C@@H]1C[C@H](CO)C1	ZINC000875232802	CD	On-Demand	Anodyne	SLC12A5	47	33
O=C(NOCc1ccccc1)N1C[C@@H](O)C[C@H]1C1CC1	ZINC000875232814	CD	On-Demand	Anodyne	Q9NAW4_PLAFA	38	42
O=C(NOCc1ccccc1)N1C[C@H](O)C[C@H]1C1CC1	ZINC000875232815	CD	On-Demand	Anodyne	Q9NAW4_PLAFA	38	42
O=C(NOCc1ccccc1)N1C[C@@H](O)C[C@@H]1C1CC1	ZINC000875232816	CD	On-Demand	Anodyne	Q9NAW4_PLAFA	38	42
O=C(NOCc1ccccc1)N1C[C@H](O)C[C@@H]1C1CC1	ZINC000875232817	CD	On-Demand	Anodyne	Q9NAW4_PLAFA	38	42
COC(=O)[C@@]12C[C@@H](NC(=O)NOCc3ccccc3)C[C@@H]1C2	ZINC000875232818	DD	On-Demand	Anodyne	SLC12A5	66	38
O=C(NOCc1ccccc1)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875232824	CD	On-Demand	Anodyne	FKBP1A	20	40
O=C(NOCc1ccccc1)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875232824	CD	On-Demand	Anodyne	CELA1	19	40
O=C(NOCc1ccccc1)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875232824	CD	On-Demand	Anodyne	PREP	41	40
O=C1CCN(C(=O)NOCc2ccccc2)CCCCCCN1	ZINC000875232827	DE	On-Demand	Anodyne	SLC12A5	45	33
O=C(NCc1ccc(Cl)cn1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875232831	FE	On-Demand	Anodyne	F2	34	42
O=C(NCc1ccc(Cl)cn1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875232832	FE	On-Demand	Anodyne	F2	34	42
O=C(NCc1ccc(Cl)cn1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875232833	FE	On-Demand	Anodyne	F2	34	42
O=C(NCc1ccc(Cl)cn1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875232834	FE	On-Demand	Anodyne	F2	34	42
O=C(NOCc1ccccc1)N1CCc2nc(C3CC3)ncc2C1	ZINC000875232856	DF	On-Demand	Anodyne	MAPK1	15	40
CC(C)(C)OC(=O)NC1(CNC(=O)NOCc2ccccc2)CCOCC1	ZINC000875232902	GE	On-Demand	Anodyne	SLC12A5	45	33
O=C(NC[C@@H]1C[C@H](O)C1)NOCc1ccccc1	ZINC000875232911	CD	On-Demand	Anodyne	CAPN2	40	37
O=C(NC[C@@H]1C[C@H](O)C1)NOCc1ccccc1	ZINC000875232911	CD	On-Demand	Anodyne	NPR	40	32
O=C(NC[C@@H]1C[C@H](O)C1)NOCc1ccccc1	ZINC000875232911	CD	On-Demand	Anodyne	KDM1A	17	40
O=C(NCC1CC(O)C1)NOCc1ccccc1	ZINC000875232912	CD	On-Demand	Anodyne	CAPN2	40	37
O=C(NCC1CC(O)C1)NOCc1ccccc1	ZINC000875232912	CD	On-Demand	Anodyne	NPR	40	32
O=C(NCC1CC(O)C1)NOCc1ccccc1	ZINC000875232912	CD	On-Demand	Anodyne	KDM1A	17	40
O=C(NC[C@@H](O)[C@H]1CCCO1)NOCc1ccccc1	ZINC000875232916	CC	On-Demand	Anodyne	CAPN2	40	39
O=C(NC[C@@H](O)[C@@H]1CCCO1)NOCc1ccccc1	ZINC000875232917	CC	On-Demand	Anodyne	CAPN2	40	39
O=C(NC[C@H](O)[C@H]1CCCO1)NOCc1ccccc1	ZINC000875232918	CC	On-Demand	Anodyne	CAPN2	40	39
O=C(NC[C@H](O)[C@@H]1CCCO1)NOCc1ccccc1	ZINC000875232919	CC	On-Demand	Anodyne	CAPN2	40	39
COc1ccccc1[C@@H]1CN(C(=O)NCCc2ccc(NC(C)=O)cc2)CCO1	ZINC000875233041	GF	On-Demand	Anodyne	TSHR	52	31
COc1ccccc1[C@H]1CN(C(=O)NCCc2ccc(NC(C)=O)cc2)CCO1	ZINC000875233042	GF	On-Demand	Anodyne	TSHR	52	31
CC(C)(C)OC(=O)NCCCNC(=O)N[C@]12C[C@@H]1COC2(C)C	ZINC000875233093	ED	On-Demand	Anodyne	EPHX2	15	42
CC(C)(C)OC(=O)NCCCNC(=O)N[C@@]12C[C@@H]1COC2(C)C	ZINC000875233094	ED	On-Demand	Anodyne	EPHX2	15	42
CC(C)(C)OC(=O)NCCCNC(=O)N[C@]12C[C@H]1COC2(C)C	ZINC000875233095	ED	On-Demand	Anodyne	EPHX2	15	42
CC(C)(C)OC(=O)NCCCNC(=O)N[C@@]12C[C@H]1COC2(C)C	ZINC000875233096	ED	On-Demand	Anodyne	EPHX2	15	42
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(C(C)(C)O)cc1	ZINC000875233102	GG	On-Demand	Anodyne	MME	50	36
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(C(C)(C)O)cc1	ZINC000875233102	GG	On-Demand	Anodyne	CTSB	24	40
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(C(C)(C)O)cc1	ZINC000875233102	GG	On-Demand	Anodyne	CTSG	22	40
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(C(C)(C)O)cc1	ZINC000875233102	GG	On-Demand	Anodyne	CTRB1	36	40
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(C(C)(C)O)cc1	ZINC000875233102	GG	On-Demand	Anodyne	MMP3	48	39
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(C(C)(C)O)cc1	ZINC000875233102	GG	On-Demand	Anodyne	CELA2A	22	40
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(C(C)(C)O)cc1	ZINC000875233102	GG	On-Demand	Anodyne	FURIN	40	32
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(C(C)(C)O)cc1	ZINC000875233102	GG	On-Demand	Anodyne	CAPN2	52	38
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(C(C)(C)O)cc1	ZINC000875233102	GG	On-Demand	Anodyne	AMP1_PLAFQ	50	38
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(C(C)(C)O)cc1	ZINC000875233102	GG	On-Demand	Anodyne	PSMB5	34	42
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(C(C)(C)O)cc1	ZINC000875233102	GG	On-Demand	Anodyne	PDS	62	36
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(C(C)(C)O)cc1	ZINC000875233103	GG	On-Demand	Anodyne	MME	50	36
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(C(C)(C)O)cc1	ZINC000875233103	GG	On-Demand	Anodyne	CTSB	24	40
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(C(C)(C)O)cc1	ZINC000875233103	GG	On-Demand	Anodyne	CTSG	22	40
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(C(C)(C)O)cc1	ZINC000875233103	GG	On-Demand	Anodyne	CTRB1	36	40
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(C(C)(C)O)cc1	ZINC000875233103	GG	On-Demand	Anodyne	MMP3	48	39
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(C(C)(C)O)cc1	ZINC000875233103	GG	On-Demand	Anodyne	CELA2A	22	40
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(C(C)(C)O)cc1	ZINC000875233103	GG	On-Demand	Anodyne	FURIN	40	32
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(C(C)(C)O)cc1	ZINC000875233103	GG	On-Demand	Anodyne	CAPN2	52	38
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(C(C)(C)O)cc1	ZINC000875233103	GG	On-Demand	Anodyne	AMP1_PLAFQ	50	38
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(C(C)(C)O)cc1	ZINC000875233103	GG	On-Demand	Anodyne	PSMB5	34	42
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(C(C)(C)O)cc1	ZINC000875233103	GG	On-Demand	Anodyne	PDS	62	36
O=C(N[C@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NOCc2ccccc2)C1	ZINC000875233128	GD	On-Demand	Anodyne	PREP	54	43
O=C(N[C@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NOCc2ccccc2)C1	ZINC000875233128	GD	On-Demand	Anodyne	EPHX2	29	40
O=C(N[C@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NOCc2ccccc2)C1	ZINC000875233128	GD	On-Demand	Anodyne	DPP7	45	39
O=C(N[C@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NOCc2ccccc2)C1	ZINC000875233128	GD	On-Demand	Anodyne	BIRC2	23	43
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NOCc2ccccc2)C1	ZINC000875233129	GD	On-Demand	Anodyne	PREP	54	43
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NOCc2ccccc2)C1	ZINC000875233129	GD	On-Demand	Anodyne	EPHX2	29	40
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NOCc2ccccc2)C1	ZINC000875233129	GD	On-Demand	Anodyne	DPP7	45	39
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NOCc2ccccc2)C1	ZINC000875233129	GD	On-Demand	Anodyne	BIRC2	23	43
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NOCc2ccccc2)C1	ZINC000875233130	GD	On-Demand	Anodyne	PREP	54	43
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NOCc2ccccc2)C1	ZINC000875233130	GD	On-Demand	Anodyne	EPHX2	29	40
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NOCc2ccccc2)C1	ZINC000875233130	GD	On-Demand	Anodyne	DPP7	45	39
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NOCc2ccccc2)C1	ZINC000875233130	GD	On-Demand	Anodyne	BIRC2	23	43
O=C(N[C@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NOCc2ccccc2)C1	ZINC000875233131	GD	On-Demand	Anodyne	PREP	54	43
O=C(N[C@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NOCc2ccccc2)C1	ZINC000875233131	GD	On-Demand	Anodyne	EPHX2	29	40
O=C(N[C@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NOCc2ccccc2)C1	ZINC000875233131	GD	On-Demand	Anodyne	DPP7	45	39
O=C(N[C@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NOCc2ccccc2)C1	ZINC000875233131	GD	On-Demand	Anodyne	BIRC2	23	43
CC[C@@H](NC(=O)NOCc1ccccc1)[C@H](O)c1ccccc1	ZINC000875233166	DF	On-Demand	Anodyne	CTSB	50	39
CC[C@@H](NC(=O)NOCc1ccccc1)[C@H](O)c1ccccc1	ZINC000875233166	DF	On-Demand	Anodyne	PAPA1_CARPA	60	34
CC[C@@H](NC(=O)NOCc1ccccc1)[C@H](O)c1ccccc1	ZINC000875233166	DF	On-Demand	Anodyne	CTSK	28	41
CC[C@@H](NC(=O)NOCc1ccccc1)[C@H](O)c1ccccc1	ZINC000875233166	DF	On-Demand	Anodyne	CAPNS1	55	38
CC[C@@H](NC(=O)NOCc1ccccc1)[C@H](O)c1ccccc1	ZINC000875233166	DF	On-Demand	Anodyne	CAPN1	74	38
CC[C@@H](NC(=O)NOCc1ccccc1)[C@H](O)c1ccccc1	ZINC000875233166	DF	On-Demand	Anodyne	CAPN2	109	39
CC[C@@H](NC(=O)NOCc1ccccc1)[C@H](O)c1ccccc1	ZINC000875233166	DF	On-Demand	Anodyne	NPR	60	34
CC[C@@H](NC(=O)NOCc1ccccc1)[C@H](O)c1ccccc1	ZINC000875233166	DF	On-Demand	Anodyne	AOC3	15	41
CC[C@@H](NC(=O)NOCc1ccccc1)[C@@H](O)c1ccccc1	ZINC000875233168	DF	On-Demand	Anodyne	CTSB	50	39
CC[C@@H](NC(=O)NOCc1ccccc1)[C@@H](O)c1ccccc1	ZINC000875233168	DF	On-Demand	Anodyne	PAPA1_CARPA	60	34
CC[C@@H](NC(=O)NOCc1ccccc1)[C@@H](O)c1ccccc1	ZINC000875233168	DF	On-Demand	Anodyne	CTSK	28	41
CC[C@@H](NC(=O)NOCc1ccccc1)[C@@H](O)c1ccccc1	ZINC000875233168	DF	On-Demand	Anodyne	CAPNS1	55	38
CC[C@@H](NC(=O)NOCc1ccccc1)[C@@H](O)c1ccccc1	ZINC000875233168	DF	On-Demand	Anodyne	CAPN1	74	38
CC[C@@H](NC(=O)NOCc1ccccc1)[C@@H](O)c1ccccc1	ZINC000875233168	DF	On-Demand	Anodyne	CAPN2	109	39
CC[C@@H](NC(=O)NOCc1ccccc1)[C@@H](O)c1ccccc1	ZINC000875233168	DF	On-Demand	Anodyne	NPR	60	34
CC[C@@H](NC(=O)NOCc1ccccc1)[C@@H](O)c1ccccc1	ZINC000875233168	DF	On-Demand	Anodyne	AOC3	15	41
COCCSc1ccc([C@H](C)NC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)cc1	ZINC000875233176	GG	On-Demand	Anodyne	SLC6A4	19	42
COCCSc1ccc([C@H](C)NC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)cc1	ZINC000875233176	GG	On-Demand	Anodyne	SLC6A3	41	38
COCCSc1ccc([C@@H](C)NC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)cc1	ZINC000875233177	GG	On-Demand	Anodyne	SLC6A4	19	42
COCCSc1ccc([C@@H](C)NC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)cc1	ZINC000875233177	GG	On-Demand	Anodyne	SLC6A3	41	38
COCCSc1ccc([C@H](C)NC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)cc1	ZINC000875233178	GG	On-Demand	Anodyne	SLC6A4	19	42
COCCSc1ccc([C@H](C)NC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)cc1	ZINC000875233178	GG	On-Demand	Anodyne	SLC6A3	41	38
COCCSc1ccc([C@@H](C)NC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)cc1	ZINC000875233179	GG	On-Demand	Anodyne	SLC6A4	19	42
COCCSc1ccc([C@@H](C)NC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)cc1	ZINC000875233179	GG	On-Demand	Anodyne	SLC6A3	41	38
COCCSc1ccc([C@H](C)NC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875233216	GH	On-Demand	Anodyne	REN	16	42
COCCSc1ccc([C@@H](C)NC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875233217	GH	On-Demand	Anodyne	REN	16	42
COCCSc1ccc([C@H](C)NC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875233218	GH	On-Demand	Anodyne	REN	16	42
COCCSc1ccc([C@@H](C)NC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875233219	GH	On-Demand	Anodyne	REN	16	42
O=C(NCC[C@H](O)C1CCCC1)NOCc1ccccc1	ZINC000875233221	CE	On-Demand	Anodyne	ACE	21	40
O=C(NCC[C@H](O)C1CCCC1)NOCc1ccccc1	ZINC000875233221	CE	On-Demand	Anodyne	KLK3	58	33
O=C(NCC[C@H](O)C1CCCC1)NOCc1ccccc1	ZINC000875233221	CE	On-Demand	Anodyne	CTSB	40	42
O=C(NCC[C@H](O)C1CCCC1)NOCc1ccccc1	ZINC000875233221	CE	On-Demand	Anodyne	CYSP_TRYCR	33	40
O=C(NCC[C@H](O)C1CCCC1)NOCc1ccccc1	ZINC000875233221	CE	On-Demand	Anodyne	CTSK	31	42
O=C(NCC[C@H](O)C1CCCC1)NOCc1ccccc1	ZINC000875233221	CE	On-Demand	Anodyne	CTSL	35	42
O=C(NCC[C@H](O)C1CCCC1)NOCc1ccccc1	ZINC000875233221	CE	On-Demand	Anodyne	CAPNS1	53	36
O=C(NCC[C@H](O)C1CCCC1)NOCc1ccccc1	ZINC000875233221	CE	On-Demand	Anodyne	CAPN1	57	38
O=C(NCC[C@H](O)C1CCCC1)NOCc1ccccc1	ZINC000875233221	CE	On-Demand	Anodyne	CAPN2	98	36
O=C(NCC[C@H](O)C1CCCC1)NOCc1ccccc1	ZINC000875233221	CE	On-Demand	Anodyne	EPHX2	15	48
O=C(NCC[C@H](O)C1CCCC1)NOCc1ccccc1	ZINC000875233221	CE	On-Demand	Anodyne	NPR	58	40
O=C(NCC[C@@H](O)C1CCCC1)NOCc1ccccc1	ZINC000875233222	CE	On-Demand	Anodyne	ACE	21	40
O=C(NCC[C@@H](O)C1CCCC1)NOCc1ccccc1	ZINC000875233222	CE	On-Demand	Anodyne	KLK3	58	33
O=C(NCC[C@@H](O)C1CCCC1)NOCc1ccccc1	ZINC000875233222	CE	On-Demand	Anodyne	CTSB	40	42
O=C(NCC[C@@H](O)C1CCCC1)NOCc1ccccc1	ZINC000875233222	CE	On-Demand	Anodyne	CYSP_TRYCR	33	40
O=C(NCC[C@@H](O)C1CCCC1)NOCc1ccccc1	ZINC000875233222	CE	On-Demand	Anodyne	CTSK	31	42
O=C(NCC[C@@H](O)C1CCCC1)NOCc1ccccc1	ZINC000875233222	CE	On-Demand	Anodyne	CTSL	35	42
O=C(NCC[C@@H](O)C1CCCC1)NOCc1ccccc1	ZINC000875233222	CE	On-Demand	Anodyne	CAPNS1	53	36
O=C(NCC[C@@H](O)C1CCCC1)NOCc1ccccc1	ZINC000875233222	CE	On-Demand	Anodyne	CAPN1	57	38
O=C(NCC[C@@H](O)C1CCCC1)NOCc1ccccc1	ZINC000875233222	CE	On-Demand	Anodyne	CAPN2	98	36
O=C(NCC[C@@H](O)C1CCCC1)NOCc1ccccc1	ZINC000875233222	CE	On-Demand	Anodyne	EPHX2	15	48
O=C(NCC[C@@H](O)C1CCCC1)NOCc1ccccc1	ZINC000875233222	CE	On-Demand	Anodyne	NPR	58	40
O=C(NOCc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875233223	CC	On-Demand	Anodyne	GHRHR	57	35
O=C(NOCc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875233223	CC	On-Demand	Anodyne	SLC12A5	74	40
CC[C@@H](NC(=O)NCCc1ccc(NC(C)=O)cc1)[C@@H](O)c1ccccc1	ZINC000875233261	FF	On-Demand	Anodyne	ADRB2	16	40
CC[C@@H](NC(=O)NCCc1ccc(NC(C)=O)cc1)[C@@H](O)c1ccccc1	ZINC000875233261	FF	On-Demand	Anodyne	ADRB1	29	40
CC[C@@H](NC(=O)NCCc1ccc(NC(C)=O)cc1)[C@@H](O)c1ccccc1	ZINC000875233261	FF	On-Demand	Anodyne	ADRB3	50	40
CC[C@@H](NC(=O)NCCc1ccc(NC(C)=O)cc1)[C@@H](O)c1ccccc1	ZINC000875233261	FF	On-Demand	Anodyne	NPY5R	31	41
CC[C@@H](NC(=O)NCCc1ccc(NC(C)=O)cc1)[C@H](O)c1ccccc1	ZINC000875233263	FF	On-Demand	Anodyne	ADRB2	16	40
CC[C@@H](NC(=O)NCCc1ccc(NC(C)=O)cc1)[C@H](O)c1ccccc1	ZINC000875233263	FF	On-Demand	Anodyne	ADRB1	29	40
CC[C@@H](NC(=O)NCCc1ccc(NC(C)=O)cc1)[C@H](O)c1ccccc1	ZINC000875233263	FF	On-Demand	Anodyne	ADRB3	50	40
CC[C@@H](NC(=O)NCCc1ccc(NC(C)=O)cc1)[C@H](O)c1ccccc1	ZINC000875233263	FF	On-Demand	Anodyne	NPY5R	31	41
O=C(NOCc1ccccc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875233287	DE	On-Demand	Anodyne	SLC12A5	43	33
O=C(NOCc1ccccc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875233288	DE	On-Demand	Anodyne	SLC12A5	43	33
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](c2ccccc2)c2nccs2)C1	ZINC000875233319	FG	On-Demand	Anodyne	P2RY12	21	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](c2ccccc2)c2nccs2)C1	ZINC000875233320	FG	On-Demand	Anodyne	P2RY12	21	41
Cc1csc([C@H]2CCN(C(=O)N[C@H](c3ccccc3)c3nccs3)C2)n1	ZINC000875233361	GI	On-Demand	Anodyne	BIRC8	45	34
O=C(NCC1CCC(F)(F)CC1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875233389	GF	On-Demand	Anodyne	F2	20	41
O=C(NCC1CCC(F)(F)CC1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875233390	GF	On-Demand	Anodyne	F2	20	41
O=C(NCC1CCC(F)(F)CC1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875233391	GF	On-Demand	Anodyne	F2	20	41
O=C(NCC1CCC(F)(F)CC1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875233392	GF	On-Demand	Anodyne	F2	20	41
CC(=O)Nc1ccc(CCNC(=O)N[C@H](C)c2ccccc2O)cc1	ZINC000875233404	EF	On-Demand	Clean	ADRB1	17	40
CC(=O)Nc1ccc(CCNC(=O)N[C@H](C)c2ccccc2O)cc1	ZINC000875233404	EF	On-Demand	Clean	ADRB3	20	40
CC(=O)Nc1ccc(CCNC(=O)N[C@H](C)c2ccccc2O)cc1	ZINC000875233404	EF	On-Demand	Clean	CA1	17	43
CC(=O)Nc1ccc(CCNC(=O)N[C@H](C)c2ccccc2O)cc1	ZINC000875233404	EF	On-Demand	Clean	NCE103	16	45
CC(=O)Nc1ccc(CCNC(=O)N[C@@H](C)c2ccccc2O)cc1	ZINC000875233405	EF	On-Demand	Clean	ADRB1	17	40
CC(=O)Nc1ccc(CCNC(=O)N[C@@H](C)c2ccccc2O)cc1	ZINC000875233405	EF	On-Demand	Clean	ADRB3	20	40
CC(=O)Nc1ccc(CCNC(=O)N[C@@H](C)c2ccccc2O)cc1	ZINC000875233405	EF	On-Demand	Clean	CA1	17	43
CC(=O)Nc1ccc(CCNC(=O)N[C@@H](C)c2ccccc2O)cc1	ZINC000875233405	EF	On-Demand	Clean	NCE103	16	45
CC(=O)Nc1ccc(CCNC(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875233430	EE	On-Demand	Anodyne	EPHX2	19	42
CC(=O)Nc1ccc(CCNC(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875233430	EE	On-Demand	Anodyne	DPP7	41	37
CC(=O)Nc1ccc(CCNC(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875233430	EE	On-Demand	Anodyne	GPBAR1	24	41
CC(=O)Nc1ccc(CCNC(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875233431	EE	On-Demand	Anodyne	EPHX2	19	42
CC(=O)Nc1ccc(CCNC(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875233431	EE	On-Demand	Anodyne	DPP7	41	37
CC(=O)Nc1ccc(CCNC(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875233431	EE	On-Demand	Anodyne	GPBAR1	24	41
CC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)c2nccs2)CC1	ZINC000875233452	EG	On-Demand	Anodyne	BIRC8	44	34
CC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)c2nccs2)CC1	ZINC000875233453	EG	On-Demand	Anodyne	BIRC8	44	34
CCCCCCCNC(=O)C(=O)NCc1ccc(F)cn1	ZINC000875233468	CD	On-Demand	Mild	ASAH1	93	38
CC(=O)Nc1ccc(CCNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875233512	FD	On-Demand	Anodyne	CCR3	32	41
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)C(=O)NCc1cccc(F)c1F	ZINC000875233533	FD	On-Demand	Anodyne	PAPA1_CARPA	31	44
CONC(=O)C1CCN(C(=O)NCCc2ccc(NC(C)=O)cc2)CC1	ZINC000875233552	FD	On-Demand	Anodyne	EPHX2	25	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)c1nccs1	ZINC000875233558	FF	On-Demand	Anodyne	SLC6A4	17	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)c1nccs1	ZINC000875233558	FF	On-Demand	Anodyne	SLC6A3	37	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)c1nccs1	ZINC000875233558	FF	On-Demand	Anodyne	BIRC8	43	31
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)c1nccs1	ZINC000875233560	FF	On-Demand	Anodyne	SLC6A4	17	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)c1nccs1	ZINC000875233560	FF	On-Demand	Anodyne	SLC6A3	37	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)c1nccs1	ZINC000875233560	FF	On-Demand	Anodyne	BIRC8	43	31
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)c1nccs1	ZINC000875233561	FF	On-Demand	Anodyne	SLC6A4	17	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)c1nccs1	ZINC000875233561	FF	On-Demand	Anodyne	SLC6A3	37	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)c1nccs1	ZINC000875233561	FF	On-Demand	Anodyne	BIRC8	43	31
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)c1nccs1	ZINC000875233562	FF	On-Demand	Anodyne	SLC6A4	17	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)c1nccs1	ZINC000875233562	FF	On-Demand	Anodyne	SLC6A3	37	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)c1nccs1	ZINC000875233562	FF	On-Demand	Anodyne	BIRC8	43	31
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(C(C)(C)O)cc2)C1	ZINC000875233583	ED	On-Demand	Anodyne	DPP7	54	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(C(C)(C)O)cc2)C1	ZINC000875233584	ED	On-Demand	Anodyne	DPP7	54	35
CONC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)c2nccs2)CC1	ZINC000875233614	FE	On-Demand	Anodyne	BIRC8	44	32
CONC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)c2nccs2)CC1	ZINC000875233615	FE	On-Demand	Anodyne	BIRC8	44	32
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2cn(C)nc2-c2ccccc2)C1	ZINC000875233681	FD	On-Demand	Anodyne	SLC6A1	51	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2cn(C)nc2-c2ccccc2)C1	ZINC000875233682	FD	On-Demand	Anodyne	SLC6A1	51	32
CC(=O)Nc1ccc(CCNC(=O)N2CC[C@](C)(C(F)(F)F)C2)cc1	ZINC000875233708	FG	On-Demand	Anodyne	EPHX2	42	47
CC(=O)Nc1ccc(CCNC(=O)N2CC[C@@](C)(C(F)(F)F)C2)cc1	ZINC000875233709	FG	On-Demand	Anodyne	EPHX2	42	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccc(NC(C)=O)cc1	ZINC000875233711	FD	On-Demand	Anodyne	SLC6A4	20	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccc(NC(C)=O)cc1	ZINC000875233711	FD	On-Demand	Anodyne	SLC6A3	40	46
O=C(NOCc1ccccc1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875233716	ED	On-Demand	Anodyne	RBP4	45	34
CC(=O)Nc1ccc(CCNC(=O)N2CCC(C)(N3CCCCC3)CC2)cc1	ZINC000875233750	GG	On-Demand	Anodyne	EPHX2	18	45
CC[C@@H]1COCCN1CCNC(=O)NCCc1ccc(NC(C)=O)cc1	ZINC000875233754	FD	On-Demand	Anodyne	MTOR	50	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NOCc1ccccc1	ZINC000875233775	DD	On-Demand	Anodyne	SLC6A4	32	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NOCc1ccccc1	ZINC000875233775	DD	On-Demand	Anodyne	SLC6A3	68	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NOCc1ccccc1	ZINC000875233776	DD	On-Demand	Anodyne	SLC6A4	32	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NOCc1ccccc1	ZINC000875233776	DD	On-Demand	Anodyne	SLC6A3	68	48
O=C(NCc1ccccc1-c1ccc(Cn2ccnc2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875233800	GG	On-Demand	Anodyne	CYP19A1	18	45
O=C(NCc1ccccc1-c1ccc(Cn2ccnc2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875233800	GG	On-Demand	Anodyne	CYP11B1	48	47
O=C(NCc1ccccc1-c1ccc(Cn2ccnc2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875233800	GG	On-Demand	Anodyne	CYP11B2	24	47
CCC1(CC)CCCN1C(=O)NCCc1ccc(NC(C)=O)cc1	ZINC000875233805	EH	On-Demand	Anodyne	SLC12A5	49	37
CCCCCCCNC(=O)C(=O)NCC1CCC(F)(F)CC1	ZINC000875233830	DG	On-Demand	Mild	EPHX2	18	41
CCCCCCCNC(=O)C(=O)NCC1CCC(F)(F)CC1	ZINC000875233830	DG	On-Demand	Mild	ASAH1	74	37
COC(=O)C1(O)CN(C(=O)NOCc2ccccc2)C1	ZINC000875233834	CC	On-Demand	Anodyne	SLC12A5	75	44
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCc2ccc(NC(C)=O)cc2)C1	ZINC000875233844	EE	On-Demand	Anodyne	TSHR	48	33
C[C@@H](NC(=O)NCCCNC(=O)OC(C)(C)C)[C@H](O)C(F)(F)F	ZINC000875233868	ED	On-Demand	Anodyne	CTSK	16	45
C[C@H](NC(=O)NCCCNC(=O)OC(C)(C)C)[C@@H](O)C(F)(F)F	ZINC000875233870	ED	On-Demand	Anodyne	CTSK	16	45
C[C@H](NC(=O)NCCCNC(=O)OC(C)(C)C)[C@H](O)C(F)(F)F	ZINC000875233872	ED	On-Demand	Anodyne	CTSK	16	45
C[C@@H](NC(=O)NCCCNC(=O)OC(C)(C)C)[C@@H](O)C(F)(F)F	ZINC000875233873	ED	On-Demand	Anodyne	CTSK	16	45
CC1(C)CCC[C@H](NC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)C1	ZINC000875233898	GG	On-Demand	Anodyne	ETHR	43	45
CC(=O)Nc1ccc(CCNC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875233934	EF	On-Demand	Clean	CFTR	41	35
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)NCC1CCC(F)(F)CC1	ZINC000875233943	GF	On-Demand	Anodyne	ROCK1	21	41
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)NCC1CCC(F)(F)CC1	ZINC000875233943	GF	On-Demand	Anodyne	ROCK2	15	41
COCCSc1ccc([C@@H](C)NC(=O)NN(C)C(=O)OC)cc1	ZINC000875233960	EE	On-Demand	Reactive	ACACA	17	42
COCCSc1ccc([C@H](C)NC(=O)NN(C)C(=O)OC)cc1	ZINC000875233961	EE	On-Demand	Reactive	ACACA	17	42
CCCCCCCNC(=O)C(=O)NCc1ccc(C(C)(C)O)cc1	ZINC000875233962	EF	On-Demand	Mild	TRPV1	22	40
CCCCCCCNC(=O)C(=O)NCc1ccc(C(C)(C)O)cc1	ZINC000875233962	EF	On-Demand	Mild	S1PR3	21	40
CCCCCCCNC(=O)C(=O)NCc1ccc(C(C)(C)O)cc1	ZINC000875233962	EF	On-Demand	Mild	S1PR2	52	40
CCCCCCCNC(=O)C(=O)NCc1ccc(C(C)(C)O)cc1	ZINC000875233962	EF	On-Demand	Mild	ASAH1	88	37
CC[C@H](C[C@H](C)O)NC(=O)NCCc1ccc(NC(C)=O)cc1	ZINC000875233975	DE	On-Demand	Anodyne	ADRB1	18	42
CC[C@H](C[C@H](C)O)NC(=O)NCCc1ccc(NC(C)=O)cc1	ZINC000875233975	DE	On-Demand	Anodyne	ADRB3	17	42
CC[C@@H]1COCCN1CCNC(=O)NOCc1ccccc1	ZINC000875234067	DD	On-Demand	Anodyne	CAPN1	18	41
CC[C@@H]1COCCN1CCNC(=O)NOCc1ccccc1	ZINC000875234067	DD	On-Demand	Anodyne	CAPN2	32	41
CC(=O)Nc1ccc(CCNC(=O)N2CCC[C@H](OC3CCC3)CC2)cc1	ZINC000875234080	FG	On-Demand	Anodyne	EPHX2	32	40
CC(=O)Nc1ccc(CCNC(=O)N2CCC[C@@H](OC3CCC3)CC2)cc1	ZINC000875234081	FG	On-Demand	Anodyne	EPHX2	32	40
CC(=O)Nc1ccc(CCNC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875234088	ED	On-Demand	Anodyne	NPY2R	24	43
CC(=O)Nc1ccc(CCNC(=O)N2CCC(N3CCN(C)CC3)CC2)cc1	ZINC000875234089	GD	On-Demand	Anodyne	L3MBTL3	102	42
CC(=O)Nc1ccc(CCNC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875234090	ED	On-Demand	Anodyne	NPY2R	24	43
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](c2ccccc2)c2nccs2)C1	ZINC000875234115	EG	On-Demand	Anodyne	BIRC8	45	34
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](c2ccccc2)c2nccs2)C1	ZINC000875234116	EG	On-Demand	Anodyne	BIRC8	45	34
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](c2ccccc2)c2nccs2)C1	ZINC000875234117	EG	On-Demand	Anodyne	BIRC8	45	34
CC(=O)[C@H]1CCCN(C(=O)N[C@H](c2ccccc2)c2nccs2)C1	ZINC000875234119	EG	On-Demand	Anodyne	BIRC8	45	34
CC[C@H](C[C@H](C)O)NC(=O)NOCc1ccccc1	ZINC000875234122	CD	On-Demand	Anodyne	MME	67	39
CC[C@H](C[C@H](C)O)NC(=O)NOCc1ccccc1	ZINC000875234122	CD	On-Demand	Anodyne	ANPEP	57	36
CC[C@H](C[C@H](C)O)NC(=O)NOCc1ccccc1	ZINC000875234122	CD	On-Demand	Anodyne	BMP1	16	41
CC[C@H](C[C@H](C)O)NC(=O)NOCc1ccccc1	ZINC000875234122	CD	On-Demand	Anodyne	KLK3	74	35
CC[C@H](C[C@H](C)O)NC(=O)NOCc1ccccc1	ZINC000875234122	CD	On-Demand	Anodyne	CTSB	63	41
CC[C@H](C[C@H](C)O)NC(=O)NOCc1ccccc1	ZINC000875234122	CD	On-Demand	Anodyne	PAPA1_CARPA	78	39
CC[C@H](C[C@H](C)O)NC(=O)NOCc1ccccc1	ZINC000875234122	CD	On-Demand	Anodyne	CTSK	38	46
CC[C@H](C[C@H](C)O)NC(=O)NOCc1ccccc1	ZINC000875234122	CD	On-Demand	Anodyne	CTSL	36	40
CC[C@H](C[C@H](C)O)NC(=O)NOCc1ccccc1	ZINC000875234122	CD	On-Demand	Anodyne	CAPNS1	66	42
CC[C@H](C[C@H](C)O)NC(=O)NOCc1ccccc1	ZINC000875234122	CD	On-Demand	Anodyne	CAPN1	91	43
CC[C@H](C[C@H](C)O)NC(=O)NOCc1ccccc1	ZINC000875234122	CD	On-Demand	Anodyne	CAPN2	130	43
CC[C@H](C[C@H](C)O)NC(=O)NOCc1ccccc1	ZINC000875234122	CD	On-Demand	Anodyne	ACE2	49	37
CC[C@H](C[C@H](C)O)NC(=O)NOCc1ccccc1	ZINC000875234122	CD	On-Demand	Anodyne	NPR	83	38
CC[C@H](C[C@H](C)O)NC(=O)NOCc1ccccc1	ZINC000875234122	CD	On-Demand	Anodyne	PSMB5	40	41
CC[C@H](C[C@H](C)O)NC(=O)NOCc1ccccc1	ZINC000875234122	CD	On-Demand	Anodyne	PDS	48	35
CC(=O)Nc1ccc(CCNC(=O)N2CCC[C@](O)(c3ccccc3)C2)cc1	ZINC000875234132	GF	On-Demand	Anodyne	EPHX2	25	60
CC(=O)Nc1ccc(CCNC(=O)N2CCC[C@](O)(c3ccccc3)C2)cc1	ZINC000875234132	GF	On-Demand	Anodyne	SLC12A5	46	36
CC(=O)Nc1ccc(CCNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)cc1	ZINC000875234134	GF	On-Demand	Anodyne	EPHX2	25	60
CC(=O)Nc1ccc(CCNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)cc1	ZINC000875234134	GF	On-Demand	Anodyne	SLC12A5	46	36
O=C(NCCCCCCc1ccccc1)C(=O)NCc1ccc(F)cn1	ZINC000875234135	FF	On-Demand	Anodyne	FAAH	72	40
O=C(NCCCCCCc1ccccc1)C(=O)NCc1ccc(F)cn1	ZINC000875234135	FF	On-Demand	Anodyne	CES1	70	38
O=C(NCCCCCCc1ccccc1)C(=O)NCc1ccc(F)cn1	ZINC000875234135	FF	On-Demand	Anodyne	AMP1_PLAFQ	32	44
O=C(NCCCCCCc1ccccc1)C(=O)NCc1ccc(F)cn1	ZINC000875234135	FF	On-Demand	Anodyne	CES1D	45	33
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875234338	GF	On-Demand	Anodyne	F2	34	44
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875234338	GF	On-Demand	Anodyne	PLG	21	44
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875234338	GF	On-Demand	Anodyne	PRSS1	18	41
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875234338	GF	On-Demand	Anodyne	ACE	31	41
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875234338	GF	On-Demand	Anodyne	FKBP1A	34	41
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875234338	GF	On-Demand	Anodyne	ELANE	17	40
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875234338	GF	On-Demand	Anodyne	TRY1_BOVIN	53	44
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875234338	GF	On-Demand	Anodyne	PREP	34	43
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875234338	GF	On-Demand	Anodyne	REN	41	36
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875234339	GF	On-Demand	Anodyne	F2	34	44
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875234339	GF	On-Demand	Anodyne	PLG	21	44
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875234339	GF	On-Demand	Anodyne	PRSS1	18	41
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875234339	GF	On-Demand	Anodyne	ACE	31	41
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875234339	GF	On-Demand	Anodyne	FKBP1A	34	41
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875234339	GF	On-Demand	Anodyne	ELANE	17	40
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875234339	GF	On-Demand	Anodyne	TRY1_BOVIN	53	44
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875234339	GF	On-Demand	Anodyne	PREP	34	43
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875234339	GF	On-Demand	Anodyne	REN	41	36
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875234340	GF	On-Demand	Anodyne	F2	34	44
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875234340	GF	On-Demand	Anodyne	PLG	21	44
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875234340	GF	On-Demand	Anodyne	PRSS1	18	41
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875234340	GF	On-Demand	Anodyne	ACE	31	41
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875234340	GF	On-Demand	Anodyne	FKBP1A	34	41
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875234340	GF	On-Demand	Anodyne	ELANE	17	40
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875234340	GF	On-Demand	Anodyne	TRY1_BOVIN	53	44
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875234340	GF	On-Demand	Anodyne	PREP	34	43
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875234340	GF	On-Demand	Anodyne	REN	41	36
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875234341	GF	On-Demand	Anodyne	F2	34	44
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875234341	GF	On-Demand	Anodyne	PLG	21	44
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875234341	GF	On-Demand	Anodyne	PRSS1	18	41
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875234341	GF	On-Demand	Anodyne	ACE	31	41
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875234341	GF	On-Demand	Anodyne	FKBP1A	34	41
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875234341	GF	On-Demand	Anodyne	ELANE	17	40
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875234341	GF	On-Demand	Anodyne	TRY1_BOVIN	53	44
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875234341	GF	On-Demand	Anodyne	PREP	34	43
CC(C)(C)OC(=O)NCCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875234341	GF	On-Demand	Anodyne	REN	41	36
CC(=O)Nc1ccc(CCNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875234343	GF	On-Demand	Anodyne	ADRB2	28	43
CC(=O)Nc1ccc(CCNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875234343	GF	On-Demand	Anodyne	ADRB1	67	49
CC(=O)Nc1ccc(CCNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875234343	GF	On-Demand	Anodyne	ADRB3	60	49
CC(=O)Nc1ccc(CCNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875234344	GF	On-Demand	Anodyne	ADRB2	28	43
CC(=O)Nc1ccc(CCNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875234344	GF	On-Demand	Anodyne	ADRB1	67	49
CC(=O)Nc1ccc(CCNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875234344	GF	On-Demand	Anodyne	ADRB3	60	49
COCCSc1ccc([C@H](C)NC(=O)NC2CC(C(=O)OC)C2)cc1	ZINC000875234354	FF	On-Demand	Anodyne	ACACA	15	40
COCCSc1ccc([C@@H](C)NC(=O)NC2CC(C(=O)OC)C2)cc1	ZINC000875234355	FF	On-Demand	Anodyne	ACACA	15	40
CC(C)(C)OC(=O)NCCCNC(=O)N[C@@]12CCCC[C@H]1C2	ZINC000875234356	DF	On-Demand	Anodyne	EPHX2	21	44
CC(C)(C)OC(=O)NCCCNC(=O)N[C@]12CCCC[C@H]1C2	ZINC000875234357	DF	On-Demand	Anodyne	EPHX2	21	44
CC(C)(C)OC(=O)NCCCNC(=O)N[C@@]12CCCC[C@@H]1C2	ZINC000875234358	DF	On-Demand	Anodyne	EPHX2	21	44
CC(C)(C)OC(=O)NCCCNC(=O)N[C@]12CCCC[C@@H]1C2	ZINC000875234359	DF	On-Demand	Anodyne	EPHX2	21	44
CCCCCCCNC(=O)C(=O)NCc1nnc(C)s1	ZINC000875234383	CD	On-Demand	Mild	ASAH1	72	35
COCC(C)(C)CCNC(=O)C(=O)NCc1ccc(OC)cc1C	ZINC000875234384	ED	On-Demand	Anodyne	MTNR1A	43	36
O=C(NC[C@H]1C[C@H](O)C1)NOCc1ccccc1	ZINC000875234389	CD	On-Demand	Anodyne	CAPN2	40	37
O=C(NC[C@H]1C[C@H](O)C1)NOCc1ccccc1	ZINC000875234389	CD	On-Demand	Anodyne	NPR	40	32
O=C(NC[C@H]1C[C@H](O)C1)NOCc1ccccc1	ZINC000875234389	CD	On-Demand	Anodyne	KDM1A	17	40
CCOC(=O)[C@H](C)C1CN(C(=O)NOCc2ccccc2)C1	ZINC000875234390	DD	On-Demand	Anodyne	ACE	53	43
CCOC(=O)[C@H](C)C1CN(C(=O)NOCc2ccccc2)C1	ZINC000875234390	DD	On-Demand	Anodyne	CELA1	18	40
CCOC(=O)[C@H](C)C1CN(C(=O)NOCc2ccccc2)C1	ZINC000875234390	DD	On-Demand	Anodyne	KLK3	40	30
CCOC(=O)[C@H](C)C1CN(C(=O)NOCc2ccccc2)C1	ZINC000875234390	DD	On-Demand	Anodyne	CTSK	40	39
CCOC(=O)[C@H](C)C1CN(C(=O)NOCc2ccccc2)C1	ZINC000875234390	DD	On-Demand	Anodyne	CAPNS1	54	37
CCOC(=O)[C@H](C)C1CN(C(=O)NOCc2ccccc2)C1	ZINC000875234390	DD	On-Demand	Anodyne	CAPN1	54	40
CCOC(=O)[C@H](C)C1CN(C(=O)NOCc2ccccc2)C1	ZINC000875234390	DD	On-Demand	Anodyne	CAPN2	71	38
CCOC(=O)[C@H](C)C1CN(C(=O)NOCc2ccccc2)C1	ZINC000875234390	DD	On-Demand	Anodyne	NPR	58	38
CCOC(=O)[C@H](C)C1CN(C(=O)NOCc2ccccc2)C1	ZINC000875234390	DD	On-Demand	Anodyne	Q6PRC7_IXORI	44	37
CC(=O)Nc1ccc(CCNC(=O)N2CCc3ccc(NC(C)=O)cc3C2)cc1	ZINC000875234393	GF	On-Demand	Anodyne	NOD2	41	34
CC(=O)Nc1ccc(CCNC(=O)N2CCc3cccc(NC(C)=O)c3C2)cc1	ZINC000875234406	GF	On-Demand	Anodyne	NOD2	43	36
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)C(=O)N[C@@H](CF)c1ccc(F)cc1	ZINC000875234410	GD	On-Demand	Anodyne	PAPA1_CARPA	31	42
C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)C(=O)N[C@H](CF)c1ccc(F)cc1	ZINC000875234412	GD	On-Demand	Anodyne	PAPA1_CARPA	31	42
COC(=O)[C@@]12C[C@@H](NC(=O)NCCc3ccc(NC(C)=O)cc3)C[C@@H]1C2	ZINC000875234419	FD	On-Demand	Anodyne	EPHX2	22	40
O=C(Nc1cc(Cl)ccc1F)[C@@H]1CC(=O)N(Cc2ccccc2Cl)C1	ZINC000875234449	GI	On-Demand	Anodyne	P2RX7	72	59
O=C(Nc1cc(Cl)ccc1F)[C@H]1CC(=O)N(Cc2ccccc2Cl)C1	ZINC000875234450	GI	On-Demand	Anodyne	P2RX7	72	59
CC(=O)Nc1ccc(CCNC(=O)N2CCC3(CCN(C)CC3)CC2)cc1	ZINC000875234462	FF	On-Demand	Anodyne	EPHX2	24	43
COC[C@@H](NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)c1ccco1	ZINC000875234467	FE	On-Demand	Anodyne	OXTR	40	34
COC[C@@H](NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)c1ccco1	ZINC000875234467	FE	On-Demand	Anodyne	GHRHR	43	43
COC[C@H](NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)c1ccco1	ZINC000875234468	FE	On-Demand	Anodyne	OXTR	40	34
COC[C@H](NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)c1ccco1	ZINC000875234468	FE	On-Demand	Anodyne	GHRHR	43	43
COC[C@@H](NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)c1ccco1	ZINC000875234469	FE	On-Demand	Anodyne	OXTR	40	34
COC[C@@H](NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)c1ccco1	ZINC000875234469	FE	On-Demand	Anodyne	GHRHR	43	43
COC[C@H](NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)c1ccco1	ZINC000875234470	FE	On-Demand	Anodyne	OXTR	40	34
COC[C@H](NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)c1ccco1	ZINC000875234470	FE	On-Demand	Anodyne	GHRHR	43	43
CC(=O)Nc1ccc(CCNC(=O)N2CCN(c3ccc(C#N)cc3)CC2)cc1	ZINC000875234484	GF	On-Demand	Mild	CTSK	28	44
CC(=O)Nc1ccc(CCNC(=O)N2CCN(c3ccc(C#N)cc3)CC2)cc1	ZINC000875234484	GF	On-Demand	Mild	GPBAR1	30	41
CC(=O)Nc1ccc(CCNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875234485	GG	On-Demand	Anodyne	FKBP1A	52	42
CC(=O)Nc1ccc(CCNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875234485	GG	On-Demand	Anodyne	ADRB3	58	37
CC(=O)Nc1ccc(CCNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875234485	GG	On-Demand	Anodyne	CCR5	15	45
CC(=O)Nc1ccc(CCNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875234486	GG	On-Demand	Anodyne	FKBP1A	52	42
CC(=O)Nc1ccc(CCNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875234486	GG	On-Demand	Anodyne	ADRB3	58	37
CC(=O)Nc1ccc(CCNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875234486	GG	On-Demand	Anodyne	CCR5	15	45
CC(=O)Nc1ccc(CCNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875234487	GG	On-Demand	Anodyne	FKBP1A	52	42
CC(=O)Nc1ccc(CCNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875234487	GG	On-Demand	Anodyne	ADRB3	58	37
CC(=O)Nc1ccc(CCNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875234487	GG	On-Demand	Anodyne	CCR5	15	45
CC(=O)Nc1ccc(CCNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875234488	GG	On-Demand	Anodyne	FKBP1A	52	42
CC(=O)Nc1ccc(CCNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875234488	GG	On-Demand	Anodyne	ADRB3	58	37
CC(=O)Nc1ccc(CCNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875234488	GG	On-Demand	Anodyne	CCR5	15	45
CC(=O)Nc1ccc(CCNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875234558	GG	On-Demand	Anodyne	FKBP1A	30	42
CC(=O)Nc1ccc(CCNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875234558	GG	On-Demand	Anodyne	OPRM1	16	41
CC(=O)Nc1ccc(CCNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875234558	GG	On-Demand	Anodyne	ADRB3	63	37
CC(=O)Nc1ccc(CCNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875234558	GG	On-Demand	Anodyne	XIAP	24	40
CC(=O)Nc1ccc(CCNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875234559	GG	On-Demand	Anodyne	FKBP1A	30	42
CC(=O)Nc1ccc(CCNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875234559	GG	On-Demand	Anodyne	OPRM1	16	41
CC(=O)Nc1ccc(CCNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875234559	GG	On-Demand	Anodyne	ADRB3	63	37
CC(=O)Nc1ccc(CCNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875234559	GG	On-Demand	Anodyne	XIAP	24	40
CC(=O)Nc1ccc(CCNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875234560	GG	On-Demand	Anodyne	FKBP1A	30	42
CC(=O)Nc1ccc(CCNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875234560	GG	On-Demand	Anodyne	OPRM1	16	41
CC(=O)Nc1ccc(CCNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875234560	GG	On-Demand	Anodyne	ADRB3	63	37
CC(=O)Nc1ccc(CCNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875234560	GG	On-Demand	Anodyne	XIAP	24	40
CC(=O)Nc1ccc(CCNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875234561	GG	On-Demand	Anodyne	FKBP1A	30	42
CC(=O)Nc1ccc(CCNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875234561	GG	On-Demand	Anodyne	OPRM1	16	41
CC(=O)Nc1ccc(CCNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875234561	GG	On-Demand	Anodyne	ADRB3	63	37
CC(=O)Nc1ccc(CCNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875234561	GG	On-Demand	Anodyne	XIAP	24	40
O=C(NCC1CCC(F)(F)CC1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875234606	GG	On-Demand	Anodyne	C3AR1	36	42
O=C(NCC1CCC(F)(F)CC1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875234607	GG	On-Demand	Anodyne	C3AR1	36	42
CC(=O)Nc1ccc(CCNC(=O)N2CCO[C@](C)(C(F)(F)F)C2)cc1	ZINC000875234612	FF	On-Demand	Anodyne	EPHX2	36	43
CC(=O)Nc1ccc(CCNC(=O)N2CCO[C@@](C)(C(F)(F)F)C2)cc1	ZINC000875234613	FF	On-Demand	Anodyne	EPHX2	36	43
COCCOc1c(Cl)cccc1NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875234626	GH	On-Demand	Anodyne	G2YM83_BOTF4	51	32
CC(=O)Nc1ccc(CCNC(=O)NCc2cc(C)ccc2O)cc1	ZINC000875234629	EF	On-Demand	Clean	NCE103	22	40
Cc1ccc2nc(C(=O)Nc3cc(C)nc(C(C)C)n3)cn2c1	ZINC000875234653	DG	On-Demand	Anodyne	MAP3K5	58	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCOc1ccccc1OC	ZINC000875234707	FE	On-Demand	Anodyne	HTR1A	22	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCOc1ccccc1OC	ZINC000875234707	FE	On-Demand	Anodyne	SLC6A4	25	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCOc1ccccc1OC	ZINC000875234707	FE	On-Demand	Anodyne	SLC6A3	46	40
O=C(Nc1cc(Cl)ccc1F)c1cc(S(=O)(=O)N2CCOCC2)ccc1Br	ZINC000875234715	JH	On-Demand	Anodyne	NR1H4	17	40
O=C(NCCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875234722	GD	On-Demand	Anodyne	HTR1A	40	56
O=C(NCCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875234722	GD	On-Demand	Anodyne	DRD2	40	50
O=C(NCCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875234722	GD	On-Demand	Anodyne	DRD4	21	46
O=C(NCCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875234722	GD	On-Demand	Anodyne	HTR2A	21	42
O=C(NCCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875234722	GD	On-Demand	Anodyne	DRD3	58	39
O=C(NCCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875234723	GD	On-Demand	Anodyne	HTR1A	40	56
O=C(NCCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875234723	GD	On-Demand	Anodyne	DRD2	40	50
O=C(NCCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875234723	GD	On-Demand	Anodyne	DRD4	21	46
O=C(NCCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875234723	GD	On-Demand	Anodyne	HTR2A	21	42
O=C(NCCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875234723	GD	On-Demand	Anodyne	DRD3	58	39
O=C(NCCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875234724	GD	On-Demand	Anodyne	HTR1A	40	56
O=C(NCCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875234724	GD	On-Demand	Anodyne	DRD2	40	50
O=C(NCCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875234724	GD	On-Demand	Anodyne	DRD4	21	46
O=C(NCCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875234724	GD	On-Demand	Anodyne	HTR2A	21	42
O=C(NCCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875234724	GD	On-Demand	Anodyne	DRD3	58	39
O=C(NCCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875234725	GD	On-Demand	Anodyne	HTR1A	40	56
O=C(NCCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875234725	GD	On-Demand	Anodyne	DRD2	40	50
O=C(NCCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875234725	GD	On-Demand	Anodyne	DRD4	21	46
O=C(NCCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875234725	GD	On-Demand	Anodyne	HTR2A	21	42
O=C(NCCCCN1CCN(c2ncccn2)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875234725	GD	On-Demand	Anodyne	DRD3	58	39
N#CCCCCNC(=O)NC1CC(Nc2ccccc2)C1	ZINC000875234754	CF	On-Demand	Mild	EPHX2	15	40
COC(=O)C1(O)CN(C(=O)NCCCOc2ccccc2OC)C1	ZINC000875234803	EC	On-Demand	Anodyne	HTR1A	24	40
COC(=O)C1(O)CN(C(=O)NCCCOc2ccccc2OC)C1	ZINC000875234803	EC	On-Demand	Anodyne	ADRA1D	26	40
COC(=O)C1(O)CN(C(=O)NCCCOc2ccccc2OC)C1	ZINC000875234803	EC	On-Demand	Anodyne	ADRA1A	24	40
COC(=O)C1(O)CN(C(=O)NCCCOc2ccccc2OC)C1	ZINC000875234803	EC	On-Demand	Anodyne	ADRA1B	21	40
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)NCCCCC#N	ZINC000875234812	EI	On-Demand	Mild	MDM2	91	33
CCC[C@H](NC(=O)N[C@H]1CCN(CC(C)(C)O)C1)c1ccccn1	ZINC000875234899	EE	On-Demand	Anodyne	BIRC2	30	40
Cc1ncsc1CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875234904	EG	On-Demand	Anodyne	CPT1A	58	34
Cc1ncsc1CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875234904	EG	On-Demand	Anodyne	VHL	44	36
Cc1ncsc1CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875234905	EG	On-Demand	Anodyne	CPT1A	58	34
Cc1ncsc1CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875234905	EG	On-Demand	Anodyne	VHL	44	36
Cc1ncsc1CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875234906	EG	On-Demand	Anodyne	CPT1A	58	34
Cc1ncsc1CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875234906	EG	On-Demand	Anodyne	VHL	44	36
Cc1ncsc1CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875234907	EG	On-Demand	Anodyne	CPT1A	58	34
Cc1ncsc1CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875234907	EG	On-Demand	Anodyne	VHL	44	36
CCC[C@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccn1	ZINC000875234909	DF	On-Demand	Anodyne	GRIN2B	20	42
CCC[C@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccn1	ZINC000875234909	DF	On-Demand	Anodyne	CALCRL	17	40
CCC[C@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccn1	ZINC000875234911	DF	On-Demand	Anodyne	GRIN2B	20	42
CCC[C@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccn1	ZINC000875234911	DF	On-Demand	Anodyne	CALCRL	17	40
N#CCCCCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875235018	DE	On-Demand	Mild	MAOB	15	44
N#CCCCCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875235018	DE	On-Demand	Mild	CTSL	18	46
N#CCCCCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875235018	DE	On-Demand	Mild	CTSV	41	46
N#CCCCCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875235019	DE	On-Demand	Mild	MAOB	15	44
N#CCCCCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875235019	DE	On-Demand	Mild	CTSL	18	46
N#CCCCCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875235019	DE	On-Demand	Mild	CTSV	41	46
CC(=O)Nc1cccc(OCCNC(=O)NC(C)(C)[C@@H]2CCCCO2)c1	ZINC000875235066	FF	On-Demand	Anodyne	HRH2	31	41
CC(=O)Nc1cccc(OCCNC(=O)NC(C)(C)[C@@H]2CCCCO2)c1	ZINC000875235066	FF	On-Demand	Anodyne	MTNR1A	21	41
CC(=O)Nc1cccc(OCCNC(=O)NC(C)(C)[C@@H]2CCCCO2)c1	ZINC000875235066	FF	On-Demand	Anodyne	MTNR1B	17	41
CC(=O)Nc1cccc(OCCNC(=O)NC(C)(C)[C@@H]2CCCCO2)c1	ZINC000875235066	FF	On-Demand	Anodyne	EPHX2	25	42
CC(=O)Nc1cccc(OCCNC(=O)NC(C)(C)[C@H]2CCCCO2)c1	ZINC000875235068	FF	On-Demand	Anodyne	HRH2	31	41
CC(=O)Nc1cccc(OCCNC(=O)NC(C)(C)[C@H]2CCCCO2)c1	ZINC000875235068	FF	On-Demand	Anodyne	MTNR1A	21	41
CC(=O)Nc1cccc(OCCNC(=O)NC(C)(C)[C@H]2CCCCO2)c1	ZINC000875235068	FF	On-Demand	Anodyne	MTNR1B	17	41
CC(=O)Nc1cccc(OCCNC(=O)NC(C)(C)[C@H]2CCCCO2)c1	ZINC000875235068	FF	On-Demand	Anodyne	EPHX2	25	42
Cc1ncsc1CNC(=O)N1Cc2cccnc2N2C[C@H](O)C[C@H]2C1	ZINC000875235079	FD	On-Demand	Anodyne	VHL	59	33
CC(=O)Nc1cccc(OCCNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)c1	ZINC000875235081	EE	On-Demand	Anodyne	HRH2	37	42
CC(=O)Nc1cccc(OCCNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)c1	ZINC000875235081	EE	On-Demand	Anodyne	MTNR1A	22	44
CC(=O)Nc1cccc(OCCNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)c1	ZINC000875235081	EE	On-Demand	Anodyne	MTNR1B	20	44
CC(=O)Nc1cccc(OCCNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)c1	ZINC000875235081	EE	On-Demand	Anodyne	EPHX2	22	40
CC(=O)Nc1cccc(OCCNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)c1	ZINC000875235082	EE	On-Demand	Anodyne	HRH2	37	42
CC(=O)Nc1cccc(OCCNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)c1	ZINC000875235082	EE	On-Demand	Anodyne	MTNR1A	22	44
CC(=O)Nc1cccc(OCCNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)c1	ZINC000875235082	EE	On-Demand	Anodyne	MTNR1B	20	44
CC(=O)Nc1cccc(OCCNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)c1	ZINC000875235082	EE	On-Demand	Anodyne	EPHX2	22	40
CC(=O)Nc1cccc(OCCNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)c1	ZINC000875235083	EE	On-Demand	Anodyne	HRH2	37	42
CC(=O)Nc1cccc(OCCNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)c1	ZINC000875235083	EE	On-Demand	Anodyne	MTNR1A	22	44
CC(=O)Nc1cccc(OCCNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)c1	ZINC000875235083	EE	On-Demand	Anodyne	MTNR1B	20	44
CC(=O)Nc1cccc(OCCNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)c1	ZINC000875235083	EE	On-Demand	Anodyne	EPHX2	22	40
CC(=O)Nc1cccc(OCCNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)c1	ZINC000875235084	EE	On-Demand	Anodyne	HRH2	37	42
CC(=O)Nc1cccc(OCCNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)c1	ZINC000875235084	EE	On-Demand	Anodyne	MTNR1A	22	44
CC(=O)Nc1cccc(OCCNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)c1	ZINC000875235084	EE	On-Demand	Anodyne	MTNR1B	20	44
CC(=O)Nc1cccc(OCCNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)c1	ZINC000875235084	EE	On-Demand	Anodyne	EPHX2	22	40
CN(C)CCOc1ccc(CCNC(=O)N(C)OCC(F)(F)F)cc1	ZINC000875235094	FE	On-Demand	Anodyne	LTA4H	17	40
CC[C@@H]1COCCN1CCNC(=O)NCCOc1cccc(NC(C)=O)c1	ZINC000875235130	GD	On-Demand	Anodyne	HRH2	43	42
CC[C@@H]1COCCN1CCNC(=O)NCCOc1cccc(NC(C)=O)c1	ZINC000875235130	GD	On-Demand	Anodyne	MTNR1A	15	40
CC[C@@H]1COCCN1CCNC(=O)NCCOc1cccc(NC(C)=O)c1	ZINC000875235130	GD	On-Demand	Anodyne	EPHX2	37	47
CCC[C@H](NC(=O)N[C@H](C)C1CN(C(=O)OC(C)(C)C)C1)c1ccccn1	ZINC000875235175	GG	On-Demand	Anodyne	GPR119	21	40
CCC[C@H](NC(=O)N[C@@H](C)C1CN(C(=O)OC(C)(C)C)C1)c1ccccn1	ZINC000875235181	GG	On-Demand	Anodyne	GPR119	21	40
CC(=O)Nc1cccc(OCCNC(=O)NCC[C@@H](O)C2CCCC2)c1	ZINC000875235186	FE	On-Demand	Anodyne	ADRB1	22	46
CC(=O)Nc1cccc(OCCNC(=O)NCC[C@@H](O)C2CCCC2)c1	ZINC000875235186	FE	On-Demand	Anodyne	HRH2	41	44
CC(=O)Nc1cccc(OCCNC(=O)NCC[C@@H](O)C2CCCC2)c1	ZINC000875235186	FE	On-Demand	Anodyne	MTNR1A	30	45
CC(=O)Nc1cccc(OCCNC(=O)NCC[C@@H](O)C2CCCC2)c1	ZINC000875235186	FE	On-Demand	Anodyne	MTNR1B	26	45
CC(=O)Nc1cccc(OCCNC(=O)NCC[C@@H](O)C2CCCC2)c1	ZINC000875235186	FE	On-Demand	Anodyne	EPHX2	32	43
CC(=O)Nc1cccc(OCCNC(=O)NCC[C@H](O)C2CCCC2)c1	ZINC000875235187	FE	On-Demand	Anodyne	ADRB1	22	46
CC(=O)Nc1cccc(OCCNC(=O)NCC[C@H](O)C2CCCC2)c1	ZINC000875235187	FE	On-Demand	Anodyne	HRH2	41	44
CC(=O)Nc1cccc(OCCNC(=O)NCC[C@H](O)C2CCCC2)c1	ZINC000875235187	FE	On-Demand	Anodyne	MTNR1A	30	45
CC(=O)Nc1cccc(OCCNC(=O)NCC[C@H](O)C2CCCC2)c1	ZINC000875235187	FE	On-Demand	Anodyne	MTNR1B	26	45
CC(=O)Nc1cccc(OCCNC(=O)NCC[C@H](O)C2CCCC2)c1	ZINC000875235187	FE	On-Demand	Anodyne	EPHX2	32	43
O=C(NCCO)C1CCN(C(=O)N[C@H](c2ccccc2)C2CCC2)CC1	ZINC000875235190	FE	On-Demand	Anodyne	CCR5	18	41
O=C(NCCO)C1CCN(C(=O)N[C@H](c2ccccc2)C2CCC2)CC1	ZINC000875235190	FE	On-Demand	Anodyne	EPHX2	17	41
O=C(NCCO)C1CCN(C(=O)N[C@@H](c2ccccc2)C2CCC2)CC1	ZINC000875235191	FE	On-Demand	Anodyne	CCR5	18	41
O=C(NCCO)C1CCN(C(=O)N[C@@H](c2ccccc2)C2CCC2)CC1	ZINC000875235191	FE	On-Demand	Anodyne	EPHX2	17	41
CC(C)[C@H]1CCC[C@H](NC(=O)N2CCC(N3CCN(C)CC3)CC2)C1	ZINC000875235210	FF	On-Demand	Anodyne	L3MBTL3	64	44
CC(C)[C@H]1CCC[C@@H](NC(=O)N2CCC(N3CCN(C)CC3)CC2)C1	ZINC000875235211	FF	On-Demand	Anodyne	L3MBTL3	64	44
CC[C@H](C[C@H](C)O)NC(=O)NCCCOc1ccccc1OC	ZINC000875235223	DE	On-Demand	Anodyne	PTPRA	43	34
O=C(N[C@@H](c1ccc(Cl)cc1)C1CCCC1)N1CCC(CO)(CO)CC1	ZINC000875235296	GG	On-Demand	Anodyne	CACNA1H	49	37
O=C(N[C@@H](c1ccc(Cl)cc1)C1CCCC1)N1CCC(CO)(CO)CC1	ZINC000875235296	GG	On-Demand	Anodyne	CCR1	54	41
O=C(N[C@H](c1ccc(Cl)cc1)C1CCCC1)N1CCC(CO)(CO)CC1	ZINC000875235298	GG	On-Demand	Anodyne	CACNA1H	49	37
O=C(N[C@H](c1ccc(Cl)cc1)C1CCCC1)N1CCC(CO)(CO)CC1	ZINC000875235298	GG	On-Demand	Anodyne	CCR1	54	41
Cc1ncsc1CNC(=O)N1Cc2cccc(O)c2C1	ZINC000875235317	CE	On-Demand	Clean	VHL	47	31
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCOc2cc(OC)ccc21	ZINC000875235326	FD	On-Demand	Anodyne	DRD4	41	31
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCOc2cc(OC)ccc21	ZINC000875235326	FD	On-Demand	Anodyne	MTNR1A	42	36
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCOc2cc(OC)ccc21	ZINC000875235327	FD	On-Demand	Anodyne	DRD4	41	31
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCOc2cc(OC)ccc21	ZINC000875235327	FD	On-Demand	Anodyne	MTNR1A	42	36
CC(=O)Nc1cccc(OCCNC(=O)N2CCCN(C=O)CC2)c1	ZINC000875235336	EC	On-Demand	Anodyne	HRH2	45	44
CC(=O)Nc1cccc(OCCNC(=O)N2CCCN(C=O)CC2)c1	ZINC000875235336	EC	On-Demand	Anodyne	MTNR1A	21	44
CC(=O)Nc1cccc(OCCNC(=O)N2CCCN(C=O)CC2)c1	ZINC000875235336	EC	On-Demand	Anodyne	MTNR1B	21	44
CC(=O)Nc1cccc(OCCNC(=O)N2CCCN(C=O)CC2)c1	ZINC000875235336	EC	On-Demand	Anodyne	EPHX2	23	41
CCC[C@H](NC(=O)N[C@H](CC)[C@@H](O)c1ccccc1)c1ccccn1	ZINC000875235350	EH	On-Demand	Anodyne	TACR3	31	42
CCC[C@H](NC(=O)N[C@H](CC)[C@H](O)c1ccccc1)c1ccccn1	ZINC000875235351	EH	On-Demand	Anodyne	TACR3	31	42
CCC[C@H](NC(=O)N[C@@H](CC)[C@@H](O)c1ccccc1)c1ccccn1	ZINC000875235352	EH	On-Demand	Anodyne	TACR3	31	42
CCC[C@H](NC(=O)N[C@@H](CC)[C@H](O)c1ccccc1)c1ccccn1	ZINC000875235353	EH	On-Demand	Anodyne	TACR3	31	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCCOc2cccc(NC(C)=O)c2)C1	ZINC000875235356	GD	On-Demand	Anodyne	HRH2	38	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCOc2cccc(NC(C)=O)c2)C1	ZINC000875235356	GD	On-Demand	Anodyne	MTNR1A	25	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCCOc2cccc(NC(C)=O)c2)C1	ZINC000875235356	GD	On-Demand	Anodyne	MTNR1B	22	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCCOc2cccc(NC(C)=O)c2)C1	ZINC000875235356	GD	On-Demand	Anodyne	EPHX2	20	40
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875235378	GG	On-Demand	Anodyne	HRH2	39	42
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875235378	GG	On-Demand	Anodyne	CCR3	23	41
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875235378	GG	On-Demand	Anodyne	MTNR1A	20	42
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875235378	GG	On-Demand	Anodyne	MTNR1B	20	42
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875235378	GG	On-Demand	Anodyne	EPHX2	40	41
CONC(=O)C1CCN(C(=O)N[C@@H](c2ccc(Cl)cc2)C2CCCC2)CC1	ZINC000875235379	GH	On-Demand	Anodyne	SLC6A3	20	44
CONC(=O)C1CCN(C(=O)N[C@@H](c2ccc(Cl)cc2)C2CCCC2)CC1	ZINC000875235379	GH	On-Demand	Anodyne	CCR1	36	42
CONC(=O)C1CCN(C(=O)N[C@H](c2ccc(Cl)cc2)C2CCCC2)CC1	ZINC000875235380	GH	On-Demand	Anodyne	SLC6A3	20	44
CONC(=O)C1CCN(C(=O)N[C@H](c2ccc(Cl)cc2)C2CCCC2)CC1	ZINC000875235380	GH	On-Demand	Anodyne	CCR1	36	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCOc1cccc(NC(C)=O)c1	ZINC000875235391	GD	On-Demand	Anodyne	HRH2	35	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCOc1cccc(NC(C)=O)c1	ZINC000875235391	GD	On-Demand	Anodyne	MTNR1A	25	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCOc1cccc(NC(C)=O)c1	ZINC000875235391	GD	On-Demand	Anodyne	MTNR1B	23	44
O=CN1CCCN(C(=O)NCCCCN2CCN(c3ncccn3)CC2)CC1	ZINC000875235450	GC	On-Demand	Anodyne	HTR1A	58	58
O=CN1CCCN(C(=O)NCCCCN2CCN(c3ncccn3)CC2)CC1	ZINC000875235450	GC	On-Demand	Anodyne	DRD2	62	46
O=CN1CCCN(C(=O)NCCCCN2CCN(c3ncccn3)CC2)CC1	ZINC000875235450	GC	On-Demand	Anodyne	DRD1	15	41
O=CN1CCCN(C(=O)NCCCCN2CCN(c3ncccn3)CC2)CC1	ZINC000875235450	GC	On-Demand	Anodyne	DRD4	31	43
O=CN1CCCN(C(=O)NCCCCN2CCN(c3ncccn3)CC2)CC1	ZINC000875235450	GC	On-Demand	Anodyne	ADRA1D	20	44
O=CN1CCCN(C(=O)NCCCCN2CCN(c3ncccn3)CC2)CC1	ZINC000875235450	GC	On-Demand	Anodyne	HTR2A	37	46
O=CN1CCCN(C(=O)NCCCCN2CCN(c3ncccn3)CC2)CC1	ZINC000875235450	GC	On-Demand	Anodyne	HTR2C	23	45
O=CN1CCCN(C(=O)NCCCCN2CCN(c3ncccn3)CC2)CC1	ZINC000875235450	GC	On-Demand	Anodyne	ADRA1A	23	44
O=CN1CCCN(C(=O)NCCCCN2CCN(c3ncccn3)CC2)CC1	ZINC000875235450	GC	On-Demand	Anodyne	DRD3	77	43
O=CN1CCCN(C(=O)NCCCCN2CCN(c3ncccn3)CC2)CC1	ZINC000875235450	GC	On-Demand	Anodyne	HTR7	46	41
N#CCCCCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875235451	DF	On-Demand	Mild	DPP4	15	42
N#CCCCCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875235452	DF	On-Demand	Mild	DPP4	15	42
N#CCCCCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875235453	DF	On-Demand	Mild	DPP4	15	42
N#CCCCCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875235454	DF	On-Demand	Mild	DPP4	15	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](c2ccccc2)C2CCC2)C1	ZINC000875235480	EG	On-Demand	Anodyne	CHRM1	16	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](c2ccccc2)C2CCC2)C1	ZINC000875235480	EG	On-Demand	Anodyne	ACE	39	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](c2ccccc2)C2CCC2)C1	ZINC000875235480	EG	On-Demand	Anodyne	P2RY12	43	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](c2ccccc2)C2CCC2)C1	ZINC000875235480	EG	On-Demand	Anodyne	CTSK	33	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](c2ccccc2)C2CCC2)C1	ZINC000875235480	EG	On-Demand	Anodyne	REN	22	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](c2ccccc2)C2CCC2)C1	ZINC000875235480	EG	On-Demand	Anodyne	Q6PRC7_IXORI	57	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](c2ccccc2)C2CCC2)C1	ZINC000875235482	EG	On-Demand	Anodyne	CHRM1	16	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](c2ccccc2)C2CCC2)C1	ZINC000875235482	EG	On-Demand	Anodyne	ACE	39	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](c2ccccc2)C2CCC2)C1	ZINC000875235482	EG	On-Demand	Anodyne	P2RY12	43	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](c2ccccc2)C2CCC2)C1	ZINC000875235482	EG	On-Demand	Anodyne	CTSK	33	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](c2ccccc2)C2CCC2)C1	ZINC000875235482	EG	On-Demand	Anodyne	REN	22	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](c2ccccc2)C2CCC2)C1	ZINC000875235482	EG	On-Demand	Anodyne	Q6PRC7_IXORI	57	35
O=C(N[C@@H](c1ccc(Cl)cc1)C1CCCC1)N1CCC2(CCNC2=O)CC1	ZINC000875235497	GH	On-Demand	Anodyne	CACNA1H	67	42
O=C(N[C@H](c1ccc(Cl)cc1)C1CCCC1)N1CCC2(CCNC2=O)CC1	ZINC000875235500	GH	On-Demand	Anodyne	CACNA1H	67	42
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@](O)(c3ccccc3)C2)c1	ZINC000875235528	GF	On-Demand	Anodyne	HRH2	40	42
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@](O)(c3ccccc3)C2)c1	ZINC000875235528	GF	On-Demand	Anodyne	MTNR1A	15	41
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@](O)(c3ccccc3)C2)c1	ZINC000875235528	GF	On-Demand	Anodyne	MTNR1B	15	41
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@](O)(c3ccccc3)C2)c1	ZINC000875235528	GF	On-Demand	Anodyne	EPHX2	36	42
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)c1	ZINC000875235529	GF	On-Demand	Anodyne	HRH2	40	42
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)c1	ZINC000875235529	GF	On-Demand	Anodyne	MTNR1A	15	41
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)c1	ZINC000875235529	GF	On-Demand	Anodyne	MTNR1B	15	41
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)c1	ZINC000875235529	GF	On-Demand	Anodyne	EPHX2	36	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccc(OCCN(C)C)cc1	ZINC000875235560	GD	On-Demand	Anodyne	LTA4H	18	41
CC(=O)Nc1cccc(OCCNC(=O)N(C)OCC(F)(F)F)c1	ZINC000875235563	EE	On-Demand	Anodyne	HRH2	23	40
CC(=O)Nc1cccc(OCCNC(=O)N(C)OCC(F)(F)F)c1	ZINC000875235563	EE	On-Demand	Anodyne	MTNR1A	28	46
CC(=O)Nc1cccc(OCCNC(=O)N(C)OCC(F)(F)F)c1	ZINC000875235563	EE	On-Demand	Anodyne	MTNR1B	26	46
Cc1ncsc1CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875235570	EF	On-Demand	Anodyne	VHL	44	36
Cc1ncsc1CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875235571	EF	On-Demand	Anodyne	VHL	44	36
Cc1ncsc1CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875235572	EF	On-Demand	Anodyne	VHL	44	36
Cc1ncsc1CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875235573	EF	On-Demand	Anodyne	VHL	44	36
CC(=O)Nc1cccc(OCCNC(=O)NC2(C)CC(F)(F)C2)c1	ZINC000875235574	EF	On-Demand	Anodyne	HRH2	29	43
CC(=O)Nc1cccc(OCCNC(=O)NC2(C)CC(F)(F)C2)c1	ZINC000875235574	EF	On-Demand	Anodyne	DRTS_LEIMA	16	40
CC(=O)Nc1cccc(OCCNC(=O)NC2(C)CC(F)(F)C2)c1	ZINC000875235574	EF	On-Demand	Anodyne	MTNR1A	29	46
CC(=O)Nc1cccc(OCCNC(=O)NC2(C)CC(F)(F)C2)c1	ZINC000875235574	EF	On-Demand	Anodyne	MTNR1B	25	46
CC(=O)Nc1cccc(OCCNC(=O)NC2(C)CC(F)(F)C2)c1	ZINC000875235574	EF	On-Demand	Anodyne	EPHX2	26	42
CC(=O)Nc1cccc(OCCNC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)c1	ZINC000875235576	GE	On-Demand	Anodyne	MTNR1A	20	42
CC(=O)Nc1cccc(OCCNC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)c1	ZINC000875235576	GE	On-Demand	Anodyne	MTNR1B	16	42
CN(C)CCOc1ccc(CCNC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875235583	GC	On-Demand	Anodyne	LTA4H	25	41
CN(C)CCOc1ccc(CCNC(=O)N2CCC(CO)(CO)CC2)cc1	ZINC000875235583	GC	On-Demand	Anodyne	ESRRG	44	33
O=C(N[C@H](c1ccccc1)c1nccs1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875235613	FH	On-Demand	Anodyne	BIRC8	45	33
O=C(N[C@H](c1ccccc1)c1nccs1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875235614	FH	On-Demand	Anodyne	BIRC8	45	33
O=C(N[C@H](c1ccccc1)c1nccs1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875235615	FH	On-Demand	Anodyne	BIRC8	45	33
O=C(N[C@H](c1ccccc1)c1nccs1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875235616	FH	On-Demand	Anodyne	BIRC8	45	33
COC(=O)N(C)NC(=O)NCCCOc1ccccc1OC	ZINC000875235653	DD	On-Demand	Reactive	HTR1A	17	43
COC(=O)N(C)NC(=O)NCCCOc1ccccc1OC	ZINC000875235653	DD	On-Demand	Reactive	ADRA1D	23	43
COC(=O)N(C)NC(=O)NCCCOc1ccccc1OC	ZINC000875235653	DD	On-Demand	Reactive	ADRA1A	18	43
COC(=O)N(C)NC(=O)NCCCOc1ccccc1OC	ZINC000875235653	DD	On-Demand	Reactive	ADRA1B	15	43
CC(=O)Nc1cccc(OCCNC(=O)N2CCN(C)C(C)(C)CC2)c1	ZINC000875235702	FE	On-Demand	Anodyne	HRH2	37	41
CC(=O)Nc1cccc(OCCNC(=O)N2CCN(C)C(C)(C)CC2)c1	ZINC000875235702	FE	On-Demand	Anodyne	DRTS_LEIMA	16	40
CC(=O)Nc1cccc(OCCNC(=O)N2CCN(C)C(C)(C)CC2)c1	ZINC000875235702	FE	On-Demand	Anodyne	MTNR1A	18	43
CC(=O)Nc1cccc(OCCNC(=O)N2CCN(C)C(C)(C)CC2)c1	ZINC000875235702	FE	On-Demand	Anodyne	MTNR1B	16	43
CC(=O)Nc1cccc(OCCNC(=O)N2CCN(C)C(C)(C)CC2)c1	ZINC000875235702	FE	On-Demand	Anodyne	EPHX2	28	44
CC(=O)Nc1cccc(OCCNC(=O)NC2([C@H]3CCCCO3)CCC2)c1	ZINC000875235703	GF	On-Demand	Anodyne	HRH2	27	40
CC(=O)Nc1cccc(OCCNC(=O)NC2([C@H]3CCCCO3)CCC2)c1	ZINC000875235703	GF	On-Demand	Anodyne	MTNR1A	17	40
CC(=O)Nc1cccc(OCCNC(=O)NC2([C@H]3CCCCO3)CCC2)c1	ZINC000875235703	GF	On-Demand	Anodyne	MTNR1B	15	40
CC(=O)Nc1cccc(OCCNC(=O)NC2([C@H]3CCCCO3)CCC2)c1	ZINC000875235703	GF	On-Demand	Anodyne	EPHX2	25	41
CC(=O)Nc1cccc(OCCNC(=O)NC2([C@@H]3CCCCO3)CCC2)c1	ZINC000875235704	GF	On-Demand	Anodyne	HRH2	27	40
CC(=O)Nc1cccc(OCCNC(=O)NC2([C@@H]3CCCCO3)CCC2)c1	ZINC000875235704	GF	On-Demand	Anodyne	MTNR1A	17	40
CC(=O)Nc1cccc(OCCNC(=O)NC2([C@@H]3CCCCO3)CCC2)c1	ZINC000875235704	GF	On-Demand	Anodyne	MTNR1B	15	40
CC(=O)Nc1cccc(OCCNC(=O)NC2([C@@H]3CCCCO3)CCC2)c1	ZINC000875235704	GF	On-Demand	Anodyne	EPHX2	25	41
CC(=O)Nc1cccc(OCCNC(=O)N[C@@H]2CC(C)(C)CC[C@H]2O)c1	ZINC000875235720	FE	On-Demand	Anodyne	HRH2	35	41
CC(=O)Nc1cccc(OCCNC(=O)N[C@@H]2CC(C)(C)CC[C@H]2O)c1	ZINC000875235720	FE	On-Demand	Anodyne	MTNR1A	19	42
CC(=O)Nc1cccc(OCCNC(=O)N[C@@H]2CC(C)(C)CC[C@H]2O)c1	ZINC000875235720	FE	On-Demand	Anodyne	MTNR1B	16	42
CC(=O)Nc1cccc(OCCNC(=O)N[C@@H]2CC(C)(C)CC[C@H]2O)c1	ZINC000875235720	FE	On-Demand	Anodyne	EPHX2	26	43
CC(=O)Nc1cccc(OCCNC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875235734	DD	On-Demand	Anodyne	HRH2	38	44
CC(=O)Nc1cccc(OCCNC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875235734	DD	On-Demand	Anodyne	MTNR1A	33	47
CC(=O)Nc1cccc(OCCNC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875235734	DD	On-Demand	Anodyne	MTNR1B	26	47
CC(=O)Nc1cccc(OCCNC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875235734	DD	On-Demand	Anodyne	EPHX2	27	42
CN(C)CCOc1ccc(CCNC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875235735	GE	On-Demand	Anodyne	HRH3	17	43
CN(C)CCOc1ccc(CCNC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875235736	GE	On-Demand	Anodyne	HRH3	17	43
COC(=O)N(C)NC(=O)NCCc1ccc(OCCN(C)C)cc1	ZINC000875235742	ED	On-Demand	Reactive	LTA4H	20	43
COC(=O)N(C)NC(=O)NCCc1ccc(OCCN(C)C)cc1	ZINC000875235742	ED	On-Demand	Reactive	MTNR1A	44	38
COC(=O)N(C)NC(=O)NCCc1ccc(OCCN(C)C)cc1	ZINC000875235742	ED	On-Demand	Reactive	MTNR1B	27	43
COC(=O)N(C)NC(=O)NCCc1ccc(OCCN(C)C)cc1	ZINC000875235742	ED	On-Demand	Reactive	ESRRG	44	33
CC(=O)Nc1cccc(OCCNC(=O)N2Cc3cccc(O)c3C2)c1	ZINC000875235760	FE	On-Demand	Clean	HRH2	25	40
CC(=O)Nc1cccc(OCCNC(=O)N2Cc3cccc(O)c3C2)c1	ZINC000875235760	FE	On-Demand	Clean	MTNR1A	27	45
CC(=O)Nc1cccc(OCCNC(=O)N2Cc3cccc(O)c3C2)c1	ZINC000875235760	FE	On-Demand	Clean	MTNR1B	25	45
CC(=O)Nc1cccc(OCCNC(=O)N2Cc3cccc(O)c3C2)c1	ZINC000875235760	FE	On-Demand	Clean	EPHX2	21	41
CCC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccccn1	ZINC000875235764	EF	On-Demand	Anodyne	SLC6A4	19	40
CCC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccccn1	ZINC000875235764	EF	On-Demand	Anodyne	SLC6A3	42	40
CCC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccccn1	ZINC000875235767	EF	On-Demand	Anodyne	SLC6A4	19	40
CCC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccccn1	ZINC000875235767	EF	On-Demand	Anodyne	SLC6A3	42	40
CC(=O)Nc1cccc(OCCNC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875235782	GF	On-Demand	Anodyne	HRH2	38	43
CC(=O)Nc1cccc(OCCNC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875235782	GF	On-Demand	Anodyne	DRTS_LEIMA	16	40
CC(=O)Nc1cccc(OCCNC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875235782	GF	On-Demand	Anodyne	MTNR1A	30	46
CC(=O)Nc1cccc(OCCNC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875235782	GF	On-Demand	Anodyne	MTNR1B	29	46
CC(=O)Nc1cccc(OCCNC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875235782	GF	On-Demand	Anodyne	EPHX2	40	46
N#CCCCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875235821	EH	On-Demand	Reactive	ADRB1	43	35
N#CCCCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875235821	EH	On-Demand	Reactive	MAOB	37	50
N#CCCCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875235821	EH	On-Demand	Reactive	LTA4H	29	46
N#CCCCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875235821	EH	On-Demand	Reactive	CA1	15	46
N#CCCCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875235821	EH	On-Demand	Reactive	SCN2A	17	41
N#CCCCCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875235821	EH	On-Demand	Reactive	FFAR1	25	40
CCCCCCCNC(=O)C(=O)NCCN1CCN(C)C(C)(C)C1	ZINC000875235830	ED	On-Demand	Mild	ASAH1	56	33
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H]1CCOC(C)(C)C1)CC2	ZINC000875235908	GE	On-Demand	Anodyne	SLC18A2	47	37
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@H]1CCOC(C)(C)C1)CC2	ZINC000875235909	GE	On-Demand	Anodyne	SLC18A2	47	37
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@@H]1CCOC(C)(C)C1)CC2	ZINC000875235910	GE	On-Demand	Anodyne	SLC18A2	47	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H]1CCOC(C)(C)C1)CC2	ZINC000875235911	GE	On-Demand	Anodyne	SLC18A2	47	37
CCCCCCCNC(=O)C(=O)N[C@H]1CCCN(c2cnn(C)c2)C1	ZINC000875235942	ED	On-Demand	Mild	ASAH1	78	34
CCCCCCCNC(=O)C(=O)N[C@@H]1CCCN(c2cnn(C)c2)C1	ZINC000875235943	ED	On-Demand	Mild	ASAH1	78	34
COc1ccccc1[C@H]1CCCN(C(=O)NCCCCC#N)CC1	ZINC000875236012	EH	On-Demand	Mild	DRD2	28	43
COc1ccccc1[C@H]1CCCN(C(=O)NCCCCC#N)CC1	ZINC000875236012	EH	On-Demand	Mild	DRD4	15	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCCC#N)CC1	ZINC000875236021	EH	On-Demand	Mild	DRD2	28	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCCC#N)CC1	ZINC000875236021	EH	On-Demand	Mild	DRD4	15	43
O=C(NCCCCN1CCN(c2ncccn2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875236106	FC	On-Demand	Anodyne	HTR1A	51	60
O=C(NCCCCN1CCN(c2ncccn2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875236106	FC	On-Demand	Anodyne	DRD2	55	52
O=C(NCCCCN1CCN(c2ncccn2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875236106	FC	On-Demand	Anodyne	DRD4	29	47
O=C(NCCCCN1CCN(c2ncccn2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875236106	FC	On-Demand	Anodyne	HTR2A	37	46
O=C(NCCCCN1CCN(c2ncccn2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875236106	FC	On-Demand	Anodyne	HTR2C	26	44
O=C(NCCCCN1CCN(c2ncccn2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875236106	FC	On-Demand	Anodyne	ADRA1A	16	40
O=C(NCCCCN1CCN(c2ncccn2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875236106	FC	On-Demand	Anodyne	DRD3	76	44
O=C(NCCCCN1CCN(c2ncccn2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875236106	FC	On-Demand	Anodyne	HTR7	18	40
CCCCCCCNC(=O)C(=O)N[C@H]1CCOc2cc(OC)ccc21	ZINC000875236118	EF	On-Demand	Mild	DRD4	41	31
CCCCCCCNC(=O)C(=O)N[C@H]1CCOc2cc(OC)ccc21	ZINC000875236118	EF	On-Demand	Mild	NQO2	32	41
CCCCCCCNC(=O)C(=O)N[C@H]1CCOc2cc(OC)ccc21	ZINC000875236118	EF	On-Demand	Mild	MTNR1A	105	46
CCCCCCCNC(=O)C(=O)N[C@H]1CCOc2cc(OC)ccc21	ZINC000875236118	EF	On-Demand	Mild	MTNR1B	91	46
CCCCCCCNC(=O)C(=O)N[C@H]1CCOc2cc(OC)ccc21	ZINC000875236118	EF	On-Demand	Mild	TRAR	44	38
CCCCCCCNC(=O)C(=O)N[C@H]1CCOc2cc(OC)ccc21	ZINC000875236118	EF	On-Demand	Mild	LASR	49	38
CCCCCCCNC(=O)C(=O)N[C@@H]1CCOc2cc(OC)ccc21	ZINC000875236120	EF	On-Demand	Mild	DRD4	41	31
CCCCCCCNC(=O)C(=O)N[C@@H]1CCOc2cc(OC)ccc21	ZINC000875236120	EF	On-Demand	Mild	NQO2	32	41
CCCCCCCNC(=O)C(=O)N[C@@H]1CCOc2cc(OC)ccc21	ZINC000875236120	EF	On-Demand	Mild	MTNR1A	105	46
CCCCCCCNC(=O)C(=O)N[C@@H]1CCOc2cc(OC)ccc21	ZINC000875236120	EF	On-Demand	Mild	MTNR1B	91	46
CCCCCCCNC(=O)C(=O)N[C@@H]1CCOc2cc(OC)ccc21	ZINC000875236120	EF	On-Demand	Mild	TRAR	44	38
CCCCCCCNC(=O)C(=O)N[C@@H]1CCOc2cc(OC)ccc21	ZINC000875236120	EF	On-Demand	Mild	LASR	49	38
CN1CCN(C2CCN(C(=O)N[C@@H](c3ccccc3)c3nccs3)CC2)CC1	ZINC000875236130	GF	On-Demand	Anodyne	BIRC8	56	35
CN1CCN(C2CCN(C(=O)N[C@@H](c3ccccc3)c3nccs3)CC2)CC1	ZINC000875236130	GF	On-Demand	Anodyne	L3MBTL3	56	38
CN1CCN(C2CCN(C(=O)N[C@H](c3ccccc3)c3nccs3)CC2)CC1	ZINC000875236131	GF	On-Demand	Anodyne	BIRC8	56	35
CN1CCN(C2CCN(C(=O)N[C@H](c3ccccc3)c3nccs3)CC2)CC1	ZINC000875236131	GF	On-Demand	Anodyne	L3MBTL3	56	38
CC(=O)Nc1cccc(OCCNC(=O)N2C[C@@H]3C[C@H]2CN3c2ccccc2)c1	ZINC000875236161	GF	On-Demand	Anodyne	MTNR1A	21	41
CC(=O)Nc1cccc(OCCNC(=O)N2C[C@@H]3C[C@H]2CN3c2ccccc2)c1	ZINC000875236161	GF	On-Demand	Anodyne	MTNR1B	20	41
CC[C@@H](NC(=O)N1CCN(C)C(C)(C)CC1)c1cccc(S(N)(=O)=O)c1	ZINC000875236176	GD	On-Demand	Anodyne	CACNA1H	32	41
Cc1ncsc1CNC(=O)N1CC[C@@H](O)[C@H]1c1ccc(Br)cc1	ZINC000875236182	GG	On-Demand	Anodyne	VHL	50	33
CCOC1CC2(C1)C[C@@H]2NC(=O)NC(C)(C)Cc1ccccc1OC	ZINC000875236190	EG	On-Demand	Anodyne	TIMP3	54	33
CCOC1CC2(C1)C[C@H]2NC(=O)NC(C)(C)Cc1ccccc1OC	ZINC000875236192	EG	On-Demand	Anodyne	TIMP3	54	33
CC[C@H](C[C@H](C)O)NC(=O)NCCOc1cccc(NC(C)=O)c1	ZINC000875236193	ED	On-Demand	Anodyne	HRH2	25	44
CC[C@H](C[C@H](C)O)NC(=O)NCCOc1cccc(NC(C)=O)c1	ZINC000875236193	ED	On-Demand	Anodyne	MTNR1A	31	45
CC[C@H](C[C@H](C)O)NC(=O)NCCOc1cccc(NC(C)=O)c1	ZINC000875236193	ED	On-Demand	Anodyne	MTNR1B	28	45
CC[C@H](C[C@H](C)O)NC(=O)NCCOc1cccc(NC(C)=O)c1	ZINC000875236193	ED	On-Demand	Anodyne	PDS	65	34
CCOC(=O)c1cc(CNC(=O)NC[C@H]2CCCN(CC)C2)on1	ZINC000875236194	ED	On-Demand	Anodyne	CCR3	26	40
CCOC(=O)c1cc(CNC(=O)NC[C@@H]2CCCN(CC)C2)on1	ZINC000875236196	ED	On-Demand	Anodyne	CCR3	26	40
Cc1cccc([C@@H](C)NC(=O)C(=O)N2CCC(N3CCN(C)CC3)CC2)c1C	ZINC000875236219	GD	On-Demand	Anodyne	L3MBTL3	53	41
CC(=O)Nc1cccc(OCCNC(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)c1	ZINC000875236287	GG	On-Demand	Anodyne	HRH2	35	41
CC(=O)Nc1cccc(OCCNC(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)c1	ZINC000875236287	GG	On-Demand	Anodyne	MTNR1A	21	43
CC(=O)Nc1cccc(OCCNC(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)c1	ZINC000875236287	GG	On-Demand	Anodyne	MTNR1B	19	43
CCC[C@H](NC(=O)N1Cc2cccnc2N2CCC[C@H]2C1)c1ccccn1	ZINC000875236291	FH	On-Demand	Anodyne	CALCRL	30	42
O=C(NCCO)C1CCN(C(=O)N[C@@H](c2ccc(Cl)cc2)C2CCC2)CC1	ZINC000875236334	GF	On-Demand	Anodyne	EPHX2	18	45
O=C(NCCO)C1CCN(C(=O)N[C@H](c2ccc(Cl)cc2)C2CCC2)CC1	ZINC000875236337	GF	On-Demand	Anodyne	EPHX2	18	45
CCC[C@H](NC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F)c1ccccn1	ZINC000875236346	GI	On-Demand	Mild	CTSF	55	33
CCC[C@H](NC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F)c1ccccn1	ZINC000875236354	GI	On-Demand	Mild	CTSF	55	33
N#CCCCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875236356	DF	On-Demand	Mild	TRY1_BOVIN	42	33
N#CCCCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875236356	DF	On-Demand	Mild	DPP4	25	43
CCC[C@H](NC(=O)N[C@@H](C)[C@@H](O)c1cc(OC)ccc1OC)c1ccccn1	ZINC000875236358	GG	On-Demand	Anodyne	MTNR1B	19	40
CCC[C@H](NC(=O)N[C@@H](C)[C@H](O)c1cc(OC)ccc1OC)c1ccccn1	ZINC000875236359	GG	On-Demand	Anodyne	MTNR1B	19	40
CCC[C@H](NC(=O)N[C@H](C)[C@@H](O)c1cc(OC)ccc1OC)c1ccccn1	ZINC000875236360	GG	On-Demand	Anodyne	MTNR1B	19	40
CCC[C@H](NC(=O)N[C@H](C)[C@H](O)c1cc(OC)ccc1OC)c1ccccn1	ZINC000875236361	GG	On-Demand	Anodyne	MTNR1B	19	40
N#CCCCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875236362	DF	On-Demand	Mild	TRY1_BOVIN	42	33
N#CCCCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875236362	DF	On-Demand	Mild	DPP4	25	43
N#CCCCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875236364	DF	On-Demand	Mild	TRY1_BOVIN	42	33
N#CCCCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875236364	DF	On-Demand	Mild	DPP4	25	43
N#CCCCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875236365	DF	On-Demand	Mild	TRY1_BOVIN	42	33
N#CCCCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875236365	DF	On-Demand	Mild	DPP4	25	43
CN(C)CCOc1ccc(CCNC(=O)NC[C@H]2C[C@H](O)C2)cc1	ZINC000875236372	ED	On-Demand	Anodyne	LTA4H	15	40
CN(C)CCOc1ccc(CCNC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875236406	FF	On-Demand	Clean	ESRRG	46	34
CC(=O)Nc1cccc(OCCNC(=O)N2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000875236425	GE	On-Demand	Anodyne	CCR3	20	41
CC(=O)Nc1cccc(OCCNC(=O)N2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000875236425	GE	On-Demand	Anodyne	MTNR1A	16	40
CC(=O)Nc1cccc(OCCNC(=O)N2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000875236425	GE	On-Demand	Anodyne	EPHX2	42	42
CC(=O)Nc1cccc(OCCNC(=O)N2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000875236427	GE	On-Demand	Anodyne	CCR3	20	41
CC(=O)Nc1cccc(OCCNC(=O)N2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000875236427	GE	On-Demand	Anodyne	MTNR1A	16	40
CC(=O)Nc1cccc(OCCNC(=O)N2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000875236427	GE	On-Demand	Anodyne	EPHX2	42	42
C[C@@](CO)(Cc1ccc(Br)cc1)NC(=O)NCCCCC#N	ZINC000875236445	FF	On-Demand	Mild	PAPA1_CARPA	15	40
CN(C)CCOc1ccc(CCNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875236451	GD	On-Demand	Anodyne	LTA4H	24	44
CN(C)CCOc1ccc(CCNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875236451	GD	On-Demand	Anodyne	CCR3	15	46
CN(C)CCOc1ccc(CCNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875236451	GD	On-Demand	Anodyne	UTS2R	17	51
CN(C)CCOc1ccc(CCNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875236451	GD	On-Demand	Anodyne	SLC6A5	36	45
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCOc3ccccc3OC)C[C@@H]1C2	ZINC000875236488	FE	On-Demand	Anodyne	HTR1A	18	40
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCOc3ccccc3OC)C[C@@H]1C2	ZINC000875236488	FE	On-Demand	Anodyne	EPHX2	19	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1scnc1C	ZINC000875236514	DD	On-Demand	Anodyne	SLC6A3	41	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1scnc1C	ZINC000875236515	DD	On-Demand	Anodyne	SLC6A3	41	38
CCCCCCCNC(=O)C(=O)N[C@H]1CCCN(c2cnn(C)c2)C1=O	ZINC000875236531	FD	On-Demand	Mild	ASAH1	82	35
CCCCCCCNC(=O)C(=O)N[C@@H]1CCCN(c2cnn(C)c2)C1=O	ZINC000875236532	FD	On-Demand	Mild	ASAH1	82	35
COc1ccccc1C[C@](C)(CO)NC(=O)NC[C@H]1CN2CCC[C@H]2CO1	ZINC000875236541	GD	On-Demand	Anodyne	MBTPS1	40	31
COc1ccccc1C[C@](C)(CO)NC(=O)NC[C@H]1CN2CCC[C@@H]2CO1	ZINC000875236542	GD	On-Demand	Anodyne	MBTPS1	40	31
COc1ccccc1C[C@](C)(CO)NC(=O)NC[C@@H]1CN2CCC[C@@H]2CO1	ZINC000875236543	GD	On-Demand	Anodyne	MBTPS1	40	31
COc1ccccc1C[C@](C)(CO)NC(=O)NC[C@@H]1CN2CCC[C@H]2CO1	ZINC000875236544	GD	On-Demand	Anodyne	MBTPS1	40	31
Cc1ncsc1CNC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875236546	EF	On-Demand	Anodyne	VHL	59	35
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)C1CCC1	ZINC000875236649	EG	On-Demand	Anodyne	SLC6A4	25	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)C1CCC1	ZINC000875236649	EG	On-Demand	Anodyne	SLC6A3	62	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)C1CCC1	ZINC000875236655	EG	On-Demand	Anodyne	SLC6A4	25	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)C1CCC1	ZINC000875236655	EG	On-Demand	Anodyne	SLC6A3	62	46
CC(=O)Nc1cccc(OCCNC(=O)N2CCCCCCNC(=O)CC2)c1	ZINC000875236656	GE	On-Demand	Anodyne	HRH2	52	47
CC(=O)Nc1cccc(OCCNC(=O)N2CCCCCCNC(=O)CC2)c1	ZINC000875236656	GE	On-Demand	Anodyne	MTNR1A	22	41
CC(=O)Nc1cccc(OCCNC(=O)N2CCCCCCNC(=O)CC2)c1	ZINC000875236656	GE	On-Demand	Anodyne	MTNR1B	20	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)C1CCC1	ZINC000875236658	EG	On-Demand	Anodyne	SLC6A4	25	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)C1CCC1	ZINC000875236658	EG	On-Demand	Anodyne	SLC6A3	62	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)C1CCC1	ZINC000875236660	EG	On-Demand	Anodyne	SLC6A4	25	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)C1CCC1	ZINC000875236660	EG	On-Demand	Anodyne	SLC6A3	62	46
CN(C)CCOc1ccc(CCNC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875236723	FD	On-Demand	Anodyne	ADRB1	17	41
CCCCCCCNC(=O)C(=O)N[C@@H]1CCOC(C)(C)C1	ZINC000875236725	CE	On-Demand	Mild	EPHX2	15	44
CCCCCCCNC(=O)C(=O)N[C@@H]1CCOC(C)(C)C1	ZINC000875236725	CE	On-Demand	Mild	LASR	45	33
CCCCCCCNC(=O)C(=O)N[C@H]1CCOC(C)(C)C1	ZINC000875236726	CE	On-Demand	Mild	EPHX2	15	44
CCCCCCCNC(=O)C(=O)N[C@H]1CCOC(C)(C)C1	ZINC000875236726	CE	On-Demand	Mild	LASR	45	33
O=C(NCCCCN1CCN(c2ncccn2)CC1)N1Cc2cccc(O)c2C1	ZINC000875236735	GD	On-Demand	Clean	HTR1A	71	59
O=C(NCCCCN1CCN(c2ncccn2)CC1)N1Cc2cccc(O)c2C1	ZINC000875236735	GD	On-Demand	Clean	DRD2	66	46
O=C(NCCCCN1CCN(c2ncccn2)CC1)N1Cc2cccc(O)c2C1	ZINC000875236735	GD	On-Demand	Clean	DRD1	17	42
O=C(NCCCCN1CCN(c2ncccn2)CC1)N1Cc2cccc(O)c2C1	ZINC000875236735	GD	On-Demand	Clean	DRD4	43	46
O=C(NCCCCN1CCN(c2ncccn2)CC1)N1Cc2cccc(O)c2C1	ZINC000875236735	GD	On-Demand	Clean	ADRA1D	21	42
O=C(NCCCCN1CCN(c2ncccn2)CC1)N1Cc2cccc(O)c2C1	ZINC000875236735	GD	On-Demand	Clean	HTR2A	45	46
O=C(NCCCCN1CCN(c2ncccn2)CC1)N1Cc2cccc(O)c2C1	ZINC000875236735	GD	On-Demand	Clean	HTR2C	29	43
O=C(NCCCCN1CCN(c2ncccn2)CC1)N1Cc2cccc(O)c2C1	ZINC000875236735	GD	On-Demand	Clean	ADRA1A	27	42
O=C(NCCCCN1CCN(c2ncccn2)CC1)N1Cc2cccc(O)c2C1	ZINC000875236735	GD	On-Demand	Clean	DRD3	87	44
O=C(NCCCCN1CCN(c2ncccn2)CC1)N1Cc2cccc(O)c2C1	ZINC000875236735	GD	On-Demand	Clean	HTR7	50	40
CC[C@@H](NC(=O)NCCOc1cccc(NC(C)=O)c1)[C@@H](O)c1ccccc1	ZINC000875236756	GF	On-Demand	Anodyne	ADRB1	23	40
CC[C@@H](NC(=O)NCCOc1cccc(NC(C)=O)c1)[C@@H](O)c1ccccc1	ZINC000875236756	GF	On-Demand	Anodyne	HRH2	26	41
CC[C@@H](NC(=O)NCCOc1cccc(NC(C)=O)c1)[C@@H](O)c1ccccc1	ZINC000875236756	GF	On-Demand	Anodyne	MTNR1A	33	46
CC[C@@H](NC(=O)NCCOc1cccc(NC(C)=O)c1)[C@@H](O)c1ccccc1	ZINC000875236756	GF	On-Demand	Anodyne	MTNR1B	32	46
CC[C@@H](NC(=O)NCCOc1cccc(NC(C)=O)c1)[C@@H](O)c1ccccc1	ZINC000875236756	GF	On-Demand	Anodyne	PDS	64	36
CC[C@@H](NC(=O)NCCOc1cccc(NC(C)=O)c1)[C@H](O)c1ccccc1	ZINC000875236759	GF	On-Demand	Anodyne	ADRB1	23	40
CC[C@@H](NC(=O)NCCOc1cccc(NC(C)=O)c1)[C@H](O)c1ccccc1	ZINC000875236759	GF	On-Demand	Anodyne	HRH2	26	41
CC[C@@H](NC(=O)NCCOc1cccc(NC(C)=O)c1)[C@H](O)c1ccccc1	ZINC000875236759	GF	On-Demand	Anodyne	MTNR1A	33	46
CC[C@@H](NC(=O)NCCOc1cccc(NC(C)=O)c1)[C@H](O)c1ccccc1	ZINC000875236759	GF	On-Demand	Anodyne	MTNR1B	32	46
CC[C@@H](NC(=O)NCCOc1cccc(NC(C)=O)c1)[C@H](O)c1ccccc1	ZINC000875236759	GF	On-Demand	Anodyne	PDS	64	36
CC[C@H](C[C@H](C)O)NC(=O)NCCCCN1CCN(c2ncccn2)CC1	ZINC000875236804	GD	On-Demand	Anodyne	HTR1A	44	53
CC[C@H](C[C@H](C)O)NC(=O)NCCCCN1CCN(c2ncccn2)CC1	ZINC000875236804	GD	On-Demand	Anodyne	DRD2	48	43
CC[C@H](C[C@H](C)O)NC(=O)NCCCCN1CCN(c2ncccn2)CC1	ZINC000875236804	GD	On-Demand	Anodyne	DRD4	24	41
CC[C@H](C[C@H](C)O)NC(=O)NCCCCN1CCN(c2ncccn2)CC1	ZINC000875236804	GD	On-Demand	Anodyne	HTR2A	31	42
CC[C@H](C[C@H](C)O)NC(=O)NCCCCN1CCN(c2ncccn2)CC1	ZINC000875236804	GD	On-Demand	Anodyne	HTR2C	24	41
CC[C@H](C[C@H](C)O)NC(=O)NCCCCN1CCN(c2ncccn2)CC1	ZINC000875236804	GD	On-Demand	Anodyne	DRD3	69	41
CCC1(CC)CCCN1C(=O)NCCCCN1CCN(c2ncccn2)CC1	ZINC000875236810	GF	On-Demand	Anodyne	HTR1A	51	54
CCC1(CC)CCCN1C(=O)NCCCCN1CCN(c2ncccn2)CC1	ZINC000875236810	GF	On-Demand	Anodyne	DRD2	55	49
CCC1(CC)CCCN1C(=O)NCCCCN1CCN(c2ncccn2)CC1	ZINC000875236810	GF	On-Demand	Anodyne	DRD4	29	42
CCC1(CC)CCCN1C(=O)NCCCCN1CCN(c2ncccn2)CC1	ZINC000875236810	GF	On-Demand	Anodyne	ADRA1D	30	49
CCC1(CC)CCCN1C(=O)NCCCCN1CCN(c2ncccn2)CC1	ZINC000875236810	GF	On-Demand	Anodyne	HTR2A	36	49
CCC1(CC)CCCN1C(=O)NCCCCN1CCN(c2ncccn2)CC1	ZINC000875236810	GF	On-Demand	Anodyne	HTR2C	27	49
CCC1(CC)CCCN1C(=O)NCCCCN1CCN(c2ncccn2)CC1	ZINC000875236810	GF	On-Demand	Anodyne	ADRA1A	43	40
CCC1(CC)CCCN1C(=O)NCCCCN1CCN(c2ncccn2)CC1	ZINC000875236810	GF	On-Demand	Anodyne	DRD3	72	49
C[C@H](NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)[C@H](C)c1ccccc1	ZINC000875236876	ED	On-Demand	Anodyne	BIRC8	46	34
C[C@H](NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)[C@@H](C)c1ccccc1	ZINC000875236877	ED	On-Demand	Anodyne	BIRC8	46	34
C[C@H](NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)[C@H](C)c1ccccc1	ZINC000875236878	ED	On-Demand	Anodyne	BIRC8	46	34
C[C@H](NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)[C@@H](C)c1ccccc1	ZINC000875236879	ED	On-Demand	Anodyne	BIRC8	46	34
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875237011	FE	On-Demand	Anodyne	HRH2	41	42
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875237011	FE	On-Demand	Anodyne	CCR3	30	41
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875237011	FE	On-Demand	Anodyne	MTNR1A	20	42
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875237011	FE	On-Demand	Anodyne	MTNR1B	19	42
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875237011	FE	On-Demand	Anodyne	EPHX2	26	40
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875237018	FE	On-Demand	Anodyne	HRH2	41	42
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875237018	FE	On-Demand	Anodyne	CCR3	30	41
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875237018	FE	On-Demand	Anodyne	MTNR1A	20	42
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875237018	FE	On-Demand	Anodyne	MTNR1B	19	42
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875237018	FE	On-Demand	Anodyne	EPHX2	26	40
CCC[C@H](NC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccccn1	ZINC000875237036	EI	On-Demand	Anodyne	CALCRL	18	40
CCC[C@H](NC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccccn1	ZINC000875237045	EI	On-Demand	Anodyne	CALCRL	18	40
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875237051	GF	On-Demand	Anodyne	HRH2	43	41
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875237051	GF	On-Demand	Anodyne	CPT1A	56	45
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875237051	GF	On-Demand	Anodyne	MTNR1A	17	40
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875237051	GF	On-Demand	Anodyne	MTNR1B	21	40
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875237053	GF	On-Demand	Anodyne	HRH2	43	41
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875237053	GF	On-Demand	Anodyne	CPT1A	56	45
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875237053	GF	On-Demand	Anodyne	MTNR1A	17	40
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875237053	GF	On-Demand	Anodyne	MTNR1B	21	40
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875237055	GF	On-Demand	Anodyne	HRH2	43	41
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875237055	GF	On-Demand	Anodyne	CPT1A	56	45
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875237055	GF	On-Demand	Anodyne	MTNR1A	17	40
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875237055	GF	On-Demand	Anodyne	MTNR1B	21	40
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875237057	GF	On-Demand	Anodyne	HRH2	43	41
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875237057	GF	On-Demand	Anodyne	CPT1A	56	45
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875237057	GF	On-Demand	Anodyne	MTNR1A	17	40
CC(=O)Nc1cccc(OCCNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875237057	GF	On-Demand	Anodyne	MTNR1B	21	40
O=C(N[C@H](c1ccc(Cl)cc1)C1CCC1)N1CCC(CO)(CO)CC1	ZINC000875237132	FF	On-Demand	Anodyne	CACNA1H	49	37
O=C(N[C@H](c1ccc(Cl)cc1)C1CCC1)N1CCC(CO)(CO)CC1	ZINC000875237132	FF	On-Demand	Anodyne	CCR1	53	39
O=C(N[C@@H](c1ccc(Cl)cc1)C1CCC1)N1CCC(CO)(CO)CC1	ZINC000875237133	FF	On-Demand	Anodyne	CACNA1H	49	37
O=C(N[C@@H](c1ccc(Cl)cc1)C1CCC1)N1CCC(CO)(CO)CC1	ZINC000875237133	FF	On-Demand	Anodyne	CCR1	53	39
CC(=O)Nc1cccc(OCCNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875237135	ED	On-Demand	Anodyne	HRH2	35	42
CC(=O)Nc1cccc(OCCNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875237135	ED	On-Demand	Anodyne	MTNR1A	23	44
CC(=O)Nc1cccc(OCCNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875237135	ED	On-Demand	Anodyne	MTNR1B	22	44
CC(=O)Nc1cccc(OCCNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875237135	ED	On-Demand	Anodyne	EPHX2	33	41
CC(=O)Nc1cccc(OCCNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875237137	ED	On-Demand	Anodyne	HRH2	35	42
CC(=O)Nc1cccc(OCCNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875237137	ED	On-Demand	Anodyne	MTNR1A	23	44
CC(=O)Nc1cccc(OCCNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875237137	ED	On-Demand	Anodyne	MTNR1B	22	44
CC(=O)Nc1cccc(OCCNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875237137	ED	On-Demand	Anodyne	EPHX2	33	41
C[C@H](NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1)[C@@H](C)c1ccccc1	ZINC000875237198	FF	On-Demand	Anodyne	BIRC8	52	31
C[C@H](NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1)[C@H](C)c1ccccc1	ZINC000875237199	FF	On-Demand	Anodyne	BIRC8	52	31
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)[C@@H](C)c2ccccc2)C1	ZINC000875237223	EE	On-Demand	Anodyne	BIRC8	46	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)[C@H](C)c2ccccc2)C1	ZINC000875237224	EE	On-Demand	Anodyne	BIRC8	46	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)[C@H](C)c2ccccc2)C1	ZINC000875237225	EE	On-Demand	Anodyne	BIRC8	46	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)[C@@H](C)c2ccccc2)C1	ZINC000875237226	EE	On-Demand	Anodyne	BIRC8	46	35
CC(=O)C1CCN(C(=O)C(=O)N[C@H](c2ccccc2Cl)C(C)C)CC1	ZINC000875237321	FF	On-Demand	Anodyne	OPRL1	33	42
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](c2ccccc2Cl)C(C)C)CC1	ZINC000875237322	FF	On-Demand	Anodyne	OPRL1	33	42
C#C[C@@H]1CC[C@@H](NC(=O)NC2(c3ccc(F)cc3)CC2)CC1	ZINC000875237378	DG	On-Demand	Mild	EPHX2	20	41
Cc1nn(C)c2ncc(C(=O)OCC(=O)N3CCN(C(c4ccccc4)c4ccccc4)CC3)cc12	ZINC000875237387	JG	On-Demand	Anodyne	PTAFR	34	42
C[C@H](NC(=O)C(=O)N(C)CCN1CC2(CCOCC2)C1)[C@@H](C)c1ccccc1	ZINC000875237388	GD	On-Demand	Anodyne	CASR	49	38
C[C@H](NC(=O)C(=O)N(C)CCN1CC2(CCOCC2)C1)[C@H](C)c1ccccc1	ZINC000875237390	GD	On-Demand	Anodyne	CASR	49	38
Cc1nn(C)c2ncc(C(=O)OCC(=O)N3CCN(Cc4cccc5ccccc45)CC3)cc12	ZINC000875237405	JF	On-Demand	Anodyne	HTR1B	15	46
Cc1ncsc1CNC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875237455	CD	On-Demand	Anodyne	VHL	41	32
Cc1ncsc1CNC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875237456	CD	On-Demand	Anodyne	VHL	41	32
Cc1ncsc1CNC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875237571	CD	On-Demand	Anodyne	VHL	49	32
CCN1CCC[C@H](CNC(=O)NCc2ccc(O)c(Cl)c2)C1	ZINC000875237581	EF	On-Demand	Anodyne	P2RX7	15	40
CCN1CCC[C@H](CNC(=O)NCc2ccc(O)c(Cl)c2)C1	ZINC000875237581	EF	On-Demand	Anodyne	CCR3	59	42
CCN1CCC[C@H](CNC(=O)NCc2ccc(O)c(Cl)c2)C1	ZINC000875237581	EF	On-Demand	Anodyne	CACNA1I	65	36
CCN1CCC[C@H](CNC(=O)NCc2ccc(O)c(Cl)c2)C1	ZINC000875237581	EF	On-Demand	Anodyne	NCE103	15	40
C[C@H](NC(=O)C(=O)N1CC[C@@H]2CSC[C@@H]2C1)[C@H](C)c1ccccc1	ZINC000875237599	EF	On-Demand	Anodyne	BIRC8	56	35
C[C@H](NC(=O)C(=O)N1CC[C@@H]2CSC[C@@H]2C1)[C@@H](C)c1ccccc1	ZINC000875237600	EF	On-Demand	Anodyne	BIRC8	56	35
C[C@H](NC(=O)C(=O)N1CC[C@@H]2CSC[C@H]2C1)[C@H](C)c1ccccc1	ZINC000875237601	EF	On-Demand	Anodyne	BIRC8	56	35
C[C@H](NC(=O)C(=O)N1CC[C@@H]2CSC[C@H]2C1)[C@@H](C)c1ccccc1	ZINC000875237602	EF	On-Demand	Anodyne	BIRC8	56	35
CCN1CCC[C@H](CNC(=O)NCC2(NC(=O)OC(C)(C)C)CCOCC2)C1	ZINC000875237614	GE	On-Demand	Anodyne	CACNA1I	41	35
C[C@H](NC(=O)C(=O)N1CCC(CO)(CO)CC1)[C@@H](C)c1ccccc1	ZINC000875237647	EC	On-Demand	Anodyne	MME	15	41
C[C@H](NC(=O)C(=O)N1CCC(CO)(CO)CC1)[C@H](C)c1ccccc1	ZINC000875237648	EC	On-Demand	Anodyne	MME	15	41
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)[C@H](C)c2ccccc2)CC1	ZINC000875237722	EE	On-Demand	Anodyne	CCR5	16	40
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)[C@H](C)c2ccccc2)CC1	ZINC000875237722	EE	On-Demand	Anodyne	BIRC8	55	35
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)[C@@H](C)c2ccccc2)CC1	ZINC000875237723	EE	On-Demand	Anodyne	CCR5	16	40
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)[C@@H](C)c2ccccc2)CC1	ZINC000875237723	EE	On-Demand	Anodyne	BIRC8	55	35
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)[C@H](C)c2ccccc2)CC1	ZINC000875237724	EE	On-Demand	Anodyne	CCR5	16	40
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)[C@H](C)c2ccccc2)CC1	ZINC000875237724	EE	On-Demand	Anodyne	BIRC8	55	35
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)[C@@H](C)c2ccccc2)CC1	ZINC000875237725	EE	On-Demand	Anodyne	CCR5	16	40
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)[C@@H](C)c2ccccc2)CC1	ZINC000875237725	EE	On-Demand	Anodyne	BIRC8	55	35
CN1CCC(CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875237748	FE	On-Demand	Mild	CCR3	51	47
CN1CCC(CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875237748	FE	On-Demand	Mild	ITK	22	49
CN1CCC(CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875237748	FE	On-Demand	Mild	PANC	58	41
COCC(C)(C)CCNC(=O)NCC1CCN(C)CC1	ZINC000875237761	CD	On-Demand	Anodyne	CACNA1H	16	42
COCC(C)(C)CCNC(=O)NCC1CCN(C)CC1	ZINC000875237761	CD	On-Demand	Anodyne	CACNA1I	66	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc2ccccc2c1	ZINC000875237785	EG	On-Demand	Anodyne	SLC6A4	42	51
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc2ccccc2c1	ZINC000875237785	EG	On-Demand	Anodyne	SLC6A3	68	51
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc2ccccc2c1	ZINC000875237787	EG	On-Demand	Anodyne	SLC6A4	42	51
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc2ccccc2c1	ZINC000875237787	EG	On-Demand	Anodyne	SLC6A3	68	51
CN1CCC(CNC(=O)NCc2cccc(OC(C)(C)C)c2)CC1	ZINC000875237791	EG	On-Demand	Anodyne	CCR3	35	40
CN1CCC(CNC(=O)NCc2cccc(OC(C)(C)C)c2)CC1	ZINC000875237791	EG	On-Demand	Anodyne	EPHX2	16	41
CN1CCC(CNC(=O)NCc2cccc(OC(C)(C)C)c2)CC1	ZINC000875237791	EG	On-Demand	Anodyne	CACNA1I	78	42
CN1CCC(CNC(=O)NCC2CCC3(CC2)CC3)CC1	ZINC000875237801	CF	On-Demand	Anodyne	CACNA1I	55	36
CN1CCC(CNC(=O)NC[C@@H]2CC=CC[C@H]2C(F)(F)F)CC1	ZINC000875237829	EF	On-Demand	Anodyne	CACNA1I	67	39
CN1CCC(CNC(=O)NCc2cc(F)cc(NC(=O)OC(C)(C)C)c2)CC1	ZINC000875237831	GG	On-Demand	Anodyne	CCR3	48	37
CN1CCC(CNC(=O)NCc2cc(F)cc(NC(=O)OC(C)(C)C)c2)CC1	ZINC000875237831	GG	On-Demand	Anodyne	CACNA1I	70	40
CN1CCC(CNC(=O)NCC2(NC(=O)OC(C)(C)C)CCOCC2)CC1	ZINC000875237835	GD	On-Demand	Anodyne	CACNA1I	48	35
O=C(NCc1ccc2ccccc2c1)N1CCC(CO)(CO)CC1	ZINC000875237856	EE	On-Demand	Anodyne	NPFFR2	22	44
O=C(NCc1ccc2ccccc2c1)N1CCC(CO)(CO)CC1	ZINC000875237856	EE	On-Demand	Anodyne	EPHX2	16	43
O=C(NCc1ccc2ccccc2c1)N1CCC(CO)(CO)CC1	ZINC000875237856	EE	On-Demand	Anodyne	NPFFR1	23	44
O=C(NCc1ccc2ccccc2c1)N1CCC(CO)(CO)CC1	ZINC000875237856	EE	On-Demand	Anodyne	NAMPT	16	43
Cc1ncsc1CNC(=O)NC1CC(Nc2ccccc2)C1	ZINC000875237892	DF	On-Demand	Anodyne	VHL	41	33
CN1CCC(CNC(=O)N[C@@H]2C[C@@H](C(=O)OC(C)(C)C)C2)CC1	ZINC000875237893	ED	On-Demand	Anodyne	CACNA1I	48	36
CN1CCC(CNC(=O)N[C@@H]2C[C@H](C(=O)OC(C)(C)C)C2)CC1	ZINC000875237895	ED	On-Demand	Anodyne	CACNA1I	48	36
CN1CCC(CNC(=O)NC2CC(C(=O)OC(C)(C)C)C2)CC1	ZINC000875237896	ED	On-Demand	Anodyne	CACNA1I	48	36
O=C(c1cc2ncc(Br)cn2n1)N1CCN2CCCC[C@@H]2C1	ZINC000875237898	FD	On-Demand	Anodyne	L3MBTL3	57	41
O=C(c1cc2ncc(Br)cn2n1)N1CCN2CCCC[C@H]2C1	ZINC000875237900	FD	On-Demand	Anodyne	L3MBTL3	57	41
Cc1ncsc1CNC(=O)N1CC([C@H]2CCC[C@H](C)C2)C1	ZINC000875237933	DG	On-Demand	Anodyne	VHL	51	35
Cc1ncsc1CNC(=O)N1CC([C@@H]2CCC[C@@H](C)C2)C1	ZINC000875237934	DG	On-Demand	Anodyne	VHL	51	35
Cc1ncsc1CNC(=O)N1CC([C@@H]2CCC[C@H](C)C2)C1	ZINC000875237935	DG	On-Demand	Anodyne	VHL	51	35
Cc1ncsc1CNC(=O)N1CC([C@H]2CCC[C@@H](C)C2)C1	ZINC000875237936	DG	On-Demand	Anodyne	VHL	51	35
CCN1CCC[C@H](CNC(=O)NCC2(c3ccccc3)CCN(C)CC2)C1	ZINC000875237950	FF	On-Demand	Anodyne	SLC6A1	45	31
CCN1CCC[C@H](CNC(=O)NCC2(c3ccccc3)CCN(C)CC2)C1	ZINC000875237950	FF	On-Demand	Anodyne	CCR3	35	40
CCN1CCC[C@H](CNC(=O)NCC2(c3ccccc3)CCN(C)CC2)C1	ZINC000875237950	FF	On-Demand	Anodyne	KCNA3	47	36
CCN1CCC[C@H](CNC(=O)NCC2(c3ccccc3)CCN(C)CC2)C1	ZINC000875237950	FF	On-Demand	Anodyne	CACNA1I	19	42
CCN1CCC[C@H](CNC(=O)NCc2ccc(N(C)C(C)=O)cc2)C1	ZINC000875237970	EE	On-Demand	Anodyne	CCR3	50	38
Cc1ncsc1CNC(=O)N1CCC[C@@H](C(=O)N[C@H]2CCC[C@H](O)C2)C1	ZINC000875237975	GD	On-Demand	Anodyne	VHL	61	39
Cc1ncsc1CNC(=O)N1CCC[C@@H](C(=O)N[C@@H]2CCC[C@H](O)C2)C1	ZINC000875237976	GD	On-Demand	Anodyne	VHL	61	39
Cc1ncsc1CNC(=O)N1CCC[C@@H](C(=O)N[C@H]2CCC[C@@H](O)C2)C1	ZINC000875237977	GD	On-Demand	Anodyne	VHL	61	39
Cc1ncsc1CNC(=O)N1CCC[C@@H](C(=O)N[C@@H]2CCC[C@@H](O)C2)C1	ZINC000875237978	GD	On-Demand	Anodyne	VHL	61	39
COCC1CC(NC(=O)NC2(c3ccc(F)cc3)CC2)C1	ZINC000875238025	CF	On-Demand	Anodyne	EPHX2	18	41
CN1CCC(CNC(=O)NCCOC(F)(F)C(F)(F)F)CC1	ZINC000875238052	ED	On-Demand	Anodyne	CACNA1I	60	39
CN1CCC(CNC(=O)NCc2ccc(Br)cn2)CC1	ZINC000875238059	ED	On-Demand	Anodyne	CACNA1I	44	35
CC1(C)CCC[C@H]1NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875238072	FF	On-Demand	Anodyne	ETHR	43	46
CN1CCC(CNC(=O)NC2CCC(OC(C)(C)C)CC2)CC1	ZINC000875238073	EF	On-Demand	Anodyne	CACNA1I	48	36
CCOC(=O)C1=CC[C@H](NC(=O)NCC2CCN(C)CC2)C1	ZINC000875238074	DD	On-Demand	Anodyne	CACNA1I	42	33
C[S@](=N)(=O)N1CCN(C(=O)NCc2ccc3ccccc3c2)CC1	ZINC000875238082	EE	On-Demand	Anodyne	F2	21	41
C[S@](=N)(=O)N1CCN(C(=O)NCc2ccc3ccccc3c2)CC1	ZINC000875238082	EE	On-Demand	Anodyne	TRY2_BOVIN	76	41
C[S@](=N)(=O)N1CCN(C(=O)NCc2ccc3ccccc3c2)CC1	ZINC000875238082	EE	On-Demand	Anodyne	TGM2	15	43
C[S@](=N)(=O)N1CCN(C(=O)NCc2ccc3ccccc3c2)CC1	ZINC000875238082	EE	On-Demand	Anodyne	F13A1	18	43
C[S@](=N)(=O)N1CCN(C(=O)NCc2ccc3ccccc3c2)CC1	ZINC000875238082	EE	On-Demand	Anodyne	NAMPT	36	40
CN1CCC(CNC(=O)NCc2ccc(C(C)(C)C)o2)CC1	ZINC000875238105	DF	On-Demand	Anodyne	CACNA1I	70	46
C[C@@H](NC(=O)NCC1CCN(C)CC1)c1cc2cnccc2o1	ZINC000875238114	DF	On-Demand	Anodyne	CACNA1I	63	36
C[C@H](NC(=O)NCC1CCN(C)CC1)c1cc2cnccc2o1	ZINC000875238115	DF	On-Demand	Anodyne	CACNA1I	63	36
CN1CCC(CNC(=O)N[C@@H]2C[C@@H](S(=O)(=O)c3ccccc3)C2)CC1	ZINC000875238127	FD	On-Demand	Anodyne	CTSS	25	41
CN1CCC(CNC(=O)N[C@@H]2C[C@@H](S(=O)(=O)c3ccccc3)C2)CC1	ZINC000875238127	FD	On-Demand	Anodyne	EPHX2	23	41
CN1CCC(CNC(=O)N[C@@H]2C[C@@H](S(=O)(=O)c3ccccc3)C2)CC1	ZINC000875238127	FD	On-Demand	Anodyne	CACNA1I	57	36
CN1CCN(C2CCN(C(=O)C(=O)N[C@H]3CCCC3(C)C)CC2)CC1	ZINC000875238130	FC	On-Demand	Anodyne	L3MBTL3	40	40
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3CCCC3(C)C)CC2)CC1	ZINC000875238131	FC	On-Demand	Anodyne	L3MBTL3	40	40
CN1CCC(CNC(=O)NC(c2ccnn2C)c2ccnn2C)CC1	ZINC000875238132	EC	On-Demand	Anodyne	CACNA1I	65	38
O=C(NCc1nc(O)c2c(n1)CCOC2)NC1(c2ccc(F)cc2)CC1	ZINC000875238173	FD	On-Demand	Anodyne	WNT3A	55	38
C[C@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)[C@@H](C)c1ccccc1	ZINC000875238174	GD	On-Demand	Anodyne	CCR5	17	40
C[C@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)[C@@H](C)c1ccccc1	ZINC000875238174	GD	On-Demand	Anodyne	BIRC8	57	36
C[C@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)[C@@H](C)c1ccccc1	ZINC000875238174	GD	On-Demand	Anodyne	L3MBTL3	75	42
C[C@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)[C@H](C)c1ccccc1	ZINC000875238176	GD	On-Demand	Anodyne	CCR5	17	40
C[C@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)[C@H](C)c1ccccc1	ZINC000875238176	GD	On-Demand	Anodyne	BIRC8	57	36
C[C@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)[C@H](C)c1ccccc1	ZINC000875238176	GD	On-Demand	Anodyne	L3MBTL3	75	42
N#Cc1ccc(Cn2cc(NC(=O)NC[C@H]3CN4CCC[C@@H]4CO3)cn2)cc1	ZINC000875238203	GD	On-Demand	Mild	ITK	15	44
N#Cc1ccc(Cn2cc(NC(=O)NC[C@H]3CN4CCC[C@@H]4CO3)cn2)cc1	ZINC000875238203	GD	On-Demand	Mild	PANC	52	36
N#Cc1ccc(Cn2cc(NC(=O)NC[C@H]3CN4CCC[C@H]4CO3)cn2)cc1	ZINC000875238204	GD	On-Demand	Mild	ITK	15	44
N#Cc1ccc(Cn2cc(NC(=O)NC[C@H]3CN4CCC[C@H]4CO3)cn2)cc1	ZINC000875238204	GD	On-Demand	Mild	PANC	52	36
N#Cc1ccc(Cn2cc(NC(=O)NC[C@@H]3CN4CCC[C@H]4CO3)cn2)cc1	ZINC000875238205	GD	On-Demand	Mild	ITK	15	44
N#Cc1ccc(Cn2cc(NC(=O)NC[C@@H]3CN4CCC[C@H]4CO3)cn2)cc1	ZINC000875238205	GD	On-Demand	Mild	PANC	52	36
N#Cc1ccc(Cn2cc(NC(=O)NC[C@@H]3CN4CCC[C@@H]4CO3)cn2)cc1	ZINC000875238206	GD	On-Demand	Mild	ITK	15	44
N#Cc1ccc(Cn2cc(NC(=O)NC[C@@H]3CN4CCC[C@@H]4CO3)cn2)cc1	ZINC000875238206	GD	On-Demand	Mild	PANC	52	36
O=C(NCc1ccc2ccccc2c1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875238237	GG	On-Demand	Anodyne	SMO	41	42
O=C(NCc1ccc2ccccc2c1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875238237	GG	On-Demand	Anodyne	ETHR	58	34
O=C(NCc1ccc2ccccc2c1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875238238	GG	On-Demand	Anodyne	SMO	41	42
O=C(NCc1ccc2ccccc2c1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875238238	GG	On-Demand	Anodyne	ETHR	58	34
CN1CCC(CNC(=O)N[C@@H]2CC[C@@H](CNC(=O)OC(C)(C)C)CC2)CC1	ZINC000875238239	GF	On-Demand	Anodyne	CACNA1I	48	36
CN1CCC(CNC(=O)N[C@@H]2CC[C@@H](NC(=O)OC(C)(C)C)CC2)CC1	ZINC000875238242	FE	On-Demand	Anodyne	CACNA1I	49	36
CN1CCC(CNC(=O)N[C@H]2Cc3ccc(C#N)cc3C2)CC1	ZINC000875238276	DD	On-Demand	Mild	CACNA1I	53	34
CN1CCC(CNC(=O)N[C@@H]2Cc3ccc(C#N)cc3C2)CC1	ZINC000875238277	DD	On-Demand	Mild	CACNA1I	53	34
CCC(CC)(CNC(=O)NCC1CCN(C)CC1)C(F)(F)F	ZINC000875238282	DF	On-Demand	Anodyne	CACNA1I	58	38
CN1CCC(CNC(=O)NCc2ncc(Cl)s2)CC1	ZINC000875238291	DD	On-Demand	Anodyne	CACNA1I	74	39
CN1CCO[C@@H](CNC(=O)NNc2ccc(OCc3ccccc3)cc2)C1	ZINC000875238301	FE	On-Demand	Reactive	TSHR	47	33
CN1CCO[C@@H](CNC(=O)NNc2ccc(OCc3ccccc3)cc2)C1	ZINC000875238301	FE	On-Demand	Reactive	LTA4H	29	40
CN1CCO[C@H](CNC(=O)NNc2ccc(OCc3ccccc3)cc2)C1	ZINC000875238302	FE	On-Demand	Reactive	TSHR	47	33
CN1CCO[C@H](CNC(=O)NNc2ccc(OCc3ccccc3)cc2)C1	ZINC000875238302	FE	On-Demand	Reactive	LTA4H	29	40
CN1CCC(CNC(=O)NCc2nc(-c3ccncc3)cs2)CC1	ZINC000875238305	EE	On-Demand	Anodyne	ROCK1	27	43
CN1CCC(CNC(=O)NCc2nc(-c3ccncc3)cs2)CC1	ZINC000875238305	EE	On-Demand	Anodyne	ROCK2	21	43
CN1CCC(CNC(=O)NC[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)OC(C)(C)C)CC1	ZINC000875238316	GF	On-Demand	Anodyne	CACNA1I	49	37
CN1CCC(CNC(=O)NC2CC(C(N)=O)C2)CC1	ZINC000875238317	CB	On-Demand	Anodyne	CACNA1I	54	35
CN1CCC(CNC(=O)NC2CCN(CC(=O)OC(C)(C)C)CC2)CC1	ZINC000875238319	FD	On-Demand	Anodyne	CACNA1I	59	38
CN1CCC(CNC(=O)NCC(F)(F)c2ccc(F)cc2F)CC1	ZINC000875238326	EF	On-Demand	Anodyne	P2RX7	15	42
CN1CCC(CNC(=O)NCC(F)(F)c2ccc(F)cc2F)CC1	ZINC000875238326	EF	On-Demand	Anodyne	CACNA1I	65	41
Cc1cccc(CN2CCO[C@@H](CNC(=O)NCC3CCN(C)CC3)C2)c1	ZINC000875238373	FD	On-Demand	Anodyne	DRD4	32	41
Cc1cccc(CN2CCO[C@@H](CNC(=O)NCC3CCN(C)CC3)C2)c1	ZINC000875238373	FD	On-Demand	Anodyne	ACHE	18	43
Cc1cccc(CN2CCO[C@@H](CNC(=O)NCC3CCN(C)CC3)C2)c1	ZINC000875238373	FD	On-Demand	Anodyne	AVPR1B	23	40
Cc1cccc(CN2CCO[C@@H](CNC(=O)NCC3CCN(C)CC3)C2)c1	ZINC000875238373	FD	On-Demand	Anodyne	CCR3	32	49
Cc1cccc(CN2CCO[C@@H](CNC(=O)NCC3CCN(C)CC3)C2)c1	ZINC000875238373	FD	On-Demand	Anodyne	CACNA1I	49	39
Cc1cccc(CN2CCO[C@H](CNC(=O)NCC3CCN(C)CC3)C2)c1	ZINC000875238374	FD	On-Demand	Anodyne	DRD4	32	41
Cc1cccc(CN2CCO[C@H](CNC(=O)NCC3CCN(C)CC3)C2)c1	ZINC000875238374	FD	On-Demand	Anodyne	ACHE	18	43
Cc1cccc(CN2CCO[C@H](CNC(=O)NCC3CCN(C)CC3)C2)c1	ZINC000875238374	FD	On-Demand	Anodyne	AVPR1B	23	40
Cc1cccc(CN2CCO[C@H](CNC(=O)NCC3CCN(C)CC3)C2)c1	ZINC000875238374	FD	On-Demand	Anodyne	CCR3	32	49
Cc1cccc(CN2CCO[C@H](CNC(=O)NCC3CCN(C)CC3)C2)c1	ZINC000875238374	FD	On-Demand	Anodyne	CACNA1I	49	39
CN1CCC(CNC(=O)NCc2ccc(C3(C)OCCO3)cc2)CC1	ZINC000875238375	EE	On-Demand	Anodyne	HTR4	41	34
CN1CCC(CNC(=O)NCc2ccc(C3(C)OCCO3)cc2)CC1	ZINC000875238375	EE	On-Demand	Anodyne	CACNA1I	45	39
CN1CCC(CNC(=O)NCC2C[C@@H]3CC[C@H](C2)S3(=O)=O)CC1	ZINC000875238380	EC	On-Demand	Anodyne	CACNA1I	50	35
CN1CCC(CNC(=O)NCc2noc3ccc(F)cc23)CC1	ZINC000875238385	DE	On-Demand	Anodyne	HTR1F	31	45
CN1CCC(CNC(=O)NCc2noc3ccc(F)cc23)CC1	ZINC000875238385	DE	On-Demand	Anodyne	CACNA1I	43	37
CN1CCC(CNC(=O)NCc2cc3c(nc2O)CCCC3)CC1	ZINC000875238416	ED	On-Demand	Anodyne	CACNA1I	53	35
C[C@H](NC(=O)NCC1CCN(C)CC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875238419	GF	On-Demand	Anodyne	CACNA1I	48	35
C[C@H](NC(=O)NCC1CCN(C)CC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875238419	GF	On-Demand	Anodyne	GPR119	30	43
C[C@@H](NC(=O)NCC1CCN(C)CC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875238420	GF	On-Demand	Anodyne	CACNA1I	48	35
C[C@@H](NC(=O)NCC1CCN(C)CC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875238420	GF	On-Demand	Anodyne	GPR119	30	43
CN1CCC(CNC(=O)NCc2nn(C)cc2C(F)F)CC1	ZINC000875238428	DD	On-Demand	Anodyne	CACNA1I	59	35
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc3ccccc3c2)C1	ZINC000875238434	EG	On-Demand	Anodyne	TRY2_BOVIN	60	36
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc3ccccc3c2)C1	ZINC000875238434	EG	On-Demand	Anodyne	DPP7	15	42
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc3ccccc3c2)C1	ZINC000875238436	DG	On-Demand	Anodyne	F2	24	40
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc3ccccc3c2)C1	ZINC000875238436	DG	On-Demand	Anodyne	HRH3	15	44
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc3ccccc3c2)C1	ZINC000875238436	DG	On-Demand	Anodyne	NMT1	34	45
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc3ccccc3c2)C1	ZINC000875238436	DG	On-Demand	Anodyne	TRY1_BOVIN	20	40
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc3ccccc3c2)C1	ZINC000875238436	DG	On-Demand	Anodyne	CCR3	45	39
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc3ccccc3c2)C1	ZINC000875238436	DG	On-Demand	Anodyne	EPHX2	20	48
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc3ccccc3c2)C1	ZINC000875238436	DG	On-Demand	Anodyne	DPP7	64	52
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc3ccccc3c2)C1	ZINC000875238437	DG	On-Demand	Anodyne	F2	24	40
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc3ccccc3c2)C1	ZINC000875238437	DG	On-Demand	Anodyne	HRH3	15	44
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc3ccccc3c2)C1	ZINC000875238437	DG	On-Demand	Anodyne	NMT1	34	45
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc3ccccc3c2)C1	ZINC000875238437	DG	On-Demand	Anodyne	TRY1_BOVIN	20	40
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc3ccccc3c2)C1	ZINC000875238437	DG	On-Demand	Anodyne	CCR3	45	39
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc3ccccc3c2)C1	ZINC000875238437	DG	On-Demand	Anodyne	EPHX2	20	48
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc3ccccc3c2)C1	ZINC000875238437	DG	On-Demand	Anodyne	DPP7	64	52
O=CN1CCCN(C(=O)NCc2ccc3ccccc3c2)CC1	ZINC000875238442	DE	On-Demand	Anodyne	TRY2_BOVIN	43	40
O=CN1CCCN(C(=O)NCc2ccc3ccccc3c2)CC1	ZINC000875238442	DE	On-Demand	Anodyne	CCR3	15	42
O=CN1CCCN(C(=O)NCc2ccc3ccccc3c2)CC1	ZINC000875238442	DE	On-Demand	Anodyne	DPP7	27	49
O=C(NCc1ccc2ccccc2c1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875238447	EH	On-Demand	Anodyne	EPHX2	15	41
O=C(NCc1ccc2ccccc2c1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875238448	EH	On-Demand	Anodyne	EPHX2	15	41
O=C(NCc1ccc2ccccc2c1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875238449	EH	On-Demand	Anodyne	EPHX2	15	41
O=C(NCc1ccc2ccccc2c1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875238450	EH	On-Demand	Anodyne	EPHX2	15	41
CN1CCC(CNC(=O)NCc2cc(Cl)cc(Cl)c2F)CC1	ZINC000875238456	EG	On-Demand	Anodyne	P2RX7	65	41
CN1CCC(CNC(=O)NCc2cc(Cl)cc(Cl)c2F)CC1	ZINC000875238456	EG	On-Demand	Anodyne	EPHX2	24	42
CN1CCC(CNC(=O)NCc2cc(Cl)cc(Cl)c2F)CC1	ZINC000875238456	EG	On-Demand	Anodyne	CACNA1I	86	43
CC(=O)C1CCN(C(=O)NCc2ccc3ccccc3c2)CC1	ZINC000875238465	DG	On-Demand	Anodyne	NMT1	33	41
CC(=O)C1CCN(C(=O)NCc2ccc3ccccc3c2)CC1	ZINC000875238465	DG	On-Demand	Anodyne	EPHX2	36	42
O=C(NCCO)C1CCN(C(=O)NCc2ccc3ccccc3c2)CC1	ZINC000875238482	FD	On-Demand	Anodyne	NMT1	34	41
O=C(NCCO)C1CCN(C(=O)NCc2ccc3ccccc3c2)CC1	ZINC000875238482	FD	On-Demand	Anodyne	EPHX2	31	45
CN1CCC(CNC(=O)NCc2ccc(CN3C(=O)CNC3=O)cc2)CC1	ZINC000875238483	FC	On-Demand	Anodyne	CACNA1I	64	40
C=CC(C)(C)CCCNC(=O)NCC1CCN(C)CC1	ZINC000875238484	CF	On-Demand	Mild	CACNA1I	48	37
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc2ccccc2c1	ZINC000875238485	DG	On-Demand	Anodyne	SLC6A3	19	40
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc2ccccc2c1	ZINC000875238485	DG	On-Demand	Anodyne	CXCR4	42	33
CN1CCC(CNC(=O)NCc2cn(C(F)F)c3ccccc23)CC1	ZINC000875238492	FG	On-Demand	Anodyne	HTR4	52	41
CN1CCC(CNC(=O)NCc2cn(C(F)F)c3ccccc23)CC1	ZINC000875238492	FG	On-Demand	Anodyne	CACNA1I	41	35
COCC1CC(NC(=O)NCc2ccc3ccccc3c2)C1	ZINC000875238498	CG	On-Demand	Anodyne	MTNR1A	25	40
CN1CCC(CNC(=O)NCc2ccc(C(C)(C)C)s2)CC1	ZINC000875238504	DG	On-Demand	Anodyne	CACNA1I	69	42
CN1CCC(CNC(=O)NCc2c(I)cnn2C)CC1	ZINC000875238508	GD	On-Demand	Anodyne	CACNA1I	53	36
C[C@@H]1[C@@H](NC(=O)NCC2CCN(C)CC2)CCN1C(=O)OC(C)(C)C	ZINC000875238513	FE	On-Demand	Anodyne	CACNA1I	45	36
CN1CCC(CNC(=O)NCc2ccnc(F)c2)CC1	ZINC000875238532	CD	On-Demand	Anodyne	CACNA1I	71	37
CN1CCC(CNC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875238535	FF	On-Demand	Mild	CCR3	27	41
CN1CCC(CNC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875238535	FF	On-Demand	Mild	MCHR1	40	41
CN1CCC(CNC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875238535	FF	On-Demand	Mild	CACNA1I	60	38
CN1CCC(CNC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875238535	FF	On-Demand	Mild	PKNB	17	43
CN1CCC(CNC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875238536	FF	On-Demand	Mild	CCR3	27	41
CN1CCC(CNC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875238536	FF	On-Demand	Mild	MCHR1	40	41
CN1CCC(CNC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875238536	FF	On-Demand	Mild	CACNA1I	60	38
CN1CCC(CNC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875238536	FF	On-Demand	Mild	PKNB	17	43
C[C@H]1CC[C@@H](NC(=O)NCC2CCN(C)CC2)CN1C(=O)OC(C)(C)C	ZINC000875238538	FE	On-Demand	Anodyne	CACNA1I	43	34
C[C@H]1CC[C@H](NC(=O)NCC2CCN(C)CC2)CN1C(=O)OC(C)(C)C	ZINC000875238539	FE	On-Demand	Anodyne	CACNA1I	43	34
C[C@@H]1CC[C@H](NC(=O)NCC2CCN(C)CC2)CN1C(=O)OC(C)(C)C	ZINC000875238540	FE	On-Demand	Anodyne	CACNA1I	43	34
CN1CCC(CNC(=O)NCc2ccc(OC(F)F)cc2F)CC1	ZINC000875238592	EF	On-Demand	Anodyne	P2RX7	48	38
CN1CCC(CNC(=O)NCc2ccc(OC(F)F)cc2F)CC1	ZINC000875238592	EF	On-Demand	Anodyne	EPHX2	18	40
CN1CCC(CNC(=O)NCc2ccc(OC(F)F)cc2F)CC1	ZINC000875238592	EF	On-Demand	Anodyne	CACNA1I	67	35
CN1CCC(CNC(=O)NC2CCN(c3ccccc3C#N)CC2)CC1	ZINC000875238597	FE	On-Demand	Mild	HTR1A	29	43
CN1CCC(CNC(=O)NC2CCN(c3ccccc3C#N)CC2)CC1	ZINC000875238597	FE	On-Demand	Mild	DRD2	32	44
CN1CCC(CNC(=O)NC2CCN(c3ccccc3C#N)CC2)CC1	ZINC000875238597	FE	On-Demand	Mild	DRD4	26	44
CN1CCC(CNC(=O)NC2CCN(c3ccccc3C#N)CC2)CC1	ZINC000875238597	FE	On-Demand	Mild	DRD3	36	40
CN1CCC(CNC(=O)NC2CCN(c3ccccc3C#N)CC2)CC1	ZINC000875238597	FE	On-Demand	Mild	HTR7	18	42
CN1CCC(CNC(=O)NC2CCN(c3ccccc3C#N)CC2)CC1	ZINC000875238597	FE	On-Demand	Mild	NPY1R	18	42
CN1CCC(CNC(=O)NC2CCN(c3ccccc3C#N)CC2)CC1	ZINC000875238597	FE	On-Demand	Mild	CACNA1I	53	35
O=C(NCc1ccc2ccccc2c1)NCc1nc(O)c2c(n1)CCOC2	ZINC000875238602	FE	On-Demand	Anodyne	WNT3A	55	33
COC[C@H](NC(=O)NCC1CCN(C)CC1)c1cccc(Br)c1	ZINC000875238603	GF	On-Demand	Anodyne	CACNA1I	56	36
COC[C@@H](NC(=O)NCC1CCN(C)CC1)c1cccc(Br)c1	ZINC000875238604	GF	On-Demand	Anodyne	CACNA1I	56	36
CN1CCC(CNC(=O)NCc2ncc(Br)s2)CC1	ZINC000875238609	EE	On-Demand	Anodyne	CACNA1I	57	34
CN1CCC(CNC(=O)NCc2noc3cc(F)ccc23)CC1	ZINC000875238615	DE	On-Demand	Anodyne	DRD2	17	42
CN1CCC(CNC(=O)NCc2noc3cc(F)ccc23)CC1	ZINC000875238615	DE	On-Demand	Anodyne	HTR2A	24	41
CN1CCC(CNC(=O)NCc2noc3cc(F)ccc23)CC1	ZINC000875238615	DE	On-Demand	Anodyne	HTR1F	32	41
CN1CCC(CNC(=O)NCc2noc3cc(F)ccc23)CC1	ZINC000875238615	DE	On-Demand	Anodyne	CACNA1I	43	37
CN1CCC(CNC(=O)NCC(C)(C)C(C)(F)F)CC1	ZINC000875238620	CE	On-Demand	Anodyne	CACNA1I	55	41
CN1CCC(CNC(=O)N[C@H]2[C@@H]3c4cc(Br)ccc4C[C@H]32)CC1	ZINC000875238625	GF	On-Demand	Anodyne	CACNA1I	64	36
CN1CCC(CNC(=O)N[C@@H]2[C@H]3Cc4ccc(Br)cc4[C@H]32)CC1	ZINC000875238626	GF	On-Demand	Anodyne	CACNA1I	64	36
CN1CCC(CNC(=O)N[C@@H]2[C@@H]3Cc4ccc(Br)cc4[C@@H]32)CC1	ZINC000875238627	GF	On-Demand	Anodyne	CACNA1I	64	36
CN1CCC(CNC(=O)N[C@@H]2[C@H]3Cc4ccc(Br)cc4[C@@H]32)CC1	ZINC000875238628	GF	On-Demand	Anodyne	CACNA1I	64	36
CC(=O)N(C)c1ccc(CNC(=O)NCC2CCN(C)CC2)cc1	ZINC000875238658	ED	On-Demand	Anodyne	CACNA1I	49	40
CN1CCC(CNC(=O)NCc2cc(-c3ccc(F)cc3F)on2)CC1	ZINC000875238663	FF	On-Demand	Anodyne	CACNA1I	43	37
CN1CCC(CNC(=O)NCC2(c3ccccc3)CCN(C)CC2)CC1	ZINC000875238707	FE	On-Demand	Anodyne	HTR4	43	35
CN1CCC(CNC(=O)NCC2(c3ccccc3)CCN(C)CC2)CC1	ZINC000875238707	FE	On-Demand	Anodyne	KCNA3	56	42
CN1CCC(CNC(=O)NCC2(c3ccccc3)CCN(C)CC2)CC1	ZINC000875238707	FE	On-Demand	Anodyne	SOAT1	18	45
CN1CCC(CNC(=O)NCC2(c3ccccc3)CCN(C)CC2)CC1	ZINC000875238707	FE	On-Demand	Anodyne	EPHX2	18	42
CN1CCC(CNC(=O)NCC2(c3ccccc3)CCN(C)CC2)CC1	ZINC000875238707	FE	On-Demand	Anodyne	CACNA1I	64	46
O=C(NCc1ccc2ccccc2c1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875238712	FF	On-Demand	Anodyne	KCNJ11	61	32
CN1CCC(CNC(=O)NCCSCCC(F)(F)F)CC1	ZINC000875238713	EE	On-Demand	Anodyne	CACNA1I	53	38
NC(=O)C1CC(NC(=O)NCc2ccc3ccccc3c2)C1	ZINC000875238718	CD	On-Demand	Anodyne	CXCR4	42	33
NC(=O)C1CC(NC(=O)NCc2ccc3ccccc3c2)C1	ZINC000875238718	CD	On-Demand	Anodyne	TPH1	32	40
O=C(NCc1ccc2ccccc2c1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875238727	FE	On-Demand	Anodyne	EPHX2	15	41
O=C(NCc1ccc2ccccc2c1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875238728	FE	On-Demand	Anodyne	EPHX2	15	41
O=C(NCc1ccc2ccccc2c1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875238729	FE	On-Demand	Anodyne	EPHX2	15	41
O=C(NCc1ccc2ccccc2c1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875238730	FE	On-Demand	Anodyne	EPHX2	15	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc2ccccc2c1	ZINC000875238745	DG	On-Demand	Anodyne	MME	16	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc2ccccc2c1	ZINC000875238745	DG	On-Demand	Anodyne	ANPEP	21	44
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc2ccccc2c1	ZINC000875238745	DG	On-Demand	Anodyne	ACE2	28	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc2ccccc2c1	ZINC000875238745	DG	On-Demand	Anodyne	PDS	56	37
CN1CCC(CNC(=O)NC2CCC(C)(N(C)C)CC2)CC1	ZINC000875238748	DD	On-Demand	Anodyne	EPHX2	16	40
CN1CCC(CNC(=O)NC2CCC(C)(N(C)C)CC2)CC1	ZINC000875238748	DD	On-Demand	Anodyne	CACNA1I	42	33
CC[C@@H](NC(=O)NCC1CCN(C)CC1)c1cccc(OC)c1OC	ZINC000875238757	EF	On-Demand	Anodyne	HTR4	41	36
CC[C@@H](NC(=O)NCC1CCN(C)CC1)c1cccc(OC)c1OC	ZINC000875238757	EF	On-Demand	Anodyne	CACNA1I	53	36
O=C(NCc1ccc2ccccc2c1)N1CCO[C@H](C(F)F)CC1	ZINC000875238758	EG	On-Demand	Anodyne	EPHX2	18	41
O=C(NCc1ccc2ccccc2c1)N1CCO[C@@H](C(F)F)CC1	ZINC000875238759	EG	On-Demand	Anodyne	EPHX2	18	41
O=C(NCc1ccc2ccccc2c1)N[C@@H]1C[C@H]1C1CCOCC1	ZINC000875238761	DG	On-Demand	Anodyne	NMT1	31	40
CONC(=O)C1CCN(C(=O)NCc2ccc3ccccc3c2)CC1	ZINC000875238762	EE	On-Demand	Anodyne	MMP13	20	41
CONC(=O)C1CCN(C(=O)NCc2ccc3ccccc3c2)CC1	ZINC000875238762	EE	On-Demand	Anodyne	NMT1	34	42
CONC(=O)C1CCN(C(=O)NCc2ccc3ccccc3c2)CC1	ZINC000875238762	EE	On-Demand	Anodyne	CXCR4	43	33
CONC(=O)C1CCN(C(=O)NCc2ccc3ccccc3c2)CC1	ZINC000875238762	EE	On-Demand	Anodyne	EPHX2	39	44
CONC(=O)C1CCN(C(=O)NCc2ccc3ccccc3c2)CC1	ZINC000875238762	EE	On-Demand	Anodyne	DPP7	15	43
CN1CCC(CNC(=O)NC[C@H]2c3ccccc3CN2C)CC1	ZINC000875238769	DD	On-Demand	Anodyne	HTR4	41	35
CN1CCC(CNC(=O)NC[C@H]2c3ccccc3CN2C)CC1	ZINC000875238769	DD	On-Demand	Anodyne	CACNA1I	65	39
CN1CCC(CNC(=O)NC[C@@H]2c3ccccc3CN2C)CC1	ZINC000875238770	DD	On-Demand	Anodyne	HTR4	41	35
CN1CCC(CNC(=O)NC[C@@H]2c3ccccc3CN2C)CC1	ZINC000875238770	DD	On-Demand	Anodyne	CACNA1I	65	39
C[C@@H](NC(=O)NCC1CCN(C)CC1)c1ccnn1C	ZINC000875238771	CD	On-Demand	Anodyne	CACNA1I	55	35
C[C@H](NC(=O)NCC1CCN(C)CC1)c1ccnn1C	ZINC000875238772	CD	On-Demand	Anodyne	CACNA1I	55	35
C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc2ccccc2c1	ZINC000875238773	DG	On-Demand	Anodyne	SLC6A4	17	44
C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc2ccccc2c1	ZINC000875238773	DG	On-Demand	Anodyne	SLC6A3	28	44
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc2ccccc2c1	ZINC000875238774	DG	On-Demand	Anodyne	SLC6A4	17	44
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc2ccccc2c1	ZINC000875238774	DG	On-Demand	Anodyne	SLC6A3	28	44
C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc2ccccc2c1	ZINC000875238776	DG	On-Demand	Anodyne	SLC6A4	17	44
C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc2ccccc2c1	ZINC000875238776	DG	On-Demand	Anodyne	SLC6A3	28	44
O=C(NCc1ccc2ccccc2c1)N1CCN(CCc2cnccn2)CC1	ZINC000875238777	GF	On-Demand	Anodyne	FAAH	18	42
O=C(NCc1ccc2ccccc2c1)N1CCN(CCc2cnccn2)CC1	ZINC000875238777	GF	On-Demand	Anodyne	NAMPT	44	38
Cc1nccnc1[C@@H](C)NC(=O)NCC1CCN(C)CC1	ZINC000875238791	CD	On-Demand	Anodyne	CACNA1I	58	34
Cc1nccnc1[C@H](C)NC(=O)NCC1CCN(C)CC1	ZINC000875238792	CD	On-Demand	Anodyne	CACNA1I	58	34
C[C@@H](NC(=O)NCC1CCN(C)CC1)c1ccc(C(F)(F)F)nc1	ZINC000875238793	EF	On-Demand	Anodyne	TRPV1	41	33
C[C@@H](NC(=O)NCC1CCN(C)CC1)c1ccc(C(F)(F)F)nc1	ZINC000875238793	EF	On-Demand	Anodyne	CACNA1I	62	39
C[C@H](NC(=O)NCC1CCN(C)CC1)c1ccc(C(F)(F)F)nc1	ZINC000875238794	EF	On-Demand	Anodyne	TRPV1	41	33
C[C@H](NC(=O)NCC1CCN(C)CC1)c1ccc(C(F)(F)F)nc1	ZINC000875238794	EF	On-Demand	Anodyne	CACNA1I	62	39
N#CCCN1CCN(C(=O)NCc2ccc3ccccc3c2)CC1	ZINC000875238827	DF	On-Demand	Mild	DRD3	16	40
CN1CCC(CNC(=O)NCc2ccc(C(F)(F)F)s2)CC1	ZINC000875238828	EF	On-Demand	Anodyne	CACNA1I	60	40
CN1CCC(CNC(=O)NC[C@@H]2C[C@H](NC(=O)OC(C)(C)C)C2)CC1	ZINC000875238829	FD	On-Demand	Anodyne	CACNA1I	48	36
CN1CCC(CNC(=O)NC[C@@H]2C[C@@H](NC(=O)OC(C)(C)C)C2)CC1	ZINC000875238830	FD	On-Demand	Anodyne	CACNA1I	48	36
CN1CCC(CNC(=O)NCC2CC(NC(=O)OC(C)(C)C)C2)CC1	ZINC000875238831	FD	On-Demand	Anodyne	CACNA1I	48	36
CN1CCC(CNC(=O)NCc2cc(C(F)(F)F)cc(Cl)n2)CC1	ZINC000875238838	FF	On-Demand	Anodyne	TACR1	19	44
CN1CCC(CNC(=O)NCc2cc(C(F)(F)F)cc(Cl)n2)CC1	ZINC000875238838	FF	On-Demand	Anodyne	CACNA1I	78	47
C[C@H](NC(=O)NCC1CCN(C)CC1)c1ccns1	ZINC000875238891	CD	On-Demand	Anodyne	CACNA1I	55	35
C[C@@H](NC(=O)NCC1CCN(C)CC1)c1ccns1	ZINC000875238892	CD	On-Demand	Anodyne	CACNA1I	55	35
CN1CC[C@H]2CN(C(=O)NCc3ccc4ccccc4c3)CC[C@@H]21	ZINC000875238894	DG	On-Demand	Anodyne	EPHX2	16	40
CN1CC[C@H]2CN(C(=O)NCc3ccc4ccccc4c3)CC[C@H]21	ZINC000875238895	DG	On-Demand	Anodyne	EPHX2	16	40
CN1CCC(CNC(=O)N[C@@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875238903	EF	On-Demand	Anodyne	GRIN2B	15	41
CN1CCC(CNC(=O)N[C@@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875238903	EF	On-Demand	Anodyne	CHRNA7	48	35
CN1CCC(CNC(=O)N[C@@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875238903	EF	On-Demand	Anodyne	C3AR1	42	41
CN1CCC(CNC(=O)N[C@@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875238903	EF	On-Demand	Anodyne	NAMPT	44	40
CN1CCC(CNC(=O)N[C@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875238904	EF	On-Demand	Anodyne	GRIN2B	15	41
CN1CCC(CNC(=O)N[C@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875238904	EF	On-Demand	Anodyne	CHRNA7	48	35
CN1CCC(CNC(=O)N[C@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875238904	EF	On-Demand	Anodyne	C3AR1	42	41
CN1CCC(CNC(=O)N[C@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875238904	EF	On-Demand	Anodyne	NAMPT	44	40
CN1CCC(CNC(=O)NCCCCC2CC2)CC1	ZINC000875238911	CE	On-Demand	Anodyne	CACNA1I	56	38
CN1CCN(C2CCN(C(=O)NCc3ccc4ccccc4c3)CC2)CC1	ZINC000875238914	FF	On-Demand	Anodyne	CHRM2	27	41
CN1CCN(C2CCN(C(=O)NCc3ccc4ccccc4c3)CC2)CC1	ZINC000875238914	FF	On-Demand	Anodyne	CCR3	56	41
CN1CCN(C2CCN(C(=O)NCc3ccc4ccccc4c3)CC2)CC1	ZINC000875238914	FF	On-Demand	Anodyne	EPHX2	25	40
CN1CCN(C2CCN(C(=O)NCc3ccc4ccccc4c3)CC2)CC1	ZINC000875238914	FF	On-Demand	Anodyne	CALCRL	39	40
CN1CCN(C2CCN(C(=O)NCc3ccc4ccccc4c3)CC2)CC1	ZINC000875238914	FF	On-Demand	Anodyne	L3MBTL3	95	42
O=C(NCc1ccc2ccccc2c1)N1CCC(CCO)(CCO)CC1	ZINC000875238915	FF	On-Demand	Anodyne	NPFFR2	15	40
O=C(NCc1ccc2ccccc2c1)N1CCC(CCO)(CCO)CC1	ZINC000875238915	FF	On-Demand	Anodyne	NPFFR1	16	40
O=C(NCc1ccc2ccccc2c1)N1C[C@H](O)C[C@H]1C1CC1	ZINC000875238916	DF	On-Demand	Anodyne	CXCR4	44	32
O=C(NCc1ccc2ccccc2c1)N1C[C@H](O)C[C@@H]1C1CC1	ZINC000875238917	DF	On-Demand	Anodyne	CXCR4	44	32
O=C(NCc1ccc2ccccc2c1)N1C[C@@H](O)C[C@H]1C1CC1	ZINC000875238918	DF	On-Demand	Anodyne	CXCR4	44	32
O=C(NCc1ccc2ccccc2c1)N1C[C@@H](O)C[C@@H]1C1CC1	ZINC000875238919	DF	On-Demand	Anodyne	CXCR4	44	32
CCOC1CC2(C1)C[C@@H]2NC(=O)NCc1ccc2ccccc2c1	ZINC000875238924	DH	On-Demand	Anodyne	TIMP3	66	38
CCOC1CC2(C1)C[C@H]2NC(=O)NCc1ccc2ccccc2c1	ZINC000875238925	DH	On-Demand	Anodyne	TIMP3	66	38
CN1CCC(CNC(=O)N[C@@H]2CCCO[C@H]2c2ccc(Cl)cc2)CC1	ZINC000875238934	FG	On-Demand	Anodyne	SLC6A3	22	41
CN1CCC(CNC(=O)N[C@@H]2CCCO[C@H]2c2ccc(Cl)cc2)CC1	ZINC000875238934	FG	On-Demand	Anodyne	CACNA1I	66	40
CN1CCC(CNC(=O)NCc2ccc3oc(O)nc3c2)CC1	ZINC000875238937	DD	On-Demand	Anodyne	CACNA1I	55	37
CN1CCC(CNC(=O)N[C@H]2CCc3ccc(Cl)cc32)CC1	ZINC000875238938	DF	On-Demand	Anodyne	CACNA1I	77	42
CN1CCC(CNC(=O)N[C@@H]2CCc3ccc(Cl)cc32)CC1	ZINC000875238939	DF	On-Demand	Anodyne	CACNA1I	77	42
CCOC(=O)c1cc(CNC(=O)NCC2CCN(C)CC2)on1	ZINC000875238940	DC	On-Demand	Anodyne	SLC5A7	22	42
CCOC(=O)c1cc(CNC(=O)NCC2CCN(C)CC2)on1	ZINC000875238940	DC	On-Demand	Anodyne	CACNA1I	54	34
CN1CCC(CNC(=O)NCc2ccc(O)c(Cl)c2)CC1	ZINC000875238966	DE	On-Demand	Anodyne	DRD1	43	39
CN1CCC(CNC(=O)NCc2ccc(O)c(Cl)c2)CC1	ZINC000875238966	DE	On-Demand	Anodyne	HTR4	48	38
CN1CCC(CNC(=O)NCc2ccc(O)c(Cl)c2)CC1	ZINC000875238966	DE	On-Demand	Anodyne	EPHX2	23	44
CN1CCC(CNC(=O)NCc2ccc(O)c(Cl)c2)CC1	ZINC000875238966	DE	On-Demand	Anodyne	CACNA1I	78	42
CN1CCC(CNC(=O)NCc2ccc(O)c(Cl)c2)CC1	ZINC000875238966	DE	On-Demand	Anodyne	NCE103	15	43
O=C(NCCC[C@H]1CCOC1=O)NCc1ccc2ccccc2c1	ZINC000875238969	EF	On-Demand	Anodyne	CXCR4	72	41
O=C(NCCC[C@H]1CCOC1=O)NCc1ccc2ccccc2c1	ZINC000875238969	EF	On-Demand	Anodyne	LUXR	59	52
O=C(NCCC[C@H]1CCOC1=O)NCc1ccc2ccccc2c1	ZINC000875238969	EF	On-Demand	Anodyne	TRAR	52	34
O=C(NCCC[C@@H]1CCOC1=O)NCc1ccc2ccccc2c1	ZINC000875238970	EF	On-Demand	Anodyne	CXCR4	72	41
O=C(NCCC[C@@H]1CCOC1=O)NCc1ccc2ccccc2c1	ZINC000875238970	EF	On-Demand	Anodyne	LUXR	59	52
O=C(NCCC[C@@H]1CCOC1=O)NCc1ccc2ccccc2c1	ZINC000875238970	EF	On-Demand	Anodyne	TRAR	52	34
CN1CCC(CNC(=O)NCc2ccc(CN3CCNC3=O)cc2)CC1	ZINC000875238972	FD	On-Demand	Anodyne	CACNA1I	63	39
CN1CCC(CNC(=O)NCc2cccc3ncccc23)CC1	ZINC000875238981	DE	On-Demand	Anodyne	HTR4	46	38
CN1CCC(CNC(=O)NCc2cccc3ncccc23)CC1	ZINC000875238981	DE	On-Demand	Anodyne	P2RX7	31	40
CN1CCC(CNC(=O)NCc2cccc3ncccc23)CC1	ZINC000875238981	DE	On-Demand	Anodyne	EPHX2	15	40
CN1CCC(CNC(=O)NCc2cccc3ncccc23)CC1	ZINC000875238981	DE	On-Demand	Anodyne	CACNA1I	40	38
CN1CCC(CNC(=O)NC[C@H]2CC(C)(C)CO2)CC1	ZINC000875238990	CD	On-Demand	Anodyne	CACNA1I	49	34
CN1CCC(CNC(=O)NC[C@@H]2CC(C)(C)CO2)CC1	ZINC000875238991	CD	On-Demand	Anodyne	CACNA1I	49	34
O=C(NCc1ccc2ccccc2c1)N[C@@H]1COCC[C@H]1O	ZINC000875238998	DD	On-Demand	Anodyne	NMT1	32	40
O=C(NCc1ccc2ccccc2c1)NCc1nc(C2CCOCC2)n[nH]1	ZINC000875239002	FF	On-Demand	Anodyne	NMT1	30	40
CO[C@@H]1C[C@@H](NC(=O)NCc2ccc3ccccc3c2)C1	ZINC000875239021	CF	On-Demand	Anodyne	EPHX2	22	40
O=C(NCc1ccc2ccccc2c1)N1Cc2cccnc2N2C[C@H](O)C[C@H]2C1	ZINC000875239103	GF	On-Demand	Anodyne	NAMPT	22	43
O=C(NCc1ccc2ccccc2c1)N1CCN(c2nccnn2)CC1	ZINC000875239176	EE	On-Demand	Anodyne	FAAH	21	40
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N1Cc2cccc(O)c2C1	ZINC000875239269	GF	On-Demand	Clean	SIGMAR1	26	47
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N1Cc2cccc(O)c2C1	ZINC000875239269	GF	On-Demand	Clean	NAMPT	25	46
C#CCCCNC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875239271	ED	On-Demand	Mild	ROCK1	22	40
C#CCCCNC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875239271	ED	On-Demand	Mild	ROCK2	15	40
CO[C@@H]1CC[C@@H](C)N(C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)C1	ZINC000875239280	GE	On-Demand	Anodyne	SIGMAR1	28	42
O=C(Nc1cc(Cl)ccc1F)c1cc(-c2cccnc2)nc2ccccc12	ZINC000875239294	GK	On-Demand	Anodyne	DHODH	15	45
O=C(Nc1cc(Cl)ccc1F)c1cc(-c2cccnc2)nc2ccccc12	ZINC000875239294	GK	On-Demand	Anodyne	F10	15	42
O=C(Nc1cc(Cl)ccc1F)c1cc(-c2cccnc2)nc2ccccc12	ZINC000875239294	GK	On-Demand	Anodyne	PRS	54	43
O=C(Nc1cc(Cl)ccc1F)c1cc(-c2cccnc2)nc2ccccc12	ZINC000875239294	GK	On-Demand	Anodyne	TACR3	27	50
O=C(Nc1cc(Cl)ccc1F)c1cc(-c2cccnc2)nc2ccccc12	ZINC000875239294	GK	On-Demand	Anodyne	KCNMA1	23	42
O=C(Nc1cc(Cl)ccc1F)c1cc(-c2cccnc2)nc2ccccc12	ZINC000875239294	GK	On-Demand	Anodyne	MT-CO2	50	40
C#CCCCNC(=O)C(=O)NC[C@@H]1CCN1Cc1ccc(OC)cc1	ZINC000875239295	EC	On-Demand	Mild	PROKR1	59	32
C#CCCCNC(=O)C(=O)NC[C@H]1CCN1Cc1ccc(OC)cc1	ZINC000875239296	EC	On-Demand	Mild	PROKR1	59	32
CCC1(CC)CCCN1C(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000875239302	FH	On-Demand	Anodyne	SIGMAR1	30	47
CCC1(CC)CCCN1C(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000875239302	FH	On-Demand	Anodyne	MCHR1	23	43
CCC1(CC)CCCN1C(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000875239302	FH	On-Demand	Anodyne	SLC12A5	57	34
O=C1OC[C@H]2CN(C(=O)NCc3ccc4ccccc4c3)C[C@@H]12	ZINC000875239327	DE	On-Demand	Anodyne	NAAA	17	40
CC(=O)NC[C@@H]1CCCCN1C(=O)NCc1ccc2ccccc2c1	ZINC000875239338	EG	On-Demand	Anodyne	F2	23	41
CC(=O)NC[C@@H]1CCCCN1C(=O)NCc1ccc2ccccc2c1	ZINC000875239338	EG	On-Demand	Anodyne	FKBP1A	26	40
CC(=O)NC[C@@H]1CCCCN1C(=O)NCc1ccc2ccccc2c1	ZINC000875239338	EG	On-Demand	Anodyne	CPT1A	27	42
C#CCCCNC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1C	ZINC000875239398	ED	On-Demand	Mild	SLC18A2	49	36
O=C(/C=C\c1ccc(Br)o1)Nc1cc(Cl)ccc1F	ZINC000875239399	EI	On-Demand	Anodyne	HPSE	48	38
C#CCCCNC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1C	ZINC000875239400	ED	On-Demand	Mild	SLC18A2	49	36
CN1CC[C@H]2CN(C(=O)NCc3ccc(CN4CCC(O)CC4)cc3)CC[C@@H]21	ZINC000875239403	GD	On-Demand	Anodyne	SIGMAR1	21	43
CN1CC[C@H]2CN(C(=O)NCc3ccc(CN4CCC(O)CC4)cc3)CC[C@@H]21	ZINC000875239403	GD	On-Demand	Anodyne	NAMPT	15	40
CN1CC[C@H]2CN(C(=O)NCc3ccc(CN4CCC(O)CC4)cc3)CC[C@H]21	ZINC000875239404	GD	On-Demand	Anodyne	SIGMAR1	21	43
CN1CC[C@H]2CN(C(=O)NCc3ccc(CN4CCC(O)CC4)cc3)CC[C@H]21	ZINC000875239404	GD	On-Demand	Anodyne	NAMPT	15	40
O=C(NC[C@H]1CCCS1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875239406	EE	On-Demand	Anodyne	OXTR	52	37
O=C(NC[C@H]1CCCS1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875239407	EE	On-Demand	Anodyne	OXTR	52	37
C#CCCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875239415	FD	On-Demand	Mild	CHRM2	17	40
C#CCCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875239415	FD	On-Demand	Mild	DRD2	30	43
C#CCCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875239415	FD	On-Demand	Mild	DRD4	46	43
C#CCCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875239415	FD	On-Demand	Mild	ACHE	68	63
C#CCCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875239415	FD	On-Demand	Mild	DRD3	30	43
C#CCCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875239415	FD	On-Demand	Mild	SLC6A3	17	50
C#CCCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875239415	FD	On-Demand	Mild	HTR4	24	40
C#CCCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875239415	FD	On-Demand	Mild	CHRM3	20	40
C#CCCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875239415	FD	On-Demand	Mild	SIGMAR1	66	46
C#CCCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875239415	FD	On-Demand	Mild	BCHE	20	51
C#CCCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875239415	FD	On-Demand	Mild	CCR3	44	45
C#CCCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875239415	FD	On-Demand	Mild	MCHR1	20	40
C#CCCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875239415	FD	On-Demand	Mild	CACNA1G	31	43
C#CCCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875239415	FD	On-Demand	Mild	SIRT3	43	32
C#CCCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875239415	FD	On-Demand	Mild	SIRT2	45	32
C#CCCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875239415	FD	On-Demand	Mild	SIRT1	45	32
C#CCCCNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875239415	FD	On-Demand	Mild	CYP2J2	43	31
CN1CCO[C@@H](CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C1	ZINC000875239438	FD	On-Demand	Mild	CCR3	24	40
CN1CCO[C@@H](CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C1	ZINC000875239438	FD	On-Demand	Mild	ITK	22	46
CN1CCO[C@@H](CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C1	ZINC000875239438	FD	On-Demand	Mild	PANC	55	38
CN1CCO[C@H](CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C1	ZINC000875239440	FD	On-Demand	Mild	CCR3	24	40
CN1CCO[C@H](CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C1	ZINC000875239440	FD	On-Demand	Mild	ITK	22	46
CN1CCO[C@H](CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C1	ZINC000875239440	FD	On-Demand	Mild	PANC	55	38
C#CCCCNC(=O)C(=O)NCCCCCCC	ZINC000875239441	CD	On-Demand	Mild	ASAH1	87	35
C#CCCCNC(=O)C(=O)NCCCCCCC	ZINC000875239441	CD	On-Demand	Mild	CQSS	48	30
NC(=O)C[C@H]1CN(C(=O)NCc2ccc3ccccc3c2)CCO1	ZINC000875239447	ED	On-Demand	Anodyne	TRY2_BOVIN	48	34
NC(=O)C[C@H]1CN(C(=O)NCc2ccc3ccccc3c2)CCO1	ZINC000875239447	ED	On-Demand	Anodyne	DPP7	15	45
NC(=O)C[C@@H]1CN(C(=O)NCc2ccc3ccccc3c2)CCO1	ZINC000875239448	ED	On-Demand	Anodyne	TRY2_BOVIN	48	34
NC(=O)C[C@@H]1CN(C(=O)NCc2ccc3ccccc3c2)CCO1	ZINC000875239448	ED	On-Demand	Anodyne	DPP7	15	45
CN1CCN(C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)CCC1(C)C	ZINC000875239451	GE	On-Demand	Anodyne	SIGMAR1	19	43
COC(=O)N(C)NC(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000875239454	FD	On-Demand	Reactive	DRD4	19	41
COC(=O)N(C)NC(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000875239454	FD	On-Demand	Reactive	LTA4H	15	40
COC(=O)N(C)NC(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000875239454	FD	On-Demand	Reactive	SIGMAR1	29	45
COC(=O)N(C)NC(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000875239454	FD	On-Demand	Reactive	MCHR1	35	46
C#CCCCNC(=O)C(=O)NC[C@@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000875239510	FC	On-Demand	Mild	DRD4	16	43
C#CCCCNC(=O)C(=O)NC[C@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000875239511	FC	On-Demand	Mild	DRD4	16	43
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NC[C@H]1CCCS1)CC2	ZINC000875239525	GE	On-Demand	Anodyne	SLC18A2	45	33
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NC[C@@H]1CCCS1)CC2	ZINC000875239526	GE	On-Demand	Anodyne	SLC18A2	45	33
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NC[C@@H]1CCCS1)CC2	ZINC000875239527	GE	On-Demand	Anodyne	SLC18A2	45	33
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NC[C@H]1CCCS1)CC2	ZINC000875239528	GE	On-Demand	Anodyne	SLC18A2	45	33
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)C1	ZINC000875239571	FE	On-Demand	Anodyne	HRH3	30	43
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)C1	ZINC000875239571	FE	On-Demand	Anodyne	SIGMAR1	22	47
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)C1	ZINC000875239571	FE	On-Demand	Anodyne	CCR3	23	42
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)C1	ZINC000875239571	FE	On-Demand	Anodyne	DPP7	49	35
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)C1	ZINC000875239571	FE	On-Demand	Anodyne	MCHR1	23	42
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)C1	ZINC000875239572	FE	On-Demand	Anodyne	HRH3	30	43
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)C1	ZINC000875239572	FE	On-Demand	Anodyne	SIGMAR1	22	47
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)C1	ZINC000875239572	FE	On-Demand	Anodyne	CCR3	23	42
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)C1	ZINC000875239572	FE	On-Demand	Anodyne	DPP7	49	35
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)C1	ZINC000875239572	FE	On-Demand	Anodyne	MCHR1	23	42
C#CCCCNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875239634	FC	On-Demand	Mild	HTR1A	55	45
C#CCCCNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875239634	FC	On-Demand	Mild	DRD2	44	45
C#CCCCNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875239634	FC	On-Demand	Mild	DRD4	44	36
C#CCCCNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875239634	FC	On-Demand	Mild	ADRA1D	34	43
C#CCCCNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875239634	FC	On-Demand	Mild	ADRA1A	33	43
C#CCCCNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875239634	FC	On-Demand	Mild	DRD3	68	45
C#CCCCNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875239634	FC	On-Demand	Mild	HTR7	44	39
C#CCCCNC(=O)C(=O)NCCN(Cc1ccccc1)c1ccccn1	ZINC000875239665	FD	On-Demand	Mild	SSTR4	15	46
C[C@@H](CNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)N(C)C1CC1	ZINC000875239713	FE	On-Demand	Mild	ITK	19	47
C[C@@H](CNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)N(C)C1CC1	ZINC000875239713	FE	On-Demand	Mild	PANC	54	36
C#CCCCNC(=O)C(=O)N[C@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000875239729	ED	On-Demand	Mild	DRD4	31	47
C#CCCCNC(=O)C(=O)N[C@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000875239729	ED	On-Demand	Mild	SIGMAR1	20	44
C#CCCCNC(=O)C(=O)N[C@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000875239729	ED	On-Demand	Mild	CCR3	28	41
C#CCCCNC(=O)C(=O)N[C@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000875239729	ED	On-Demand	Mild	UTS2R	22	41
C#CCCCNC(=O)C(=O)N[C@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000875239729	ED	On-Demand	Mild	CCR2	17	47
C#CCCCNC(=O)C(=O)N[C@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000875239729	ED	On-Demand	Mild	MCHR1	31	45
C#CCCCNC(=O)C(=O)N[C@@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000875239730	ED	On-Demand	Mild	DRD4	31	47
C#CCCCNC(=O)C(=O)N[C@@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000875239730	ED	On-Demand	Mild	SIGMAR1	20	44
C#CCCCNC(=O)C(=O)N[C@@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000875239730	ED	On-Demand	Mild	CCR3	28	41
C#CCCCNC(=O)C(=O)N[C@@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000875239730	ED	On-Demand	Mild	UTS2R	22	41
C#CCCCNC(=O)C(=O)N[C@@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000875239730	ED	On-Demand	Mild	CCR2	17	47
C#CCCCNC(=O)C(=O)N[C@@H]1CCN(Cc2ccc(C)cc2)C1	ZINC000875239730	ED	On-Demand	Mild	MCHR1	31	45
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875239739	GC	On-Demand	Anodyne	DRD4	19	40
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875239739	GC	On-Demand	Anodyne	ACHE	20	40
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875239739	GC	On-Demand	Anodyne	SIGMAR1	31	48
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875239739	GC	On-Demand	Anodyne	MCHR1	18	42
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875239739	GC	On-Demand	Anodyne	NAMPT	19	40
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875239750	FE	On-Demand	Anodyne	SIGMAR1	20	43
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875239751	FE	On-Demand	Anodyne	SIGMAR1	20	43
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875239752	FE	On-Demand	Anodyne	SIGMAR1	20	43
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875239753	FE	On-Demand	Anodyne	SIGMAR1	20	43
CC(=O)C1CCN(C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)CC1	ZINC000875239760	FE	On-Demand	Anodyne	HRH3	22	45
CC(=O)C1CCN(C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)CC1	ZINC000875239760	FE	On-Demand	Anodyne	SIGMAR1	26	52
CC(=O)C1CCN(C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)CC1	ZINC000875239760	FE	On-Demand	Anodyne	EPHX2	15	41
CC(=O)C1CCN(C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)CC1	ZINC000875239760	FE	On-Demand	Anodyne	MCHR1	25	43
CC(=O)C1CCN(C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)CC1	ZINC000875239760	FE	On-Demand	Anodyne	CACNA1G	34	40
CC(=O)C1CCN(C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)CC1	ZINC000875239760	FE	On-Demand	Anodyne	NAMPT	24	41
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875239770	ED	On-Demand	Anodyne	ACHE	25	41
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875239770	ED	On-Demand	Anodyne	SIGMAR1	33	48
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875239770	ED	On-Demand	Anodyne	CCR3	25	41
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875239770	ED	On-Demand	Anodyne	MCHR1	25	47
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875239770	ED	On-Demand	Anodyne	CACNA1I	60	43
O=CN1CCCN(C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)CC1	ZINC000875239774	FD	On-Demand	Anodyne	DRD4	17	41
O=CN1CCCN(C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)CC1	ZINC000875239774	FD	On-Demand	Anodyne	SIGMAR1	28	46
O=CN1CCCN(C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)CC1	ZINC000875239774	FD	On-Demand	Anodyne	CCR3	18	43
COC(=O)[C@@]1(OC)CCN(C(=O)NCc2ccc3ccccc3c2)C1	ZINC000875239826	EE	On-Demand	Anodyne	MMP13	15	41
O=C(NCc1ccc2ccccc2c1)N(C1CC1)C1CC1	ZINC000875239847	CH	On-Demand	Anodyne	CXCR4	45	32
O=C(NCc1ccc2ccccc2c1)N(C1CC1)C1CC1	ZINC000875239847	CH	On-Demand	Anodyne	LUXR	15	47
O=C(/C=C\c1ccc(I)o1)Nc1cc(Cl)ccc1F	ZINC000875239900	GI	On-Demand	Anodyne	HPSE	43	38
C[C@@H]1CN(C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)Cc2ccccc21	ZINC000875239936	GG	On-Demand	Anodyne	DRD4	43	41
C[C@@H]1CN(C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)Cc2ccccc21	ZINC000875239936	GG	On-Demand	Anodyne	SIGMAR1	33	45
C[C@@H]1CN(C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)Cc2ccccc21	ZINC000875239936	GG	On-Demand	Anodyne	NAMPT	23	43
C#CCCCNC(=O)C(=O)NC[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000875239945	ED	On-Demand	Mild	DRD4	16	47
C#CCCCNC(=O)C(=O)NC[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000875239946	ED	On-Demand	Mild	DRD4	16	47
C#CCCCNC(=O)C(=O)NC[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000875239947	ED	On-Demand	Mild	DRD4	16	47
C#CCCCNC(=O)C(=O)NC[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000875239948	ED	On-Demand	Mild	DRD4	16	47
O=C(NCC[C@H](O)C1CCCC1)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000875239953	GE	On-Demand	Anodyne	SIGMAR1	23	43
O=C(NCC[C@H](O)C1CCCC1)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000875239953	GE	On-Demand	Anodyne	MCHR1	24	44
O=C(NCC[C@@H](O)C1CCCC1)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000875239954	GE	On-Demand	Anodyne	SIGMAR1	23	43
O=C(NCC[C@@H](O)C1CCCC1)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000875239954	GE	On-Demand	Anodyne	MCHR1	24	44
C#CCCCNC(=O)C(=O)N1CCC[C@H](c2ccc(F)c(F)c2)C1	ZINC000875239961	EE	On-Demand	Mild	ADRA1A	41	37
C#CCCCNC(=O)C(=O)N1CCC[C@@H](c2ccc(F)c(F)c2)C1	ZINC000875239962	EE	On-Demand	Mild	ADRA1A	41	37
CN1CCO[C@@H](CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875239974	EC	On-Demand	Anodyne	DRD4	26	41
CN1CCO[C@H](CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875239975	EC	On-Demand	Anodyne	DRD4	26	41
C#CCCCNC(=O)C(=O)N1Cc2cccc(OC)c2C1	ZINC000875239977	CD	On-Demand	Mild	SSTR1	49	34
C#CCCCNC(=O)C(=O)N[C@@H]1CCO[C@H]1c1ccc(F)c(F)c1	ZINC000875240052	ED	On-Demand	Mild	ADRA1A	43	37
O=C(NCc1ccc2ccccc2c1)NC[C@@H]1CN(Cc2ccncc2)CCO1	ZINC000875240086	GF	On-Demand	Anodyne	DRD4	25	42
O=C(NCc1ccc2ccccc2c1)NC[C@@H]1CN(Cc2ccncc2)CCO1	ZINC000875240086	GF	On-Demand	Anodyne	CCR3	30	60
O=C(NCc1ccc2ccccc2c1)NC[C@@H]1CN(Cc2ccncc2)CCO1	ZINC000875240086	GF	On-Demand	Anodyne	MCHR1	16	42
O=C(NCc1ccc2ccccc2c1)NC[C@H]1CN(Cc2ccncc2)CCO1	ZINC000875240087	GF	On-Demand	Anodyne	DRD4	25	42
O=C(NCc1ccc2ccccc2c1)NC[C@H]1CN(Cc2ccncc2)CCO1	ZINC000875240087	GF	On-Demand	Anodyne	CCR3	30	60
O=C(NCc1ccc2ccccc2c1)NC[C@H]1CN(Cc2ccncc2)CCO1	ZINC000875240087	GF	On-Demand	Anodyne	MCHR1	16	42
O=C(NCc1ccc2ccccc2c1)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875240091	EG	On-Demand	Anodyne	EPHX2	15	41
O=C(NCc1ccc2ccccc2c1)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875240092	EG	On-Demand	Anodyne	EPHX2	15	41
O=C(NCCN1CC[C@H](O)C1)NCc1ccc2ccccc2c1	ZINC000875240157	DD	On-Demand	Anodyne	OPRK1	21	40
O=C(NCCN1CC[C@H](O)C1)NCc1ccc2ccccc2c1	ZINC000875240157	DD	On-Demand	Anodyne	SIGMAR1	18	47
O=C(NCCN1CC[C@H](O)C1)NCc1ccc2ccccc2c1	ZINC000875240157	DD	On-Demand	Anodyne	CCR3	63	44
O=C(NCCN1CC[C@H](O)C1)NCc1ccc2ccccc2c1	ZINC000875240157	DD	On-Demand	Anodyne	PLD1	57	41
O=C(NCCN1CC[C@H](O)C1)NCc1ccc2ccccc2c1	ZINC000875240157	DD	On-Demand	Anodyne	PLD2	73	41
O=C(NCCN1CC[C@H](O)C1)NCc1ccc2ccccc2c1	ZINC000875240157	DD	On-Demand	Anodyne	MCHR1	27	48
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc2ccccc2c1	ZINC000875240158	DD	On-Demand	Anodyne	OPRK1	21	40
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc2ccccc2c1	ZINC000875240158	DD	On-Demand	Anodyne	SIGMAR1	18	47
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc2ccccc2c1	ZINC000875240158	DD	On-Demand	Anodyne	CCR3	63	44
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc2ccccc2c1	ZINC000875240158	DD	On-Demand	Anodyne	PLD1	57	41
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc2ccccc2c1	ZINC000875240158	DD	On-Demand	Anodyne	PLD2	73	41
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc2ccccc2c1	ZINC000875240158	DD	On-Demand	Anodyne	MCHR1	27	48
O=C(NCc1ccc2ccccc2c1)N1CC[C@H]2CC[C@@H](C1)S2(=O)=O	ZINC000875240198	FF	On-Demand	Anodyne	EPHX2	17	44
O=C(NCc1ccc2ccccc2c1)N1CC[C@H]2CC[C@@H](C1)S2(=O)=O	ZINC000875240198	FF	On-Demand	Anodyne	DPP7	17	45
C#CCCCNC(=O)C(=O)N[C@@H](CC)CCc1ccccc1	ZINC000875240227	DE	On-Demand	Mild	MME	46	38
C#CCCCNC(=O)C(=O)N[C@@H](CC)CCc1ccccc1	ZINC000875240227	DE	On-Demand	Mild	CTSB	22	40
C#CCCCNC(=O)C(=O)N[C@@H](CC)CCc1ccccc1	ZINC000875240227	DE	On-Demand	Mild	MMP3	42	36
C#CCCCNC(=O)C(=O)N[C@@H](CC)CCc1ccccc1	ZINC000875240227	DE	On-Demand	Mild	CAPN1	32	40
C#CCCCNC(=O)C(=O)N[C@@H](CC)CCc1ccccc1	ZINC000875240227	DE	On-Demand	Mild	CAPN2	65	40
C#CCCCNC(=O)C(=O)N[C@@H](CC)CCc1ccccc1	ZINC000875240227	DE	On-Demand	Mild	CTSC	16	43
C#CCCCNC(=O)C(=O)N[C@@H](CC)CCc1ccccc1	ZINC000875240227	DE	On-Demand	Mild	AMP1_PLAFQ	32	43
C#CCCCNC(=O)C(=O)N[C@@H](CC)CCc1ccccc1	ZINC000875240227	DE	On-Demand	Mild	NPFFR1	48	32
C#CCCCNC(=O)C(=O)N[C@H](CC)CCc1ccccc1	ZINC000875240228	DE	On-Demand	Mild	MME	46	38
C#CCCCNC(=O)C(=O)N[C@H](CC)CCc1ccccc1	ZINC000875240228	DE	On-Demand	Mild	CTSB	22	40
C#CCCCNC(=O)C(=O)N[C@H](CC)CCc1ccccc1	ZINC000875240228	DE	On-Demand	Mild	MMP3	42	36
C#CCCCNC(=O)C(=O)N[C@H](CC)CCc1ccccc1	ZINC000875240228	DE	On-Demand	Mild	CAPN1	32	40
C#CCCCNC(=O)C(=O)N[C@H](CC)CCc1ccccc1	ZINC000875240228	DE	On-Demand	Mild	CAPN2	65	40
C#CCCCNC(=O)C(=O)N[C@H](CC)CCc1ccccc1	ZINC000875240228	DE	On-Demand	Mild	CTSC	16	43
C#CCCCNC(=O)C(=O)N[C@H](CC)CCc1ccccc1	ZINC000875240228	DE	On-Demand	Mild	AMP1_PLAFQ	32	43
C#CCCCNC(=O)C(=O)N[C@H](CC)CCc1ccccc1	ZINC000875240228	DE	On-Demand	Mild	NPFFR1	48	32
C[C@H]1C[C@@H](C)C[C@H](NC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)C1	ZINC000875240248	GF	On-Demand	Anodyne	ETHR	54	48
C[C@@H]1CC(NC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)C[C@@H](C)C1	ZINC000875240249	GF	On-Demand	Anodyne	ETHR	54	48
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875240268	GF	On-Demand	Anodyne	SIGMAR1	21	44
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875240268	GF	On-Demand	Anodyne	NAMPT	15	41
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875240269	GF	On-Demand	Anodyne	SIGMAR1	21	44
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875240269	GF	On-Demand	Anodyne	NAMPT	15	41
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875240270	GF	On-Demand	Anodyne	SIGMAR1	21	44
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875240270	GF	On-Demand	Anodyne	NAMPT	15	41
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875240271	GF	On-Demand	Anodyne	SIGMAR1	21	44
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875240271	GF	On-Demand	Anodyne	NAMPT	15	41
C#CCCCNC(=O)C(=O)N1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2	ZINC000875240277	EF	On-Demand	Mild	CCR3	20	42
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@@H]2CN(C)CCO2)CC1	ZINC000875240279	FE	On-Demand	Anodyne	DRD2	19	43
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@@H]2CN(C)CCO2)CC1	ZINC000875240279	FE	On-Demand	Anodyne	SMO	31	41
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@@H]2CN(C)CCO2)CC1	ZINC000875240280	FE	On-Demand	Anodyne	DRD2	19	43
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@@H]2CN(C)CCO2)CC1	ZINC000875240280	FE	On-Demand	Anodyne	SMO	31	41
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@H]2CN(C)CCO2)CC1	ZINC000875240281	FE	On-Demand	Anodyne	DRD2	19	43
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@H]2CN(C)CCO2)CC1	ZINC000875240281	FE	On-Demand	Anodyne	SMO	31	41
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@H]2CN(C)CCO2)CC1	ZINC000875240282	FE	On-Demand	Anodyne	DRD2	19	43
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@H]2CN(C)CCO2)CC1	ZINC000875240282	FE	On-Demand	Anodyne	SMO	31	41
COC(=O)C1(O)CN(C(=O)NCc2cc(F)ccc2F)C1	ZINC000875240314	DC	On-Demand	Anodyne	P2RX7	42	37
COC(=O)C1(O)CN(C(=O)NCc2cc(F)ccc2F)C1	ZINC000875240314	DC	On-Demand	Anodyne	DPP4	17	41
COCCN(CC1CCN(C)CC1)C(=O)NCc1cc(F)ccc1F	ZINC000875240357	FE	On-Demand	Anodyne	CACNA1I	55	32
COCCN(CC1CCN(C)CC1)C(=O)NCc1cc(F)ccc1F	ZINC000875240357	FE	On-Demand	Anodyne	ACKR3	69	36
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ncccc2C)CC1	ZINC000875240375	FH	On-Demand	Anodyne	HTR1A	15	40
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ncccc2C)CC1	ZINC000875240375	FH	On-Demand	Anodyne	EPHX2	17	45
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ncccc2C)CC1	ZINC000875240375	FH	On-Demand	Anodyne	RBP4	40	39
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ncccc2C)CC1	ZINC000875240376	FH	On-Demand	Anodyne	HTR1A	15	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ncccc2C)CC1	ZINC000875240376	FH	On-Demand	Anodyne	EPHX2	17	45
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ncccc2C)CC1	ZINC000875240376	FH	On-Demand	Anodyne	RBP4	40	39
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@@H]1CCCS1	ZINC000875240411	GE	On-Demand	Anodyne	DRD2	20	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@@H]1CCCS1	ZINC000875240411	GE	On-Demand	Anodyne	DRD4	40	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@@H]1CCCS1	ZINC000875240411	GE	On-Demand	Anodyne	ACHE	62	59
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@@H]1CCCS1	ZINC000875240411	GE	On-Demand	Anodyne	DRD3	16	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@@H]1CCCS1	ZINC000875240411	GE	On-Demand	Anodyne	HTR4	25	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@@H]1CCCS1	ZINC000875240411	GE	On-Demand	Anodyne	CHRM3	15	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@@H]1CCCS1	ZINC000875240411	GE	On-Demand	Anodyne	SIGMAR1	54	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@H]1CCCS1	ZINC000875240412	GE	On-Demand	Anodyne	DRD2	20	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@H]1CCCS1	ZINC000875240412	GE	On-Demand	Anodyne	DRD4	40	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@H]1CCCS1	ZINC000875240412	GE	On-Demand	Anodyne	ACHE	62	59
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@H]1CCCS1	ZINC000875240412	GE	On-Demand	Anodyne	DRD3	16	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@H]1CCCS1	ZINC000875240412	GE	On-Demand	Anodyne	HTR4	25	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@H]1CCCS1	ZINC000875240412	GE	On-Demand	Anodyne	CHRM3	15	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NC[C@H]1CCCS1	ZINC000875240412	GE	On-Demand	Anodyne	SIGMAR1	54	44
O=C(NCc1ccc2ccccc2c1)N[C@@H]1CCN(C2CCC2)C1=O	ZINC000875240498	EF	On-Demand	Anodyne	CXCR4	55	35
O=C(NCc1ccc2ccccc2c1)N[C@H]1CCN(C2CCC2)C1=O	ZINC000875240500	EF	On-Demand	Anodyne	CXCR4	55	35
C#CCCCNC(=O)C(=O)NCc1ccccc1CC(C)C	ZINC000875240550	DE	On-Demand	Mild	AMP1_PLAFQ	43	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ncccc1C	ZINC000875240643	DD	On-Demand	Anodyne	SLC6A3	51	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ncccc1C	ZINC000875240644	DD	On-Demand	Anodyne	SLC6A3	51	39
Cc1cccc2c1CC[C@@H]2NC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875240654	FG	On-Demand	Anodyne	ETHR	53	35
Cc1cccc2c1CC[C@H]2NC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875240655	FG	On-Demand	Anodyne	ETHR	53	35
Cc1cccc2c1CC[C@@H]2NC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875240656	FG	On-Demand	Anodyne	ETHR	53	35
Cc1cccc2c1CC[C@H]2NC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875240657	FG	On-Demand	Anodyne	ETHR	53	35
O=C(NCc1cccc(CO)c1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875240699	FE	On-Demand	Anodyne	NAMPT	23	40
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000875240813	FD	On-Demand	Anodyne	SIGMAR1	20	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000875240813	FD	On-Demand	Anodyne	MCHR1	15	44
NC(=O)[C@@H]1C[C@@H](NC(=O)NCc2ccc3ccccc3c2)C1	ZINC000875240839	CD	On-Demand	Anodyne	CXCR4	42	33
NC(=O)[C@@H]1C[C@@H](NC(=O)NCc2ccc3ccccc3c2)C1	ZINC000875240839	CD	On-Demand	Anodyne	TPH1	32	40
C[C@@]1(CO)CN(C(=O)NCc2ccc3ccccc3c2)C[C@]1(C)CO	ZINC000875240893	EE	On-Demand	Anodyne	TPH1	32	40
C[C@@]1(CO)CN(C(=O)NCc2ccc3ccccc3c2)C[C@]1(C)CO	ZINC000875240893	EE	On-Demand	Anodyne	NAMPT	28	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cc(F)ccc2F)C1	ZINC000875241046	EE	On-Demand	Anodyne	P2RX7	46	38
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cc(F)ccc2F)C1	ZINC000875241046	EE	On-Demand	Anodyne	DPP4	29	50
CC[C@@H](NC(=O)NCCN(C)C1CCCC1)[C@@H](O)c1ccccc1	ZINC000875241049	EF	On-Demand	Anodyne	CCR5	20	40
CC[C@@H](NC(=O)NCCN(C)C1CCCC1)[C@@H](O)c1ccccc1	ZINC000875241049	EF	On-Demand	Anodyne	AMY2	45	31
CC[C@@H](NC(=O)NCCN(C)C1CCCC1)[C@H](O)c1ccccc1	ZINC000875241051	EF	On-Demand	Anodyne	CCR5	20	40
CC[C@@H](NC(=O)NCCN(C)C1CCCC1)[C@H](O)c1ccccc1	ZINC000875241051	EF	On-Demand	Anodyne	AMY2	45	31
C#CCCCNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875241078	ED	On-Demand	Mild	ETHR	55	48
C[C@]1(C(F)(F)F)CCN(C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)C1	ZINC000875241092	GG	On-Demand	Anodyne	SIGMAR1	23	42
C[C@]1(C(F)(F)F)CCN(C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)C1	ZINC000875241092	GG	On-Demand	Anodyne	MCHR1	22	43
CS(=O)(=O)NC1CN(C(=O)NCc2ccc3ccccc3c2)C1	ZINC000875241115	ED	On-Demand	Anodyne	TRY2_BOVIN	50	34
CS(=O)(=O)NC1CN(C(=O)NCc2ccc3ccccc3c2)C1	ZINC000875241115	ED	On-Demand	Anodyne	NAMPT	23	40
CC[C@@H]1COCCN1CCNC(=O)NCc1cc(F)ccc1F	ZINC000875241161	ED	On-Demand	Anodyne	P2RX7	40	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCOc1ccccc1C	ZINC000875241163	EE	On-Demand	Anodyne	SLC6A3	43	38
Cc1cccc2c1CC[C@H]2NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875241207	EI	On-Demand	Anodyne	EPHX2	16	42
Cc1cccc2c1CC[C@@H]2NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875241209	EI	On-Demand	Anodyne	EPHX2	16	42
Cc1cccc2c1CC[C@@H]2NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875241211	EI	On-Demand	Anodyne	EPHX2	16	42
Cc1cccc2c1CC[C@H]2NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875241213	EI	On-Demand	Anodyne	EPHX2	16	42
O=C(NCc1cccc(CO)c1)N1Cc2cccnc2N2C[C@H](O)C[C@H]2C1	ZINC000875241215	FD	On-Demand	Anodyne	NAMPT	20	41
O=C(NCC1(N2CCCC2)CCOCC1)NNc1cccc(F)c1Cl	ZINC000875241240	FF	On-Demand	Reactive	HCN1	58	38
O=C(NCC1(N2CCCC2)CCOCC1)NNc1cccc(F)c1Cl	ZINC000875241240	FF	On-Demand	Reactive	HCN4	49	31
CC[C@@H](NC(=O)NCc1cccc(CO)c1)[C@@H](O)c1ccccc1	ZINC000875241258	EE	On-Demand	Anodyne	ANPEP	16	44
CC[C@@H](NC(=O)NCc1cccc(CO)c1)[C@@H](O)c1ccccc1	ZINC000875241258	EE	On-Demand	Anodyne	PDS	55	38
CC[C@@H](NC(=O)NCc1cccc(CO)c1)[C@H](O)c1ccccc1	ZINC000875241259	EE	On-Demand	Anodyne	ANPEP	16	44
CC[C@@H](NC(=O)NCc1cccc(CO)c1)[C@H](O)c1ccccc1	ZINC000875241259	EE	On-Demand	Anodyne	PDS	55	38
Cc1nnc(NNC(=O)NCc2cc(F)ccc2F)n1C	ZINC000875241274	CD	On-Demand	Reactive	P2RX7	64	40
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCc2cc(F)ccc2F)[C@@H](O)C1	ZINC000875241280	GE	On-Demand	Anodyne	P2RX7	43	37
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCc2cc(F)ccc2F)[C@@H](O)C1	ZINC000875241280	GE	On-Demand	Anodyne	GPR119	44	61
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NCc2cc(F)ccc2F)[C@@H](O)C1	ZINC000875241281	GE	On-Demand	Anodyne	P2RX7	43	37
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NCc2cc(F)ccc2F)[C@@H](O)C1	ZINC000875241281	GE	On-Demand	Anodyne	GPR119	44	61
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCc2cc(F)ccc2F)[C@H](O)C1	ZINC000875241282	GE	On-Demand	Anodyne	P2RX7	43	37
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCc2cc(F)ccc2F)[C@H](O)C1	ZINC000875241282	GE	On-Demand	Anodyne	GPR119	44	61
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NCc2cc(F)ccc2F)[C@H](O)C1	ZINC000875241283	GE	On-Demand	Anodyne	P2RX7	43	37
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NCc2cc(F)ccc2F)[C@H](O)C1	ZINC000875241283	GE	On-Demand	Anodyne	GPR119	44	61
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(F)ccc1F	ZINC000875241306	DE	On-Demand	Anodyne	SLC6A4	35	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(F)ccc1F	ZINC000875241306	DE	On-Demand	Anodyne	SLC6A3	68	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(F)ccc1F	ZINC000875241306	DE	On-Demand	Anodyne	P2RX7	51	37
COC(=O)N(C)NC(=O)NCC1(N2CCCC2)CCOCC1	ZINC000875241320	DC	On-Demand	Reactive	HCN1	60	39
COC(=O)N(C)NC(=O)NCC1(N2CCCC2)CCOCC1	ZINC000875241320	DC	On-Demand	Reactive	HCN4	50	33
CC(=O)N1CCC[C@@H](C(=O)NNC(=O)NCc2ccc3ccccc3c2)[C@H]1C	ZINC000875241375	GE	On-Demand	Reactive	OPRM1	23	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(F)ccc1F	ZINC000875241394	DE	On-Demand	Anodyne	SLC6A4	35	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(F)ccc1F	ZINC000875241394	DE	On-Demand	Anodyne	SLC6A3	68	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(F)ccc1F	ZINC000875241394	DE	On-Demand	Anodyne	P2RX7	51	37
CN(C)C[C@@H]1CN(C(=O)NCc2cc(F)ccc2F)C[C@H]1CN(C)C	ZINC000875241404	FD	On-Demand	Anodyne	P2RX7	51	39
CN(C)C[C@@H]1CN(C(=O)NCc2cc(F)ccc2F)C[C@H]1CN(C)C	ZINC000875241404	FD	On-Demand	Anodyne	DPP4	19	46
Cc1cccc2c1CC[C@@H]2NC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875241474	FE	On-Demand	Anodyne	L3MBTL3	84	45
Cc1cccc2c1CC[C@H]2NC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875241476	FE	On-Demand	Anodyne	L3MBTL3	84	45
CN1CCN(C(=O)NCc2cc(F)ccc2F)CCC1(C)C	ZINC000875241515	DF	On-Demand	Anodyne	CACNA1H	58	37
CN1CCN(C(=O)NCc2cc(F)ccc2F)CCC1(C)C	ZINC000875241515	DF	On-Demand	Anodyne	P2RX7	42	37
CN1CCN(C(=O)NCc2cc(F)ccc2F)CCC1(C)C	ZINC000875241515	DF	On-Demand	Anodyne	DPP4	16	42
CN1CCN(C(=O)NCc2cc(F)ccc2F)CCC1(C)C	ZINC000875241515	DF	On-Demand	Anodyne	EPHX2	16	44
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cccc(CO)c2)CC1	ZINC000875241516	FH	On-Demand	Anodyne	HTR1A	18	42
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cccc(CO)c2)CC1	ZINC000875241516	FH	On-Demand	Anodyne	DRD2	24	49
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cccc(CO)c2)CC1	ZINC000875241516	FH	On-Demand	Anodyne	DRD4	19	49
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cccc(CO)c2)CC1	ZINC000875241516	FH	On-Demand	Anodyne	EPHX2	17	40
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cccc(CO)c2)CC1	ZINC000875241516	FH	On-Demand	Anodyne	RBP4	25	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cccc(CO)c2)CC1	ZINC000875241518	FH	On-Demand	Anodyne	HTR1A	18	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cccc(CO)c2)CC1	ZINC000875241518	FH	On-Demand	Anodyne	DRD2	24	49
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cccc(CO)c2)CC1	ZINC000875241518	FH	On-Demand	Anodyne	DRD4	19	49
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cccc(CO)c2)CC1	ZINC000875241518	FH	On-Demand	Anodyne	EPHX2	17	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cccc(CO)c2)CC1	ZINC000875241518	FH	On-Demand	Anodyne	RBP4	25	41
C[C@@H](CNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)N(C)C1CC1	ZINC000875241611	FF	On-Demand	Anodyne	OPRL1	15	44
O=C(NCc1ccc2ccccc2c1)N1CCc2nc(C3CC3)ncc2C1	ZINC000875241636	FH	On-Demand	Anodyne	MAPK1	30	43
O=C(NCc1ccc2ccccc2c1)N1CCc2nc(C3CC3)ncc2C1	ZINC000875241636	FH	On-Demand	Anodyne	NAMPT	28	42
CC[C@@H]1COCCN1CCNC(=O)NCC1(N2CCCC2)CCOCC1	ZINC000875241822	FD	On-Demand	Anodyne	HCN1	44	37
CC[C@@H]1COCCN1CCNC(=O)NCC1(N2CCCC2)CCOCC1	ZINC000875241822	FD	On-Demand	Anodyne	HCN4	40	30
CC(C)(C)OC(=O)N1CCC2(CC1)CN(C(=O)NCc1cccc(CO)c1)C2	ZINC000875241828	GF	On-Demand	Anodyne	GPR119	29	42
O=C(N[C@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCc2cc(F)ccc2F)C1	ZINC000875241844	GE	On-Demand	Anodyne	EPHX2	31	44
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCc2cc(F)ccc2F)C1	ZINC000875241846	GE	On-Demand	Anodyne	EPHX2	31	44
O=C(N[C@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCc2cc(F)ccc2F)C1	ZINC000875241848	GE	On-Demand	Anodyne	EPHX2	31	44
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCc2cc(F)ccc2F)C1	ZINC000875241850	GE	On-Demand	Anodyne	EPHX2	31	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(CO)c1	ZINC000875241881	DD	On-Demand	Anodyne	SLC6A4	36	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(CO)c1	ZINC000875241881	DD	On-Demand	Anodyne	SLC6A3	64	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(CO)c1	ZINC000875241901	DD	On-Demand	Anodyne	SLC6A4	36	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(CO)c1	ZINC000875241901	DD	On-Demand	Anodyne	SLC6A3	64	41
NC(=O)CCOC(=O)c1cc(-c2ccco2)n(-c2ccc(Cl)cc2)n1	ZINC000875241915	FF	On-Demand	Anodyne	FABP4	26	50
NC(=O)CCOC(=O)c1cc(-c2ccco2)n(-c2ccc(Cl)cc2)n1	ZINC000875241915	FF	On-Demand	Anodyne	RPA1	61	42
O=C1CCN(C(=O)NCc2cc(F)ccc2F)CCCCCCN1	ZINC000875241917	EF	On-Demand	Anodyne	P2RX7	28	40
C[C@@H]1CC(NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)C[C@@H](C)O1	ZINC000875241946	FE	On-Demand	Anodyne	C3AR1	40	41
C[C@@H]1CC(NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)C[C@@H](C)O1	ZINC000875241950	FE	On-Demand	Anodyne	C3AR1	40	41
O=C(NCC1(N2CCCC2)CCOCC1)NC1CC(Nc2ccccc2)C1	ZINC000875241954	FF	On-Demand	Anodyne	HCN1	66	40
O=C(NCC1(N2CCCC2)CCOCC1)NC1CC(Nc2ccccc2)C1	ZINC000875241954	FF	On-Demand	Anodyne	HCN4	52	34
O=C(NCC1(N2CCCC2)CCOCC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875242003	GE	On-Demand	Anodyne	SMO	17	43
O=C(NCC1(N2CCCC2)CCOCC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875242003	GE	On-Demand	Anodyne	HCN1	68	39
O=C(NCC1(N2CCCC2)CCOCC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875242003	GE	On-Demand	Anodyne	HCN4	49	32
O=C(NCC1(N2CCCC2)CCOCC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875242005	GE	On-Demand	Anodyne	SMO	17	43
O=C(NCC1(N2CCCC2)CCOCC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875242005	GE	On-Demand	Anodyne	HCN1	68	39
O=C(NCC1(N2CCCC2)CCOCC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875242005	GE	On-Demand	Anodyne	HCN4	49	32
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2(N3CCCC3)CCOCC2)C1	ZINC000875242009	FD	On-Demand	Anodyne	HCN1	58	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2(N3CCCC3)CCOCC2)C1	ZINC000875242009	FD	On-Demand	Anodyne	HCN4	49	32
O=C(NCc1cccc(CO)c1)NC1CC(Nc2ccccc2)C1	ZINC000875242044	EF	On-Demand	Anodyne	EPHX2	19	45
O=C(NC[C@H]1CCCS1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875242047	GE	On-Demand	Anodyne	ETHR	66	50
O=C(NCCO)C1CCN(C(=O)NCc2cc(F)ccc2F)CC1	ZINC000875242052	EC	On-Demand	Anodyne	EPHX2	32	56
O=C(NCc1cccc(CO)c1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875242066	EE	On-Demand	Anodyne	PDS	42	38
O=C(NCc1cccc(CO)c1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875242067	EE	On-Demand	Anodyne	PDS	42	38
COC(=O)N(C)NC(=O)NCc1cc(F)ccc1F	ZINC000875242078	CD	On-Demand	Reactive	P2RX7	41	36
O=C(NCc1cccc(CO)c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875242122	EF	On-Demand	Anodyne	F2	43	45
O=C(NCc1cccc(CO)c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875242122	EF	On-Demand	Anodyne	TRY1_BOVIN	41	38
O=C(NCc1cccc(CO)c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875242122	EF	On-Demand	Anodyne	PREP	47	48
O=C(NCc1cccc(CO)c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875242122	EF	On-Demand	Anodyne	TMPRSS11D	60	34
O=C(NCc1cccc(CO)c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875242123	EF	On-Demand	Anodyne	F2	43	45
O=C(NCc1cccc(CO)c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875242123	EF	On-Demand	Anodyne	TRY1_BOVIN	41	38
O=C(NCc1cccc(CO)c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875242123	EF	On-Demand	Anodyne	PREP	47	48
O=C(NCc1cccc(CO)c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875242123	EF	On-Demand	Anodyne	TMPRSS11D	60	34
O=C(NCc1cccc(CO)c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875242124	EF	On-Demand	Anodyne	F2	43	45
O=C(NCc1cccc(CO)c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875242124	EF	On-Demand	Anodyne	TRY1_BOVIN	41	38
O=C(NCc1cccc(CO)c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875242124	EF	On-Demand	Anodyne	PREP	47	48
O=C(NCc1cccc(CO)c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875242124	EF	On-Demand	Anodyne	TMPRSS11D	60	34
O=C(NCc1cccc(CO)c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875242125	EF	On-Demand	Anodyne	F2	43	45
O=C(NCc1cccc(CO)c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875242125	EF	On-Demand	Anodyne	TRY1_BOVIN	41	38
O=C(NCc1cccc(CO)c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875242125	EF	On-Demand	Anodyne	PREP	47	48
O=C(NCc1cccc(CO)c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875242125	EF	On-Demand	Anodyne	TMPRSS11D	60	34
C[C@@H]1CN(C(=O)NCc2cc(F)ccc2F)CC[C@H](C(F)(F)F)O1	ZINC000875242134	FG	On-Demand	Anodyne	DPP4	18	44
C[C@@H]1CN(C(=O)NCc2cc(F)ccc2F)CC[C@H](C(F)(F)F)O1	ZINC000875242134	FG	On-Demand	Anodyne	EPHX2	16	45
C[C@@H]1CN(C(=O)NCc2cc(F)ccc2F)CC[C@@H](C(F)(F)F)O1	ZINC000875242135	FG	On-Demand	Anodyne	DPP4	18	44
C[C@@H]1CN(C(=O)NCc2cc(F)ccc2F)CC[C@@H](C(F)(F)F)O1	ZINC000875242135	FG	On-Demand	Anodyne	EPHX2	16	45
O=C(NCc1cccc(CO)c1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875242140	EE	On-Demand	Anodyne	EPHX2	15	51
O=C(NCc1cccc(CO)c1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875242140	EE	On-Demand	Anodyne	NPSR1	25	40
O=C(NCc1cccc(CO)c1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875242141	EE	On-Demand	Anodyne	EPHX2	15	51
O=C(NCc1cccc(CO)c1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875242141	EE	On-Demand	Anodyne	NPSR1	25	40
CN(CCNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)C1CCCC1	ZINC000875242159	FF	On-Demand	Mild	CCR3	21	42
CN(CCNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)C1CCCC1	ZINC000875242159	FF	On-Demand	Mild	ITK	29	48
CN(CCNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)C1CCCC1	ZINC000875242159	FF	On-Demand	Mild	PANC	54	36
CCCCCCCNC(=O)C(=O)NC[C@H]1CCCS1	ZINC000875242160	CE	On-Demand	Mild	EPHX2	15	44
CCCCCCCNC(=O)C(=O)NC[C@H]1CCCS1	ZINC000875242160	CE	On-Demand	Mild	ASAH1	49	32
CCCCCCCNC(=O)C(=O)NC[C@@H]1CCCS1	ZINC000875242161	CE	On-Demand	Mild	EPHX2	15	44
CCCCCCCNC(=O)C(=O)NC[C@@H]1CCCS1	ZINC000875242161	CE	On-Demand	Mild	ASAH1	49	32
O=C(NCc1cccc(CO)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875242176	EF	On-Demand	Anodyne	EPHX2	26	47
O=C(NCc1cccc(CO)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875242176	EF	On-Demand	Anodyne	TPSAB1	17	44
O=C(NCc1cccc(CO)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875242177	EF	On-Demand	Anodyne	EPHX2	26	47
O=C(NCc1cccc(CO)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875242177	EF	On-Demand	Anodyne	TPSAB1	17	44
C[C@@H]1CC(NC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)C[C@@H](C)O1	ZINC000875242199	GE	On-Demand	Anodyne	ETHR	60	47
CC[C@H](C[C@H](C)O)NC(=O)NCC1(N2CCCC2)CCOCC1	ZINC000875242209	ED	On-Demand	Anodyne	HCN1	53	41
O=C(NCC1(N2CCCC2)CCOCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875242245	GF	On-Demand	Anodyne	HCN1	60	39
O=C(NCC1(N2CCCC2)CCOCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875242245	GF	On-Demand	Anodyne	HCN4	52	34
O=C(NCC1(N2CCCC2)CCOCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875242246	GF	On-Demand	Anodyne	HCN1	60	39
O=C(NCC1(N2CCCC2)CCOCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875242246	GF	On-Demand	Anodyne	HCN4	52	34
O=C(NCC1(N2CCCC2)CCOCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875242247	GF	On-Demand	Anodyne	HCN1	60	39
O=C(NCC1(N2CCCC2)CCOCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875242247	GF	On-Demand	Anodyne	HCN4	52	34
O=C(NCC1(N2CCCC2)CCOCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875242248	GF	On-Demand	Anodyne	HCN1	60	39
O=C(NCC1(N2CCCC2)CCOCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875242248	GF	On-Demand	Anodyne	HCN4	52	34
O=C(NCc1cccc(CO)c1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875242284	FE	On-Demand	Anodyne	SIGMAR1	24	41
O=C(NCc1cccc(CO)c1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875242284	FE	On-Demand	Anodyne	FAAH	22	43
CN1CCN(C2CCN(C(=O)C(=O)NC[C@@H]3CCCS3)CC2)CC1	ZINC000875242293	FC	On-Demand	Anodyne	L3MBTL3	42	39
CN1CCN(C2CCN(C(=O)C(=O)NC[C@H]3CCCS3)CC2)CC1	ZINC000875242294	FC	On-Demand	Anodyne	L3MBTL3	42	39
CN(CCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)C1CCCC1	ZINC000875242295	EF	On-Demand	Anodyne	CCR5	21	40
CN(CCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)C1CCCC1	ZINC000875242296	EF	On-Demand	Anodyne	CCR5	21	40
CN(CCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)C1CCCC1	ZINC000875242297	EF	On-Demand	Anodyne	CCR5	21	40
CN(CCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)C1CCCC1	ZINC000875242298	EF	On-Demand	Anodyne	CCR5	21	40
COC(=O)c1cc(C#N)c(=O)n(CC(=O)Nc2ccc3nc(O)[nH]c3c2)c1	ZINC000875242379	FC	On-Demand	Mild	ENPP1	63	33
CCC1(CC)CCCN1C(=O)NCc1cccc(CO)c1	ZINC000875242381	CG	On-Demand	Anodyne	SLC12A5	61	34
Cc1ccccc1CN1CCO[C@@H](CNC(=O)C(=O)NC[C@@H]2CCCS2)C1	ZINC000875242407	GD	On-Demand	Anodyne	SLC6A1	50	35
Cc1ccccc1CN1CCO[C@@H](CNC(=O)C(=O)NC[C@H]2CCCS2)C1	ZINC000875242409	GD	On-Demand	Anodyne	SLC6A1	50	35
CC[C@@H](NC(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1C)c1nc(C)cs1	ZINC000875242452	GI	On-Demand	Anodyne	SLC18A2	45	32
CC[C@@H](NC(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1C)c1nc(C)cs1	ZINC000875242453	GI	On-Demand	Anodyne	SLC18A2	45	32
CC[C@@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)c1nc(C)cs1	ZINC000875242472	GH	On-Demand	Mild	ITK	16	49
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(CO)c1	ZINC000875242482	CD	On-Demand	Anodyne	ANPEP	25	46
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(CO)c1	ZINC000875242482	CD	On-Demand	Anodyne	PDS	54	35
CCCCCCCNC(=O)C(=O)N[C@H]1C[C@H](C)O[C@H](C)C1	ZINC000875242488	CE	On-Demand	Mild	EPHX2	16	45
CCCCCCCNC(=O)C(=O)N[C@H]1C[C@H](C)O[C@H](C)C1	ZINC000875242488	CE	On-Demand	Mild	ASAH1	53	31
CCCCCCCNC(=O)C(=O)NC1C[C@@H](C)O[C@H](C)C1	ZINC000875242490	CE	On-Demand	Mild	EPHX2	16	45
CCCCCCCNC(=O)C(=O)NC1C[C@@H](C)O[C@H](C)C1	ZINC000875242490	CE	On-Demand	Mild	ASAH1	53	31
CCCCCCCNC(=O)C(=O)NC1C[C@H](C)O[C@@H](C)C1	ZINC000875242493	CE	On-Demand	Mild	EPHX2	16	45
CCCCCCCNC(=O)C(=O)NC1C[C@H](C)O[C@@H](C)C1	ZINC000875242493	CE	On-Demand	Mild	ASAH1	53	31
C[C@@H](NC(=O)NCc1cc(F)ccc1F)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875242549	FG	On-Demand	Anodyne	P2RX7	46	39
C[C@@H](NC(=O)NCc1cc(F)ccc1F)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875242549	FG	On-Demand	Anodyne	DPP4	15	44
C[C@@H](NC(=O)NCc1cc(F)ccc1F)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875242549	FG	On-Demand	Anodyne	GPR119	31	62
C[C@@H]([C@@H](C)NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)N1CCOCC1	ZINC000875242574	GE	On-Demand	Mild	ITK	15	47
C[C@@H]([C@@H](C)NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)N1CCOCC1	ZINC000875242574	GE	On-Demand	Mild	PANC	41	36
C[C@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)[C@H](C)N1CCOCC1	ZINC000875242576	GE	On-Demand	Mild	ITK	15	47
C[C@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)[C@H](C)N1CCOCC1	ZINC000875242576	GE	On-Demand	Mild	PANC	41	36
C[C@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)[C@@H](C)N1CCOCC1	ZINC000875242580	GE	On-Demand	Mild	ITK	15	47
C[C@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)[C@@H](C)N1CCOCC1	ZINC000875242580	GE	On-Demand	Mild	PANC	41	36
C[C@H](NC(=O)NC1CC(Nc2ccccc2)C1)[C@H](C)N1CCOCC1	ZINC000875242702	EE	On-Demand	Anodyne	ITGAL	43	34
C[C@@H](NC(=O)NC1CC(Nc2ccccc2)C1)[C@@H](C)N1CCOCC1	ZINC000875242704	EE	On-Demand	Anodyne	ITGAL	43	34
C[C@H](NC(=O)NC1CC(Nc2ccccc2)C1)[C@@H](C)N1CCOCC1	ZINC000875242705	EE	On-Demand	Anodyne	ITGAL	43	34
C[C@@H]([C@@H](C)NC(=O)NC1CC(Nc2ccccc2)C1)N1CCOCC1	ZINC000875242706	EE	On-Demand	Anodyne	ITGAL	43	34
Cc1nnc(NNC(=O)NCC2(N3CCCC3)CCOCC2)n1C	ZINC000875242751	EC	On-Demand	Reactive	HCN1	44	38
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NCC1(N2CCCC2)CCOCC1	ZINC000875242752	GE	On-Demand	Anodyne	HCN1	42	37
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NCC1(N2CCCC2)CCOCC1	ZINC000875242753	GE	On-Demand	Anodyne	HCN1	42	37
CC(C)(C)OC(=O)N1CC[C@H]2[C@H]1CCCN2C(=O)NCc1cccc(CO)c1	ZINC000875242766	GF	On-Demand	Anodyne	PREP	35	42
CC(C)(C)OC(=O)N1CC[C@@H]2[C@H]1CCCN2C(=O)NCc1cccc(CO)c1	ZINC000875242767	GF	On-Demand	Anodyne	PREP	35	42
CC(C)(C)OC(=O)N1CC[C@H]2[C@@H]1CCCN2C(=O)NCc1cccc(CO)c1	ZINC000875242768	GF	On-Demand	Anodyne	PREP	35	42
CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H]1CCCN2C(=O)NCc1cccc(CO)c1	ZINC000875242769	GF	On-Demand	Anodyne	PREP	35	42
C[C@@H]1CC(NC(=O)C(=O)NCCCCCCc2ccccc2)C[C@@H](C)O1	ZINC000875242795	FF	On-Demand	Anodyne	SIGMAR1	18	41
C[C@@H]1CC(NC(=O)C(=O)NCCCCCCc2ccccc2)C[C@@H](C)O1	ZINC000875242795	FF	On-Demand	Anodyne	MTNR1A	28	42
C[C@@H]1CC(NC(=O)C(=O)NCCCCCCc2ccccc2)C[C@@H](C)O1	ZINC000875242795	FF	On-Demand	Anodyne	MTNR1B	29	42
C[C@@H]1CC(NC(=O)C(=O)NCCCCCCc2ccccc2)C[C@@H](C)O1	ZINC000875242795	FF	On-Demand	Anodyne	FAAH	55	40
C[C@@H]1CC(NC(=O)C(=O)NCCCCCCc2ccccc2)C[C@@H](C)O1	ZINC000875242795	FF	On-Demand	Anodyne	CES1	60	37
C[C@@H]1CC(NC(=O)C(=O)NCCCCCCc2ccccc2)C[C@@H](C)O1	ZINC000875242795	FF	On-Demand	Anodyne	AMP1_PLAFQ	23	45
C[C@@H]1CC(NC(=O)C(=O)NCCCCCCc2ccccc2)C[C@@H](C)O1	ZINC000875242795	FF	On-Demand	Anodyne	NAAA	44	42
C[C@H]1CCC[C@@H](NC(=O)C(=O)N2CCC(N3CCN(C)CC3)CC2)CC1	ZINC000875242848	FD	On-Demand	Anodyne	L3MBTL3	40	40
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(C(C)=O)CC1	ZINC000875242895	CD	On-Demand	Anodyne	RIR1_HHV11	40	34
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)[C@@H](C)N1CCOCC1	ZINC000875242962	GE	On-Demand	Anodyne	OPRL1	16	43
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)[C@@H](C)N1CCOCC1	ZINC000875242964	GE	On-Demand	Anodyne	OPRL1	16	43
C[C@@H]([C@@H](C)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)N1CCOCC1	ZINC000875242966	GE	On-Demand	Anodyne	OPRL1	16	43
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)[C@H](C)N1CCOCC1	ZINC000875242967	GE	On-Demand	Anodyne	OPRL1	16	43
Cc1nc(C(C)(C)NC(=O)NCCC2CCN(Cc3ccccc3)CC2)no1	ZINC000875242987	GG	On-Demand	Anodyne	DRD2	15	42
Cc1nc(C(C)(C)NC(=O)NCCC2CCN(Cc3ccccc3)CC2)no1	ZINC000875242987	GG	On-Demand	Anodyne	DRD4	39	40
Cc1nc(C(C)(C)NC(=O)NCCC2CCN(Cc3ccccc3)CC2)no1	ZINC000875242987	GG	On-Demand	Anodyne	ACHE	59	55
Cc1nc(C(C)(C)NC(=O)NCCC2CCN(Cc3ccccc3)CC2)no1	ZINC000875242987	GG	On-Demand	Anodyne	SIGMAR1	46	42
Cc1nc(C(C)(C)NC(=O)NCCC2CCN(Cc3ccccc3)CC2)no1	ZINC000875242987	GG	On-Demand	Anodyne	MCHR1	16	40
Cc1nc(C(C)(C)NC(=O)NCCC2CCN(Cc3ccccc3)CC2)no1	ZINC000875242987	GG	On-Demand	Anodyne	CACNA1I	43	35
CC[C@@H](NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1)c1nc(C)cs1	ZINC000875243002	GI	On-Demand	Anodyne	ETHR	62	43
COC(=O)c1cc(C#N)c(=O)n(CC(=O)Nc2ccccc2C(=O)N[C@@H](C)c2ccccc2)c1	ZINC000875243028	JF	On-Demand	Mild	FAS	51	43
COC(=O)c1cc(C#N)c(=O)n(CC(=O)Nc2ccccc2C(=O)N[C@H](C)c2ccccc2)c1	ZINC000875243029	JF	On-Demand	Mild	FAS	51	43
C[C@@H]1CCC[C@H]1NC(=O)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875243073	FH	On-Demand	Anodyne	EPHX2	18	47
C[C@H]1CCC[C@H]1NC(=O)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875243074	FH	On-Demand	Anodyne	EPHX2	18	47
C[C@H]1CCC[C@@H]1NC(=O)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875243076	FH	On-Demand	Anodyne	EPHX2	18	47
C[C@@H]1CC(NC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C[C@@H](C)O1	ZINC000875243156	FE	On-Demand	Anodyne	OXTR	58	41
C[C@@H]1CC(NC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C[C@@H](C)O1	ZINC000875243157	FE	On-Demand	Anodyne	OXTR	58	41
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H]1C[C@H](C)O[C@H](C)C1)CC2	ZINC000875243211	GE	On-Demand	Anodyne	SLC18A2	48	38
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@H]1C[C@H](C)O[C@H](C)C1)CC2	ZINC000875243312	GE	On-Demand	Anodyne	SLC18A2	48	38
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NC1C[C@H](C)O[C@@H](C)C1)CC2	ZINC000875243313	GE	On-Demand	Anodyne	SLC18A2	48	38
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NC1C[C@@H](C)O[C@H](C)C1)CC2	ZINC000875243314	GE	On-Demand	Anodyne	SLC18A2	48	38
CC[C@@H](NC(=O)N1CCN(c2ccc(F)cc2C#N)CC1)c1nc(C)cs1	ZINC000875243326	GG	On-Demand	Mild	P2RY12	15	40
O=C(NCC1(N2CCCC2)CCOCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875243394	GE	On-Demand	Anodyne	NPFFR1	40	36
O=C(NCC1(N2CCCC2)CCOCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875243394	GE	On-Demand	Anodyne	HCN1	68	38
O=C(NCC1(N2CCCC2)CCOCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875243394	GE	On-Demand	Anodyne	HCN4	49	33
C[C@@H]1CCC[C@H]1NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875243412	DG	On-Demand	Mild	ITK	19	49
C[C@@H]1CCC[C@H]1NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875243412	DG	On-Demand	Mild	PANC	55	37
C[C@H]1CCC[C@@H]1NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875243414	DG	On-Demand	Mild	ITK	19	49
C[C@H]1CCC[C@@H]1NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875243414	DG	On-Demand	Mild	PANC	55	37
C[C@H]1CCC[C@H]1NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875243415	DG	On-Demand	Mild	ITK	19	49
C[C@H]1CCC[C@H]1NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875243415	DG	On-Demand	Mild	PANC	55	37
COCCN(CC1CCN(C)CC1)C(=O)NCC1CCN(C(C)=O)CC1	ZINC000875243426	FD	On-Demand	Anodyne	CACNA1I	41	33
COC(=O)[C@@]12C[C@@H](NC(=O)NCC3CCN(C(C)=O)CC3)C[C@@H]1C2	ZINC000875243460	EC	On-Demand	Anodyne	EPHX2	18	53
CC[C@@H](NC(=O)NCC1(N2CCCC2)CCOCC1)[C@@H](O)c1ccccc1	ZINC000875243541	GE	On-Demand	Anodyne	HCN1	79	44
CC[C@@H](NC(=O)NCC1(N2CCCC2)CCOCC1)[C@@H](O)c1ccccc1	ZINC000875243541	GE	On-Demand	Anodyne	HCN4	56	36
CC[C@@H](NC(=O)NCC1(N2CCCC2)CCOCC1)[C@H](O)c1ccccc1	ZINC000875243544	GE	On-Demand	Anodyne	HCN1	79	44
CC[C@@H](NC(=O)NCC1(N2CCCC2)CCOCC1)[C@H](O)c1ccccc1	ZINC000875243544	GE	On-Demand	Anodyne	HCN4	56	36
CCCCCCCNC(=O)C(=O)NCC1CCC(OC)CC1	ZINC000875243545	DE	On-Demand	Mild	EPHX2	16	43
CCCCCCCNC(=O)C(=O)NCC1CCC(OC)CC1	ZINC000875243545	DE	On-Demand	Mild	ASAH1	65	41
O=C(NCC1(N2CCCC2)CCOCC1)N1Cc2cccc(O)c2C1	ZINC000875243578	EE	On-Demand	Clean	HCN1	67	38
O=C(NCC1(N2CCCC2)CCOCC1)N1Cc2cccc(O)c2C1	ZINC000875243578	EE	On-Demand	Clean	HCN4	47	30
O=C(NCC1(N2CCCC2)CCOCC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875243579	GE	On-Demand	Anodyne	HCN1	63	37
O=C(NCC1(N2CCCC2)CCOCC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875243579	GE	On-Demand	Anodyne	HCN4	50	32
O=C(NCC1(N2CCCC2)CCOCC1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875243606	GE	On-Demand	Anodyne	SMO	17	41
O=C(NCC1(N2CCCC2)CCOCC1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875243606	GE	On-Demand	Anodyne	HCN1	44	35
CN(CCNC(=O)N1CCC[C@@](O)(c2ccccc2)C1)C1CCCC1	ZINC000875243715	EF	On-Demand	Anodyne	EPHX2	15	46
CN(CCNC(=O)N1CCC[C@](O)(c2ccccc2)C1)C1CCCC1	ZINC000875243716	EF	On-Demand	Anodyne	EPHX2	15	46
CCOC(=O)C1=C(Cn2cc(C(=O)OC)cc(C#N)c2=O)NC(=O)N[C@@H]1c1ccccc1	ZINC000875243829	ID	On-Demand	Mild	ADRA1A	19	40
CCOC(=O)C1=C(Cn2cc(C(=O)OC)cc(C#N)c2=O)NC(=O)N[C@@H]1c1ccccc1	ZINC000875243829	ID	On-Demand	Mild	CACNA1C	64	39
CCOC(=O)C1=C(Cn2cc(C(=O)OC)cc(C#N)c2=O)NC(=O)N[C@@H]1c1ccccc1	ZINC000875243829	ID	On-Demand	Mild	CACNA1D	94	39
CCOC(=O)C1=C(Cn2cc(C(=O)OC)cc(C#N)c2=O)NC(=O)N[C@@H]1c1ccccc1	ZINC000875243829	ID	On-Demand	Mild	SLC27A4	79	37
CCOC(=O)C1=C(Cn2cc(C(=O)OC)cc(C#N)c2=O)NC(=O)N[C@H]1c1ccccc1	ZINC000875243830	ID	On-Demand	Mild	ADRA1A	19	40
CCOC(=O)C1=C(Cn2cc(C(=O)OC)cc(C#N)c2=O)NC(=O)N[C@H]1c1ccccc1	ZINC000875243830	ID	On-Demand	Mild	CACNA1C	64	39
CCOC(=O)C1=C(Cn2cc(C(=O)OC)cc(C#N)c2=O)NC(=O)N[C@H]1c1ccccc1	ZINC000875243830	ID	On-Demand	Mild	CACNA1D	94	39
CCOC(=O)C1=C(Cn2cc(C(=O)OC)cc(C#N)c2=O)NC(=O)N[C@H]1c1ccccc1	ZINC000875243830	ID	On-Demand	Mild	SLC27A4	79	37
COc1ccccc1N(C)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cc(Cl)ccc2F)c1	ZINC000875243908	JK	On-Demand	Anodyne	CPT1A	46	38
COc1ccccc1N(C)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cc(Cl)ccc2F)c1	ZINC000875243908	JK	On-Demand	Anodyne	KCNMA1	39	41
COc1ccc(N2CCN(C(=O)C(=O)N[C@H]3CCO[C@H](C)C3)CC2)c(OC)c1	ZINC000875243966	GD	On-Demand	Clean	NPBWR1	49	32
COc1ccc(N2CCN(C(=O)C(=O)N[C@H]3CCO[C@@H](C)C3)CC2)c(OC)c1	ZINC000875243967	GD	On-Demand	Clean	NPBWR1	49	32
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H]3CCO[C@H](C)C3)CC2)c(OC)c1	ZINC000875243968	GD	On-Demand	Clean	NPBWR1	49	32
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H]3CCO[C@@H](C)C3)CC2)c(OC)c1	ZINC000875243969	GD	On-Demand	Clean	NPBWR1	49	32
C[C@H]1CCC[C@@H](NC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)CC1	ZINC000875244008	GG	On-Demand	Anodyne	SMO	27	40
C[C@H]1CCC[C@@H](NC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)CC1	ZINC000875244008	GG	On-Demand	Anodyne	ETHR	54	47
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)N[C@@H]3CCO[C@H](C)C3)C2)c1	ZINC000875244037	GC	On-Demand	Anodyne	DRD4	27	41
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)N[C@H]3CCO[C@H](C)C3)C2)c1	ZINC000875244038	GC	On-Demand	Anodyne	DRD4	27	41
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)N[C@@H]3CCO[C@@H](C)C3)C2)c1	ZINC000875244039	GC	On-Demand	Anodyne	DRD4	27	41
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)N[C@H]3CCO[C@@H](C)C3)C2)c1	ZINC000875244040	GC	On-Demand	Anodyne	DRD4	27	41
C[C@@H]1CCC[C@H]1NC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875244045	DF	On-Demand	Anodyne	EPHX2	33	54
C[C@@H]1CCC[C@H]1NC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875244046	DF	On-Demand	Anodyne	EPHX2	33	54
CC[C@@H](NC(=O)NCC1CCN(C(C)=O)CC1)[C@@H](O)c1ccccc1	ZINC000875244120	EE	On-Demand	Anodyne	GRIN2B	45	43
CC[C@@H](NC(=O)NCC1CCN(C(C)=O)CC1)[C@@H](O)c1ccccc1	ZINC000875244120	EE	On-Demand	Anodyne	EPHX2	17	42
CC[C@@H](NC(=O)NCC1CCN(C(C)=O)CC1)[C@@H](O)c1ccccc1	ZINC000875244120	EE	On-Demand	Anodyne	XIAP	53	36
CC[C@@H](NC(=O)NCC1CCN(C(C)=O)CC1)[C@H](O)c1ccccc1	ZINC000875244121	EE	On-Demand	Anodyne	GRIN2B	45	43
CC[C@@H](NC(=O)NCC1CCN(C(C)=O)CC1)[C@H](O)c1ccccc1	ZINC000875244121	EE	On-Demand	Anodyne	EPHX2	17	42
CC[C@@H](NC(=O)NCC1CCN(C(C)=O)CC1)[C@H](O)c1ccccc1	ZINC000875244121	EE	On-Demand	Anodyne	XIAP	53	36
COc1ccccc1[C@H]1CCCN(C(=O)NCC2CCN(C(C)=O)CC2)CC1	ZINC000875244245	GG	On-Demand	Anodyne	EPHX2	18	41
COc1ccccc1[C@H]1CCCN(C(=O)NCC2CCN(C(C)=O)CC2)CC1	ZINC000875244245	GG	On-Demand	Anodyne	RBP4	37	41
COc1ccccc1[C@H]1CCCN(C(=O)NCC2CCN(C(C)=O)CC2)CC1	ZINC000875244245	GG	On-Demand	Anodyne	SMO	17	40
COc1ccccc1[C@H]1CCCN(C(=O)NCC2CCN(C(C)=O)CC2)CC1	ZINC000875244245	GG	On-Demand	Anodyne	MBTPS1	50	36
COc1ccccc1[C@H]1CCCN(C(=O)NCC2CCN(C(C)=O)CC2)CC1	ZINC000875244245	GG	On-Demand	Anodyne	ACKR3	63	32
COc1ccccc1[C@@H]1CCCN(C(=O)NCC2CCN(C(C)=O)CC2)CC1	ZINC000875244246	GG	On-Demand	Anodyne	EPHX2	18	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCC2CCN(C(C)=O)CC2)CC1	ZINC000875244246	GG	On-Demand	Anodyne	RBP4	37	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCC2CCN(C(C)=O)CC2)CC1	ZINC000875244246	GG	On-Demand	Anodyne	SMO	17	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCC2CCN(C(C)=O)CC2)CC1	ZINC000875244246	GG	On-Demand	Anodyne	MBTPS1	50	36
COc1ccccc1[C@@H]1CCCN(C(=O)NCC2CCN(C(C)=O)CC2)CC1	ZINC000875244246	GG	On-Demand	Anodyne	ACKR3	63	32
Cc1nc(C(C)(C)NC(=O)NCc2ccc(OC(F)F)cc2F)no1	ZINC000875244307	FF	On-Demand	Anodyne	TRPV1	59	33
Cc1nc(C(C)(C)NC(=O)NCc2ccc(OC(F)F)cc2F)no1	ZINC000875244307	FF	On-Demand	Anodyne	BDKRB1	15	40
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H]1CCO[C@H](C)C1)CC2	ZINC000875244319	GD	On-Demand	Anodyne	SLC18A2	46	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H]1CCO[C@@H](C)C1)CC2	ZINC000875244320	GD	On-Demand	Anodyne	SLC18A2	46	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H]1CCO[C@H](C)C1)CC2	ZINC000875244321	GD	On-Demand	Anodyne	SLC18A2	46	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H]1CCO[C@@H](C)C1)CC2	ZINC000875244322	GD	On-Demand	Anodyne	SLC18A2	46	34
COC(=O)c1cc(C#N)c(=O)n(CC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1	ZINC000875244527	IC	On-Demand	Mild	SSTR1	49	43
C[C@]1(NC(=O)C(F)(F)F)CCN(C(=O)NCc2ccc(C#N)cc2F)C1	ZINC000875244556	FE	On-Demand	Mild	EPHX2	15	40
COc1ccc(-c2csc(NC(=O)COC(=O)c3ccccc3SCc3cscn3)n2)cc1	ZINC000875244558	JK	On-Demand	Anodyne	ROCK1	20	42
N#Cc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c(F)c1	ZINC000875244604	FG	On-Demand	Mild	F2	32	43
N#Cc1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c(F)c1	ZINC000875244605	FG	On-Demand	Mild	F2	32	43
N#Cc1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c(F)c1	ZINC000875244606	FG	On-Demand	Mild	F2	32	43
N#Cc1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c(F)c1	ZINC000875244607	FG	On-Demand	Mild	F2	32	43
N#Cc1ccc(CNC(=O)N2CCC3(CCNC3=O)CC2)c(F)c1	ZINC000875244613	ED	On-Demand	Mild	CACNA1H	50	41
C[C@H](NC(=O)C(=O)NC[C@H]1CCC[C@H]1C)c1ccc(C(F)(F)F)nc1	ZINC000875244661	FF	On-Demand	Anodyne	TRPV1	43	34
C[C@H]1CCC[C@@H]1CNC(=O)C(=O)N[C@H](C)c1ccc(C(F)(F)F)nc1	ZINC000875244663	FF	On-Demand	Anodyne	TRPV1	43	34
C[C@H](NC(=O)C(=O)NC[C@H]1CCC[C@@H]1C)c1ccc(C(F)(F)F)nc1	ZINC000875244664	FF	On-Demand	Anodyne	TRPV1	43	34
C[C@H](NC(=O)C(=O)NC[C@@H]1CCC[C@@H]1C)c1ccc(C(F)(F)F)nc1	ZINC000875244665	FF	On-Demand	Anodyne	TRPV1	43	34
C[C@H]1CCC[C@H]1CNC(=O)C(=O)N[C@H](C)c1ccc(C(F)(F)F)nc1	ZINC000875244666	FF	On-Demand	Anodyne	TRPV1	43	34
C[C@H](NC(=O)C(=O)NC[C@@H]1CCC[C@H]1C)c1ccc(C(F)(F)F)nc1	ZINC000875244668	FF	On-Demand	Anodyne	TRPV1	43	34
C[C@@H](CN(C)C(=O)NCc1ccc(C#N)cc1F)NC(=O)OC(C)(C)C	ZINC000875244675	FF	On-Demand	Mild	PAPA1_CARPA	33	41
CCCCCCCNC(=O)C(=O)NCc1ccn2ccnc2c1	ZINC000875244689	DE	On-Demand	Mild	ASAH1	88	37
O=C(OCc1cccc([N+](=O)[O-])c1)c1ccccc1SCc1cscn1	ZINC000875244707	GJ	On-Demand	Bother	CACNA1C	54	42
O=C(OCc1cccc([N+](=O)[O-])c1)c1ccccc1SCc1cscn1	ZINC000875244707	GJ	On-Demand	Bother	CACNA1D	81	42
O=C(NCCCN1C(=O)CCC1=O)NC1CC(Nc2ccccc2)C1	ZINC000875244726	ED	On-Demand	Anodyne	CCR3	23	40
N#Cc1ccc(CNC(=O)N2CCC(c3nc(C4CCC4)no3)CC2)c(F)c1	ZINC000875244760	GG	On-Demand	Mild	EPHX2	16	45
N#Cc1ccc(CNC(=O)N2CCC(c3nc(C4CCC4)no3)CC2)c(F)c1	ZINC000875244760	GG	On-Demand	Mild	SMO	35	42
N#Cc1ccc(CNC(=O)N2CCC(c3nc(C4CCC4)no3)CC2)c(F)c1	ZINC000875244760	GG	On-Demand	Mild	ETHR	63	46
CC[C@@H](NC(=O)NCc1ccc(C#N)cc1F)[C@@H](O)c1ccccc1	ZINC000875244763	EG	On-Demand	Mild	CYSP_TRYCR	26	41
CC[C@@H](NC(=O)NCc1ccc(C#N)cc1F)[C@@H](O)c1ccccc1	ZINC000875244763	EG	On-Demand	Mild	CTSF	32	41
CC[C@@H](NC(=O)NCc1ccc(C#N)cc1F)[C@H](O)c1ccccc1	ZINC000875244764	EG	On-Demand	Mild	CYSP_TRYCR	26	41
CC[C@@H](NC(=O)NCc1ccc(C#N)cc1F)[C@H](O)c1ccccc1	ZINC000875244764	EG	On-Demand	Mild	CTSF	32	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1C[C@H]2CC[C@H]1O2	ZINC000875244793	GD	On-Demand	Anodyne	DRD2	18	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1C[C@H]2CC[C@H]1O2	ZINC000875244793	GD	On-Demand	Anodyne	DRD4	35	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1C[C@H]2CC[C@H]1O2	ZINC000875244793	GD	On-Demand	Anodyne	ACHE	56	56
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1C[C@H]2CC[C@H]1O2	ZINC000875244793	GD	On-Demand	Anodyne	DRD3	15	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1C[C@H]2CC[C@H]1O2	ZINC000875244793	GD	On-Demand	Anodyne	SIGMAR1	50	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000875244794	GD	On-Demand	Anodyne	DRD2	18	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000875244794	GD	On-Demand	Anodyne	DRD4	35	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000875244794	GD	On-Demand	Anodyne	ACHE	56	56
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000875244794	GD	On-Demand	Anodyne	DRD3	15	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000875244794	GD	On-Demand	Anodyne	SIGMAR1	50	44
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(C#N)cc2F)C1	ZINC000875244804	DE	On-Demand	Mild	P2RX7	32	40
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(C#N)cc2F)C1	ZINC000875244804	DE	On-Demand	Mild	EPHX2	19	45
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(C#N)cc2F)C1	ZINC000875244805	DE	On-Demand	Mild	P2RX7	32	40
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(C#N)cc2F)C1	ZINC000875244805	DE	On-Demand	Mild	EPHX2	19	45
COC(=O)C1=NO[C@@]2(CCN(C(=O)NC3CC(C)(c4ccccc4)C3)C2)C1	ZINC000875244877	FE	On-Demand	Anodyne	EPHX2	19	41
COC(=O)C1=NO[C@]2(CCN(C(=O)NC3CC(C)(c4ccccc4)C3)C2)C1	ZINC000875244878	FE	On-Demand	Anodyne	EPHX2	19	41
O=C(OCC(=O)N1CCc2[nH]c3ccccc3c2C1)c1ccccc1SCc1cscn1	ZINC000875244949	JJ	On-Demand	Anodyne	SSTR4	45	33
O=C(N[C@H]1C[C@H]2CC[C@H]1O2)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875244962	ED	On-Demand	Anodyne	OXTR	59	39
O=C(N[C@@H]1C[C@H]2CC[C@H]1O2)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875244963	ED	On-Demand	Anodyne	OXTR	59	39
O=C(N[C@@H]1C[C@H]2CC[C@H]1O2)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875244964	ED	On-Demand	Anodyne	OXTR	59	39
O=C(N[C@H]1C[C@H]2CC[C@H]1O2)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875244965	ED	On-Demand	Anodyne	OXTR	59	39
C[C@@H](NC(=O)NCc1ccc(C#N)cc1F)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875244977	GF	On-Demand	Mild	GPR119	24	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C#N)cc1F	ZINC000875244997	ED	On-Demand	Mild	SLC6A3	41	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C#N)cc1F	ZINC000875244998	ED	On-Demand	Mild	SLC6A3	41	37
CC(=O)C1CCN(C(=O)NCc2ccc(C#N)cc2F)CC1	ZINC000875245024	DE	On-Demand	Mild	P2RX7	34	40
CC(=O)C1CCN(C(=O)NCc2ccc(C#N)cc2F)CC1	ZINC000875245024	DE	On-Demand	Mild	EPHX2	25	52
O=C1CCC(=O)N1CCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875245029	FD	On-Demand	Anodyne	TRY1_BOVIN	44	34
O=C1CCC(=O)N1CCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875245030	FD	On-Demand	Anodyne	TRY1_BOVIN	44	34
O=C1CCC(=O)N1CCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875245031	FD	On-Demand	Anodyne	TRY1_BOVIN	44	34
O=C1CCC(=O)N1CCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875245032	FD	On-Demand	Anodyne	TRY1_BOVIN	44	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H]1C[C@H]3CC[C@H]1O3)CC2	ZINC000875245047	FD	On-Demand	Anodyne	SLC18A2	45	33
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H]1C[C@H]3CC[C@H]1O3)CC2	ZINC000875245048	FD	On-Demand	Anodyne	SLC18A2	45	33
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@@H]1C[C@H]3CC[C@H]1O3)CC2	ZINC000875245049	FD	On-Demand	Anodyne	SLC18A2	45	33
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@H]1C[C@H]3CC[C@H]1O3)CC2	ZINC000875245050	FD	On-Demand	Anodyne	SLC18A2	45	33
CCCCCCCNC(=O)C(=O)NC[C@@H](C)S(C)(=O)=O	ZINC000875245054	DC	On-Demand	Mild	ASAH1	78	33
CCCCCCCNC(=O)C(=O)NC[C@@H](C)S(C)(=O)=O	ZINC000875245054	DC	On-Demand	Mild	NOD1	50	38
CCCCCCCNC(=O)C(=O)NC[C@@H](C)S(C)(=O)=O	ZINC000875245054	DC	On-Demand	Mild	CQSS	51	33
CCCCCCCNC(=O)C(=O)NC[C@H](C)S(C)(=O)=O	ZINC000875245055	DC	On-Demand	Mild	ASAH1	78	33
CCCCCCCNC(=O)C(=O)NC[C@H](C)S(C)(=O)=O	ZINC000875245055	DC	On-Demand	Mild	NOD1	50	38
CCCCCCCNC(=O)C(=O)NC[C@H](C)S(C)(=O)=O	ZINC000875245055	DC	On-Demand	Mild	CQSS	51	33
C[C@@H]1CCC[C@H]1CNC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875245079	FC	On-Demand	Anodyne	L3MBTL3	42	39
C[C@H]1CCC[C@H]1CNC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875245080	FC	On-Demand	Anodyne	L3MBTL3	42	39
C[C@H]1CCC[C@@H]1CNC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875245082	FC	On-Demand	Anodyne	L3MBTL3	42	39
C[C@H]1CCC[C@H]1CNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875245087	FF	On-Demand	Anodyne	SMO	37	41
C[C@H]1CCC[C@H]1CNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875245087	FF	On-Demand	Anodyne	ETHR	60	48
C[C@@H]1CCC[C@H]1CNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875245088	FF	On-Demand	Anodyne	SMO	37	41
C[C@@H]1CCC[C@H]1CNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875245088	FF	On-Demand	Anodyne	ETHR	60	48
C[C@H]1CCC[C@@H]1CNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875245091	FF	On-Demand	Anodyne	SMO	37	41
C[C@H]1CCC[C@@H]1CNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875245091	FF	On-Demand	Anodyne	ETHR	60	48
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2CCCOC2)CC1	ZINC000875245094	EG	On-Demand	Anodyne	EPHX2	19	40
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2CCCOC2)CC1	ZINC000875245094	EG	On-Demand	Anodyne	RBP4	33	40
COc1ccccc1[C@H]1CCCN(C(=O)N[C@H]2CCCOC2)CC1	ZINC000875245096	EG	On-Demand	Anodyne	EPHX2	19	40
COc1ccccc1[C@H]1CCCN(C(=O)N[C@H]2CCCOC2)CC1	ZINC000875245096	EG	On-Demand	Anodyne	RBP4	33	40
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CCCOC2)CC1	ZINC000875245098	EG	On-Demand	Anodyne	EPHX2	19	40
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CCCOC2)CC1	ZINC000875245098	EG	On-Demand	Anodyne	RBP4	33	40
COc1ccccc1[C@H]1CCCN(C(=O)N[C@@H]2CCCOC2)CC1	ZINC000875245100	EG	On-Demand	Anodyne	EPHX2	19	40
COc1ccccc1[C@H]1CCCN(C(=O)N[C@@H]2CCCOC2)CC1	ZINC000875245100	EG	On-Demand	Anodyne	RBP4	33	40
O=C(NCCCCC1CCCC1)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875245129	GG	On-Demand	Anodyne	BMP1	62	41
O=C(NCCCCC1CCCC1)C(=O)NCc1ncc(Br)s1	ZINC000875245201	GF	On-Demand	Anodyne	BMP1	64	35
O=C(N[C@H]1CCCOC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875245247	DD	On-Demand	Anodyne	EPHX2	29	44
O=C(N[C@@H]1CCCOC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875245248	DD	On-Demand	Anodyne	EPHX2	29	44
O=C(N[C@H]1CCCOC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875245249	DD	On-Demand	Anodyne	EPHX2	29	44
O=C(N[C@@H]1CCCOC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875245250	DD	On-Demand	Anodyne	EPHX2	29	44
CSCC[C@@H](C)NC(=O)C(=O)NCc1cccc2[nH]ccc12	ZINC000875245253	DE	On-Demand	Anodyne	MMP1	16	40
CSCC[C@H](C)NC(=O)C(=O)NCc1cccc2[nH]ccc12	ZINC000875245254	DE	On-Demand	Anodyne	MMP1	16	40
C[C@]1(C(F)(F)F)CCN(C(=O)NCc2ccc(C#N)cc2F)C1	ZINC000875245272	EG	On-Demand	Mild	EPHX2	16	41
O=C(NCCCN1C(=O)CCC1=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875245343	GE	On-Demand	Reactive	TSHR	48	32
O=C(NCCCN1C(=O)CCC1=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875245343	GE	On-Demand	Reactive	LTA4H	31	44
O=C(NCCCN1C(=O)CCC1=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875245343	GE	On-Demand	Reactive	CA1	16	47
CONC(=O)C1CCN(C(=O)NCc2ccc(C#N)cc2F)CC1	ZINC000875245346	ED	On-Demand	Mild	EPHX2	25	50
C[C@H](NC(=O)C(=O)NCCCCC1CCCC1)c1ccnn1C	ZINC000875245363	DE	On-Demand	Anodyne	BMP1	76	35
C[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000875245376	JK	On-Demand	Anodyne	EPHX2	53	39
CSCC[C@@H](C)NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875245448	FF	On-Demand	Anodyne	C3AR1	41	41
CSCC[C@@H](C)NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875245449	FF	On-Demand	Anodyne	C3AR1	41	41
CSCC[C@H](C)NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875245450	FF	On-Demand	Anodyne	C3AR1	41	41
CSCC[C@H](C)NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875245451	FF	On-Demand	Anodyne	C3AR1	41	41
C[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000875245528	IJ	On-Demand	Anodyne	TPP2	56	35
C[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000875245540	IJ	On-Demand	Anodyne	TPP2	56	35
CC(=O)c1cccc(NC(=O)[C@H](C)OC(=O)c2ccccc2SCc2cscn2)c1	ZINC000875245582	IJ	On-Demand	Anodyne	GPR142	40	43
CC(=O)c1cccc(NC(=O)[C@@H](C)OC(=O)c2ccccc2SCc2cscn2)c1	ZINC000875245583	IJ	On-Demand	Anodyne	GPR142	40	43
N#Cc1ccc(CNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)c(F)c1	ZINC000875245598	FF	On-Demand	Mild	EPHX2	19	51
N#Cc1ccc(CNC(=O)N2CCC[C@](O)(c3ccccc3)C2)c(F)c1	ZINC000875245599	FF	On-Demand	Mild	EPHX2	19	51
O=C(COC(=O)c1ccccc1SCc1cscn1)NCc1cccc(Cl)c1	ZINC000875245603	IJ	On-Demand	Anodyne	PDS	61	37
CN1CC[C@H]2CN(C(=O)NCc3ccc(C#N)cc3F)CC[C@H]21	ZINC000875245638	DD	On-Demand	Mild	P2RX7	31	41
CN1CC[C@H]2CN(C(=O)NCc3ccc(C#N)cc3F)CC[C@H]21	ZINC000875245638	DD	On-Demand	Mild	EPHX2	15	46
CN1CC[C@H]2CN(C(=O)NCc3ccc(C#N)cc3F)CC[C@@H]21	ZINC000875245639	DD	On-Demand	Mild	P2RX7	31	41
CN1CC[C@H]2CN(C(=O)NCc3ccc(C#N)cc3F)CC[C@@H]21	ZINC000875245639	DD	On-Demand	Mild	EPHX2	15	46
CN1CCN(C2CCN(C(=O)C(=O)NCc3ccn4ccnc4c3)CC2)CC1	ZINC000875245643	GC	On-Demand	Anodyne	L3MBTL3	45	37
O=C(COC(=O)c1ccccc1SCc1cscn1)c1cccc([N+](=O)[O-])c1	ZINC000875245660	HI	On-Demand	Bother	CACNA1D	52	33
C=C(C)CN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875245668	EF	On-Demand	Mild	DRD4	29	53
C=C(C)CN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875245668	EF	On-Demand	Mild	LTA4H	23	43
C=C(C)CN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875245668	EF	On-Demand	Mild	SIGMAR1	26	46
C=C(C)CN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875245668	EF	On-Demand	Mild	EPHX2	41	45
CCSCC[C@@H](C)NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875245712	GF	On-Demand	Anodyne	ETHR	55	46
CCSCC[C@H](C)NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875245713	GF	On-Demand	Anodyne	ETHR	55	46
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1C[C@H]2CC[C@H]1O2	ZINC000875245716	EE	On-Demand	Anodyne	CES1	44	33
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1C[C@H]2CC[C@H]1O2	ZINC000875245716	EE	On-Demand	Anodyne	AMP1_PLAFQ	22	44
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000875245717	EE	On-Demand	Anodyne	CES1	44	33
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000875245717	EE	On-Demand	Anodyne	AMP1_PLAFQ	22	44
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(C#N)cc1F	ZINC000875245725	CE	On-Demand	Mild	CYSP_TRYCR	27	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(C#N)cc1F	ZINC000875245725	CE	On-Demand	Mild	CTSF	29	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(C#N)cc1F	ZINC000875245725	CE	On-Demand	Mild	CTSV	15	41
C=C(C)CN1CCC(NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)CC1	ZINC000875245728	GG	On-Demand	Mild	SIGMAR1	17	41
C[C@H](OC(=O)c1ccccc1SCc1cscn1)c1cccc([N+](=O)[O-])c1	ZINC000875245733	HK	On-Demand	Bother	CACNA1C	47	35
C[C@H](OC(=O)c1ccccc1SCc1cscn1)c1cccc([N+](=O)[O-])c1	ZINC000875245733	HK	On-Demand	Bother	CACNA1D	74	35
C=C(C)CN1CCC(NC(=O)NC2CC(C(=O)OC)C2)CC1	ZINC000875245744	DD	On-Demand	Mild	EPHX2	19	42
CSCC[C@@H](C)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875245794	FE	On-Demand	Anodyne	ROCK1	24	40
CSCC[C@@H](C)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875245794	FE	On-Demand	Anodyne	ROCK2	16	40
CSCC[C@H](C)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875245796	FE	On-Demand	Anodyne	ROCK1	24	40
CSCC[C@H](C)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875245796	FE	On-Demand	Anodyne	ROCK2	16	40
CC(=O)C1CCN(C(=O)NCC2(c3ccccc3Cl)CCOCC2)CC1	ZINC000875245814	GG	On-Demand	Anodyne	EPHX2	15	41
C[C@H]1CC[C@H](CNC(=O)C(=O)NC2CCN(CC(=O)OC(C)(C)C)CC2)C1	ZINC000875245878	GD	On-Demand	Anodyne	CACNA1I	40	35
C[C@H]1CC[C@@H](CNC(=O)C(=O)NC2CCN(CC(=O)OC(C)(C)C)CC2)C1	ZINC000875245880	GD	On-Demand	Anodyne	CACNA1I	40	35
C[C@H]1CC[C@H](CNC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)C1	ZINC000875245912	FF	On-Demand	Anodyne	SMO	29	40
C[C@H]1CC[C@H](CNC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)C1	ZINC000875245912	FF	On-Demand	Anodyne	ETHR	59	47
C[C@H]1CC[C@@H](CNC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)C1	ZINC000875245914	FF	On-Demand	Anodyne	SMO	29	40
C[C@H]1CC[C@@H](CNC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)C1	ZINC000875245914	FF	On-Demand	Anodyne	ETHR	59	47
CCCCCCCNC(=O)C(=O)N[C@H]1CCO[C@@H]1C	ZINC000875245956	CD	On-Demand	Mild	ASAH1	49	34
CCCCCCCNC(=O)C(=O)N[C@H]1CCO[C@@H]1C	ZINC000875245956	CD	On-Demand	Mild	LASR	54	35
CCCCCCCNC(=O)C(=O)N[C@@H]1CCO[C@H]1C	ZINC000875245957	CD	On-Demand	Mild	ASAH1	49	34
CCCCCCCNC(=O)C(=O)N[C@@H]1CCO[C@H]1C	ZINC000875245957	CD	On-Demand	Mild	LASR	54	35
CCCCCCCNC(=O)C(=O)N[C@H]1CCO[C@H]1C	ZINC000875245958	CD	On-Demand	Mild	ASAH1	49	34
CCCCCCCNC(=O)C(=O)N[C@H]1CCO[C@H]1C	ZINC000875245958	CD	On-Demand	Mild	LASR	54	35
CCCCCCCNC(=O)C(=O)N[C@@H]1CCO[C@@H]1C	ZINC000875245959	CD	On-Demand	Mild	ASAH1	49	34
CCCCCCCNC(=O)C(=O)N[C@@H]1CCO[C@@H]1C	ZINC000875245959	CD	On-Demand	Mild	LASR	54	35
O=C(NCCC1CCC1)C(=O)NCc1ncc(Br)s1	ZINC000875245968	ED	On-Demand	Anodyne	SIRT2	44	32
O=C(NCCC1CCC1)C(=O)NCc1ncc(Br)s1	ZINC000875245968	ED	On-Demand	Anodyne	SIRT1	41	32
C=C(C)CN1CCC(NC(=O)N[C@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000875245969	EF	On-Demand	Mild	CCR5	22	40
C=C(C)CN1CCC(NC(=O)N[C@@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000875245970	EF	On-Demand	Mild	CCR5	22	40
C=C(C)CN1CCC(NC(=O)N[C@@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000875245971	EF	On-Demand	Mild	CCR5	22	40
C=C(C)CN1CCC(NC(=O)N[C@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000875245973	EF	On-Demand	Mild	CCR5	22	40
O=C(N[C@H]1C[C@H]2CC[C@H]1O2)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875245988	FD	On-Demand	Anodyne	ETHR	42	45
O=C(N[C@@H]1C[C@H]2CC[C@H]1O2)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875245990	FD	On-Demand	Anodyne	ETHR	42	45
N#Cc1ccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c(F)c1	ZINC000875246005	EG	On-Demand	Mild	EPHX2	24	58
N#Cc1ccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c(F)c1	ZINC000875246008	EG	On-Demand	Mild	EPHX2	24	58
CCCCCCCNC(=O)C(=O)NCCC1CCC1	ZINC000875246014	CE	On-Demand	Mild	EPHX2	19	50
CCCCCCCNC(=O)C(=O)NCCC1CCC1	ZINC000875246014	CE	On-Demand	Mild	ASAH1	80	38
C[C@@H]1CN(C(=O)NCc2ccc(C#N)cc2F)CC[C@H](C(F)(F)F)O1	ZINC000875246063	FF	On-Demand	Mild	EPHX2	15	44
C[C@@H]1CN(C(=O)NCc2ccc(C#N)cc2F)CC[C@@H](C(F)(F)F)O1	ZINC000875246065	FF	On-Demand	Mild	EPHX2	15	44
COc1ccc(N2CCN(C(=O)NCc3ccc(C#N)cc3F)CC2)c(OC)c1	ZINC000875246067	GF	On-Demand	Mild	HTR1A	19	42
COc1ccc(N2CCN(C(=O)NCc3ccc(C#N)cc3F)CC2)c(OC)c1	ZINC000875246067	GF	On-Demand	Mild	DRD2	17	42
COc1ccc(N2CCN(C(=O)NCc3ccc(C#N)cc3F)CC2)c(OC)c1	ZINC000875246067	GF	On-Demand	Mild	DRD4	41	32
COc1ccc(N2CCN(C(=O)NCc3ccc(C#N)cc3F)CC2)c(OC)c1	ZINC000875246067	GF	On-Demand	Mild	PDGFRB	35	41
COc1ccc(N2CCN(C(=O)NCc3ccc(C#N)cc3F)CC2)c(OC)c1	ZINC000875246067	GF	On-Demand	Mild	HTR7	20	42
COc1ccc(N2CCN(C(=O)NCc3ccc(C#N)cc3F)CC2)c(OC)c1	ZINC000875246067	GF	On-Demand	Mild	TNIK	44	38
CS(=O)(=O)c1ccc(OCCNC(=O)N2CC[C@@H]3CSC[C@@H]3C2)cc1	ZINC000875246140	GD	On-Demand	Anodyne	MMP13	44	37
CS(=O)(=O)c1ccc(OCCNC(=O)N2CC[C@@H]3CSC[C@@H]3C2)cc1	ZINC000875246140	GD	On-Demand	Anodyne	GPR119	45	38
CS(=O)(=O)c1ccc(OCCNC(=O)N2CC[C@H]3CSC[C@H]3C2)cc1	ZINC000875246141	GD	On-Demand	Anodyne	MMP13	44	37
CS(=O)(=O)c1ccc(OCCNC(=O)N2CC[C@H]3CSC[C@H]3C2)cc1	ZINC000875246141	GD	On-Demand	Anodyne	GPR119	45	38
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NCCCN1C(=O)CCC1=O	ZINC000875246155	GD	On-Demand	Anodyne	PTGES2	45	32
CCN(Cc1ccccc1)C(=O)[C@H](C)OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1	ZINC000875246227	IG	On-Demand	Anodyne	NR1H4	29	41
CCN(Cc1ccccc1)C(=O)[C@H](C)OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1	ZINC000875246227	IG	On-Demand	Anodyne	LIMK2	27	42
CCN(Cc1ccccc1)C(=O)[C@@H](C)OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1	ZINC000875246229	IG	On-Demand	Anodyne	NR1H4	29	41
CCN(Cc1ccccc1)C(=O)[C@@H](C)OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1	ZINC000875246229	IG	On-Demand	Anodyne	LIMK2	27	42
CCN(Cc1ccccc1)C(=O)[C@@H](C)OC(=O)/C=C/c1ccc(NS(C)(=O)=O)cc1	ZINC000875246230	IG	On-Demand	Anodyne	NR1H4	29	41
CCN(Cc1ccccc1)C(=O)[C@@H](C)OC(=O)/C=C/c1ccc(NS(C)(=O)=O)cc1	ZINC000875246230	IG	On-Demand	Anodyne	LIMK2	27	42
CCN(Cc1ccccc1)C(=O)[C@H](C)OC(=O)/C=C/c1ccc(NS(C)(=O)=O)cc1	ZINC000875246231	IG	On-Demand	Anodyne	NR1H4	29	41
CCN(Cc1ccccc1)C(=O)[C@H](C)OC(=O)/C=C/c1ccc(NS(C)(=O)=O)cc1	ZINC000875246231	IG	On-Demand	Anodyne	LIMK2	27	42
C=CCN1CCC(NC(=O)NNc2ccc(OC)cc2Br)CC1	ZINC000875246239	GF	On-Demand	Reactive	PDK1	40	33
C=CCN1CCC(NC(=O)NNc2ccc(OC)cc2Br)CC1	ZINC000875246239	GF	On-Demand	Reactive	MCHR1	15	43
CCOC(=O)COC(=O)/C=C/c1ccc(NS(C)(=O)=O)cc1	ZINC000875246250	ED	On-Demand	Anodyne	PTPRB	24	40
CCOC(=O)COC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1	ZINC000875246252	ED	On-Demand	Anodyne	PTPRB	24	40
COc1cccc(COC(=O)/C=C\c2ccc(NS(C)(=O)=O)cc2)c1	ZINC000875246268	FF	On-Demand	Anodyne	NR1H4	40	37
COc1cccc(COC(=O)/C=C\c2ccc(NS(C)(=O)=O)cc2)c1	ZINC000875246268	FF	On-Demand	Anodyne	PTPRB	45	45
COc1cccc(COC(=O)/C=C\c2ccc(NS(C)(=O)=O)cc2)c1	ZINC000875246268	FF	On-Demand	Anodyne	AKR1B10	35	40
C[C@@H](CCC1CCCCC1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875246344	EE	On-Demand	Anodyne	BMP1	79	36
C[C@@H](CCC1CCCCC1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875246344	EE	On-Demand	Anodyne	CCR3	40	31
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NCC2(N(C)C)CCC2)CCO1	ZINC000875246355	GD	On-Demand	Anodyne	HCN1	47	35
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NCC2(N(C)C)CCC2)CCO1	ZINC000875246355	GD	On-Demand	Anodyne	HCN4	40	34
COc1ccccc1[C@H]1CN(C(=O)C(=O)NCC2(N(C)C)CCC2)CCO1	ZINC000875246356	GD	On-Demand	Anodyne	HCN1	47	35
COc1ccccc1[C@H]1CN(C(=O)C(=O)NCC2(N(C)C)CCC2)CCO1	ZINC000875246356	GD	On-Demand	Anodyne	HCN4	40	34
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CC(C)(c2ccccc2)C1	ZINC000875246389	EF	On-Demand	Anodyne	SLC6A4	22	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CC(C)(c2ccccc2)C1	ZINC000875246389	EF	On-Demand	Anodyne	SLC6A3	45	42
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCCOC3)cn2)cc1	ZINC000875246419	EE	On-Demand	Mild	ITK	17	48
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCCOC3)cn2)cc1	ZINC000875246419	EE	On-Demand	Mild	PANC	54	36
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCCOC3)cn2)cc1	ZINC000875246420	EE	On-Demand	Mild	ITK	17	48
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCCOC3)cn2)cc1	ZINC000875246420	EE	On-Demand	Mild	PANC	54	36
CS(=O)(=O)c1ccc(OCCNC(=O)N2CC[C@@H]3CSC[C@H]3C2)cc1	ZINC000875246456	GD	On-Demand	Anodyne	MMP13	44	37
CS(=O)(=O)c1ccc(OCCNC(=O)N2CC[C@@H]3CSC[C@H]3C2)cc1	ZINC000875246456	GD	On-Demand	Anodyne	GPR119	45	38
NS(=O)(=O)c1ccc(OCCOC(=O)c2ccccc2SCc2cscn2)cc1	ZINC000875246485	JG	On-Demand	Anodyne	CA2	19	41
NS(=O)(=O)c1ccc(OCCOC(=O)c2ccccc2SCc2cscn2)cc1	ZINC000875246485	JG	On-Demand	Anodyne	CA1	15	41
NS(=O)(=O)c1ccc(OCCOC(=O)c2ccccc2SCc2cscn2)cc1	ZINC000875246485	JG	On-Demand	Anodyne	CA7	23	41
NS(=O)(=O)c1ccc(OCCOC(=O)c2ccccc2SCc2cscn2)cc1	ZINC000875246485	JG	On-Demand	Anodyne	CA12	15	41
NS(=O)(=O)c1ccc(OCCOC(=O)c2ccccc2SCc2cscn2)cc1	ZINC000875246485	JG	On-Demand	Anodyne	CA9	15	41
O=C(O[C@H](C(=O)NCc1ccccc1)c1ccccc1)c1ccccc1SCc1cscn1	ZINC000875246507	JK	On-Demand	Anodyne	PDS	43	34
CO[C@@H]1CC[C@@H](C)N(C(=O)NCc2ccc(C#N)cc2F)C1	ZINC000875246509	DE	On-Demand	Mild	P2RX7	45	41
O=C(O[C@@H](C(=O)NCc1ccccc1)c1ccccc1)c1ccccc1SCc1cscn1	ZINC000875246510	JK	On-Demand	Anodyne	PDS	43	34
N#Cc1ccc(CNC(=O)N2CC[C@H]3CS(=O)(=O)C[C@@H]3C2)c(F)c1	ZINC000875246543	FD	On-Demand	Mild	P2RX7	17	40
N#Cc1ccc(CNC(=O)N2CC[C@H]3CS(=O)(=O)C[C@@H]3C2)c(F)c1	ZINC000875246543	FD	On-Demand	Mild	EPHX2	15	47
N#Cc1ccc(CNC(=O)N2CC[C@@H]3CS(=O)(=O)C[C@@H]3C2)c(F)c1	ZINC000875246544	FD	On-Demand	Mild	P2RX7	17	40
N#Cc1ccc(CNC(=O)N2CC[C@@H]3CS(=O)(=O)C[C@@H]3C2)c(F)c1	ZINC000875246544	FD	On-Demand	Mild	EPHX2	15	47
N#Cc1ccc(CNC(=O)N2CC[C@H]3CS(=O)(=O)C[C@H]3C2)c(F)c1	ZINC000875246545	FD	On-Demand	Mild	P2RX7	17	40
N#Cc1ccc(CNC(=O)N2CC[C@H]3CS(=O)(=O)C[C@H]3C2)c(F)c1	ZINC000875246545	FD	On-Demand	Mild	EPHX2	15	47
N#Cc1ccc(CNC(=O)N2CC[C@@H]3CS(=O)(=O)C[C@H]3C2)c(F)c1	ZINC000875246546	FD	On-Demand	Mild	P2RX7	17	40
N#Cc1ccc(CNC(=O)N2CC[C@@H]3CS(=O)(=O)C[C@H]3C2)c(F)c1	ZINC000875246546	FD	On-Demand	Mild	EPHX2	15	47
C[C@@H](CCC1CCCCC1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875246548	EE	On-Demand	Anodyne	BMP1	79	36
C[C@@H](CCC1CCCCC1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875246548	EE	On-Demand	Anodyne	CCR3	40	31
O=C(NCCOc1ccc(F)c(F)c1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875246553	FF	On-Demand	Anodyne	EPHX2	21	41
O=C(NCCOc1ccc(F)c(F)c1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875246555	FF	On-Demand	Anodyne	EPHX2	21	41
C[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875246579	JI	On-Demand	Anodyne	DRD4	28	43
C[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875246579	JI	On-Demand	Anodyne	SIGMAR1	22	41
C[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875246579	JI	On-Demand	Anodyne	BIRC2	31	41
C[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875246589	JI	On-Demand	Anodyne	DRD4	28	43
C[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875246589	JI	On-Demand	Anodyne	SIGMAR1	22	41
C[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875246589	JI	On-Demand	Anodyne	BIRC2	31	41
C=C(C)CN1CCC(NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)CC1	ZINC000875246605	FF	On-Demand	Mild	SIGMAR1	20	42
C=C(C)CN1CCC(NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)CC1	ZINC000875246605	FF	On-Demand	Mild	EPHX2	19	43
C=C(C)CN1CCC(NC(=O)N2CCC[C@](O)(c3ccccc3)C2)CC1	ZINC000875246607	FF	On-Demand	Mild	SIGMAR1	20	42
C=C(C)CN1CCC(NC(=O)N2CCC[C@](O)(c3ccccc3)C2)CC1	ZINC000875246607	FF	On-Demand	Mild	EPHX2	19	43
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCOC(C)C)CC2	ZINC000875246609	FD	On-Demand	Anodyne	SLC18A2	53	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCOC(C)C)CC2	ZINC000875246610	FD	On-Demand	Anodyne	SLC18A2	53	37
COCCN(CC1CCN(C)CC1)C(=O)NCCOc1ccc(F)cc1F	ZINC000875246611	GE	On-Demand	Anodyne	ACKR3	71	39
C=CCN1CCC(NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)CC1	ZINC000875246634	EE	On-Demand	Mild	EPHX2	17	42
C=CCN1CCC(NC(=O)N2CCC[C@](O)(c3ccccc3)C2)CC1	ZINC000875246636	EE	On-Demand	Mild	EPHX2	17	42
O=C(NCCOc1ccccc1C(F)(F)F)N1CCC(CO)(CO)CC1	ZINC000875246683	GD	On-Demand	Anodyne	RBP4	93	41
O=C(NCCOc1ccccc1C(F)(F)F)N1CCC(CO)(CO)CC1	ZINC000875246683	GD	On-Demand	Anodyne	SCD	28	41
CN1CCN(C2CCN(C(=O)NCc3ccc(C#N)cc3F)CC2)CC1	ZINC000875246688	FD	On-Demand	Mild	P2RX7	33	40
CN1CCN(C2CCN(C(=O)NCc3ccc(C#N)cc3F)CC2)CC1	ZINC000875246688	FD	On-Demand	Mild	EPHX2	15	49
CN1CCN(C2CCN(C(=O)NCc3ccc(C#N)cc3F)CC2)CC1	ZINC000875246688	FD	On-Demand	Mild	L3MBTL3	57	38
C[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000875246689	JJ	On-Demand	Anodyne	EDNRB	17	40
C[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000875246689	JJ	On-Demand	Anodyne	CCKAR	33	43
C[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000875246689	JJ	On-Demand	Anodyne	NMBR	20	43
C[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000875246689	JJ	On-Demand	Anodyne	GRPR	62	34
C[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000875246689	JJ	On-Demand	Anodyne	MMP11	43	32
C[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000875246689	JJ	On-Demand	Anodyne	MC1R	40	31
C=CCN1CCC(NC(=O)N(Cc2ccccc2)[C@H](CC)CO)CC1	ZINC000875246692	EF	On-Demand	Mild	SIGMAR1	19	41
O=C(OCc1cc(=O)oc2cc(O)ccc12)c1ccccc1SCc1cscn1	ZINC000875246693	IJ	On-Demand	Anodyne	HSD17B3	34	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCOc1ccc(F)cc1F	ZINC000875246758	FE	On-Demand	Anodyne	SLC6A4	19	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCOc1ccc(F)cc1F	ZINC000875246758	FE	On-Demand	Anodyne	SLC6A3	38	41
COc1ccc([C@@H]2CN(C(=O)C(=O)NCc3ccn4ccnc4c3)CCO2)cc1	ZINC000875246760	GD	On-Demand	Anodyne	NOS2	69	35
CCc1ccc([C@H](C)NC(=O)/C=C/c2ccc(O)cc2)cc1	ZINC000875246807	CH	On-Demand	Anodyne	KCNQ2	49	37
CCc1ccc([C@H](C)NC(=O)/C=C/c2ccc(O)cc2)cc1	ZINC000875246807	CH	On-Demand	Anodyne	HDAC8	17	45
CCc1ccc([C@H](C)NC(=O)/C=C/c2ccc(O)cc2)cc1	ZINC000875246807	CH	On-Demand	Anodyne	F3	19	41
CCc1ccc([C@H](C)NC(=O)/C=C/c2ccc(O)cc2)cc1	ZINC000875246807	CH	On-Demand	Anodyne	SSSIM	15	46
C[C@H](NC(=O)N1C[C@@](C)(CO)[C@@](C)(CO)C1)c1csc2ccccc12	ZINC000875246809	FF	On-Demand	Anodyne	FFAR2	49	33
CCc1ccc([C@H](C)NC(=O)/C=C\c2ccc(O)cc2)cc1	ZINC000875246812	CH	On-Demand	Anodyne	KCNQ2	49	37
CCc1ccc([C@H](C)NC(=O)/C=C\c2ccc(O)cc2)cc1	ZINC000875246812	CH	On-Demand	Anodyne	HDAC8	17	45
CCc1ccc([C@H](C)NC(=O)/C=C\c2ccc(O)cc2)cc1	ZINC000875246812	CH	On-Demand	Anodyne	F3	19	41
CCc1ccc([C@H](C)NC(=O)/C=C\c2ccc(O)cc2)cc1	ZINC000875246812	CH	On-Demand	Anodyne	SSSIM	15	46
C[C@@H](NC(=O)N1C[C@@](C)(CO)[C@@](C)(CO)C1)c1csc2ccccc12	ZINC000875246814	FF	On-Demand	Anodyne	FFAR2	49	33
C[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)NCc1ccccc1	ZINC000875246818	HI	On-Demand	Anodyne	GPR142	40	38
C[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)NCc1ccccc1	ZINC000875246818	HI	On-Demand	Anodyne	PDS	49	37
CSCC[C@@H](C)NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875246866	GE	On-Demand	Anodyne	ETHR	56	48
CSCC[C@H](C)NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875246868	GE	On-Demand	Anodyne	ETHR	56	48
O=C(N[C@H]1CCCOC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875246920	DD	On-Demand	Anodyne	DRD4	28	42
O=C(N[C@H]1CCCOC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875246920	DD	On-Demand	Anodyne	ACHE	23	41
O=C(N[C@H]1CCCOC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875246920	DD	On-Demand	Anodyne	SIGMAR1	36	46
O=C(N[C@H]1CCCOC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875246920	DD	On-Demand	Anodyne	CCR3	26	47
O=C(N[C@H]1CCCOC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875246920	DD	On-Demand	Anodyne	EPHX2	15	42
O=C(N[C@H]1CCCOC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875246920	DD	On-Demand	Anodyne	MCHR1	16	44
O=C(N[C@@H]1CCCOC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875246921	DD	On-Demand	Anodyne	DRD4	28	42
O=C(N[C@@H]1CCCOC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875246921	DD	On-Demand	Anodyne	ACHE	23	41
O=C(N[C@@H]1CCCOC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875246921	DD	On-Demand	Anodyne	SIGMAR1	36	46
O=C(N[C@@H]1CCCOC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875246921	DD	On-Demand	Anodyne	CCR3	26	47
O=C(N[C@@H]1CCCOC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875246921	DD	On-Demand	Anodyne	EPHX2	15	42
O=C(N[C@@H]1CCCOC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875246921	DD	On-Demand	Anodyne	MCHR1	16	44
CC(=O)C1CCN(C(=O)NCCOc2ccc(S(C)(=O)=O)cc2)CC1	ZINC000875246956	FD	On-Demand	Anodyne	MMP13	54	39
CC(=O)C1CCN(C(=O)NCCOc2ccc(S(C)(=O)=O)cc2)CC1	ZINC000875246956	FD	On-Demand	Anodyne	EPHX2	16	47
CC(=O)C1CCN(C(=O)NCCOc2ccc(S(C)(=O)=O)cc2)CC1	ZINC000875246956	FD	On-Demand	Anodyne	GPR119	50	38
COC(=O)N(C)NC(=O)NCC(C)(C)c1ccc(OC)c(OC)c1	ZINC000875246965	ED	On-Demand	Reactive	MT-ND1	30	45
CSCC[C@@H](C)NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875246987	EE	On-Demand	Anodyne	OXTR	51	36
CSCC[C@@H](C)NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875246987	EE	On-Demand	Anodyne	GHRHR	49	42
CSCC[C@H](C)NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875246988	EE	On-Demand	Anodyne	OXTR	51	36
CSCC[C@H](C)NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875246988	EE	On-Demand	Anodyne	GHRHR	49	42
CSCC[C@@H](C)NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875246989	EE	On-Demand	Anodyne	OXTR	51	36
CSCC[C@@H](C)NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875246989	EE	On-Demand	Anodyne	GHRHR	49	42
CSCC[C@H](C)NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875246990	EE	On-Demand	Anodyne	OXTR	51	36
CSCC[C@H](C)NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875246990	EE	On-Demand	Anodyne	GHRHR	49	42
O=C(NCCO)C1CCN(C(=O)NCCOc2ccc(F)c(F)c2)CC1	ZINC000875247034	FC	On-Demand	Anodyne	EPHX2	19	49
CS(=O)(=O)Nc1ccc(/C=C\C(=O)OCc2ccc3c(c2)OCO3)cc1	ZINC000875247073	GF	On-Demand	Anodyne	GRIN1	15	48
CS(=O)(=O)Nc1ccc(/C=C\C(=O)OCc2ccc3c(c2)OCO3)cc1	ZINC000875247073	GF	On-Demand	Anodyne	BMP1	63	36
CS(=O)(=O)Nc1ccc(/C=C\C(=O)OCc2ccc3c(c2)OCO3)cc1	ZINC000875247073	GF	On-Demand	Anodyne	TRPV1	16	45
CS(=O)(=O)Nc1ccc(/C=C\C(=O)OCc2ccc3c(c2)OCO3)cc1	ZINC000875247073	GF	On-Demand	Anodyne	NR1H4	23	40
CS(=O)(=O)Nc1ccc(/C=C\C(=O)OCc2ccc3c(c2)OCO3)cc1	ZINC000875247073	GF	On-Demand	Anodyne	DYRK2	54	34
CS(=O)(=O)Nc1ccc(/C=C\C(=O)OCc2ccc3c(c2)OCO3)cc1	ZINC000875247073	GF	On-Demand	Anodyne	AKR1B10	15	40
CS(=O)(=O)Nc1ccc(/C=C/C(=O)OCc2ccc3c(c2)OCO3)cc1	ZINC000875247075	GF	On-Demand	Anodyne	GRIN1	15	48
CS(=O)(=O)Nc1ccc(/C=C/C(=O)OCc2ccc3c(c2)OCO3)cc1	ZINC000875247075	GF	On-Demand	Anodyne	BMP1	63	36
CS(=O)(=O)Nc1ccc(/C=C/C(=O)OCc2ccc3c(c2)OCO3)cc1	ZINC000875247075	GF	On-Demand	Anodyne	TRPV1	16	45
CS(=O)(=O)Nc1ccc(/C=C/C(=O)OCc2ccc3c(c2)OCO3)cc1	ZINC000875247075	GF	On-Demand	Anodyne	NR1H4	23	40
CS(=O)(=O)Nc1ccc(/C=C/C(=O)OCc2ccc3c(c2)OCO3)cc1	ZINC000875247075	GF	On-Demand	Anodyne	DYRK2	54	34
CS(=O)(=O)Nc1ccc(/C=C/C(=O)OCc2ccc3c(c2)OCO3)cc1	ZINC000875247075	GF	On-Demand	Anodyne	AKR1B10	15	40
C[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000875247092	JJ	On-Demand	Anodyne	EPHX2	74	41
O=CN1CCCN(C(=O)NCCOc2ccccc2C(F)(F)F)CC1	ZINC000875247109	FD	On-Demand	Anodyne	RBP4	83	38
COc1ccccc1[C@H]1CCCN(C(=O)NCCCN2C(=O)CCC2=O)CC1	ZINC000875247166	GF	On-Demand	Anodyne	HTR1A	47	44
COc1ccccc1[C@H]1CCCN(C(=O)NCCCN2C(=O)CCC2=O)CC1	ZINC000875247166	GF	On-Demand	Anodyne	DRD2	39	44
COc1ccccc1[C@H]1CCCN(C(=O)NCCCN2C(=O)CCC2=O)CC1	ZINC000875247166	GF	On-Demand	Anodyne	DRD4	18	43
COc1ccccc1[C@H]1CCCN(C(=O)NCCCN2C(=O)CCC2=O)CC1	ZINC000875247166	GF	On-Demand	Anodyne	ADRA1D	57	39
COc1ccccc1[C@H]1CCCN(C(=O)NCCCN2C(=O)CCC2=O)CC1	ZINC000875247166	GF	On-Demand	Anodyne	ADRA1A	55	42
COc1ccccc1[C@H]1CCCN(C(=O)NCCCN2C(=O)CCC2=O)CC1	ZINC000875247166	GF	On-Demand	Anodyne	ADRA1B	51	39
COc1ccccc1[C@H]1CCCN(C(=O)NCCCN2C(=O)CCC2=O)CC1	ZINC000875247166	GF	On-Demand	Anodyne	DRD3	40	37
COc1ccccc1[C@H]1CCCN(C(=O)NCCCN2C(=O)CCC2=O)CC1	ZINC000875247166	GF	On-Demand	Anodyne	HTR7	21	44
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCN2C(=O)CCC2=O)CC1	ZINC000875247169	GF	On-Demand	Anodyne	HTR1A	47	44
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCN2C(=O)CCC2=O)CC1	ZINC000875247169	GF	On-Demand	Anodyne	DRD2	39	44
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCN2C(=O)CCC2=O)CC1	ZINC000875247169	GF	On-Demand	Anodyne	DRD4	18	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCN2C(=O)CCC2=O)CC1	ZINC000875247169	GF	On-Demand	Anodyne	ADRA1D	57	39
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCN2C(=O)CCC2=O)CC1	ZINC000875247169	GF	On-Demand	Anodyne	ADRA1A	55	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCN2C(=O)CCC2=O)CC1	ZINC000875247169	GF	On-Demand	Anodyne	ADRA1B	51	39
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCN2C(=O)CCC2=O)CC1	ZINC000875247169	GF	On-Demand	Anodyne	DRD3	40	37
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCN2C(=O)CCC2=O)CC1	ZINC000875247169	GF	On-Demand	Anodyne	HTR7	21	44
C=CCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875247198	FD	On-Demand	Mild	SIGMAR1	15	45
C=CCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875247198	FD	On-Demand	Mild	MCHR1	17	42
C=CCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875247201	FD	On-Demand	Mild	SIGMAR1	15	45
C=CCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875247201	FD	On-Demand	Mild	MCHR1	17	42
CC[C@H](C[C@H](C)O)NC(=O)NCCOc1ccc(F)c(F)c1	ZINC000875247217	DE	On-Demand	Anodyne	PDS	47	33
CCc1ccc([C@H](C)NC(=O)/C=C\c2nc3ccccc3s2)cc1	ZINC000875247263	EJ	On-Demand	Anodyne	KCNQ2	51	37
CCc1ccc([C@H](C)NC(=O)/C=C\c2nc3ccccc3s2)cc1	ZINC000875247263	EJ	On-Demand	Anodyne	UL26	75	35
CCc1ccc([C@H](C)NC(=O)/C=C\c2nc3ccccc3s2)cc1	ZINC000875247263	EJ	On-Demand	Anodyne	SCAF_EBVB9	66	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H]1CCO[C@H]1C)CC2	ZINC000875247310	FD	On-Demand	Anodyne	SLC18A2	40	33
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H]1CCO[C@H]1C)CC2	ZINC000875247314	FD	On-Demand	Anodyne	SLC18A2	40	33
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H]1CCO[C@@H]1C)CC2	ZINC000875247316	FD	On-Demand	Anodyne	SLC18A2	40	33
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H]1CCO[C@@H]1C)CC2	ZINC000875247318	FD	On-Demand	Anodyne	SLC18A2	40	33
CSCC[C@H](C)NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875247345	FD	On-Demand	Anodyne	ACE	40	40
CSCC[C@H](C)NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875247345	FD	On-Demand	Anodyne	FKBP1A	25	41
CSCC[C@H](C)NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875247345	FD	On-Demand	Anodyne	MME	15	40
O=C(NCCCN1C(=O)CCC1=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875247346	FD	On-Demand	Anodyne	HRH2	23	41
O=C(NCCCN1C(=O)CCC1=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875247346	FD	On-Demand	Anodyne	PTGER4	23	44
CSCC[C@H](C)NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875247348	FD	On-Demand	Anodyne	ACE	40	40
CSCC[C@H](C)NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875247348	FD	On-Demand	Anodyne	FKBP1A	25	41
CSCC[C@H](C)NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875247348	FD	On-Demand	Anodyne	MME	15	40
O=C(NCCCN1C(=O)CCC1=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875247349	FD	On-Demand	Anodyne	HRH2	23	41
O=C(NCCCN1C(=O)CCC1=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875247349	FD	On-Demand	Anodyne	PTGER4	23	44
CSCC[C@H](C)NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875247350	FD	On-Demand	Anodyne	ACE	40	40
CSCC[C@H](C)NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875247350	FD	On-Demand	Anodyne	FKBP1A	25	41
CSCC[C@H](C)NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875247350	FD	On-Demand	Anodyne	MME	15	40
CSCC[C@H](C)NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875247353	FD	On-Demand	Anodyne	ACE	40	40
CSCC[C@H](C)NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875247353	FD	On-Demand	Anodyne	FKBP1A	25	41
CSCC[C@H](C)NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875247353	FD	On-Demand	Anodyne	MME	15	40
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)c2ccccc2SCc2cscn2)c1	ZINC000875247387	JJ	On-Demand	Anodyne	GPR142	39	43
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)c2ccccc2SCc2cscn2)c1	ZINC000875247387	JJ	On-Demand	Anodyne	KCNK3	46	33
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)c2ccccc2SCc2cscn2)c1	ZINC000875247387	JJ	On-Demand	Anodyne	KCNK9	40	33
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)c2ccccc2SCc2cscn2)c1	ZINC000875247399	JJ	On-Demand	Anodyne	GPR142	39	43
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)c2ccccc2SCc2cscn2)c1	ZINC000875247399	JJ	On-Demand	Anodyne	KCNK3	46	33
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)c2ccccc2SCc2cscn2)c1	ZINC000875247399	JJ	On-Demand	Anodyne	KCNK9	40	33
CN(C)C[C@@H]1CN(C(=O)NCc2ccc(C#N)cc2F)C[C@H]1CN(C)C	ZINC000875247432	FD	On-Demand	Mild	P2RX7	27	42
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCc1ccc(C#N)cc1F)CC2	ZINC000875247442	GH	On-Demand	Mild	SLC18A2	44	32
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCc1ccc(C#N)cc1F)CC2	ZINC000875247443	GH	On-Demand	Mild	SLC18A2	44	32
O=C(NCCC1CCC1)C(=O)NCc1ccnc(N2CCSCC2)c1	ZINC000875247553	FD	On-Demand	Anodyne	SIRT3	50	31
O=C(NCCC1CCC1)C(=O)NCc1ccnc(N2CCSCC2)c1	ZINC000875247553	FD	On-Demand	Anodyne	SIRT2	52	32
O=C(NCCC1CCC1)C(=O)NCc1ccnc(N2CCSCC2)c1	ZINC000875247553	FD	On-Demand	Anodyne	SIRT1	50	31
O=C(NCCC1CCC1)C(=O)NCc1ccnc(-c2ccccc2)c1	ZINC000875247575	EF	On-Demand	Anodyne	VCP	57	38
C=C(C)CN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875247576	GE	On-Demand	Mild	MCHR1	16	42
C=C(C)CN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875247587	GE	On-Demand	Mild	MCHR1	16	42
O=C(OCc1cnc(-c2ccccc2)s1)c1ccccc1SCc1cscn1	ZINC000875247604	HK	On-Demand	Anodyne	GPR142	47	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCCC2CCCC2)C1	ZINC000875247618	DE	On-Demand	Anodyne	BMP1	41	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCCC2CCCC2)C1	ZINC000875247621	DE	On-Demand	Anodyne	BMP1	41	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCOc1ccc(F)c(F)c1	ZINC000875247636	FE	On-Demand	Anodyne	SLC6A4	22	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCOc1ccc(F)c(F)c1	ZINC000875247636	FE	On-Demand	Anodyne	SLC6A3	42	40
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)c1ccccc1SCc1cscn1	ZINC000875247649	HE	On-Demand	Anodyne	CPT1A	70	37
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)c1ccccc1SCc1cscn1	ZINC000875247649	HE	On-Demand	Anodyne	CPT2	45	34
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)c1ccccc1SCc1cscn1	ZINC000875247649	HE	On-Demand	Anodyne	PREP	40	40
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)c1ccccc1SCc1cscn1	ZINC000875247651	HE	On-Demand	Anodyne	CPT1A	70	37
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)c1ccccc1SCc1cscn1	ZINC000875247651	HE	On-Demand	Anodyne	CPT2	45	34
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)c1ccccc1SCc1cscn1	ZINC000875247651	HE	On-Demand	Anodyne	PREP	40	40
C[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000875247675	JI	On-Demand	Anodyne	STAT6	59	36
CN1CCN(C2CCN(C(=O)C(=O)NCC3(C)CCCCCC3)CC2)CC1	ZINC000875247679	GD	On-Demand	Anodyne	L3MBTL3	46	40
O=C(NC1CC(Nc2ccccc2)C1)N[C@H]1CCCOC1	ZINC000875247761	CE	On-Demand	Anodyne	EPHX2	18	47
O=C(NC1CC(Nc2ccccc2)C1)N[C@@H]1CCCOC1	ZINC000875247763	CE	On-Demand	Anodyne	EPHX2	18	47
COc1ccc(NC(=O)[C@H](C)OC(=O)c2ccccc2SCc2cscn2)c(OC)c1	ZINC000875247774	JJ	On-Demand	Anodyne	GPR142	30	40
CSCC[C@@H](C)NC(=O)C(=O)N[C@@H](CCc1ccccc1)c1ccccn1	ZINC000875247807	GG	On-Demand	Anodyne	MME	24	44
CSCC[C@H](C)NC(=O)C(=O)N[C@@H](CCc1ccccc1)c1ccccn1	ZINC000875247810	GG	On-Demand	Anodyne	MME	24	44
CSCC[C@H](C)NC(=O)C(=O)N[C@H](CCc1ccccc1)c1ccccn1	ZINC000875247813	GG	On-Demand	Anodyne	MME	24	44
CSCC[C@@H](C)NC(=O)C(=O)N[C@H](CCc1ccccc1)c1ccccn1	ZINC000875247815	GG	On-Demand	Anodyne	MME	24	44
CSCC[C@H](C)NC(=O)C(=O)N[C@@H]1CC[C@@H](NC(=O)OC(C)(C)C)CC1	ZINC000875247817	GE	On-Demand	Anodyne	CTSK	15	50
Cn1nccc1C(NC(=O)C(=O)NCCCCC1CCCC1)c1ccnn1C	ZINC000875247819	GD	On-Demand	Anodyne	BMP1	78	37
CSCC[C@@H](C)NC(=O)C(=O)N[C@@H]1CC[C@@H](NC(=O)OC(C)(C)C)CC1	ZINC000875247821	GE	On-Demand	Anodyne	CTSK	15	50
COc1ccc([N+](=O)[O-])cc1COC(=O)c1ccccc1SCc1cscn1	ZINC000875247822	HJ	On-Demand	Bother	CACNA1D	40	32
CC[C@@H](NC(=O)C(=O)NCC1(N(C)C)CCC1)c1cccc(OC)c1OC	ZINC000875247881	GD	On-Demand	Anodyne	SLC6A5	15	43
C[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000875247917	JG	On-Demand	Anodyne	CA2	17	43
C[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000875247917	JG	On-Demand	Anodyne	CA4	18	43
C[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000875247917	JG	On-Demand	Anodyne	GPR142	32	41
O=C(COC(=O)c1ccccc1SCc1cscn1)NCCc1nc2ccccc2s1	ZINC000875247923	JJ	On-Demand	Anodyne	TMPRSS6	48	31
O=C(NCCC1CCC1)C(=O)NCc1ccc2cccnc2c1	ZINC000875247938	DE	On-Demand	Anodyne	BMP1	57	38
O=C(NCCC1CCC1)C(=O)NCc1ccc2cccnc2c1	ZINC000875247938	DE	On-Demand	Anodyne	SIRT3	44	32
O=C(NCCC1CCC1)C(=O)NCc1ccc2cccnc2c1	ZINC000875247938	DE	On-Demand	Anodyne	SIRT2	46	32
O=C(NCCC1CCC1)C(=O)NCc1ccc2cccnc2c1	ZINC000875247938	DE	On-Demand	Anodyne	SIRT1	46	34
O=C(NCCC1CCC1)C(=O)NCc1ccc2cccnc2c1	ZINC000875247938	DE	On-Demand	Anodyne	SUCNR1	40	32
C[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000875247953	JK	On-Demand	Anodyne	KCNQ2	19	45
C=C(C)CN1CCC(NC(=O)N(Cc2ccccc2)[C@H](CC)CO)CC1	ZINC000875247957	FG	On-Demand	Mild	SIGMAR1	19	41
CN1CCN(C(=O)NCCOc2ccc(S(C)(=O)=O)cc2)CCC1(C)C	ZINC000875248077	GD	On-Demand	Anodyne	MMP13	38	42
CN1CCN(C(=O)NCCOc2ccc(S(C)(=O)=O)cc2)CCC1(C)C	ZINC000875248077	GD	On-Demand	Anodyne	ADAM17	35	42
CN1CCN(C(=O)NCCOc2ccc(S(C)(=O)=O)cc2)CCC1(C)C	ZINC000875248077	GD	On-Demand	Anodyne	MMP9	21	42
C=C(C)CN1CCC(NC(=O)NNc2cccc(F)c2Cl)CC1	ZINC000875248086	EG	On-Demand	Reactive	SIGMAR1	15	42
C[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000875248126	JK	On-Demand	Mild	VIPR1	27	43
Cn1nccc1C(NC(=O)C(=O)NCC1(C)CCCCCC1)c1ccnn1C	ZINC000875248276	GD	On-Demand	Anodyne	HCN1	48	30
Cn1nccc1C(NC(=O)C(=O)NCC1(C)CCCCCC1)c1ccnn1C	ZINC000875248276	GD	On-Demand	Anodyne	HCN4	46	30
O=C(COC(=O)c1ccccc1SCc1cscn1)Nc1ccccc1N1CCCC1=O	ZINC000875248304	JI	On-Demand	Anodyne	KCNQ2	40	31
O=C(NCCC1CCC1)C(=O)NCc1ccc(OC(F)F)cc1F	ZINC000875248317	EE	On-Demand	Anodyne	TRPV1	57	38
CS(=O)(=O)c1ccc(OCCNC(=O)NC[C@@H]2CCC23CCOCC3)cc1	ZINC000875248339	GD	On-Demand	Anodyne	MMP13	39	42
C[C@H](OC(=O)/C=C/c1ccc(NS(C)(=O)=O)cc1)C(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000875248340	IG	On-Demand	Anodyne	EPHX2	39	41
CS(=O)(=O)c1ccc(OCCNC(=O)NC[C@H]2CCC23CCOCC3)cc1	ZINC000875248341	GD	On-Demand	Anodyne	MMP13	39	42
C[C@@H](OC(=O)/C=C/c1ccc(NS(C)(=O)=O)cc1)C(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000875248343	IG	On-Demand	Anodyne	EPHX2	39	41
C[C@@H](OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1)C(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000875248347	IG	On-Demand	Anodyne	EPHX2	39	41
C[C@H](OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1)C(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000875248350	IG	On-Demand	Anodyne	EPHX2	39	41
O=C(NCCC1CCC1)C(=O)NCc1cccc2ncccc12	ZINC000875248400	DE	On-Demand	Anodyne	CDK5	20	41
O=C(NCCC1CCC1)C(=O)NCc1cccc2ncccc12	ZINC000875248400	DE	On-Demand	Anodyne	SIRT3	41	32
O=C(NCCC1CCC1)C(=O)NCc1cccc2ncccc12	ZINC000875248400	DE	On-Demand	Anodyne	SIRT2	45	32
O=C(NCCC1CCC1)C(=O)NCc1cccc2ncccc12	ZINC000875248400	DE	On-Demand	Anodyne	SIRT1	41	33
C=CCN1CCC(NC(=O)N[C@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000875248428	EE	On-Demand	Mild	CCR5	20	42
C=CCN1CCC(NC(=O)N[C@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000875248428	EE	On-Demand	Mild	XIAP	40	35
COc1ccc(NC(=O)[C@H](C)OC(=O)c2ccccc2SCc2cscn2)cc1OC	ZINC000875248429	JJ	On-Demand	Anodyne	GRM4	16	44
COc1ccc(NC(=O)[C@H](C)OC(=O)c2ccccc2SCc2cscn2)cc1OC	ZINC000875248429	JJ	On-Demand	Anodyne	ENPP1	75	36
COc1ccc(NC(=O)[C@H](C)OC(=O)c2ccccc2SCc2cscn2)cc1OC	ZINC000875248429	JJ	On-Demand	Anodyne	GPR142	36	46
C=CCN1CCC(NC(=O)N[C@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000875248430	EE	On-Demand	Mild	CCR5	20	42
C=CCN1CCC(NC(=O)N[C@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000875248430	EE	On-Demand	Mild	XIAP	40	35
C=CCN1CCC(NC(=O)N[C@@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000875248432	EE	On-Demand	Mild	CCR5	20	42
C=CCN1CCC(NC(=O)N[C@@H](CC)[C@@H](O)c2ccccc2)CC1	ZINC000875248432	EE	On-Demand	Mild	XIAP	40	35
C=CCN1CCC(NC(=O)N[C@@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000875248434	EE	On-Demand	Mild	CCR5	20	42
C=CCN1CCC(NC(=O)N[C@@H](CC)[C@H](O)c2ccccc2)CC1	ZINC000875248434	EE	On-Demand	Mild	XIAP	40	35
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCC3CCC3)C2)cc1	ZINC000875248437	ED	On-Demand	Anodyne	DRD2	19	51
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCC3CCC3)C2)cc1	ZINC000875248437	ED	On-Demand	Anodyne	DRD4	37	51
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCC3CCC3)C2)cc1	ZINC000875248437	ED	On-Demand	Anodyne	ACHE	32	53
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCC3CCC3)C2)cc1	ZINC000875248437	ED	On-Demand	Anodyne	DRD3	17	40
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCC3CCC3)C2)cc1	ZINC000875248437	ED	On-Demand	Anodyne	CHRM3	15	47
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCC3CCC3)C2)cc1	ZINC000875248437	ED	On-Demand	Anodyne	SIGMAR1	26	43
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCC3CCC3)C2)cc1	ZINC000875248437	ED	On-Demand	Anodyne	SSTR5	43	36
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCC3CCC3)C2)cc1	ZINC000875248437	ED	On-Demand	Anodyne	CCR3	41	42
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCC3CCC3)C2)cc1	ZINC000875248437	ED	On-Demand	Anodyne	UTS2R	23	42
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCC3CCC3)C2)cc1	ZINC000875248437	ED	On-Demand	Anodyne	CCR2	23	49
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCC3CCC3)C2)cc1	ZINC000875248437	ED	On-Demand	Anodyne	MCHR1	40	46
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCC3CCC3)C2)cc1	ZINC000875248437	ED	On-Demand	Anodyne	CACNA1I	25	43
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCC3CCC3)C2)cc1	ZINC000875248437	ED	On-Demand	Anodyne	BIRC2	44	40
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCC3CCC3)C2)cc1	ZINC000875248439	ED	On-Demand	Anodyne	DRD2	19	51
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCC3CCC3)C2)cc1	ZINC000875248439	ED	On-Demand	Anodyne	DRD4	37	51
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCC3CCC3)C2)cc1	ZINC000875248439	ED	On-Demand	Anodyne	ACHE	32	53
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCC3CCC3)C2)cc1	ZINC000875248439	ED	On-Demand	Anodyne	DRD3	17	40
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCC3CCC3)C2)cc1	ZINC000875248439	ED	On-Demand	Anodyne	CHRM3	15	47
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCC3CCC3)C2)cc1	ZINC000875248439	ED	On-Demand	Anodyne	SIGMAR1	26	43
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCC3CCC3)C2)cc1	ZINC000875248439	ED	On-Demand	Anodyne	SSTR5	43	36
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCC3CCC3)C2)cc1	ZINC000875248439	ED	On-Demand	Anodyne	CCR3	41	42
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCC3CCC3)C2)cc1	ZINC000875248439	ED	On-Demand	Anodyne	UTS2R	23	42
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCC3CCC3)C2)cc1	ZINC000875248439	ED	On-Demand	Anodyne	CCR2	23	49
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCC3CCC3)C2)cc1	ZINC000875248439	ED	On-Demand	Anodyne	MCHR1	40	46
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCC3CCC3)C2)cc1	ZINC000875248439	ED	On-Demand	Anodyne	CACNA1I	25	43
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCC3CCC3)C2)cc1	ZINC000875248439	ED	On-Demand	Anodyne	BIRC2	44	40
O=C(NCCC1CCC1)C(=O)NC[C@H]1CN(Cc2ccncc2)CCO1	ZINC000875248442	FC	On-Demand	Anodyne	ACHE	15	47
O=C(NCCC1CCC1)C(=O)NC[C@@H]1CN(Cc2ccncc2)CCO1	ZINC000875248445	FC	On-Demand	Anodyne	ACHE	15	47
C[C@H](OC(=O)/C=C/c1ccc(NS(C)(=O)=O)cc1)C(=O)NCCc1ccc(F)cc1	ZINC000875248474	IF	On-Demand	Anodyne	GRIN1	22	48
C[C@H](OC(=O)/C=C/c1ccc(NS(C)(=O)=O)cc1)C(=O)NCCc1ccc(F)cc1	ZINC000875248474	IF	On-Demand	Anodyne	TRPV1	29	41
C[C@@H](OC(=O)/C=C/c1ccc(NS(C)(=O)=O)cc1)C(=O)NCCc1ccc(F)cc1	ZINC000875248476	IF	On-Demand	Anodyne	GRIN1	22	48
C[C@@H](OC(=O)/C=C/c1ccc(NS(C)(=O)=O)cc1)C(=O)NCCc1ccc(F)cc1	ZINC000875248476	IF	On-Demand	Anodyne	TRPV1	29	41
CC(=O)[C@H]1CCCN(C(=O)NCCOc2ccc(S(C)(=O)=O)cc2)C1	ZINC000875248478	FD	On-Demand	Anodyne	MMP13	44	40
C[C@@H](OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1)C(=O)NCCc1ccc(F)cc1	ZINC000875248479	IF	On-Demand	Anodyne	GRIN1	22	48
C[C@@H](OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1)C(=O)NCCc1ccc(F)cc1	ZINC000875248479	IF	On-Demand	Anodyne	TRPV1	29	41
CC(=O)[C@@H]1CCCN(C(=O)NCCOc2ccc(S(C)(=O)=O)cc2)C1	ZINC000875248482	FD	On-Demand	Anodyne	MMP13	44	40
C[C@H](OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1)C(=O)NCCc1ccc(F)cc1	ZINC000875248484	IF	On-Demand	Anodyne	GRIN1	22	48
C[C@H](OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1)C(=O)NCCc1ccc(F)cc1	ZINC000875248484	IF	On-Demand	Anodyne	TRPV1	29	41
C[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)Nc1cccc(C#N)c1	ZINC000875248502	HI	On-Demand	Mild	GPR142	30	40
C[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)Nc1ccc(N2CCCCC2)cc1	ZINC000875248514	JK	On-Demand	Anodyne	KCNQ2	19	44
C=CCN1CCC(NC(=O)NC2CC(C(=O)OC)C2)CC1	ZINC000875248553	CC	On-Demand	Mild	EPHX2	16	41
C[C@H](NC(=O)C(=O)NC[C@@H]1CC[C@@H](C)C1)c1ccc(C(F)(F)F)nc1	ZINC000875248587	FF	On-Demand	Anodyne	TRPV1	56	40
C[C@H]1CC[C@@H](CNC(=O)C(=O)N[C@H](C)c2ccc(C(F)(F)F)nc2)C1	ZINC000875248589	FF	On-Demand	Anodyne	TRPV1	56	40
C[C@H]1CC[C@@H](CNC(=O)C(=O)N[C@@H](C)c2ccc(C(F)(F)F)nc2)C1	ZINC000875248590	FF	On-Demand	Anodyne	TRPV1	56	40
C[C@H]1CC[C@H](CNC(=O)C(=O)N[C@@H](C)c2ccc(C(F)(F)F)nc2)C1	ZINC000875248591	FF	On-Demand	Anodyne	TRPV1	56	40
C[C@H]1CC[C@H](CNC(=O)C(=O)N[C@H](C)c2ccc(C(F)(F)F)nc2)C1	ZINC000875248592	FF	On-Demand	Anodyne	TRPV1	56	40
C[C@H](NC(=O)C(=O)NC[C@H]1CC[C@@H](C)C1)c1ccc(C(F)(F)F)nc1	ZINC000875248594	FF	On-Demand	Anodyne	TRPV1	56	40
CCCCCCCNC(=O)C(=O)N[C@@H]1CCCn2ncnc21	ZINC000875248599	DD	On-Demand	Mild	ASAH1	79	35
CCCCCCCNC(=O)C(=O)N[C@H]1CCCn2ncnc21	ZINC000875248600	DD	On-Demand	Mild	ASAH1	79	35
CC[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)NCc1ccccc1	ZINC000875248619	IJ	On-Demand	Anodyne	PDS	55	40
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCCOC1	ZINC000875248673	EG	On-Demand	Reactive	LTA4H	46	45
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCCOC1	ZINC000875248673	EG	On-Demand	Reactive	ADAM17	20	48
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCCOC1	ZINC000875248673	EG	On-Demand	Reactive	FAAH	26	40
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCCOC1	ZINC000875248673	EG	On-Demand	Reactive	SLC6A5	32	41
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCCOC1	ZINC000875248673	EG	On-Demand	Reactive	EPHX2	24	46
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCCOC1	ZINC000875248673	EG	On-Demand	Reactive	NAAA	19	46
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCCOC1	ZINC000875248673	EG	On-Demand	Reactive	FFAR1	29	42
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCCOC1	ZINC000875248674	EG	On-Demand	Reactive	LTA4H	46	45
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCCOC1	ZINC000875248674	EG	On-Demand	Reactive	ADAM17	20	48
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCCOC1	ZINC000875248674	EG	On-Demand	Reactive	FAAH	26	40
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCCOC1	ZINC000875248674	EG	On-Demand	Reactive	SLC6A5	32	41
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCCOC1	ZINC000875248674	EG	On-Demand	Reactive	EPHX2	24	46
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCCOC1	ZINC000875248674	EG	On-Demand	Reactive	NAAA	19	46
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCCOC1	ZINC000875248674	EG	On-Demand	Reactive	FFAR1	29	42
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)CCSC	ZINC000875248692	EF	On-Demand	Anodyne	ACE	45	52
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)CCSC	ZINC000875248692	EF	On-Demand	Anodyne	MME	70	52
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)CCSC	ZINC000875248692	EF	On-Demand	Anodyne	ANPEP	43	40
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)CCSC	ZINC000875248692	EF	On-Demand	Anodyne	CTSL	18	40
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)CCSC	ZINC000875248692	EF	On-Demand	Anodyne	MMP3	46	38
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)CCSC	ZINC000875248692	EF	On-Demand	Anodyne	CAPN1	39	40
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)CCSC	ZINC000875248692	EF	On-Demand	Anodyne	CAPN2	70	35
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)CCSC	ZINC000875248692	EF	On-Demand	Anodyne	ACE2	53	36
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)CCSC	ZINC000875248692	EF	On-Demand	Anodyne	CTSC	19	43
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)CCSC	ZINC000875248692	EF	On-Demand	Anodyne	FPR1	41	42
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)CCSC	ZINC000875248693	EF	On-Demand	Anodyne	ACE	45	52
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)CCSC	ZINC000875248693	EF	On-Demand	Anodyne	MME	70	52
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)CCSC	ZINC000875248693	EF	On-Demand	Anodyne	ANPEP	43	40
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)CCSC	ZINC000875248693	EF	On-Demand	Anodyne	CTSL	18	40
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)CCSC	ZINC000875248693	EF	On-Demand	Anodyne	MMP3	46	38
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)CCSC	ZINC000875248693	EF	On-Demand	Anodyne	CAPN1	39	40
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)CCSC	ZINC000875248693	EF	On-Demand	Anodyne	CAPN2	70	35
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)CCSC	ZINC000875248693	EF	On-Demand	Anodyne	ACE2	53	36
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)CCSC	ZINC000875248693	EF	On-Demand	Anodyne	CTSC	19	43
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)CCSC	ZINC000875248693	EF	On-Demand	Anodyne	FPR1	41	42
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)CCSC	ZINC000875248694	EF	On-Demand	Anodyne	ACE	45	52
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)CCSC	ZINC000875248694	EF	On-Demand	Anodyne	MME	70	52
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)CCSC	ZINC000875248694	EF	On-Demand	Anodyne	ANPEP	43	40
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)CCSC	ZINC000875248694	EF	On-Demand	Anodyne	CTSL	18	40
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)CCSC	ZINC000875248694	EF	On-Demand	Anodyne	MMP3	46	38
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)CCSC	ZINC000875248694	EF	On-Demand	Anodyne	CAPN1	39	40
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)CCSC	ZINC000875248694	EF	On-Demand	Anodyne	CAPN2	70	35
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)CCSC	ZINC000875248694	EF	On-Demand	Anodyne	ACE2	53	36
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)CCSC	ZINC000875248694	EF	On-Demand	Anodyne	CTSC	19	43
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)CCSC	ZINC000875248694	EF	On-Demand	Anodyne	FPR1	41	42
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)CCSC	ZINC000875248695	EF	On-Demand	Anodyne	ACE	45	52
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)CCSC	ZINC000875248695	EF	On-Demand	Anodyne	MME	70	52
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)CCSC	ZINC000875248695	EF	On-Demand	Anodyne	ANPEP	43	40
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)CCSC	ZINC000875248695	EF	On-Demand	Anodyne	CTSL	18	40
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)CCSC	ZINC000875248695	EF	On-Demand	Anodyne	MMP3	46	38
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)CCSC	ZINC000875248695	EF	On-Demand	Anodyne	CAPN1	39	40
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)CCSC	ZINC000875248695	EF	On-Demand	Anodyne	CAPN2	70	35
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)CCSC	ZINC000875248695	EF	On-Demand	Anodyne	ACE2	53	36
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)CCSC	ZINC000875248695	EF	On-Demand	Anodyne	CTSC	19	43
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)CCSC	ZINC000875248695	EF	On-Demand	Anodyne	FPR1	41	42
C#C[C@@H]1CC[C@@H](NC(=O)NCCOc2ccc(S(C)(=O)=O)cc2)CC1	ZINC000875248727	FD	On-Demand	Mild	HRH2	17	42
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)N[C@@H]3CCO[C@H]3C)C2)c1	ZINC000875248755	GC	On-Demand	Anodyne	DRD4	30	40
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)N[C@H]3CCO[C@H]3C)C2)c1	ZINC000875248756	GC	On-Demand	Anodyne	DRD4	30	40
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)N[C@@H]3CCO[C@@H]3C)C2)c1	ZINC000875248757	GC	On-Demand	Anodyne	DRD4	30	40
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)N[C@H]3CCO[C@@H]3C)C2)c1	ZINC000875248758	GC	On-Demand	Anodyne	DRD4	30	40
O=C(NCCC1CCC1)C(=O)NCc1ncc(Cl)s1	ZINC000875248759	DD	On-Demand	Anodyne	SIRT2	44	32
O=C(NCCC1CCC1)C(=O)NCc1ncc(Cl)s1	ZINC000875248759	DD	On-Demand	Anodyne	SIRT1	41	32
COCCN(CC1CCN(C)CC1)C(=O)NCCOc1ccc(F)c(F)c1	ZINC000875248771	GE	On-Demand	Anodyne	CHRNA10	40	44
COCCN(CC1CCN(C)CC1)C(=O)NCCOc1ccc(F)c(F)c1	ZINC000875248771	GE	On-Demand	Anodyne	ACKR3	50	31
O=C(NCCOc1ccccc1C(F)(F)F)NC[C@H]1C[C@H](O)C1	ZINC000875248776	EE	On-Demand	Anodyne	RBP4	46	38
O=C(OCc1ccc2ccccc2n1)c1ccccc1SCc1cscn1	ZINC000875248837	GK	On-Demand	Anodyne	CYSLTR1	71	40
C=CCN1CCC(NC(=O)N2C[C@@H]3C[C@H]2CN3c2ccccc2)CC1	ZINC000875248842	EE	On-Demand	Mild	DRD4	15	40
C=CCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(Cl)cc2)CC1	ZINC000875248875	FF	On-Demand	Mild	MCHR1	18	40
C=CCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(Cl)cc2)CC1	ZINC000875248877	FF	On-Demand	Mild	MCHR1	18	40
CCSCC[C@@H](C)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875248897	GE	On-Demand	Anodyne	ROCK1	23	40
CCSCC[C@@H](C)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875248897	GE	On-Demand	Anodyne	ROCK2	15	40
CCSCC[C@H](C)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875248900	GE	On-Demand	Anodyne	ROCK1	23	40
CCSCC[C@H](C)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875248900	GE	On-Demand	Anodyne	ROCK2	15	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC(C)(C)c1ccc(OC)c(OC)c1	ZINC000875248921	GF	On-Demand	Anodyne	SLC6A4	18	42
C[C@H](NC(=O)Nc1cnn(C2CCN(C)CC2)c1)c1csc2ccccc12	ZINC000875248975	GI	On-Demand	Anodyne	MAP3K7	18	40
COC(=O)c1sccc1NC(=O)COC(=O)c1ccccc1SCc1cscn1	ZINC000875249066	II	On-Demand	Anodyne	FAS	64	48
O=C(COC(=O)c1ccccc1SCc1cscn1)NCC1(c2ccccc2)CC1	ZINC000875249067	II	On-Demand	Anodyne	KCNA3	41	35
C=CCN1CCC(NC(=O)N2CCC[C@@H](c3ccccc3OC)CC2)CC1	ZINC000875249077	FH	On-Demand	Mild	DRD2	17	46
C=CCN1CCC(NC(=O)N2CCC[C@@H](c3ccccc3OC)CC2)CC1	ZINC000875249077	FH	On-Demand	Mild	DRD4	18	45
C=CCN1CCC(NC(=O)N2CCC[C@H](c3ccccc3OC)CC2)CC1	ZINC000875249078	FH	On-Demand	Mild	DRD2	17	46
C=CCN1CCC(NC(=O)N2CCC[C@H](c3ccccc3OC)CC2)CC1	ZINC000875249078	FH	On-Demand	Mild	DRD4	18	45
C=CCN1CCC(NC(=O)NC[C@H]2CN(Cc3ccccc3C)CCO2)CC1	ZINC000875249113	GE	On-Demand	Mild	DRD4	21	46
C=CCN1CCC(NC(=O)NC[C@@H]2CN(Cc3ccccc3C)CCO2)CC1	ZINC000875249114	GE	On-Demand	Mild	DRD4	21	46
C=CCN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875249118	EF	On-Demand	Mild	DRD4	18	53
C=CCN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875249118	EF	On-Demand	Mild	LTA4H	20	42
C=CCN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875249118	EF	On-Demand	Mild	SIGMAR1	24	45
C=CCN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875249118	EF	On-Demand	Mild	EPHX2	33	45
C=CCN1CCC(NC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875249121	FG	On-Demand	Mild	MCHR1	38	47
C=CCN1CCC(NC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875249122	FG	On-Demand	Mild	MCHR1	38	47
Cc1nnc(NNC(=O)NCCOc2ccccc2C(F)(F)F)n1C	ZINC000875249123	FD	On-Demand	Reactive	RBP4	15	41
COc1ccc(N2CCN(C(=O)C(=O)NCCOC(C)C)CC2)c(OC)c1	ZINC000875249141	GC	On-Demand	Clean	HTR1A	41	41
COc1ccc(N2CCN(C(=O)C(=O)NCCOC(C)C)CC2)c(OC)c1	ZINC000875249141	GC	On-Demand	Clean	DRD2	39	43
COc1ccc(N2CCN(C(=O)C(=O)NCCOC(C)C)CC2)c(OC)c1	ZINC000875249141	GC	On-Demand	Clean	DRD4	44	35
COc1ccc(N2CCN(C(=O)C(=O)NCCOC(C)C)CC2)c(OC)c1	ZINC000875249141	GC	On-Demand	Clean	DRD3	56	39
COc1ccc(N2CCN(C(=O)C(=O)NCCOC(C)C)CC2)c(OC)c1	ZINC000875249141	GC	On-Demand	Clean	PDGFRB	42	38
C=CCN1CCC(NC(=O)N(CC)[C@H](C)[C@H](O)c2ccccc2)CC1	ZINC000875249155	EF	On-Demand	Mild	OPRD1	15	46
C=CCN1CCC(NC(=O)N(CC)[C@@H](C)[C@H](O)c2ccccc2)CC1	ZINC000875249156	EF	On-Demand	Mild	OPRD1	15	46
C=CCN1CCC(NC(=O)N(CC)[C@@H](C)[C@@H](O)c2ccccc2)CC1	ZINC000875249157	EF	On-Demand	Mild	OPRD1	15	46
C=CCN1CCC(NC(=O)N(CC)[C@H](C)[C@@H](O)c2ccccc2)CC1	ZINC000875249158	EF	On-Demand	Mild	OPRD1	15	46
C=CCN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875249171	FE	On-Demand	Mild	DRD4	17	44
C=CCN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875249171	FE	On-Demand	Mild	SIGMAR1	17	49
C=CCN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875249171	FE	On-Demand	Mild	EPHX2	15	42
C=CCN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875249171	FE	On-Demand	Mild	MCHR1	20	43
C=CCN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875249172	FE	On-Demand	Mild	DRD4	17	44
C=CCN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875249172	FE	On-Demand	Mild	SIGMAR1	17	49
C=CCN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875249172	FE	On-Demand	Mild	EPHX2	15	42
C=CCN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875249172	FE	On-Demand	Mild	MCHR1	20	43
COC(=O)N(C)NC(=O)NCCOc1ccccc1C(F)(F)F	ZINC000875249173	ED	On-Demand	Reactive	RBP4	17	47
C[C@H](NC(=O)C(=O)NCCC1CCC1)c1ccc(C(F)(F)F)nc1	ZINC000875249192	EF	On-Demand	Anodyne	TRPV1	82	40
C=C(C)CN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875249198	FF	On-Demand	Mild	DRD4	21	43
C=C(C)CN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875249198	FF	On-Demand	Mild	SIGMAR1	17	48
C=C(C)CN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875249198	FF	On-Demand	Mild	EPHX2	20	43
C=C(C)CN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875249198	FF	On-Demand	Mild	CXCR3	15	41
C=C(C)CN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875249199	FF	On-Demand	Mild	DRD4	21	43
C=C(C)CN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875249199	FF	On-Demand	Mild	SIGMAR1	17	48
C=C(C)CN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875249199	FF	On-Demand	Mild	EPHX2	20	43
C=C(C)CN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875249199	FF	On-Demand	Mild	CXCR3	15	41
C=C(C)CN1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875249207	GF	On-Demand	Mild	CCR3	27	40
C=C(C)CN1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875249207	GF	On-Demand	Mild	ITK	15	46
C=C(C)CN1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875249207	GF	On-Demand	Mild	MCHR1	18	44
C=C(C)CN1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875249207	GF	On-Demand	Mild	PANC	49	36
NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)COC(=O)c1ccccc1SCc1cscn1	ZINC000875249226	JF	On-Demand	Anodyne	EIF2AK3	41	32
C[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)Nc1cccc(Br)c1	ZINC000875249244	JK	On-Demand	Anodyne	GPR142	35	41
CS(=O)(=O)c1ccc(OCCNC(=O)NC2([C@@H]3CCCCO3)CCC2)cc1	ZINC000875249250	GE	On-Demand	Anodyne	MMP13	16	41
CS(=O)(=O)c1ccc(OCCNC(=O)NC2([C@H]3CCCCO3)CCC2)cc1	ZINC000875249251	GE	On-Demand	Anodyne	MMP13	16	41
C=C(C)CN1CCC(NC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875249256	GH	On-Demand	Mild	MCHR1	38	46
C=C(C)CN1CCC(NC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875249257	GH	On-Demand	Mild	MCHR1	38	46
CN1CCN(C2CCN(C(=O)C(=O)NCC3(N(C)C)CCC3)CC2)CC1	ZINC000875249266	FB	On-Demand	Anodyne	L3MBTL3	62	42
CN1CCN(C2CCN(C(=O)C(=O)NCCCCC3CCCC3)CC2)CC1	ZINC000875249271	GD	On-Demand	Anodyne	L3MBTL3	42	39
CN1CC[C@H]2CN(C(=O)NCCOc3ccc(S(C)(=O)=O)cc3)CC[C@H]21	ZINC000875249279	GD	On-Demand	Anodyne	MMP13	40	38
CN1CC[C@H]2CN(C(=O)NCCOc3ccc(S(C)(=O)=O)cc3)CC[C@H]21	ZINC000875249279	GD	On-Demand	Anodyne	GPR119	48	38
CN1CC[C@H]2CN(C(=O)NCCOc3ccc(S(C)(=O)=O)cc3)CC[C@@H]21	ZINC000875249281	GD	On-Demand	Anodyne	MMP13	40	38
CN1CC[C@H]2CN(C(=O)NCCOc3ccc(S(C)(=O)=O)cc3)CC[C@@H]21	ZINC000875249281	GD	On-Demand	Anodyne	GPR119	48	38
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCCn2ncnc21	ZINC000875249300	FE	On-Demand	Anodyne	FKBP1A	28	42
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCCn2ncnc21	ZINC000875249300	FE	On-Demand	Anodyne	PREP	47	34
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCCn2ncnc21	ZINC000875249301	FE	On-Demand	Anodyne	FKBP1A	28	42
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCCn2ncnc21	ZINC000875249301	FE	On-Demand	Anodyne	PREP	47	34
O=C(OCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1SCc1cscn1	ZINC000875249302	JH	On-Demand	Bother	SSTR1	34	44
Cc1cccc(NC(=O)[C@H](C)OC(=O)c2ccccc2SCc2cscn2)c1	ZINC000875249323	HJ	On-Demand	Anodyne	GPR142	35	42
Cc1cccc(NC(=O)[C@H](C)OC(=O)c2ccccc2SCc2cscn2)c1	ZINC000875249323	HJ	On-Demand	Anodyne	KCNK3	56	35
Cc1cccc(NC(=O)[C@H](C)OC(=O)c2ccccc2SCc2cscn2)c1	ZINC000875249323	HJ	On-Demand	Anodyne	KCNK9	53	35
C[C@H](OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1)C(=O)N(C)Cc1ccccc1	ZINC000875249324	HF	On-Demand	Anodyne	NR1H4	32	43
C[C@H](OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1)C(=O)N(C)Cc1ccccc1	ZINC000875249324	HF	On-Demand	Anodyne	LIMK2	28	40
C[C@@H](OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1)C(=O)N(C)Cc1ccccc1	ZINC000875249325	HF	On-Demand	Anodyne	NR1H4	32	43
C[C@@H](OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1)C(=O)N(C)Cc1ccccc1	ZINC000875249325	HF	On-Demand	Anodyne	LIMK2	28	40
Cc1cccc(NC(=O)[C@@H](C)OC(=O)c2ccccc2SCc2cscn2)c1	ZINC000875249327	HJ	On-Demand	Anodyne	GPR142	35	42
Cc1cccc(NC(=O)[C@@H](C)OC(=O)c2ccccc2SCc2cscn2)c1	ZINC000875249327	HJ	On-Demand	Anodyne	KCNK3	56	35
Cc1cccc(NC(=O)[C@@H](C)OC(=O)c2ccccc2SCc2cscn2)c1	ZINC000875249327	HJ	On-Demand	Anodyne	KCNK9	53	35
C[C@@H](NC(=O)N1CCc2nc(C3CC3)ncc2C1)c1csc2ccccc12	ZINC000875249344	GI	On-Demand	Anodyne	MAPK1	50	36
C[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000875249356	JJ	On-Demand	Anodyne	DRD4	29	43
C[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000875249356	JJ	On-Demand	Anodyne	SIGMAR1	30	45
C[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000875249356	JJ	On-Demand	Anodyne	SSTR5	48	36
C[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000875249356	JJ	On-Demand	Anodyne	CCR3	18	43
C[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000875249356	JJ	On-Demand	Anodyne	SCN5A	41	38
C[C@H](OC(=O)c1ccccc1SCc1cscn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000875249356	JJ	On-Demand	Anodyne	MCHR1	29	41
COC(=O)C1(O)CN(C(=O)NCCOc2ccccc2C(F)(F)F)C1	ZINC000875249358	FD	On-Demand	Anodyne	RBP4	68	38
C=CCN1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(OC)c(OC)c2)CC1	ZINC000875249365	GD	On-Demand	Mild	SSTR5	50	37
C=CCN1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(OC)c(OC)c2)CC1	ZINC000875249367	GD	On-Demand	Mild	SSTR5	50	37
C=CCN1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875249373	FF	On-Demand	Mild	CCR3	26	41
C=CCN1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875249373	FF	On-Demand	Mild	MCHR1	18	45
C=CCN1CCC(NC(=O)NNc2cccc(F)c2Cl)CC1	ZINC000875249404	EF	On-Demand	Reactive	SIGMAR1	15	43
COC(=O)N(C)NC(=O)NCCOc1ccc(F)c(F)c1	ZINC000875249409	DD	On-Demand	Reactive	MTNR1B	21	40
O=C(NCCCCC1CCCC1)C(=O)NCc1ncc(Cl)s1	ZINC000875249427	EF	On-Demand	Anodyne	BMP1	46	33
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1csc2ccccc12	ZINC000875249430	EF	On-Demand	Anodyne	FFAR2	59	34
CCCCCCCNC(=O)C(=O)NCC1(N(C)C)CCC1	ZINC000875249446	CD	On-Demand	Mild	ASAH1	79	33
CCc1ccc([C@H](C)NC(=O)COC(=O)c2ccccc2SCc2cscn2)cc1	ZINC000875249455	IK	On-Demand	Anodyne	BMP1	16	40
C[C@H](NC(=O)NCCCN1CCC[C@H]1C(N)=O)c1csc2ccccc12	ZINC000875249503	FF	On-Demand	Anodyne	TRY1_BOVIN	49	36
C[C@@H](NC(=O)NCCCN1CCC[C@H]1C(N)=O)c1csc2ccccc12	ZINC000875249504	FF	On-Demand	Anodyne	TRY1_BOVIN	49	36
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875249550	FE	On-Demand	Anodyne	DRD4	27	40
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875249550	FE	On-Demand	Anodyne	SIGMAR1	40	38
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875249551	FE	On-Demand	Anodyne	DRD4	27	40
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875249551	FE	On-Demand	Anodyne	SIGMAR1	40	38
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875249552	FE	On-Demand	Anodyne	DRD4	27	40
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875249552	FE	On-Demand	Anodyne	SIGMAR1	40	38
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875249553	FE	On-Demand	Anodyne	DRD4	27	40
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875249553	FE	On-Demand	Anodyne	SIGMAR1	40	38
COC(=O)C1CCC(NC(=O)N2C[C@@H]3[C@@H](C[C@H]3c3ccccc3)C2)CC1	ZINC000875249565	FG	On-Demand	Anodyne	SLC6A3	36	41
COC(=O)C1CCC(NC(=O)N2C[C@@H]3[C@@H](C[C@H]3c3ccccc3)C2)CC1	ZINC000875249565	FG	On-Demand	Anodyne	EPHX2	24	42
COC(=O)C1CCC(NC(=O)N2C[C@@H]3[C@@H](C[C@H]3c3ccccc3)C2)CC1	ZINC000875249565	FG	On-Demand	Anodyne	SMO	15	42
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875249566	FD	On-Demand	Mild	DRD4	28	49
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875249566	FD	On-Demand	Mild	SIGMAR1	32	40
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875249567	FD	On-Demand	Mild	DRD4	28	49
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875249567	FD	On-Demand	Mild	SIGMAR1	32	40
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875249568	FD	On-Demand	Mild	DRD4	28	49
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875249568	FD	On-Demand	Mild	SIGMAR1	32	40
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875249569	FD	On-Demand	Mild	DRD4	28	49
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875249569	FD	On-Demand	Mild	SIGMAR1	32	40
CCO[C@H]1COCC[C@@H]1NC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875249581	GC	On-Demand	Anodyne	CCR2	17	43
CCO[C@H]1COCC[C@H]1NC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875249582	GC	On-Demand	Anodyne	CCR2	17	43
Cc1ccc2c(c1)[C@H](NC(=O)N1CCC(C(=O)NCCO)CC1)CC2	ZINC000875249620	ED	On-Demand	Anodyne	EPHX2	27	42
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875249630	GD	On-Demand	Mild	DRD4	34	51
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875249630	GD	On-Demand	Mild	SIGMAR1	33	41
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875249631	GD	On-Demand	Mild	DRD4	34	51
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875249631	GD	On-Demand	Mild	SIGMAR1	33	41
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875249632	GD	On-Demand	Mild	DRD4	34	51
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875249632	GD	On-Demand	Mild	SIGMAR1	33	41
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875249633	GD	On-Demand	Mild	DRD4	34	51
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875249633	GD	On-Demand	Mild	SIGMAR1	33	41
COC(=O)C1CCC(NC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875249638	FG	On-Demand	Anodyne	FKBP1A	49	39
COC(=O)C1CCC(NC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875249639	FG	On-Demand	Anodyne	FKBP1A	49	39
COC(=O)C1CCC(NC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875249640	FG	On-Demand	Anodyne	FKBP1A	49	39
COC(=O)C1CCC(NC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875249641	FG	On-Demand	Anodyne	FKBP1A	49	39
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1[C@@H](C)CN(Cc2ccccc2)C[C@H]1C	ZINC000875249694	GD	On-Demand	Mild	DRD4	17	41
C#CC[C@H](COC)NC(=O)C(=O)NC1[C@@H](C)CN(Cc2ccccc2)C[C@@H]1C	ZINC000875249695	GD	On-Demand	Mild	DRD4	17	41
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H]1[C@@H](C)CN(Cc2ccccc2)C[C@H]1C	ZINC000875249696	GD	On-Demand	Mild	DRD4	17	41
C#CC[C@H](COC)NC(=O)C(=O)NC1[C@H](C)CN(Cc2ccccc2)C[C@H]1C	ZINC000875249697	GD	On-Demand	Mild	DRD4	17	41
COC(=O)C1CCC(NC(=O)N2CCC(c3nc(C4CCC4)no3)CC2)CC1	ZINC000875249710	GF	On-Demand	Anodyne	SMO	38	46
COC(=O)C1CCC(NC(=O)N2CCC(c3nc(C4CCC4)no3)CC2)CC1	ZINC000875249710	GF	On-Demand	Anodyne	ETHR	58	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1ccc(OC)c(OC)c1	ZINC000875249726	GE	On-Demand	Anodyne	SLC6A4	20	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1ccc(OC)c(OC)c1	ZINC000875249726	GE	On-Demand	Anodyne	SLC6A3	43	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1ccc(OC)c(OC)c1	ZINC000875249727	GE	On-Demand	Anodyne	SLC6A4	20	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1ccc(OC)c(OC)c1	ZINC000875249727	GE	On-Demand	Anodyne	SLC6A3	43	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1ccc(OC)c(OC)c1	ZINC000875249728	GE	On-Demand	Anodyne	SLC6A4	20	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1ccc(OC)c(OC)c1	ZINC000875249728	GE	On-Demand	Anodyne	SLC6A3	43	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1ccc(OC)c(OC)c1	ZINC000875249729	GE	On-Demand	Anodyne	SLC6A4	20	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1ccc(OC)c(OC)c1	ZINC000875249729	GE	On-Demand	Anodyne	SLC6A3	43	39
CC(=O)C1CCN(C(=O)C(=O)NC[C@H]2CCc3ccccc3C2)CC1	ZINC000875249735	ED	On-Demand	Anodyne	PREP	37	44
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H]2CCc3ccccc3C2)CC1	ZINC000875249736	ED	On-Demand	Anodyne	PREP	37	44
CN1CCN(C2CCN(C(=O)C(=O)NC[C@@H]3CCc4ccccc4C3)CC2)CC1	ZINC000875249744	GD	On-Demand	Anodyne	PREP	26	40
CN1CCN(C2CCN(C(=O)C(=O)NC[C@@H]3CCc4ccccc4C3)CC2)CC1	ZINC000875249744	GD	On-Demand	Anodyne	L3MBTL3	59	40
CN1CCN(C2CCN(C(=O)C(=O)NC[C@H]3CCc4ccccc4C3)CC2)CC1	ZINC000875249745	GD	On-Demand	Anodyne	PREP	26	40
CN1CCN(C2CCN(C(=O)C(=O)NC[C@H]3CCc4ccccc4C3)CC2)CC1	ZINC000875249745	GD	On-Demand	Anodyne	L3MBTL3	59	40
C#CC[C@H](CCOC)NC(=O)C(=O)NC1[C@@H](C)CN(Cc2ccccc2)C[C@@H]1C	ZINC000875249756	GD	On-Demand	Mild	DRD4	20	43
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H]1[C@@H](C)CN(Cc2ccccc2)C[C@H]1C	ZINC000875249757	GD	On-Demand	Mild	DRD4	20	43
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1[C@@H](C)CN(Cc2ccccc2)C[C@H]1C	ZINC000875249758	GD	On-Demand	Mild	DRD4	20	43
C#CC[C@H](CCOC)NC(=O)C(=O)NC1[C@H](C)CN(Cc2ccccc2)C[C@H]1C	ZINC000875249759	GD	On-Demand	Mild	DRD4	20	43
O=C1CCN(C(=O)C(=O)NC[C@H]2CCc3ccccc3C2)CCCCCCN1	ZINC000875249779	GD	On-Demand	Anodyne	PREP	35	44
O=C1CCN(C(=O)C(=O)NC[C@@H]2CCc3ccccc3C2)CCCCCCN1	ZINC000875249780	GD	On-Demand	Anodyne	PREP	35	44
COC(=O)C1CCC(NC(=O)NCCCCC2CC2)CC1	ZINC000875249788	CF	On-Demand	Anodyne	EPHX2	15	49
COC(=O)C1CCC(NC(=O)N2CC3(CC(=O)N3Cc3ccccc3)C2)CC1	ZINC000875249802	GD	On-Demand	Anodyne	SIGMAR1	20	41
O=C(NC[C@@H]1CCc2ccccc2C1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875249812	EE	On-Demand	Anodyne	PREP	24	40
O=C(NC[C@H]1CCc2ccccc2C1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875249813	EE	On-Demand	Anodyne	PREP	24	40
COC(=O)C1CCC(NC(=O)NCc2ccc(CN3CCNC3=O)cc2)CC1	ZINC000875249833	GD	On-Demand	Anodyne	EPHX2	20	46
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N2OC3CCC2CC3)C1	ZINC000875249845	FF	On-Demand	Anodyne	GPR119	26	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N2OC3CCC2CC3)C1	ZINC000875249847	FF	On-Demand	Anodyne	GPR119	26	41
CN(CCNC(=O)NCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)CC(F)F	ZINC000875249860	GE	On-Demand	Anodyne	GPR119	23	41
CN(CCNC(=O)NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1)CC(F)F	ZINC000875249861	GE	On-Demand	Anodyne	GPR119	23	41
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)C1(F)CCOCC1	ZINC000875249889	GD	On-Demand	Anodyne	LRRK2	29	40
O=CN1CCCN(C(=O)N[C@H]2CCN(c3ccc(F)cc3F)C2)CC1	ZINC000875249912	FD	On-Demand	Anodyne	CCR3	25	45
O=CN1CCCN(C(=O)N[C@@H]2CCN(c3ccc(F)cc3F)C2)CC1	ZINC000875249913	FD	On-Demand	Anodyne	CCR3	25	45
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N[C@H]2CCC[C@@H]2O)C1	ZINC000875249916	ED	On-Demand	Anodyne	GPR119	33	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N[C@H]2CCC[C@@H]2O)C1	ZINC000875249917	ED	On-Demand	Anodyne	GPR119	33	41
CN1CCCC[C@H](N(C)C(=O)NCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)C1=O	ZINC000875249930	GE	On-Demand	Anodyne	GPR119	22	40
CN1CCCC[C@H](N(C)C(=O)NCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)C1=O	ZINC000875249931	GE	On-Demand	Anodyne	GPR119	22	40
CN1CCCC[C@@H](N(C)C(=O)NCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)C1=O	ZINC000875249932	GE	On-Demand	Anodyne	GPR119	22	40
CN1CCCC[C@@H](N(C)C(=O)NCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)C1=O	ZINC000875249933	GE	On-Demand	Anodyne	GPR119	22	40
COC(=O)c1sccc1NC(=O)COC(=O)c1cnc2ccccc2c1C(F)(F)F	ZINC000875249988	IH	On-Demand	Anodyne	FAS	58	46
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1c2cccc(F)c2CC[C@H]1C	ZINC000875250010	FF	On-Demand	Anodyne	DRD4	40	33
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1c2cccc(F)c2CC[C@H]1C	ZINC000875250012	FF	On-Demand	Anodyne	DRD4	40	33
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1c2cccc(F)c2CC[C@@H]1C	ZINC000875250014	FF	On-Demand	Anodyne	DRD4	40	33
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1c2cccc(F)c2CC[C@@H]1C	ZINC000875250016	FF	On-Demand	Anodyne	DRD4	40	33
CC(=O)C1CCN(C(=O)C(=O)NC2[C@H](C)CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875250090	GE	On-Demand	Anodyne	DRD4	41	42
CC(=O)C1CCN(C(=O)C(=O)NC2[C@H](C)CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875250090	GE	On-Demand	Anodyne	ACHE	26	40
CC(=O)C1CCN(C(=O)C(=O)NC2[C@H](C)CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875250090	GE	On-Demand	Anodyne	SIGMAR1	45	46
CC(=O)C1CCN(C(=O)C(=O)NC2[C@H](C)CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875250090	GE	On-Demand	Anodyne	MLNR	51	38
CC(=O)C1CCN(C(=O)C(=O)NC2[C@@H](C)CN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000875250092	GE	On-Demand	Anodyne	DRD4	41	42
CC(=O)C1CCN(C(=O)C(=O)NC2[C@@H](C)CN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000875250092	GE	On-Demand	Anodyne	ACHE	26	40
CC(=O)C1CCN(C(=O)C(=O)NC2[C@@H](C)CN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000875250092	GE	On-Demand	Anodyne	SIGMAR1	45	46
CC(=O)C1CCN(C(=O)C(=O)NC2[C@@H](C)CN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000875250092	GE	On-Demand	Anodyne	MLNR	51	38
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2[C@@H](C)CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875250094	GE	On-Demand	Anodyne	DRD4	41	42
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2[C@@H](C)CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875250094	GE	On-Demand	Anodyne	ACHE	26	40
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2[C@@H](C)CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875250094	GE	On-Demand	Anodyne	SIGMAR1	45	46
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2[C@@H](C)CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875250094	GE	On-Demand	Anodyne	MLNR	51	38
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875250095	FE	On-Demand	Anodyne	DRD2	15	51
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875250095	FE	On-Demand	Anodyne	DRD4	44	51
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875250095	FE	On-Demand	Anodyne	ACHE	29	40
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875250095	FE	On-Demand	Anodyne	SIGMAR1	53	42
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875250096	FE	On-Demand	Anodyne	DRD2	15	51
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875250096	FE	On-Demand	Anodyne	DRD4	44	51
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875250096	FE	On-Demand	Anodyne	ACHE	29	40
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875250096	FE	On-Demand	Anodyne	SIGMAR1	53	42
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875250098	FE	On-Demand	Anodyne	DRD2	15	51
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875250098	FE	On-Demand	Anodyne	DRD4	44	51
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875250098	FE	On-Demand	Anodyne	ACHE	29	40
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875250098	FE	On-Demand	Anodyne	SIGMAR1	53	42
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875250099	FE	On-Demand	Anodyne	DRD2	15	51
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875250099	FE	On-Demand	Anodyne	DRD4	44	51
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875250099	FE	On-Demand	Anodyne	ACHE	29	40
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875250099	FE	On-Demand	Anodyne	SIGMAR1	53	42
COC(=O)C1CCC(NC(=O)N[C@@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875250104	GE	On-Demand	Anodyne	EPHX2	24	40
COC(=O)C1CCC(NC(=O)N[C@](C)(CO)Cc2ccc(OC)cc2)CC1	ZINC000875250105	GE	On-Demand	Anodyne	EPHX2	24	40
COC(=O)C1CCC(NC(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)CC1	ZINC000875250109	FF	On-Demand	Anodyne	MLNR	16	41
COC(=O)C1CCC(NC(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)CC1	ZINC000875250109	FF	On-Demand	Anodyne	EPHX2	51	51
COC(=O)C1CCC(NC(=O)NCc2ccnc(F)c2)CC1	ZINC000875250110	DD	On-Demand	Anodyne	EPHX2	21	40
COC(=O)C1CCC(NC(=O)N(C)CCc2cccc(C#N)c2)CC1	ZINC000875250121	EE	On-Demand	Mild	PTGES	17	46
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000875250130	GD	On-Demand	Anodyne	DRD4	41	49
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000875250130	GD	On-Demand	Anodyne	ACHE	28	40
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000875250130	GD	On-Demand	Anodyne	SIGMAR1	42	45
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000875250130	GD	On-Demand	Anodyne	MLNR	43	36
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000875250131	GD	On-Demand	Anodyne	DRD4	41	49
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000875250131	GD	On-Demand	Anodyne	ACHE	28	40
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000875250131	GD	On-Demand	Anodyne	SIGMAR1	42	45
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000875250131	GD	On-Demand	Anodyne	MLNR	43	36
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875250132	GD	On-Demand	Anodyne	DRD4	41	49
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875250132	GD	On-Demand	Anodyne	ACHE	28	40
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875250132	GD	On-Demand	Anodyne	SIGMAR1	42	45
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875250132	GD	On-Demand	Anodyne	MLNR	43	36
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875250133	GD	On-Demand	Anodyne	DRD4	41	49
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875250133	GD	On-Demand	Anodyne	ACHE	28	40
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875250133	GD	On-Demand	Anodyne	SIGMAR1	42	45
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875250133	GD	On-Demand	Anodyne	MLNR	43	36
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875250134	GE	On-Demand	Anodyne	DRD4	40	49
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875250134	GE	On-Demand	Anodyne	ACHE	29	40
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875250134	GE	On-Demand	Anodyne	SIGMAR1	40	45
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875250135	GE	On-Demand	Anodyne	DRD4	40	49
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875250135	GE	On-Demand	Anodyne	ACHE	29	40
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875250135	GE	On-Demand	Anodyne	SIGMAR1	40	45
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875250136	GE	On-Demand	Anodyne	DRD4	40	49
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875250136	GE	On-Demand	Anodyne	ACHE	29	40
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875250136	GE	On-Demand	Anodyne	SIGMAR1	40	45
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875250137	GE	On-Demand	Anodyne	DRD4	40	49
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875250137	GE	On-Demand	Anodyne	ACHE	29	40
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875250137	GE	On-Demand	Anodyne	SIGMAR1	40	45
CS(=O)(=O)Nc1ccc(/C=C/C(=O)OCc2ccccc2OC(F)F)cc1	ZINC000875250139	GG	On-Demand	Anodyne	AKR1B10	22	40
CS(=O)(=O)Nc1ccc(/C=C\C(=O)OCc2ccccc2OC(F)F)cc1	ZINC000875250145	GG	On-Demand	Anodyne	AKR1B10	22	40
C[C@@H](OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1)c1nc(-c2cccnc2)no1	ZINC000875250180	HF	On-Demand	Anodyne	ADRB3	18	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N2CCCN(C=O)CC2)C1	ZINC000875250184	FD	On-Demand	Anodyne	GPR119	24	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N2CCCN(C=O)CC2)C1	ZINC000875250185	FD	On-Demand	Anodyne	GPR119	24	40
C[C@H](OC(=O)/C=C/c1ccc(NS(C)(=O)=O)cc1)c1nc(-c2cccnc2)no1	ZINC000875250200	HF	On-Demand	Anodyne	ADRB3	18	40
C[C@H](OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1)c1nc(-c2cccnc2)no1	ZINC000875250202	HF	On-Demand	Anodyne	ADRB3	18	40
C[C@@H](OC(=O)/C=C/c1ccc(NS(C)(=O)=O)cc1)c1nc(-c2cccnc2)no1	ZINC000875250204	HF	On-Demand	Anodyne	ADRB3	18	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N2CCO[C@@H]3CCC[C@@H]32)C1	ZINC000875250205	FF	On-Demand	Anodyne	GPR119	23	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(C(F)F)cc2)C1	ZINC000875250231	EE	On-Demand	Anodyne	DPP7	55	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(C(F)F)cc2)C1	ZINC000875250232	EE	On-Demand	Anodyne	DPP7	55	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)c1cnc2ccccc2c1C(F)(F)F	ZINC000875250267	IH	On-Demand	Anodyne	CMA1	48	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)c1cnc2ccccc2c1C(F)(F)F	ZINC000875250267	IH	On-Demand	Anodyne	CTRA_BOVIN	42	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)c1cnc2ccccc2c1C(F)(F)F	ZINC000875250267	IH	On-Demand	Anodyne	CTRC	41	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)c1cnc2ccccc2c1C(F)(F)F	ZINC000875250294	IH	On-Demand	Anodyne	CMA1	48	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)c1cnc2ccccc2c1C(F)(F)F	ZINC000875250294	IH	On-Demand	Anodyne	CTRA_BOVIN	42	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)c1cnc2ccccc2c1C(F)(F)F	ZINC000875250294	IH	On-Demand	Anodyne	CTRC	41	37
O=C(NCC[C@H](O)C1CCCC1)N[C@@H]1CCN(c2ccccc2)C1	ZINC000875250297	EF	On-Demand	Anodyne	EPHX2	19	45
O=C(NCC[C@@H](O)C1CCCC1)N[C@H]1CCN(c2ccccc2)C1	ZINC000875250299	EF	On-Demand	Anodyne	EPHX2	19	45
O=C(NCC[C@@H](O)C1CCCC1)N[C@@H]1CCN(c2ccccc2)C1	ZINC000875250302	EF	On-Demand	Anodyne	EPHX2	19	45
O=C(NCC[C@H](O)C1CCCC1)N[C@H]1CCN(c2ccccc2)C1	ZINC000875250305	EF	On-Demand	Anodyne	EPHX2	19	45
CC[C@H](OC(=O)/C=C/c1ccc(NS(C)(=O)=O)cc1)C(=O)Nc1ccc(OC)cc1	ZINC000875250306	IG	On-Demand	Anodyne	HDAC8	19	47
CC[C@H](OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1)C(=O)Nc1ccc(OC)cc1	ZINC000875250309	IG	On-Demand	Anodyne	HDAC8	19	47
O=C1CCCCN1CCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875250332	FE	On-Demand	Anodyne	TRY1_BOVIN	42	35
O=C1CCCCN1CCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875250332	FE	On-Demand	Anodyne	TYRO3	19	41
O=C1CCCCN1CCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875250332	FE	On-Demand	Anodyne	TMPRSS11D	41	35
O=C1CCCCN1CCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875250336	FE	On-Demand	Anodyne	TRY1_BOVIN	42	35
O=C1CCCCN1CCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875250336	FE	On-Demand	Anodyne	TYRO3	19	41
O=C1CCCCN1CCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875250336	FE	On-Demand	Anodyne	TMPRSS11D	41	35
O=C1CCCCN1CCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875250339	FE	On-Demand	Anodyne	TRY1_BOVIN	42	35
O=C1CCCCN1CCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875250339	FE	On-Demand	Anodyne	TYRO3	19	41
O=C1CCCCN1CCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875250339	FE	On-Demand	Anodyne	TMPRSS11D	41	35
COC(=O)C1CCC(NC(=O)NCC2(c3ccccc3)CCN(C)CC2)CC1	ZINC000875250340	GF	On-Demand	Anodyne	KCNA3	58	51
COC(=O)C1CCC(NC(=O)NCC2(c3ccccc3)CCN(C)CC2)CC1	ZINC000875250340	GF	On-Demand	Anodyne	SOAT1	17	43
COC(=O)C1CCC(NC(=O)NCC2(c3ccccc3)CCN(C)CC2)CC1	ZINC000875250340	GF	On-Demand	Anodyne	EPHX2	31	40
COC(=O)C1CCC(NC(=O)NCC2(c3ccccc3)CCN(C)CC2)CC1	ZINC000875250340	GF	On-Demand	Anodyne	CACNA1G	18	42
O=C1CCCCN1CCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875250342	FE	On-Demand	Anodyne	TRY1_BOVIN	42	35
O=C1CCCCN1CCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875250342	FE	On-Demand	Anodyne	TYRO3	19	41
O=C1CCCCN1CCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875250342	FE	On-Demand	Anodyne	TMPRSS11D	41	35
COc1ccc(CN(C)C(=O)[C@@H](C)OC(=O)/C=C/c2ccc(NS(C)(=O)=O)cc2)cc1F	ZINC000875250369	JF	On-Demand	Anodyne	NR1H4	31	40
COc1ccc(CN(C)C(=O)[C@H](C)OC(=O)/C=C/c2ccc(NS(C)(=O)=O)cc2)cc1F	ZINC000875250371	JF	On-Demand	Anodyne	NR1H4	31	40
COc1ccc(CN(C)C(=O)[C@@H](C)OC(=O)/C=C\c2ccc(NS(C)(=O)=O)cc2)cc1F	ZINC000875250373	JF	On-Demand	Anodyne	NR1H4	31	40
COc1ccc(CN(C)C(=O)[C@H](C)OC(=O)/C=C\c2ccc(NS(C)(=O)=O)cc2)cc1F	ZINC000875250375	JF	On-Demand	Anodyne	NR1H4	31	40
COC(=O)c1cccc(COC(=O)c2cnc3ccccc3c2C(F)(F)F)c1	ZINC000875250393	GI	On-Demand	Anodyne	NR1H3	24	42
O=C(OCC(=O)N1CCN(C(=O)Nc2ccccc2)CC1)c1cnc2ccccc2c1C(F)(F)F	ZINC000875250433	JH	On-Demand	Anodyne	P2RY12	16	47
O=C(OCC(=O)N1CCN(C(=O)Nc2ccccc2)CC1)c1cnc2ccccc2c1C(F)(F)F	ZINC000875250433	JH	On-Demand	Anodyne	PDGFRB	38	44
O=C(OCC(=O)N1CCN(C(=O)Nc2ccccc2)CC1)c1cnc2ccccc2c1C(F)(F)F	ZINC000875250433	JH	On-Demand	Anodyne	EPHX2	30	42
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(Br)cc1	ZINC000875250453	EF	On-Demand	Anodyne	ANPEP	22	47
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(Br)cc1	ZINC000875250453	EF	On-Demand	Anodyne	PDS	46	36
CC[C@@H](NC(=O)N[C@@H](C)c1ccccc1)[C@H](O)c1ccccc1	ZINC000875250469	DH	On-Demand	Anodyne	CTSK	18	43
CC[C@@H](NC(=O)N[C@@H](C)c1ccccc1)[C@H](O)c1ccccc1	ZINC000875250469	DH	On-Demand	Anodyne	ACE2	44	35
CC[C@@H](NC(=O)N[C@@H](C)c1ccccc1)[C@H](O)c1ccccc1	ZINC000875250469	DH	On-Demand	Anodyne	AOC3	16	40
CC[C@@H](NC(=O)N[C@H](C)c1ccccc1)[C@@H](O)c1ccccc1	ZINC000875250470	DH	On-Demand	Anodyne	CTSK	18	43
CC[C@@H](NC(=O)N[C@H](C)c1ccccc1)[C@@H](O)c1ccccc1	ZINC000875250470	DH	On-Demand	Anodyne	ACE2	44	35
CC[C@@H](NC(=O)N[C@H](C)c1ccccc1)[C@@H](O)c1ccccc1	ZINC000875250470	DH	On-Demand	Anodyne	AOC3	16	40
CC[C@@H](NC(=O)N[C@@H](C)c1ccccc1)[C@@H](O)c1ccccc1	ZINC000875250471	DH	On-Demand	Anodyne	CTSK	18	43
CC[C@@H](NC(=O)N[C@@H](C)c1ccccc1)[C@@H](O)c1ccccc1	ZINC000875250471	DH	On-Demand	Anodyne	ACE2	44	35
CC[C@@H](NC(=O)N[C@@H](C)c1ccccc1)[C@@H](O)c1ccccc1	ZINC000875250471	DH	On-Demand	Anodyne	AOC3	16	40
CC[C@@H](NC(=O)N[C@H](C)c1ccccc1)[C@H](O)c1ccccc1	ZINC000875250472	DH	On-Demand	Anodyne	CTSK	18	43
CC[C@@H](NC(=O)N[C@H](C)c1ccccc1)[C@H](O)c1ccccc1	ZINC000875250472	DH	On-Demand	Anodyne	ACE2	44	35
CC[C@@H](NC(=O)N[C@H](C)c1ccccc1)[C@H](O)c1ccccc1	ZINC000875250472	DH	On-Demand	Anodyne	AOC3	16	40
CC(=O)N1CCC[C@@H]1C(=O)Oc1c(Br)cccc1Br	ZINC000875250474	GG	On-Demand	Anodyne	FKBP1A	53	36
CC(=O)N1CCC[C@@H]1C(=O)Oc1c(Br)cccc1Br	ZINC000875250474	GG	On-Demand	Anodyne	PREP	64	41
O=C(NCc1nnnn1-c1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875250486	FE	On-Demand	Anodyne	EPHX2	21	41
O=C(NCc1nnnn1-c1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875250487	FE	On-Demand	Anodyne	EPHX2	21	41
CCCCCCCNC(=O)C(=O)N[C@H](C)c1ccncc1OC	ZINC000875250488	DE	On-Demand	Mild	ASAH1	54	33
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1ccncc1OC	ZINC000875250489	DE	On-Demand	Mild	ASAH1	54	33
O=C(COC(=O)c1cnc2ccccc2c1C(F)(F)F)N[C@@H](c1ccccc1)C1CC1	ZINC000875250495	IJ	On-Demand	Anodyne	TACR3	21	42
O=C(COC(=O)c1cnc2ccccc2c1C(F)(F)F)N[C@H](c1ccccc1)C1CC1	ZINC000875250496	IJ	On-Demand	Anodyne	TACR3	21	42
O=C(COC(=O)c1cnc2ccccc2c1C(F)(F)F)c1cnc(N2CCCCC2)s1	ZINC000875250511	IJ	On-Demand	Anodyne	MLYCD	43	34
O=C1CCCCN1CCCNC(=O)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875250585	FD	On-Demand	Anodyne	TYRO3	19	41
C[C@H](OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1)C(=O)NCCc1ccccc1	ZINC000875250586	HE	On-Demand	Anodyne	MMP2	18	47
C[C@H](OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1)C(=O)NCCc1ccccc1	ZINC000875250586	HE	On-Demand	Anodyne	AMP1_PLAFQ	26	41
C[C@H](OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1)C(=O)NCCc1ccccc1	ZINC000875250586	HE	On-Demand	Anodyne	AKR1B10	17	41
C[C@@H](OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1)C(=O)NCCc1ccccc1	ZINC000875250587	HE	On-Demand	Anodyne	MMP2	18	47
C[C@@H](OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1)C(=O)NCCc1ccccc1	ZINC000875250587	HE	On-Demand	Anodyne	AMP1_PLAFQ	26	41
C[C@@H](OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1)C(=O)NCCc1ccccc1	ZINC000875250587	HE	On-Demand	Anodyne	AKR1B10	17	41
N#CCCN1CCN(C(=O)C(=O)N[C@@H](c2ccccc2)C2CCOCC2)CC1	ZINC000875250611	GD	On-Demand	Mild	CASR	41	36
N#CCCN1CCN(C(=O)C(=O)N[C@@H](c2ccccc2)C2CCOCC2)CC1	ZINC000875250611	GD	On-Demand	Mild	CTSS	21	42
N#CCCN1CCN(C(=O)C(=O)N[C@H](c2ccccc2)C2CCOCC2)CC1	ZINC000875250612	GD	On-Demand	Mild	CASR	41	36
N#CCCN1CCN(C(=O)C(=O)N[C@H](c2ccccc2)C2CCOCC2)CC1	ZINC000875250612	GD	On-Demand	Mild	CTSS	21	42
O=C1CCCCN1CCCNC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875250631	FE	On-Demand	Anodyne	ADRA1A	15	40
O=C1CCCCN1CCCNC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875250631	FE	On-Demand	Anodyne	TYRO3	19	40
O=C1CCCCN1CCCNC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875250632	FE	On-Demand	Anodyne	ADRA1A	15	40
O=C1CCCCN1CCCNC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875250632	FE	On-Demand	Anodyne	TYRO3	19	40
COC(=O)N(C)NC(=O)N[C@@H]1CCN(c2ccccc2)C1	ZINC000875250633	CD	On-Demand	Reactive	EPHX2	15	46
COC(=O)N(C)NC(=O)N[C@H]1CCN(c2ccccc2)C1	ZINC000875250635	CD	On-Demand	Reactive	EPHX2	15	46
CCCCCCCNC(=O)C(=O)NCc1ccc(C(F)F)cc1	ZINC000875250645	EG	On-Demand	Mild	S1PR4	17	46
CCCCCCCNC(=O)C(=O)NCc1ccc(C(F)F)cc1	ZINC000875250645	EG	On-Demand	Mild	GRIA1	41	36
CCCCCCCNC(=O)C(=O)NCc1ccc(C(F)F)cc1	ZINC000875250645	EG	On-Demand	Mild	S1PR2	61	46
CCCCCCCNC(=O)C(=O)NCc1ccc(C(F)F)cc1	ZINC000875250645	EG	On-Demand	Mild	ASAH1	98	37
COC(=O)c1cccc(NC(=O)COC(=O)c2cnc3ccccc3c2C(F)(F)F)c1	ZINC000875250651	IH	On-Demand	Anodyne	KCNK3	45	33
O=C(NC[C@@H]1CCc2ccccc2C1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875250674	GF	On-Demand	Anodyne	PREP	42	46
CC[C@H](C[C@H](C)O)NC(=O)NCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000875250675	FE	On-Demand	Anodyne	GPR119	22	42
O=C(NC[C@H]1CCc2ccccc2C1)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875250676	GF	On-Demand	Anodyne	PREP	42	46
CC[C@H](C[C@H](C)O)NC(=O)NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000875250677	FE	On-Demand	Anodyne	GPR119	22	42
O=C(NC[C@@H]1CCc2ccccc2C1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875250679	GF	On-Demand	Anodyne	PREP	42	46
O=C(NC[C@H]1CCc2ccccc2C1)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875250681	GF	On-Demand	Anodyne	PREP	42	46
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@H]1CCc2ccccc2C1	ZINC000875250683	EE	On-Demand	Anodyne	PREP	25	40
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@H]1CCc2ccccc2C1	ZINC000875250685	EE	On-Demand	Anodyne	PREP	25	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)NC2CN(c3ccncn3)C2)C1	ZINC000875250686	GD	On-Demand	Anodyne	GRIN2B	17	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)NC2CN(c3ccncn3)C2)C1	ZINC000875250686	GD	On-Demand	Anodyne	SIRT3	40	37
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)NC2CN(c3ccncn3)C2)C1	ZINC000875250686	GD	On-Demand	Anodyne	SIRT2	40	37
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)NC2CN(c3ccncn3)C2)C1	ZINC000875250686	GD	On-Demand	Anodyne	SIRT1	42	37
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)NC2CN(c3ccncn3)C2)C1	ZINC000875250686	GD	On-Demand	Anodyne	GPR119	49	56
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@@H]1CCc2ccccc2C1	ZINC000875250687	EE	On-Demand	Anodyne	PREP	25	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)NC2CN(c3ccncn3)C2)C1	ZINC000875250688	GD	On-Demand	Anodyne	GRIN2B	17	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)NC2CN(c3ccncn3)C2)C1	ZINC000875250688	GD	On-Demand	Anodyne	SIRT3	40	37
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)NC2CN(c3ccncn3)C2)C1	ZINC000875250688	GD	On-Demand	Anodyne	SIRT2	40	37
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)NC2CN(c3ccncn3)C2)C1	ZINC000875250688	GD	On-Demand	Anodyne	SIRT1	42	37
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)NC2CN(c3ccncn3)C2)C1	ZINC000875250688	GD	On-Demand	Anodyne	GPR119	49	56
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@@H]1CCc2ccccc2C1	ZINC000875250689	EE	On-Demand	Anodyne	PREP	25	40
COC(=O)C1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875250726	EF	On-Demand	Anodyne	EPHX2	43	39
O=C(NCCOC1CCC1)C(=O)NCc1ccnc(-c2ccccc2)c1	ZINC000875250730	FE	On-Demand	Anodyne	VCP	48	36
O=C(NCc1ccc(Br)cc1)N1CCC(CO)(CO)CC1	ZINC000875250765	FD	On-Demand	Anodyne	NAMPT	23	43
CS(=O)(=O)Nc1ccc(/C=C\C(=O)OCC(=O)C2CCCCC2)cc1	ZINC000875250865	FF	On-Demand	Anodyne	NR1H4	23	40
CS(=O)(=O)Nc1ccc(/C=C/C(=O)OCc2nnnn2Cc2ccccc2)cc1	ZINC000875250867	HD	On-Demand	Anodyne	AKR1B10	17	44
CCOC1CC2(C1)C[C@H]2C(=O)Nc1ccc([N+](=O)[O-])cc1F	ZINC000875250868	DF	On-Demand	Bother	CACNA1D	40	32
CS(=O)(=O)Nc1ccc(/C=C\C(=O)OCc2nnnn2Cc2ccccc2)cc1	ZINC000875250869	HD	On-Demand	Anodyne	AKR1B10	17	44
C[C@@H](NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)c1ccccc1	ZINC000875250888	DH	On-Demand	Anodyne	ACE	46	45
C[C@@H](NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)c1ccccc1	ZINC000875250888	DH	On-Demand	Anodyne	PREP	60	38
C[C@@H](NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)c1ccccc1	ZINC000875250888	DH	On-Demand	Anodyne	XIAP	58	41
C[C@@H](NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)c1ccccc1	ZINC000875250888	DH	On-Demand	Anodyne	BIRC8	54	32
C[C@@H](NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)c1ccccc1	ZINC000875250888	DH	On-Demand	Anodyne	WNT3	40	32
C[C@@H](NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)c1ccccc1	ZINC000875250890	DH	On-Demand	Anodyne	ACE	46	45
C[C@@H](NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)c1ccccc1	ZINC000875250890	DH	On-Demand	Anodyne	PREP	60	38
C[C@@H](NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)c1ccccc1	ZINC000875250890	DH	On-Demand	Anodyne	XIAP	58	41
C[C@@H](NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)c1ccccc1	ZINC000875250890	DH	On-Demand	Anodyne	BIRC8	54	32
C[C@@H](NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)c1ccccc1	ZINC000875250890	DH	On-Demand	Anodyne	WNT3	40	32
C[C@@H](NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)c1ccccc1	ZINC000875250892	DH	On-Demand	Anodyne	ACE	46	45
C[C@@H](NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)c1ccccc1	ZINC000875250892	DH	On-Demand	Anodyne	PREP	60	38
C[C@@H](NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)c1ccccc1	ZINC000875250892	DH	On-Demand	Anodyne	XIAP	58	41
C[C@@H](NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)c1ccccc1	ZINC000875250892	DH	On-Demand	Anodyne	BIRC8	54	32
C[C@@H](NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)c1ccccc1	ZINC000875250892	DH	On-Demand	Anodyne	WNT3	40	32
C[C@@H](NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)c1ccccc1	ZINC000875250894	DH	On-Demand	Anodyne	ACE	46	45
C[C@@H](NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)c1ccccc1	ZINC000875250894	DH	On-Demand	Anodyne	PREP	60	38
C[C@@H](NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)c1ccccc1	ZINC000875250894	DH	On-Demand	Anodyne	XIAP	58	41
C[C@@H](NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)c1ccccc1	ZINC000875250894	DH	On-Demand	Anodyne	BIRC8	54	32
C[C@@H](NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)c1ccccc1	ZINC000875250894	DH	On-Demand	Anodyne	WNT3	40	32
CCOC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)/C=C/c2ccc(NS(C)(=O)=O)cc2)CC1	ZINC000875250900	JD	On-Demand	Anodyne	P2RY12	46	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)/C=C/c2ccc(NS(C)(=O)=O)cc2)CC1	ZINC000875250900	JD	On-Demand	Anodyne	TGM2	18	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)/C=C/c2ccc(NS(C)(=O)=O)cc2)CC1	ZINC000875250900	JD	On-Demand	Anodyne	F13A1	31	40
CCOC(=O)N1CCN(C(=O)[C@H](C)OC(=O)/C=C/c2ccc(NS(C)(=O)=O)cc2)CC1	ZINC000875250901	JD	On-Demand	Anodyne	P2RY12	46	36
CCOC(=O)N1CCN(C(=O)[C@H](C)OC(=O)/C=C/c2ccc(NS(C)(=O)=O)cc2)CC1	ZINC000875250901	JD	On-Demand	Anodyne	TGM2	18	40
CCOC(=O)N1CCN(C(=O)[C@H](C)OC(=O)/C=C/c2ccc(NS(C)(=O)=O)cc2)CC1	ZINC000875250901	JD	On-Demand	Anodyne	F13A1	31	40
CCOC(=O)N1CCN(C(=O)[C@H](C)OC(=O)/C=C\c2ccc(NS(C)(=O)=O)cc2)CC1	ZINC000875250902	JD	On-Demand	Anodyne	P2RY12	46	36
CCOC(=O)N1CCN(C(=O)[C@H](C)OC(=O)/C=C\c2ccc(NS(C)(=O)=O)cc2)CC1	ZINC000875250902	JD	On-Demand	Anodyne	TGM2	18	40
CCOC(=O)N1CCN(C(=O)[C@H](C)OC(=O)/C=C\c2ccc(NS(C)(=O)=O)cc2)CC1	ZINC000875250902	JD	On-Demand	Anodyne	F13A1	31	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)/C=C\c2ccc(NS(C)(=O)=O)cc2)CC1	ZINC000875250903	JD	On-Demand	Anodyne	P2RY12	46	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)/C=C\c2ccc(NS(C)(=O)=O)cc2)CC1	ZINC000875250903	JD	On-Demand	Anodyne	TGM2	18	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)/C=C\c2ccc(NS(C)(=O)=O)cc2)CC1	ZINC000875250903	JD	On-Demand	Anodyne	F13A1	31	40
O=C(NCCCc1ccccn1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875250908	FD	On-Demand	Anodyne	FKBP1A	23	44
O=C(NCCCc1ccccn1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875250909	FD	On-Demand	Anodyne	FKBP1A	23	44
O=C(NCCCc1ccccn1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875250910	FD	On-Demand	Anodyne	FKBP1A	23	44
O=C(NCCCc1ccccn1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875250911	FD	On-Demand	Anodyne	FKBP1A	23	44
C[C@@H]1CN(C(=O)N[C@@H]2CCN(c3ccccc3)C2)CC[C@@H](C(F)(F)F)O1	ZINC000875250922	FG	On-Demand	Anodyne	SFRP1	78	34
C[C@@H]1CN(C(=O)N[C@@H]2CCN(c3ccccc3)C2)CC[C@@H](C(F)(F)F)O1	ZINC000875250922	FG	On-Demand	Anodyne	WNT3	50	31
C[C@@H]1CN(C(=O)N[C@@H]2CCN(c3ccccc3)C2)CC[C@H](C(F)(F)F)O1	ZINC000875250924	FG	On-Demand	Anodyne	SFRP1	78	34
C[C@@H]1CN(C(=O)N[C@@H]2CCN(c3ccccc3)C2)CC[C@H](C(F)(F)F)O1	ZINC000875250924	FG	On-Demand	Anodyne	WNT3	50	31
C[C@@H]1CN(C(=O)N[C@H]2CCN(c3ccccc3)C2)CC[C@H](C(F)(F)F)O1	ZINC000875250926	FG	On-Demand	Anodyne	SFRP1	78	34
C[C@@H]1CN(C(=O)N[C@H]2CCN(c3ccccc3)C2)CC[C@H](C(F)(F)F)O1	ZINC000875250926	FG	On-Demand	Anodyne	WNT3	50	31
NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)COC(=O)c1cnc2ccccc2c1C(F)(F)F	ZINC000875250927	JF	On-Demand	Anodyne	EIF2AK3	68	34
C[C@@H]1CN(C(=O)N[C@H]2CCN(c3ccccc3)C2)CC[C@@H](C(F)(F)F)O1	ZINC000875250928	FG	On-Demand	Anodyne	SFRP1	78	34
C[C@@H]1CN(C(=O)N[C@H]2CCN(c3ccccc3)C2)CC[C@@H](C(F)(F)F)O1	ZINC000875250928	FG	On-Demand	Anodyne	WNT3	50	31
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NCCCN1CCCCC1=O	ZINC000875250931	GE	On-Demand	Anodyne	TYRO3	21	41
CS(=O)(=O)c1cccc(NC(=O)COC(=O)c2cnc3ccccc3c2C(F)(F)F)c1	ZINC000875250936	JG	On-Demand	Anodyne	NR1H3	35	43
CS(=O)(=O)c1cccc(NC(=O)COC(=O)c2cnc3ccccc3c2C(F)(F)F)c1	ZINC000875250936	JG	On-Demand	Anodyne	NR1H2	38	43
C[C@@H](NC(=O)N1CCC[C@@H](C(=O)N[C@@H]2CCC[C@@H](O)C2)C1)c1ccccc1	ZINC000875250978	FF	On-Demand	Anodyne	EPHX2	26	41
C[C@@H](NC(=O)N1CCC[C@@H](C(=O)N[C@@H]2CCC[C@@H](O)C2)C1)c1ccccc1	ZINC000875250978	FF	On-Demand	Anodyne	XIAP	51	38
C[C@@H](NC(=O)N1CCC[C@@H](C(=O)N[C@@H]2CCC[C@@H](O)C2)C1)c1ccccc1	ZINC000875250978	FF	On-Demand	Anodyne	BIRC3	53	42
C[C@@H](NC(=O)N1CCC[C@@H](C(=O)N[C@@H]2CCC[C@@H](O)C2)C1)c1ccccc1	ZINC000875250978	FF	On-Demand	Anodyne	BIRC2	57	42
C[C@@H](NC(=O)N1CCC[C@@H](C(=O)N[C@@H]2CCC[C@@H](O)C2)C1)c1ccccc1	ZINC000875250978	FF	On-Demand	Anodyne	BIRC8	55	34
COC(=O)C1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875250980	FE	On-Demand	Anodyne	EPHX2	21	45
C[C@@H](NC(=O)N1CCC[C@@H](C(=O)N[C@H]2CCC[C@@H](O)C2)C1)c1ccccc1	ZINC000875250981	FF	On-Demand	Anodyne	EPHX2	26	41
C[C@@H](NC(=O)N1CCC[C@@H](C(=O)N[C@H]2CCC[C@@H](O)C2)C1)c1ccccc1	ZINC000875250981	FF	On-Demand	Anodyne	XIAP	51	38
C[C@@H](NC(=O)N1CCC[C@@H](C(=O)N[C@H]2CCC[C@@H](O)C2)C1)c1ccccc1	ZINC000875250981	FF	On-Demand	Anodyne	BIRC3	53	42
C[C@@H](NC(=O)N1CCC[C@@H](C(=O)N[C@H]2CCC[C@@H](O)C2)C1)c1ccccc1	ZINC000875250981	FF	On-Demand	Anodyne	BIRC2	57	42
C[C@@H](NC(=O)N1CCC[C@@H](C(=O)N[C@H]2CCC[C@@H](O)C2)C1)c1ccccc1	ZINC000875250981	FF	On-Demand	Anodyne	BIRC8	55	34
C[C@@H](NC(=O)N1CCC[C@@H](C(=O)N[C@@H]2CCC[C@H](O)C2)C1)c1ccccc1	ZINC000875250983	FF	On-Demand	Anodyne	EPHX2	26	41
C[C@@H](NC(=O)N1CCC[C@@H](C(=O)N[C@@H]2CCC[C@H](O)C2)C1)c1ccccc1	ZINC000875250983	FF	On-Demand	Anodyne	XIAP	51	38
C[C@@H](NC(=O)N1CCC[C@@H](C(=O)N[C@@H]2CCC[C@H](O)C2)C1)c1ccccc1	ZINC000875250983	FF	On-Demand	Anodyne	BIRC3	53	42
C[C@@H](NC(=O)N1CCC[C@@H](C(=O)N[C@@H]2CCC[C@H](O)C2)C1)c1ccccc1	ZINC000875250983	FF	On-Demand	Anodyne	BIRC2	57	42
C[C@@H](NC(=O)N1CCC[C@@H](C(=O)N[C@@H]2CCC[C@H](O)C2)C1)c1ccccc1	ZINC000875250983	FF	On-Demand	Anodyne	BIRC8	55	34
C[C@@H](NC(=O)N1CCC[C@@H](C(=O)N[C@H]2CCC[C@H](O)C2)C1)c1ccccc1	ZINC000875250985	FF	On-Demand	Anodyne	EPHX2	26	41
C[C@@H](NC(=O)N1CCC[C@@H](C(=O)N[C@H]2CCC[C@H](O)C2)C1)c1ccccc1	ZINC000875250985	FF	On-Demand	Anodyne	XIAP	51	38
C[C@@H](NC(=O)N1CCC[C@@H](C(=O)N[C@H]2CCC[C@H](O)C2)C1)c1ccccc1	ZINC000875250985	FF	On-Demand	Anodyne	BIRC3	53	42
C[C@@H](NC(=O)N1CCC[C@@H](C(=O)N[C@H]2CCC[C@H](O)C2)C1)c1ccccc1	ZINC000875250985	FF	On-Demand	Anodyne	BIRC2	57	42
C[C@@H](NC(=O)N1CCC[C@@H](C(=O)N[C@H]2CCC[C@H](O)C2)C1)c1ccccc1	ZINC000875250985	FF	On-Demand	Anodyne	BIRC8	55	34
COC(=O)C1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875250988	FE	On-Demand	Anodyne	EPHX2	21	45
O=C(NCc1nnnn1-c1ccccc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875251020	GE	On-Demand	Anodyne	PREP	18	40
O=C(NCc1nnnn1-c1ccccc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875251024	GE	On-Demand	Anodyne	PREP	18	40
O=C(NCc1nnnn1-c1ccccc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875251027	GE	On-Demand	Anodyne	PREP	18	40
CN(Cc1ccc(Cl)c(Cl)c1)C(=O)COC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1	ZINC000875251029	JH	On-Demand	Anodyne	GRIN1	27	42
O=C(NCc1nnnn1-c1ccccc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875251030	GE	On-Demand	Anodyne	PREP	18	40
COC(=O)C1CCC(NC(=O)NCCC[C@H]2CCOC2=O)CC1	ZINC000875251031	ED	On-Demand	Anodyne	TRAR	40	33
COC(=O)C1CCC(NC(=O)NCCC[C@H]2CCOC2=O)CC1	ZINC000875251031	ED	On-Demand	Anodyne	LASR	47	33
CN(Cc1ccc(Cl)c(Cl)c1)C(=O)COC(=O)/C=C/c1ccc(NS(C)(=O)=O)cc1	ZINC000875251032	JH	On-Demand	Anodyne	GRIN1	27	42
COC(=O)C1CCC(NC(=O)NCCC[C@@H]2CCOC2=O)CC1	ZINC000875251033	ED	On-Demand	Anodyne	TRAR	40	33
COC(=O)C1CCC(NC(=O)NCCC[C@@H]2CCOC2=O)CC1	ZINC000875251033	ED	On-Demand	Anodyne	LASR	47	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2[C@@H](C)CN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875251043	GE	On-Demand	Anodyne	DRD4	30	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2[C@@H](C)CN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875251043	GE	On-Demand	Anodyne	SLC6A1	77	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2[C@@H](C)CN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875251043	GE	On-Demand	Anodyne	SIGMAR1	35	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2[C@@H](C)CN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875251043	GE	On-Demand	Anodyne	MLNR	51	36
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H]2[C@@H](C)CN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875251046	GE	On-Demand	Anodyne	DRD4	30	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H]2[C@@H](C)CN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875251046	GE	On-Demand	Anodyne	SLC6A1	77	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H]2[C@@H](C)CN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875251046	GE	On-Demand	Anodyne	SIGMAR1	35	44
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H]2[C@@H](C)CN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875251046	GE	On-Demand	Anodyne	MLNR	51	36
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2[C@H](C)CN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875251049	GE	On-Demand	Anodyne	DRD4	30	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2[C@H](C)CN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875251049	GE	On-Demand	Anodyne	SLC6A1	77	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2[C@H](C)CN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875251049	GE	On-Demand	Anodyne	SIGMAR1	35	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2[C@H](C)CN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875251049	GE	On-Demand	Anodyne	MLNR	51	36
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2[C@@H](C)CN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875251050	GE	On-Demand	Anodyne	DRD4	30	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2[C@@H](C)CN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875251050	GE	On-Demand	Anodyne	SLC6A1	77	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2[C@@H](C)CN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875251050	GE	On-Demand	Anodyne	SIGMAR1	35	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2[C@@H](C)CN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875251050	GE	On-Demand	Anodyne	MLNR	51	36
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Br)cc1	ZINC000875251122	FF	On-Demand	Anodyne	SLC6A4	33	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Br)cc1	ZINC000875251122	FF	On-Demand	Anodyne	SLC6A3	62	47
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Br)cc1	ZINC000875251123	FF	On-Demand	Anodyne	SLC6A4	33	47
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Br)cc1	ZINC000875251123	FF	On-Demand	Anodyne	SLC6A3	62	47
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)c1sccc1CC#N	ZINC000875251193	GE	On-Demand	Mild	SLC9A1	52	41
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCOC1CCC1	ZINC000875251211	EE	On-Demand	Anodyne	ACE	55	39
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCOC1CCC1	ZINC000875251211	EE	On-Demand	Anodyne	MME	42	39
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCOC1CCC1	ZINC000875251211	EE	On-Demand	Anodyne	TIMP3	80	38
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCOC1CCC1	ZINC000875251211	EE	On-Demand	Anodyne	MMP3	42	39
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCOC1CCC1	ZINC000875251211	EE	On-Demand	Anodyne	CAPN1	49	39
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCOC1CCC1	ZINC000875251211	EE	On-Demand	Anodyne	CAPN2	91	39
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCOC1CCC1	ZINC000875251211	EE	On-Demand	Anodyne	NPR	41	33
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCOC1CCC1	ZINC000875251212	EE	On-Demand	Anodyne	ACE	55	39
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCOC1CCC1	ZINC000875251212	EE	On-Demand	Anodyne	MME	42	39
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCOC1CCC1	ZINC000875251212	EE	On-Demand	Anodyne	TIMP3	80	38
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCOC1CCC1	ZINC000875251212	EE	On-Demand	Anodyne	MMP3	42	39
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCOC1CCC1	ZINC000875251212	EE	On-Demand	Anodyne	CAPN1	49	39
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCOC1CCC1	ZINC000875251212	EE	On-Demand	Anodyne	CAPN2	91	39
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCOC1CCC1	ZINC000875251212	EE	On-Demand	Anodyne	NPR	41	33
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2CCN(c3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875251264	FD	On-Demand	Anodyne	EPHX2	24	40
CN(C)C[C@@H]1CN(C(=O)N[C@H]2CCN(c3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875251265	FD	On-Demand	Anodyne	EPHX2	24	40
N#Cc1cccc([C@H](NC(=O)NCCCN2CCCCC2=O)C(F)(F)F)c1	ZINC000875251269	GF	On-Demand	Mild	CCR3	26	44
N#Cc1cccc([C@@H](NC(=O)NCCCN2CCCCC2=O)C(F)(F)F)c1	ZINC000875251270	GF	On-Demand	Mild	CCR3	26	44
O=C1CCCCN1CCCNC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875251277	FE	On-Demand	Anodyne	TYRO3	19	42
CCc1ccc([C@H](C)NC(=O)/C=C\c2ccc3ccccc3n2)cc1	ZINC000875251286	EJ	On-Demand	Anodyne	KCNQ2	51	37
CCc1ccc([C@H](C)NC(=O)/C=C/c2ccc3ccccc3n2)cc1	ZINC000875251288	EJ	On-Demand	Anodyne	KCNQ2	51	37
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCN2CCCCC2=O)CC1	ZINC000875251294	GG	On-Demand	Anodyne	HTR1A	38	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCN2CCCCC2=O)CC1	ZINC000875251294	GG	On-Demand	Anodyne	DRD2	33	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCN2CCCCC2=O)CC1	ZINC000875251294	GG	On-Demand	Anodyne	ADRA1D	41	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCN2CCCCC2=O)CC1	ZINC000875251294	GG	On-Demand	Anodyne	ADRA1A	42	50
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCN2CCCCC2=O)CC1	ZINC000875251294	GG	On-Demand	Anodyne	TYRO3	23	46
COc1ccccc1[C@H]1CCCN(C(=O)NCCCN2CCCCC2=O)CC1	ZINC000875251296	GG	On-Demand	Anodyne	HTR1A	38	41
COc1ccccc1[C@H]1CCCN(C(=O)NCCCN2CCCCC2=O)CC1	ZINC000875251296	GG	On-Demand	Anodyne	DRD2	33	42
COc1ccccc1[C@H]1CCCN(C(=O)NCCCN2CCCCC2=O)CC1	ZINC000875251296	GG	On-Demand	Anodyne	ADRA1D	41	42
COc1ccccc1[C@H]1CCCN(C(=O)NCCCN2CCCCC2=O)CC1	ZINC000875251296	GG	On-Demand	Anodyne	ADRA1A	42	50
COc1ccccc1[C@H]1CCCN(C(=O)NCCCN2CCCCC2=O)CC1	ZINC000875251296	GG	On-Demand	Anodyne	TYRO3	23	46
COC(=O)C1CCC(NC(=O)NC2CC(C(=O)OC)C2)CC1	ZINC000875251305	DC	On-Demand	Anodyne	EPHX2	26	45
COC(=O)C1CCC(NC(=O)NCc2ccc(N(C)C(C)=O)cc2)CC1	ZINC000875251317	FE	On-Demand	Anodyne	EPHX2	18	43
COC(=O)C1CCC(NC(=O)NCc2ccc(O)c(Cl)c2)CC1	ZINC000875251324	EF	On-Demand	Anodyne	NCE103	15	45
CSCCOC(=O)/C=C/c1ccc(NS(C)(=O)=O)cc1	ZINC000875251325	DD	On-Demand	Anodyne	AKR1B10	19	40
CSCCOC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1	ZINC000875251326	DD	On-Demand	Anodyne	AKR1B10	19	40
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(=O)NCC[C@@H]1CCSC1	ZINC000875251327	GE	On-Demand	Anodyne	DRD4	33	45
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(=O)NCC[C@@H]1CCSC1	ZINC000875251327	GE	On-Demand	Anodyne	ACHE	39	46
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)NCC[C@H]1CCSC1	ZINC000875251329	GE	On-Demand	Anodyne	DRD4	33	45
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)NCC[C@H]1CCSC1	ZINC000875251329	GE	On-Demand	Anodyne	ACHE	39	46
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(=O)NCC[C@H]1CCSC1	ZINC000875251330	GE	On-Demand	Anodyne	DRD4	33	45
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(=O)NCC[C@H]1CCSC1	ZINC000875251330	GE	On-Demand	Anodyne	ACHE	39	46
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)NCC[C@@H]1CCSC1	ZINC000875251331	GE	On-Demand	Anodyne	DRD4	33	45
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)NCC[C@@H]1CCSC1	ZINC000875251331	GE	On-Demand	Anodyne	ACHE	39	46
CS(=O)(=O)Nc1ccc(/C=C/C(=O)OCC(=O)NCC2(N3CCOCC3)CCCCC2)cc1	ZINC000875251341	JD	On-Demand	Anodyne	HCN1	54	34
CS(=O)(=O)Nc1ccc(/C=C/C(=O)OCC(=O)NCC2(N3CCOCC3)CCCCC2)cc1	ZINC000875251341	JD	On-Demand	Anodyne	HCN4	50	32
CS(=O)(=O)Nc1ccc(/C=C\C(=O)OCC(=O)NCC2(N3CCOCC3)CCCCC2)cc1	ZINC000875251343	JD	On-Demand	Anodyne	HCN1	54	34
CS(=O)(=O)Nc1ccc(/C=C\C(=O)OCC(=O)NCC2(N3CCOCC3)CCCCC2)cc1	ZINC000875251343	JD	On-Demand	Anodyne	HCN4	50	32
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(c2ccccc2)C1	ZINC000875251361	CD	On-Demand	Anodyne	EPHX2	15	48
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(c2ccccc2)C1	ZINC000875251362	CD	On-Demand	Anodyne	EPHX2	15	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2ccccc2)C1	ZINC000875251377	EE	On-Demand	Anodyne	SLC6A4	28	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2ccccc2)C1	ZINC000875251377	EE	On-Demand	Anodyne	SLC6A3	56	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2ccccc2)C1	ZINC000875251379	EE	On-Demand	Anodyne	SLC6A4	28	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2ccccc2)C1	ZINC000875251379	EE	On-Demand	Anodyne	SLC6A3	56	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2ccccc2)C1	ZINC000875251381	EE	On-Demand	Anodyne	SLC6A4	28	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2ccccc2)C1	ZINC000875251381	EE	On-Demand	Anodyne	SLC6A3	56	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2ccccc2)C1	ZINC000875251384	EE	On-Demand	Anodyne	SLC6A4	28	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2ccccc2)C1	ZINC000875251384	EE	On-Demand	Anodyne	SLC6A3	56	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875251419	GD	On-Demand	Anodyne	DRD4	35	49
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875251419	GD	On-Demand	Anodyne	SLC6A1	66	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875251419	GD	On-Demand	Anodyne	SIGMAR1	35	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875251419	GD	On-Demand	Anodyne	MLNR	44	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875251419	GD	On-Demand	Anodyne	BIRC2	20	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875251420	GD	On-Demand	Anodyne	DRD4	35	49
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875251420	GD	On-Demand	Anodyne	SLC6A1	66	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875251420	GD	On-Demand	Anodyne	SIGMAR1	35	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875251420	GD	On-Demand	Anodyne	MLNR	44	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875251420	GD	On-Demand	Anodyne	BIRC2	20	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875251421	GD	On-Demand	Anodyne	DRD4	35	49
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875251421	GD	On-Demand	Anodyne	SLC6A1	66	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875251421	GD	On-Demand	Anodyne	SIGMAR1	35	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875251421	GD	On-Demand	Anodyne	MLNR	44	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875251421	GD	On-Demand	Anodyne	BIRC2	20	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875251422	GD	On-Demand	Anodyne	DRD4	35	49
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875251422	GD	On-Demand	Anodyne	SLC6A1	66	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875251422	GD	On-Demand	Anodyne	SIGMAR1	35	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875251422	GD	On-Demand	Anodyne	MLNR	44	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875251422	GD	On-Demand	Anodyne	BIRC2	20	40
COC(=O)C1CCC(NC(=O)N2CCC(C(C)=O)CC2)CC1	ZINC000875251431	DD	On-Demand	Anodyne	EPHX2	15	42
CCO[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1F)C1CCCC1	ZINC000875251468	DG	On-Demand	Bother	CACNA1D	55	35
O=C(COC(=O)c1cnc2ccccc2c1C(F)(F)F)Nc1cc(F)cc(F)c1	ZINC000875251469	HI	On-Demand	Anodyne	ATF1	44	32
O=C(COC(=O)c1cnc2ccccc2c1C(F)(F)F)Nc1cc(F)cc(F)c1	ZINC000875251469	HI	On-Demand	Anodyne	NFKB1	41	32
C[C@H]1CN(C(=O)N[C@@H](C)c2ccccc2)CC[C@@H](C(F)(F)F)O1	ZINC000875251488	EG	On-Demand	Anodyne	RBP4	40	36
C[C@H]1CN(C(=O)N[C@H](C)c2ccccc2)CC[C@H](C(F)(F)F)O1	ZINC000875251489	EG	On-Demand	Anodyne	RBP4	40	36
C[C@H]1CN(C(=O)N[C@H](C)c2ccccc2)CC[C@@H](C(F)(F)F)O1	ZINC000875251490	EG	On-Demand	Anodyne	RBP4	40	36
C[C@H]1CN(C(=O)N[C@@H](C)c2ccccc2)CC[C@H](C(F)(F)F)O1	ZINC000875251491	EG	On-Demand	Anodyne	RBP4	40	36
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N2CCO[C@H](C(F)F)CC2)C1	ZINC000875251508	GF	On-Demand	Anodyne	GPR119	22	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N2CCO[C@H](C(F)F)CC2)C1	ZINC000875251509	GF	On-Demand	Anodyne	GPR119	22	42
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N2CCO[C@@H](C(F)F)CC2)C1	ZINC000875251510	GF	On-Demand	Anodyne	GPR119	22	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N2CCO[C@@H](C(F)F)CC2)C1	ZINC000875251511	GF	On-Demand	Anodyne	GPR119	22	42
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCC[C@@H]2Cc2ccccc2)CC1	ZINC000875251515	FE	On-Demand	Anodyne	CCR3	32	41
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCC[C@H]2Cc2ccccc2)CC1	ZINC000875251517	FE	On-Demand	Anodyne	CCR3	32	41
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCC[C@H]2Cc2ccccc2)CC1	ZINC000875251519	FE	On-Demand	Anodyne	CCR3	32	41
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCC[C@@H]2Cc2ccccc2)CC1	ZINC000875251521	FE	On-Demand	Anodyne	CCR3	32	41
O=C(COC(=O)c1cnc2ccccc2c1C(F)(F)F)Nc1ccc(CN2CCOCC2)cc1	ZINC000875251523	JH	On-Demand	Anodyne	PIK3CA	22	41
O=C(COC(=O)c1cnc2ccccc2c1C(F)(F)F)Nc1ccc(CN2CCOCC2)cc1	ZINC000875251523	JH	On-Demand	Anodyne	MTOR	35	41
O=C(COC(=O)c1cnc2ccccc2c1C(F)(F)F)Nc1ccc(CN2CCOCC2)cc1	ZINC000875251523	JH	On-Demand	Anodyne	EPHX2	18	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)NC(C)(C)C(C)(C)O)C1	ZINC000875251527	FE	On-Demand	Anodyne	GPR119	26	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)NC(C)(C)C(C)(C)O)C1	ZINC000875251529	FE	On-Demand	Anodyne	GPR119	26	40
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1N(C)CC	ZINC000875251536	DE	On-Demand	Anodyne	ANPEP	19	44
O=C(NCCOC1CCC1)C(=O)N[C@@H]1CCN(c2ccc(Cl)cc2F)C1	ZINC000875251566	GD	On-Demand	Anodyne	LIPG	40	35
O=C(NCCOC1CCC1)C(=O)N[C@H]1CCN(c2ccc(Cl)cc2F)C1	ZINC000875251568	GD	On-Demand	Anodyne	LIPG	40	35
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)NCCN2CC[C@H](O)C2)C1	ZINC000875251585	FC	On-Demand	Anodyne	CACNA1I	41	33
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)NCCN2CC[C@H](O)C2)C1	ZINC000875251585	FC	On-Demand	Anodyne	GPR119	23	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)NCCN2CC[C@H](O)C2)C1	ZINC000875251587	FC	On-Demand	Anodyne	CACNA1I	41	33
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)NCCN2CC[C@H](O)C2)C1	ZINC000875251587	FC	On-Demand	Anodyne	GPR119	23	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)NCCN2CC[C@@H](O)C2)C1	ZINC000875251588	FC	On-Demand	Anodyne	CACNA1I	41	33
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)NCCN2CC[C@@H](O)C2)C1	ZINC000875251588	FC	On-Demand	Anodyne	GPR119	23	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)NCCN2CC[C@@H](O)C2)C1	ZINC000875251589	FC	On-Demand	Anodyne	CACNA1I	41	33
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)NCCN2CC[C@@H](O)C2)C1	ZINC000875251589	FC	On-Demand	Anodyne	GPR119	23	40
O=C(OCC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1cnc2ccccc2c1C(F)(F)F	ZINC000875251591	IH	On-Demand	Bother	EIF2AK3	42	32
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1CNC(=O)C(=O)NCCOC1CCC1	ZINC000875251597	FD	On-Demand	Anodyne	DRD4	19	48
C[C@H]1CN(Cc2ccccc2)C[C@H]1CNC(=O)C(=O)NCCOC1CCC1	ZINC000875251598	FD	On-Demand	Anodyne	DRD4	19	48
C[C@@H]1CN(Cc2ccccc2)C[C@H]1CNC(=O)C(=O)NCCOC1CCC1	ZINC000875251599	FD	On-Demand	Anodyne	DRD4	19	48
C[C@H]1CN(Cc2ccccc2)C[C@@H]1CNC(=O)C(=O)NCCOC1CCC1	ZINC000875251600	FD	On-Demand	Anodyne	DRD4	19	48
CS(=O)(=O)Nc1ccc(/C=C/C(=O)OCCCO)cc1	ZINC000875251651	CC	On-Demand	Anodyne	AKR1B10	33	44
CS(=O)(=O)Nc1ccc(/C=C\C(=O)OCCCO)cc1	ZINC000875251652	CC	On-Demand	Anodyne	AKR1B10	33	44
C[C@@H](OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1)C(=O)N(C)Cc1cccc(F)c1	ZINC000875251664	IF	On-Demand	Anodyne	GRIN1	15	42
C[C@@H](OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1)C(=O)N(C)Cc1cccc(F)c1	ZINC000875251664	IF	On-Demand	Anodyne	NR1H4	31	45
C[C@H](OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1)C(=O)N(C)Cc1cccc(F)c1	ZINC000875251665	IF	On-Demand	Anodyne	GRIN1	15	42
C[C@H](OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1)C(=O)N(C)Cc1cccc(F)c1	ZINC000875251665	IF	On-Demand	Anodyne	NR1H4	31	45
C[C@H](OC(=O)/C=C/c1ccc(NS(C)(=O)=O)cc1)C(=O)N(C)Cc1cccc(F)c1	ZINC000875251666	IF	On-Demand	Anodyne	GRIN1	15	42
C[C@H](OC(=O)/C=C/c1ccc(NS(C)(=O)=O)cc1)C(=O)N(C)Cc1cccc(F)c1	ZINC000875251666	IF	On-Demand	Anodyne	NR1H4	31	45
C[C@@H](OC(=O)/C=C/c1ccc(NS(C)(=O)=O)cc1)C(=O)N(C)Cc1cccc(F)c1	ZINC000875251667	IF	On-Demand	Anodyne	GRIN1	15	42
C[C@@H](OC(=O)/C=C/c1ccc(NS(C)(=O)=O)cc1)C(=O)N(C)Cc1cccc(F)c1	ZINC000875251667	IF	On-Demand	Anodyne	NR1H4	31	45
CS(=O)(=O)Nc1ccc(/C=C/C(=O)OCCOC(c2ccccc2)c2ccccc2)cc1	ZINC000875251689	JI	On-Demand	Anodyne	AKR1B10	30	45
CS(=O)(=O)Nc1ccc(/C=C\C(=O)OCCOC(c2ccccc2)c2ccccc2)cc1	ZINC000875251690	JI	On-Demand	Anodyne	AKR1B10	30	45
O=C(N[C@H]1CCN(c2ccccc2)C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875251716	FG	On-Demand	Anodyne	EPHX2	25	43
O=C(N[C@H]1CCN(c2ccccc2)C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875251717	FG	On-Demand	Anodyne	EPHX2	25	43
O=C(N[C@@H]1CCN(c2ccccc2)C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875251719	FG	On-Demand	Anodyne	EPHX2	25	43
O=C(N[C@@H]1CCN(c2ccccc2)C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875251720	FG	On-Demand	Anodyne	EPHX2	25	43
C[C@H](OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1)C(=O)N(C)CCOc1ccc(Cl)cc1	ZINC000875251725	JG	On-Demand	Anodyne	GRIN1	25	40
C[C@@H](OC(=O)/C=C/c1ccc(NS(C)(=O)=O)cc1)C(=O)N(C)CCOc1ccc(Cl)cc1	ZINC000875251727	JG	On-Demand	Anodyne	GRIN1	25	40
C[C@@H](OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1)C(=O)N(C)CCOc1ccc(Cl)cc1	ZINC000875251729	JG	On-Demand	Anodyne	GRIN1	25	40
C[C@H](OC(=O)/C=C/c1ccc(NS(C)(=O)=O)cc1)C(=O)N(C)CCOc1ccc(Cl)cc1	ZINC000875251731	JG	On-Demand	Anodyne	GRIN1	25	40
C[C@@H](OC(=O)/C=C/c1ccc(NS(C)(=O)=O)cc1)C(=O)N(C)Cc1c(F)cccc1Cl	ZINC000875251737	JG	On-Demand	Anodyne	GRIN1	20	40
C[C@@H](OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1)C(=O)N(C)Cc1c(F)cccc1Cl	ZINC000875251750	JG	On-Demand	Anodyne	GRIN1	20	40
C[C@H](OC(=O)/C=C/c1ccc(NS(C)(=O)=O)cc1)C(=O)N(C)Cc1c(F)cccc1Cl	ZINC000875251752	JG	On-Demand	Anodyne	GRIN1	20	40
C[C@H](OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1)C(=O)N(C)Cc1c(F)cccc1Cl	ZINC000875251754	JG	On-Demand	Anodyne	GRIN1	20	40
O=C(NCCO)C1CCN(C(=O)NCc2ccc(Br)cc2)CC1	ZINC000875251759	GD	On-Demand	Anodyne	EPHX2	20	46
COC(=O)C1CCC(NC(=O)N2CCC(N3CCN(C)CC3)CC2)CC1	ZINC000875251786	FD	On-Demand	Anodyne	L3MBTL3	47	41
COC(=O)C1CCC(NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)CC1	ZINC000875251791	FE	On-Demand	Anodyne	EPHX2	27	45
COC(=O)C1CCC(NC(=O)N2CCC[C@](O)(c3ccccc3)C2)CC1	ZINC000875251792	FE	On-Demand	Anodyne	EPHX2	27	45
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)NCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000875251844	GF	On-Demand	Anodyne	GPR119	32	40
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000875251845	GF	On-Demand	Anodyne	GPR119	32	40
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)Nc1c(C)noc1C	ZINC000875251853	CG	On-Demand	Bother	GSTM2	47	34
NC(=O)CCOC(=O)c1cccc(OC[C@H]2CCCO2)c1	ZINC000875251919	CD	On-Demand	Anodyne	CHRNA10	48	47
NC(=O)CCOC(=O)c1cccc(OC[C@@H]2CCCO2)c1	ZINC000875251921	CD	On-Demand	Anodyne	CHRNA10	48	47
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)c1cnc2ccccc2c1C(F)(F)F	ZINC000875251944	HE	On-Demand	Anodyne	CPT1A	87	41
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)c1cnc2ccccc2c1C(F)(F)F	ZINC000875251944	HE	On-Demand	Anodyne	CPT2	48	36
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)c1cnc2ccccc2c1C(F)(F)F	ZINC000875251944	HE	On-Demand	Anodyne	PREP	56	38
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)c1cnc2ccccc2c1C(F)(F)F	ZINC000875251953	HE	On-Demand	Anodyne	CPT1A	87	41
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)c1cnc2ccccc2c1C(F)(F)F	ZINC000875251953	HE	On-Demand	Anodyne	CPT2	48	36
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)c1cnc2ccccc2c1C(F)(F)F	ZINC000875251953	HE	On-Demand	Anodyne	PREP	56	38
O=C(COC(=O)c1cnc2ccccc2c1C(F)(F)F)N[C@H]1CCOc2ccccc21	ZINC000875251960	II	On-Demand	Anodyne	TRAR	51	41
O=C(COC(=O)c1cnc2ccccc2c1C(F)(F)F)N[C@@H]1CCOc2ccccc21	ZINC000875251965	II	On-Demand	Anodyne	TRAR	51	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N[C@@H]2CCCC[C@@H]2O)C1	ZINC000875251982	FE	On-Demand	Anodyne	GPR119	31	41
COCCOC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1	ZINC000875251986	CD	On-Demand	Anodyne	PTPRB	45	35
COCCOC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1	ZINC000875251986	CD	On-Demand	Anodyne	AKR1B10	36	45
CN1CCN(C(=O)N[C@H]2CCN(c3ccccc3)C2)CCC1(C)C	ZINC000875251988	EE	On-Demand	Anodyne	EPHX2	18	42
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N2CC[C@@H]3CC[C@@H](O)[C@@H]32)C1	ZINC000875251989	FE	On-Demand	Anodyne	GPR119	28	45
CN1CCN(C(=O)N[C@@H]2CCN(c3ccccc3)C2)CCC1(C)C	ZINC000875251990	EE	On-Demand	Anodyne	EPHX2	18	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N2CC[C@@H]3CC[C@@H](O)[C@@H]32)C1	ZINC000875251991	FE	On-Demand	Anodyne	GPR119	28	45
O=C1CCCCN1CCCNC(=O)N1Cc2cccc(O)c2C1	ZINC000875251992	DD	On-Demand	Clean	TYRO3	18	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N2CC=CC2)C1	ZINC000875251993	DE	On-Demand	Anodyne	GPR119	34	43
O=C(NCCCN1CCCCC1=O)NC1CC(Nc2ccccc2)C1	ZINC000875251994	EE	On-Demand	Anodyne	CCR3	31	40
O=C(NCCCN1CCCCC1=O)NC1CC(Nc2ccccc2)C1	ZINC000875251994	EE	On-Demand	Anodyne	TYRO3	21	45
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N2CC=CC2)C1	ZINC000875251995	DE	On-Demand	Anodyne	GPR119	34	43
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N(C2CC2)C2CC2)C1	ZINC000875251997	EF	On-Demand	Anodyne	GPR119	28	42
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N(C2CC2)C2CC2)C1	ZINC000875251999	EF	On-Demand	Anodyne	GPR119	28	42
NS(=O)(=O)c1ccc(OCCOC(=O)c2cnc3ccccc3c2C(F)(F)F)cc1	ZINC000875252037	IG	On-Demand	Anodyne	CA2	24	44
NS(=O)(=O)c1ccc(OCCOC(=O)c2cnc3ccccc3c2C(F)(F)F)cc1	ZINC000875252037	IG	On-Demand	Anodyne	CA1	22	44
NS(=O)(=O)c1ccc(OCCOC(=O)c2cnc3ccccc3c2C(F)(F)F)cc1	ZINC000875252037	IG	On-Demand	Anodyne	CA7	26	44
NS(=O)(=O)c1ccc(OCCOC(=O)c2cnc3ccccc3c2C(F)(F)F)cc1	ZINC000875252037	IG	On-Demand	Anodyne	CA12	19	44
NS(=O)(=O)c1ccc(OCCOC(=O)c2cnc3ccccc3c2C(F)(F)F)cc1	ZINC000875252037	IG	On-Demand	Anodyne	CA9	19	44
CCOC(=O)N1CCC(NC(=O)COC(=O)/C=C/c2ccc(NS(C)(=O)=O)cc2)CC1	ZINC000875252055	JD	On-Demand	Anodyne	CCR8	49	41
O=C(COC(=O)c1cnc2ccccc2c1C(F)(F)F)Nc1cc(Cl)ccc1-n1cncn1	ZINC000875252056	JI	On-Demand	Anodyne	F2	24	41
CCOC(=O)N1CCC(NC(=O)COC(=O)/C=C\c2ccc(NS(C)(=O)=O)cc2)CC1	ZINC000875252059	JD	On-Demand	Anodyne	CCR8	49	41
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)Nc2c(C)noc2C)C1	ZINC000875252069	GG	On-Demand	Anodyne	SLC12A5	41	35
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)Nc2c(C)noc2C)C1	ZINC000875252075	GG	On-Demand	Anodyne	SLC12A5	41	35
CO[C@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)Nc2c(C)noc2C)C1	ZINC000875252077	GG	On-Demand	Anodyne	SLC12A5	41	35
CO[C@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)Nc2c(C)noc2C)C1	ZINC000875252080	GG	On-Demand	Anodyne	SLC12A5	41	35
O=C(NCCCN1CCN(c2cccc(Cl)c2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875252093	GD	On-Demand	Anodyne	HTR1A	88	65
O=C(NCCCN1CCN(c2cccc(Cl)c2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875252093	GD	On-Demand	Anodyne	DRD2	75	58
O=C(NCCCN1CCN(c2cccc(Cl)c2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875252093	GD	On-Demand	Anodyne	DRD1	18	49
O=C(NCCCN1CCN(c2cccc(Cl)c2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875252093	GD	On-Demand	Anodyne	DRD4	49	48
O=C(NCCCN1CCN(c2cccc(Cl)c2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875252093	GD	On-Demand	Anodyne	ADRA1D	32	46
O=C(NCCCN1CCN(c2cccc(Cl)c2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875252093	GD	On-Demand	Anodyne	HTR2A	79	58
O=C(NCCCN1CCN(c2cccc(Cl)c2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875252093	GD	On-Demand	Anodyne	HTR2C	46	53
O=C(NCCCN1CCN(c2cccc(Cl)c2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875252093	GD	On-Demand	Anodyne	SLC6A4	23	53
O=C(NCCCN1CCN(c2cccc(Cl)c2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875252093	GD	On-Demand	Anodyne	ADRA1A	42	48
O=C(NCCCN1CCN(c2cccc(Cl)c2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875252093	GD	On-Demand	Anodyne	ADRA1B	28	46
O=C(NCCCN1CCN(c2cccc(Cl)c2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875252093	GD	On-Demand	Anodyne	DRD3	105	55
O=C(NCCCN1CCN(c2cccc(Cl)c2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875252093	GD	On-Demand	Anodyne	HTR7	87	50
O=C(NCCCN1CCN(c2cccc(Cl)c2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875252093	GD	On-Demand	Anodyne	NPY1R	15	42
O=C(NCCCN1CCN(c2cccc(Cl)c2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875252093	GD	On-Demand	Anodyne	CCR3	33	41
O=C(NCCCN1CCN(c2cccc(Cl)c2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875252093	GD	On-Demand	Anodyne	CACNA1I	37	42
O=C(COC(=O)c1cnc2ccccc2c1C(F)(F)F)Nc1ccc(N2CCCCC2)nc1	ZINC000875252135	JI	On-Demand	Anodyne	DGAT1	43	45
CCn1nc(C)c(CN(C)C(=O)C(=O)NCc2ccc(N(C)C)cc2C)c1C	ZINC000875252154	GE	On-Demand	Clean	P2RX7	21	45
CCOC1CC2(C1)C[C@H]2NC(=O)NC1CCC(C(=O)OC)CC1	ZINC000875252159	DD	On-Demand	Anodyne	EPHX2	24	40
CCOC1CC2(C1)C[C@@H]2NC(=O)NC1CCC(C(=O)OC)CC1	ZINC000875252164	DD	On-Demand	Anodyne	EPHX2	24	40
COc1ccc2c(COC(=O)c3cnc4ccccc4c3C(F)(F)F)cc(=O)oc2c1	ZINC000875252197	IJ	On-Demand	Anodyne	CYP11B1	17	40
COc1ccc2c(COC(=O)c3cnc4ccccc4c3C(F)(F)F)cc(=O)oc2c1	ZINC000875252197	IJ	On-Demand	Anodyne	MAOB	41	44
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875252231	FE	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875252231	FE	On-Demand	Anodyne	GPR119	32	42
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875252232	FE	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875252232	FE	On-Demand	Anodyne	GPR119	32	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875252233	FE	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875252233	FE	On-Demand	Anodyne	GPR119	32	42
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875252240	GD	On-Demand	Anodyne	CHRM2	16	41
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875252240	GD	On-Demand	Anodyne	DRD4	36	48
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875252240	GD	On-Demand	Anodyne	CHRM3	21	41
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875252240	GD	On-Demand	Anodyne	SIGMAR1	37	44
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875252240	GD	On-Demand	Anodyne	MLNR	66	36
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875252240	GD	On-Demand	Anodyne	CYP2J2	45	32
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875252242	GD	On-Demand	Anodyne	CHRM2	16	41
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875252242	GD	On-Demand	Anodyne	DRD4	36	48
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875252242	GD	On-Demand	Anodyne	CHRM3	21	41
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875252242	GD	On-Demand	Anodyne	SIGMAR1	37	44
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875252242	GD	On-Demand	Anodyne	MLNR	66	36
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875252242	GD	On-Demand	Anodyne	CYP2J2	45	32
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875252244	GD	On-Demand	Anodyne	CHRM2	16	41
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875252244	GD	On-Demand	Anodyne	DRD4	36	48
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875252244	GD	On-Demand	Anodyne	CHRM3	21	41
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875252244	GD	On-Demand	Anodyne	SIGMAR1	37	44
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875252244	GD	On-Demand	Anodyne	MLNR	66	36
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875252244	GD	On-Demand	Anodyne	CYP2J2	45	32
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875252246	GD	On-Demand	Anodyne	CHRM2	16	41
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875252246	GD	On-Demand	Anodyne	DRD4	36	48
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875252246	GD	On-Demand	Anodyne	CHRM3	21	41
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875252246	GD	On-Demand	Anodyne	SIGMAR1	37	44
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875252246	GD	On-Demand	Anodyne	MLNR	66	36
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875252246	GD	On-Demand	Anodyne	CYP2J2	45	32
COC(=O)C1CCC(NC(=O)NCc2cc(C(F)(F)F)cc(Cl)n2)CC1	ZINC000875252271	GG	On-Demand	Anodyne	CCR2	43	35
O=C(NC[C@@H]1CCc2ccccc2C1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875252273	FE	On-Demand	Anodyne	PREP	28	44
O=C(NC[C@@H]1CCc2ccccc2C1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875252275	FE	On-Demand	Anodyne	PREP	28	44
O=C(NC[C@@H]1CCc2ccccc2C1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875252278	FE	On-Demand	Anodyne	PREP	28	44
O=C(NC[C@@H]1CCc2ccccc2C1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875252280	FE	On-Demand	Anodyne	PREP	28	44
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875252296	GE	On-Demand	Anodyne	DRD2	20	50
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875252296	GE	On-Demand	Anodyne	DRD4	43	50
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875252296	GE	On-Demand	Anodyne	ACHE	39	41
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875252296	GE	On-Demand	Anodyne	DRD3	20	50
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875252296	GE	On-Demand	Anodyne	SIGMAR1	38	42
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875252296	GE	On-Demand	Anodyne	MCHR1	15	46
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875252297	GE	On-Demand	Anodyne	DRD2	20	50
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875252297	GE	On-Demand	Anodyne	DRD4	43	50
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875252297	GE	On-Demand	Anodyne	ACHE	39	41
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875252297	GE	On-Demand	Anodyne	DRD3	20	50
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875252297	GE	On-Demand	Anodyne	SIGMAR1	38	42
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875252297	GE	On-Demand	Anodyne	MCHR1	15	46
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875252298	GE	On-Demand	Anodyne	DRD2	20	50
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875252298	GE	On-Demand	Anodyne	DRD4	43	50
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875252298	GE	On-Demand	Anodyne	ACHE	39	41
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875252298	GE	On-Demand	Anodyne	DRD3	20	50
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875252298	GE	On-Demand	Anodyne	SIGMAR1	38	42
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875252298	GE	On-Demand	Anodyne	MCHR1	15	46
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875252299	GE	On-Demand	Anodyne	DRD2	20	50
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875252299	GE	On-Demand	Anodyne	DRD4	43	50
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875252299	GE	On-Demand	Anodyne	ACHE	39	41
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875252299	GE	On-Demand	Anodyne	DRD3	20	50
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875252299	GE	On-Demand	Anodyne	SIGMAR1	38	42
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875252299	GE	On-Demand	Anodyne	MCHR1	15	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCc2ccc(F)cc21	ZINC000875252314	EF	On-Demand	Anodyne	SLC6A3	34	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCc2ccc(F)cc21	ZINC000875252315	EF	On-Demand	Anodyne	SLC6A3	34	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCc2ccc(F)cc21	ZINC000875252317	EF	On-Demand	Anodyne	SLC6A3	34	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCc2ccc(F)cc21	ZINC000875252319	EF	On-Demand	Anodyne	SLC6A3	34	41
O=C(OCc1ccc2ccccc2n1)c1cnc2ccccc2c1C(F)(F)F	ZINC000875252321	GK	On-Demand	Anodyne	CYSLTR1	66	42
O=C(OCc1ccc2ccccc2n1)c1cnc2ccccc2c1C(F)(F)F	ZINC000875252321	GK	On-Demand	Anodyne	ALOX5AP	42	40
C#Cc1cccc(N(CC(=O)N2CCOCC2)C(=O)[C@H]2CCCN2C(C)=O)c1	ZINC000875252358	GC	On-Demand	Mild	PREP	40	35
N#CCN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875252361	FD	On-Demand	Mild	DRD4	17	44
N#CCN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875252361	FD	On-Demand	Mild	SIGMAR1	17	49
N#CCN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875252361	FD	On-Demand	Mild	CCR3	23	40
N#CCN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875252361	FD	On-Demand	Mild	EPHX2	16	42
N#CCN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875252361	FD	On-Demand	Mild	CTSV	29	40
N#CCN1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875252361	FD	On-Demand	Mild	MCHR1	21	41
N#CCN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875252362	FD	On-Demand	Mild	DRD4	17	44
N#CCN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875252362	FD	On-Demand	Mild	SIGMAR1	17	49
N#CCN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875252362	FD	On-Demand	Mild	CCR3	23	40
N#CCN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875252362	FD	On-Demand	Mild	EPHX2	16	42
N#CCN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875252362	FD	On-Demand	Mild	CTSV	29	40
N#CCN1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875252362	FD	On-Demand	Mild	MCHR1	21	41
O=C(NCCS(=O)(=O)N1CCSCC1)NC1CC(Nc2ccccc2)C1	ZINC000875252395	GD	On-Demand	Anodyne	PTPN2	43	33
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875252469	FE	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875252469	FE	On-Demand	Anodyne	GPR119	32	42
COC(=O)N(C)NC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000875252501	GD	On-Demand	Reactive	HTR1A	115	59
COC(=O)N(C)NC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000875252501	GD	On-Demand	Reactive	DRD2	92	57
COC(=O)N(C)NC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000875252501	GD	On-Demand	Reactive	DRD1	22	48
COC(=O)N(C)NC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000875252501	GD	On-Demand	Reactive	DRD4	56	53
COC(=O)N(C)NC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000875252501	GD	On-Demand	Reactive	ADRA1D	59	51
COC(=O)N(C)NC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000875252501	GD	On-Demand	Reactive	HTR2A	91	57
COC(=O)N(C)NC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000875252501	GD	On-Demand	Reactive	HTR2C	52	54
COC(=O)N(C)NC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000875252501	GD	On-Demand	Reactive	SLC6A4	26	54
COC(=O)N(C)NC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000875252501	GD	On-Demand	Reactive	ADRA1A	75	51
COC(=O)N(C)NC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000875252501	GD	On-Demand	Reactive	ADRA1B	49	51
COC(=O)N(C)NC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000875252501	GD	On-Demand	Reactive	DRD3	122	54
COC(=O)N(C)NC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000875252501	GD	On-Demand	Reactive	HTR4	25	45
COC(=O)N(C)NC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000875252501	GD	On-Demand	Reactive	DRD5	19	41
COC(=O)N(C)NC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000875252501	GD	On-Demand	Reactive	HRP1_PLAFA	60	37
COC(=O)N(C)NC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000875252501	GD	On-Demand	Reactive	HTR7	122	52
COC(=O)N(C)NC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000875252501	GD	On-Demand	Reactive	NPY1R	15	42
COC(=O)N(C)NC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000875252501	GD	On-Demand	Reactive	CCR3	28	41
COC(=O)N(C)NC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000875252501	GD	On-Demand	Reactive	HTR6	15	52
COC(=O)N(C)NC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000875252501	GD	On-Demand	Reactive	CACNA1G	18	48
O=C1CCCCN1CCCNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875252522	FD	On-Demand	Anodyne	TYRO3	19	43
O=C(NCCCN1CCCCC1=O)NNc1cccc(F)c1Br	ZINC000875252585	GF	On-Demand	Reactive	TYRO3	19	41
C[C@@H]1CN(C(=O)NCc2nnnn2-c2ccccc2)CC[C@H](C(F)(F)F)O1	ZINC000875252594	GD	On-Demand	Anodyne	TACR1	23	41
C[C@@H]1CN(C(=O)NCc2nnnn2-c2ccccc2)CC[C@@H](C(F)(F)F)O1	ZINC000875252600	GD	On-Demand	Anodyne	TACR1	23	41
CS(=O)(=O)Nc1ccc(/C=C/C(=O)OCc2csc(COc3ccc(Cl)cc3)n2)cc1	ZINC000875252620	JJ	On-Demand	Anodyne	GRIN1	26	41
CS(=O)(=O)Nc1ccc(/C=C\C(=O)OCc2csc(COc3ccc(Cl)cc3)n2)cc1	ZINC000875252624	JJ	On-Demand	Anodyne	GRIN1	26	41
CN(Cc1ccns1)C(=O)NCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000875252630	FF	On-Demand	Anodyne	GPR119	33	42
CN(Cc1ccns1)C(=O)NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000875252633	FF	On-Demand	Anodyne	GPR119	33	42
O=C1CCCCN1CCCNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875252653	GF	On-Demand	Anodyne	ADRA1A	15	40
O=C1CCCCN1CCCNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875252653	GF	On-Demand	Anodyne	OPRL1	15	43
O=C1CCCCN1CCCNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875252653	GF	On-Demand	Anodyne	TYRO3	19	42
CS(=O)(=O)Nc1ccc(/C=C\C(=O)OCc2ccccn2)cc1	ZINC000875252675	EE	On-Demand	Anodyne	AKR1B10	22	43
CCO[C@H]1COCC[C@@H]1NC(=O)C(=O)N[C@@H](C)c1ccc(C(F)(F)F)nc1	ZINC000875252679	GD	On-Demand	Anodyne	CCR2	26	41
CCO[C@H]1COCC[C@H]1NC(=O)C(=O)N[C@H](C)c1ccc(C(F)(F)F)nc1	ZINC000875252682	GD	On-Demand	Anodyne	CCR2	26	41
CCO[C@H]1COCC[C@H]1NC(=O)C(=O)N[C@@H](C)c1ccc(C(F)(F)F)nc1	ZINC000875252683	GD	On-Demand	Anodyne	CCR2	26	41
CCO[C@H]1COCC[C@@H]1NC(=O)C(=O)N[C@H](C)c1ccc(C(F)(F)F)nc1	ZINC000875252686	GD	On-Demand	Anodyne	CCR2	26	41
O=C(NC[C@H]1CCc2ccccc2C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875252693	FC	On-Demand	Anodyne	PREP	34	44
O=C(NC[C@@H]1CCc2ccccc2C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875252699	FC	On-Demand	Anodyne	PREP	34	44
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N2CC(Cc3ccco3)C2)C1	ZINC000875252703	GG	On-Demand	Anodyne	GPR119	33	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N2CC(Cc3ccco3)C2)C1	ZINC000875252705	GG	On-Demand	Anodyne	GPR119	33	42
COC(=O)C1CCC(NC(=O)NC2CCN(c3ccccc3C#N)CC2)CC1	ZINC000875252710	GF	On-Demand	Mild	HTR1A	22	41
COC(=O)C1CCC(NC(=O)NC2CCN(c3ccccc3C#N)CC2)CC1	ZINC000875252710	GF	On-Demand	Mild	AR	22	43
COC(=O)C1CCC(NC(=O)NC2CCN(c3ccccc3C#N)CC2)CC1	ZINC000875252710	GF	On-Demand	Mild	DRD2	27	43
COC(=O)C1CCC(NC(=O)NC2CCN(c3ccccc3C#N)CC2)CC1	ZINC000875252710	GF	On-Demand	Mild	DRD4	22	42
COC(=O)C1CCC(NC(=O)NC2CCN(c3ccccc3C#N)CC2)CC1	ZINC000875252710	GF	On-Demand	Mild	ADRA1D	30	43
COC(=O)C1CCC(NC(=O)NC2CCN(c3ccccc3C#N)CC2)CC1	ZINC000875252710	GF	On-Demand	Mild	ADRA1A	23	43
COC(=O)C1CCC(NC(=O)NC2CCN(c3ccccc3C#N)CC2)CC1	ZINC000875252710	GF	On-Demand	Mild	ADRA1B	24	43
COC(=O)C1CCC(NC(=O)NC2CCN(c3ccccc3C#N)CC2)CC1	ZINC000875252710	GF	On-Demand	Mild	DRD3	20	42
COC(=O)C1CCC(NC(=O)NC2CCN(c3ccccc3C#N)CC2)CC1	ZINC000875252710	GF	On-Demand	Mild	NPY1R	18	40
COC(=O)C1CCC(NC(=O)NC2CCN(c3ccccc3C#N)CC2)CC1	ZINC000875252710	GF	On-Demand	Mild	EPHX2	33	40
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N1CC[C@@H]2[C@H](CCN2C)C1	ZINC000875252743	GD	On-Demand	Anodyne	DRD4	35	48
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N1CC[C@@H]2[C@H](CCN2C)C1	ZINC000875252743	GD	On-Demand	Anodyne	SIGMAR1	33	42
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N1CC[C@@H]2[C@H](CCN2C)C1	ZINC000875252743	GD	On-Demand	Anodyne	MLNR	46	36
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N1CC[C@@H]2[C@@H](CCN2C)C1	ZINC000875252745	GD	On-Demand	Anodyne	DRD4	35	48
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N1CC[C@@H]2[C@@H](CCN2C)C1	ZINC000875252745	GD	On-Demand	Anodyne	SIGMAR1	33	42
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N1CC[C@@H]2[C@@H](CCN2C)C1	ZINC000875252745	GD	On-Demand	Anodyne	MLNR	46	36
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N1CC[C@H]2[C@@H](CCN2C)C1	ZINC000875252747	GD	On-Demand	Anodyne	DRD4	35	48
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N1CC[C@H]2[C@@H](CCN2C)C1	ZINC000875252747	GD	On-Demand	Anodyne	SIGMAR1	33	42
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N1CC[C@H]2[C@@H](CCN2C)C1	ZINC000875252747	GD	On-Demand	Anodyne	MLNR	46	36
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N1CC[C@H]2[C@H](CCN2C)C1	ZINC000875252750	GD	On-Demand	Anodyne	DRD4	35	48
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N1CC[C@H]2[C@H](CCN2C)C1	ZINC000875252750	GD	On-Demand	Anodyne	SIGMAR1	33	42
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(=O)N1CC[C@H]2[C@H](CCN2C)C1	ZINC000875252750	GD	On-Demand	Anodyne	MLNR	46	36
CN(C)S(=O)(=O)c1ccc(OCCOC(=O)c2cnc3ccccc3c2C(F)(F)F)cc1	ZINC000875252761	JH	On-Demand	Anodyne	MMP13	15	42
COC(=O)C1CCC(NC(=O)N[C@H](C)c2ccc(C(F)(F)F)nc2)CC1	ZINC000875252771	FG	On-Demand	Anodyne	EPHX2	42	37
COC(=O)C1CCC(NC(=O)N[C@@H](C)c2ccc(C(F)(F)F)nc2)CC1	ZINC000875252774	FG	On-Demand	Anodyne	EPHX2	42	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCc3ccccc3C2)C1	ZINC000875252777	ED	On-Demand	Anodyne	PREP	52	48
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCc3ccccc3C2)C1	ZINC000875252780	ED	On-Demand	Anodyne	PREP	52	48
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCc3ccccc3C2)C1	ZINC000875252782	ED	On-Demand	Anodyne	PREP	52	48
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCc3ccccc3C2)C1	ZINC000875252783	ED	On-Demand	Anodyne	PREP	52	48
O=C(NCc1ccc(C(F)F)cc1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875252784	GF	On-Demand	Anodyne	F2	32	41
O=C(NCc1ccc(C(F)F)cc1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875252784	GF	On-Demand	Anodyne	TMPRSS11D	65	35
O=C(NCc1ccc(C(F)F)cc1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875252786	GF	On-Demand	Anodyne	F2	32	41
O=C(NCc1ccc(C(F)F)cc1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875252786	GF	On-Demand	Anodyne	TMPRSS11D	65	35
O=C(NCc1ccc(C(F)F)cc1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875252788	GF	On-Demand	Anodyne	F2	32	41
O=C(NCc1ccc(C(F)F)cc1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875252788	GF	On-Demand	Anodyne	TMPRSS11D	65	35
O=C(NCc1ccc(C(F)F)cc1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875252790	GF	On-Demand	Anodyne	F2	32	41
O=C(NCc1ccc(C(F)F)cc1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875252790	GF	On-Demand	Anodyne	TMPRSS11D	65	35
COC(=O)C1CCC(NC(=O)N2CCc3cc(OC)c(OC)cc3[C@@H]2C)CC1	ZINC000875252793	GG	On-Demand	Anodyne	SLC18A2	46	34
COC(=O)C1CCC(NC(=O)N2CCc3cc(OC)c(OC)cc3[C@H]2C)CC1	ZINC000875252794	GG	On-Demand	Anodyne	SLC18A2	46	34
O=C(NC[C@H]1CCc2ccccc2C1)C(=O)N[C@H]1CC12CCC2	ZINC000875252796	DD	On-Demand	Anodyne	PREP	26	42
O=C(NC[C@@H]1CCc2ccccc2C1)C(=O)N[C@H]1CC12CCC2	ZINC000875252797	DD	On-Demand	Anodyne	PREP	26	42
O=C(NC[C@@H]1CCc2ccccc2C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875252798	DD	On-Demand	Anodyne	PREP	26	42
O=C(NC[C@H]1CCc2ccccc2C1)C(=O)N[C@@H]1CC12CCC2	ZINC000875252799	DD	On-Demand	Anodyne	PREP	26	42
COC(=O)C1CCC(NC(=O)N[C@@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875252800	FG	On-Demand	Anodyne	CHRNA7	43	38
COC(=O)C1CCC(NC(=O)N[C@@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875252800	FG	On-Demand	Anodyne	C3AR1	43	43
COC(=O)C1CCC(NC(=O)N[C@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875252801	FG	On-Demand	Anodyne	CHRNA7	43	38
COC(=O)C1CCC(NC(=O)N[C@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875252801	FG	On-Demand	Anodyne	C3AR1	43	43
CC[C@@H](NC(=O)NC1CCN(CC#N)CC1)[C@H](O)c1ccccc1	ZINC000875252828	ED	On-Demand	Mild	CCR5	19	40
CC[C@@H](NC(=O)NC1CCN(CC#N)CC1)[C@@H](O)c1ccccc1	ZINC000875252830	ED	On-Demand	Mild	CCR5	19	40
COC(=O)C1CCC(NC(=O)NCc2nc(-c3ccncc3)cs2)CC1	ZINC000875252897	FF	On-Demand	Anodyne	ROCK1	27	44
COC(=O)C1CCC(NC(=O)NCc2nc(-c3ccncc3)cs2)CC1	ZINC000875252897	FF	On-Demand	Anodyne	ROCK2	20	44
COC(=O)C1CCC(NC(=O)N2CCN(c3ccc(C#N)nc3)CC2)CC1	ZINC000875252930	FD	On-Demand	Mild	PTR1	43	31
Cc1ccc2c(c1)[C@H](NC(=O)N1CCC[C@H](OC3CCC3)CC1)CC2	ZINC000875252955	EI	On-Demand	Anodyne	EPHX2	18	40
Cc1ccc2c(c1)[C@H](NC(=O)N1CCC[C@@H](OC3CCC3)CC1)CC2	ZINC000875252958	EI	On-Demand	Anodyne	EPHX2	18	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCN1CCCCC1=O	ZINC000875252982	ED	On-Demand	Anodyne	TYRO3	19	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(c2ccccc2)C1	ZINC000875252986	DE	On-Demand	Anodyne	EPHX2	17	42
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(c2ccccc2)C1	ZINC000875252987	DE	On-Demand	Anodyne	EPHX2	17	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000875253003	EE	On-Demand	Anodyne	ACE	33	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000875253003	EE	On-Demand	Anodyne	P2RY12	79	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000875253003	EE	On-Demand	Anodyne	BIRC2	26	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(c3ccccc3)C2)C1	ZINC000875253006	EE	On-Demand	Anodyne	ACE	33	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(c3ccccc3)C2)C1	ZINC000875253006	EE	On-Demand	Anodyne	P2RY12	79	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(c3ccccc3)C2)C1	ZINC000875253006	EE	On-Demand	Anodyne	BIRC2	26	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)NCC2CC(O)C2)C1	ZINC000875253027	ED	On-Demand	Anodyne	CACNA1I	46	34
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)NCC2CC(O)C2)C1	ZINC000875253027	ED	On-Demand	Anodyne	GPR119	26	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875253029	ED	On-Demand	Anodyne	CACNA1I	46	34
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875253029	ED	On-Demand	Anodyne	GPR119	26	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)NCC2CC(O)C2)C1	ZINC000875253031	ED	On-Demand	Anodyne	CACNA1I	46	34
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)NCC2CC(O)C2)C1	ZINC000875253031	ED	On-Demand	Anodyne	GPR119	26	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)NC[C@@H]2C[C@H](O)C2)C1	ZINC000875253033	ED	On-Demand	Anodyne	CACNA1I	46	34
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)NC[C@@H]2C[C@H](O)C2)C1	ZINC000875253033	ED	On-Demand	Anodyne	GPR119	26	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)NC[C@@H]2C[C@H](O)C2)C1	ZINC000875253035	ED	On-Demand	Anodyne	CACNA1I	46	34
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)NC[C@@H]2C[C@H](O)C2)C1	ZINC000875253035	ED	On-Demand	Anodyne	GPR119	26	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875253036	ED	On-Demand	Anodyne	CACNA1I	46	34
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875253036	ED	On-Demand	Anodyne	GPR119	26	40
O=C(NCCOC1CCC1)C(=O)N[C@H](c1ccccn1)C1CCC1	ZINC000875253038	ED	On-Demand	Anodyne	TTK	27	40
O=C(NCCOC1CCC1)C(=O)N[C@@H](c1ccccn1)C1CCC1	ZINC000875253039	ED	On-Demand	Anodyne	TTK	27	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N2CCCC(F)(F)CC2)C1	ZINC000875253045	GG	On-Demand	Anodyne	GPR119	25	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N2CCCC(F)(F)CC2)C1	ZINC000875253046	GG	On-Demand	Anodyne	GPR119	25	41
O=C(NCCCN1CCCCC1=O)NCC[C@H](O)C1CCCC1	ZINC000875253062	ED	On-Demand	Anodyne	TYRO3	20	41
O=C(NCCCN1CCCCC1=O)NCC[C@@H](O)C1CCCC1	ZINC000875253064	ED	On-Demand	Anodyne	TYRO3	20	41
CS(=O)(=O)Nc1ccc(/C=C\C(=O)OCc2cc(-c3ccccc3)no2)cc1	ZINC000875253071	GG	On-Demand	Anodyne	HDAC1	19	41
CS(=O)(=O)Nc1ccc(/C=C\C(=O)OCc2cc(-c3ccccc3)no2)cc1	ZINC000875253071	GG	On-Demand	Anodyne	AKR1B10	16	41
CCOc1ccccc1COC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1	ZINC000875253077	GG	On-Demand	Anodyne	AKR1B10	21	42
O=C(N[C@H]1CCN(c2ccc(F)cc2F)C1)N1CCC(CO)(CO)CC1	ZINC000875253099	FD	On-Demand	Anodyne	CCR3	24	41
O=C(N[C@@H]1CCN(c2ccc(F)cc2F)C1)N1CCC(CO)(CO)CC1	ZINC000875253101	FD	On-Demand	Anodyne	CCR3	24	41
O=C(NCCCN1CCCCC1=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875253107	FD	On-Demand	Anodyne	HRH2	26	44
O=C(NCCCN1CCCCC1=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875253107	FD	On-Demand	Anodyne	PTGER4	25	44
O=C(NCCCN1CCCCC1=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875253107	FD	On-Demand	Anodyne	DPP7	15	41
O=C(NCCCN1CCCCC1=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875253107	FD	On-Demand	Anodyne	TYRO3	21	48
O=C(NCCCN1CCCCC1=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875253109	FD	On-Demand	Anodyne	HRH2	26	44
O=C(NCCCN1CCCCC1=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875253109	FD	On-Demand	Anodyne	PTGER4	25	44
O=C(NCCCN1CCCCC1=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875253109	FD	On-Demand	Anodyne	DPP7	15	41
O=C(NCCCN1CCCCC1=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875253109	FD	On-Demand	Anodyne	TYRO3	21	48
CN(C(=O)NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1)[C@@H]1CCCC[C@H]1O	ZINC000875253116	FF	On-Demand	Anodyne	GPR119	28	40
CN(C(=O)NCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)[C@@H]1CCCC[C@H]1O	ZINC000875253118	FF	On-Demand	Anodyne	GPR119	28	40
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)C1(C)CC(F)(F)C1	ZINC000875253167	GE	On-Demand	Anodyne	HRH4	15	40
COCCN(CCCc1ccccc1)C(=O)C1(F)CCOCC1	ZINC000875253226	DF	On-Demand	Anodyne	AMY2	51	29
O=C(N[C@@H](c1ccccc1)C1CCOCC1)C(=O)N1CCC(CCF)CC1	ZINC000875253307	GF	On-Demand	Anodyne	CTSS	15	40
CN1CCN(C2CCN(C(=O)C(=O)NCc3ccc(C(F)F)cc3)CC2)CC1	ZINC000875253308	GD	On-Demand	Anodyne	L3MBTL3	78	40
O=C(N[C@H](c1ccccc1)C1CCOCC1)C(=O)N1CCC(CCF)CC1	ZINC000875253309	GF	On-Demand	Anodyne	CTSS	15	40
O=C(N[C@H]1CCN(c2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875253321	DF	On-Demand	Clean	EPHX2	15	41
O=C(N[C@@H]1CCN(c2ccccc2)C1)N1Cc2cccc(O)c2C1	ZINC000875253322	DF	On-Demand	Clean	EPHX2	15	41
C[C@@H](OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1)C(=O)NCCc1ccc2c(c1)OCCO2	ZINC000875253323	JE	On-Demand	Anodyne	GRIN1	27	47
C[C@@H](OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1)C(=O)NCCc1ccc2c(c1)OCCO2	ZINC000875253323	JE	On-Demand	Anodyne	TRPV1	24	48
C[C@H](OC(=O)/C=C/c1ccc(NS(C)(=O)=O)cc1)C(=O)NCCc1ccc2c(c1)OCCO2	ZINC000875253324	JE	On-Demand	Anodyne	GRIN1	27	47
C[C@H](OC(=O)/C=C/c1ccc(NS(C)(=O)=O)cc1)C(=O)NCCc1ccc2c(c1)OCCO2	ZINC000875253324	JE	On-Demand	Anodyne	TRPV1	24	48
C[C@H](OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1)C(=O)NCCc1ccc2c(c1)OCCO2	ZINC000875253326	JE	On-Demand	Anodyne	GRIN1	27	47
C[C@H](OC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1)C(=O)NCCc1ccc2c(c1)OCCO2	ZINC000875253326	JE	On-Demand	Anodyne	TRPV1	24	48
CC[C@@H]1CCC[C@H](NC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)C1	ZINC000875253327	GG	On-Demand	Anodyne	ETHR	55	47
C[C@@H](OC(=O)/C=C/c1ccc(NS(C)(=O)=O)cc1)C(=O)NCCc1ccc2c(c1)OCCO2	ZINC000875253328	JE	On-Demand	Anodyne	GRIN1	27	47
C[C@@H](OC(=O)/C=C/c1ccc(NS(C)(=O)=O)cc1)C(=O)NCCc1ccc2c(c1)OCCO2	ZINC000875253328	JE	On-Demand	Anodyne	TRPV1	24	48
CC[C@@H]1CCC[C@@H](NC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)C1	ZINC000875253329	GG	On-Demand	Anodyne	ETHR	55	47
CC[C@H]1CCC[C@@H](NC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)C1	ZINC000875253331	GG	On-Demand	Anodyne	ETHR	55	47
CC[C@H]1CCC[C@H](NC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)C1	ZINC000875253333	GG	On-Demand	Anodyne	ETHR	55	47
O=C1CCCCN1CCCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875253341	FF	On-Demand	Anodyne	TYRO3	20	43
O=C1CCCCN1CCCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875253343	FF	On-Demand	Anodyne	TYRO3	20	43
O=C1CCCCN1CCCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875253345	FF	On-Demand	Anodyne	TYRO3	20	43
O=C1CCCCN1CCCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875253347	FF	On-Demand	Anodyne	TYRO3	20	43
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875253352	GG	On-Demand	Clean	GPR119	34	44
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875253354	GG	On-Demand	Clean	GPR119	34	44
CN1CCO[C@H](CN(C)C(=O)NCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)C1	ZINC000875253355	GD	On-Demand	Anodyne	GPR119	20	41
CN1CCO[C@H](CN(C)C(=O)NCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)C1	ZINC000875253356	GD	On-Demand	Anodyne	GPR119	20	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875253396	GF	On-Demand	Anodyne	GPR119	29	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875253397	GF	On-Demand	Anodyne	GPR119	29	41
CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1	ZINC000875253398	ID	On-Demand	Anodyne	FKBP1A	45	37
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875253399	GF	On-Demand	Anodyne	GPR119	29	41
CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)/C=C/c1ccc(NS(C)(=O)=O)cc1	ZINC000875253400	ID	On-Demand	Anodyne	FKBP1A	45	37
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875253401	GF	On-Demand	Anodyne	GPR119	29	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N2CC3(CCCO3)C2)C1	ZINC000875253416	FE	On-Demand	Anodyne	GPR119	20	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N2CC3(CCCO3)C2)C1	ZINC000875253418	FE	On-Demand	Anodyne	GPR119	20	40
O=C(N[C@H]1CCN(c2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875253425	ED	On-Demand	Anodyne	EPHX2	22	41
O=C(N[C@@H]1CCN(c2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875253427	ED	On-Demand	Anodyne	EPHX2	22	41
CCc1ccc([C@H](C)NC(=O)/C=C\c2cnc3ccccc3n2)cc1	ZINC000875253428	EI	On-Demand	Anodyne	KCNQ2	52	39
CCc1ccc([C@H](C)NC(=O)/C=C\c2cnc3ccccc3n2)cc1	ZINC000875253428	EI	On-Demand	Anodyne	UL26	62	38
CCc1ccc([C@H](C)NC(=O)/C=C\c2cnc3ccccc3n2)cc1	ZINC000875253428	EI	On-Demand	Anodyne	SCAF_EBVB9	54	35
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N2CC[C@H]3CC[C@@H](C2)[S@@]3=O)C1	ZINC000875253441	GE	On-Demand	Anodyne	GPR119	30	44
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N2CC[C@H]3CC[C@@H](C2)[S@]3=O)C1	ZINC000875253443	GE	On-Demand	Anodyne	GPR119	30	44
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N2CC[C@H]3CC[C@@H](C2)[S@@]3=O)C1	ZINC000875253445	GE	On-Demand	Anodyne	GPR119	30	44
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N2CC[C@H]3CC[C@@H](C2)[S@]3=O)C1	ZINC000875253447	GE	On-Demand	Anodyne	GPR119	30	44
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)NCC[C@H](O)C(F)F)C1	ZINC000875253477	FD	On-Demand	Anodyne	GPR119	23	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)NCC[C@@H](O)C(F)F)C1	ZINC000875253479	FD	On-Demand	Anodyne	GPR119	23	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)NCC[C@H](O)C(F)F)C1	ZINC000875253481	FD	On-Demand	Anodyne	GPR119	23	41
O=C(COC(=O)c1cnc2ccccc2c1C(F)(F)F)NCC1(c2ccccc2)CC1	ZINC000875253482	II	On-Demand	Anodyne	KCNA3	42	35
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)NCC[C@@H](O)C(F)F)C1	ZINC000875253483	FD	On-Demand	Anodyne	GPR119	23	41
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NC1CCN(CC#N)CC1	ZINC000875253485	GF	On-Demand	Mild	DRD4	20	41
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NC1CCN(CC#N)CC1	ZINC000875253485	GF	On-Demand	Mild	LTA4H	15	41
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NC1CCN(CC#N)CC1	ZINC000875253485	GF	On-Demand	Mild	SIGMAR1	27	44
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NC1CCN(CC#N)CC1	ZINC000875253485	GF	On-Demand	Mild	MCHR1	16	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)C1	ZINC000875253559	GE	On-Demand	Anodyne	GPR119	22	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)C1	ZINC000875253561	GE	On-Demand	Anodyne	GPR119	22	40
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCN(CC#N)CC2)CC1	ZINC000875253578	FF	On-Demand	Mild	DRD4	17	45
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCN(CC#N)CC2)CC1	ZINC000875253578	FF	On-Demand	Mild	RBP4	28	40
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCN(CC#N)CC2)CC1	ZINC000875253585	FF	On-Demand	Mild	DRD4	17	45
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCN(CC#N)CC2)CC1	ZINC000875253585	FF	On-Demand	Mild	RBP4	28	40
CS(=O)(=O)Nc1ccc(/C=C/C(=O)OCC(=O)N(CCC#N)c2cccc(Cl)c2)cc1	ZINC000875253616	JG	On-Demand	Mild	NR1H4	37	40
CS(=O)(=O)Nc1ccc(/C=C\C(=O)OCC(=O)N(CCC#N)c2cccc(Cl)c2)cc1	ZINC000875253617	JG	On-Demand	Mild	NR1H4	37	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)c1oc2ccc(OC)cc2c1C	ZINC000875253624	EH	On-Demand	Anodyne	MTNR1A	40	36
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)c1oc2ccc(OC)cc2c1C	ZINC000875253625	EH	On-Demand	Anodyne	MTNR1A	40	36
CN1CCCC[C@H]1CCOC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1	ZINC000875253645	FE	On-Demand	Anodyne	ACKR3	62	32
CN1CCCC[C@@H]1CCOC(=O)/C=C\c1ccc(NS(C)(=O)=O)cc1	ZINC000875253646	FE	On-Demand	Anodyne	ACKR3	62	32
CN1CCCC[C@@H]1CCOC(=O)/C=C/c1ccc(NS(C)(=O)=O)cc1	ZINC000875253647	FE	On-Demand	Anodyne	ACKR3	62	32
CN1CCCC[C@H]1CCOC(=O)/C=C/c1ccc(NS(C)(=O)=O)cc1	ZINC000875253648	FE	On-Demand	Anodyne	ACKR3	62	32
N#CCN1CCC(NC(=O)NNc2cccc(F)c2Cl)CC1	ZINC000875253760	EE	On-Demand	Reactive	SIGMAR1	15	43
O=C(NCCCN1CCCCC1=O)NNc1cccc(F)c1Cl	ZINC000875253801	EF	On-Demand	Reactive	TYRO3	19	41
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(c4ccccc4)C3)C[C@@H]1C2	ZINC000875253880	ED	On-Demand	Anodyne	EPHX2	15	47
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(c4ccccc4)C3)C[C@@H]1C2	ZINC000875253881	ED	On-Demand	Anodyne	EPHX2	15	47
CS(=O)(=O)Nc1ccc(/C=C/C(=O)OCC(=O)N2CCN(Cc3cccc(Cl)c3)CC2)cc1	ZINC000875253884	JF	On-Demand	Anodyne	FAAH	18	46
CS(=O)(=O)Nc1ccc(/C=C\C(=O)OCC(=O)N2CCN(Cc3cccc(Cl)c3)CC2)cc1	ZINC000875253889	JF	On-Demand	Anodyne	FAAH	18	46
N#CCN1CCC(NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)CC1	ZINC000875253941	ED	On-Demand	Mild	EPHX2	16	44
N#CCN1CCC(NC(=O)N2CCC[C@](O)(c3ccccc3)C2)CC1	ZINC000875253942	ED	On-Demand	Mild	EPHX2	16	44
N#CCN1CCC(NC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875253960	FE	On-Demand	Mild	MCHR1	42	46
N#CCN1CCC(NC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875253961	FE	On-Demand	Mild	MCHR1	42	46
N#CCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875254040	FD	On-Demand	Mild	CHRM2	17	43
N#CCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875254040	FD	On-Demand	Mild	DRD4	39	49
N#CCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875254040	FD	On-Demand	Mild	ACHE	28	41
N#CCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875254040	FD	On-Demand	Mild	CHRM3	22	43
N#CCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875254040	FD	On-Demand	Mild	SIGMAR1	43	52
N#CCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875254040	FD	On-Demand	Mild	CCR3	28	46
N#CCN1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875254040	FD	On-Demand	Mild	MCHR1	26	45
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NC1CCN(CC#N)CC1	ZINC000875254079	FD	On-Demand	Mild	MCHR1	17	40
N#CCN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875254103	ED	On-Demand	Mild	DRD4	18	53
N#CCN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875254103	ED	On-Demand	Mild	SIGMAR1	21	45
N#CCN1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875254103	ED	On-Demand	Mild	EPHX2	36	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cc(C)cc(C)c1	ZINC000875254155	EG	On-Demand	Anodyne	SLC6A3	46	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cc(C)cc(C)c1	ZINC000875254156	EG	On-Demand	Anodyne	SLC6A3	46	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cc(C)cc(C)c1	ZINC000875254157	EG	On-Demand	Anodyne	SLC6A3	46	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cc(C)cc(C)c1	ZINC000875254158	EG	On-Demand	Anodyne	SLC6A3	46	38
Cc1noc(C)c1CCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875254159	FG	On-Demand	Anodyne	CPT1A	51	35
Cc1noc(C)c1CCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875254160	FG	On-Demand	Anodyne	CPT1A	51	35
Cc1noc(C)c1CCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875254161	FG	On-Demand	Anodyne	CPT1A	51	35
Cc1noc(C)c1CCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875254162	FG	On-Demand	Anodyne	CPT1A	51	35
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)NC1CCN(CC#N)CC1	ZINC000875254258	FH	On-Demand	Mild	MDM2	48	32
N#CCN1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875254261	GF	On-Demand	Reactive	DRD4	21	47
N#CCN1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875254261	GF	On-Demand	Reactive	LTA4H	43	45
N#CCN1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875254261	GF	On-Demand	Reactive	SIGMAR1	27	43
N#CCN1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875254261	GF	On-Demand	Reactive	CACNA1B	18	42
N#CCN1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875254261	GF	On-Demand	Reactive	ADAM17	19	43
N#CCN1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875254261	GF	On-Demand	Reactive	SLC6A5	37	49
N#CCN1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875254261	GF	On-Demand	Reactive	EPHX2	37	41
N#CCN1CCC(NC(=O)NNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000875254261	GF	On-Demand	Reactive	MCHR1	24	42
Cc1noc(C)c1CCNC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875254408	EE	On-Demand	Anodyne	ADAMTS4	25	41
Cc1noc(C)c1CCNC(=O)NNc1cccc(F)c1Cl	ZINC000875254428	EF	On-Demand	Reactive	P2RX7	17	49
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1nc(-c2ccccc2)cs1	ZINC000875254457	FH	On-Demand	Anodyne	P2RY12	45	33
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1nc(-c2ccccc2)cs1	ZINC000875254458	FH	On-Demand	Anodyne	P2RY12	45	33
C[C@@H](NC(=O)N1CCCC2(CC1)CC2)c1cc(F)ccc1N1CCC(O)CC1	ZINC000875254469	GH	On-Demand	Anodyne	CACNA1H	40	37
CCO[C@H](C(=O)N(CC#N)c1ccccc1)C1CCCC1	ZINC000875254500	CG	On-Demand	Mild	AMY2	51	35
CCO[C@@H](C(=O)N(CC#N)c1ccccc1)C1CCCC1	ZINC000875254501	CG	On-Demand	Mild	AMY2	51	35
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](COC)c1cccc(C(F)(F)F)c1	ZINC000875254537	GD	On-Demand	Mild	PDS	40	36
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](COC)c1cccc(C(F)(F)F)c1	ZINC000875254538	GD	On-Demand	Mild	PDS	40	36
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](COC)c1cccc(C(F)(F)F)c1	ZINC000875254539	GD	On-Demand	Mild	PDS	40	36
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](COC)c1cccc(C(F)(F)F)c1	ZINC000875254540	GD	On-Demand	Mild	PDS	40	36
C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)[C@@]12CCC[C@]1(OC)OCC2	ZINC000875254554	FG	On-Demand	Mild	CACNA1D	45	35
C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)[C@@]1(CC)CCNC1=O	ZINC000875254589	EE	On-Demand	Mild	CACNA1D	64	36
C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)[C@]1(CC)CCNC1=O	ZINC000875254590	EE	On-Demand	Mild	CACNA1D	64	36
COC(=O)/C=C\c1ccc(OCc2cc([N+](=O)[O-])ccc2OC)c(OC)c1	ZINC000875254642	FG	On-Demand	Bother	KCNMA1	19	40
COC(=O)/C=C\c1ccc(OCc2cc([N+](=O)[O-])ccc2OC)c(OC)c1	ZINC000875254642	FG	On-Demand	Bother	TUBB1	41	36
COC(=O)/C=C\c1ccc(OCc2cc([N+](=O)[O-])ccc2OC)c(OC)c1	ZINC000875254642	FG	On-Demand	Bother	ABCG2	20	40
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)C1([C@@H]2CCCCO2)CCC1	ZINC000875254654	GH	On-Demand	Anodyne	L3MBTL3	51	33
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)C1([C@H]2CCCCO2)CCC1	ZINC000875254655	GH	On-Demand	Anodyne	L3MBTL3	51	33
CN1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CCC1(C)C	ZINC000875254660	EG	On-Demand	Anodyne	HTR1A	15	42
CN1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CCC1(C)C	ZINC000875254660	EG	On-Demand	Anodyne	HTR1D	67	34
CN1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CCC1(C)C	ZINC000875254660	EG	On-Demand	Anodyne	HTR1B	55	42
CN1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CCC1(C)C	ZINC000875254660	EG	On-Demand	Anodyne	SSTR2	37	47
CN1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CCC1(C)C	ZINC000875254660	EG	On-Demand	Anodyne	TACR1	15	45
CN1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CCC1(C)C	ZINC000875254660	EG	On-Demand	Anodyne	NMBR	76	34
CN1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CCC1(C)C	ZINC000875254660	EG	On-Demand	Anodyne	GRPR	40	33
CN1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CCC1(C)C	ZINC000875254660	EG	On-Demand	Anodyne	GHSR	38	41
O=C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CCCCCCN1	ZINC000875254661	FG	On-Demand	Anodyne	ACHE	25	40
O=C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CCCCCCN1	ZINC000875254661	FG	On-Demand	Anodyne	SSTR2	39	41
O=C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CCCCCCN1	ZINC000875254661	FG	On-Demand	Anodyne	MC4R	21	42
O=C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CCCCCCN1	ZINC000875254661	FG	On-Demand	Anodyne	BCHE	16	40
O=C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CCCCCCN1	ZINC000875254661	FG	On-Demand	Anodyne	NMBR	42	36
O=C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CCCCCCN1	ZINC000875254661	FG	On-Demand	Anodyne	MC3R	49	39
O=C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CCCCCCN1	ZINC000875254661	FG	On-Demand	Anodyne	MC1R	40	42
CC(=O)[C@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254674	EG	On-Demand	Anodyne	HTR1A	17	43
CC(=O)[C@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254674	EG	On-Demand	Anodyne	ACHE	28	40
CC(=O)[C@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254674	EG	On-Demand	Anodyne	HTR1D	77	38
CC(=O)[C@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254674	EG	On-Demand	Anodyne	HTR1B	67	42
CC(=O)[C@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254674	EG	On-Demand	Anodyne	SSTR2	86	42
CC(=O)[C@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254674	EG	On-Demand	Anodyne	EDNRA	24	45
CC(=O)[C@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254674	EG	On-Demand	Anodyne	TACR1	26	40
CC(=O)[C@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254674	EG	On-Demand	Anodyne	CCKAR	82	40
CC(=O)[C@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254674	EG	On-Demand	Anodyne	BCHE	17	40
CC(=O)[C@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254674	EG	On-Demand	Anodyne	NMBR	63	32
CC(=O)[C@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254674	EG	On-Demand	Anodyne	MC3R	64	42
CC(=O)[C@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254674	EG	On-Demand	Anodyne	MC5R	63	46
CC(=O)[C@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254674	EG	On-Demand	Anodyne	GRPR	49	31
CC(=O)[C@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254674	EG	On-Demand	Anodyne	ECE1	40	33
CC(=O)[C@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254674	EG	On-Demand	Anodyne	CCKBR	66	43
CC(=O)[C@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254674	EG	On-Demand	Anodyne	GHSR	51	38
CC(=O)[C@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254674	EG	On-Demand	Anodyne	MC1R	70	42
CC(=O)[C@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254674	EG	On-Demand	Anodyne	KISS1R	62	31
CC(=O)[C@@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254675	EG	On-Demand	Anodyne	HTR1A	17	43
CC(=O)[C@@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254675	EG	On-Demand	Anodyne	ACHE	28	40
CC(=O)[C@@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254675	EG	On-Demand	Anodyne	HTR1D	77	38
CC(=O)[C@@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254675	EG	On-Demand	Anodyne	HTR1B	67	42
CC(=O)[C@@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254675	EG	On-Demand	Anodyne	SSTR2	86	42
CC(=O)[C@@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254675	EG	On-Demand	Anodyne	EDNRA	24	45
CC(=O)[C@@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254675	EG	On-Demand	Anodyne	TACR1	26	40
CC(=O)[C@@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254675	EG	On-Demand	Anodyne	CCKAR	82	40
CC(=O)[C@@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254675	EG	On-Demand	Anodyne	BCHE	17	40
CC(=O)[C@@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254675	EG	On-Demand	Anodyne	NMBR	63	32
CC(=O)[C@@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254675	EG	On-Demand	Anodyne	MC3R	64	42
CC(=O)[C@@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254675	EG	On-Demand	Anodyne	MC5R	63	46
CC(=O)[C@@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254675	EG	On-Demand	Anodyne	GRPR	49	31
CC(=O)[C@@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254675	EG	On-Demand	Anodyne	ECE1	40	33
CC(=O)[C@@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254675	EG	On-Demand	Anodyne	CCKBR	66	43
CC(=O)[C@@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254675	EG	On-Demand	Anodyne	GHSR	51	38
CC(=O)[C@@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254675	EG	On-Demand	Anodyne	MC1R	70	42
CC(=O)[C@@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875254675	EG	On-Demand	Anodyne	KISS1R	62	31
CC[C@]1(C(=O)Nc2cc(C(=O)N3CCOCC3)ccc2OC)CCNC1=O	ZINC000875254679	GD	On-Demand	Anodyne	LRRK2	31	41
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)[C@]1(C)CCC(=O)N1	ZINC000875254683	FC	On-Demand	Anodyne	LRRK2	33	42
COCc1cc(CNC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)ccc1F	ZINC000875254684	FE	On-Demand	Anodyne	SLC6A3	48	39
COCc1cc(CNC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)ccc1F	ZINC000875254685	FE	On-Demand	Anodyne	SLC6A3	48	39
CC(=O)C1CCN(C(=O)N[C@@H](COc2ccccc2)c2ccccc2)CC1	ZINC000875254686	FH	On-Demand	Anodyne	CCR5	30	42
CC(=O)C1CCN(C(=O)N[C@@H](COc2ccccc2)c2ccccc2)CC1	ZINC000875254686	FH	On-Demand	Anodyne	CPT1A	44	35
CC(=O)C1CCN(C(=O)N[C@H](COc2ccccc2)c2ccccc2)CC1	ZINC000875254687	FH	On-Demand	Anodyne	CCR5	30	42
CC(=O)C1CCN(C(=O)N[C@H](COc2ccccc2)c2ccccc2)CC1	ZINC000875254687	FH	On-Demand	Anodyne	CPT1A	44	35
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)[C@@H](NC=O)C(C)C	ZINC000875254692	ED	On-Demand	Anodyne	HPGD	36	40
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C1(F)CCOCC1	ZINC000875254702	FD	On-Demand	Anodyne	LRRK2	36	46
COC(=O)/C=C\c1ccc(OCc2cc(OC)ccc2OC)c(OC)c1	ZINC000875254719	FG	On-Demand	Anodyne	TSHR	58	34
COC(=O)/C=C\c1ccc(OCc2cc(OC)ccc2OC)c(OC)c1	ZINC000875254719	FG	On-Demand	Anodyne	CYP1B1	46	45
COC(=O)/C=C\c1ccc(OCc2cc(OC)ccc2OC)c(OC)c1	ZINC000875254719	FG	On-Demand	Anodyne	APP	19	41
COC(=O)/C=C\c1ccc(OCc2cc(OC)ccc2OC)c(OC)c1	ZINC000875254719	FG	On-Demand	Anodyne	MTNR1A	39	41
COC(=O)/C=C\c1ccc(OCc2cc(OC)ccc2OC)c(OC)c1	ZINC000875254719	FG	On-Demand	Anodyne	MTNR1B	36	45
COC(=O)/C=C\c1ccc(OCc2cc(OC)ccc2OC)c(OC)c1	ZINC000875254719	FG	On-Demand	Anodyne	CYP1A1	44	45
COC(=O)/C=C\c1ccc(OCc2cc(OC)ccc2OC)c(OC)c1	ZINC000875254719	FG	On-Demand	Anodyne	NR1H4	46	41
COC(=O)/C=C\c1ccc(OCc2cc(OC)ccc2OC)c(OC)c1	ZINC000875254719	FG	On-Demand	Anodyne	TUBB1	70	39
COC(=O)/C=C\c1ccc(OCc2cc(OC)ccc2OC)c(OC)c1	ZINC000875254719	FG	On-Demand	Anodyne	AKR1C3	32	42
COC(=O)/C=C\c1ccc(OCc2cc(OC)ccc2OC)c(OC)c1	ZINC000875254719	FG	On-Demand	Anodyne	ABCG2	22	48
COC(=O)N(C)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875254728	DE	On-Demand	Reactive	HTR1A	16	47
COC(=O)N(C)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875254728	DE	On-Demand	Reactive	HTR1D	28	40
COC(=O)N(C)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875254728	DE	On-Demand	Reactive	HTR1B	26	40
COC(=O)N(C)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875254728	DE	On-Demand	Reactive	TACR1	24	42
COC(=O)N(C)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875254728	DE	On-Demand	Reactive	CCKAR	82	42
COC(=O)N(C)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875254728	DE	On-Demand	Reactive	BCHE	15	40
COC(=O)N(C)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875254728	DE	On-Demand	Reactive	MPO	76	39
COC(=O)N(C)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875254728	DE	On-Demand	Reactive	BRS3	26	41
COC(=O)N(C)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875254728	DE	On-Demand	Reactive	NMBR	58	31
COC(=O)N(C)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875254728	DE	On-Demand	Reactive	MC5R	40	36
COC(=O)N(C)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875254728	DE	On-Demand	Reactive	MTNR1A	40	48
COC(=O)N(C)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875254728	DE	On-Demand	Reactive	MTNR1B	32	42
COC(=O)N(C)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875254728	DE	On-Demand	Reactive	GRIA1	18	41
COC(=O)N(C)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875254728	DE	On-Demand	Reactive	CCKBR	65	39
COC(=O)N(C)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875254728	DE	On-Demand	Reactive	GHSR	47	35
COC(=O)N(C)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875254728	DE	On-Demand	Reactive	MMP9	17	48
COC(=O)N(C)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875254728	DE	On-Demand	Reactive	MC1R	44	39
COC(=O)N(C)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875254728	DE	On-Demand	Reactive	MMP1	17	40
COC(=O)N(C)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875254728	DE	On-Demand	Reactive	KISS1R	48	31
CCCCCCCNC(=O)C(=O)N[C@H]1CCN(c2cnn(C)c2)C1=O	ZINC000875254809	EC	On-Demand	Mild	ASAH1	90	36
CCCCCCCNC(=O)C(=O)N[C@@H]1CCN(c2cnn(C)c2)C1=O	ZINC000875254810	EC	On-Demand	Mild	ASAH1	90	36
CCCC[C@@H](COC)NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875254813	GE	On-Demand	Anodyne	ETHR	48	43
CCCC[C@H](COC)NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875254814	GE	On-Demand	Anodyne	ETHR	48	43
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875254835	GG	On-Demand	Anodyne	SLC9A1	45	32
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875254835	GG	On-Demand	Anodyne	HPGD	42	41
C#CC[C@H](COC)NC(=O)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000875254848	GC	On-Demand	Mild	L3MBTL3	51	32
C#CC[C@@H](COC)NC(=O)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000875254849	GC	On-Demand	Mild	L3MBTL3	51	32
C=CCN(Cc1cccc(C#N)c1)C(=O)C(C)(C)c1cccc(OC)c1	ZINC000875254852	EI	On-Demand	Mild	PTGES	22	43
CCOC(=O)[C@@H]1CCCN(C(=O)COc2ccc(/C=C\C(=O)OC)cc2OC)C1	ZINC000875254854	HE	On-Demand	Anodyne	FDFT1	20	42
CCOC(=O)[C@@H]1CCCN(C(=O)COc2ccc(/C=C\C(=O)OC)cc2OC)C1	ZINC000875254854	HE	On-Demand	Anodyne	NR1H4	27	41
CCOC(=O)[C@@H]1CCCN(C(=O)COc2ccc(/C=C\C(=O)OC)cc2OC)C1	ZINC000875254854	HE	On-Demand	Anodyne	ACKR3	43	33
CCOC(=O)[C@@H]1CCCN(C(=O)COc2ccc(/C=C/C(=O)OC)cc2OC)C1	ZINC000875254855	HE	On-Demand	Anodyne	FDFT1	20	42
CCOC(=O)[C@@H]1CCCN(C(=O)COc2ccc(/C=C/C(=O)OC)cc2OC)C1	ZINC000875254855	HE	On-Demand	Anodyne	NR1H4	27	41
CCOC(=O)[C@@H]1CCCN(C(=O)COc2ccc(/C=C/C(=O)OC)cc2OC)C1	ZINC000875254855	HE	On-Demand	Anodyne	ACKR3	43	33
COCc1cc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)ccc1F	ZINC000875254857	FD	On-Demand	Anodyne	CCR3	26	48
COCc1cc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)ccc1F	ZINC000875254857	FD	On-Demand	Anodyne	MCHR1	17	43
O=CN1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875254858	ED	On-Demand	Anodyne	ACHE	29	42
O=CN1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875254858	ED	On-Demand	Anodyne	HTR1D	44	38
O=CN1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875254858	ED	On-Demand	Anodyne	HTR1B	37	40
O=CN1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875254858	ED	On-Demand	Anodyne	SSTR2	38	41
O=CN1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875254858	ED	On-Demand	Anodyne	EDNRA	15	44
O=CN1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875254858	ED	On-Demand	Anodyne	BCHE	17	42
O=CN1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875254858	ED	On-Demand	Anodyne	MPO	46	38
O=CN1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875254858	ED	On-Demand	Anodyne	MC3R	45	36
O=CN1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875254858	ED	On-Demand	Anodyne	MC5R	36	42
O=CN1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875254858	ED	On-Demand	Anodyne	MC1R	46	36
O=C(NCCCc1c[nH]c2ccccc12)NC[C@H]1C[C@H](O)C1	ZINC000875254867	DE	On-Demand	Anodyne	ACHE	24	40
O=C(NCCCc1c[nH]c2ccccc12)NC[C@H]1C[C@H](O)C1	ZINC000875254867	DE	On-Demand	Anodyne	HTR1B	32	40
O=C(NCCCc1c[nH]c2ccccc12)NC[C@H]1C[C@H](O)C1	ZINC000875254867	DE	On-Demand	Anodyne	CCKAR	58	39
O=C(NCCCc1c[nH]c2ccccc12)NC[C@H]1C[C@H](O)C1	ZINC000875254867	DE	On-Demand	Anodyne	BCHE	15	40
O=C(NCCCc1c[nH]c2ccccc12)NC[C@H]1C[C@H](O)C1	ZINC000875254867	DE	On-Demand	Anodyne	MPO	48	36
O=C(NCCCc1c[nH]c2ccccc12)NC[C@H]1C[C@H](O)C1	ZINC000875254867	DE	On-Demand	Anodyne	NMBR	54	39
O=C(NCCCc1c[nH]c2ccccc12)NC[C@H]1C[C@H](O)C1	ZINC000875254867	DE	On-Demand	Anodyne	MTNR1A	21	41
O=C(NCCCc1c[nH]c2ccccc12)NC[C@H]1C[C@H](O)C1	ZINC000875254867	DE	On-Demand	Anodyne	CCKBR	58	43
O=C(NCCCc1c[nH]c2ccccc12)NC[C@H]1C[C@H](O)C1	ZINC000875254867	DE	On-Demand	Anodyne	MC1R	39	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(/C=C/C(=O)OC)cc2OC)CC1	ZINC000875254868	HD	On-Demand	Anodyne	P2RY12	47	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(/C=C/C(=O)OC)cc2OC)CC1	ZINC000875254869	HD	On-Demand	Anodyne	P2RY12	47	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(/C=C\C(=O)OC)cc2OC)CC1	ZINC000875254870	HD	On-Demand	Anodyne	P2RY12	47	36
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(/C=C\C(=O)OC)cc2OC)CC1	ZINC000875254871	HD	On-Demand	Anodyne	P2RY12	47	36
CCc1nc(CNC(=O)N[C@](C)(CO)Cc2ccc(OC)c(OC)c2)cs1	ZINC000875254884	GF	On-Demand	Anodyne	DRTS_TRYCR	43	30
CCc1nc(CNC(=O)N[C@@](C)(CO)Cc2ccc(OC)c(OC)c2)cs1	ZINC000875254885	GF	On-Demand	Anodyne	DRTS_TRYCR	43	30
COCc1cc(CNC(=O)N2CCC(C(=O)NCCO)CC2)ccc1F	ZINC000875254886	FD	On-Demand	Anodyne	EPHX2	24	55
COC(=O)/C=C\c1ccc(OC[C@@H](O)COc2ccc(C#N)cc2)c(OC)c1	ZINC000875254892	GF	On-Demand	Mild	ESRRA	19	40
COC(=O)/C=C\c1ccc(OC[C@@H](O)COc2ccc(C#N)cc2)c(OC)c1	ZINC000875254892	GF	On-Demand	Mild	TUBB1	45	35
COC(=O)/C=C\c1ccc(OC[C@H](O)COc2ccc(C#N)cc2)c(OC)c1	ZINC000875254893	GF	On-Demand	Mild	ESRRA	19	40
COC(=O)/C=C\c1ccc(OC[C@H](O)COc2ccc(C#N)cc2)c(OC)c1	ZINC000875254893	GF	On-Demand	Mild	TUBB1	45	35
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H](COc1ccccc1)c1ccccc1	ZINC000875254894	EF	On-Demand	Anodyne	MAN1B1	55	35
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H](COc1ccccc1)c1ccccc1	ZINC000875254894	EF	On-Demand	Anodyne	PDS	45	37
O=C(NC[C@H]1C[C@H](O)C1)N[C@H](COc1ccccc1)c1ccccc1	ZINC000875254895	EF	On-Demand	Anodyne	MAN1B1	55	35
O=C(NC[C@H]1C[C@H](O)C1)N[C@H](COc1ccccc1)c1ccccc1	ZINC000875254895	EF	On-Demand	Anodyne	PDS	45	37
CCc1nc(CNC(=O)N(CC)[C@H](C)[C@@H](O)c2ccccc2)cs1	ZINC000875254913	EG	On-Demand	Anodyne	NPY5R	21	40
CCc1nc(CNC(=O)N(CC)[C@H](C)[C@H](O)c2ccccc2)cs1	ZINC000875254914	EG	On-Demand	Anodyne	NPY5R	21	40
CCc1nc(CNC(=O)N(CC)[C@@H](C)[C@H](O)c2ccccc2)cs1	ZINC000875254915	EG	On-Demand	Anodyne	NPY5R	21	40
CCc1nc(CNC(=O)N(CC)[C@@H](C)[C@@H](O)c2ccccc2)cs1	ZINC000875254916	EG	On-Demand	Anodyne	NPY5R	21	40
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCCCc1c[nH]c3ccccc13)CC2	ZINC000875254917	GH	On-Demand	Anodyne	HTR1D	49	46
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCCCc1c[nH]c3ccccc13)CC2	ZINC000875254917	GH	On-Demand	Anodyne	HTR1B	43	46
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCCCc1c[nH]c3ccccc13)CC2	ZINC000875254917	GH	On-Demand	Anodyne	SSTR2	20	42
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCCCc1c[nH]c3ccccc13)CC2	ZINC000875254917	GH	On-Demand	Anodyne	NMBR	51	33
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCCCc1c[nH]c3ccccc13)CC2	ZINC000875254917	GH	On-Demand	Anodyne	GRPR	51	33
COC(=O)/C=C\c1ccc(OCc2ccc(OC(F)F)c(OC)c2)c(OC)c1	ZINC000875254922	GI	On-Demand	Anodyne	APP	19	41
COC(=O)/C=C\c1ccc(OCc2ccc(OC(F)F)c(OC)c2)c(OC)c1	ZINC000875254922	GI	On-Demand	Anodyne	NR1H4	46	41
COC(=O)/C=C\c1ccc(OCc2ccc(OC(F)F)c(OC)c2)c(OC)c1	ZINC000875254922	GI	On-Demand	Anodyne	TUBB1	47	37
COC(=O)/C=C\c1ccc(OCc2ccc(OC(F)F)c(OC)c2)c(OC)c1	ZINC000875254922	GI	On-Demand	Anodyne	AKR1C3	23	42
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)c2cc3ccccc3s2)C1	ZINC000875254937	EH	On-Demand	Anodyne	PREP	26	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)c2cc3ccccc3s2)C1	ZINC000875254938	EH	On-Demand	Anodyne	PREP	26	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)c2cc3ccccc3s2)C1	ZINC000875254939	EH	On-Demand	Anodyne	PREP	26	40
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)c2cc3ccccc3s2)C1	ZINC000875254940	EH	On-Demand	Anodyne	PREP	26	40
C[C@@H](NC(=O)N1CCC(C)(F)CC1)c1cc(F)ccc1N1CCC(O)CC1	ZINC000875254955	GG	On-Demand	Anodyne	CACNA1H	47	38
C[C@@H](NC(=O)NCCN1CC[C@H](O)C1)c1cc(F)ccc1N1CCC(O)CC1	ZINC000875254962	GD	On-Demand	Anodyne	CCR3	46	36
C[C@@H](NC(=O)NCCN1CC[C@@H](O)C1)c1cc(F)ccc1N1CCC(O)CC1	ZINC000875254963	GD	On-Demand	Anodyne	CCR3	46	36
C[C@H](NC(=O)NCCN1CC[C@@H](O)C1)c1cc(F)ccc1N1CCC(O)CC1	ZINC000875254964	GD	On-Demand	Anodyne	CCR3	46	36
C[C@H](NC(=O)NCCN1CC[C@H](O)C1)c1cc(F)ccc1N1CCC(O)CC1	ZINC000875254965	GD	On-Demand	Anodyne	CCR3	46	36
C[C@@H](NC(=O)N1CC(c2ccccc2)C1)c1cc(F)ccc1N1CCC(O)CC1	ZINC000875254974	GH	On-Demand	Anodyne	CCR5	48	35
CCCC[C@@H](COC)NC(=O)C(=O)N1CC[C@H](c2nc(C)cs2)C1	ZINC000875254980	FE	On-Demand	Anodyne	P2RY12	56	32
CCCC[C@@H](COC)NC(=O)C(=O)N1CC[C@@H](c2nc(C)cs2)C1	ZINC000875254981	FE	On-Demand	Anodyne	P2RY12	56	32
CCCC[C@H](COC)NC(=O)C(=O)N1CC[C@H](c2nc(C)cs2)C1	ZINC000875254982	FE	On-Demand	Anodyne	P2RY12	56	32
CCCC[C@H](COC)NC(=O)C(=O)N1CC[C@@H](c2nc(C)cs2)C1	ZINC000875254983	FE	On-Demand	Anodyne	P2RY12	56	32
C[C@@H](NC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)c1cc2ccccc2s1	ZINC000875254992	GI	On-Demand	Anodyne	ETHR	42	36
C[C@@H](NC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)c1cc2ccccc2s1	ZINC000875254993	GI	On-Demand	Anodyne	ETHR	42	36
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1nc(-c2ccccc2)cs1	ZINC000875255031	GF	On-Demand	Anodyne	NPY5R	22	46
COC(=O)/C=C\c1ccc(OCC(=O)N2CCC[C@@H]3CCCC[C@@H]32)c(OC)c1	ZINC000875255037	GG	On-Demand	Anodyne	CPT1A	47	35
COC(=O)/C=C\c1ccc(OCC(=O)N2CCC[C@@H]3CCCC[C@@H]32)c(OC)c1	ZINC000875255037	GG	On-Demand	Anodyne	ACKR3	65	35
COC(=O)/C=C\c1ccc(OCC(=O)N2CCC[C@@H]3CCCC[C@H]32)c(OC)c1	ZINC000875255038	GG	On-Demand	Anodyne	CPT1A	47	35
COC(=O)/C=C\c1ccc(OCC(=O)N2CCC[C@@H]3CCCC[C@H]32)c(OC)c1	ZINC000875255038	GG	On-Demand	Anodyne	ACKR3	65	35
CCCCCCCNC(=O)C(=O)N[C@H](CC)c1nccs1	ZINC000875255039	DF	On-Demand	Mild	ASAH1	67	34
CCCCCCCNC(=O)C(=O)N[C@@H](CC)c1nccs1	ZINC000875255040	DF	On-Demand	Mild	ASAH1	67	34
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C1(C)CC(F)(F)C1	ZINC000875255043	FF	On-Demand	Anodyne	LRRK2	33	45
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875255052	GE	On-Demand	Anodyne	HTR1D	58	38
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875255052	GE	On-Demand	Anodyne	HTR1B	50	46
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875255052	GE	On-Demand	Anodyne	SSTR2	64	38
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875255052	GE	On-Demand	Anodyne	MC3R	41	38
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875255052	GE	On-Demand	Anodyne	MC5R	35	42
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875255052	GE	On-Demand	Anodyne	CCKBR	41	38
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875255053	GE	On-Demand	Anodyne	HTR1D	58	38
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875255053	GE	On-Demand	Anodyne	HTR1B	50	46
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875255053	GE	On-Demand	Anodyne	SSTR2	64	38
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875255053	GE	On-Demand	Anodyne	MC3R	41	38
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875255053	GE	On-Demand	Anodyne	MC5R	35	42
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875255053	GE	On-Demand	Anodyne	CCKBR	41	38
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875255054	GE	On-Demand	Anodyne	HTR1D	58	38
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875255054	GE	On-Demand	Anodyne	HTR1B	50	46
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875255054	GE	On-Demand	Anodyne	SSTR2	64	38
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875255054	GE	On-Demand	Anodyne	MC3R	41	38
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875255054	GE	On-Demand	Anodyne	MC5R	35	42
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875255054	GE	On-Demand	Anodyne	CCKBR	41	38
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875255055	GE	On-Demand	Anodyne	HTR1D	58	38
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875255055	GE	On-Demand	Anodyne	HTR1B	50	46
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875255055	GE	On-Demand	Anodyne	SSTR2	64	38
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875255055	GE	On-Demand	Anodyne	MC3R	41	38
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875255055	GE	On-Demand	Anodyne	MC5R	35	42
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875255055	GE	On-Demand	Anodyne	CCKBR	41	38
O=C(N[C@@H](COc1ccccc1)c1ccccc1)N1CCC2(CCNC2=O)CC1	ZINC000875255059	GG	On-Demand	Anodyne	CACNA1H	43	33
O=C(N[C@@H](COc1ccccc1)c1ccccc1)N1CCC2(CCNC2=O)CC1	ZINC000875255059	GG	On-Demand	Anodyne	GHRHR	52	35
O=C(N[C@H](COc1ccccc1)c1ccccc1)N1CCC2(CCNC2=O)CC1	ZINC000875255060	GG	On-Demand	Anodyne	CACNA1H	43	33
O=C(N[C@H](COc1ccccc1)c1ccccc1)N1CCC2(CCNC2=O)CC1	ZINC000875255060	GG	On-Demand	Anodyne	GHRHR	52	35
COC(=O)/C=C\c1ccc(OC[C@@H](O)Cc2ccccc2)c(OC)c1	ZINC000875255061	EF	On-Demand	Anodyne	ADRB2	22	50
COC(=O)/C=C\c1ccc(OC[C@@H](O)Cc2ccccc2)c(OC)c1	ZINC000875255061	EF	On-Demand	Anodyne	ADRB1	19	50
COC(=O)/C=C\c1ccc(OC[C@@H](O)Cc2ccccc2)c(OC)c1	ZINC000875255061	EF	On-Demand	Anodyne	APP	19	41
COC(=O)/C=C\c1ccc(OC[C@@H](O)Cc2ccccc2)c(OC)c1	ZINC000875255061	EF	On-Demand	Anodyne	CYP1A1	16	45
COC(=O)/C=C\c1ccc(OC[C@@H](O)Cc2ccccc2)c(OC)c1	ZINC000875255061	EF	On-Demand	Anodyne	NR1H4	50	45
COC(=O)/C=C\c1ccc(OC[C@@H](O)Cc2ccccc2)c(OC)c1	ZINC000875255061	EF	On-Demand	Anodyne	ABCB1	45	44
COC(=O)/C=C\c1ccc(OC[C@@H](O)Cc2ccccc2)c(OC)c1	ZINC000875255061	EF	On-Demand	Anodyne	CAPN1	16	49
COC(=O)/C=C\c1ccc(OC[C@@H](O)Cc2ccccc2)c(OC)c1	ZINC000875255061	EF	On-Demand	Anodyne	TUBB1	43	37
COC(=O)/C=C\c1ccc(OC[C@@H](O)Cc2ccccc2)c(OC)c1	ZINC000875255061	EF	On-Demand	Anodyne	AKR1C3	24	46
COC(=O)/C=C\c1ccc(OC[C@H](O)Cc2ccccc2)c(OC)c1	ZINC000875255062	EF	On-Demand	Anodyne	ADRB2	22	50
COC(=O)/C=C\c1ccc(OC[C@H](O)Cc2ccccc2)c(OC)c1	ZINC000875255062	EF	On-Demand	Anodyne	ADRB1	19	50
COC(=O)/C=C\c1ccc(OC[C@H](O)Cc2ccccc2)c(OC)c1	ZINC000875255062	EF	On-Demand	Anodyne	APP	19	41
COC(=O)/C=C\c1ccc(OC[C@H](O)Cc2ccccc2)c(OC)c1	ZINC000875255062	EF	On-Demand	Anodyne	CYP1A1	16	45
COC(=O)/C=C\c1ccc(OC[C@H](O)Cc2ccccc2)c(OC)c1	ZINC000875255062	EF	On-Demand	Anodyne	NR1H4	50	45
COC(=O)/C=C\c1ccc(OC[C@H](O)Cc2ccccc2)c(OC)c1	ZINC000875255062	EF	On-Demand	Anodyne	ABCB1	45	44
COC(=O)/C=C\c1ccc(OC[C@H](O)Cc2ccccc2)c(OC)c1	ZINC000875255062	EF	On-Demand	Anodyne	CAPN1	16	49
COC(=O)/C=C\c1ccc(OC[C@H](O)Cc2ccccc2)c(OC)c1	ZINC000875255062	EF	On-Demand	Anodyne	TUBB1	43	37
COC(=O)/C=C\c1ccc(OC[C@H](O)Cc2ccccc2)c(OC)c1	ZINC000875255062	EF	On-Demand	Anodyne	AKR1C3	24	46
CN1CC[C@H]2CN(C(=O)NCCCc3c[nH]c4ccccc34)CC[C@@H]21	ZINC000875255066	EF	On-Demand	Anodyne	HTR1A	17	44
CN1CC[C@H]2CN(C(=O)NCCCc3c[nH]c4ccccc34)CC[C@@H]21	ZINC000875255066	EF	On-Demand	Anodyne	HTR1D	83	37
CN1CC[C@H]2CN(C(=O)NCCCc3c[nH]c4ccccc34)CC[C@@H]21	ZINC000875255066	EF	On-Demand	Anodyne	HTR1B	73	48
CN1CC[C@H]2CN(C(=O)NCCCc3c[nH]c4ccccc34)CC[C@@H]21	ZINC000875255066	EF	On-Demand	Anodyne	SSTR2	67	39
CN1CC[C@H]2CN(C(=O)NCCCc3c[nH]c4ccccc34)CC[C@@H]21	ZINC000875255066	EF	On-Demand	Anodyne	EDNRA	15	41
CN1CC[C@H]2CN(C(=O)NCCCc3c[nH]c4ccccc34)CC[C@@H]21	ZINC000875255066	EF	On-Demand	Anodyne	CCKAR	56	38
CN1CC[C@H]2CN(C(=O)NCCCc3c[nH]c4ccccc34)CC[C@@H]21	ZINC000875255066	EF	On-Demand	Anodyne	MC3R	49	37
CN1CC[C@H]2CN(C(=O)NCCCc3c[nH]c4ccccc34)CC[C@@H]21	ZINC000875255066	EF	On-Demand	Anodyne	MC5R	39	41
CN1CC[C@H]2CN(C(=O)NCCCc3c[nH]c4ccccc34)CC[C@@H]21	ZINC000875255066	EF	On-Demand	Anodyne	CCKBR	53	39
CN1CC[C@H]2CN(C(=O)NCCCc3c[nH]c4ccccc34)CC[C@@H]21	ZINC000875255066	EF	On-Demand	Anodyne	MMP9	15	42
CN1CC[C@H]2CN(C(=O)NCCCc3c[nH]c4ccccc34)CC[C@@H]21	ZINC000875255066	EF	On-Demand	Anodyne	MC1R	45	38
CN1CC[C@H]2CN(C(=O)NCCCc3c[nH]c4ccccc34)CC[C@@H]21	ZINC000875255066	EF	On-Demand	Anodyne	KISS1R	49	31
CN1CC[C@H]2CN(C(=O)NCCCc3c[nH]c4ccccc34)CC[C@H]21	ZINC000875255067	EF	On-Demand	Anodyne	HTR1A	17	44
CN1CC[C@H]2CN(C(=O)NCCCc3c[nH]c4ccccc34)CC[C@H]21	ZINC000875255067	EF	On-Demand	Anodyne	HTR1D	83	37
CN1CC[C@H]2CN(C(=O)NCCCc3c[nH]c4ccccc34)CC[C@H]21	ZINC000875255067	EF	On-Demand	Anodyne	HTR1B	73	48
CN1CC[C@H]2CN(C(=O)NCCCc3c[nH]c4ccccc34)CC[C@H]21	ZINC000875255067	EF	On-Demand	Anodyne	SSTR2	67	39
CN1CC[C@H]2CN(C(=O)NCCCc3c[nH]c4ccccc34)CC[C@H]21	ZINC000875255067	EF	On-Demand	Anodyne	EDNRA	15	41
CN1CC[C@H]2CN(C(=O)NCCCc3c[nH]c4ccccc34)CC[C@H]21	ZINC000875255067	EF	On-Demand	Anodyne	CCKAR	56	38
CN1CC[C@H]2CN(C(=O)NCCCc3c[nH]c4ccccc34)CC[C@H]21	ZINC000875255067	EF	On-Demand	Anodyne	MC3R	49	37
CN1CC[C@H]2CN(C(=O)NCCCc3c[nH]c4ccccc34)CC[C@H]21	ZINC000875255067	EF	On-Demand	Anodyne	MC5R	39	41
CN1CC[C@H]2CN(C(=O)NCCCc3c[nH]c4ccccc34)CC[C@H]21	ZINC000875255067	EF	On-Demand	Anodyne	CCKBR	53	39
CN1CC[C@H]2CN(C(=O)NCCCc3c[nH]c4ccccc34)CC[C@H]21	ZINC000875255067	EF	On-Demand	Anodyne	MMP9	15	42
CN1CC[C@H]2CN(C(=O)NCCCc3c[nH]c4ccccc34)CC[C@H]21	ZINC000875255067	EF	On-Demand	Anodyne	MC1R	45	38
CN1CC[C@H]2CN(C(=O)NCCCc3c[nH]c4ccccc34)CC[C@H]21	ZINC000875255067	EF	On-Demand	Anodyne	KISS1R	49	31
COC(=O)C1(O)CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255069	ED	On-Demand	Anodyne	HTR1D	48	35
COC(=O)C1(O)CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255069	ED	On-Demand	Anodyne	HTR1B	39	41
COC(=O)C1(O)CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255069	ED	On-Demand	Anodyne	SSTR2	31	41
COC(=O)C1(O)CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255069	ED	On-Demand	Anodyne	TACR1	20	40
COC(=O)C1(O)CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255069	ED	On-Demand	Anodyne	CCKAR	73	39
COC(=O)C1(O)CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255069	ED	On-Demand	Anodyne	MPO	41	37
COC(=O)C1(O)CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255069	ED	On-Demand	Anodyne	NMBR	59	31
COC(=O)C1(O)CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255069	ED	On-Demand	Anodyne	CCKBR	69	41
COC(=O)C1(O)CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255069	ED	On-Demand	Anodyne	GHSR	48	36
COC(=O)C1(O)CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255069	ED	On-Demand	Anodyne	MC1R	50	38
COC(=O)C1(O)CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255069	ED	On-Demand	Anodyne	KISS1R	55	31
Cc1nnc(NNC(=O)NCCCc2c[nH]c3ccccc23)n1C	ZINC000875255070	ED	On-Demand	Reactive	CCKAR	66	40
Cc1nnc(NNC(=O)NCCCc2c[nH]c3ccccc23)n1C	ZINC000875255070	ED	On-Demand	Reactive	MPO	41	33
Cc1nnc(NNC(=O)NCCCc2c[nH]c3ccccc23)n1C	ZINC000875255070	ED	On-Demand	Reactive	BRS3	26	41
Cc1nnc(NNC(=O)NCCCc2c[nH]c3ccccc23)n1C	ZINC000875255070	ED	On-Demand	Reactive	NMBR	28	40
Cc1nnc(NNC(=O)NCCCc2c[nH]c3ccccc23)n1C	ZINC000875255070	ED	On-Demand	Reactive	MC3R	56	38
Cc1nnc(NNC(=O)NCCCc2c[nH]c3ccccc23)n1C	ZINC000875255070	ED	On-Demand	Reactive	MC5R	67	34
Cc1nnc(NNC(=O)NCCCc2c[nH]c3ccccc23)n1C	ZINC000875255070	ED	On-Demand	Reactive	GRPR	53	30
Cc1nnc(NNC(=O)NCCCc2c[nH]c3ccccc23)n1C	ZINC000875255070	ED	On-Demand	Reactive	MMP11	54	32
Cc1nnc(NNC(=O)NCCCc2c[nH]c3ccccc23)n1C	ZINC000875255070	ED	On-Demand	Reactive	GHSR	53	41
Cc1nnc(NNC(=O)NCCCc2c[nH]c3ccccc23)n1C	ZINC000875255070	ED	On-Demand	Reactive	MC1R	80	38
Cc1nnc(NNC(=O)NCCCc2c[nH]c3ccccc23)n1C	ZINC000875255070	ED	On-Demand	Reactive	KISS1R	63	32
N#Cc1ccc(N2CCN(C(=O)NCCCc3c[nH]c4ccccc34)CC2)cn1	ZINC000875255074	GF	On-Demand	Mild	HTR1A	18	45
N#Cc1ccc(N2CCN(C(=O)NCCCc3c[nH]c4ccccc34)CC2)cn1	ZINC000875255074	GF	On-Demand	Mild	HTR1D	60	40
N#Cc1ccc(N2CCN(C(=O)NCCCc3c[nH]c4ccccc34)CC2)cn1	ZINC000875255074	GF	On-Demand	Mild	HTR1B	46	40
COC(=O)/C=C\c1ccc(OCc2cccc(C(=O)OC)c2)c(OC)c1	ZINC000875255081	FG	On-Demand	Anodyne	TNFRSF1A	23	40
COC(=O)/C=C\c1ccc(OCc2cccc(C(=O)OC)c2)c(OC)c1	ZINC000875255081	FG	On-Demand	Anodyne	NR1H4	49	40
COC(=O)/C=C\c1ccc(OCc2cccc(C(=O)OC)c2)c(OC)c1	ZINC000875255081	FG	On-Demand	Anodyne	TUBB1	55	39
COC(=O)/C=C\c1ccc(OCc2cccc(C(=O)OC)c2)c(OC)c1	ZINC000875255081	FG	On-Demand	Anodyne	AKR1C3	24	46
COC(=O)/C=C\c1ccc(OCc2cccc(C(=O)OC)c2)c(OC)c1	ZINC000875255081	FG	On-Demand	Anodyne	ABCG2	19	43
COC(=O)/C=C\c1ccc(OCc2cccc(C(=O)OC)c2)c(OC)c1	ZINC000875255081	FG	On-Demand	Anodyne	ADCYAP1R1	32	42
O=C(NCCCc1c[nH]c2ccccc12)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875255082	DH	On-Demand	Anodyne	HTR1D	40	39
O=C(NCCCc1c[nH]c2ccccc12)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875255082	DH	On-Demand	Anodyne	SSTR2	43	38
O=C(NCCCc1c[nH]c2ccccc12)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875255082	DH	On-Demand	Anodyne	CCKAR	48	37
O=C(NCCCc1c[nH]c2ccccc12)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875255082	DH	On-Demand	Anodyne	MPO	48	36
O=C(NCCCc1c[nH]c2ccccc12)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875255082	DH	On-Demand	Anodyne	MC3R	52	37
O=C(NCCCc1c[nH]c2ccccc12)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875255082	DH	On-Demand	Anodyne	MC5R	44	41
O=C(NCCCc1c[nH]c2ccccc12)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875255082	DH	On-Demand	Anodyne	CCKBR	53	41
O=C(NCCCc1c[nH]c2ccccc12)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875255082	DH	On-Demand	Anodyne	GHSR	41	36
O=C(NCCCc1c[nH]c2ccccc12)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875255082	DH	On-Demand	Anodyne	MMP9	16	47
O=C(NCCCc1c[nH]c2ccccc12)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875255082	DH	On-Demand	Anodyne	MC1R	52	39
O=C(NCCCc1c[nH]c2ccccc12)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875255082	DH	On-Demand	Anodyne	KISS1R	45	30
COC(=O)/C=C\c1ccc(OCc2cc3c(cc2Br)OCO3)c(OC)c1	ZINC000875255097	HH	On-Demand	Anodyne	NR1H4	42	40
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)C1(OC(C)C)CCC1	ZINC000875255107	FG	On-Demand	Anodyne	HPGD	35	40
C=CC(C)(C)CCCNC(=O)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000875255114	GF	On-Demand	Mild	GRIN2B	40	35
C=CC(C)(C)CCCNC(=O)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000875255114	GF	On-Demand	Mild	CACNA1I	54	37
C=CC(C)(C)CCCNC(=O)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000875255114	GF	On-Demand	Mild	L3MBTL3	43	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875255117	GD	On-Demand	Anodyne	SLC6A1	74	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875255117	GD	On-Demand	Anodyne	PREP	35	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875255117	GD	On-Demand	Anodyne	CACNA1I	40	31
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875255117	GD	On-Demand	Anodyne	L3MBTL3	83	39
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875255118	GD	On-Demand	Anodyne	SLC6A1	74	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875255118	GD	On-Demand	Anodyne	PREP	35	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875255118	GD	On-Demand	Anodyne	CACNA1I	40	31
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000875255118	GD	On-Demand	Anodyne	L3MBTL3	83	39
COc1cccc(C(C)(C)C(=O)Nc2cc(C(=O)N3CCCC3)ccc2OC)c1	ZINC000875255121	GH	On-Demand	Anodyne	DRD4	40	32
COc1cccc(C(C)(C)C(=O)Nc2cc(C(=O)N3CCCC3)ccc2OC)c1	ZINC000875255121	GH	On-Demand	Anodyne	HRH3	26	45
COc1cccc(C(C)(C)C(=O)Nc2cc(C(=O)N3CCCC3)ccc2OC)c1	ZINC000875255121	GH	On-Demand	Anodyne	NPY2R	27	46
COc1cccc(C(C)(C)C(=O)Nc2cc(C(=O)N3CCCC3)ccc2OC)c1	ZINC000875255121	GH	On-Demand	Anodyne	L3MBTL3	43	36
COc1cccc(C(C)(C)C(=O)Nc2cc(C(=O)N3CCCC3)ccc2OC)c1	ZINC000875255121	GH	On-Demand	Anodyne	HPGD	32	45
COC(=O)/C=C\c1ccc(OCC(=O)N2Cc3ccccc3C[C@H]2C(=O)OC)c(OC)c1	ZINC000875255125	IE	On-Demand	Anodyne	CFTR	49	36
COC(=O)/C=C\c1ccc(OCC(=O)N2Cc3ccccc3C[C@H]2C(=O)OC)c(OC)c1	ZINC000875255125	IE	On-Demand	Anodyne	ADAM9	53	33
COC(=O)/C=C\c1ccc(OCC(=O)N2Cc3ccccc3C[C@@H]2C(=O)OC)c(OC)c1	ZINC000875255127	IE	On-Demand	Anodyne	CFTR	49	36
COC(=O)/C=C\c1ccc(OCC(=O)N2Cc3ccccc3C[C@@H]2C(=O)OC)c(OC)c1	ZINC000875255127	IE	On-Demand	Anodyne	ADAM9	53	33
O=C(NCCCc1c[nH]c2ccccc12)N1Cc2cccc(O)c2C1	ZINC000875255131	EH	On-Demand	Clean	ACHE	25	40
O=C(NCCCc1c[nH]c2ccccc12)N1Cc2cccc(O)c2C1	ZINC000875255131	EH	On-Demand	Clean	SSTR2	36	41
O=C(NCCCc1c[nH]c2ccccc12)N1Cc2cccc(O)c2C1	ZINC000875255131	EH	On-Demand	Clean	BCHE	16	40
O=C(NCCCc1c[nH]c2ccccc12)N1Cc2cccc(O)c2C1	ZINC000875255131	EH	On-Demand	Clean	MPO	45	34
O=C(NCCCc1c[nH]c2ccccc12)N1Cc2cccc(O)c2C1	ZINC000875255131	EH	On-Demand	Clean	MC1R	46	35
O=C(NCCCc1c[nH]c2ccccc12)N1Cc2cccc(O)c2C1	ZINC000875255131	EH	On-Demand	Clean	KISS1R	45	33
CN(C)[C@@H]1CN(C(=O)NCCCc2c[nH]c3ccccc23)C[C@@H]1n1ccnn1	ZINC000875255132	GD	On-Demand	Anodyne	HTR1D	48	36
CN(C)[C@@H]1CN(C(=O)NCCCc2c[nH]c3ccccc23)C[C@@H]1n1ccnn1	ZINC000875255132	GD	On-Demand	Anodyne	HTR1B	42	35
CN(C)[C@@H]1CN(C(=O)NCCCc2c[nH]c3ccccc23)C[C@@H]1n1ccnn1	ZINC000875255132	GD	On-Demand	Anodyne	CCKAR	44	33
CN(C)[C@@H]1CN(C(=O)NCCCc2c[nH]c3ccccc23)C[C@@H]1n1ccnn1	ZINC000875255132	GD	On-Demand	Anodyne	NMBR	50	34
CN(C)[C@@H]1CN(C(=O)NCCCc2c[nH]c3ccccc23)C[C@@H]1n1ccnn1	ZINC000875255132	GD	On-Demand	Anodyne	MC3R	45	32
CN(C)[C@@H]1CN(C(=O)NCCCc2c[nH]c3ccccc23)C[C@@H]1n1ccnn1	ZINC000875255132	GD	On-Demand	Anodyne	MC5R	41	35
CN(C)[C@@H]1CN(C(=O)NCCCc2c[nH]c3ccccc23)C[C@@H]1n1ccnn1	ZINC000875255132	GD	On-Demand	Anodyne	MC1R	43	36
CCCC[C@@H](COC)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875255137	GE	On-Demand	Anodyne	ROCK1	22	43
CCCC[C@@H](COC)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875255137	GE	On-Demand	Anodyne	ROCK2	15	43
CCCC[C@H](COC)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875255138	GE	On-Demand	Anodyne	ROCK1	22	43
CCCC[C@H](COC)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875255138	GE	On-Demand	Anodyne	ROCK2	15	43
C[C@@H](NC(=O)N1CCc2c(CC(N)=O)cccc2C1)c1cc2ccccc2s1	ZINC000875255150	GH	On-Demand	Anodyne	Q6PRC7_IXORI	45	32
C[C@@H](NC(=O)NC1(C)CC(F)(F)C1)c1nc(-c2ccccc2)cs1	ZINC000875255155	FI	On-Demand	Anodyne	ROCK1	19	45
C[C@H](NC(=O)NC1(C)CC(F)(F)C1)c1nc(-c2ccccc2)cs1	ZINC000875255156	FI	On-Demand	Anodyne	ROCK1	19	45
C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)[C@]1(C)CCC(=O)N1	ZINC000875255195	DD	On-Demand	Mild	CACNA1D	64	37
COC(=O)N(C)NC(=O)N[C@@H](C)c1nc(-c2ccccc2)cs1	ZINC000875255200	EF	On-Demand	Reactive	ROCK1	19	46
COC(=O)N(C)NC(=O)N[C@H](C)c1nc(-c2ccccc2)cs1	ZINC000875255201	EF	On-Demand	Reactive	ROCK1	19	46
CC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255244	EG	On-Demand	Anodyne	HTR1A	18	44
CC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255244	EG	On-Demand	Anodyne	HTR1D	82	38
CC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255244	EG	On-Demand	Anodyne	HTR1B	71	47
CC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255244	EG	On-Demand	Anodyne	SSTR2	73	43
CC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255244	EG	On-Demand	Anodyne	SLC6A4	16	46
CC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255244	EG	On-Demand	Anodyne	EDNRA	23	45
CC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255244	EG	On-Demand	Anodyne	TACR1	27	41
CC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255244	EG	On-Demand	Anodyne	MC4R	25	41
CC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255244	EG	On-Demand	Anodyne	CCKAR	61	39
CC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255244	EG	On-Demand	Anodyne	MPO	49	38
CC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255244	EG	On-Demand	Anodyne	BRS3	25	41
CC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255244	EG	On-Demand	Anodyne	NMBR	42	40
CC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255244	EG	On-Demand	Anodyne	MC3R	45	38
CC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255244	EG	On-Demand	Anodyne	MC5R	49	42
CC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255244	EG	On-Demand	Anodyne	MAPK9	16	42
CC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255244	EG	On-Demand	Anodyne	CCKBR	61	40
CC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255244	EG	On-Demand	Anodyne	GHSR	53	39
CC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255244	EG	On-Demand	Anodyne	CCR2	18	41
CC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255244	EG	On-Demand	Anodyne	MC1R	48	41
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)[C@@]12CCCC[C@@H]1C2	ZINC000875255248	FF	On-Demand	Anodyne	LRRK2	32	44
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)[C@@]12CCCC[C@H]1C2	ZINC000875255249	FF	On-Demand	Anodyne	LRRK2	32	44
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)[C@]12CCCC[C@@H]1C2	ZINC000875255250	FF	On-Demand	Anodyne	LRRK2	32	44
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)[C@]12CCCC[C@H]1C2	ZINC000875255251	FF	On-Demand	Anodyne	LRRK2	32	44
O=C(NCCCc1c[nH]c2ccccc12)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875255254	FG	On-Demand	Anodyne	HTR1D	41	34
O=C(NCCCc1c[nH]c2ccccc12)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875255254	FG	On-Demand	Anodyne	HTR1B	39	44
O=C(NCCCc1c[nH]c2ccccc12)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875255254	FG	On-Demand	Anodyne	SSTR2	33	40
O=C(NCCCc1c[nH]c2ccccc12)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875255254	FG	On-Demand	Anodyne	TACR1	18	40
O=C(NCCCc1c[nH]c2ccccc12)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875255255	FG	On-Demand	Anodyne	HTR1D	41	34
O=C(NCCCc1c[nH]c2ccccc12)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875255255	FG	On-Demand	Anodyne	HTR1B	39	44
O=C(NCCCc1c[nH]c2ccccc12)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875255255	FG	On-Demand	Anodyne	SSTR2	33	40
O=C(NCCCc1c[nH]c2ccccc12)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875255255	FG	On-Demand	Anodyne	TACR1	18	40
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)c1scnc1C(F)F	ZINC000875255258	GH	On-Demand	Anodyne	F10	47	31
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)c1scnc1C(F)F	ZINC000875255258	GH	On-Demand	Anodyne	SLC9A1	48	36
O=C(NCCCc1c[nH]c2ccccc12)N1CCC[C@H](OC2CCC2)CC1	ZINC000875255267	FI	On-Demand	Anodyne	HTR1D	63	36
O=C(NCCCc1c[nH]c2ccccc12)N1CCC[C@H](OC2CCC2)CC1	ZINC000875255267	FI	On-Demand	Anodyne	HTR1B	56	47
O=C(NCCCc1c[nH]c2ccccc12)N1CCC[C@H](OC2CCC2)CC1	ZINC000875255267	FI	On-Demand	Anodyne	SSTR2	70	40
O=C(NCCCc1c[nH]c2ccccc12)N1CCC[C@H](OC2CCC2)CC1	ZINC000875255267	FI	On-Demand	Anodyne	EDNRA	16	42
O=C(NCCCc1c[nH]c2ccccc12)N1CCC[C@H](OC2CCC2)CC1	ZINC000875255267	FI	On-Demand	Anodyne	CCKAR	48	40
O=C(NCCCc1c[nH]c2ccccc12)N1CCC[C@H](OC2CCC2)CC1	ZINC000875255267	FI	On-Demand	Anodyne	MC3R	50	42
O=C(NCCCc1c[nH]c2ccccc12)N1CCC[C@H](OC2CCC2)CC1	ZINC000875255267	FI	On-Demand	Anodyne	MC5R	42	46
O=C(NCCCc1c[nH]c2ccccc12)N1CCC[C@H](OC2CCC2)CC1	ZINC000875255267	FI	On-Demand	Anodyne	MAPK9	15	40
O=C(NCCCc1c[nH]c2ccccc12)N1CCC[C@H](OC2CCC2)CC1	ZINC000875255267	FI	On-Demand	Anodyne	CCKBR	47	40
O=C(NCCCc1c[nH]c2ccccc12)N1CCC[C@H](OC2CCC2)CC1	ZINC000875255267	FI	On-Demand	Anodyne	GHSR	43	36
O=C(NCCCc1c[nH]c2ccccc12)N1CCC[C@H](OC2CCC2)CC1	ZINC000875255267	FI	On-Demand	Anodyne	MC1R	41	42
O=C(NCCCc1c[nH]c2ccccc12)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875255268	FI	On-Demand	Anodyne	HTR1D	63	36
O=C(NCCCc1c[nH]c2ccccc12)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875255268	FI	On-Demand	Anodyne	HTR1B	56	47
O=C(NCCCc1c[nH]c2ccccc12)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875255268	FI	On-Demand	Anodyne	SSTR2	70	40
O=C(NCCCc1c[nH]c2ccccc12)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875255268	FI	On-Demand	Anodyne	EDNRA	16	42
O=C(NCCCc1c[nH]c2ccccc12)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875255268	FI	On-Demand	Anodyne	CCKAR	48	40
O=C(NCCCc1c[nH]c2ccccc12)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875255268	FI	On-Demand	Anodyne	MC3R	50	42
O=C(NCCCc1c[nH]c2ccccc12)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875255268	FI	On-Demand	Anodyne	MC5R	42	46
O=C(NCCCc1c[nH]c2ccccc12)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875255268	FI	On-Demand	Anodyne	MAPK9	15	40
O=C(NCCCc1c[nH]c2ccccc12)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875255268	FI	On-Demand	Anodyne	CCKBR	47	40
O=C(NCCCc1c[nH]c2ccccc12)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875255268	FI	On-Demand	Anodyne	GHSR	43	36
O=C(NCCCc1c[nH]c2ccccc12)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875255268	FI	On-Demand	Anodyne	MC1R	41	42
C=C(Cl)COc1ccc(/C=C\C(=O)OC)cc1OC	ZINC000875255271	CG	On-Demand	Mild	APP	21	45
C=C(Cl)COc1ccc(/C=C\C(=O)OC)cc1OC	ZINC000875255271	CG	On-Demand	Mild	NR1H4	42	38
C=C(Cl)COc1ccc(/C=C\C(=O)OC)cc1OC	ZINC000875255271	CG	On-Demand	Mild	TUBB1	58	41
C=C(Cl)COc1ccc(/C=C\C(=O)OC)cc1OC	ZINC000875255271	CG	On-Demand	Mild	AKR1C3	16	40
C=C(Cl)COc1ccc(/C=C\C(=O)OC)cc1OC	ZINC000875255271	CG	On-Demand	Mild	ABCG2	16	46
C=C(Cl)COc1ccc(/C=C\C(=O)OC)cc1OC	ZINC000875255271	CG	On-Demand	Mild	CYSP_PLAFA	29	40
C=C(Cl)COc1ccc(/C=C/C(=O)OC)cc1OC	ZINC000875255272	CG	On-Demand	Mild	APP	21	45
C=C(Cl)COc1ccc(/C=C/C(=O)OC)cc1OC	ZINC000875255272	CG	On-Demand	Mild	NR1H4	42	38
C=C(Cl)COc1ccc(/C=C/C(=O)OC)cc1OC	ZINC000875255272	CG	On-Demand	Mild	TUBB1	58	41
C=C(Cl)COc1ccc(/C=C/C(=O)OC)cc1OC	ZINC000875255272	CG	On-Demand	Mild	AKR1C3	16	40
C=C(Cl)COc1ccc(/C=C/C(=O)OC)cc1OC	ZINC000875255272	CG	On-Demand	Mild	ABCG2	16	46
C=C(Cl)COc1ccc(/C=C/C(=O)OC)cc1OC	ZINC000875255272	CG	On-Demand	Mild	CYSP_PLAFA	29	40
CC(=O)Nc1cccc2c1CN(C(=O)NCCCc1c[nH]c3ccccc13)CC2	ZINC000875255278	GH	On-Demand	Anodyne	SSTR2	21	42
CC(=O)Nc1cccc2c1CN(C(=O)NCCCc1c[nH]c3ccccc13)CC2	ZINC000875255278	GH	On-Demand	Anodyne	EDNRA	18	46
CC(=O)Nc1cccc2c1CN(C(=O)NCCCc1c[nH]c3ccccc13)CC2	ZINC000875255278	GH	On-Demand	Anodyne	NMBR	43	35
COC(=O)/C=C\c1ccc(OC[C@H]2COc3ccccc3O2)c(OC)c1	ZINC000875255286	FG	On-Demand	Anodyne	ADRA1B	16	42
COC(=O)/C=C\c1ccc(OC[C@H]2COc3ccccc3O2)c(OC)c1	ZINC000875255286	FG	On-Demand	Anodyne	ADRA2B	20	42
COC(=O)/C=C\c1ccc(OC[C@H]2COc3ccccc3O2)c(OC)c1	ZINC000875255286	FG	On-Demand	Anodyne	ADRA2C	30	42
COC(=O)/C=C\c1ccc(OC[C@H]2COc3ccccc3O2)c(OC)c1	ZINC000875255286	FG	On-Demand	Anodyne	NR1H4	45	38
COC(=O)/C=C\c1ccc(OC[C@H]2COc3ccccc3O2)c(OC)c1	ZINC000875255286	FG	On-Demand	Anodyne	PTGDR	28	43
COC(=O)/C=C\c1ccc(OC[C@H]2COc3ccccc3O2)c(OC)c1	ZINC000875255286	FG	On-Demand	Anodyne	ACKR3	51	32
COC(=O)/C=C\c1ccc(OC[C@@H]2COc3ccccc3O2)c(OC)c1	ZINC000875255287	FG	On-Demand	Anodyne	ADRA1B	16	42
COC(=O)/C=C\c1ccc(OC[C@@H]2COc3ccccc3O2)c(OC)c1	ZINC000875255287	FG	On-Demand	Anodyne	ADRA2B	20	42
COC(=O)/C=C\c1ccc(OC[C@@H]2COc3ccccc3O2)c(OC)c1	ZINC000875255287	FG	On-Demand	Anodyne	ADRA2C	30	42
COC(=O)/C=C\c1ccc(OC[C@@H]2COc3ccccc3O2)c(OC)c1	ZINC000875255287	FG	On-Demand	Anodyne	NR1H4	45	38
COC(=O)/C=C\c1ccc(OC[C@@H]2COc3ccccc3O2)c(OC)c1	ZINC000875255287	FG	On-Demand	Anodyne	PTGDR	28	43
COC(=O)/C=C\c1ccc(OC[C@@H]2COc3ccccc3O2)c(OC)c1	ZINC000875255287	FG	On-Demand	Anodyne	ACKR3	51	32
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)C1(C)CC(F)(F)C1	ZINC000875255290	FG	On-Demand	Anodyne	L3MBTL3	40	33
C[S@](=N)(=O)N1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255309	FE	On-Demand	Anodyne	HTR1D	47	37
C[S@](=N)(=O)N1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255309	FE	On-Demand	Anodyne	HTR1B	40	41
C[S@](=N)(=O)N1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255309	FE	On-Demand	Anodyne	SSTR2	33	42
C[S@](=N)(=O)N1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255309	FE	On-Demand	Anodyne	TACR1	16	40
C[S@](=N)(=O)N1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255309	FE	On-Demand	Anodyne	CCKAR	43	39
C[S@](=N)(=O)N1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255309	FE	On-Demand	Anodyne	MPO	44	33
C[S@](=N)(=O)N1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255309	FE	On-Demand	Anodyne	MC5R	40	39
C[S@](=N)(=O)N1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255309	FE	On-Demand	Anodyne	CCKBR	55	41
C[S@](=N)(=O)N1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255309	FE	On-Demand	Anodyne	ALOX15	15	43
C[S@](=N)(=O)N1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255309	FE	On-Demand	Anodyne	MC1R	44	36
C[S@](=N)(=O)N1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255309	FE	On-Demand	Anodyne	KISS1R	44	30
COC(=O)/C=C\c1ccc(OCc2ccc(S(=O)(=O)C(F)F)cc2)c(OC)c1	ZINC000875255311	HG	On-Demand	Anodyne	NR1H4	44	38
COC(=O)/C=C\c1ccc(OCc2ccc(S(=O)(=O)C(F)F)cc2)c(OC)c1	ZINC000875255311	HG	On-Demand	Anodyne	TUBB1	46	35
COC(=O)/C=C\c1ccc(OCc2ccc(S(=O)(=O)C(F)F)cc2)c(OC)c1	ZINC000875255311	HG	On-Demand	Anodyne	AKR1C3	23	41
COCc1cc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)ccc1F	ZINC000875255313	FH	On-Demand	Anodyne	EPHX2	21	46
COCc1cc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)ccc1F	ZINC000875255314	FH	On-Demand	Anodyne	EPHX2	21	46
COC(=O)/C=C\c1ccc(OC[C@H](O)c2ccccc2)c(OC)c1	ZINC000875255320	EF	On-Demand	Anodyne	APP	20	42
COC(=O)/C=C\c1ccc(OC[C@H](O)c2ccccc2)c(OC)c1	ZINC000875255320	EF	On-Demand	Anodyne	MTNR1B	16	41
COC(=O)/C=C\c1ccc(OC[C@H](O)c2ccccc2)c(OC)c1	ZINC000875255320	EF	On-Demand	Anodyne	CYP1A1	15	47
COC(=O)/C=C\c1ccc(OC[C@H](O)c2ccccc2)c(OC)c1	ZINC000875255320	EF	On-Demand	Anodyne	NR1H4	50	44
COC(=O)/C=C\c1ccc(OC[C@H](O)c2ccccc2)c(OC)c1	ZINC000875255320	EF	On-Demand	Anodyne	TUBB1	48	38
COC(=O)/C=C\c1ccc(OC[C@H](O)c2ccccc2)c(OC)c1	ZINC000875255320	EF	On-Demand	Anodyne	AKR1C3	23	43
COCC(C)(C)CCNC(=O)C(=O)NCc1cccc(-c2ccc(C#N)s2)c1	ZINC000875255321	GG	On-Demand	Mild	CTSV	40	32
O=C(NCCCc1c[nH]c2ccccc12)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875255436	FG	On-Demand	Anodyne	MPO	41	35
O=C(NCCCc1c[nH]c2ccccc12)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875255437	FG	On-Demand	Anodyne	MPO	41	35
COC(=O)/C=C\c1ccc(OCC(=O)N2CCC[C@H]2c2ccc(OC)c(OC)c2)c(OC)c1	ZINC000875255449	JH	On-Demand	Anodyne	CPT1A	86	37
COC(=O)/C=C\c1ccc(OCC(=O)N2CCC[C@H]2c2ccc(OC)c(OC)c2)c(OC)c1	ZINC000875255449	JH	On-Demand	Anodyne	NR1H4	42	38
COC(=O)/C=C\c1ccc(OCC(=O)N2CCC[C@H]2c2ccc(OC)c(OC)c2)c(OC)c1	ZINC000875255449	JH	On-Demand	Anodyne	ACKR3	60	36
COC(=O)/C=C\c1ccc(OCC(=O)N2CCC[C@@H]2c2ccc(OC)c(OC)c2)c(OC)c1	ZINC000875255450	JH	On-Demand	Anodyne	CPT1A	86	37
COC(=O)/C=C\c1ccc(OCC(=O)N2CCC[C@@H]2c2ccc(OC)c(OC)c2)c(OC)c1	ZINC000875255450	JH	On-Demand	Anodyne	NR1H4	42	38
COC(=O)/C=C\c1ccc(OCC(=O)N2CCC[C@@H]2c2ccc(OC)c(OC)c2)c(OC)c1	ZINC000875255450	JH	On-Demand	Anodyne	ACKR3	60	36
COC(=O)/C=C\c1ccc(OCCCN2C(=O)c3ccccc3C2=O)c(OC)c1	ZINC000875255456	GF	On-Demand	Anodyne	APP	19	44
COC(=O)/C=C\c1ccc(OCCCN2C(=O)c3ccccc3C2=O)c(OC)c1	ZINC000875255456	GF	On-Demand	Anodyne	NR1H4	43	41
COC(=O)/C=C\c1ccc(OCCCN2C(=O)c3ccccc3C2=O)c(OC)c1	ZINC000875255456	GF	On-Demand	Anodyne	TUBB1	41	35
COC(=O)/C=C\c1ccc(OCCCN2C(=O)c3ccccc3C2=O)c(OC)c1	ZINC000875255456	GF	On-Demand	Anodyne	ABCG2	15	41
COC(=O)/C=C\c1ccc(OCCCN2C(=O)c3ccccc3C2=O)c(OC)c1	ZINC000875255456	GF	On-Demand	Anodyne	ACKR3	43	33
CN(C)C[C@@H]1CN(C(=O)NCCCc2c[nH]c3ccccc23)C[C@H]1CN(C)C	ZINC000875255458	GE	On-Demand	Anodyne	HTR1D	85	40
CN(C)C[C@@H]1CN(C(=O)NCCCc2c[nH]c3ccccc23)C[C@H]1CN(C)C	ZINC000875255458	GE	On-Demand	Anodyne	HTR1B	69	41
CN(C)C[C@@H]1CN(C(=O)NCCCc2c[nH]c3ccccc23)C[C@H]1CN(C)C	ZINC000875255458	GE	On-Demand	Anodyne	SSTR2	51	39
CN(C)C[C@@H]1CN(C(=O)NCCCc2c[nH]c3ccccc23)C[C@H]1CN(C)C	ZINC000875255458	GE	On-Demand	Anodyne	SLC6A4	15	49
CN(C)C[C@@H]1CN(C(=O)NCCCc2c[nH]c3ccccc23)C[C@H]1CN(C)C	ZINC000875255458	GE	On-Demand	Anodyne	CCKAR	67	38
CN(C)C[C@@H]1CN(C(=O)NCCCc2c[nH]c3ccccc23)C[C@H]1CN(C)C	ZINC000875255458	GE	On-Demand	Anodyne	BCHE	15	40
CN(C)C[C@@H]1CN(C(=O)NCCCc2c[nH]c3ccccc23)C[C@H]1CN(C)C	ZINC000875255458	GE	On-Demand	Anodyne	MPO	47	40
CN(C)C[C@@H]1CN(C(=O)NCCCc2c[nH]c3ccccc23)C[C@H]1CN(C)C	ZINC000875255458	GE	On-Demand	Anodyne	MC5R	38	40
CN(C)C[C@@H]1CN(C(=O)NCCCc2c[nH]c3ccccc23)C[C@H]1CN(C)C	ZINC000875255458	GE	On-Demand	Anodyne	MMP11	42	32
CN(C)C[C@@H]1CN(C(=O)NCCCc2c[nH]c3ccccc23)C[C@H]1CN(C)C	ZINC000875255458	GE	On-Demand	Anodyne	CCKBR	64	39
CN(C)C[C@@H]1CN(C(=O)NCCCc2c[nH]c3ccccc23)C[C@H]1CN(C)C	ZINC000875255458	GE	On-Demand	Anodyne	GHSR	47	37
CN(C)C[C@@H]1CN(C(=O)NCCCc2c[nH]c3ccccc23)C[C@H]1CN(C)C	ZINC000875255458	GE	On-Demand	Anodyne	MC1R	50	39
CN(C)C[C@@H]1CN(C(=O)NCCCc2c[nH]c3ccccc23)C[C@H]1CN(C)C	ZINC000875255458	GE	On-Demand	Anodyne	KISS1R	48	31
CN1CCN(C2CCN(C(=O)NCCCc3c[nH]c4ccccc34)CC2)CC1	ZINC000875255464	GF	On-Demand	Anodyne	HTR1A	22	44
CN1CCN(C2CCN(C(=O)NCCCc3c[nH]c4ccccc34)CC2)CC1	ZINC000875255464	GF	On-Demand	Anodyne	HTR1D	91	51
CN1CCN(C2CCN(C(=O)NCCCc3c[nH]c4ccccc34)CC2)CC1	ZINC000875255464	GF	On-Demand	Anodyne	HTR1B	83	51
CN1CCN(C2CCN(C(=O)NCCCc3c[nH]c4ccccc34)CC2)CC1	ZINC000875255464	GF	On-Demand	Anodyne	SSTR2	61	43
CN1CCN(C2CCN(C(=O)NCCCc3c[nH]c4ccccc34)CC2)CC1	ZINC000875255464	GF	On-Demand	Anodyne	SLC6A4	17	46
CN1CCN(C2CCN(C(=O)NCCCc3c[nH]c4ccccc34)CC2)CC1	ZINC000875255464	GF	On-Demand	Anodyne	EDNRA	15	44
CN1CCN(C2CCN(C(=O)NCCCc3c[nH]c4ccccc34)CC2)CC1	ZINC000875255464	GF	On-Demand	Anodyne	TACR1	21	41
CN1CCN(C2CCN(C(=O)NCCCc3c[nH]c4ccccc34)CC2)CC1	ZINC000875255464	GF	On-Demand	Anodyne	HTR1F	55	35
CN1CCN(C2CCN(C(=O)NCCCc3c[nH]c4ccccc34)CC2)CC1	ZINC000875255464	GF	On-Demand	Anodyne	CCKAR	46	38
CN1CCN(C2CCN(C(=O)NCCCc3c[nH]c4ccccc34)CC2)CC1	ZINC000875255464	GF	On-Demand	Anodyne	MPO	40	38
CN1CCN(C2CCN(C(=O)NCCCc3c[nH]c4ccccc34)CC2)CC1	ZINC000875255464	GF	On-Demand	Anodyne	NMBR	44	38
CN1CCN(C2CCN(C(=O)NCCCc3c[nH]c4ccccc34)CC2)CC1	ZINC000875255464	GF	On-Demand	Anodyne	MC3R	42	40
CN1CCN(C2CCN(C(=O)NCCCc3c[nH]c4ccccc34)CC2)CC1	ZINC000875255464	GF	On-Demand	Anodyne	MC5R	40	44
CN1CCN(C2CCN(C(=O)NCCCc3c[nH]c4ccccc34)CC2)CC1	ZINC000875255464	GF	On-Demand	Anodyne	MAPK9	17	43
CN1CCN(C2CCN(C(=O)NCCCc3c[nH]c4ccccc34)CC2)CC1	ZINC000875255464	GF	On-Demand	Anodyne	CCKBR	58	40
CN1CCN(C2CCN(C(=O)NCCCc3c[nH]c4ccccc34)CC2)CC1	ZINC000875255464	GF	On-Demand	Anodyne	GHSR	47	39
CN1CCN(C2CCN(C(=O)NCCCc3c[nH]c4ccccc34)CC2)CC1	ZINC000875255464	GF	On-Demand	Anodyne	CCR2	17	41
CN1CCN(C2CCN(C(=O)NCCCc3c[nH]c4ccccc34)CC2)CC1	ZINC000875255464	GF	On-Demand	Anodyne	MC1R	33	40
CN1CCN(C2CCN(C(=O)NCCCc3c[nH]c4ccccc34)CC2)CC1	ZINC000875255464	GF	On-Demand	Anodyne	CALCRL	18	46
CN1CCN(C2CCN(C(=O)NCCCc3c[nH]c4ccccc34)CC2)CC1	ZINC000875255464	GF	On-Demand	Anodyne	L3MBTL3	48	38
CCc1nc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cs1	ZINC000875255471	FH	On-Demand	Anodyne	CPT1A	44	35
CCc1nc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cs1	ZINC000875255472	FH	On-Demand	Anodyne	CPT1A	44	35
CCc1nc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cs1	ZINC000875255473	FH	On-Demand	Anodyne	CPT1A	44	35
CCc1nc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cs1	ZINC000875255474	FH	On-Demand	Anodyne	CPT1A	44	35
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875255476	EG	On-Demand	Anodyne	HTR1D	56	38
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875255476	EG	On-Demand	Anodyne	HTR1B	51	46
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875255476	EG	On-Demand	Anodyne	SSTR2	47	38
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875255476	EG	On-Demand	Anodyne	MC5R	35	42
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875255476	EG	On-Demand	Anodyne	MC1R	40	39
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875255477	EG	On-Demand	Anodyne	HTR1D	56	38
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875255477	EG	On-Demand	Anodyne	HTR1B	51	46
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875255477	EG	On-Demand	Anodyne	SSTR2	47	38
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875255477	EG	On-Demand	Anodyne	MC5R	35	42
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875255477	EG	On-Demand	Anodyne	MC1R	40	39
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875255478	EG	On-Demand	Anodyne	HTR1D	56	38
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875255478	EG	On-Demand	Anodyne	HTR1B	51	46
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875255478	EG	On-Demand	Anodyne	SSTR2	47	38
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875255478	EG	On-Demand	Anodyne	MC5R	35	42
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875255478	EG	On-Demand	Anodyne	MC1R	40	39
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@H]2CSC[C@H]2C1	ZINC000875255479	EG	On-Demand	Anodyne	HTR1D	56	38
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@H]2CSC[C@H]2C1	ZINC000875255479	EG	On-Demand	Anodyne	HTR1B	51	46
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@H]2CSC[C@H]2C1	ZINC000875255479	EG	On-Demand	Anodyne	SSTR2	47	38
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@H]2CSC[C@H]2C1	ZINC000875255479	EG	On-Demand	Anodyne	MC5R	35	42
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@H]2CSC[C@H]2C1	ZINC000875255479	EG	On-Demand	Anodyne	MC1R	40	39
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)c1sccc1CC#N	ZINC000875255486	GF	On-Demand	Mild	LRRK2	32	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875255488	FF	On-Demand	Anodyne	SSTR2	44	34
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875255488	FF	On-Demand	Anodyne	SLC6A4	22	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875255488	FF	On-Demand	Anodyne	TACR1	21	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875255488	FF	On-Demand	Anodyne	CCKAR	65	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875255488	FF	On-Demand	Anodyne	NMBR	21	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875255488	FF	On-Demand	Anodyne	MC3R	44	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875255488	FF	On-Demand	Anodyne	MC5R	39	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875255488	FF	On-Demand	Anodyne	CCKBR	65	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875255488	FF	On-Demand	Anodyne	GHSR	51	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875255488	FF	On-Demand	Anodyne	MC1R	40	39
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000875255489	GD	On-Demand	Mild	CACNA1I	41	32
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000875255489	GD	On-Demand	Mild	L3MBTL3	51	32
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000875255490	GD	On-Demand	Mild	CACNA1I	41	32
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000875255490	GD	On-Demand	Mild	L3MBTL3	51	32
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)[C@@]12CCCC[C@@H]1C2	ZINC000875255491	EG	On-Demand	Anodyne	L3MBTL3	69	35
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)[C@@]12CCCC[C@H]1C2	ZINC000875255492	EG	On-Demand	Anodyne	L3MBTL3	69	35
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)[C@]12CCCC[C@@H]1C2	ZINC000875255493	EG	On-Demand	Anodyne	L3MBTL3	69	35
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)[C@]12CCCC[C@H]1C2	ZINC000875255494	EG	On-Demand	Anodyne	L3MBTL3	69	35
C[C@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255504	EH	On-Demand	Clean	HTR1D	22	40
C[C@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255504	EH	On-Demand	Clean	HTR1B	22	40
C[C@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255504	EH	On-Demand	Clean	SSTR2	70	43
C[C@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255504	EH	On-Demand	Clean	MME	22	41
C[C@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255504	EH	On-Demand	Clean	EDNRB	20	41
C[C@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255504	EH	On-Demand	Clean	EDNRA	30	43
C[C@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255504	EH	On-Demand	Clean	TACR1	27	47
C[C@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255504	EH	On-Demand	Clean	CCKAR	94	44
C[C@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255504	EH	On-Demand	Clean	CTSL	23	41
C[C@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255504	EH	On-Demand	Clean	MPO	58	36
C[C@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255504	EH	On-Demand	Clean	BRS3	29	46
C[C@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255504	EH	On-Demand	Clean	NMBR	63	46
C[C@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255504	EH	On-Demand	Clean	MC3R	55	39
C[C@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255504	EH	On-Demand	Clean	MC5R	52	35
C[C@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255504	EH	On-Demand	Clean	MTNR1A	29	41
C[C@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255504	EH	On-Demand	Clean	MMP2	24	43
C[C@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255504	EH	On-Demand	Clean	MMP8	33	43
C[C@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255504	EH	On-Demand	Clean	GRIA1	22	42
C[C@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255504	EH	On-Demand	Clean	GRPR	71	33
C[C@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255504	EH	On-Demand	Clean	ECE1	51	41
C[C@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255504	EH	On-Demand	Clean	MMP11	54	33
C[C@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255504	EH	On-Demand	Clean	CCKBR	74	38
C[C@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255504	EH	On-Demand	Clean	GHSR	65	40
C[C@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255504	EH	On-Demand	Clean	MMP9	22	43
C[C@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255504	EH	On-Demand	Clean	MC1R	77	39
C[C@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255504	EH	On-Demand	Clean	MMP1	23	43
C[C@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255504	EH	On-Demand	Clean	NPR	27	41
C[C@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255504	EH	On-Demand	Clean	KISS1R	74	36
C[C@@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255505	EH	On-Demand	Clean	HTR1D	22	40
C[C@@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255505	EH	On-Demand	Clean	HTR1B	22	40
C[C@@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255505	EH	On-Demand	Clean	SSTR2	70	43
C[C@@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255505	EH	On-Demand	Clean	MME	22	41
C[C@@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255505	EH	On-Demand	Clean	EDNRB	20	41
C[C@@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255505	EH	On-Demand	Clean	EDNRA	30	43
C[C@@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255505	EH	On-Demand	Clean	TACR1	27	47
C[C@@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255505	EH	On-Demand	Clean	CCKAR	94	44
C[C@@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255505	EH	On-Demand	Clean	CTSL	23	41
C[C@@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255505	EH	On-Demand	Clean	MPO	58	36
C[C@@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255505	EH	On-Demand	Clean	BRS3	29	46
C[C@@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255505	EH	On-Demand	Clean	NMBR	63	46
C[C@@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255505	EH	On-Demand	Clean	MC3R	55	39
C[C@@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255505	EH	On-Demand	Clean	MC5R	52	35
C[C@@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255505	EH	On-Demand	Clean	MTNR1A	29	41
C[C@@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255505	EH	On-Demand	Clean	MMP2	24	43
C[C@@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255505	EH	On-Demand	Clean	MMP8	33	43
C[C@@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255505	EH	On-Demand	Clean	GRIA1	22	42
C[C@@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255505	EH	On-Demand	Clean	GRPR	71	33
C[C@@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255505	EH	On-Demand	Clean	ECE1	51	41
C[C@@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255505	EH	On-Demand	Clean	MMP11	54	33
C[C@@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255505	EH	On-Demand	Clean	CCKBR	74	38
C[C@@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255505	EH	On-Demand	Clean	GHSR	65	40
C[C@@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255505	EH	On-Demand	Clean	MMP9	22	43
C[C@@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255505	EH	On-Demand	Clean	MC1R	77	39
C[C@@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255505	EH	On-Demand	Clean	MMP1	23	43
C[C@@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255505	EH	On-Demand	Clean	NPR	27	41
C[C@@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1ccccc1O	ZINC000875255505	EH	On-Demand	Clean	KISS1R	74	36
COCc1cc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)ccc1F	ZINC000875255507	FG	On-Demand	Anodyne	DPP4	15	41
COCc1cc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)ccc1F	ZINC000875255507	FG	On-Demand	Anodyne	PREP	22	40
COCc1cc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)ccc1F	ZINC000875255508	FG	On-Demand	Anodyne	DPP4	15	41
COCc1cc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)ccc1F	ZINC000875255508	FG	On-Demand	Anodyne	PREP	22	40
COCc1cc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)ccc1F	ZINC000875255509	FG	On-Demand	Anodyne	DPP4	15	41
COCc1cc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)ccc1F	ZINC000875255509	FG	On-Demand	Anodyne	PREP	22	40
COCc1cc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)ccc1F	ZINC000875255510	FG	On-Demand	Anodyne	DPP4	15	41
COCc1cc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)ccc1F	ZINC000875255510	FG	On-Demand	Anodyne	PREP	22	40
C#CC[C@@H](COC)NC(=O)C(=O)NCc1cccc(-c2ccc(C#N)s2)c1	ZINC000875255514	GE	On-Demand	Mild	CTSV	41	32
C#CC[C@H](COC)NC(=O)C(=O)NCc1cccc(-c2ccc(C#N)s2)c1	ZINC000875255515	GE	On-Demand	Mild	CTSV	41	32
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)Nc1ccc(F)cc1Cl	ZINC000875255548	IJ	On-Demand	Anodyne	STK33	25	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2nc(-c3ccccc3)cs2)C1	ZINC000875255560	GH	On-Demand	Anodyne	P2RY12	163	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2nc(-c3ccccc3)cs2)C1	ZINC000875255562	GH	On-Demand	Anodyne	P2RY12	163	37
N#CCN(C(=O)[C@@H](Cc1cccnc1)C1CCCC1)c1ccccc1	ZINC000875255580	EH	On-Demand	Mild	C3AR1	40	41
N#CCN(C(=O)[C@H](Cc1cccnc1)C1CCCC1)c1ccccc1	ZINC000875255584	EH	On-Demand	Mild	C3AR1	40	41
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1nc(-c2ccccc2)cs1	ZINC000875255594	GI	On-Demand	Anodyne	NPY5R	18	45
COC(=O)/C=C\c1ccc(OCC(=O)N2CCN(c3cccc(C)c3)CC2)c(OC)c1	ZINC000875255601	HF	On-Demand	Anodyne	NR1H4	42	35
O=C(NCCCc1c[nH]c2ccccc12)N1CCC2(CCNC2=O)CC1	ZINC000875255613	FE	On-Demand	Anodyne	ACHE	25	40
O=C(NCCCc1c[nH]c2ccccc12)N1CCC2(CCNC2=O)CC1	ZINC000875255613	FE	On-Demand	Anodyne	SSTR2	37	49
O=C(NCCCc1c[nH]c2ccccc12)N1CCC2(CCNC2=O)CC1	ZINC000875255613	FE	On-Demand	Anodyne	GHRHR	27	42
O=C(NCCCc1c[nH]c2ccccc12)N1CCC2(CCNC2=O)CC1	ZINC000875255613	FE	On-Demand	Anodyne	BCHE	16	40
O=C(NCCCc1c[nH]c2ccccc12)N1CCC2(CCNC2=O)CC1	ZINC000875255613	FE	On-Demand	Anodyne	NMBR	64	32
O=C(NCCCc1c[nH]c2ccccc12)N1CCC2(CCNC2=O)CC1	ZINC000875255613	FE	On-Demand	Anodyne	MC3R	45	34
O=C(NCCCc1c[nH]c2ccccc12)N1CCC2(CCNC2=O)CC1	ZINC000875255613	FE	On-Demand	Anodyne	GHSR	39	43
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255617	FF	On-Demand	Anodyne	ACE	21	46
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255617	FF	On-Demand	Anodyne	SSTR2	111	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255617	FF	On-Demand	Anodyne	TACR1	30	43
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255617	FF	On-Demand	Anodyne	MC4R	52	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255617	FF	On-Demand	Anodyne	SSTR4	42	35
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255617	FF	On-Demand	Anodyne	SSTR5	42	35
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255617	FF	On-Demand	Anodyne	CCKAR	120	43
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255617	FF	On-Demand	Anodyne	BRS3	26	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255617	FF	On-Demand	Anodyne	NMBR	39	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255617	FF	On-Demand	Anodyne	MC3R	76	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255617	FF	On-Demand	Anodyne	MC5R	80	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255617	FF	On-Demand	Anodyne	MMP2	24	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255617	FF	On-Demand	Anodyne	MMP8	32	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255617	FF	On-Demand	Anodyne	GRPR	48	34
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255617	FF	On-Demand	Anodyne	ECE1	48	36
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255617	FF	On-Demand	Anodyne	MMP11	75	36
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255617	FF	On-Demand	Anodyne	CCKBR	108	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255617	FF	On-Demand	Anodyne	GHSR	64	43
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255617	FF	On-Demand	Anodyne	MMP9	23	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255617	FF	On-Demand	Anodyne	MC1R	99	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255617	FF	On-Demand	Anodyne	MMP1	20	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255617	FF	On-Demand	Anodyne	AANAT	52	30
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255617	FF	On-Demand	Anodyne	KISS1R	74	35
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255617	FF	On-Demand	Anodyne	ERAP2	40	34
O=C(NCCCc1c[nH]c2ccccc12)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875255626	GE	On-Demand	Anodyne	HTR1B	26	40
O=C(NCCCc1c[nH]c2ccccc12)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875255626	GE	On-Demand	Anodyne	TPR	15	45
O=C(NCCCc1c[nH]c2ccccc12)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875255626	GE	On-Demand	Anodyne	MPO	45	35
O=C(NCCCc1c[nH]c2ccccc12)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875255626	GE	On-Demand	Anodyne	CCKBR	45	40
O=C(NCCCc1c[nH]c2ccccc12)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875255626	GE	On-Demand	Anodyne	MC1R	40	36
O=C(NCCCCC1CC1)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000875255630	GE	On-Demand	Anodyne	ACHE	20	42
O=C(NCCCCC1CC1)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000875255630	GE	On-Demand	Anodyne	GRIN2B	57	38
O=C(NCCCCC1CC1)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000875255630	GE	On-Demand	Anodyne	CACNA1I	54	37
O=C(NCCCCC1CC1)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000875255630	GE	On-Demand	Anodyne	L3MBTL3	66	39
CC(=O)N(C)c1ccc(CNC(=O)NCCCc2c[nH]c3ccccc23)cc1	ZINC000875255632	GH	On-Demand	Anodyne	TACR1	19	40
CC(=O)N(C)c1ccc(CNC(=O)NCCCc2c[nH]c3ccccc23)cc1	ZINC000875255632	GH	On-Demand	Anodyne	MC4R	29	40
CC(=O)N(C)c1ccc(CNC(=O)NCCCc2c[nH]c3ccccc23)cc1	ZINC000875255632	GH	On-Demand	Anodyne	CCKAR	67	40
CC(=O)N(C)c1ccc(CNC(=O)NCCCc2c[nH]c3ccccc23)cc1	ZINC000875255632	GH	On-Demand	Anodyne	BCHE	15	40
CC(=O)N(C)c1ccc(CNC(=O)NCCCc2c[nH]c3ccccc23)cc1	ZINC000875255632	GH	On-Demand	Anodyne	MPO	43	39
CC(=O)N(C)c1ccc(CNC(=O)NCCCc2c[nH]c3ccccc23)cc1	ZINC000875255632	GH	On-Demand	Anodyne	BRS3	27	43
CC(=O)N(C)c1ccc(CNC(=O)NCCCc2c[nH]c3ccccc23)cc1	ZINC000875255632	GH	On-Demand	Anodyne	NMBR	48	39
CC(=O)N(C)c1ccc(CNC(=O)NCCCc2c[nH]c3ccccc23)cc1	ZINC000875255632	GH	On-Demand	Anodyne	MC3R	43	40
CC(=O)N(C)c1ccc(CNC(=O)NCCCc2c[nH]c3ccccc23)cc1	ZINC000875255632	GH	On-Demand	Anodyne	MC5R	41	35
CC(=O)N(C)c1ccc(CNC(=O)NCCCc2c[nH]c3ccccc23)cc1	ZINC000875255632	GH	On-Demand	Anodyne	MTNR1A	18	40
CC(=O)N(C)c1ccc(CNC(=O)NCCCc2c[nH]c3ccccc23)cc1	ZINC000875255632	GH	On-Demand	Anodyne	GRIA1	20	41
CC(=O)N(C)c1ccc(CNC(=O)NCCCc2c[nH]c3ccccc23)cc1	ZINC000875255632	GH	On-Demand	Anodyne	CCKBR	42	38
CC(=O)N(C)c1ccc(CNC(=O)NCCCc2c[nH]c3ccccc23)cc1	ZINC000875255632	GH	On-Demand	Anodyne	MC1R	55	40
CC(=O)N(C)c1ccc(CNC(=O)NCCCc2c[nH]c3ccccc23)cc1	ZINC000875255632	GH	On-Demand	Anodyne	MMP1	15	40
CC(=O)N(C)c1ccc(CNC(=O)NCCCc2c[nH]c3ccccc23)cc1	ZINC000875255632	GH	On-Demand	Anodyne	KISS1R	54	34
C[C@]1(NC(=O)C(F)(F)F)CCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255641	GF	On-Demand	Anodyne	SSTR2	27	44
C[C@]1(NC(=O)C(F)(F)F)CCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255641	GF	On-Demand	Anodyne	GHRHR	25	40
C[C@]1(NC(=O)C(F)(F)F)CCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255641	GF	On-Demand	Anodyne	TACR1	20	40
C[C@]1(NC(=O)C(F)(F)F)CCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255641	GF	On-Demand	Anodyne	NMBR	83	36
C[C@]1(NC(=O)C(F)(F)F)CCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255641	GF	On-Demand	Anodyne	GRPR	44	36
C[C@]1(NC(=O)C(F)(F)F)CCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255641	GF	On-Demand	Anodyne	CCKBR	48	39
C[C@]1(NC(=O)C(F)(F)F)CCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875255641	GF	On-Demand	Anodyne	GHSR	33	44
COC(=O)/C=C\c1ccc(OC[C@H]2CCCCO2)c(OC)c1	ZINC000875255651	DF	On-Demand	Anodyne	NR1H4	43	40
COC(=O)/C=C\c1ccc(OC[C@H]2CCCCO2)c(OC)c1	ZINC000875255651	DF	On-Demand	Anodyne	TUBB1	46	38
COC(=O)/C=C\c1ccc(OC[C@H]2CCCCO2)c(OC)c1	ZINC000875255651	DF	On-Demand	Anodyne	ACKR3	48	33
COC(=O)/C=C\c1ccc(OC[C@@H]2CCCCO2)c(OC)c1	ZINC000875255653	DF	On-Demand	Anodyne	NR1H4	43	40
COC(=O)/C=C\c1ccc(OC[C@@H]2CCCCO2)c(OC)c1	ZINC000875255653	DF	On-Demand	Anodyne	TUBB1	46	38
COC(=O)/C=C\c1ccc(OC[C@@H]2CCCCO2)c(OC)c1	ZINC000875255653	DF	On-Demand	Anodyne	ACKR3	48	33
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875255672	GI	On-Demand	Anodyne	LRRK2	26	41
COC(=O)/C=C\c1ccc(OC[C@@H](C#N)CCC#N)c(OC)c1	ZINC000875255673	DF	On-Demand	Mild	TUBB1	41	35
COC(=O)/C=C\c1ccc(OC[C@H](C#N)CCC#N)c(OC)c1	ZINC000875255674	DF	On-Demand	Mild	TUBB1	41	35
C=CCN(Cc1cccc(C#N)c1)C(=O)[C@@H](NC=O)C(C)C	ZINC000875255693	CD	On-Demand	Mild	PTGES	30	43
COCc1cc(CNC(=O)N2CCC(CO)(CO)CC2)ccc1F	ZINC000875255712	ED	On-Demand	Anodyne	CACNA1H	42	32
NC(=O)Cc1cccc2c1CCN(C(=O)NCCCc1c[nH]c3ccccc13)C2	ZINC000875255717	GF	On-Demand	Anodyne	SSTR2	35	44
NC(=O)Cc1cccc2c1CCN(C(=O)NCCCc1c[nH]c3ccccc13)C2	ZINC000875255717	GF	On-Demand	Anodyne	MC3R	48	34
NC(=O)Cc1cccc2c1CCN(C(=O)NCCCc1c[nH]c3ccccc13)C2	ZINC000875255717	GF	On-Demand	Anodyne	MC5R	42	36
NC(=O)Cc1cccc2c1CCN(C(=O)NCCCc1c[nH]c3ccccc13)C2	ZINC000875255717	GF	On-Demand	Anodyne	MC1R	57	35
NC(=O)Cc1cccc2c1CCN(C(=O)NCCCc1c[nH]c3ccccc13)C2	ZINC000875255717	GF	On-Demand	Anodyne	KISS1R	60	32
C[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1cc2ccccc2s1	ZINC000875255718	GG	On-Demand	Anodyne	L3MBTL3	62	41
CONC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255733	FE	On-Demand	Anodyne	HTR1A	17	44
CONC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255733	FE	On-Demand	Anodyne	HTR1D	62	37
CONC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255733	FE	On-Demand	Anodyne	HTR1B	55	48
CONC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255733	FE	On-Demand	Anodyne	SSTR2	92	42
CONC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255733	FE	On-Demand	Anodyne	EDNRA	16	43
CONC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255733	FE	On-Demand	Anodyne	TACR1	27	40
CONC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255733	FE	On-Demand	Anodyne	CCKAR	68	39
CONC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255733	FE	On-Demand	Anodyne	NMBR	27	41
CONC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255733	FE	On-Demand	Anodyne	MC3R	56	37
CONC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255733	FE	On-Demand	Anodyne	MC5R	48	41
CONC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255733	FE	On-Demand	Anodyne	MAPK9	15	42
CONC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255733	FE	On-Demand	Anodyne	CCKBR	66	39
CONC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255733	FE	On-Demand	Anodyne	GHSR	56	39
CONC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255733	FE	On-Demand	Anodyne	MC1R	45	38
CONC(=O)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255733	FE	On-Demand	Anodyne	KISS1R	51	31
CCCCCCCNC(=O)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000875255749	GF	On-Demand	Mild	HTR4	45	36
CCCCCCCNC(=O)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000875255749	GF	On-Demand	Mild	P2RY12	71	35
CCCCCCCNC(=O)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000875255749	GF	On-Demand	Mild	GRIN2B	59	37
CCCCCCCNC(=O)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000875255749	GF	On-Demand	Mild	CCR3	16	43
CCCCCCCNC(=O)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000875255749	GF	On-Demand	Mild	EPHX2	24	52
CCCCCCCNC(=O)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000875255749	GF	On-Demand	Mild	CACNA1I	53	36
CCCCCCCNC(=O)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000875255749	GF	On-Demand	Mild	ASAH1	89	43
CCCCCCCNC(=O)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000875255749	GF	On-Demand	Mild	L3MBTL3	62	38
O=C(NCC1CCN(C(=O)c2ccccc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875255751	FD	On-Demand	Anodyne	L3MBTL3	69	35
O=C(NCC1CCN(C(=O)c2ccccc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875255753	FD	On-Demand	Anodyne	L3MBTL3	69	35
COc1ccc(-c2csc(NC(=O)COC(=O)c3ccccc3NC(=O)c3cccs3)n2)cc1	ZINC000875255773	JJ	On-Demand	Anodyne	ROCK1	22	43
COc1ccc(-c2csc(NC(=O)COC(=O)c3ccccc3NC(=O)c3cccs3)n2)cc1	ZINC000875255773	JJ	On-Demand	Anodyne	ROCK2	15	43
COc1ccc(-c2csc(NC(=O)COC(=O)c3ccccc3NC(=O)c3cccs3)n2)cc1	ZINC000875255773	JJ	On-Demand	Anodyne	TBK1	15	40
COc1ccc(-c2csc(NC(=O)COC(=O)c3ccccc3NC(=O)c3cccs3)n2)cc1	ZINC000875255773	JJ	On-Demand	Anodyne	STK33	27	41
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)Nc1cccc(Cl)c1	ZINC000875255780	HI	On-Demand	Anodyne	KISS1R	22	43
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)Nc1cccc(Cl)c1	ZINC000875255780	HI	On-Demand	Anodyne	KCNK3	40	46
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)Nc1cccc(Cl)c1	ZINC000875255780	HI	On-Demand	Anodyne	KCNK9	34	46
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)Nc1ccccc1-c1ccccc1	ZINC000875255788	JK	On-Demand	Anodyne	STK33	25	42
NS(=O)(=O)c1ccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875255795	JE	On-Demand	Anodyne	CA2	72	54
NS(=O)(=O)c1ccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875255795	JE	On-Demand	Anodyne	CA1	68	51
NS(=O)(=O)c1ccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875255795	JE	On-Demand	Anodyne	CA7	31	51
NS(=O)(=O)c1ccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875255795	JE	On-Demand	Anodyne	CA5B	74	51
NS(=O)(=O)c1ccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875255795	JE	On-Demand	Anodyne	CA4	62	43
NS(=O)(=O)c1ccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875255795	JE	On-Demand	Anodyne	CA5A	80	51
NS(=O)(=O)c1ccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875255795	JE	On-Demand	Anodyne	CA14	20	45
NS(=O)(=O)c1ccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875255795	JE	On-Demand	Anodyne	CA12	47	40
NS(=O)(=O)c1ccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875255795	JE	On-Demand	Anodyne	CA9	53	42
NS(=O)(=O)c1ccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875255795	JE	On-Demand	Anodyne	MTCA1	45	40
NS(=O)(=O)c1ccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875255795	JE	On-Demand	Anodyne	P96878_MYCTU	56	40
N#Cc1ccc(Cl)cc1NC(=O)COC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875255805	II	On-Demand	Mild	KISS1R	22	40
Cc1ccc(CNC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875255810	HH	On-Demand	Anodyne	HDAC1	22	41
Cc1ccc(CNC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875255810	HH	On-Demand	Anodyne	HDAC2	18	41
C[C@H](NC(=O)C(=O)NCCCC1CC1)c1ccc(C(F)(F)F)nc1	ZINC000875255811	EF	On-Demand	Anodyne	TRPV1	83	36
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NCc1cocn1	ZINC000875255831	EF	On-Demand	Anodyne	SIGMAR1	18	44
O=C(Nc1ccccc1C(=O)OCC(=O)N1CCCc2ccccc21)c1cccs1	ZINC000875255832	HI	On-Demand	Anodyne	AVPR2	57	41
O=C(Nc1ccccc1C(=O)OCC(=O)N1CCCc2ccccc21)c1cccs1	ZINC000875255832	HI	On-Demand	Anodyne	NOS1	24	42
O=C(NCCO)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255839	FD	On-Demand	Anodyne	HTR1D	53	37
O=C(NCCO)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255839	FD	On-Demand	Anodyne	HTR1B	47	44
O=C(NCCO)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255839	FD	On-Demand	Anodyne	SSTR2	46	40
O=C(NCCO)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255839	FD	On-Demand	Anodyne	MC5R	34	40
O=C(NCCO)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255839	FD	On-Demand	Anodyne	MAPK9	15	41
O=C(NCCO)C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255839	FD	On-Demand	Anodyne	GHSR	39	40
COCc1cc(CNC(=O)N2Cc3cccc(O)c3C2)ccc1F	ZINC000875255848	EF	On-Demand	Clean	NAMPT	20	40
C#CC[C@@H](CCOC)NC(=O)C(=O)NCc1cccc(-c2ccc(C#N)s2)c1	ZINC000875255851	GE	On-Demand	Mild	CTSV	42	33
C#CC[C@H](CCOC)NC(=O)C(=O)NCc1cccc(-c2ccc(C#N)s2)c1	ZINC000875255852	GE	On-Demand	Mild	CTSV	42	33
COC(=O)/C=C\c1ccc(OCc2ccoc2C(=O)OC)c(OC)c1	ZINC000875255859	EF	On-Demand	Anodyne	TUBB1	42	36
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)c1scnc1C(F)F	ZINC000875255861	GF	On-Demand	Anodyne	F10	49	34
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)c1scnc1C(F)F	ZINC000875255861	GF	On-Demand	Anodyne	SLC9A1	47	35
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)c1scnc1C(F)F	ZINC000875255861	GF	On-Demand	Anodyne	LRRK2	36	45
COC(=O)/C=C\c1ccc(OCc2cc(-c3ccc(OC)cc3)no2)c(OC)c1	ZINC000875255869	GI	On-Demand	Anodyne	NR1H4	35	40
COC(=O)/C=C\c1ccc(OCc2cc(-c3ccc(OC)cc3)no2)c(OC)c1	ZINC000875255869	GI	On-Demand	Anodyne	ABCG2	16	41
O=C(NCCCc1c[nH]c2ccccc12)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875255872	FG	On-Demand	Anodyne	MC5R	38	40
COC(=O)/C=C\c1ccc(OC[C@@H](O)COc2ccc3ccccc3c2)c(OC)c1	ZINC000875255883	HH	On-Demand	Anodyne	ADRB2	21	52
COC(=O)/C=C\c1ccc(OC[C@@H](O)COc2ccc3ccccc3c2)c(OC)c1	ZINC000875255883	HH	On-Demand	Anodyne	CYP1B1	17	40
COC(=O)/C=C\c1ccc(OC[C@@H](O)COc2ccc3ccccc3c2)c(OC)c1	ZINC000875255883	HH	On-Demand	Anodyne	CYP1A1	19	40
COC(=O)/C=C\c1ccc(OC[C@@H](O)COc2ccc3ccccc3c2)c(OC)c1	ZINC000875255883	HH	On-Demand	Anodyne	NR1H4	48	42
COC(=O)/C=C\c1ccc(OC[C@@H](O)COc2ccc3ccccc3c2)c(OC)c1	ZINC000875255883	HH	On-Demand	Anodyne	ABCB1	22	42
COC(=O)/C=C\c1ccc(OC[C@@H](O)COc2ccc3ccccc3c2)c(OC)c1	ZINC000875255883	HH	On-Demand	Anodyne	TUBB1	50	35
COC(=O)/C=C\c1ccc(OC[C@@H](O)COc2ccc3ccccc3c2)c(OC)c1	ZINC000875255883	HH	On-Demand	Anodyne	ABCG2	16	48
COC(=O)/C=C\c1ccc(OC[C@@H](O)COc2ccc3ccccc3c2)c(OC)c1	ZINC000875255883	HH	On-Demand	Anodyne	CYSP_PLAFA	19	42
COC(=O)/C=C\c1ccc(OC[C@H](O)COc2ccc3ccccc3c2)c(OC)c1	ZINC000875255884	HH	On-Demand	Anodyne	ADRB2	21	52
COC(=O)/C=C\c1ccc(OC[C@H](O)COc2ccc3ccccc3c2)c(OC)c1	ZINC000875255884	HH	On-Demand	Anodyne	CYP1B1	17	40
COC(=O)/C=C\c1ccc(OC[C@H](O)COc2ccc3ccccc3c2)c(OC)c1	ZINC000875255884	HH	On-Demand	Anodyne	CYP1A1	19	40
COC(=O)/C=C\c1ccc(OC[C@H](O)COc2ccc3ccccc3c2)c(OC)c1	ZINC000875255884	HH	On-Demand	Anodyne	NR1H4	48	42
COC(=O)/C=C\c1ccc(OC[C@H](O)COc2ccc3ccccc3c2)c(OC)c1	ZINC000875255884	HH	On-Demand	Anodyne	ABCB1	22	42
COC(=O)/C=C\c1ccc(OC[C@H](O)COc2ccc3ccccc3c2)c(OC)c1	ZINC000875255884	HH	On-Demand	Anodyne	TUBB1	50	35
COC(=O)/C=C\c1ccc(OC[C@H](O)COc2ccc3ccccc3c2)c(OC)c1	ZINC000875255884	HH	On-Demand	Anodyne	ABCG2	16	48
COC(=O)/C=C\c1ccc(OC[C@H](O)COc2ccc3ccccc3c2)c(OC)c1	ZINC000875255884	HH	On-Demand	Anodyne	CYSP_PLAFA	19	42
C=CCN(Cc1cccc(C#N)c1)C(=O)C1(OC(C)C)CCC1	ZINC000875255887	DG	On-Demand	Mild	PTGES	28	41
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCc3c[nH]c4ccccc34)C[C@@H]1C2	ZINC000875255890	FF	On-Demand	Anodyne	TACR1	15	40
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCc3c[nH]c4ccccc34)C[C@@H]1C2	ZINC000875255890	FF	On-Demand	Anodyne	CCKAR	62	39
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCc3c[nH]c4ccccc34)C[C@@H]1C2	ZINC000875255890	FF	On-Demand	Anodyne	NMBR	77	32
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCc3c[nH]c4ccccc34)C[C@@H]1C2	ZINC000875255890	FF	On-Demand	Anodyne	GRPR	40	31
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCc3c[nH]c4ccccc34)C[C@@H]1C2	ZINC000875255890	FF	On-Demand	Anodyne	CCKBR	60	41
COC(=O)/C=C\c1ccc(OCc2ccccc2OC(F)F)c(OC)c1	ZINC000875255898	FI	On-Demand	Anodyne	APP	18	40
COC(=O)/C=C\c1ccc(OCc2ccccc2OC(F)F)c(OC)c1	ZINC000875255898	FI	On-Demand	Anodyne	NR1H4	43	42
COC(=O)/C=C\c1ccc(OCc2ccccc2OC(F)F)c(OC)c1	ZINC000875255898	FI	On-Demand	Anodyne	TUBB1	41	35
COC(=O)/C=C\c1ccc(OCc2ccccc2OC(F)F)c(OC)c1	ZINC000875255898	FI	On-Demand	Anodyne	AKR1C3	22	42
COC(=O)/C=C\c1ccc(OCc2ccccc2OC(F)F)c(OC)c1	ZINC000875255898	FI	On-Demand	Anodyne	ABCG2	15	41
COC[C@@H](NC(=O)C(=O)N[C@H](C)c1ccnn1C)c1cccc(C(F)(F)F)c1	ZINC000875255900	GE	On-Demand	Anodyne	PDS	42	36
COC[C@H](NC(=O)C(=O)N[C@@H](C)c1ccnn1C)c1cccc(C(F)(F)F)c1	ZINC000875255902	GE	On-Demand	Anodyne	PDS	42	36
COC[C@H](NC(=O)C(=O)N[C@H](C)c1ccnn1C)c1cccc(C(F)(F)F)c1	ZINC000875255904	GE	On-Demand	Anodyne	PDS	42	36
COC[C@@H](NC(=O)C(=O)N[C@@H](C)c1ccnn1C)c1cccc(C(F)(F)F)c1	ZINC000875255906	GE	On-Demand	Anodyne	PDS	42	36
N#CCN(C(=O)CC(F)(F)C(F)(F)F)c1ccccc1	ZINC000875255916	CG	On-Demand	Mild	MLYCD	18	48
Cn1nnnc1C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255972	FE	On-Demand	Anodyne	HTR1A	15	45
Cn1nnnc1C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255972	FE	On-Demand	Anodyne	HTR1D	78	45
Cn1nnnc1C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255972	FE	On-Demand	Anodyne	HTR1B	71	45
Cn1nnnc1C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255972	FE	On-Demand	Anodyne	SSTR2	46	39
Cn1nnnc1C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255972	FE	On-Demand	Anodyne	HTR1F	48	35
Cn1nnnc1C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255972	FE	On-Demand	Anodyne	MC4R	31	40
Cn1nnnc1C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255972	FE	On-Demand	Anodyne	MC3R	60	35
Cn1nnnc1C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255972	FE	On-Demand	Anodyne	MC5R	55	38
Cn1nnnc1C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255972	FE	On-Demand	Anodyne	MAPK9	16	40
Cn1nnnc1C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255972	FE	On-Demand	Anodyne	GHSR	57	42
Cn1nnnc1C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255972	FE	On-Demand	Anodyne	CCR2	17	40
Cn1nnnc1C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255972	FE	On-Demand	Anodyne	MC1R	62	40
Cn1nnnc1C1CCN(C(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000875255972	FE	On-Demand	Anodyne	KISS1R	43	31
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000875255975	JK	On-Demand	Anodyne	GRM4	15	48
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000875255975	JK	On-Demand	Anodyne	STK33	25	41
CC(=O)Nc1cccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875255976	IH	On-Demand	Anodyne	KISS1R	22	40
CC(=O)Nc1cccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875255976	IH	On-Demand	Anodyne	KCNK3	70	49
CC(=O)Nc1cccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875255976	IH	On-Demand	Anodyne	KCNK9	73	49
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)Nc1cccc([N+](=O)[O-])c1	ZINC000875255979	IH	On-Demand	Bother	CACNA1D	55	37
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)Nc1cccc([N+](=O)[O-])c1	ZINC000875255979	IH	On-Demand	Bother	KCNK9	24	43
C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)C1(OC(C)C)CCC1	ZINC000875255988	EG	On-Demand	Mild	CACNA1C	42	38
C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)C1(OC(C)C)CCC1	ZINC000875255988	EG	On-Demand	Mild	CACNA1D	67	38
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875255989	JE	On-Demand	Anodyne	CA2	73	57
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875255989	JE	On-Demand	Anodyne	CA1	63	57
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875255989	JE	On-Demand	Anodyne	CA7	39	57
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875255989	JE	On-Demand	Anodyne	CA5B	76	57
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875255989	JE	On-Demand	Anodyne	CA4	51	47
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875255989	JE	On-Demand	Anodyne	CA5A	79	52
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875255989	JE	On-Demand	Anodyne	CA14	30	44
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875255989	JE	On-Demand	Anodyne	CA12	44	48
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875255989	JE	On-Demand	Anodyne	CA9	48	48
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875255989	JE	On-Demand	Anodyne	CYNT	18	40
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875255989	JE	On-Demand	Anodyne	NCE103	17	43
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875255989	JE	On-Demand	Anodyne	P96878_MYCTU	25	43
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875255989	JE	On-Demand	Anodyne	A6YCJ1_9METZ	16	44
NS(=O)(=O)c1cccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875256000	JE	On-Demand	Anodyne	CA2	31	57
NS(=O)(=O)c1cccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875256000	JE	On-Demand	Anodyne	CA1	24	42
NS(=O)(=O)c1cccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875256000	JE	On-Demand	Anodyne	CA7	18	41
NS(=O)(=O)c1cccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875256000	JE	On-Demand	Anodyne	CA5B	60	41
NS(=O)(=O)c1cccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875256000	JE	On-Demand	Anodyne	CA4	35	47
NS(=O)(=O)c1cccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875256000	JE	On-Demand	Anodyne	CA5A	64	41
NS(=O)(=O)c1cccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875256000	JE	On-Demand	Anodyne	CA12	15	43
NS(=O)(=O)c1cccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875256000	JE	On-Demand	Anodyne	TTK	25	49
NS(=O)(=O)c1cccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875256000	JE	On-Demand	Anodyne	KISS1R	22	40
NS(=O)(=O)c1cccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875256000	JE	On-Demand	Anodyne	KCNK9	28	43
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)c1cccc(Br)c1	ZINC000875256001	IJ	On-Demand	Anodyne	KCNK9	20	44
O=C(NCc1cocn1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875256036	DE	On-Demand	Anodyne	CPT1A	88	35
O=C(NCc1cocn1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875256038	DE	On-Demand	Anodyne	CPT1A	88	35
O=C(NCc1cocn1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875256040	DE	On-Demand	Anodyne	CPT1A	88	35
O=C(NCc1cocn1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875256041	DE	On-Demand	Anodyne	CPT1A	88	35
CC(=O)c1cccc(NC(=O)[C@H](C)OC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875256050	II	On-Demand	Anodyne	KCNK3	76	49
CC(=O)c1cccc(NC(=O)[C@H](C)OC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875256050	II	On-Demand	Anodyne	KCNK9	71	49
CC(=O)c1cccc(NC(=O)[C@@H](C)OC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875256052	II	On-Demand	Anodyne	KCNK3	76	49
CC(=O)c1cccc(NC(=O)[C@@H](C)OC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875256052	II	On-Demand	Anodyne	KCNK9	71	49
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000875256070	JK	On-Demand	Anodyne	ROCK1	21	43
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000875256070	JK	On-Demand	Anodyne	ROCK2	15	43
O=C(NCCCC1CC1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875256087	EF	On-Demand	Anodyne	BMP1	17	41
O=C(NCCCC1CC1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875256088	EF	On-Demand	Anodyne	BMP1	17	41
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)c1cccc(Cl)c1	ZINC000875256113	HK	On-Demand	Anodyne	KCNK3	37	42
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)c1cccc(Cl)c1	ZINC000875256113	HK	On-Demand	Anodyne	KCNK9	37	42
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)Nc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000875256136	JI	On-Demand	Bother	STK33	24	41
CC[C@@](C)(NC(=O)NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O)c1ccccc1	ZINC000875256146	FF	On-Demand	Anodyne	AMY2	46	32
CC[C@@](C)(NC(=O)N[C@@H]1CCS(=O)(=O)[C@@H]1C)c1ccccc1	ZINC000875256148	DE	On-Demand	Anodyne	AMY2	44	31
CC[C@@](C)(NC(=O)NCc1ccnc(F)c1)c1ccccc1	ZINC000875256169	DG	On-Demand	Anodyne	PDS	48	35
CC[C@@](C)(NC(=O)NCC(C)(C)C(=O)N1CCCC1)c1ccccc1	ZINC000875256175	EG	On-Demand	Anodyne	FKBP1A	21	41
COC(=O)/C=C\c1ccc(OCC(=O)N2CCC[C@H]2c2cc(OC)ccc2OC)c(OC)c1	ZINC000875256177	JH	On-Demand	Anodyne	CPT1A	92	39
COC(=O)/C=C\c1ccc(OCC(=O)N2CCC[C@H]2c2cc(OC)ccc2OC)c(OC)c1	ZINC000875256177	JH	On-Demand	Anodyne	NR1H4	38	40
COC(=O)/C=C\c1ccc(OCC(=O)N2CCC[C@H]2c2cc(OC)ccc2OC)c(OC)c1	ZINC000875256177	JH	On-Demand	Anodyne	ACKR3	46	33
COC(=O)/C=C\c1ccc(OCC(=O)N2CCC[C@@H]2c2cc(OC)ccc2OC)c(OC)c1	ZINC000875256184	JH	On-Demand	Anodyne	CPT1A	92	39
COC(=O)/C=C\c1ccc(OCC(=O)N2CCC[C@@H]2c2cc(OC)ccc2OC)c(OC)c1	ZINC000875256184	JH	On-Demand	Anodyne	NR1H4	38	40
COC(=O)/C=C\c1ccc(OCC(=O)N2CCC[C@@H]2c2cc(OC)ccc2OC)c(OC)c1	ZINC000875256184	JH	On-Demand	Anodyne	ACKR3	46	33
CC[C@H](C[C@H](C)O)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875256196	DF	On-Demand	Anodyne	SSTR2	33	40
CC[C@H](C[C@H](C)O)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875256196	DF	On-Demand	Anodyne	MME	22	41
CC[C@H](C[C@H](C)O)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875256196	DF	On-Demand	Anodyne	EDNRA	35	43
CC[C@H](C[C@H](C)O)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875256196	DF	On-Demand	Anodyne	TACR1	25	48
CC[C@H](C[C@H](C)O)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875256196	DF	On-Demand	Anodyne	CCKAR	89	43
CC[C@H](C[C@H](C)O)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875256196	DF	On-Demand	Anodyne	CTSL	25	44
CC[C@H](C[C@H](C)O)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875256196	DF	On-Demand	Anodyne	MPO	46	38
CC[C@H](C[C@H](C)O)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875256196	DF	On-Demand	Anodyne	BRS3	28	44
CC[C@H](C[C@H](C)O)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875256196	DF	On-Demand	Anodyne	NMBR	69	34
CC[C@H](C[C@H](C)O)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875256196	DF	On-Demand	Anodyne	MC3R	62	38
CC[C@H](C[C@H](C)O)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875256196	DF	On-Demand	Anodyne	MC5R	70	35
CC[C@H](C[C@H](C)O)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875256196	DF	On-Demand	Anodyne	MMP2	25	50
CC[C@H](C[C@H](C)O)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875256196	DF	On-Demand	Anodyne	MMP8	36	48
CC[C@H](C[C@H](C)O)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875256196	DF	On-Demand	Anodyne	GRIA1	20	41
CC[C@H](C[C@H](C)O)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875256196	DF	On-Demand	Anodyne	MMP14	19	41
CC[C@H](C[C@H](C)O)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875256196	DF	On-Demand	Anodyne	GRPR	91	37
CC[C@H](C[C@H](C)O)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875256196	DF	On-Demand	Anodyne	ECE1	51	41
CC[C@H](C[C@H](C)O)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875256196	DF	On-Demand	Anodyne	MMP11	56	34
CC[C@H](C[C@H](C)O)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875256196	DF	On-Demand	Anodyne	CCKBR	63	38
CC[C@H](C[C@H](C)O)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875256196	DF	On-Demand	Anodyne	GHSR	58	41
CC[C@H](C[C@H](C)O)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875256196	DF	On-Demand	Anodyne	MMP9	22	48
CC[C@H](C[C@H](C)O)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875256196	DF	On-Demand	Anodyne	MC1R	88	38
CC[C@H](C[C@H](C)O)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875256196	DF	On-Demand	Anodyne	MMP7	20	48
CC[C@H](C[C@H](C)O)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875256196	DF	On-Demand	Anodyne	MMP1	24	48
CC[C@H](C[C@H](C)O)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875256196	DF	On-Demand	Anodyne	NPR	27	41
CC[C@H](C[C@H](C)O)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875256196	DF	On-Demand	Anodyne	KISS1R	76	36
CC[C@H](C[C@H](C)O)NC(=O)NCCCc1c[nH]c2ccccc12	ZINC000875256196	DF	On-Demand	Anodyne	ERAP2	40	37
CSC[C@@H](C)NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875256202	FD	On-Demand	Anodyne	ETHR	62	49
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)Nc1cccc(C(F)(F)F)c1	ZINC000875256213	IJ	On-Demand	Anodyne	KCNK3	43	38
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)Nc1cccc(C(F)(F)F)c1	ZINC000875256213	IJ	On-Demand	Anodyne	KCNK9	43	43
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C1(OC(C)C)CCC1	ZINC000875256282	GE	On-Demand	Anodyne	LRRK2	30	43
COCCN(CC1CCN(C)CC1)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875256285	GG	On-Demand	Anodyne	HTR1A	17	43
COCCN(CC1CCN(C)CC1)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875256285	GG	On-Demand	Anodyne	HTR1D	60	41
COCCN(CC1CCN(C)CC1)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875256285	GG	On-Demand	Anodyne	HTR1B	55	45
COCCN(CC1CCN(C)CC1)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875256285	GG	On-Demand	Anodyne	SLC6A4	15	41
COCCN(CC1CCN(C)CC1)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875256285	GG	On-Demand	Anodyne	HTR4	35	43
COCCN(CC1CCN(C)CC1)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000875256285	GG	On-Demand	Anodyne	MC1R	17	40
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875256287	EG	On-Demand	Anodyne	HTR1A	19	43
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875256287	EG	On-Demand	Anodyne	HTR1D	48	34
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875256287	EG	On-Demand	Anodyne	HTR1B	39	43
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875256287	EG	On-Demand	Anodyne	SSTR2	79	37
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875256287	EG	On-Demand	Anodyne	SLC6A4	16	42
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875256287	EG	On-Demand	Anodyne	EDNRA	26	40
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875256287	EG	On-Demand	Anodyne	TACR1	30	42
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875256287	EG	On-Demand	Anodyne	MC4R	37	41
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875256287	EG	On-Demand	Anodyne	TACR2	19	42
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875256287	EG	On-Demand	Anodyne	CCKAR	101	40
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875256287	EG	On-Demand	Anodyne	NMBR	38	41
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875256287	EG	On-Demand	Anodyne	MC3R	72	39
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875256287	EG	On-Demand	Anodyne	MC5R	71	43
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875256287	EG	On-Demand	Anodyne	GRPR	66	31
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875256287	EG	On-Demand	Anodyne	ECE1	42	34
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875256287	EG	On-Demand	Anodyne	MMP11	57	33
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875256287	EG	On-Demand	Anodyne	CCKBR	89	41
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875256287	EG	On-Demand	Anodyne	GHSR	48	35
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875256287	EG	On-Demand	Anodyne	MMP9	16	43
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000875256287	EG	On-Demand	Anodyne	MC1R	73	41
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)NC12CC3CC(CC(C3)C1)C2	ZINC000875256291	II	On-Demand	Anodyne	CNR2	15	50
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)NC12CC3CC(CC(C3)C1)C2	ZINC000875256291	II	On-Demand	Anodyne	EPHX2	51	41
O=C(NCCCc1c[nH]c2ccccc12)N1CCC(CO)(CO)CC1	ZINC000875256300	ED	On-Demand	Anodyne	ACHE	24	41
O=C(NCCCc1c[nH]c2ccccc12)N1CCC(CO)(CO)CC1	ZINC000875256300	ED	On-Demand	Anodyne	HTR1D	56	36
O=C(NCCCc1c[nH]c2ccccc12)N1CCC(CO)(CO)CC1	ZINC000875256300	ED	On-Demand	Anodyne	HTR1B	46	41
O=C(NCCCc1c[nH]c2ccccc12)N1CCC(CO)(CO)CC1	ZINC000875256300	ED	On-Demand	Anodyne	SSTR2	42	47
O=C(NCCCc1c[nH]c2ccccc12)N1CCC(CO)(CO)CC1	ZINC000875256300	ED	On-Demand	Anodyne	EDNRA	15	42
O=C(NCCCc1c[nH]c2ccccc12)N1CCC(CO)(CO)CC1	ZINC000875256300	ED	On-Demand	Anodyne	TACR1	20	47
O=C(NCCCc1c[nH]c2ccccc12)N1CCC(CO)(CO)CC1	ZINC000875256300	ED	On-Demand	Anodyne	CCKAR	43	39
O=C(NCCCc1c[nH]c2ccccc12)N1CCC(CO)(CO)CC1	ZINC000875256300	ED	On-Demand	Anodyne	BCHE	15	41
O=C(NCCCc1c[nH]c2ccccc12)N1CCC(CO)(CO)CC1	ZINC000875256300	ED	On-Demand	Anodyne	MPO	49	36
O=C(NCCCc1c[nH]c2ccccc12)N1CCC(CO)(CO)CC1	ZINC000875256300	ED	On-Demand	Anodyne	BRS3	25	40
O=C(NCCCc1c[nH]c2ccccc12)N1CCC(CO)(CO)CC1	ZINC000875256300	ED	On-Demand	Anodyne	NMBR	48	34
O=C(NCCCc1c[nH]c2ccccc12)N1CCC(CO)(CO)CC1	ZINC000875256300	ED	On-Demand	Anodyne	MC5R	34	41
O=C(NCCCc1c[nH]c2ccccc12)N1CCC(CO)(CO)CC1	ZINC000875256300	ED	On-Demand	Anodyne	ECE1	42	35
O=C(NCCCc1c[nH]c2ccccc12)N1CCC(CO)(CO)CC1	ZINC000875256300	ED	On-Demand	Anodyne	CCKBR	53	40
O=C(NCCCc1c[nH]c2ccccc12)N1CCC(CO)(CO)CC1	ZINC000875256300	ED	On-Demand	Anodyne	GHSR	47	41
O=C(NCCCc1c[nH]c2ccccc12)N1CCC(CO)(CO)CC1	ZINC000875256300	ED	On-Demand	Anodyne	MC1R	44	37
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)C1(F)CCOCC1	ZINC000875256315	FE	On-Demand	Anodyne	LRRK2	30	41
CCN(Cc1ccc2c(c1)OCCO2)C(=O)COc1ccc(/C=C/C(=O)OC)cc1OC	ZINC000875256317	IG	On-Demand	Anodyne	NR1H4	44	40
CCN(Cc1ccc2c(c1)OCCO2)C(=O)COc1ccc(/C=C\C(=O)OC)cc1OC	ZINC000875256318	IG	On-Demand	Anodyne	NR1H4	44	40
COC(=O)/C=C\c1ccc(OCCOc2cc(C)cc(C)c2)c(OC)c1	ZINC000875256326	FH	On-Demand	Anodyne	APP	21	46
COC(=O)/C=C\c1ccc(OCCOc2cc(C)cc(C)c2)c(OC)c1	ZINC000875256326	FH	On-Demand	Anodyne	TUBB1	61	39
COC(=O)/C=C\c1ccc(OCCOc2cc(C)cc(C)c2)c(OC)c1	ZINC000875256326	FH	On-Demand	Anodyne	ABCG2	15	44
COC(=O)/C=C\c1ccc(OCc2csc(-c3cccs3)n2)c(OC)c1	ZINC000875256330	GJ	On-Demand	Anodyne	TNFRSF1A	21	42
C[C@H]1C[C@H](CO)CCN1C(=O)C(=O)NCc1cccc(-c2ccc(C#N)s2)c1	ZINC000875256333	GF	On-Demand	Mild	CTSV	40	31
CC(C)(C)OC(=O)N[C@@H]1CC=C(C(=O)N(CC#N)c2ccccc2)C1	ZINC000875256357	EG	On-Demand	Mild	PAPA1_CARPA	37	41
CCCC[C@@H](COC)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875256378	DC	On-Demand	Anodyne	CTSK	36	42
CCCC[C@H](COC)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875256379	DC	On-Demand	Anodyne	CTSK	36	42
CCCC[C@@H](COC)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875256380	DC	On-Demand	Anodyne	CTSK	36	42
CCCC[C@H](COC)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875256381	DC	On-Demand	Anodyne	CTSK	36	42
CCCC[C@@H](COC)NC(=O)C(=O)N1CCN(C)c2ncccc2C1	ZINC000875256420	ED	On-Demand	Anodyne	P2RY12	45	34
CCCC[C@H](COC)NC(=O)C(=O)N1CCN(C)c2ncccc2C1	ZINC000875256421	ED	On-Demand	Anodyne	P2RY12	45	34
C[C@H](NC(=O)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1)c1ccnn1C	ZINC000875256441	GD	On-Demand	Anodyne	GRIN2B	40	39
C[C@H](NC(=O)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1)c1ccnn1C	ZINC000875256441	GD	On-Demand	Anodyne	CACNA1I	41	33
COC(=O)/C=C\c1ccc(OCC2CCCCC2)c(OC)c1	ZINC000875256447	DH	On-Demand	Anodyne	APP	19	41
COC(=O)/C=C\c1ccc(OCC2CCCCC2)c(OC)c1	ZINC000875256447	DH	On-Demand	Anodyne	NR1H4	50	45
COC(=O)/C=C\c1ccc(OCC2CCCCC2)c(OC)c1	ZINC000875256447	DH	On-Demand	Anodyne	TUBB1	48	39
COC(=O)/C=C\c1ccc(OCC2CCCCC2)c(OC)c1	ZINC000875256447	DH	On-Demand	Anodyne	HPGD	29	44
COC(=O)/C=C\c1ccc(OCC2CCCCC2)c(OC)c1	ZINC000875256447	DH	On-Demand	Anodyne	ACKR3	48	34
O=C(NCC1CCN(C(=O)c2ccccc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875256448	GE	On-Demand	Anodyne	GRIN2B	53	34
O=C(NCC1CCN(C(=O)c2ccccc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875256448	GE	On-Demand	Anodyne	L3MBTL3	66	36
CC(=O)C1CCN(C(=O)C(=O)NCC2CCN(C(=O)c3ccccc3)CC2)CC1	ZINC000875256452	GD	On-Demand	Anodyne	GRIN2B	56	35
CC(=O)C1CCN(C(=O)C(=O)NCC2CCN(C(=O)c3ccccc3)CC2)CC1	ZINC000875256452	GD	On-Demand	Anodyne	EPHX2	17	53
CC(=O)C1CCN(C(=O)C(=O)NCC2CCN(C(=O)c3ccccc3)CC2)CC1	ZINC000875256452	GD	On-Demand	Anodyne	CACNA1I	58	37
CC(=O)C1CCN(C(=O)C(=O)NCC2CCN(C(=O)c3ccccc3)CC2)CC1	ZINC000875256452	GD	On-Demand	Anodyne	L3MBTL3	81	37
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)[C@@H](NC=O)C(C)C	ZINC000875256455	FC	On-Demand	Anodyne	LRRK2	31	44
COCc1cc(CNC(=O)N[C@H](C)C2CN(C(=O)OC(C)(C)C)C2)ccc1F	ZINC000875256485	GG	On-Demand	Anodyne	GPR119	19	47
COCc1cc(CNC(=O)N[C@@H](C)C2CN(C(=O)OC(C)(C)C)C2)ccc1F	ZINC000875256486	GG	On-Demand	Anodyne	GPR119	19	47
CONC(=O)C1CCN(C(=O)N[C@@H](COc2ccccc2)c2ccccc2)CC1	ZINC000875256491	GF	On-Demand	Anodyne	CCR5	27	40
CONC(=O)C1CCN(C(=O)N[C@H](COc2ccccc2)c2ccccc2)CC1	ZINC000875256492	GF	On-Demand	Anodyne	CCR5	27	40
COC(=O)/C=C\c1ccc(OCc2c(F)c(F)c(F)c(F)c2F)c(OC)c1	ZINC000875256494	GI	On-Demand	Anodyne	APP	21	47
COC(=O)/C=C\c1ccc(OCc2c(F)c(F)c(F)c(F)c2F)c(OC)c1	ZINC000875256494	GI	On-Demand	Anodyne	CYP1A1	15	43
COC(=O)/C=C\c1ccc(OCc2c(F)c(F)c(F)c(F)c2F)c(OC)c1	ZINC000875256494	GI	On-Demand	Anodyne	NR1H4	43	37
COC(=O)/C=C\c1ccc(OCc2c(F)c(F)c(F)c(F)c2F)c(OC)c1	ZINC000875256494	GI	On-Demand	Anodyne	TUBB1	60	43
COC(=O)/C=C\c1ccc(OCc2c(F)c(F)c(F)c(F)c2F)c(OC)c1	ZINC000875256494	GI	On-Demand	Anodyne	ABCG2	18	48
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)c1sccc1CC#N	ZINC000875256495	FG	On-Demand	Mild	SLC9A1	50	40
COCc1cc(CNC(=O)N2Cc3cccnc3N3CCC[C@H]3C2)ccc1F	ZINC000875256496	GG	On-Demand	Anodyne	NOS2	47	32
C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)[C@@H](NC=O)C(C)C	ZINC000875256504	DD	On-Demand	Mild	CACNA1D	54	37
O=C(NCc1cocn1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875256506	DE	On-Demand	Anodyne	PREP	43	41
O=C(NCc1cocn1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875256508	DE	On-Demand	Anodyne	PREP	43	41
O=C(NCc1cocn1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875256509	DE	On-Demand	Anodyne	PREP	43	41
O=C(NCc1cocn1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875256510	DE	On-Demand	Anodyne	PREP	43	41
O=C(Nc1ccccc1C(=O)OCc1nc2ccccc2s1)c1cccs1	ZINC000875256517	GJ	On-Demand	Anodyne	STK33	33	43
O=C(Nc1ccccc1C(=O)OCC(=O)N1CCC(Cc2ccccc2)CC1)c1cccs1	ZINC000875256533	JJ	On-Demand	Anodyne	GRIN2B	65	40
CC[C@@](C)(NC(=O)N[C@@H]1C[C@@H](C(N)=O)C1)c1ccccc1	ZINC000875256548	CD	On-Demand	Anodyne	AMY2	56	33
CC[C@@](C)(NC(=O)NC1CC(C(N)=O)C1)c1ccccc1	ZINC000875256549	CD	On-Demand	Anodyne	AMY2	56	33
CC[C@@](C)(NC(=O)Nc1cnn(C2CCN(C)CC2)c1)c1ccccc1	ZINC000875256596	FH	On-Demand	Anodyne	AMY2	42	29
CC[C@@](C)(NC(=O)Nc1cnn(C2CCN(C)CC2)c1)c1ccccc1	ZINC000875256596	FH	On-Demand	Anodyne	PANC	52	35
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)NNC(=O)c1ccc(Cl)cc1	ZINC000875256618	JG	On-Demand	Reactive	F10	28	44
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)NNC(=O)c1ccc(Cl)cc1	ZINC000875256618	JG	On-Demand	Reactive	HDAC1	23	40
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)Nc1ccc2ccccc2c1	ZINC000875256625	IJ	On-Demand	Anodyne	KCNK9	15	41
C#CC[C@H](CCOC)NC(=O)N[C@@](C)(CC)c1ccccc1	ZINC000875256633	DG	On-Demand	Mild	AMY2	57	34
C#CC[C@@H](CCOC)NC(=O)N[C@](C)(CC)c1ccccc1	ZINC000875256634	DG	On-Demand	Mild	AMY2	57	34
C#CC[C@H](CCOC)NC(=O)N[C@](C)(CC)c1ccccc1	ZINC000875256635	DG	On-Demand	Mild	AMY2	57	34
C#CC[C@@H](CCOC)NC(=O)N[C@@](C)(CC)c1ccccc1	ZINC000875256636	DG	On-Demand	Mild	AMY2	57	34
N#Cc1ccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875256644	HH	On-Demand	Mild	KISS1R	23	41
CC[C@@](C)(NC(=O)NCC[C@H]1CCCOC1)c1ccccc1	ZINC000875256648	DG	On-Demand	Anodyne	AMY2	44	31
CCCN(C(=O)c1cccn(C2CC2)c1=O)c1cccc2ccccc12	ZINC000875256649	EI	On-Demand	Anodyne	POLR1A	65	34
CC[C@@](C)(NC(=O)NCC[C@@H]1CCCOC1)c1ccccc1	ZINC000875256650	DG	On-Demand	Anodyne	AMY2	44	31
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H](C)CSC)CC2	ZINC000875256653	FE	On-Demand	Anodyne	SLC18A2	52	38
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H](C)CSC)CC2	ZINC000875256653	FE	On-Demand	Anodyne	MTNR1B	15	45
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@@H](C)CSC)CC2	ZINC000875256654	FE	On-Demand	Anodyne	SLC18A2	52	38
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@@H](C)CSC)CC2	ZINC000875256654	FE	On-Demand	Anodyne	MTNR1B	15	45
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H](C)CSC)CC2	ZINC000875256655	FE	On-Demand	Anodyne	SLC18A2	52	38
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H](C)CSC)CC2	ZINC000875256655	FE	On-Demand	Anodyne	MTNR1B	15	45
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@H](C)CSC)CC2	ZINC000875256656	FE	On-Demand	Anodyne	SLC18A2	52	38
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@H](C)CSC)CC2	ZINC000875256656	FE	On-Demand	Anodyne	MTNR1B	15	45
CCc1ccc([C@H](C)NC(=O)/C=C\c2ccccc2)cc1	ZINC000875256669	CI	On-Demand	Anodyne	KCNQ2	55	42
CCc1ccc([C@H](C)NC(=O)/C=C\c2ccccc2)cc1	ZINC000875256669	CI	On-Demand	Anodyne	ACACA	19	41
CCc1ccc([C@H](C)NC(=O)/C=C\c2ccccc2)cc1	ZINC000875256669	CI	On-Demand	Anodyne	ACACB	17	41
CCc1ccc([C@H](C)NC(=O)/C=C\c2ccccc2)cc1	ZINC000875256669	CI	On-Demand	Anodyne	HDAC8	47	38
CCc1ccc([C@H](C)NC(=O)/C=C\c2ccccc2)cc1	ZINC000875256669	CI	On-Demand	Anodyne	MMP2	18	48
CCc1ccc([C@H](C)NC(=O)/C=C\c2ccccc2)cc1	ZINC000875256669	CI	On-Demand	Anodyne	HDAC6	30	48
CCc1ccc([C@H](C)NC(=O)/C=C\c2ccccc2)cc1	ZINC000875256669	CI	On-Demand	Anodyne	MMP9	17	48
CCc1ccc([C@H](C)NC(=O)/C=C\c2ccccc2)cc1	ZINC000875256669	CI	On-Demand	Anodyne	ACE2	44	33
CCc1ccc([C@H](C)NC(=O)/C=C\c2ccccc2)cc1	ZINC000875256669	CI	On-Demand	Anodyne	UL26	39	43
CCc1ccc([C@H](C)NC(=O)/C=C\c2ccccc2)cc1	ZINC000875256669	CI	On-Demand	Anodyne	SCAF_EBVB9	29	43
CCOC1CC2(C1)C[C@H]2C(=O)N(CC#N)c1ccccc1	ZINC000875256708	CF	On-Demand	Mild	TIMP3	53	31
C[C@@H](NC(=O)N1CCCC(F)(F)CC1)c1cc(F)ccc1N1CCC(O)CC1	ZINC000875256711	GH	On-Demand	Anodyne	CACNA1H	44	37
Cc1ccc(C(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875256724	GI	On-Demand	Anodyne	HDAC1	15	42
Cc1ccc(C(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875256724	GI	On-Demand	Anodyne	KCNK9	15	41
CO[C@H](C(=O)OC(C)(C)C)C(=O)N(CC#N)c1ccccc1	ZINC000875256725	DD	On-Demand	Mild	PAPA1_CARPA	53	43
C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)C1(C)CC(F)(F)C1	ZINC000875256768	DH	On-Demand	Mild	CACNA1C	41	38
C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)C1(C)CC(F)(F)C1	ZINC000875256768	DH	On-Demand	Mild	CACNA1D	69	38
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1nc(-c2ccccc2)cs1	ZINC000875256780	FI	On-Demand	Anodyne	ROCK1	15	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)c1nc(-c2ccccc2)cs1	ZINC000875256787	EH	On-Demand	Anodyne	ROCK1	20	45
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)c1nc(-c2ccccc2)cs1	ZINC000875256788	EH	On-Demand	Anodyne	ROCK1	20	45
COC(=O)c1ccc(S(=O)(=O)Cc2coc(-c3ccc(OC)cc3)n2)cc1	ZINC000875256810	GG	On-Demand	Anodyne	MMP13	28	40
COC(=O)c1ccc(S(=O)(=O)Cc2coc(-c3ccc(OC)cc3)n2)cc1	ZINC000875256810	GG	On-Demand	Anodyne	MMP2	22	43
COC(=O)c1ccc(S(=O)(=O)Cc2coc(-c3ccc(OC)cc3)n2)cc1	ZINC000875256810	GG	On-Demand	Anodyne	MMP8	19	40
COC(=O)c1ccc(S(=O)(=O)Cc2coc(-c3ccc(OC)cc3)n2)cc1	ZINC000875256810	GG	On-Demand	Anodyne	MMP9	25	40
COC(=O)c1ccc(S(=O)(=O)Cc2coc(-c3ccc(OC)cc3)n2)cc1	ZINC000875256810	GG	On-Demand	Anodyne	MMP1	20	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cl)cc1OC	ZINC000875256816	FF	On-Demand	Anodyne	SLC6A2	15	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cl)cc1OC	ZINC000875256816	FF	On-Demand	Anodyne	SLC6A4	36	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cl)cc1OC	ZINC000875256816	FF	On-Demand	Anodyne	SLC6A3	59	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cl)cc1OC	ZINC000875256816	FF	On-Demand	Anodyne	P2RX7	40	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cl)cc1OC	ZINC000875256817	FF	On-Demand	Anodyne	SLC6A2	15	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cl)cc1OC	ZINC000875256817	FF	On-Demand	Anodyne	SLC6A4	36	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cl)cc1OC	ZINC000875256817	FF	On-Demand	Anodyne	SLC6A3	59	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cl)cc1OC	ZINC000875256817	FF	On-Demand	Anodyne	P2RX7	40	39
COC(=O)[C@]12C[C@H](NC(=O)NCC3(N4CCC(OC)CC4)CCCC3)C[C@H]1C2	ZINC000875256831	GE	On-Demand	Anodyne	HCN1	54	33
COC(=O)[C@]12C[C@H](NC(=O)NCC3(N4CCC(OC)CC4)CCCC3)C[C@H]1C2	ZINC000875256831	GE	On-Demand	Anodyne	HCN4	52	33
CCCCCCCNC(=O)C(=O)N[C@H](C)CSC	ZINC000875256850	CD	On-Demand	Mild	ASAH1	81	35
CCCCCCCNC(=O)C(=O)N[C@H](C)CSC	ZINC000875256850	CD	On-Demand	Mild	NOD1	62	38
CCCCCCCNC(=O)C(=O)N[C@H](C)CSC	ZINC000875256850	CD	On-Demand	Mild	CQSS	50	33
CCCCCCCNC(=O)C(=O)N[C@@H](C)CSC	ZINC000875256851	CD	On-Demand	Mild	ASAH1	81	35
CCCCCCCNC(=O)C(=O)N[C@@H](C)CSC	ZINC000875256851	CD	On-Demand	Mild	NOD1	62	38
CCCCCCCNC(=O)C(=O)N[C@@H](C)CSC	ZINC000875256851	CD	On-Demand	Mild	CQSS	50	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1(N2CCC(OC)CC2)CCCC1	ZINC000875256856	GE	On-Demand	Anodyne	HCN1	55	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1(N2CCC(OC)CC2)CCCC1	ZINC000875256856	GE	On-Demand	Anodyne	HCN4	53	37
CC[C@]1(C(=O)Nc2cc(COc3cccc(F)c3)ccc2OC)CCNC1=O	ZINC000875256874	GG	On-Demand	Anodyne	MAOB	16	40
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)Nc1ccc(Cl)cc1C(F)(F)F	ZINC000875256885	JK	On-Demand	Anodyne	STK33	25	40
COC(=O)N(C)NC(=O)NCC1(N2CCC(OC)CC2)CCCC1	ZINC000875256898	ED	On-Demand	Reactive	HCN1	60	38
COC(=O)N(C)NC(=O)NCC1(N2CCC(OC)CC2)CCCC1	ZINC000875256898	ED	On-Demand	Reactive	HCN4	58	38
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCCCSC)CC2	ZINC000875256899	GE	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCCCSC)CC2	ZINC000875256900	GE	On-Demand	Anodyne	SLC18A2	48	36
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000875256943	JJ	On-Demand	Bother	KCNMA1	19	40
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)Nc1cc(Cl)ccc1Cl	ZINC000875256968	IK	On-Demand	Anodyne	STK33	25	42
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)C(=O)NCCCC2CC2)C(C)(C)C1	ZINC000875256974	GE	On-Demand	Anodyne	GPR119	21	40
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)C(=O)NCCCC2CC2)C(C)(C)C1	ZINC000875256975	GE	On-Demand	Anodyne	GPR119	21	40
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000875256986	II	On-Demand	Bother	KCNK9	33	41
C[C@H](NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1)c1ccc(F)cc1Cl	ZINC000875257001	GG	On-Demand	Anodyne	ENV	41	36
CC(=O)N(C)c1ccc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)cc1	ZINC000875257006	GI	On-Demand	Anodyne	KCNK3	90	41
CC(=O)N(C)c1ccc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)cc1	ZINC000875257006	GI	On-Demand	Anodyne	KCNK9	46	37
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1nc(-c2ccccc2)cs1	ZINC000875257020	EF	On-Demand	Anodyne	ROCK1	19	44
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1nc(-c2ccccc2)cs1	ZINC000875257021	EF	On-Demand	Anodyne	ROCK1	19	44
C[C@@H](CC(=O)N(CC#N)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000875257054	DF	On-Demand	Mild	CTSB	32	42
C[C@@H](CC(=O)N(CC#N)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000875257054	DF	On-Demand	Mild	PAPA1_CARPA	56	47
C[C@@H](CC(=O)N(CC#N)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000875257054	DF	On-Demand	Mild	CTSK	20	44
C[C@@H](CC(=O)N(CC#N)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000875257054	DF	On-Demand	Mild	CTSL	17	47
C[C@@H](CC(=O)N(CC#N)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000875257054	DF	On-Demand	Mild	FPR1	45	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1nc(-c2ccccc2)cs1	ZINC000875257073	GH	On-Demand	Anodyne	SLC6A4	18	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1nc(-c2ccccc2)cs1	ZINC000875257073	GH	On-Demand	Anodyne	SLC6A3	38	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1nc(-c2ccccc2)cs1	ZINC000875257074	GH	On-Demand	Anodyne	SLC6A4	18	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1nc(-c2ccccc2)cs1	ZINC000875257074	GH	On-Demand	Anodyne	SLC6A3	38	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1nc(-c2ccccc2)cs1	ZINC000875257075	GH	On-Demand	Anodyne	SLC6A4	18	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1nc(-c2ccccc2)cs1	ZINC000875257075	GH	On-Demand	Anodyne	SLC6A3	38	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1nc(-c2ccccc2)cs1	ZINC000875257076	GH	On-Demand	Anodyne	SLC6A4	18	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1nc(-c2ccccc2)cs1	ZINC000875257076	GH	On-Demand	Anodyne	SLC6A3	38	40
CC[C@@H]1COCCN1CCNC(=O)NCC1(N2CCC(OC)CC2)CCCC1	ZINC000875257137	GD	On-Demand	Anodyne	HCN1	56	35
CC[C@@H]1COCCN1CCNC(=O)NCC1(N2CCC(OC)CC2)CCCC1	ZINC000875257137	GD	On-Demand	Anodyne	HCN4	53	35
CCOC(=O)[C@@H]1CCCN(C(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)C1	ZINC000875257148	IF	On-Demand	Anodyne	CCR8	51	34
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@](C)(CC)c1ccccc1	ZINC000875257154	DH	On-Demand	Anodyne	TIMP3	53	32
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@](C)(CC)c1ccccc1	ZINC000875257154	DH	On-Demand	Anodyne	AMY2	52	30
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@@](C)(CC)c1ccccc1	ZINC000875257155	DH	On-Demand	Anodyne	TIMP3	53	32
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@@](C)(CC)c1ccccc1	ZINC000875257155	DH	On-Demand	Anodyne	AMY2	52	30
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(Cl)cc1OC	ZINC000875257157	GF	On-Demand	Anodyne	CACNA1I	55	35
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(Cl)cc1OC	ZINC000875257157	GF	On-Demand	Anodyne	ACKR3	62	31
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2(N3CCC(OC)CC3)CCCC2)C1	ZINC000875257169	GE	On-Demand	Anodyne	HCN1	58	35
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2(N3CCC(OC)CC3)CCCC2)C1	ZINC000875257169	GE	On-Demand	Anodyne	HCN4	55	35
COC(=O)C1(O)CN(C(=O)NCC2(N3CCC(OC)CC3)CCCC2)C1	ZINC000875257199	FC	On-Demand	Anodyne	HCN1	54	34
COC(=O)C1(O)CN(C(=O)NCC2(N3CCC(OC)CC3)CCCC2)C1	ZINC000875257199	FC	On-Demand	Anodyne	HCN4	52	34
CSC[C@@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875257211	GE	On-Demand	Anodyne	DRD2	24	48
CSC[C@@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875257211	GE	On-Demand	Anodyne	DRD4	43	44
CSC[C@@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875257211	GE	On-Demand	Anodyne	ACHE	63	59
CSC[C@@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875257211	GE	On-Demand	Anodyne	DRD3	16	43
CSC[C@@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875257211	GE	On-Demand	Anodyne	SLC6A3	18	50
CSC[C@@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875257211	GE	On-Demand	Anodyne	HTR4	36	46
CSC[C@@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875257211	GE	On-Demand	Anodyne	SIGMAR1	53	48
CSC[C@@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875257211	GE	On-Demand	Anodyne	BCHE	18	48
CSC[C@@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875257211	GE	On-Demand	Anodyne	MCHR1	25	45
CSC[C@@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875257211	GE	On-Demand	Anodyne	CACNA1G	27	41
CSC[C@@H](C)NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875257211	GE	On-Demand	Anodyne	CACNA1I	55	38
C#CC[C@@H](COC)NC(=O)N[C@](C)(CC)c1ccccc1	ZINC000875257221	CF	On-Demand	Mild	AMY2	56	33
C#CC[C@H](COC)NC(=O)N[C@](C)(CC)c1ccccc1	ZINC000875257222	CF	On-Demand	Mild	AMY2	56	33
C#CC[C@@H](COC)NC(=O)N[C@@](C)(CC)c1ccccc1	ZINC000875257223	CF	On-Demand	Mild	AMY2	56	33
C#CC[C@H](COC)NC(=O)N[C@@](C)(CC)c1ccccc1	ZINC000875257224	CF	On-Demand	Mild	AMY2	56	33
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)c1cccc(Cl)c1	ZINC000875257226	GJ	On-Demand	Anodyne	KCNK3	19	44
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)c1cccc(Cl)c1	ZINC000875257226	GJ	On-Demand	Anodyne	KCNK9	16	44
CCOC(=O)C1CCN(C(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)CC1	ZINC000875257248	IF	On-Demand	Anodyne	CCR8	64	35
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)NCc1ccc2c(c1)OCO2	ZINC000875257257	IG	On-Demand	Anodyne	NOS2	86	36
CN(C)S(=O)(=O)c1cccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875257258	JG	On-Demand	Anodyne	KISS1R	21	40
CN(C)S(=O)(=O)c1cccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875257258	JG	On-Demand	Anodyne	KCNK9	24	41
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875257285	JI	On-Demand	Bother	KCNMA1	23	55
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875257286	JI	On-Demand	Bother	KCNMA1	23	55
N#Cc1c(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)sc2c1CCCCC2	ZINC000875257301	JJ	On-Demand	Mild	VIPR1	31	52
CC(C)c1cccc(C(C)C)c1NC(=O)COC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875257307	JK	On-Demand	Anodyne	SOAT1	47	38
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)Nc1ccc2nc(O)[nH]c2c1	ZINC000875257309	IG	On-Demand	Anodyne	NR2E3	50	31
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)Nc1ccc2nc(O)[nH]c2c1	ZINC000875257309	IG	On-Demand	Anodyne	STK33	40	43
COC(=O)C1(O)CN(C(=O)NCc2ccc(Cl)cc2OC)C1	ZINC000875257401	EC	On-Demand	Anodyne	F10	46	30
COC(=O)C1(O)CN(C(=O)NCc2ccc(Cl)cc2OC)C1	ZINC000875257401	EC	On-Demand	Anodyne	EPHX2	16	44
CC[C@@](C)(NC(=O)NC1CC(COC)C1)c1ccccc1	ZINC000875257408	CG	On-Demand	Anodyne	AMY2	54	32
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)Nc1ccc(Cl)cc1	ZINC000875257425	HI	On-Demand	Anodyne	F10	19	42
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)Nc1ccc(Cl)cc1	ZINC000875257425	HI	On-Demand	Anodyne	STK33	24	40
NC(=O)[C@H]1CCCN(Cc2cccc(CNC(=O)N3C[C@H]4CC=CC[C@H]4C3)c2)C1	ZINC000875257439	GE	On-Demand	Anodyne	SLC6A1	47	32
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC(=O)N3C[C@H]4CC=CC[C@H]4C3)c2)C1	ZINC000875257440	GE	On-Demand	Anodyne	SLC6A1	47	32
CCc1ccc([C@H](C)NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cc1	ZINC000875257444	DI	On-Demand	Bother	KCNQ2	47	36
CCc1ccc([C@H](C)NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cc1	ZINC000875257444	DI	On-Demand	Bother	UL26	19	48
CCc1ccc([C@H](C)NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cc1	ZINC000875257444	DI	On-Demand	Bother	MMP1	20	40
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)Nc1ccc(N2CCOCC2)cc1	ZINC000875257457	JH	On-Demand	Anodyne	STAT6	52	35
O=C(NCc1cocn1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875257499	CE	On-Demand	Anodyne	EPHX2	16	40
O=C(NCc1cocn1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875257500	CE	On-Demand	Anodyne	EPHX2	16	40
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)Nc1ccc(Cl)cc1Cl	ZINC000875257507	IK	On-Demand	Anodyne	CA5B	17	40
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)Nc1ccc(Cl)cc1Cl	ZINC000875257507	IK	On-Demand	Anodyne	CA5A	19	40
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)Nc1ccc(Cl)cc1Cl	ZINC000875257507	IK	On-Demand	Anodyne	STK33	25	42
COc1ccc(N2CCN(C(=O)C(=O)NCCCCSC)CC2)c(OC)c1	ZINC000875257526	GD	On-Demand	Clean	HTR1A	39	45
COc1ccc(N2CCN(C(=O)C(=O)NCCCCSC)CC2)c(OC)c1	ZINC000875257526	GD	On-Demand	Clean	DRD2	38	45
COc1ccc(N2CCN(C(=O)C(=O)NCCCCSC)CC2)c(OC)c1	ZINC000875257526	GD	On-Demand	Clean	DRD4	43	34
COc1ccc(N2CCN(C(=O)C(=O)NCCCCSC)CC2)c(OC)c1	ZINC000875257526	GD	On-Demand	Clean	ADRA1D	24	41
COc1ccc(N2CCN(C(=O)C(=O)NCCCCSC)CC2)c(OC)c1	ZINC000875257526	GD	On-Demand	Clean	ADRA1A	23	41
COc1ccc(N2CCN(C(=O)C(=O)NCCCCSC)CC2)c(OC)c1	ZINC000875257526	GD	On-Demand	Clean	DRD3	63	45
O=C(Nc1ccccc1C(=O)OCCN1C(=O)c2ccccc2C1=O)c1cccs1	ZINC000875257556	HG	On-Demand	Anodyne	STK33	26	42
CC[C@@](C)(NC(=O)NC[C@@H]1CCO[C@@H]1C(=O)OC)c1ccccc1	ZINC000875257561	EE	On-Demand	Anodyne	AMY2	43	30
CC(C)c1ccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875257577	HJ	On-Demand	Anodyne	STK33	24	41
CC[C@@](C)(NC(=O)NCCC[C@H]1CCOC1=O)c1ccccc1	ZINC000875257593	DF	On-Demand	Anodyne	AMY2	44	30
CC[C@@](C)(NC(=O)NCCC[C@@H]1CCOC1=O)c1ccccc1	ZINC000875257596	DF	On-Demand	Anodyne	AMY2	44	30
CC[C@@](C)(NC(=O)N[C@@H]1CCCn2nccc21)c1ccccc1	ZINC000875257597	DG	On-Demand	Anodyne	AMY2	49	34
CC[C@@](C)(NC(=O)N[C@H]1CCCn2nccc21)c1ccccc1	ZINC000875257598	DG	On-Demand	Anodyne	AMY2	49	34
COc1ccc(CN(C)C(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)cc1OC	ZINC000875257630	JH	On-Demand	Anodyne	KCNK3	40	33
COC(=O)c1cccc(COC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875257637	GI	On-Demand	Anodyne	KCNK3	35	42
COC(=O)c1cccc(COC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875257637	GI	On-Demand	Anodyne	KCNK9	33	45
CCc1ccc([C@H](C)NC(=O)/C=C\c2ccc3c(c2)OCO3)cc1	ZINC000875257638	DH	On-Demand	Anodyne	KCNQ2	57	58
CCc1ccc([C@H](C)NC(=O)/C=C\c2ccc3c(c2)OCO3)cc1	ZINC000875257638	DH	On-Demand	Anodyne	NR1H4	21	42
CCc1ccc([C@H](C)NC(=O)/C=C\c2ccc3c(c2)OCO3)cc1	ZINC000875257638	DH	On-Demand	Anodyne	DYRK2	63	37
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)c1nc(O)c2ccccc2n1	ZINC000875257649	HJ	On-Demand	Anodyne	STK33	27	40
CC(=O)[C@@H](C)OC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875257650	DG	On-Demand	Anodyne	KCNK9	15	40
CC(=O)[C@H](C)OC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875257651	DG	On-Demand	Anodyne	KCNK9	15	40
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)c1ccccc1	ZINC000875257687	GI	On-Demand	Anodyne	KCNK3	21	45
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)c1ccccc1	ZINC000875257687	GI	On-Demand	Anodyne	KCNK9	16	45
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)Nc1ccc2ccccc2c1	ZINC000875257697	IK	On-Demand	Anodyne	KCNK9	28	40
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)NCc1cocn1	ZINC000875257770	EH	On-Demand	Anodyne	MDM2	72	33
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)c1cccc(C(F)(F)F)c1	ZINC000875257786	IK	On-Demand	Anodyne	KCNK3	21	42
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)c1cccc(C(F)(F)F)c1	ZINC000875257786	IK	On-Demand	Anodyne	KCNK9	20	42
CCOC(=O)N1CCN(C(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)CC1	ZINC000875257794	IE	On-Demand	Anodyne	P2RY12	47	41
CCc1ccc([C@H](C)NC(=O)/C=C\c2ccco2)cc1	ZINC000875257821	CH	On-Demand	Anodyne	KCNQ2	51	39
C[C@@H](NC(=O)N1CC[C@@H](c2cccc(Cl)c2)C1(C)C)c1nnc2n1CCC2	ZINC000875257825	GH	On-Demand	Anodyne	MDM2	101	32
C[C@@H](NC(=O)N1CC[C@H](c2cccc(Cl)c2)C1(C)C)c1nnc2n1CCC2	ZINC000875257826	GH	On-Demand	Anodyne	MDM2	101	32
O=C(NCCCC1CC1)C(=O)NCc1ccc(OC(F)F)cc1F	ZINC000875257828	EE	On-Demand	Anodyne	TRPV1	59	33
O=C(NCc1cocn1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875257832	DD	On-Demand	Anodyne	EPHX2	15	46
O=C(NCc1cocn1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875257833	DD	On-Demand	Anodyne	EPHX2	15	46
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)NNC(=O)c1cccc([N+](=O)[O-])c1	ZINC000875257838	JF	On-Demand	Reactive	CACNA1D	42	37
CCc1ccc([C@H](C)NC(=O)/C=C\c2ccc(Br)o2)cc1	ZINC000875257840	EI	On-Demand	Anodyne	KCNQ2	48	37
CCc1ccc([C@H](C)NC(=O)/C=C\c2ccc(Br)o2)cc1	ZINC000875257840	EI	On-Demand	Anodyne	UL26	48	48
CCc1ccc([C@H](C)NC(=O)/C=C\c2ccc(Br)o2)cc1	ZINC000875257840	EI	On-Demand	Anodyne	SCAF_EBVB9	47	48
CCc1ccc([C@H](C)NC(=O)/C=C/c2ccc(Br)o2)cc1	ZINC000875257842	EI	On-Demand	Anodyne	KCNQ2	48	37
CCc1ccc([C@H](C)NC(=O)/C=C/c2ccc(Br)o2)cc1	ZINC000875257842	EI	On-Demand	Anodyne	UL26	48	48
CCc1ccc([C@H](C)NC(=O)/C=C/c2ccc(Br)o2)cc1	ZINC000875257842	EI	On-Demand	Anodyne	SCAF_EBVB9	47	48
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)Nc1cc([N+](=O)[O-])ccc1F	ZINC000875257843	IH	On-Demand	Bother	KCNMA1	24	41
CC[C@@](C)(NC(=O)N[C@@H]1CC=C(C(=O)OC)C1)c1ccccc1	ZINC000875257945	DF	On-Demand	Anodyne	AMY2	55	32
CC[C@@](C)(NC(=O)N[C@H]1CC=C(C(=O)OC)C1)c1ccccc1	ZINC000875257946	DF	On-Demand	Anodyne	AMY2	55	32
CC[C@@](C)(NC(=O)NCc1nc(O)c2c(n1)CCOC2)c1ccccc1	ZINC000875257958	FE	On-Demand	Anodyne	WNT3A	46	33
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)Nc1ccc(F)c(Cl)c1	ZINC000875257962	IJ	On-Demand	Anodyne	GRM4	22	50
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)Nc1cccc2nsnc12	ZINC000875258010	IH	On-Demand	Anodyne	STK33	29	41
CCCCCCCNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1	ZINC000875258042	EF	On-Demand	Mild	S1PR2	48	39
CCCCCCCNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1	ZINC000875258042	EF	On-Demand	Mild	SPHK1	24	42
CCCCCCCNC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1	ZINC000875258042	EF	On-Demand	Mild	ASAH1	100	38
N#C[C@@]1(C(=O)Oc2cccc(C(=O)Nc3ccccc3)c2)CCCOC1	ZINC000875258043	FG	On-Demand	Mild	KCNK3	90	43
N#C[C@@]1(C(=O)Oc2cccc(C(=O)Nc3ccccc3)c2)CCCOC1	ZINC000875258043	FG	On-Demand	Mild	KCNK9	40	36
N#C[C@]1(C(=O)Oc2cccc(C(=O)Nc3ccccc3)c2)CCCOC1	ZINC000875258044	FG	On-Demand	Mild	KCNK3	90	43
N#C[C@]1(C(=O)Oc2cccc(C(=O)Nc3ccccc3)c2)CCCOC1	ZINC000875258044	FG	On-Demand	Mild	KCNK9	40	36
CC[C@@](C)(NC(=O)NC[C@@H]1C[C@H](OC)C1)c1ccccc1	ZINC000875258088	CG	On-Demand	Anodyne	AMY2	54	32
CSC[C@@H](C)NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875258092	EE	On-Demand	Anodyne	C3AR1	42	42
CSC[C@@H](C)NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875258093	EE	On-Demand	Anodyne	C3AR1	42	42
CC(=O)c1cccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875258109	HH	On-Demand	Anodyne	KCNK3	78	50
CC(=O)c1cccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875258109	HH	On-Demand	Anodyne	KCNK9	71	50
CC[C@H](C[C@H](C)O)NC(=O)NCC1(N2CCC(OC)CC2)CCCC1	ZINC000875258122	FE	On-Demand	Anodyne	HCN1	68	37
CC[C@H](C[C@H](C)O)NC(=O)NCC1(N2CCC(OC)CC2)CCCC1	ZINC000875258122	FE	On-Demand	Anodyne	HCN4	57	37
CC[C@@H](NC(=O)N[C@@H](C)c1cccnc1)[C@H](O)c1ccccc1	ZINC000875258181	DF	On-Demand	Anodyne	KCNA5	28	50
CC[C@@H](NC(=O)N[C@@H](C)c1cccnc1)[C@H](O)c1ccccc1	ZINC000875258181	DF	On-Demand	Anodyne	TACR3	27	40
CC[C@@H](NC(=O)N[C@@H](C)c1cccnc1)[C@@H](O)c1ccccc1	ZINC000875258182	DF	On-Demand	Anodyne	KCNA5	28	50
CC[C@@H](NC(=O)N[C@@H](C)c1cccnc1)[C@@H](O)c1ccccc1	ZINC000875258182	DF	On-Demand	Anodyne	TACR3	27	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1	ZINC000875258207	FD	On-Demand	Clean	DPP7	49	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(N3CC=CC3)cc2)C1	ZINC000875258208	FD	On-Demand	Clean	DPP7	49	33
O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@H](c1ccccn1)C1CCC1	ZINC000875258228	GF	On-Demand	Clean	TTK	27	40
O=C(NCc1ccc(N2CC=CC2)cc1)C(=O)N[C@@H](c1ccccn1)C1CCC1	ZINC000875258229	GF	On-Demand	Clean	TTK	27	40
CCc1ccc([C@H](C)NC(=O)/C=C\c2cccs2)cc1	ZINC000875258235	CI	On-Demand	Anodyne	KCNQ2	52	37
CCc1ccc([C@H](C)NC(=O)/C=C\c2cccs2)cc1	ZINC000875258235	CI	On-Demand	Anodyne	UL26	67	33
CCc1ccc([C@H](C)NC(=O)/C=C\c2cccs2)cc1	ZINC000875258235	CI	On-Demand	Anodyne	SCAF_EBVB9	65	33
COc1ccccc1COC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875258251	FI	On-Demand	Anodyne	KCNK3	43	36
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)Nc1ccc(Cl)cn1	ZINC000875258253	II	On-Demand	Anodyne	F10	42	44
COc1ccc(C)cc1NC(=O)COC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875258273	HI	On-Demand	Anodyne	KCNK3	43	38
CC[C@@](C)(NC(=O)N[C@H]1CCN(C2CCC2)C1=O)c1ccccc1	ZINC000875258354	EF	On-Demand	Anodyne	AMY2	44	31
CC[C@@](C)(NC(=O)N[C@H]1CCN(C2CCC2)C1=O)c1ccccc1	ZINC000875258354	EF	On-Demand	Anodyne	BIRC2	43	38
CC[C@@](C)(NC(=O)N[C@@H]1CCN(C2CCC2)C1=O)c1ccccc1	ZINC000875258355	EF	On-Demand	Anodyne	AMY2	44	31
CC[C@@](C)(NC(=O)N[C@@H]1CCN(C2CCC2)C1=O)c1ccccc1	ZINC000875258355	EF	On-Demand	Anodyne	BIRC2	43	38
C[C@H](NC(=O)C(=O)NCC1(N(C)C)Cc2ccccc2C1)c1ccnn1C	ZINC000875258370	FC	On-Demand	Anodyne	HCN1	40	35
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(F)c(Br)c1	ZINC000875258377	GE	On-Demand	Anodyne	CACNA1H	53	42
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(F)c(Br)c1	ZINC000875258377	GE	On-Demand	Anodyne	MAPK1	41	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875258437	JG	On-Demand	Anodyne	FCER2	42	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875258437	JG	On-Demand	Anodyne	CAPNS1	52	31
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875258437	JG	On-Demand	Anodyne	CTRB_BOVIN	44	30
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875258438	JG	On-Demand	Anodyne	FCER2	42	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875258438	JG	On-Demand	Anodyne	CAPNS1	52	31
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875258438	JG	On-Demand	Anodyne	CTRB_BOVIN	44	30
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3ccc(Cl)cc3OC)C[C@@H]1C2	ZINC000875258465	FE	On-Demand	Anodyne	EPHX2	15	40
CSC[C@@H](C)NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875258469	ED	On-Demand	Anodyne	OXTR	56	38
CSC[C@@H](C)NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875258469	ED	On-Demand	Anodyne	GHRHR	35	42
CSC[C@@H](C)NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875258470	ED	On-Demand	Anodyne	OXTR	56	38
CSC[C@@H](C)NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875258470	ED	On-Demand	Anodyne	GHRHR	35	42
CN(C(=O)COC(=O)c1ccccc1NC(=O)c1cccs1)C1(C#N)CCCCC1	ZINC000875258525	IH	On-Demand	Mild	HCN1	50	30
CN(C(=O)COC(=O)c1ccccc1NC(=O)c1cccs1)C1(C#N)CCCCC1	ZINC000875258525	IH	On-Demand	Mild	HCN4	48	30
CSC[C@@H](C)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875258533	FD	On-Demand	Anodyne	ROCK1	25	42
CSC[C@@H](C)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875258533	FD	On-Demand	Anodyne	ROCK2	17	42
O=C(Nc1ccccc1C(=O)OCc1ccc(F)cc1)c1cccs1	ZINC000875258539	FI	On-Demand	Anodyne	STK33	30	42
CC[C@@](C)(NC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)OC)c1ccccc1	ZINC000875258556	ED	On-Demand	Anodyne	CTSB	23	43
CC[C@@](C)(NC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)OC)c1ccccc1	ZINC000875258556	ED	On-Demand	Anodyne	PAPA1_CARPA	47	35
CC[C@@](C)(NC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)OC)c1ccccc1	ZINC000875258556	ED	On-Demand	Anodyne	AMY2	57	33
CC[C@@](C)(NC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)OC)c1ccccc1	ZINC000875258556	ED	On-Demand	Anodyne	HLA-DRB1	76	38
CC[C@@](C)(NC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)OC)c1ccccc1	ZINC000875258556	ED	On-Demand	Anodyne	KIF11	15	41
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)c1ccc(F)cc1	ZINC000875258577	GJ	On-Demand	Anodyne	STK33	29	40
CCCCCCCNC(=O)C(=O)N[C@H]1CCc2cnn(C(C)C)c2C1	ZINC000875258580	EF	On-Demand	Mild	ASAH1	56	32
CCCCCCCNC(=O)C(=O)N[C@@H]1CCc2cnn(C(C)C)c2C1	ZINC000875258581	EF	On-Demand	Mild	ASAH1	56	32
COc1cccc(C2(CNC(=O)NNc3nnc(C)n3C)CCCC2)c1	ZINC000875258588	FE	On-Demand	Reactive	DRD4	40	32
COc1cccc(C2(CNC(=O)NNc3nnc(C)n3C)CCCC2)c1	ZINC000875258588	FE	On-Demand	Reactive	KCNA3	42	35
COc1cccc(C2(CNC(=O)NNc3nnc(C)n3C)CCCC2)c1	ZINC000875258588	FE	On-Demand	Reactive	SOAT1	20	47
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H](C)Cc1ccncc1)CC2	ZINC000875258608	GE	On-Demand	Anodyne	SLC18A2	49	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H](C)Cc1ccncc1)CC2	ZINC000875258609	GE	On-Demand	Anodyne	SLC18A2	49	35
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@H](C)Cc1ccncc1)CC2	ZINC000875258610	GE	On-Demand	Anodyne	SLC18A2	49	35
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@@H](C)Cc1ccncc1)CC2	ZINC000875258611	GE	On-Demand	Anodyne	SLC18A2	49	35
COc1cccc(C2(CNC(=O)N3CCCN(C=O)CC3)CCCC2)c1	ZINC000875258612	FE	On-Demand	Anodyne	DRD4	41	32
COc1cccc(C2(CNC(=O)N3CCCN(C=O)CC3)CCCC2)c1	ZINC000875258612	FE	On-Demand	Anodyne	KCNA3	43	35
COc1cccc(C2(CNC(=O)N3CCCN(C=O)CC3)CCCC2)c1	ZINC000875258612	FE	On-Demand	Anodyne	SOAT1	18	48
COc1ccc(OC)c([C@H]2CCCN2C(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875258621	JJ	On-Demand	Anodyne	CPT1A	50	40
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000875258634	JI	On-Demand	Anodyne	EPHX2	62	44
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)c1nc2ccccc2s1	ZINC000875258644	HK	On-Demand	Anodyne	STK33	30	41
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)c1ccccc1	ZINC000875258651	FJ	On-Demand	Anodyne	STK33	26	41
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)c1ccccc1	ZINC000875258651	FJ	On-Demand	Anodyne	KCNK9	19	42
COc1cccc(C2(CNC(=O)N3CCC4(CCNC4=O)CC3)CCCC2)c1	ZINC000875258656	GF	On-Demand	Anodyne	DRD4	40	30
COc1cccc(C2(CNC(=O)N3CCC4(CCNC4=O)CC3)CCCC2)c1	ZINC000875258656	GF	On-Demand	Anodyne	SOAT1	17	45
COc1cccc(C2(CNC(=O)N3C[C@H]4C(=O)OC[C@H]4C3)CCCC2)c1	ZINC000875258680	FE	On-Demand	Anodyne	SOAT1	15	41
COc1cc2c(cc1OC)CN(C(=O)COC(=O)c1ccccc1NC(=O)c1cccs1)CC2	ZINC000875258743	JH	On-Demand	Anodyne	ABCB1B	57	46
COc1cc2c(cc1OC)CN(C(=O)COC(=O)c1ccccc1NC(=O)c1cccs1)CC2	ZINC000875258743	JH	On-Demand	Anodyne	ABCB1	25	46
COc1cc2c(cc1OC)CN(C(=O)COC(=O)c1ccccc1NC(=O)c1cccs1)CC2	ZINC000875258743	JH	On-Demand	Anodyne	ABCG2	43	46
COC(=O)c1cccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875258768	IH	On-Demand	Anodyne	KCNK3	81	49
COC(=O)c1cccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875258768	IH	On-Demand	Anodyne	KCNK9	68	49
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000875258772	JK	On-Demand	Anodyne	PRNP	41	36
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000875258772	JK	On-Demand	Anodyne	HDAC1	28	40
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000875258772	JK	On-Demand	Anodyne	KCNK3	48	52
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000875258772	JK	On-Demand	Anodyne	KCNK9	21	52
NS(=O)(=O)c1ccc(OCCOC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875258787	IF	On-Demand	Anodyne	CA2	48	47
NS(=O)(=O)c1ccc(OCCOC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875258787	IF	On-Demand	Anodyne	CA1	45	43
NS(=O)(=O)c1ccc(OCCOC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875258787	IF	On-Demand	Anodyne	CA7	39	43
NS(=O)(=O)c1ccc(OCCOC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875258787	IF	On-Demand	Anodyne	CA5B	67	39
NS(=O)(=O)c1ccc(OCCOC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875258787	IF	On-Demand	Anodyne	CA5A	71	39
NS(=O)(=O)c1ccc(OCCOC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875258787	IF	On-Demand	Anodyne	CA12	37	43
NS(=O)(=O)c1ccc(OCCOC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875258787	IF	On-Demand	Anodyne	CA9	45	41
NS(=O)(=O)c1ccc(OCCOC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875258787	IF	On-Demand	Anodyne	MTCA1	22	41
NS(=O)(=O)c1ccc(OCCOC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875258787	IF	On-Demand	Anodyne	P96878_MYCTU	27	41
O=C(Nc1ccccc1C(=O)OCCN1CCCCC1)c1cccs1	ZINC000875258799	FH	On-Demand	Anodyne	SLC6A1	43	36
O=C(Nc1ccccc1C(=O)OCCN1CCCCC1)c1cccs1	ZINC000875258799	FH	On-Demand	Anodyne	HTR4	33	49
O=C(Nc1ccccc1C(=O)OCCN1CCCCC1)c1cccs1	ZINC000875258799	FH	On-Demand	Anodyne	SLC9A1	18	41
CN1CCC[C@H](CNC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875258878	FF	On-Demand	Mild	CCR3	36	42
CN1CCC[C@H](CNC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875258878	FF	On-Demand	Mild	MCHR1	36	40
CN1CCC[C@H](CNC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875258878	FF	On-Demand	Mild	CACNA1I	41	34
CN1CCC[C@H](CNC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875258879	FF	On-Demand	Mild	CCR3	36	42
CN1CCC[C@H](CNC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875258879	FF	On-Demand	Mild	MCHR1	36	40
CN1CCC[C@H](CNC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875258879	FF	On-Demand	Mild	CACNA1I	41	34
C[C@@H](Cc1ccncc1)NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875258910	GE	On-Demand	Anodyne	ADRB3	18	40
C[C@@H](Cc1ccncc1)NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875258910	GE	On-Demand	Anodyne	C3AR1	42	42
C[C@@H](Cc1ccncc1)NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875258911	GE	On-Demand	Anodyne	ADRB3	18	40
C[C@@H](Cc1ccncc1)NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875258911	GE	On-Demand	Anodyne	C3AR1	42	42
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)Nc1cc(Cl)ccc1F	ZINC000875258923	IJ	On-Demand	Anodyne	STK33	26	42
N#Cc1ccc(C(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875258981	GH	On-Demand	Mild	CTRB_BOVIN	46	32
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)NCC1(N2CCOCC2)CCCCC1	ZINC000875259019	JG	On-Demand	Anodyne	HCN1	84	41
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)NCC1(N2CCOCC2)CCCCC1	ZINC000875259019	JG	On-Demand	Anodyne	HCN4	60	40
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)Nc1ccc2nc(O)[nH]c2c1	ZINC000875259047	JH	On-Demand	Anodyne	NR2E3	52	36
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)Nc1ccc2nc(O)[nH]c2c1	ZINC000875259047	JH	On-Demand	Anodyne	STK33	37	43
CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875259081	IG	On-Demand	Anodyne	FKBP1A	43	41
CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875259081	IG	On-Demand	Anodyne	CPT1A	40	36
C[C@@H](Cc1ccncc1)NC(=O)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875259084	FE	On-Demand	Anodyne	PDE4A	24	43
C[C@@H](Cc1ccncc1)NC(=O)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875259086	FE	On-Demand	Anodyne	PDE4A	24	43
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000875259097	JF	On-Demand	Anodyne	CA2	20	56
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000875259097	JF	On-Demand	Anodyne	CA4	19	43
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000875259097	JF	On-Demand	Anodyne	TTK	22	47
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000875259097	JF	On-Demand	Anodyne	KCNK9	37	41
CC(=O)C1CCN(C(=O)C(=O)NCCCc2ccccc2F)CC1	ZINC000875259119	ED	On-Demand	Anodyne	CACNA1G	21	41
COc1ccc(N2CCN(C(=O)C(=O)NCC[C@H]3CCOC3)CC2)c(OC)c1	ZINC000875259174	GC	On-Demand	Clean	DRD4	40	32
COc1ccc(N2CCN(C(=O)C(=O)NCC[C@H]3CCOC3)CC2)c(OC)c1	ZINC000875259174	GC	On-Demand	Clean	MTNR1A	21	40
COc1ccc(N2CCN(C(=O)C(=O)NCC[C@@H]3CCOC3)CC2)c(OC)c1	ZINC000875259175	GC	On-Demand	Clean	DRD4	40	32
COc1ccc(N2CCN(C(=O)C(=O)NCC[C@@H]3CCOC3)CC2)c(OC)c1	ZINC000875259175	GC	On-Demand	Clean	MTNR1A	21	40
COc1cccc(C2(CNC(=O)N3CCC(C(C)=O)CC3)CCCC2)c1	ZINC000875259195	FH	On-Demand	Anodyne	DRD4	42	32
COc1cccc(C2(CNC(=O)N3CCC(C(C)=O)CC3)CCCC2)c1	ZINC000875259195	FH	On-Demand	Anodyne	KCNA3	45	39
COc1cccc(C2(CNC(=O)N3CCC(C(C)=O)CC3)CCCC2)c1	ZINC000875259195	FH	On-Demand	Anodyne	MTNR1A	41	43
COc1cccc(C2(CNC(=O)N3CCC(C(C)=O)CC3)CCCC2)c1	ZINC000875259195	FH	On-Demand	Anodyne	MTNR1B	46	43
COc1cccc(C2(CNC(=O)N3CCC(C(C)=O)CC3)CCCC2)c1	ZINC000875259195	FH	On-Demand	Anodyne	SOAT1	17	46
COc1cccc(C2(CNC(=O)N3CCC(C(C)=O)CC3)CCCC2)c1	ZINC000875259195	FH	On-Demand	Anodyne	EPHX2	19	40
COc1cccc(C2(CNC(=O)N3CCC(C(C)=O)CC3)CCCC2)c1	ZINC000875259195	FH	On-Demand	Anodyne	SMO	15	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)Cc2ccncc2)C1	ZINC000875259201	DC	On-Demand	Anodyne	DPP7	22	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)Cc2ccncc2)C1	ZINC000875259202	DC	On-Demand	Anodyne	DPP7	22	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)Cc2ccncc2)C1	ZINC000875259204	DC	On-Demand	Anodyne	DPP7	22	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)Cc2ccncc2)C1	ZINC000875259205	DC	On-Demand	Anodyne	DPP7	22	40
COc1cccc(C2(CNC(=O)N3CCC(c4nnnn4C)CC3)CCCC2)c1	ZINC000875259259	GF	On-Demand	Anodyne	MTNR1A	17	40
COc1cccc(C2(CNC(=O)N3CCC(c4nnnn4C)CC3)CCCC2)c1	ZINC000875259259	GF	On-Demand	Anodyne	MTNR1B	21	40
COc1cccc(C2(CNC(=O)N3CCC(c4nnnn4C)CC3)CCCC2)c1	ZINC000875259259	GF	On-Demand	Anodyne	SOAT1	18	43
COc1cccc(C2(CNC(=O)N3CCC(c4nnnn4C)CC3)CCCC2)c1	ZINC000875259259	GF	On-Demand	Anodyne	SMO	16	42
CCCCCCCNC(=O)C(=O)N[C@@H](C)Cc1ccncc1	ZINC000875259268	DE	On-Demand	Mild	GRIA1	58	43
CCCCCCCNC(=O)C(=O)N[C@@H](C)Cc1ccncc1	ZINC000875259268	DE	On-Demand	Mild	ASAH1	91	37
CCCCCCCNC(=O)C(=O)N[C@H](C)Cc1ccncc1	ZINC000875259269	DE	On-Demand	Mild	GRIA1	58	43
CCCCCCCNC(=O)C(=O)N[C@H](C)Cc1ccncc1	ZINC000875259269	DE	On-Demand	Mild	ASAH1	91	37
CN1CCN(C2CCN(C(=O)C(=O)NCCCc3ccccc3F)CC2)CC1	ZINC000875259328	GD	On-Demand	Anodyne	L3MBTL3	53	39
O=C(NCC[C@@H]1CCOC1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875259337	GD	On-Demand	Anodyne	ETHR	55	48
O=C(NCC[C@H]1CCOC1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875259338	GD	On-Demand	Anodyne	ETHR	55	48
O=C(Nc1ccccc1C(=O)OCc1cc(=O)n2cc(Cl)ccc2n1)c1cccs1	ZINC000875259349	II	On-Demand	Anodyne	STK33	26	40
CS(=O)(=O)c1cccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875259378	JG	On-Demand	Anodyne	KCNK3	30	40
CS(=O)(=O)c1cccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875259378	JG	On-Demand	Anodyne	KCNK9	29	43
O=CN1CCCN(C(=O)NCc2ccccc2Oc2cccc(F)c2)CC1	ZINC000875259386	FF	On-Demand	Anodyne	HRH3	26	47
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NCC2(c3ccccc3Cl)CC2)CC1	ZINC000875259397	GD	On-Demand	Anodyne	SLC6A9	45	38
O=C(NCc1ccccc1Oc1cccc(F)c1)N1CCC(CO)(CO)CC1	ZINC000875259427	GF	On-Demand	Anodyne	CACNA1H	42	35
O=C(NCc1ccccc1Oc1cccc(F)c1)N1CCC(CO)(CO)CC1	ZINC000875259427	GF	On-Demand	Anodyne	CCR8	35	41
O=C(Nc1ccccc1C(=O)OCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1cccs1	ZINC000875259454	JG	On-Demand	Bother	SSTR1	40	41
O=C(Nc1ccccc1C(=O)OCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1cccs1	ZINC000875259454	JG	On-Demand	Bother	WDR5	32	42
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000875259457	JK	On-Demand	Anodyne	P2RY1	75	45
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000875259457	JK	On-Demand	Anodyne	STK33	24	43
COc1ccc(-c2noc(COC(=O)c3ccccc3NC(=O)c3cccs3)n2)cc1	ZINC000875259468	II	On-Demand	Anodyne	STK33	27	41
C[C@@H](Cc1ccncc1)NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875259477	FE	On-Demand	Anodyne	OXTR	50	42
C[C@@H](Cc1ccncc1)NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875259477	FE	On-Demand	Anodyne	GHRHR	38	41
C[C@@H](Cc1ccncc1)NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875259478	FE	On-Demand	Anodyne	OXTR	50	42
C[C@@H](Cc1ccncc1)NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875259478	FE	On-Demand	Anodyne	GHRHR	38	41
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)c1cccc(F)c1	ZINC000875259509	GI	On-Demand	Anodyne	STK33	26	41
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)c1cccc(F)c1	ZINC000875259509	GI	On-Demand	Anodyne	KCNK3	22	44
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)c1cccc(F)c1	ZINC000875259509	GI	On-Demand	Anodyne	KCNK9	20	44
CN1CCC[C@H](CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C1	ZINC000875259520	FE	On-Demand	Mild	CCR3	56	43
CN1CCC[C@H](CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C1	ZINC000875259520	FE	On-Demand	Mild	ITK	19	49
CN1CCC[C@H](CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C1	ZINC000875259520	FE	On-Demand	Mild	PANC	54	37
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)Nc1ccccc1Cl	ZINC000875259542	IJ	On-Demand	Anodyne	GRM4	15	50
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@H]1CCOC1	ZINC000875259549	GD	On-Demand	Anodyne	CHRM2	18	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@H]1CCOC1	ZINC000875259549	GD	On-Demand	Anodyne	DRD2	24	46
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@H]1CCOC1	ZINC000875259549	GD	On-Demand	Anodyne	DRD4	47	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@H]1CCOC1	ZINC000875259549	GD	On-Demand	Anodyne	ACHE	67	64
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@H]1CCOC1	ZINC000875259549	GD	On-Demand	Anodyne	HRH1	15	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@H]1CCOC1	ZINC000875259549	GD	On-Demand	Anodyne	DRD3	17	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@H]1CCOC1	ZINC000875259549	GD	On-Demand	Anodyne	SLC6A3	16	51
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@H]1CCOC1	ZINC000875259549	GD	On-Demand	Anodyne	HTR4	33	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@H]1CCOC1	ZINC000875259549	GD	On-Demand	Anodyne	CHRM3	20	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@H]1CCOC1	ZINC000875259549	GD	On-Demand	Anodyne	SIGMAR1	73	47
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@H]1CCOC1	ZINC000875259549	GD	On-Demand	Anodyne	BCHE	19	54
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@H]1CCOC1	ZINC000875259549	GD	On-Demand	Anodyne	CCR3	35	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@H]1CCOC1	ZINC000875259549	GD	On-Demand	Anodyne	MCHR1	23	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@H]1CCOC1	ZINC000875259549	GD	On-Demand	Anodyne	CACNA1G	26	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@@H]1CCOC1	ZINC000875259550	GD	On-Demand	Anodyne	CHRM2	18	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@@H]1CCOC1	ZINC000875259550	GD	On-Demand	Anodyne	DRD2	24	46
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@@H]1CCOC1	ZINC000875259550	GD	On-Demand	Anodyne	DRD4	47	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@@H]1CCOC1	ZINC000875259550	GD	On-Demand	Anodyne	ACHE	67	64
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@@H]1CCOC1	ZINC000875259550	GD	On-Demand	Anodyne	HRH1	15	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@@H]1CCOC1	ZINC000875259550	GD	On-Demand	Anodyne	DRD3	17	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@@H]1CCOC1	ZINC000875259550	GD	On-Demand	Anodyne	SLC6A3	16	51
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@@H]1CCOC1	ZINC000875259550	GD	On-Demand	Anodyne	HTR4	33	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@@H]1CCOC1	ZINC000875259550	GD	On-Demand	Anodyne	CHRM3	20	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@@H]1CCOC1	ZINC000875259550	GD	On-Demand	Anodyne	SIGMAR1	73	47
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@@H]1CCOC1	ZINC000875259550	GD	On-Demand	Anodyne	BCHE	19	54
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@@H]1CCOC1	ZINC000875259550	GD	On-Demand	Anodyne	CCR3	35	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@@H]1CCOC1	ZINC000875259550	GD	On-Demand	Anodyne	MCHR1	23	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCC[C@@H]1CCOC1	ZINC000875259550	GD	On-Demand	Anodyne	CACNA1G	26	41
O=C(Nc1ccccc1C(=O)OCCCN1C(=O)c2ccccc2C1=O)c1cccs1	ZINC000875259597	IH	On-Demand	Anodyne	STK33	25	40
C[C@@H](Cc1ccncc1)NC(=O)C(=O)NCCCCC1CC1	ZINC000875259599	DD	On-Demand	Anodyne	GRIA1	42	38
COCCCCCNC(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875259603	FH	On-Demand	Anodyne	DRD4	43	33
COc1ccc(-c2noc(COC(=O)c3ccccc3NC(=O)c3cccs3)n2)c(OC)c1	ZINC000875259657	JI	On-Demand	Anodyne	STK33	28	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCCc2ccccc2F)C1	ZINC000875259697	ED	On-Demand	Anodyne	SLC6A1	50	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCCc2ccccc2F)C1	ZINC000875259698	ED	On-Demand	Anodyne	SLC6A1	50	35
O=C(Nc1ccccc1C(=O)OCc1ccc(-n2cccn2)cc1)c1cccs1	ZINC000875259714	HJ	On-Demand	Anodyne	AMP1_PLAFQ	50	35
C[C@H](NC(=O)C(=O)NCC[C@@H]1CCCCO1)c1ccc(C(F)(F)F)nc1	ZINC000875259729	FE	On-Demand	Anodyne	TRPV1	50	34
C[C@H](NC(=O)C(=O)NCC[C@H]1CCCCO1)c1ccc(C(F)(F)F)nc1	ZINC000875259731	FE	On-Demand	Anodyne	TRPV1	50	34
COc1ccc(NC(=O)[C@H](C)OC(=O)c2ccccc2NC(=O)c2cccs2)cc1	ZINC000875259741	HI	On-Demand	Anodyne	STK33	28	42
COc1cccc(C2(CNC(=O)NC[C@H]3C[C@H](O)C3)CCCC2)c1	ZINC000875259799	EF	On-Demand	Anodyne	KCNA3	45	36
COc1cccc(C2(CNC(=O)NC[C@H]3C[C@H](O)C3)CCCC2)c1	ZINC000875259799	EF	On-Demand	Anodyne	MTNR1A	42	41
COc1cccc(C2(CNC(=O)NC[C@H]3C[C@H](O)C3)CCCC2)c1	ZINC000875259799	EF	On-Demand	Anodyne	MTNR1B	38	41
COc1cccc(C2(CNC(=O)NC[C@H]3C[C@H](O)C3)CCCC2)c1	ZINC000875259799	EF	On-Demand	Anodyne	SOAT1	17	46
O=C(Nc1ccccc1C(=O)OCC(=O)c1ccc(F)cc1F)c1cccs1	ZINC000875259815	HI	On-Demand	Anodyne	STK33	25	41
CN1CCC[C@H](CNC(=O)NCC2(NC(=O)OC(C)(C)C)CCOCC2)C1	ZINC000875259852	GD	On-Demand	Anodyne	CACNA1I	54	36
C[C@@H](Cc1ccncc1)NC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875259868	GD	On-Demand	Anodyne	MC4R	35	41
C[C@@H](Cc1ccncc1)NC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875259868	GD	On-Demand	Anodyne	NPY2R	77	37
COC(=O)N(C)NC(=O)NCC1(c2cccc(OC)c2)CCCC1	ZINC000875259879	EE	On-Demand	Reactive	KCNA3	44	36
COC(=O)N(C)NC(=O)NCC1(c2cccc(OC)c2)CCCC1	ZINC000875259879	EE	On-Demand	Reactive	MTNR1A	57	42
COC(=O)N(C)NC(=O)NCC1(c2cccc(OC)c2)CCCC1	ZINC000875259879	EE	On-Demand	Reactive	MTNR1B	49	42
COC(=O)N(C)NC(=O)NCC1(c2cccc(OC)c2)CCCC1	ZINC000875259879	EE	On-Demand	Reactive	SOAT1	18	48
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)Nc1cccc(Br)c1	ZINC000875259882	JJ	On-Demand	Anodyne	KCNK3	48	41
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)Nc1cccc(Br)c1	ZINC000875259882	JJ	On-Demand	Anodyne	KCNK9	47	44
COc1ccc(NC(=O)[C@H](C)OC(=O)c2ccccc2NC(=O)c2cccs2)c([N+](=O)[O-])c1	ZINC000875259890	JI	On-Demand	Bother	STK33	18	41
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875259919	HE	On-Demand	Anodyne	CPT1A	45	37
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875259919	HE	On-Demand	Anodyne	CPT2	43	33
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875259919	HE	On-Demand	Anodyne	PREP	43	34
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875259920	HE	On-Demand	Anodyne	CPT1A	45	37
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875259920	HE	On-Demand	Anodyne	CPT2	43	33
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875259920	HE	On-Demand	Anodyne	PREP	43	34
C[C@H](NC(=O)C(=O)NCCCc1ccccc1F)c1ccc(C(F)(F)F)nc1	ZINC000875259951	GG	On-Demand	Anodyne	TRPV1	93	37
C[C@H](NC(=O)C(=O)NCCCc1ccccc1F)c1ccnn1C	ZINC000875259979	ED	On-Demand	Anodyne	MTNR1A	25	40
C[C@H](NC(=O)C(=O)NCCCc1ccccc1F)c1ccnn1C	ZINC000875259979	ED	On-Demand	Anodyne	MTNR1B	26	40
CN1CCCC[C@H]1CCOC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875260002	FI	On-Demand	Anodyne	NOS1	22	45
CN1CCCC[C@H]1CCOC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875260002	FI	On-Demand	Anodyne	ACKR3	63	33
CN1CCCC[C@@H]1CCOC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875260004	FI	On-Demand	Anodyne	NOS1	22	45
CN1CCCC[C@@H]1CCOC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875260004	FI	On-Demand	Anodyne	ACKR3	63	33
CCCOc1cccc(CCNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875260033	FD	On-Demand	Anodyne	HRH2	31	41
CCCOc1cccc(CCNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875260034	FD	On-Demand	Anodyne	HRH2	31	41
COc1cccc(C2(CNC(=O)N3CCC(CO)(CO)CC3)CCCC2)c1	ZINC000875260054	GE	On-Demand	Anodyne	DRD4	42	32
COc1cccc(C2(CNC(=O)N3CCC(CO)(CO)CC3)CCCC2)c1	ZINC000875260054	GE	On-Demand	Anodyne	KCNA3	44	36
COc1cccc(C2(CNC(=O)N3CCC(CO)(CO)CC3)CCCC2)c1	ZINC000875260054	GE	On-Demand	Anodyne	MTNR1A	31	40
COc1cccc(C2(CNC(=O)N3CCC(CO)(CO)CC3)CCCC2)c1	ZINC000875260054	GE	On-Demand	Anodyne	MTNR1B	36	40
COc1cccc(C2(CNC(=O)N3CCC(CO)(CO)CC3)CCCC2)c1	ZINC000875260054	GE	On-Demand	Anodyne	SOAT1	19	50
CONC(=O)C1CCN(C(=O)NCC2(c3cccc(OC)c3)CCCC2)CC1	ZINC000875260062	GF	On-Demand	Anodyne	DRD4	40	31
CONC(=O)C1CCN(C(=O)NCC2(c3cccc(OC)c3)CCCC2)CC1	ZINC000875260062	GF	On-Demand	Anodyne	KCNA3	42	35
CONC(=O)C1CCN(C(=O)NCC2(c3cccc(OC)c3)CCCC2)CC1	ZINC000875260062	GF	On-Demand	Anodyne	MTNR1A	32	45
CONC(=O)C1CCN(C(=O)NCC2(c3cccc(OC)c3)CCCC2)CC1	ZINC000875260062	GF	On-Demand	Anodyne	MTNR1B	33	45
CONC(=O)C1CCN(C(=O)NCC2(c3cccc(OC)c3)CCCC2)CC1	ZINC000875260062	GF	On-Demand	Anodyne	SOAT1	17	45
CONC(=O)C1CCN(C(=O)NCC2(c3cccc(OC)c3)CCCC2)CC1	ZINC000875260062	GF	On-Demand	Anodyne	CACNA1G	15	43
CC(C)c1cccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875260100	HJ	On-Demand	Anodyne	KISS1R	22	40
CC(C)c1cccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875260100	HJ	On-Demand	Anodyne	STK33	23	41
CC(C)c1cccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875260100	HJ	On-Demand	Anodyne	KCNK3	48	41
CC(C)c1cccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875260100	HJ	On-Demand	Anodyne	KCNK9	48	43
COc1cccc(C(C)(C)CNC(=O)C(=O)NCC[C@H]2CCSC2)c1	ZINC000875260103	FE	On-Demand	Anodyne	DRD4	40	31
COc1cccc(C(C)(C)CNC(=O)C(=O)NCC[C@@H]2CCSC2)c1	ZINC000875260104	FE	On-Demand	Anodyne	DRD4	40	31
COc1cccc(C(C)(C)CNC(=O)C(=O)N2CCC(C(C)=O)CC2)c1	ZINC000875260107	FD	On-Demand	Anodyne	DRD4	43	33
COc1cccc(C(C)(C)CNC(=O)C(=O)N2CCC(C(C)=O)CC2)c1	ZINC000875260107	FD	On-Demand	Anodyne	MTNR1B	41	38
COc1cccc(C(C)(C)CNC(=O)C(=O)N2CCC(C(C)=O)CC2)c1	ZINC000875260107	FD	On-Demand	Anodyne	CACNA1G	16	40
Cc1nnc(NNC(=O)NCC2(N3CCOC(C)(C)C3)CCCCC2)n1C	ZINC000875260112	GD	On-Demand	Reactive	HCN1	50	32
Cc1nnc(NNC(=O)NCC2(N3CCOC(C)(C)C3)CCCCC2)n1C	ZINC000875260112	GD	On-Demand	Reactive	HCN4	48	32
CC(=O)C1CCN(C(=O)NCC2(N3CCOC(C)(C)C3)CCCCC2)CC1	ZINC000875260120	GF	On-Demand	Anodyne	HCN1	52	32
CC(=O)C1CCN(C(=O)NCC2(N3CCOC(C)(C)C3)CCCCC2)CC1	ZINC000875260120	GF	On-Demand	Anodyne	HCN4	50	32
O=C(NCC[C@@H]1CCCCO1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875260148	GE	On-Demand	Anodyne	ETHR	65	52
O=C(NCC[C@H]1CCCCO1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875260149	GE	On-Demand	Anodyne	ETHR	65	52
CCCCCCCNC(=O)C(=O)NCC[C@@H]1CCCCO1	ZINC000875260168	CE	On-Demand	Mild	ASAH1	43	34
CCCCCCCNC(=O)C(=O)NCC[C@@H]1CCCCO1	ZINC000875260168	CE	On-Demand	Mild	LASR	44	32
CCCCCCCNC(=O)C(=O)NCC[C@H]1CCCCO1	ZINC000875260169	CE	On-Demand	Mild	ASAH1	43	34
CCCCCCCNC(=O)C(=O)NCC[C@H]1CCCCO1	ZINC000875260169	CE	On-Demand	Mild	LASR	44	32
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)N[C@@H]1CCOc2ccccc21	ZINC000875260199	IH	On-Demand	Anodyne	TRAR	48	36
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)N[C@H]1CCOc2ccccc21	ZINC000875260200	IH	On-Demand	Anodyne	TRAR	48	36
C[C@@H](CN(C)C(=O)C(=O)NCCCc1ccccc1F)NC(=O)OC(C)(C)C	ZINC000875260205	GE	On-Demand	Anodyne	PAPA1_CARPA	28	45
C[C@@H](CN(C)C(=O)C(=O)NCCCc1ccccc1F)NC(=O)OC(C)(C)C	ZINC000875260205	GE	On-Demand	Anodyne	FPR1	41	37
O=C(Nc1ccccc1C(=O)OCc1ccc2ccccc2n1)c1cccs1	ZINC000875260212	GJ	On-Demand	Anodyne	CYSLTR1	47	39
O=C(Nc1ccccc1C(=O)OCc1ccc2ccccc2n1)c1cccs1	ZINC000875260212	GJ	On-Demand	Anodyne	STK33	34	44
COC(=O)C1CCN(C(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)CC1	ZINC000875260252	GF	On-Demand	Anodyne	PTR1	44	31
COC(=O)c1ccc(COC(=O)C2(c3cccc(Cl)c3)CCC2)o1	ZINC000875260256	EH	On-Demand	Anodyne	SLC12A5	44	34
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)NCc1nc(-c3ccncc3)cs1)C2	ZINC000875260264	GD	On-Demand	Anodyne	HTR3A	34	40
O=C(Nc1ccccc1C(=O)OCC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1cccs1	ZINC000875260265	JH	On-Demand	Bother	WDR5	32	40
O=C(COC(=O)C1(c2cccc(Cl)c2)CCC1)Nc1ccccc1I	ZINC000875260267	JJ	On-Demand	Anodyne	KCNQ2	19	40
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NC1C[C@@H]2CCC[C@H](C1)N2C	ZINC000875260286	FD	On-Demand	Anodyne	HTR3A	40	44
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NC1C[C@@H]2CCC[C@H](C1)N2C	ZINC000875260286	FD	On-Demand	Anodyne	HTR4	25	42
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NC1C[C@@H]2CCC[C@H](C1)N2C	ZINC000875260286	FD	On-Demand	Anodyne	GLRA1	40	30
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NC1C[C@@H]2CCC[C@H](C1)N2C	ZINC000875260289	FD	On-Demand	Anodyne	HTR3A	40	44
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NC1C[C@@H]2CCC[C@H](C1)N2C	ZINC000875260289	FD	On-Demand	Anodyne	HTR4	25	42
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NC1C[C@@H]2CCC[C@H](C1)N2C	ZINC000875260289	FD	On-Demand	Anodyne	GLRA1	40	30
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000875260323	JJ	On-Demand	Mild	VIPR1	28	44
COC(=O)c1ccc(OCCNC(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875260324	ED	On-Demand	Anodyne	HRH3	35	41
COC(=O)c1ccc(OCCNC(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875260324	ED	On-Demand	Anodyne	PSMB1	40	38
COC(=O)c1ccc(OCCNC(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875260326	ED	On-Demand	Anodyne	HRH3	35	41
COC(=O)c1ccc(OCCNC(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875260326	ED	On-Demand	Anodyne	PSMB1	40	38
Cn1nc(Cl)c(C(=O)N(CCN2CCOCC2)c2ccccc2)c1Cl	ZINC000875260334	GF	On-Demand	Anodyne	CASR	52	39
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)NCc1cccc3ncccc13)C2	ZINC000875260382	FD	On-Demand	Anodyne	HTR3A	39	46
O=C(COC(=O)C1(c2cccc(Cl)c2)CCC1)Nc1ccccc1F	ZINC000875260398	FI	On-Demand	Anodyne	KCNQ2	30	40
COC(=O)c1ccc(OCCNC(=O)N2CCCCCCNC(=O)CC2)cc1	ZINC000875260405	GD	On-Demand	Anodyne	HRH3	15	40
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000875260406	GF	On-Demand	Reactive	DRD2	19	47
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000875260406	GF	On-Demand	Reactive	DRD4	48	48
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000875260406	GF	On-Demand	Reactive	ACHE	25	46
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000875260406	GF	On-Demand	Reactive	HRH1	25	47
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000875260406	GF	On-Demand	Reactive	OPRK1	26	40
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000875260406	GF	On-Demand	Reactive	KCNH2	18	46
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000875260406	GF	On-Demand	Reactive	CHRM3	16	40
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000875260406	GF	On-Demand	Reactive	LTA4H	23	41
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000875260406	GF	On-Demand	Reactive	SIGMAR1	48	62
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000875260406	GF	On-Demand	Reactive	SSTR5	86	47
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000875260406	GF	On-Demand	Reactive	CCR3	75	47
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000875260406	GF	On-Demand	Reactive	UTS2R	38	52
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000875260406	GF	On-Demand	Reactive	EPHX2	18	43
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000875260406	GF	On-Demand	Reactive	PDK1	54	41
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000875260406	GF	On-Demand	Reactive	CXCR3	46	38
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000875260406	GF	On-Demand	Reactive	MCHR1	72	61
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000875260406	GF	On-Demand	Reactive	CCR8	18	43
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000875260416	GG	On-Demand	Anodyne	DRD4	33	47
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000875260416	GG	On-Demand	Anodyne	OPRK1	19	40
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000875260416	GG	On-Demand	Anodyne	KCNH2	15	44
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000875260416	GG	On-Demand	Anodyne	SIGMAR1	37	60
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000875260416	GG	On-Demand	Anodyne	SSTR5	73	44
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000875260416	GG	On-Demand	Anodyne	CCR3	53	52
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000875260416	GG	On-Demand	Anodyne	UTS2R	22	44
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000875260416	GG	On-Demand	Anodyne	PDK1	50	38
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000875260416	GG	On-Demand	Anodyne	CXCR3	50	41
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000875260416	GG	On-Demand	Anodyne	MCHR1	58	54
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000875260416	GG	On-Demand	Anodyne	CACNA1I	58	43
O=C(COC(=O)C1(c2cccc(Cl)c2)CCC1)N1CCc2ccccc2C1	ZINC000875260429	GH	On-Demand	Anodyne	DPP8	18	42
N#Cc1cccc(NC(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)c1	ZINC000875260430	FH	On-Demand	Mild	MCHR1	43	47
Cc1nccnc1[C@H](C)NC(=O)NCC1(N2CCOC(C)(C)C2)CCCCC1	ZINC000875260443	GF	On-Demand	Anodyne	HCN1	55	36
Cc1nccnc1[C@H](C)NC(=O)NCC1(N2CCOC(C)(C)C2)CCCCC1	ZINC000875260443	GF	On-Demand	Anodyne	HCN4	51	36
Cc1nccnc1[C@@H](C)NC(=O)NCC1(N2CCOC(C)(C)C2)CCCCC1	ZINC000875260444	GF	On-Demand	Anodyne	HCN1	55	36
Cc1nccnc1[C@@H](C)NC(=O)NCC1(N2CCOC(C)(C)C2)CCCCC1	ZINC000875260444	GF	On-Demand	Anodyne	HCN4	51	36
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000875260464	JH	On-Demand	Anodyne	KCNK3	43	45
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000875260464	JH	On-Demand	Anodyne	KCNK9	33	45
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)Nc1sc2c(c1C#N)CCCCC2	ZINC000875260517	JK	On-Demand	Mild	VIPR1	29	46
O=C(NC[C@H]1CCOc2ccccc21)N1CCC[C@H](OC2CCC2)CC1	ZINC000875260535	FH	On-Demand	Anodyne	SMO	28	42
O=C(NC[C@@H]1CCOc2ccccc21)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875260538	FH	On-Demand	Anodyne	SMO	28	42
O=C(NC[C@@H]1CCOc2ccccc21)N1CCC[C@H](OC2CCC2)CC1	ZINC000875260541	FH	On-Demand	Anodyne	SMO	28	42
NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)COC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875260543	JE	On-Demand	Anodyne	CA7	16	44
NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)COC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875260543	JE	On-Demand	Anodyne	NOS1	17	42
C[C@H](NC(=O)C(=O)NCCCc1ccccc1F)c1cc2cnccc2o1	ZINC000875260585	FF	On-Demand	Anodyne	MTNR1A	23	40
C[C@H](NC(=O)C(=O)NCCCc1ccccc1F)c1cc2cnccc2o1	ZINC000875260585	FF	On-Demand	Anodyne	MTNR1B	24	40
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCC[C@H]1CCCCO1)CC2	ZINC000875260628	GE	On-Demand	Anodyne	MTNR1B	16	42
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCC[C@H]1CCCCO1)CC2	ZINC000875260629	GE	On-Demand	Anodyne	MTNR1B	16	42
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCC[C@@H]1CCCCO1)CC2	ZINC000875260630	GE	On-Demand	Anodyne	MTNR1B	16	42
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCC[C@@H]1CCCCO1)CC2	ZINC000875260631	GE	On-Demand	Anodyne	MTNR1B	16	42
O=C(COC(=O)C1(c2cccc(Cl)c2)CCC1)Nc1cccc([N+](=O)[O-])c1	ZINC000875260652	GH	On-Demand	Bother	CACNA1D	55	33
O=C(COC(=O)C1(c2cccc(Cl)c2)CCC1)NC(=O)NC1CCCCC1	ZINC000875260669	GG	On-Demand	Anodyne	EPHX2	17	53
N#Cc1ccc(CC(=O)Nc2sc3c(c2C(=O)NC2CC2)CCC3)cn1	ZINC000875260670	FF	On-Demand	Mild	VIPR1	28	45
O=C(COC(=O)C1(c2cccc(Cl)c2)CCC1)Nc1ccccc1Cl	ZINC000875260675	GJ	On-Demand	Anodyne	KCNQ2	29	43
O=C(COC(=O)C1(c2cccc(Cl)c2)CCC1)NC(=O)NCc1ccccc1	ZINC000875260702	HG	On-Demand	Anodyne	PDS	47	37
O=C(COC(=O)C1(c2cccc(Cl)c2)CCC1)NCc1ccccc1	ZINC000875260705	FH	On-Demand	Anodyne	PDS	55	39
Cn1c(=O)c(C(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)c(N)n(Cc2ccccc2)c1=O	ZINC000875260728	JF	On-Demand	Anodyne	SLC12A5	53	33
CC(=O)Nc1ccc2c(COC(=O)C3(c4cccc(Cl)c4)CCC3)cc(=O)oc2c1	ZINC000875260731	IJ	On-Demand	Anodyne	MAOB	25	43
CCCCCCCNC(=O)C(=O)NCc1cc(F)ccc1N1CCOCC1	ZINC000875260738	GE	On-Demand	Mild	ASAH1	89	48
C[C@H](NC(=O)C(=O)NCC[C@H]1CCOC1)c1ccc(C(F)(F)F)nc1	ZINC000875260765	FD	On-Demand	Anodyne	TRPV1	47	33
C[C@H](NC(=O)C(=O)NCC[C@@H]1CCOC1)c1ccc(C(F)(F)F)nc1	ZINC000875260768	FD	On-Demand	Anodyne	TRPV1	47	33
CCOC(=O)N1CCC(NC(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)CC1	ZINC000875260773	JF	On-Demand	Anodyne	CCR8	94	46
COC(=O)N(C)NC(=O)NCCCc1cccc(Br)c1	ZINC000875260806	EE	On-Demand	Reactive	MTNR1A	36	46
COC(=O)N(C)NC(=O)NCCCc1cccc(Br)c1	ZINC000875260806	EE	On-Demand	Reactive	MTNR1B	32	46
COC(=O)N(C)NC(=O)NCCCc1cccc(Br)c1	ZINC000875260806	EE	On-Demand	Reactive	CRTM	49	39
COc1ccc(NC(=O)[C@H](C)OC(=O)c2ccccc2NC(=O)c2cccs2)cc1OC	ZINC000875260810	JI	On-Demand	Anodyne	GRM4	17	57
COc1ccc(NC(=O)[C@H](C)OC(=O)c2ccccc2NC(=O)c2cccs2)cc1OC	ZINC000875260810	JI	On-Demand	Anodyne	KCNK3	49	37
COc1ccc(NC(=O)[C@H](C)OC(=O)c2ccccc2NC(=O)c2cccs2)cc1OC	ZINC000875260810	JI	On-Demand	Anodyne	KCNK9	47	39
O=C(NCC1(C(=O)N2CCCn3nccc32)CCCC1)OCc1ccccc1	ZINC000875260830	GG	On-Demand	Anodyne	CAPN2	42	32
O=C(NCC1(C(=O)N2CCCn3nccc32)CCCC1)OCc1ccccc1	ZINC000875260830	GG	On-Demand	Anodyne	NPR	42	32
O=C(NCC1(C(=O)N2CCCn3nccc32)CCCC1)OCc1ccccc1	ZINC000875260830	GG	On-Demand	Anodyne	SLC12A5	59	35
O=C(COC(=O)C1(c2cccc(Cl)c2)CCC1)Nc1ccc(N2CCOCC2)cc1	ZINC000875260831	IH	On-Demand	Anodyne	STAT6	55	35
COc1cccc(C(C)(C)CNC(=O)C(=O)N[C@H](C)c2ccnn2C)c1	ZINC000875260900	FD	On-Demand	Anodyne	DRD4	40	30
COc1cccc(C(C)(C)CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)c1	ZINC000875260901	FD	On-Demand	Anodyne	DRD4	40	30
CCCOc1cccc(CCNC(=O)C(=O)N[C@H]2CC23CCC3)c1	ZINC000875260910	EE	On-Demand	Anodyne	HRH2	28	41
CCCOc1cccc(CCNC(=O)C(=O)N[C@@H]2CC23CCC3)c1	ZINC000875260911	EE	On-Demand	Anodyne	HRH2	28	41
CC[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)Nc1ccc(OC)cc1	ZINC000875260924	IJ	On-Demand	Anodyne	STK33	27	41
Cc1nc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)sc1C	ZINC000875260956	FE	On-Demand	Anodyne	SLC5A7	20	51
Cc1nc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)sc1C	ZINC000875260956	FE	On-Demand	Anodyne	SIRT3	49	30
Cc1nc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)sc1C	ZINC000875260956	FE	On-Demand	Anodyne	SIRT2	51	33
Cc1nc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)sc1C	ZINC000875260956	FE	On-Demand	Anodyne	SIRT1	50	33
CCCOc1cccc(CCNC(=O)C(=O)NCc2cccc3ncccc23)c1	ZINC000875260959	GF	On-Demand	Anodyne	MTNR1A	57	45
CCCOc1cccc(CCNC(=O)C(=O)NCc2cccc3ncccc23)c1	ZINC000875260959	GF	On-Demand	Anodyne	MTNR1B	45	38
CCCOc1cccc(CCNC(=O)C(=O)NCc2cccc3ncccc23)c1	ZINC000875260959	GF	On-Demand	Anodyne	PDS	54	35
Cc1c(NC(=O)[C@H](C)OC(=O)c2ccccc2NC(=O)c2cccs2)cccc1[N+](=O)[O-]	ZINC000875260975	JI	On-Demand	Bother	COLA	45	37
Cc1c(NC(=O)[C@@H](C)OC(=O)c2ccccc2NC(=O)c2cccs2)cccc1[N+](=O)[O-]	ZINC000875260976	JI	On-Demand	Bother	COLA	45	37
CCCOc1cccc(CCNC(=O)C(=O)N2CC[C@H]3CSC[C@H]3C2)c1	ZINC000875260977	GE	On-Demand	Anodyne	HRH2	26	40
CCCOc1cccc(CCNC(=O)C(=O)N2CC[C@@H]3CSC[C@H]3C2)c1	ZINC000875260978	GE	On-Demand	Anodyne	HRH2	26	40
CCCOc1cccc(CCNC(=O)C(=O)N2CC[C@H]3CSC[C@@H]3C2)c1	ZINC000875260979	GE	On-Demand	Anodyne	HRH2	26	40
CCCOc1cccc(CCNC(=O)C(=O)N2CC[C@@H]3CSC[C@@H]3C2)c1	ZINC000875260980	GE	On-Demand	Anodyne	HRH2	26	40
COc1ccc(OC)c([C@H](C)NC(=O)[C@H](C)OC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875260994	JI	On-Demand	Anodyne	STK33	22	40
COc1ccc(OC)c([C@H](C)NC(=O)[C@@H](C)OC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875260996	JI	On-Demand	Anodyne	STK33	22	40
NS(=O)(=O)c1cccc(NC(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)c1	ZINC000875260998	HF	On-Demand	Anodyne	CA2	30	50
NS(=O)(=O)c1cccc(NC(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)c1	ZINC000875260998	HF	On-Demand	Anodyne	CA1	25	44
NS(=O)(=O)c1cccc(NC(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)c1	ZINC000875260998	HF	On-Demand	Anodyne	CA5B	40	34
NS(=O)(=O)c1cccc(NC(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)c1	ZINC000875260998	HF	On-Demand	Anodyne	CA4	33	50
NS(=O)(=O)c1cccc(NC(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)c1	ZINC000875260998	HF	On-Demand	Anodyne	CA5A	45	34
NS(=O)(=O)c1cccc(NC(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)c1	ZINC000875260998	HF	On-Demand	Anodyne	TTK	19	41
COC(=O)c1ccc(OCCNC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)cc1	ZINC000875260999	GD	On-Demand	Anodyne	SLC6A4	22	42
COC(=O)c1ccc(OCCNC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)cc1	ZINC000875260999	GD	On-Demand	Anodyne	SLC6A3	41	42
COC(=O)c1ccc(OCCNC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)cc1	ZINC000875261001	GD	On-Demand	Anodyne	SLC6A4	22	42
COC(=O)c1ccc(OCCNC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)cc1	ZINC000875261001	GD	On-Demand	Anodyne	SLC6A3	41	42
NS(=O)(=O)c1ccc(NC(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)cc1	ZINC000875261033	HF	On-Demand	Anodyne	CA2	76	46
NS(=O)(=O)c1ccc(NC(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)cc1	ZINC000875261033	HF	On-Demand	Anodyne	CA1	69	46
NS(=O)(=O)c1ccc(NC(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)cc1	ZINC000875261033	HF	On-Demand	Anodyne	CA7	36	43
NS(=O)(=O)c1ccc(NC(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)cc1	ZINC000875261033	HF	On-Demand	Anodyne	CA5B	59	43
NS(=O)(=O)c1ccc(NC(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)cc1	ZINC000875261033	HF	On-Demand	Anodyne	CA4	66	43
NS(=O)(=O)c1ccc(NC(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)cc1	ZINC000875261033	HF	On-Demand	Anodyne	CA5A	64	43
NS(=O)(=O)c1ccc(NC(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)cc1	ZINC000875261033	HF	On-Demand	Anodyne	CA14	41	35
NS(=O)(=O)c1ccc(NC(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)cc1	ZINC000875261033	HF	On-Demand	Anodyne	CA12	54	41
NS(=O)(=O)c1ccc(NC(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)cc1	ZINC000875261033	HF	On-Demand	Anodyne	CA9	56	41
NS(=O)(=O)c1ccc(NC(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)cc1	ZINC000875261033	HF	On-Demand	Anodyne	MTCA1	50	43
NS(=O)(=O)c1ccc(NC(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)cc1	ZINC000875261033	HF	On-Demand	Anodyne	P96878_MYCTU	62	43
C[C@H]1CCCCN1C(=O)COC(=O)C1(c2cccc(Cl)c2)CCC1	ZINC000875261059	EH	On-Demand	Anodyne	CPT1A	70	42
C[C@H]1CCCCN1C(=O)COC(=O)C1(c2cccc(Cl)c2)CCC1	ZINC000875261059	EH	On-Demand	Anodyne	CPT2	42	42
C[C@@H]1CCCCN1C(=O)COC(=O)C1(c2cccc(Cl)c2)CCC1	ZINC000875261060	EH	On-Demand	Anodyne	CPT1A	70	42
C[C@@H]1CCCCN1C(=O)COC(=O)C1(c2cccc(Cl)c2)CCC1	ZINC000875261060	EH	On-Demand	Anodyne	CPT2	42	42
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1)C2	ZINC000875261076	FD	On-Demand	Anodyne	HTR3A	31	40
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)NCc1nn(C)cc1C(F)F)C2	ZINC000875261088	FD	On-Demand	Anodyne	HTR3A	32	42
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000875261095	JJ	On-Demand	Anodyne	KCNQ2	35	42
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000875261095	JJ	On-Demand	Anodyne	PRNP	41	37
O=C(COC(=O)C1(c2cccc(Cl)c2)CCC1)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000875261106	JF	On-Demand	Anodyne	TGM2	40	35
O=C(COC(=O)C1(c2cccc(Cl)c2)CCC1)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000875261106	JF	On-Demand	Anodyne	F13A1	45	37
CCCCCCCNC(=O)C(=O)NC1C[C@@H]2CCC[C@H](C1)N2C	ZINC000875261139	DE	On-Demand	Mild	HTR3A	36	42
CCCCCCCNC(=O)C(=O)NC1C[C@@H]2CCC[C@H](C1)N2C	ZINC000875261139	DE	On-Demand	Mild	ASAH1	57	33
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)NCCC[C@@H]1C=CCC1)C2	ZINC000875261141	ED	On-Demand	Anodyne	HTR3A	34	40
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)NCCC[C@H]1C=CCC1)C2	ZINC000875261142	ED	On-Demand	Anodyne	HTR3A	34	40
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)NCc1ccc(C(C)(C)C)o1)C2	ZINC000875261143	FE	On-Demand	Anodyne	HTR3A	34	41
CC[C@@H](NC(=O)NCCCN(C(=O)C1CCC1)C1CC1)[C@@H](O)c1ccccc1	ZINC000875261157	GF	On-Demand	Anodyne	CCR5	15	43
CC[C@@H](NC(=O)NCCCN(C(=O)C1CCC1)C1CC1)[C@H](O)c1ccccc1	ZINC000875261162	GF	On-Demand	Anodyne	CCR5	15	43
O=C(Nc1ccccc1C(=O)OCc1nc(COc2ccc(F)cc2)no1)c1cccs1	ZINC000875261186	JI	On-Demand	Anodyne	STK33	26	40
O=C(Nc1ccccc1C(=O)OCC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1cccs1	ZINC000875261187	JH	On-Demand	Bother	NOS1	15	42
O=C(Nc1ccccc1C(=O)OCC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1cccs1	ZINC000875261187	JH	On-Demand	Bother	WDR5	33	42
COc1cccc(C(C)(C)CNC(=O)C(=O)NCc2nn(C)cc2C(F)F)c1	ZINC000875261192	GE	On-Demand	Anodyne	DRD4	40	32
CCc1nocc1C(=O)N(CC)c1ccc(S(=O)(=O)C(F)(F)F)cc1	ZINC000875261247	GG	On-Demand	Anodyne	MLYCD	15	40
CCCOc1cccc(CCNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)c1	ZINC000875261259	FD	On-Demand	Anodyne	HRH2	46	46
CCCOc1cccc(CCNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)c1	ZINC000875261259	FD	On-Demand	Anodyne	MTNR1A	29	42
CCCOc1cccc(CCNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)c1	ZINC000875261260	FD	On-Demand	Anodyne	HRH2	46	46
CCCOc1cccc(CCNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)c1	ZINC000875261260	FD	On-Demand	Anodyne	MTNR1A	29	42
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)c1cccc([N+](=O)[O-])c1	ZINC000875261265	HH	On-Demand	Bother	CACNA1D	63	38
CCCOc1cccc(CCNC(=O)C(=O)NC2CCC(C)(N(C)C)CC2)c1	ZINC000875261270	GF	On-Demand	Anodyne	HRH2	25	41
CCCOc1cccc(CCNC(=O)C(=O)NC2CCC(C)(N(C)C)CC2)c1	ZINC000875261270	GF	On-Demand	Anodyne	FAAH	19	45
CCCOc1cccc(CCNC(=O)C(=O)NC2CCC(C)(N(C)C)CC2)c1	ZINC000875261270	GF	On-Demand	Anodyne	CRTM	47	31
Cc1oc(-c2ccccc2)nc1COC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875261273	HK	On-Demand	Anodyne	PPARG	72	46
Cc1oc(-c2ccccc2)nc1COC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875261273	HK	On-Demand	Anodyne	PPARA	77	43
Cc1oc(-c2ccccc2)nc1COC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875261273	HK	On-Demand	Anodyne	PDE8B	60	34
COC(=O)c1ccc(OCCNC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875261305	FD	On-Demand	Anodyne	HRH3	15	44
COC(=O)c1ccc(OCCNC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875261306	FD	On-Demand	Anodyne	HRH3	15	44
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)N1C[C@H]3CC=CC[C@H]3C1)C2	ZINC000875261307	ED	On-Demand	Anodyne	HTR3A	32	41
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)NCc1ccc(OC(F)(F)F)cc1	ZINC000875261317	JI	On-Demand	Anodyne	STK33	20	42
CO[C@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)N2CCCn3nccc32)C1	ZINC000875261335	GE	On-Demand	Anodyne	SLC12A5	58	36
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)N2CCCn3nccc32)C1	ZINC000875261337	GE	On-Demand	Anodyne	SLC12A5	58	36
CO[C@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)N2CCCn3nccc32)C1	ZINC000875261339	GE	On-Demand	Anodyne	SLC12A5	58	36
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)N2CCCn3nccc32)C1	ZINC000875261341	GE	On-Demand	Anodyne	SLC12A5	58	36
COC(=O)c1ccc(OCCNC(=O)N2CC[C@@H]3[C@@H](CCN3C)C2)cc1	ZINC000875261355	FD	On-Demand	Anodyne	HRH3	16	44
O=C(COC(=O)C1(c2cccc(Cl)c2)CCC1)Nc1ccc(Cl)cn1	ZINC000875261356	GH	On-Demand	Anodyne	F10	41	40
COC(=O)c1ccc(OCCNC(=O)N2CC[C@@H]3[C@H](CCN3C)C2)cc1	ZINC000875261357	FD	On-Demand	Anodyne	HRH3	16	44
COC(=O)c1ccc(OCCNC(=O)N2CC[C@H]3[C@@H](CCN3C)C2)cc1	ZINC000875261359	FD	On-Demand	Anodyne	HRH3	16	44
COC(=O)c1ccc(OCCNC(=O)N2CC[C@H]3[C@H](CCN3C)C2)cc1	ZINC000875261360	FD	On-Demand	Anodyne	HRH3	16	44
O=C(NCCCN(C(=O)C1CCC1)C1CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875261388	GF	On-Demand	Anodyne	CCR5	22	40
O=C(NCCCN(C(=O)C1CCC1)C1CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875261391	GF	On-Demand	Anodyne	CCR5	22	40
CCN(C(=O)[C@H]1CCCN1C(C)=O)c1ccc(S(=O)(=O)C(F)(F)F)cc1	ZINC000875261410	GE	On-Demand	Anodyne	SFRP1	47	41
CCN(C(=O)[C@H]1CCCN1C(C)=O)c1ccc(S(=O)(=O)C(F)(F)F)cc1	ZINC000875261410	GE	On-Demand	Anodyne	WNT3	63	41
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)cc1	ZINC000875261427	JE	On-Demand	Anodyne	CA2	69	53
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)cc1	ZINC000875261427	JE	On-Demand	Anodyne	CA1	64	53
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)cc1	ZINC000875261427	JE	On-Demand	Anodyne	CA7	41	48
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)cc1	ZINC000875261427	JE	On-Demand	Anodyne	CA5B	53	48
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)cc1	ZINC000875261427	JE	On-Demand	Anodyne	CA4	44	48
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)cc1	ZINC000875261427	JE	On-Demand	Anodyne	CA5A	54	48
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)cc1	ZINC000875261427	JE	On-Demand	Anodyne	CA14	37	43
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)cc1	ZINC000875261427	JE	On-Demand	Anodyne	CA12	50	53
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)cc1	ZINC000875261427	JE	On-Demand	Anodyne	CA9	51	53
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)cc1	ZINC000875261427	JE	On-Demand	Anodyne	NCE103	27	49
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)cc1	ZINC000875261427	JE	On-Demand	Anodyne	P96878_MYCTU	26	49
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)cc1	ZINC000875261427	JE	On-Demand	Anodyne	A6YCJ1_9METZ	16	43
CCCOc1cccc(CCNC(=O)C(=O)N2CCC(C(C)=O)CC2)c1	ZINC000875261465	FD	On-Demand	Anodyne	HRH2	39	45
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)C1(c2cccc(Cl)c2)CCC1	ZINC000875261469	HH	On-Demand	Anodyne	CMA1	15	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)C1(c2cccc(Cl)c2)CCC1	ZINC000875261469	HH	On-Demand	Anodyne	PAPA1_CARPA	40	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)C1(c2cccc(Cl)c2)CCC1	ZINC000875261469	HH	On-Demand	Anodyne	TIMP3	74	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)C1(c2cccc(Cl)c2)CCC1	ZINC000875261469	HH	On-Demand	Anodyne	CAPNS1	41	30
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)C1(c2cccc(Cl)c2)CCC1	ZINC000875261469	HH	On-Demand	Anodyne	HLA-DRB1	57	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)C1(c2cccc(Cl)c2)CCC1	ZINC000875261469	HH	On-Demand	Anodyne	SLC12A5	45	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)C1(c2cccc(Cl)c2)CCC1	ZINC000875261470	HH	On-Demand	Anodyne	CMA1	15	42
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)C1(c2cccc(Cl)c2)CCC1	ZINC000875261470	HH	On-Demand	Anodyne	PAPA1_CARPA	40	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)C1(c2cccc(Cl)c2)CCC1	ZINC000875261470	HH	On-Demand	Anodyne	TIMP3	74	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)C1(c2cccc(Cl)c2)CCC1	ZINC000875261470	HH	On-Demand	Anodyne	CAPNS1	41	30
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)C1(c2cccc(Cl)c2)CCC1	ZINC000875261470	HH	On-Demand	Anodyne	HLA-DRB1	57	41
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)C1(c2cccc(Cl)c2)CCC1	ZINC000875261470	HH	On-Demand	Anodyne	SLC12A5	45	34
O=C(OCc1ccccc1[N+](=O)[O-])C1(c2cccc(Cl)c2)CCC1	ZINC000875261490	EI	On-Demand	Bother	COLA	83	40
CCCCCCCNC(=O)C(=O)NCCc1nc(C)c(C)s1	ZINC000875261512	EF	On-Demand	Mild	ASAH1	68	37
COC(=O)N(C)NC(=O)NCC1(N2CCOC(C)(C)C2)CCCCC1	ZINC000875261514	FD	On-Demand	Reactive	HCN1	54	34
COC(=O)N(C)NC(=O)NCC1(N2CCOC(C)(C)C2)CCCCC1	ZINC000875261514	FD	On-Demand	Reactive	HCN4	52	34
N#Cc1ccc(NC(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)cc1	ZINC000875261531	FH	On-Demand	Mild	MCHR1	31	44
Cc1nc(CNC(=O)C(=O)N2CCN(c3ccc(F)cc3F)CC2)sc1C	ZINC000875261561	GE	On-Demand	Anodyne	NPY2R	56	35
COc1ccc(NC(=O)[C@H](OC(=O)c2ccccc2NC(=O)c2cccs2)C(C)C)cc1	ZINC000875261567	JJ	On-Demand	Anodyne	STK33	27	41
CCCOc1cccc(CCNC(=O)C(=O)NCc2ncc(Cl)s2)c1	ZINC000875261573	GF	On-Demand	Anodyne	PDS	50	34
O=C(COC(=O)C1(c2cccc(Cl)c2)CCC1)N1CCCCCC1	ZINC000875261586	EH	On-Demand	Anodyne	DPP7	28	40
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1)C2	ZINC000875261587	GE	On-Demand	Anodyne	HTR3A	32	40
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1)C2	ZINC000875261587	GE	On-Demand	Anodyne	CHRNA7	42	37
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1)C2	ZINC000875261587	GE	On-Demand	Anodyne	C3AR1	41	41
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1)C2	ZINC000875261587	GE	On-Demand	Anodyne	GLRA1	39	41
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1)C2	ZINC000875261588	GE	On-Demand	Anodyne	HTR3A	32	40
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1)C2	ZINC000875261588	GE	On-Demand	Anodyne	CHRNA7	42	37
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1)C2	ZINC000875261588	GE	On-Demand	Anodyne	C3AR1	41	41
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1)C2	ZINC000875261588	GE	On-Demand	Anodyne	GLRA1	39	41
N#Cc1ccc(COC(=O)C2(c3cccc(Cl)c3)CCC2)cc1	ZINC000875261589	EI	On-Demand	Mild	SLC12A5	67	48
CCCCCCCNC(=O)C(=O)NC[C@@H](C)c1nc(C)cs1	ZINC000875261595	EF	On-Demand	Mild	ASAH1	71	34
CCCCCCCNC(=O)C(=O)NC[C@H](C)c1nc(C)cs1	ZINC000875261596	EF	On-Demand	Mild	ASAH1	71	34
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875261597	JH	On-Demand	Anodyne	DRD4	33	49
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875261597	JH	On-Demand	Anodyne	SIGMAR1	23	45
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875261597	JH	On-Demand	Anodyne	CCR3	24	41
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875261597	JH	On-Demand	Anodyne	MCHR1	17	41
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875261597	JH	On-Demand	Anodyne	BIRC2	23	40
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875261598	JH	On-Demand	Anodyne	DRD4	33	49
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875261598	JH	On-Demand	Anodyne	SIGMAR1	23	45
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875261598	JH	On-Demand	Anodyne	CCR3	24	41
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875261598	JH	On-Demand	Anodyne	MCHR1	17	41
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000875261598	JH	On-Demand	Anodyne	BIRC2	23	40
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)C2	ZINC000875261612	GD	On-Demand	Anodyne	HTR3A	35	43
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)C2	ZINC000875261612	GD	On-Demand	Anodyne	SLC6A3	18	40
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)C2	ZINC000875261612	GD	On-Demand	Anodyne	HTR4	20	42
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)C2	ZINC000875261612	GD	On-Demand	Anodyne	GLRA1	48	37
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)C2	ZINC000875261614	GD	On-Demand	Anodyne	HTR3A	35	43
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)C2	ZINC000875261614	GD	On-Demand	Anodyne	SLC6A3	18	40
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)C2	ZINC000875261614	GD	On-Demand	Anodyne	HTR4	20	42
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)C2	ZINC000875261614	GD	On-Demand	Anodyne	GLRA1	48	37
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)C2	ZINC000875261615	GD	On-Demand	Anodyne	HTR3A	35	43
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)C2	ZINC000875261615	GD	On-Demand	Anodyne	SLC6A3	18	40
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)C2	ZINC000875261615	GD	On-Demand	Anodyne	HTR4	20	42
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)C2	ZINC000875261615	GD	On-Demand	Anodyne	GLRA1	48	37
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)C2	ZINC000875261616	GD	On-Demand	Anodyne	HTR3A	35	43
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)C2	ZINC000875261616	GD	On-Demand	Anodyne	SLC6A3	18	40
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)C2	ZINC000875261616	GD	On-Demand	Anodyne	HTR4	20	42
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)C2	ZINC000875261616	GD	On-Demand	Anodyne	GLRA1	48	37
COc1cccc(C(C)(C)CNC(=O)C(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875261659	GC	On-Demand	Anodyne	DRD4	42	32
COc1cccc(C(C)(C)CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875261661	FD	On-Demand	Anodyne	DRD4	43	33
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)NCc1ccc(Br)cn1)C2	ZINC000875261662	GD	On-Demand	Anodyne	HTR3A	33	41
COc1cccc(C(C)(C)CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875261664	FD	On-Demand	Anodyne	DRD4	43	33
COc1cccc(C(C)(C)CNC(=O)C(=O)N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)c1	ZINC000875261668	GE	On-Demand	Anodyne	DRD4	40	32
CCCCCCCNC(=O)C(=O)NCc1nc(C)c(C)s1	ZINC000875261691	DE	On-Demand	Mild	ASAH1	68	37
CCCCCCCNC(=O)C(=O)NCC[C@@H]1CCOC1	ZINC000875261733	CD	On-Demand	Mild	EPHX2	15	41
CCCCCCCNC(=O)C(=O)NCC[C@@H]1CCOC1	ZINC000875261733	CD	On-Demand	Mild	ASAH1	49	35
CCCCCCCNC(=O)C(=O)NCC[C@H]1CCOC1	ZINC000875261735	CD	On-Demand	Mild	EPHX2	15	41
CCCCCCCNC(=O)C(=O)NCC[C@H]1CCOC1	ZINC000875261735	CD	On-Demand	Mild	ASAH1	49	35
COc1cccc(C(C)(C)CNC(=O)C(=O)N[C@H]2CC23CCC3)c1	ZINC000875261743	EE	On-Demand	Anodyne	DRD4	41	32
COc1cccc(C(C)(C)CNC(=O)C(=O)N[C@@H]2CC23CCC3)c1	ZINC000875261745	EE	On-Demand	Anodyne	DRD4	41	32
COCC(C)(C)CCNC(=O)C(=O)NCC(C)(C)c1cccc(OC)c1	ZINC000875261790	FE	On-Demand	Anodyne	DRD4	44	33
Cc1nc(CNC(=O)C(=O)N[C@H](C)c2ccc(C(F)(F)F)nc2)sc1C	ZINC000875261805	GF	On-Demand	Anodyne	TRPV1	62	31
Cc1nc(CNC(=O)C(=O)N[C@@H](C)c2ccc(C(F)(F)F)nc2)sc1C	ZINC000875261807	GF	On-Demand	Anodyne	TRPV1	62	31
CN(C)S(=O)(=O)c1cccc(COC(=O)C2(c3cccc(Cl)c3)CCC2)c1	ZINC000875261857	HH	On-Demand	Anodyne	SLC12A5	57	41
O=C(COC(=O)C1(c2cccc(Cl)c2)CCC1)N1CCCCC1	ZINC000875261865	EG	On-Demand	Anodyne	DPP7	28	40
COc1ccc([C@@H]2CCCN2C(=O)COC(=O)c2ccccc2NC(=O)c2cccs2)cc1OC	ZINC000875261885	JJ	On-Demand	Anodyne	CPT1A	40	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1ccc(C)cc1C	ZINC000875261932	EF	On-Demand	Anodyne	SLC6A3	49	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1ccc(C)cc1C	ZINC000875261935	EF	On-Demand	Anodyne	SLC6A3	49	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1ccc(C)cc1C	ZINC000875261938	EF	On-Demand	Anodyne	SLC6A3	49	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1ccc(C)cc1C	ZINC000875261941	EF	On-Demand	Anodyne	SLC6A3	49	38
CC[C@H]1CCCCN1C(=O)COC(=O)C1(c2cccc(Cl)c2)CCC1	ZINC000875261969	FI	On-Demand	Anodyne	CPT1A	59	41
CC[C@H]1CCCCN1C(=O)COC(=O)C1(c2cccc(Cl)c2)CCC1	ZINC000875261969	FI	On-Demand	Anodyne	CPT2	36	41
CC[C@@H]1CCCCN1C(=O)COC(=O)C1(c2cccc(Cl)c2)CCC1	ZINC000875261971	FI	On-Demand	Anodyne	CPT1A	59	41
CC[C@@H]1CCCCN1C(=O)COC(=O)C1(c2cccc(Cl)c2)CCC1	ZINC000875261971	FI	On-Demand	Anodyne	CPT2	36	41
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)NCCCCC1CC1)C2	ZINC000875261972	DD	On-Demand	Anodyne	HTR3A	34	44
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)N1CC[C@]3(CCc4ccccc43)C1)C2	ZINC000875261975	GE	On-Demand	Anodyne	OXTR	55	39
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)N1CC[C@]3(CCc4ccccc43)C1)C2	ZINC000875261975	GE	On-Demand	Anodyne	HTR3A	32	40
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)N1CC[C@@]3(CCc4ccccc43)C1)C2	ZINC000875261979	GE	On-Demand	Anodyne	OXTR	55	39
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)N1CC[C@@]3(CCc4ccccc43)C1)C2	ZINC000875261979	GE	On-Demand	Anodyne	HTR3A	32	40
COc1cccc(C(C)(C)CNC(=O)C(=O)NC2CCC(C)(N(C)C)CC2)c1	ZINC000875261997	GE	On-Demand	Anodyne	DRD4	41	32
O=C(NC1(C(=O)N2CCCn3nccc32)CC1)OCc1ccccc1	ZINC000875262006	EE	On-Demand	Anodyne	CTSK	17	44
O=C(NC1(C(=O)N2CCCn3nccc32)CC1)OCc1ccccc1	ZINC000875262006	EE	On-Demand	Anodyne	SLC12A5	67	36
N#CCc1ccsc1C(=O)N(CCN1CCOCC1)c1ccccc1	ZINC000875262007	FF	On-Demand	Mild	CASR	47	40
COc1ccc2c(COC(=O)C3(c4cccc(Cl)c4)CCC3)cc(=O)oc2c1	ZINC000875262008	GJ	On-Demand	Anodyne	MAOB	39	50
O=C(COC(=O)C1(c2cccc(Cl)c2)CCC1)NNC(=O)c1cccc([N+](=O)[O-])c1	ZINC000875262036	IF	On-Demand	Reactive	CACNA1D	55	34
C[C@H](NC(=O)C(=O)NC1C[C@@H]2CCC[C@H](C1)N2C)c1ccnn1C	ZINC000875262046	EC	On-Demand	Anodyne	HTR3A	36	45
COc1ccc(-c2nnc(COC(=O)c3ccccc3NC(=O)c3cccs3)o2)cc1	ZINC000875262050	II	On-Demand	Anodyne	STK33	27	42
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000875262051	JI	On-Demand	Anodyne	EDNRB	19	41
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000875262051	JI	On-Demand	Anodyne	EDNRA	24	42
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000875262051	JI	On-Demand	Anodyne	TACR1	18	46
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000875262051	JI	On-Demand	Anodyne	CCKAR	63	45
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000875262051	JI	On-Demand	Anodyne	CTSL	21	40
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000875262051	JI	On-Demand	Anodyne	BRS3	27	41
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000875262051	JI	On-Demand	Anodyne	NMBR	33	45
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000875262051	JI	On-Demand	Anodyne	GRPR	46	31
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000875262051	JI	On-Demand	Anodyne	ECE1	41	35
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000875262051	JI	On-Demand	Anodyne	MMP11	75	35
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000875262051	JI	On-Demand	Anodyne	KISS1R	49	32
O=C(Nc1ccccc1C(=O)OCc1cccc2cccnc12)c1cccs1	ZINC000875262070	GJ	On-Demand	Anodyne	G2YM83_BOTF4	56	31
CCOC(=O)C1CCN(C(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)CC1	ZINC000875262071	HG	On-Demand	Anodyne	FDFT1	26	43
COC(=O)c1ccc(OCCNC(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875262084	ED	On-Demand	Anodyne	HRH3	24	45
COC(=O)c1ccc(OCCNC(=O)N2CCC(C(C)=O)CC2)cc1	ZINC000875262084	ED	On-Demand	Anodyne	EPHX2	19	41
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC(C)(C)c1cccc(OC)c1	ZINC000875262089	FD	On-Demand	Mild	DRD4	41	32
C#CC[C@H](CCOC)NC(=O)C(=O)NCC(C)(C)c1cccc(OC)c1	ZINC000875262090	FD	On-Demand	Mild	DRD4	41	32
CC[C@@H](NC(C)=O)C(=O)N(CC)c1ccc(S(=O)(=O)C(F)(F)F)cc1	ZINC000875262092	GE	On-Demand	Anodyne	MLYCD	16	42
COc1cccc(C(C)(C)CNC(=O)C(=O)N2CC[C@@H]3[C@H](CCN3C)C2)c1	ZINC000875262141	FD	On-Demand	Anodyne	DRD4	44	34
COc1cccc(C(C)(C)CNC(=O)C(=O)N2CC[C@@H]3[C@@H](CCN3C)C2)c1	ZINC000875262142	FD	On-Demand	Anodyne	DRD4	44	34
COc1cccc(C(C)(C)CNC(=O)C(=O)N2CC[C@H]3[C@H](CCN3C)C2)c1	ZINC000875262143	FD	On-Demand	Anodyne	DRD4	44	34
COc1cccc(C(C)(C)CNC(=O)C(=O)N2CC[C@H]3[C@@H](CCN3C)C2)c1	ZINC000875262144	FD	On-Demand	Anodyne	DRD4	44	34
CC[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)NCc1ccccc1	ZINC000875262190	HI	On-Demand	Anodyne	PDS	45	36
CCCOc1cccc(CCNC(=O)C(=O)NCc2nn(C)cc2C(F)F)c1	ZINC000875262209	GE	On-Demand	Anodyne	PDS	47	34
O=C(COC(=O)c1ccccc1NC(=O)c1cccs1)NCC1(c2ccccc2)CC1	ZINC000875262210	II	On-Demand	Anodyne	KCNA3	47	41
CCCOc1cccc(CCNC(=O)C(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875262217	GC	On-Demand	Anodyne	HRH2	34	43
O=C(COC(=O)C1(c2cccc(Cl)c2)CCC1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000875262226	JF	On-Demand	Anodyne	EPHX2	15	41
O=C(COC(=O)C1(c2cccc(Cl)c2)CCC1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000875262226	JF	On-Demand	Anodyne	TGM2	56	38
O=C(COC(=O)C1(c2cccc(Cl)c2)CCC1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000875262226	JF	On-Demand	Anodyne	F13A1	78	38
O=C(COC(=O)C1(c2cccc(Cl)c2)CCC1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000875262226	JF	On-Demand	Anodyne	NAMPT	24	42
COc1ccc(NC(=O)[C@H](C)OC(=O)c2ccccc2NC(=O)c2cccs2)c(OC)c1	ZINC000875262269	JI	On-Demand	Anodyne	STK33	24	44
COc1cc(C)ccc1C(=O)COC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875262304	HI	On-Demand	Anodyne	KCNK3	44	40
COc1cc(C)ccc1C(=O)COC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875262304	HI	On-Demand	Anodyne	KCNK9	39	40
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(=O)NCc1ncc(Cl)s1)C2	ZINC000875262310	FD	On-Demand	Anodyne	HTR3A	33	41
CCOC(=O)N1CCN(C(=O)[C@H](C)OC(=O)c2ccccc2NC(=O)c2cccs2)CC1	ZINC000875262311	JF	On-Demand	Anodyne	P2RY12	139	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)c2ccccc2NC(=O)c2cccs2)CC1	ZINC000875262312	JF	On-Demand	Anodyne	P2RY12	139	40
Cc1nc(CCNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)sc1C	ZINC000875262340	GE	On-Demand	Anodyne	SIRT3	49	30
Cc1nc(CCNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)sc1C	ZINC000875262340	GE	On-Demand	Anodyne	SIRT2	51	33
Cc1nc(CCNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)sc1C	ZINC000875262340	GE	On-Demand	Anodyne	SIRT1	50	33
O=C(NC[C@H]1CCOc2ccccc21)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875262346	FF	On-Demand	Anodyne	RBP4	40	35
O=C(NC[C@H]1CCOc2ccccc21)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875262348	FF	On-Demand	Anodyne	RBP4	40	35
O=C(NC[C@@H]1CCOc2ccccc21)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875262350	FF	On-Demand	Anodyne	RBP4	40	35
O=C(NC[C@@H]1CCOc2ccccc21)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875262352	FF	On-Demand	Anodyne	RBP4	40	35
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)c1ccc(F)cc1F	ZINC000875262374	HJ	On-Demand	Anodyne	STK33	26	40
Cc1nc(CNC(=O)C(=O)N2CCN(c3ccc(C#N)cc3)CC2)sc1C	ZINC000875262387	GD	On-Demand	Mild	SLC27A1	17	40
COc1cccc(C(C)(C)CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)c1	ZINC000875262390	FD	On-Demand	Anodyne	DRD4	40	31
COc1cccc(C(C)(C)CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)c1	ZINC000875262390	FD	On-Demand	Anodyne	MTNR1A	26	40
COc1cccc(C(C)(C)CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)c1	ZINC000875262390	FD	On-Demand	Anodyne	MTNR1B	31	40
COc1cccc(C(C)(C)CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)c1	ZINC000875262391	FD	On-Demand	Anodyne	DRD4	40	31
COc1cccc(C(C)(C)CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)c1	ZINC000875262391	FD	On-Demand	Anodyne	MTNR1A	26	40
COc1cccc(C(C)(C)CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)c1	ZINC000875262391	FD	On-Demand	Anodyne	MTNR1B	31	40
CCCOc1cccc(CCNC(=O)C(=O)NCc2cnn(CC)n2)c1	ZINC000875262402	FD	On-Demand	Anodyne	PDS	42	33
CCCOc1cccc(CCNC(=O)C(=O)N[C@@H](C)c2ccnn2C)c1	ZINC000875262403	FD	On-Demand	Anodyne	PDS	48	35
CCCOc1cccc(CCNC(=O)C(=O)N[C@H](C)c2ccnn2C)c1	ZINC000875262404	FD	On-Demand	Anodyne	PDS	48	35
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875262417	JI	On-Demand	Anodyne	KCNK3	71	49
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875262417	JI	On-Demand	Anodyne	KCNK9	74	49
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875262418	JI	On-Demand	Anodyne	KCNK3	71	49
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)c2ccccc2NC(=O)c2cccs2)c1	ZINC000875262418	JI	On-Demand	Anodyne	KCNK9	74	49
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)Nc1cc(Cl)ccc1F	ZINC000875262420	IJ	On-Demand	Anodyne	STK33	25	41
Cc1ccc(C[C@@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)c(C)c1	ZINC000875262425	FD	On-Demand	Anodyne	EPHX2	30	44
O=C(OCc1cccc([N+](=O)[O-])c1)C1(c2cccc(Cl)c2)CCC1	ZINC000875262438	EI	On-Demand	Bother	CACNA1C	51	39
O=C(OCc1cccc([N+](=O)[O-])c1)C1(c2cccc(Cl)c2)CCC1	ZINC000875262438	EI	On-Demand	Bother	CACNA1D	83	39
O=C(OCc1cccc([N+](=O)[O-])c1)C1(c2cccc(Cl)c2)CCC1	ZINC000875262438	EI	On-Demand	Bother	SLC12A5	64	37
C[C@H](NC(=O)C(=O)NC1C[C@@H]2CCC[C@H](C1)N2C)c1cc2cnccc2o1	ZINC000875262445	FE	On-Demand	Anodyne	HTR3A	35	42
CCCCCCCNC(=O)C(=O)NCc1sc(C)nc1C	ZINC000875262456	DE	On-Demand	Mild	ASAH1	73	35
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000875262463	JI	On-Demand	Anodyne	DRD4	34	46
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000875262463	JI	On-Demand	Anodyne	ACHE	23	43
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000875262463	JI	On-Demand	Anodyne	SIGMAR1	31	51
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000875262463	JI	On-Demand	Anodyne	SLC6A5	23	41
C[C@H](OC(=O)c1ccccc1NC(=O)c1cccs1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000875262463	JI	On-Demand	Anodyne	MCHR1	30	44
C#CCn1cnc(-c2ccccc2)c1NC(=O)C[C@H](C)NC(=O)OC(C)(C)C	ZINC000875262511	GG	On-Demand	Mild	FPR1	42	34
COC[C@H](NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)C(C)C	ZINC000875262584	ED	On-Demand	Anodyne	OXTR	45	37
COC[C@H](NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)C(C)C	ZINC000875262584	ED	On-Demand	Anodyne	GHRHR	28	43
COC[C@H](NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)C(C)C	ZINC000875262586	ED	On-Demand	Anodyne	OXTR	45	37
COC[C@H](NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)C(C)C	ZINC000875262586	ED	On-Demand	Anodyne	GHRHR	28	43
COC[C@@H](NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)C(C)C	ZINC000875262588	ED	On-Demand	Anodyne	OXTR	45	37
COC[C@@H](NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)C(C)C	ZINC000875262588	ED	On-Demand	Anodyne	GHRHR	28	43
COC[C@@H](NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)C(C)C	ZINC000875262590	ED	On-Demand	Anodyne	OXTR	45	37
COC[C@@H](NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)C(C)C	ZINC000875262590	ED	On-Demand	Anodyne	GHRHR	28	43
CC[C@@](C)(NC(=O)c1cnn(-c2cccc(F)c2)c1C(F)(F)F)C(=O)OC	ZINC000875262620	GG	On-Demand	Anodyne	MST1R	40	40
COC[C@@H](NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1)C(C)C	ZINC000875262651	FD	On-Demand	Anodyne	ROCK1	24	46
COC[C@@H](NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1)C(C)C	ZINC000875262651	FD	On-Demand	Anodyne	ROCK2	17	46
COC[C@H](NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1)C(C)C	ZINC000875262652	FD	On-Demand	Anodyne	ROCK1	24	46
COC[C@H](NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1)C(C)C	ZINC000875262652	FD	On-Demand	Anodyne	ROCK2	17	46
Cc1nnc(NNC(=O)NCCCCN2CCC(Cc3ccccc3)CC2)n1C	ZINC000875262658	GE	On-Demand	Reactive	HTR1A	28	41
Cc1nnc(NNC(=O)NCCCCN2CCC(Cc3ccccc3)CC2)n1C	ZINC000875262658	GE	On-Demand	Reactive	DRD2	39	41
Cc1nnc(NNC(=O)NCCCCN2CCC(Cc3ccccc3)CC2)n1C	ZINC000875262658	GE	On-Demand	Reactive	DRD4	26	42
Cc1nnc(NNC(=O)NCCCCN2CCC(Cc3ccccc3)CC2)n1C	ZINC000875262658	GE	On-Demand	Reactive	ACHE	29	48
Cc1nnc(NNC(=O)NCCCCN2CCC(Cc3ccccc3)CC2)n1C	ZINC000875262658	GE	On-Demand	Reactive	ADRA1D	22	41
Cc1nnc(NNC(=O)NCCCCN2CCC(Cc3ccccc3)CC2)n1C	ZINC000875262658	GE	On-Demand	Reactive	HTR2A	28	51
Cc1nnc(NNC(=O)NCCCCN2CCC(Cc3ccccc3)CC2)n1C	ZINC000875262658	GE	On-Demand	Reactive	ADRA1A	36	41
Cc1nnc(NNC(=O)NCCCCN2CCC(Cc3ccccc3)CC2)n1C	ZINC000875262658	GE	On-Demand	Reactive	ADRA1B	23	41
Cc1nnc(NNC(=O)NCCCCN2CCC(Cc3ccccc3)CC2)n1C	ZINC000875262658	GE	On-Demand	Reactive	DRD3	55	38
Cc1nnc(NNC(=O)NCCCCN2CCC(Cc3ccccc3)CC2)n1C	ZINC000875262658	GE	On-Demand	Reactive	HTR4	42	39
Cc1nnc(NNC(=O)NCCCCN2CCC(Cc3ccccc3)CC2)n1C	ZINC000875262658	GE	On-Demand	Reactive	GRIN2B	71	41
Cc1nnc(NNC(=O)NCCCCN2CCC(Cc3ccccc3)CC2)n1C	ZINC000875262658	GE	On-Demand	Reactive	SIGMAR1	28	46
Cc1nnc(NNC(=O)NCCCCN2CCC(Cc3ccccc3)CC2)n1C	ZINC000875262658	GE	On-Demand	Reactive	NPY1R	18	48
Cc1nnc(NNC(=O)NCCCCN2CCC(Cc3ccccc3)CC2)n1C	ZINC000875262658	GE	On-Demand	Reactive	CCR3	80	58
Cc1nnc(NNC(=O)NCCCCN2CCC(Cc3ccccc3)CC2)n1C	ZINC000875262658	GE	On-Demand	Reactive	CCR5	18	43
CCNS(=O)(=O)CCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875262692	FC	On-Demand	Anodyne	TMPRSS11D	46	33
CCNS(=O)(=O)CCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875262693	FC	On-Demand	Anodyne	TMPRSS11D	46	33
CCNS(=O)(=O)CCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875262694	FC	On-Demand	Anodyne	TMPRSS11D	46	33
CCNS(=O)(=O)CCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875262695	FC	On-Demand	Anodyne	TMPRSS11D	46	33
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](CCCO)c2ccccc2)CC1	ZINC000875262757	ED	On-Demand	Anodyne	CCR5	32	42
CC(=O)C1CCN(C(=O)C(=O)N[C@H](CCCO)c2ccccc2)CC1	ZINC000875262758	ED	On-Demand	Anodyne	CCR5	32	42
Cc1c(NC(=O)[C@@H](NC=O)C(C)C)cccc1C(=O)N1CCCC1	ZINC000875262766	ED	On-Demand	Anodyne	KCNQ2	42	35
CCNS(=O)(=O)CCNC(=O)N1CCOC[C@H]1c1ccc(OC)cc1	ZINC000875262871	FC	On-Demand	Anodyne	MMP13	24	42
CCNS(=O)(=O)CCNC(=O)N1CCOC[C@H]1c1ccc(OC)cc1	ZINC000875262871	FC	On-Demand	Anodyne	MMP3	28	42
CCNS(=O)(=O)CCNC(=O)N1CCOC[C@H]1c1ccc(OC)cc1	ZINC000875262871	FC	On-Demand	Anodyne	MMP1	28	42
CCNS(=O)(=O)CCNC(=O)N1CCOC[C@@H]1c1ccc(OC)cc1	ZINC000875262872	FC	On-Demand	Anodyne	MMP13	24	42
CCNS(=O)(=O)CCNC(=O)N1CCOC[C@@H]1c1ccc(OC)cc1	ZINC000875262872	FC	On-Demand	Anodyne	MMP3	28	42
CCNS(=O)(=O)CCNC(=O)N1CCOC[C@@H]1c1ccc(OC)cc1	ZINC000875262872	FC	On-Demand	Anodyne	MMP1	28	42
Cn1nc(Cl)c(C(=O)Nc2ccccc2N2CCC(C(N)=O)CC2)c1Cl	ZINC000875262877	GF	On-Demand	Anodyne	KCNQ2	73	39
Cn1nc(Cl)c(C(=O)Nc2ccccc2N2CCC(C(N)=O)CC2)c1Cl	ZINC000875262877	GF	On-Demand	Anodyne	EPHB3	45	32
O=CN1CCCN(C(=O)N[C@H]2CCOc3ccc(F)cc32)CC1	ZINC000875262908	DD	On-Demand	Anodyne	CCR3	15	41
O=CN1CCCN(C(=O)N[C@@H]2CCOc3ccc(F)cc32)CC1	ZINC000875262911	DD	On-Demand	Anodyne	CCR3	15	41
O=C(NCCCc1cccc(F)c1)NC[C@H]1C[C@H](O)C1	ZINC000875262926	CD	On-Demand	Anodyne	CCR3	32	40
O=C(NCCCc1cccc(F)c1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875262990	EG	On-Demand	Anodyne	CACNA1G	17	41
O=C(NCCCc1cccc(F)c1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875262991	EG	On-Demand	Anodyne	CACNA1G	17	41
COC[C@H](NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1)C(C)C	ZINC000875263016	GD	On-Demand	Anodyne	ETHR	59	46
COC[C@@H](NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1)C(C)C	ZINC000875263018	GD	On-Demand	Anodyne	ETHR	59	46
O=C(COC(=O)C1(c2ccc(F)cc2)CCC1)NC1CCCCCC1	ZINC000875263058	EH	On-Demand	Anodyne	AVPR1A	31	40
CC[C@H](C[C@H](C)O)NC(=O)NCCCc1cccc(F)c1	ZINC000875263110	CF	On-Demand	Anodyne	MTNR1A	19	42
CC[C@H](C[C@H](C)O)NC(=O)NCCCc1cccc(F)c1	ZINC000875263110	CF	On-Demand	Anodyne	MTNR1B	21	42
O=C(Nc1ccccc1)C1CCN(C(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)CC1	ZINC000875263131	JI	On-Demand	Anodyne	MAPK1	18	44
O=C(Nc1ccccc1)C1CCN(C(=O)COC(=O)C2(c3cccc(Cl)c3)CCC2)CC1	ZINC000875263131	JI	On-Demand	Anodyne	EPHX2	24	41
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1CCOc2ccc(F)cc21	ZINC000875263145	GF	On-Demand	Anodyne	ACKR3	46	33
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1CCOc2ccc(F)cc21	ZINC000875263148	GF	On-Demand	Anodyne	ACKR3	46	33
COc1cccc(C(C)(C)C(=O)Nc2cccc(C(=O)N3CCCC3)c2C)c1	ZINC000875263190	GI	On-Demand	Anodyne	NPY2R	26	43
C[C@H](NC(=O)COC(=O)C1(c2ccc(F)cc2)CCC1)c1ccc(Cl)cc1	ZINC000875263219	GI	On-Demand	Anodyne	AVPR1A	32	41
C[C@@H](NC(=O)COC(=O)C1(c2ccc(F)cc2)CCC1)c1ccc(Cl)cc1	ZINC000875263221	GI	On-Demand	Anodyne	AVPR1A	32	41
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](C)CN1CCN(c2ccccc2)CC1	ZINC000875263244	GC	On-Demand	Mild	HTR1A	23	41
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](C)CN1CCN(c2ccccc2)CC1	ZINC000875263244	GC	On-Demand	Mild	DRD2	15	41
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)CN1CCN(c2ccccc2)CC1	ZINC000875263246	GC	On-Demand	Mild	HTR1A	23	41
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)CN1CCN(c2ccccc2)CC1	ZINC000875263246	GC	On-Demand	Mild	DRD2	15	41
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](C)CN1CCN(c2ccccc2)CC1	ZINC000875263248	GC	On-Demand	Mild	HTR1A	23	41
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](C)CN1CCN(c2ccccc2)CC1	ZINC000875263248	GC	On-Demand	Mild	DRD2	15	41
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)CN1CCN(c2ccccc2)CC1	ZINC000875263249	GC	On-Demand	Mild	HTR1A	23	41
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)CN1CCN(c2ccccc2)CC1	ZINC000875263249	GC	On-Demand	Mild	DRD2	15	41
N#CCc1ccsc1C(=O)Nc1ccccc1N1CCC(C(N)=O)CC1	ZINC000875263266	FF	On-Demand	Mild	KCNQ2	72	41
CC(=O)N1CCC[C@@H]1C(=O)Oc1ccccc1Oc1ccccn1	ZINC000875263281	EF	On-Demand	Anodyne	FKBP1A	45	42
CC(=O)N1CCC[C@@H]1C(=O)Oc1ccccc1Oc1ccccn1	ZINC000875263281	EF	On-Demand	Anodyne	PREP	55	38
O=C(Nc1cccc(C(F)(F)F)n1)[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000875263330	FG	On-Demand	Anodyne	EPHX2	27	48
O=C(Nc1cccc(C(F)(F)F)n1)[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000875263330	FG	On-Demand	Anodyne	SFRP1	119	43
O=C(Nc1cccc(C(F)(F)F)n1)[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000875263330	FG	On-Demand	Anodyne	WNT3	78	36
O=C(Nc1cccc(C(F)(F)F)n1)[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000875263330	FG	On-Demand	Anodyne	L3MBTL3	46	34
O=C(Nc1cccc(C(F)(F)F)n1)[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000875263330	FG	On-Demand	Anodyne	MAP3K12	30	40
O=C(Nc1cccc(C(F)(F)F)n1)[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000875263331	FG	On-Demand	Anodyne	EPHX2	27	48
O=C(Nc1cccc(C(F)(F)F)n1)[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000875263331	FG	On-Demand	Anodyne	SFRP1	119	43
O=C(Nc1cccc(C(F)(F)F)n1)[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000875263331	FG	On-Demand	Anodyne	WNT3	78	36
O=C(Nc1cccc(C(F)(F)F)n1)[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000875263331	FG	On-Demand	Anodyne	L3MBTL3	46	34
O=C(Nc1cccc(C(F)(F)F)n1)[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000875263331	FG	On-Demand	Anodyne	MAP3K12	30	40
O=C(NCCCCN1CCC(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875263332	FF	On-Demand	Anodyne	HTR1A	25	41
O=C(NCCCCN1CCC(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875263332	FF	On-Demand	Anodyne	DRD2	37	42
O=C(NCCCCN1CCC(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875263332	FF	On-Demand	Anodyne	DRD4	28	42
O=C(NCCCCN1CCC(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875263332	FF	On-Demand	Anodyne	ACHE	32	49
O=C(NCCCCN1CCC(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875263332	FF	On-Demand	Anodyne	HTR2A	24	54
O=C(NCCCCN1CCC(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875263332	FF	On-Demand	Anodyne	ADRA1A	16	41
O=C(NCCCCN1CCC(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875263332	FF	On-Demand	Anodyne	DRD3	56	41
O=C(NCCCCN1CCC(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875263332	FF	On-Demand	Anodyne	HTR4	51	41
O=C(NCCCCN1CCC(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875263332	FF	On-Demand	Anodyne	GRIN2B	74	44
O=C(NCCCCN1CCC(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875263332	FF	On-Demand	Anodyne	SIGMAR1	48	53
O=C(NCCCCN1CCC(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875263332	FF	On-Demand	Anodyne	CCR3	79	65
O=C(NCCCCN1CCC(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875263332	FF	On-Demand	Anodyne	EPHX2	16	46
O=C(NCCCCN1CCC(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875263332	FF	On-Demand	Anodyne	GRIN2C	24	40
O=C(NCCCCN1CCC(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875263332	FF	On-Demand	Anodyne	AMP1_PLAFQ	17	40
O=C(NCCCCN1CCC(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875263332	FF	On-Demand	Anodyne	CACNA1I	45	39
O=C(NCCCCN1CCC(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875263332	FF	On-Demand	Anodyne	CYP2J2	45	32
COC(=O)[C@H](NC(=O)c1c(C(F)(F)F)coc1C)c1ccccc1	ZINC000875263343	EG	On-Demand	Anodyne	TACR3	21	46
COC(=O)[C@H](NC(=O)c1c(C(F)(F)F)coc1C)c1ccccc1	ZINC000875263343	EG	On-Demand	Anodyne	MTTP	42	33
O=C(OCc1ccccc1[N+](=O)[O-])C1(c2ccc(F)cc2)CCC1	ZINC000875263358	EH	On-Demand	Bother	COLA	63	39
O=C(OCc1ccccc1[N+](=O)[O-])C1(c2ccc(F)cc2)CCC1	ZINC000875263358	EH	On-Demand	Bother	SLC12A5	42	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](CCCO)c2ccccc2)C1	ZINC000875263420	ED	On-Demand	Anodyne	CCR5	29	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](CCCO)c2ccccc2)C1	ZINC000875263421	ED	On-Demand	Anodyne	CCR5	29	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](CCCO)c2ccccc2)C1	ZINC000875263422	ED	On-Demand	Anodyne	CCR5	29	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](CCCO)c2ccccc2)C1	ZINC000875263423	ED	On-Demand	Anodyne	CCR5	29	40
Cn1ncc2c(N3CCN(C(=O)COC(=O)C4(c5cccc(Cl)c5)CCC4)CC3)ncnc21	ZINC000875263429	JE	On-Demand	Anodyne	AKT2	40	39
Cn1ncc2c(N3CCN(C(=O)COC(=O)C4(c5cccc(Cl)c5)CCC4)CC3)ncnc21	ZINC000875263429	JE	On-Demand	Anodyne	AKT3	44	34
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NC[C@H](C)CC1(C)OCCO1	ZINC000875263430	GE	On-Demand	Anodyne	CAPN2	50	34
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NC[C@@H](C)CC1(C)OCCO1	ZINC000875263431	GE	On-Demand	Anodyne	CAPN2	50	34
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NC[C@H](C)CC1(C)OCCO1	ZINC000875263432	GE	On-Demand	Anodyne	CAPN2	50	34
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NC[C@@H](C)CC1(C)OCCO1	ZINC000875263433	GE	On-Demand	Anodyne	CAPN2	50	34
O=C(N[C@H](CCCO)c1ccccc1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875263434	GF	On-Demand	Anodyne	GHRHR	54	45
O=C(N[C@@H](CCCO)c1ccccc1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875263435	GF	On-Demand	Anodyne	GHRHR	54	45
O=C(N[C@@H](CCCO)c1ccccc1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875263436	GF	On-Demand	Anodyne	GHRHR	54	45
O=C(N[C@H](CCCO)c1ccccc1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875263437	GF	On-Demand	Anodyne	GHRHR	54	45
O=C(OCc1ccc(F)c(F)c1)C1(c2ccc(F)cc2)CCC1	ZINC000875263454	DI	On-Demand	Anodyne	SLC12A5	62	42
Cc1c(NC(=O)C2(c3ccnc4ccccc34)CC2)cccc1C(=O)N1CCCC1	ZINC000875263467	GI	On-Demand	Anodyne	HNMT	45	33
CCNS(=O)(=O)CCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875263473	GD	On-Demand	Anodyne	DRD2	15	43
CCNS(=O)(=O)CCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875263475	GD	On-Demand	Anodyne	DRD2	15	43
O=C(NCCS(=O)(=O)NCC1CCC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875263547	GD	On-Demand	Anodyne	EPHX2	16	42
O=C(NCCS(=O)(=O)NCC1CCC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875263548	GD	On-Demand	Anodyne	EPHX2	16	42
COCCN(CC1CCN(C)CC1)C(=O)NCCCc1cccc(F)c1	ZINC000875263555	FF	On-Demand	Anodyne	CCR3	41	38
COCCN(CC1CCN(C)CC1)C(=O)NCCCc1cccc(F)c1	ZINC000875263555	FF	On-Demand	Anodyne	ACKR3	58	34
COC(=O)N(C)NC(=O)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000875263560	GF	On-Demand	Reactive	HTR1A	43	47
COC(=O)N(C)NC(=O)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000875263560	GF	On-Demand	Reactive	DRD2	56	44
COC(=O)N(C)NC(=O)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000875263560	GF	On-Demand	Reactive	DRD4	44	46
COC(=O)N(C)NC(=O)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000875263560	GF	On-Demand	Reactive	ACHE	44	52
COC(=O)N(C)NC(=O)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000875263560	GF	On-Demand	Reactive	ADRA1D	41	42
COC(=O)N(C)NC(=O)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000875263560	GF	On-Demand	Reactive	HTR2A	37	60
COC(=O)N(C)NC(=O)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000875263560	GF	On-Demand	Reactive	ADRA1A	60	42
COC(=O)N(C)NC(=O)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000875263560	GF	On-Demand	Reactive	HRH1	19	49
COC(=O)N(C)NC(=O)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000875263560	GF	On-Demand	Reactive	ADRA1B	38	42
COC(=O)N(C)NC(=O)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000875263560	GF	On-Demand	Reactive	DRD3	78	44
COC(=O)N(C)NC(=O)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000875263560	GF	On-Demand	Reactive	HTR4	72	40
COC(=O)N(C)NC(=O)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000875263560	GF	On-Demand	Reactive	GRIN2B	71	44
COC(=O)N(C)NC(=O)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000875263560	GF	On-Demand	Reactive	TACR2	23	41
COC(=O)N(C)NC(=O)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000875263560	GF	On-Demand	Reactive	SIGMAR1	61	51
COC(=O)N(C)NC(=O)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000875263560	GF	On-Demand	Reactive	NPY1R	15	47
COC(=O)N(C)NC(=O)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000875263560	GF	On-Demand	Reactive	BCHE	22	52
COC(=O)N(C)NC(=O)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000875263560	GF	On-Demand	Reactive	CCR3	88	63
COC(=O)N(C)NC(=O)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000875263560	GF	On-Demand	Reactive	SCN2A	15	60
COC(=O)N(C)NC(=O)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000875263560	GF	On-Demand	Reactive	CCR5	40	47
COC(=O)N(C)NC(=O)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000875263560	GF	On-Demand	Reactive	CYP2J2	46	33
O=C(COC(=O)C1(c2ccc(F)cc2)CCC1)N1CCN(S(=O)(=O)c2c(F)cccc2F)CC1	ZINC000875263574	JF	On-Demand	Anodyne	PKM	22	45
CC[C@@](C)(NC(=O)NC1CCN(CCS(C)(=O)=O)CC1)c1ccc(F)cc1	ZINC000875263581	GE	On-Demand	Anodyne	CCR3	33	43
CC[C@@](C)(NC(=O)NC1CCN(CCS(C)(=O)=O)CC1)c1ccc(F)cc1	ZINC000875263581	GE	On-Demand	Anodyne	EPHX2	35	41
CC[C@@](C)(NC(=O)NC1CCN(CCS(C)(=O)=O)CC1)c1ccc(F)cc1	ZINC000875263581	GE	On-Demand	Anodyne	CACNA1G	35	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2ccccc2)C1=O	ZINC000875263603	FD	On-Demand	Anodyne	SLC6A4	21	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2ccccc2)C1=O	ZINC000875263603	FD	On-Demand	Anodyne	SLC6A3	41	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2ccccc2)C1=O	ZINC000875263604	FD	On-Demand	Anodyne	SLC6A4	21	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2ccccc2)C1=O	ZINC000875263604	FD	On-Demand	Anodyne	SLC6A3	41	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2ccccc2)C1=O	ZINC000875263605	FD	On-Demand	Anodyne	SLC6A4	21	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2ccccc2)C1=O	ZINC000875263605	FD	On-Demand	Anodyne	SLC6A3	41	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2ccccc2)C1=O	ZINC000875263606	FD	On-Demand	Anodyne	SLC6A4	21	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2ccccc2)C1=O	ZINC000875263606	FD	On-Demand	Anodyne	SLC6A3	41	42
CC(=O)N[C@H](CC(C)C)C(=O)Nc1cccc(C(F)(F)F)n1	ZINC000875263632	DF	On-Demand	Anodyne	ANPEP	29	44
CC(=O)N[C@H](CC(C)C)C(=O)Nc1cccc(C(F)(F)F)n1	ZINC000875263632	DF	On-Demand	Anodyne	CTSK	41	35
CC(=O)N[C@H](CC(C)C)C(=O)Nc1cccc(C(F)(F)F)n1	ZINC000875263632	DF	On-Demand	Anodyne	CAPNS1	50	30
CC(=O)N[C@H](CC(C)C)C(=O)Nc1cccc(C(F)(F)F)n1	ZINC000875263632	DF	On-Demand	Anodyne	CAPN1	58	40
CC(=O)N[C@H](CC(C)C)C(=O)Nc1cccc(C(F)(F)F)n1	ZINC000875263632	DF	On-Demand	Anodyne	CAPN2	60	34
CC(=O)N[C@H](CC(C)C)C(=O)Nc1cccc(C(F)(F)F)n1	ZINC000875263632	DF	On-Demand	Anodyne	HPN	53	33
CC[C@@H](C)[C@@H](NC(=O)COC(=O)C1(c2ccc(F)cc2)CCC1)C(=O)OC	ZINC000875263670	GE	On-Demand	Anodyne	CACNA1H	22	44
CC[C@@H](C)[C@H](NC(=O)COC(=O)C1(c2ccc(F)cc2)CCC1)C(=O)OC	ZINC000875263671	GE	On-Demand	Anodyne	CACNA1H	22	44
O=C(OCc1cccc([N+](=O)[O-])c1)C1(c2ccc(F)cc2)CCC1	ZINC000875263704	EH	On-Demand	Bother	CACNA1C	63	50
O=C(OCc1cccc([N+](=O)[O-])c1)C1(c2ccc(F)cc2)CCC1	ZINC000875263704	EH	On-Demand	Bother	CACNA1D	97	50
O=C(OCc1cccc([N+](=O)[O-])c1)C1(c2ccc(F)cc2)CCC1	ZINC000875263704	EH	On-Demand	Bother	SLC12A5	66	42
O=C(COC(=O)C1(c2ccc(F)cc2)CCC1)c1ccc([N+](=O)[O-])cc1	ZINC000875263749	FH	On-Demand	Bother	SLC27A4	49	33
O=C(NCCS(=O)(=O)NCC1CCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875263795	GD	On-Demand	Anodyne	PRSS1	18	41
O=C(NCCS(=O)(=O)NCC1CCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875263795	GD	On-Demand	Anodyne	TMPRSS11D	41	33
O=C(NCCS(=O)(=O)NCC1CCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875263796	GD	On-Demand	Anodyne	PRSS1	18	41
O=C(NCCS(=O)(=O)NCC1CCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875263796	GD	On-Demand	Anodyne	TMPRSS11D	41	33
O=C(NCCS(=O)(=O)NCC1CCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875263797	GD	On-Demand	Anodyne	PRSS1	18	41
O=C(NCCS(=O)(=O)NCC1CCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875263797	GD	On-Demand	Anodyne	TMPRSS11D	41	33
O=C(NCCS(=O)(=O)NCC1CCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875263798	GD	On-Demand	Anodyne	PRSS1	18	41
O=C(NCCS(=O)(=O)NCC1CCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875263798	GD	On-Demand	Anodyne	TMPRSS11D	41	33
C[C@H](NC(=O)/C=C\c1nc2ccccc2s1)c1ccc2ccccc2c1	ZINC000875263817	FK	On-Demand	Anodyne	KCNQ2	57	41
C[C@H](NC(=O)/C=C\c1nc2ccccc2s1)c1ccc2ccccc2c1	ZINC000875263817	FK	On-Demand	Anodyne	UL26	88	35
C[C@H](NC(=O)/C=C\c1nc2ccccc2s1)c1ccc2ccccc2c1	ZINC000875263817	FK	On-Demand	Anodyne	SCAF_EBVB9	71	35
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCc1cccc(F)c1	ZINC000875263844	EE	On-Demand	Anodyne	SLC6A4	24	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCc1cccc(F)c1	ZINC000875263844	EE	On-Demand	Anodyne	SLC6A3	48	45
O=C(Nc1cccc(C(F)(F)F)n1)c1ccnc(N2CCOCC2)n1	ZINC000875263851	FD	On-Demand	Anodyne	PIK3CA	26	42
O=C(COC(=O)C1(c2ccc(F)cc2)CCC1)c1cnc(N2CCCCC2)s1	ZINC000875263894	HI	On-Demand	Anodyne	MLYCD	39	45
CCOC(=O)C1=C(COC(=O)C2(c3ccc(F)cc3)CCC2)NC(=O)N[C@H]1c1ccco1	ZINC000875263905	IG	On-Demand	Anodyne	SLC27A4	41	29
CCOC(=O)C1=C(COC(=O)C2(c3ccc(F)cc3)CCC2)NC(=O)N[C@@H]1c1ccco1	ZINC000875263906	IG	On-Demand	Anodyne	SLC27A4	41	29
COC(=O)c1ccc(CC(=O)OCC(=O)N2CCCc3ccccc32)cn1	ZINC000875263918	FD	On-Demand	Anodyne	AVPR2	41	43
O=C(N[C@@H]1CCN(c2ccccc2)C1=O)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875263950	GD	On-Demand	Anodyne	RBP4	41	35
O=C(N[C@H]1CCN(c2ccccc2)C1=O)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875263951	GD	On-Demand	Anodyne	RBP4	41	35
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(c2ccccc2)C1=O	ZINC000875263962	DD	On-Demand	Anodyne	XIAP	50	37
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(c2ccccc2)C1=O	ZINC000875263963	DD	On-Demand	Anodyne	XIAP	50	37
COC(=O)c1cccc(NC(=O)COC(=O)C2(c3ccc(F)cc3)CCC2)c1	ZINC000875264078	GG	On-Demand	Anodyne	HIF1A	19	50
C[C@H](NC(=O)/C=C\c1ccc2ccccc2n1)c1ccc2ccccc2c1	ZINC000875264080	FK	On-Demand	Anodyne	KCNQ2	59	43
C[C@H](NC(=O)/C=C\c1ccc2ccccc2n1)c1ccc2ccccc2c1	ZINC000875264080	FK	On-Demand	Anodyne	UL26	64	36
C[C@H](NC(=O)/C=C\c1ccc2ccccc2n1)c1ccc2ccccc2c1	ZINC000875264080	FK	On-Demand	Anodyne	SCAF_EBVB9	54	33
O=C(Nc1cccc(C(F)(F)F)n1)c1ccc(C(=O)N2CCOCC2)cc1	ZINC000875264136	GF	On-Demand	Anodyne	EPHX2	20	55
O=C(Nc1cccc(C(F)(F)F)n1)c1ccc(C(=O)N2CCOCC2)cc1	ZINC000875264136	GF	On-Demand	Anodyne	MAP3K5	45	35
O=C(Nc1cccc(C(F)(F)F)n1)c1ccc(C(=O)N2CCOCC2)cc1	ZINC000875264136	GF	On-Demand	Anodyne	BTK	49	47
O=C(Nc1cccc(C(F)(F)F)n1)c1ccc(C(=O)N2CCOCC2)cc1	ZINC000875264136	GF	On-Demand	Anodyne	MLYCD	20	51
O=C(NCCO)C1CCN(C(=O)NCCCc2cccc(F)c2)CC1	ZINC000875264137	FD	On-Demand	Anodyne	MTNR1A	15	43
O=C(NCCO)C1CCN(C(=O)NCCCc2cccc(F)c2)CC1	ZINC000875264137	FD	On-Demand	Anodyne	MTNR1B	15	43
O=C(NCCO)C1CCN(C(=O)NCCCc2cccc(F)c2)CC1	ZINC000875264137	FD	On-Demand	Anodyne	CACNA1G	38	49
COC(=O)c1cccc(COC(=O)C2(c3ccc(F)cc3)CCC2)c1	ZINC000875264138	EH	On-Demand	Anodyne	SLC12A5	66	42
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1cccc(C(F)(F)F)n1	ZINC000875264160	EH	On-Demand	Anodyne	NQO2	21	40
O=C(COC(=O)C1(c2ccc(F)cc2)CCC1)c1cccc([N+](=O)[O-])c1	ZINC000875264172	FH	On-Demand	Bother	CACNA1C	53	36
O=C(COC(=O)C1(c2ccc(F)cc2)CCC1)c1cccc([N+](=O)[O-])c1	ZINC000875264172	FH	On-Demand	Bother	CACNA1D	81	36
O=C(COC(=O)C1(c2ccc(F)cc2)CCC1)N1CCC(c2nc3ccccc3s2)CC1	ZINC000875264188	JJ	On-Demand	Anodyne	ETHR	40	36
O=C(Nc1cccc(C(F)(F)F)n1)[C@@H]1C[C@H]1c1ccsc1	ZINC000875264193	DH	On-Demand	Anodyne	NPBWR1	69	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(c3ccccc3)C2=O)C1	ZINC000875264205	FD	On-Demand	Anodyne	ACE	49	46
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(c3ccccc3)C2=O)C1	ZINC000875264205	FD	On-Demand	Anodyne	P2RY12	46	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(c3ccccc3)C2=O)C1	ZINC000875264205	FD	On-Demand	Anodyne	BIRC2	43	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(c3ccccc3)C2=O)C1	ZINC000875264206	FD	On-Demand	Anodyne	ACE	49	46
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(c3ccccc3)C2=O)C1	ZINC000875264206	FD	On-Demand	Anodyne	P2RY12	46	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(c3ccccc3)C2=O)C1	ZINC000875264206	FD	On-Demand	Anodyne	BIRC2	43	35
O=C(N[C@H]1CCN(c2ccccc2)C1=O)N1CCC2(CCNC2=O)CC1	ZINC000875264213	FD	On-Demand	Anodyne	CALCRL	15	51
O=C(N[C@@H]1CCN(c2ccccc2)C1=O)N1CCC2(CCNC2=O)CC1	ZINC000875264214	FD	On-Demand	Anodyne	CALCRL	15	51
CC[C@@H](NC(=O)NC1CCN(CCS(C)(=O)=O)CC1)[C@@H](O)c1ccccc1	ZINC000875264231	GD	On-Demand	Anodyne	CCR5	51	47
CC[C@@H](NC(=O)NC1CCN(CCS(C)(=O)=O)CC1)[C@H](O)c1ccccc1	ZINC000875264233	GD	On-Demand	Anodyne	CCR5	51	47
O=C(N[C@H]1CCN(c2ccccc2)C1=O)N1CCC(CO)(CO)CC1	ZINC000875264246	EC	On-Demand	Anodyne	EPHX2	19	40
O=C(N[C@@H]1CCN(c2ccccc2)C1=O)N1CCC(CO)(CO)CC1	ZINC000875264248	EC	On-Demand	Anodyne	EPHX2	19	40
CN(C)C[C@@H]1CN(C(=O)NCCOc2ccc([N+](=O)[O-])cc2)C[C@H]1CN(C)C	ZINC000875264268	GD	On-Demand	Bother	SLC27A4	43	32
CCNS(=O)(=O)CCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875264305	FD	On-Demand	Anodyne	FKBP1A	21	40
CCNS(=O)(=O)CCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875264307	FD	On-Demand	Anodyne	FKBP1A	21	40
CCNS(=O)(=O)CCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875264309	FD	On-Demand	Anodyne	FKBP1A	21	40
CCNS(=O)(=O)CCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875264311	FD	On-Demand	Anodyne	FKBP1A	21	40
C#CCn1cnc(-c2ccccc2)c1NC(=O)[C@H]1CCCN1C(C)=O	ZINC000875264318	EE	On-Demand	Mild	F2	42	36
C#CCn1cnc(-c2ccccc2)c1NC(=O)[C@H]1CCCN1C(C)=O	ZINC000875264318	EE	On-Demand	Mild	TRY1_BOVIN	64	36
C#CCn1cnc(-c2ccccc2)c1NC(=O)[C@H]1CCCN1C(C)=O	ZINC000875264318	EE	On-Demand	Mild	PREP	67	34
C#CCn1cnc(-c2ccccc2)c1NC(=O)[C@H]1CCCN1C(C)=O	ZINC000875264318	EE	On-Demand	Mild	LGMN	74	35
C#CCn1cnc(-c2ccccc2)c1NC(=O)[C@H]1CCCN1C(C)=O	ZINC000875264318	EE	On-Demand	Mild	XIAP	42	40
C[C@H](C(=O)Nc1cccc(C(F)(F)F)n1)n1ccc(C(F)(F)F)n1	ZINC000875264322	FH	On-Demand	Anodyne	CARM1	57	35
C[C@H](NC(=O)/C=C/c1ccc(O)cc1)c1ccc2ccccc2c1	ZINC000875264344	DI	On-Demand	Anodyne	KCNQ2	58	45
C[C@H](NC(=O)/C=C/c1ccc(O)cc1)c1ccc2ccccc2c1	ZINC000875264344	DI	On-Demand	Anodyne	HDAC8	41	38
C[C@H](NC(=O)/C=C/c1ccc(O)cc1)c1ccc2ccccc2c1	ZINC000875264344	DI	On-Demand	Anodyne	F3	24	40
C[C@H](NC(=O)/C=C/c1ccc(O)cc1)c1ccc2ccccc2c1	ZINC000875264344	DI	On-Demand	Anodyne	MMP2	16	47
C[C@H](NC(=O)/C=C/c1ccc(O)cc1)c1ccc2ccccc2c1	ZINC000875264344	DI	On-Demand	Anodyne	HDAC6	22	43
C[C@H](NC(=O)/C=C/c1ccc(O)cc1)c1ccc2ccccc2c1	ZINC000875264344	DI	On-Demand	Anodyne	MMP9	16	47
C[C@H](NC(=O)/C=C/c1ccc(O)cc1)c1ccc2ccccc2c1	ZINC000875264344	DI	On-Demand	Anodyne	UL26	49	38
C[C@H](NC(=O)/C=C\c1ccc(O)cc1)c1ccc2ccccc2c1	ZINC000875264345	DI	On-Demand	Anodyne	KCNQ2	58	45
C[C@H](NC(=O)/C=C\c1ccc(O)cc1)c1ccc2ccccc2c1	ZINC000875264345	DI	On-Demand	Anodyne	HDAC8	41	38
C[C@H](NC(=O)/C=C\c1ccc(O)cc1)c1ccc2ccccc2c1	ZINC000875264345	DI	On-Demand	Anodyne	F3	24	40
C[C@H](NC(=O)/C=C\c1ccc(O)cc1)c1ccc2ccccc2c1	ZINC000875264345	DI	On-Demand	Anodyne	MMP2	16	47
C[C@H](NC(=O)/C=C\c1ccc(O)cc1)c1ccc2ccccc2c1	ZINC000875264345	DI	On-Demand	Anodyne	HDAC6	22	43
C[C@H](NC(=O)/C=C\c1ccc(O)cc1)c1ccc2ccccc2c1	ZINC000875264345	DI	On-Demand	Anodyne	MMP9	16	47
C[C@H](NC(=O)/C=C\c1ccc(O)cc1)c1ccc2ccccc2c1	ZINC000875264345	DI	On-Demand	Anodyne	UL26	49	38
C#CCn1cnc(-c2ccccc2)c1NC(=O)c1ccc(C2CCOCC2)cc1	ZINC000875264419	GI	On-Demand	Mild	DGAT1	23	40
COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)[C@@H](NC=O)C(C)C	ZINC000875264447	GE	On-Demand	Anodyne	HPGD	38	42
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264459	GF	On-Demand	Anodyne	ACE	54	49
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264459	GF	On-Demand	Anodyne	GHRHR	42	34
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264459	GF	On-Demand	Anodyne	P2RY12	112	36
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264459	GF	On-Demand	Anodyne	MME	84	49
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264459	GF	On-Demand	Anodyne	UGCG	49	47
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264459	GF	On-Demand	Anodyne	MC4R	120	44
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264459	GF	On-Demand	Anodyne	CTRA_BOVIN	40	32
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264459	GF	On-Demand	Anodyne	CTSB	22	41
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264459	GF	On-Demand	Anodyne	TRY2_BOVIN	83	37
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264459	GF	On-Demand	Anodyne	TRY1_BOVIN	40	37
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264459	GF	On-Demand	Anodyne	CTSL	30	40
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264459	GF	On-Demand	Anodyne	CACNA1B	25	41
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264459	GF	On-Demand	Anodyne	CYP51A1	22	41
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264459	GF	On-Demand	Anodyne	ITGA4	26	44
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264459	GF	On-Demand	Anodyne	PREP	28	57
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264459	GF	On-Demand	Anodyne	MC3R	43	40
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264459	GF	On-Demand	Anodyne	MC5R	65	38
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264459	GF	On-Demand	Anodyne	CCKBR	27	43
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264459	GF	On-Demand	Anodyne	CTSS	16	40
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264459	GF	On-Demand	Anodyne	CAPN1	41	48
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264459	GF	On-Demand	Anodyne	ACE2	71	38
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264459	GF	On-Demand	Anodyne	DPP7	53	42
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264459	GF	On-Demand	Anodyne	CTSV	50	38
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264459	GF	On-Demand	Anodyne	BLA1_STEMA	45	35
Cn1nc(Cl)c(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264460	GF	On-Demand	Anodyne	ACE	54	49
Cn1nc(Cl)c(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264460	GF	On-Demand	Anodyne	GHRHR	42	34
Cn1nc(Cl)c(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264460	GF	On-Demand	Anodyne	P2RY12	112	36
Cn1nc(Cl)c(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264460	GF	On-Demand	Anodyne	MME	84	49
Cn1nc(Cl)c(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264460	GF	On-Demand	Anodyne	UGCG	49	47
Cn1nc(Cl)c(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264460	GF	On-Demand	Anodyne	MC4R	120	44
Cn1nc(Cl)c(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264460	GF	On-Demand	Anodyne	CTRA_BOVIN	40	32
Cn1nc(Cl)c(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264460	GF	On-Demand	Anodyne	CTSB	22	41
Cn1nc(Cl)c(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264460	GF	On-Demand	Anodyne	TRY2_BOVIN	83	37
Cn1nc(Cl)c(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264460	GF	On-Demand	Anodyne	TRY1_BOVIN	40	37
Cn1nc(Cl)c(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264460	GF	On-Demand	Anodyne	CTSL	30	40
Cn1nc(Cl)c(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264460	GF	On-Demand	Anodyne	CACNA1B	25	41
Cn1nc(Cl)c(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264460	GF	On-Demand	Anodyne	CYP51A1	22	41
Cn1nc(Cl)c(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264460	GF	On-Demand	Anodyne	ITGA4	26	44
Cn1nc(Cl)c(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264460	GF	On-Demand	Anodyne	PREP	28	57
Cn1nc(Cl)c(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264460	GF	On-Demand	Anodyne	MC3R	43	40
Cn1nc(Cl)c(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264460	GF	On-Demand	Anodyne	MC5R	65	38
Cn1nc(Cl)c(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264460	GF	On-Demand	Anodyne	CCKBR	27	43
Cn1nc(Cl)c(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264460	GF	On-Demand	Anodyne	CTSS	16	40
Cn1nc(Cl)c(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264460	GF	On-Demand	Anodyne	CAPN1	41	48
Cn1nc(Cl)c(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264460	GF	On-Demand	Anodyne	ACE2	71	38
Cn1nc(Cl)c(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264460	GF	On-Demand	Anodyne	DPP7	53	42
Cn1nc(Cl)c(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264460	GF	On-Demand	Anodyne	CTSV	50	38
Cn1nc(Cl)c(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)c1Cl	ZINC000875264460	GF	On-Demand	Anodyne	BLA1_STEMA	45	35
CC(C)c1ccccc1NC(=O)COC(=O)C1(c2cccc(F)c2)CCC1	ZINC000875264512	FJ	On-Demand	Anodyne	SOAT1	22	41
O=C(COC(=O)C1(c2ccc(F)cc2)CCC1)NCCc1ccc(Cl)cc1	ZINC000875264532	GH	On-Demand	Anodyne	AVPR1A	31	40
O=C(Nc1cccc(C(F)(F)F)n1)c1cnn(C2CC2)c1	ZINC000875264537	CF	On-Demand	Anodyne	MAP3K5	44	32
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCCCOC(C)C)CC2	ZINC000875264613	GE	On-Demand	Anodyne	SLC18A2	52	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCCCOC(C)C)CC2	ZINC000875264615	GE	On-Demand	Anodyne	SLC18A2	52	36
COC[C@H](NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)C(C)C	ZINC000875264626	ED	On-Demand	Anodyne	ACE	35	41
COC[C@H](NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)C(C)C	ZINC000875264626	ED	On-Demand	Anodyne	XIAP	42	37
COC[C@H](NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)C(C)C	ZINC000875264626	ED	On-Demand	Anodyne	BRCA1	59	31
COC[C@H](NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)C(C)C	ZINC000875264627	ED	On-Demand	Anodyne	ACE	35	41
COC[C@H](NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)C(C)C	ZINC000875264627	ED	On-Demand	Anodyne	XIAP	42	37
COC[C@H](NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)C(C)C	ZINC000875264627	ED	On-Demand	Anodyne	BRCA1	59	31
COC[C@H](NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)C(C)C	ZINC000875264628	ED	On-Demand	Anodyne	ACE	35	41
COC[C@H](NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)C(C)C	ZINC000875264628	ED	On-Demand	Anodyne	XIAP	42	37
COC[C@H](NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)C(C)C	ZINC000875264628	ED	On-Demand	Anodyne	BRCA1	59	31
COC[C@H](NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)C(C)C	ZINC000875264629	ED	On-Demand	Anodyne	ACE	35	41
COC[C@H](NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)C(C)C	ZINC000875264629	ED	On-Demand	Anodyne	XIAP	42	37
COC[C@H](NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)C(C)C	ZINC000875264629	ED	On-Demand	Anodyne	BRCA1	59	31
COC(=O)N(C)NC(=O)NCCCc1cccc(F)c1	ZINC000875264691	CD	On-Demand	Reactive	MTNR1A	36	46
COC(=O)N(C)NC(=O)NCCCc1cccc(F)c1	ZINC000875264691	CD	On-Demand	Reactive	MTNR1B	32	46
COC(=O)N(C)NC(=O)NCCCc1cccc(F)c1	ZINC000875264691	CD	On-Demand	Reactive	CRTM	54	39
O=C(N[C@H]1CCN(c2ccccc2)C1=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875264750	FF	On-Demand	Anodyne	EPHX2	21	42
O=C(N[C@H]1CCN(c2ccccc2)C1=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875264751	FF	On-Demand	Anodyne	EPHX2	21	42
O=C(N[C@@H]1CCN(c2ccccc2)C1=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875264752	FF	On-Demand	Anodyne	EPHX2	21	42
O=C(N[C@@H]1CCN(c2ccccc2)C1=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875264753	FF	On-Demand	Anodyne	EPHX2	21	42
N#C[C@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264755	FD	On-Demand	Mild	ACE	32	44
N#C[C@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264755	FD	On-Demand	Mild	GHRHR	65	36
N#C[C@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264755	FD	On-Demand	Mild	MME	49	44
N#C[C@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264755	FD	On-Demand	Mild	MC4R	74	41
N#C[C@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264755	FD	On-Demand	Mild	TRY2_BOVIN	34	41
N#C[C@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264755	FD	On-Demand	Mild	TRY1_BOVIN	15	41
N#C[C@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264755	FD	On-Demand	Mild	NPFFR2	45	30
N#C[C@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264755	FD	On-Demand	Mild	TIMP3	62	35
N#C[C@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264755	FD	On-Demand	Mild	PREP	16	52
N#C[C@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264755	FD	On-Demand	Mild	MC5R	48	39
N#C[C@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264755	FD	On-Demand	Mild	CCKBR	24	43
N#C[C@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264755	FD	On-Demand	Mild	ACE2	50	35
N#C[C@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264755	FD	On-Demand	Mild	CTSC	33	40
N#C[C@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264755	FD	On-Demand	Mild	PSMB8	47	33
N#C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264756	FD	On-Demand	Mild	ACE	32	44
N#C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264756	FD	On-Demand	Mild	GHRHR	65	36
N#C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264756	FD	On-Demand	Mild	MME	49	44
N#C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264756	FD	On-Demand	Mild	MC4R	74	41
N#C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264756	FD	On-Demand	Mild	TRY2_BOVIN	34	41
N#C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264756	FD	On-Demand	Mild	TRY1_BOVIN	15	41
N#C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264756	FD	On-Demand	Mild	NPFFR2	45	30
N#C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264756	FD	On-Demand	Mild	TIMP3	62	35
N#C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264756	FD	On-Demand	Mild	PREP	16	52
N#C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264756	FD	On-Demand	Mild	MC5R	48	39
N#C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264756	FD	On-Demand	Mild	CCKBR	24	43
N#C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264756	FD	On-Demand	Mild	ACE2	50	35
N#C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264756	FD	On-Demand	Mild	CTSC	33	40
N#C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264756	FD	On-Demand	Mild	PSMB8	47	33
N#C[C@@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264757	FD	On-Demand	Mild	ACE	32	44
N#C[C@@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264757	FD	On-Demand	Mild	GHRHR	65	36
N#C[C@@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264757	FD	On-Demand	Mild	MME	49	44
N#C[C@@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264757	FD	On-Demand	Mild	MC4R	74	41
N#C[C@@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264757	FD	On-Demand	Mild	TRY2_BOVIN	34	41
N#C[C@@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264757	FD	On-Demand	Mild	TRY1_BOVIN	15	41
N#C[C@@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264757	FD	On-Demand	Mild	NPFFR2	45	30
N#C[C@@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264757	FD	On-Demand	Mild	TIMP3	62	35
N#C[C@@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264757	FD	On-Demand	Mild	PREP	16	52
N#C[C@@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264757	FD	On-Demand	Mild	MC5R	48	39
N#C[C@@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264757	FD	On-Demand	Mild	CCKBR	24	43
N#C[C@@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264757	FD	On-Demand	Mild	ACE2	50	35
N#C[C@@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264757	FD	On-Demand	Mild	CTSC	33	40
N#C[C@@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264757	FD	On-Demand	Mild	PSMB8	47	33
N#C[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264758	FD	On-Demand	Mild	ACE	32	44
N#C[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264758	FD	On-Demand	Mild	GHRHR	65	36
N#C[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264758	FD	On-Demand	Mild	MME	49	44
N#C[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264758	FD	On-Demand	Mild	MC4R	74	41
N#C[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264758	FD	On-Demand	Mild	TRY2_BOVIN	34	41
N#C[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264758	FD	On-Demand	Mild	TRY1_BOVIN	15	41
N#C[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264758	FD	On-Demand	Mild	NPFFR2	45	30
N#C[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264758	FD	On-Demand	Mild	TIMP3	62	35
N#C[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264758	FD	On-Demand	Mild	PREP	16	52
N#C[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264758	FD	On-Demand	Mild	MC5R	48	39
N#C[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264758	FD	On-Demand	Mild	CCKBR	24	43
N#C[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264758	FD	On-Demand	Mild	ACE2	50	35
N#C[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264758	FD	On-Demand	Mild	CTSC	33	40
N#C[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCCOC1	ZINC000875264758	FD	On-Demand	Mild	PSMB8	47	33
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000875264776	JH	On-Demand	Anodyne	TGM2	62	41
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000875264776	JH	On-Demand	Anodyne	F13A1	87	41
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000875264776	JH	On-Demand	Anodyne	NAMPT	32	56
CN1CCN(C2CCN(C(=O)N[C@H]3CCN(c4ccccc4)C3=O)CC2)CC1	ZINC000875264813	GD	On-Demand	Anodyne	EPHX2	17	47
CN1CCN(C2CCN(C(=O)N[C@H]3CCN(c4ccccc4)C3=O)CC2)CC1	ZINC000875264813	GD	On-Demand	Anodyne	CALCRL	42	36
CN1CCN(C2CCN(C(=O)N[C@H]3CCN(c4ccccc4)C3=O)CC2)CC1	ZINC000875264813	GD	On-Demand	Anodyne	L3MBTL3	74	41
CN1CCN(C2CCN(C(=O)N[C@@H]3CCN(c4ccccc4)C3=O)CC2)CC1	ZINC000875264814	GD	On-Demand	Anodyne	EPHX2	17	47
CN1CCN(C2CCN(C(=O)N[C@@H]3CCN(c4ccccc4)C3=O)CC2)CC1	ZINC000875264814	GD	On-Demand	Anodyne	CALCRL	42	36
CN1CCN(C2CCN(C(=O)N[C@@H]3CCN(c4ccccc4)C3=O)CC2)CC1	ZINC000875264814	GD	On-Demand	Anodyne	L3MBTL3	74	41
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)Nc1ccc(F)c(Cl)c1	ZINC000875264816	GI	On-Demand	Anodyne	MCHR1	29	46
COCCN(CC1CCN(C)CC1)C(=O)NC[C@H]1CCCN1CCOC	ZINC000875264847	FD	On-Demand	Anodyne	ACKR3	59	30
COCCN(CC1CCN(C)CC1)C(=O)NC[C@@H]1CCCN1CCOC	ZINC000875264849	FD	On-Demand	Anodyne	ACKR3	59	30
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NC1CCN(CCO)CC1)CC2	ZINC000875264858	GD	On-Demand	Anodyne	SLC18A2	47	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NC1CCN(CCO)CC1)CC2	ZINC000875264858	GD	On-Demand	Anodyne	HTR4	51	48
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NC1CCN(CCO)CC1)CC2	ZINC000875264859	GD	On-Demand	Anodyne	SLC18A2	47	35
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NC1CCN(CCO)CC1)CC2	ZINC000875264859	GD	On-Demand	Anodyne	HTR4	51	48
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(CCO)CC2)C1	ZINC000875264876	CC	On-Demand	Anodyne	HTR4	15	41
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(CCO)CC2)C1	ZINC000875264877	CC	On-Demand	Anodyne	HTR4	15	41
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)C1(c2ccc(F)cc2)CCC1	ZINC000875264901	FD	On-Demand	Anodyne	CPT2	46	37
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)C1(c2ccc(F)cc2)CCC1	ZINC000875264902	FD	On-Demand	Anodyne	CPT2	46	37
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)NC12CC3CC(CC(C3)C1)C2	ZINC000875264925	GH	On-Demand	Anodyne	EPHX2	56	38
O=C(NNc1cccc(F)c1Br)NC1CCN(CCO)CC1	ZINC000875264936	GD	On-Demand	Reactive	SIGMAR1	15	43
O=C(NNc1cccc(F)c1Br)NC1CCN(CCO)CC1	ZINC000875264936	GD	On-Demand	Reactive	SLC6A5	25	42
COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)C1(F)CCOCC1	ZINC000875264980	GG	On-Demand	Anodyne	LRRK2	28	41
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264983	EF	On-Demand	Anodyne	ACE	73	42
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264983	EF	On-Demand	Anodyne	OPRM1	38	41
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264983	EF	On-Demand	Anodyne	OPRD1	28	40
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264983	EF	On-Demand	Anodyne	GHRHR	83	37
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264983	EF	On-Demand	Anodyne	MME	82	46
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264983	EF	On-Demand	Anodyne	UGCG	26	45
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264983	EF	On-Demand	Anodyne	MC4R	101	49
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264983	EF	On-Demand	Anodyne	CTRA_BOVIN	42	33
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264983	EF	On-Demand	Anodyne	TRY2_BOVIN	62	39
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264983	EF	On-Demand	Anodyne	TRY1_BOVIN	43	34
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264983	EF	On-Demand	Anodyne	CACNA1B	33	45
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264983	EF	On-Demand	Anodyne	NPFFR2	52	35
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264983	EF	On-Demand	Anodyne	CYP51A1	22	43
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264983	EF	On-Demand	Anodyne	TIMP3	82	39
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264983	EF	On-Demand	Anodyne	PREP	31	55
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264983	EF	On-Demand	Anodyne	MC3R	49	46
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264983	EF	On-Demand	Anodyne	MC5R	62	46
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264983	EF	On-Demand	Anodyne	ECE1	42	42
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264983	EF	On-Demand	Anodyne	CELA2A	42	33
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264983	EF	On-Demand	Anodyne	CCKBR	31	45
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264983	EF	On-Demand	Anodyne	CAPN1	30	40
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264983	EF	On-Demand	Anodyne	ACE2	70	40
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264983	EF	On-Demand	Anodyne	MC1R	35	46
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264983	EF	On-Demand	Anodyne	DPP7	56	38
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264983	EF	On-Demand	Anodyne	ST14	41	34
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264983	EF	On-Demand	Anodyne	CALCRL	24	42
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264983	EF	On-Demand	Anodyne	BRCA1	43	31
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264984	EF	On-Demand	Anodyne	ACE	73	42
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264984	EF	On-Demand	Anodyne	OPRM1	38	41
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264984	EF	On-Demand	Anodyne	OPRD1	28	40
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264984	EF	On-Demand	Anodyne	GHRHR	83	37
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264984	EF	On-Demand	Anodyne	MME	82	46
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264984	EF	On-Demand	Anodyne	UGCG	26	45
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264984	EF	On-Demand	Anodyne	MC4R	101	49
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264984	EF	On-Demand	Anodyne	CTRA_BOVIN	42	33
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264984	EF	On-Demand	Anodyne	TRY2_BOVIN	62	39
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264984	EF	On-Demand	Anodyne	TRY1_BOVIN	43	34
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264984	EF	On-Demand	Anodyne	CACNA1B	33	45
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264984	EF	On-Demand	Anodyne	NPFFR2	52	35
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264984	EF	On-Demand	Anodyne	CYP51A1	22	43
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264984	EF	On-Demand	Anodyne	TIMP3	82	39
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264984	EF	On-Demand	Anodyne	PREP	31	55
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264984	EF	On-Demand	Anodyne	MC3R	49	46
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264984	EF	On-Demand	Anodyne	MC5R	62	46
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264984	EF	On-Demand	Anodyne	ECE1	42	42
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264984	EF	On-Demand	Anodyne	CELA2A	42	33
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264984	EF	On-Demand	Anodyne	CCKBR	31	45
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264984	EF	On-Demand	Anodyne	CAPN1	30	40
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264984	EF	On-Demand	Anodyne	ACE2	70	40
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264984	EF	On-Demand	Anodyne	MC1R	35	46
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264984	EF	On-Demand	Anodyne	DPP7	56	38
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264984	EF	On-Demand	Anodyne	ST14	41	34
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264984	EF	On-Demand	Anodyne	CALCRL	24	42
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264984	EF	On-Demand	Anodyne	BRCA1	43	31
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264985	EF	On-Demand	Anodyne	ACE	73	42
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264985	EF	On-Demand	Anodyne	OPRM1	38	41
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264985	EF	On-Demand	Anodyne	OPRD1	28	40
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264985	EF	On-Demand	Anodyne	GHRHR	83	37
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264985	EF	On-Demand	Anodyne	MME	82	46
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264985	EF	On-Demand	Anodyne	UGCG	26	45
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264985	EF	On-Demand	Anodyne	MC4R	101	49
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264985	EF	On-Demand	Anodyne	CTRA_BOVIN	42	33
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264985	EF	On-Demand	Anodyne	TRY2_BOVIN	62	39
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264985	EF	On-Demand	Anodyne	TRY1_BOVIN	43	34
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264985	EF	On-Demand	Anodyne	CACNA1B	33	45
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264985	EF	On-Demand	Anodyne	NPFFR2	52	35
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264985	EF	On-Demand	Anodyne	CYP51A1	22	43
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264985	EF	On-Demand	Anodyne	TIMP3	82	39
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264985	EF	On-Demand	Anodyne	PREP	31	55
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264985	EF	On-Demand	Anodyne	MC3R	49	46
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264985	EF	On-Demand	Anodyne	MC5R	62	46
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264985	EF	On-Demand	Anodyne	ECE1	42	42
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264985	EF	On-Demand	Anodyne	CELA2A	42	33
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264985	EF	On-Demand	Anodyne	CCKBR	31	45
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264985	EF	On-Demand	Anodyne	CAPN1	30	40
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264985	EF	On-Demand	Anodyne	ACE2	70	40
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264985	EF	On-Demand	Anodyne	MC1R	35	46
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264985	EF	On-Demand	Anodyne	DPP7	56	38
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264985	EF	On-Demand	Anodyne	ST14	41	34
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264985	EF	On-Demand	Anodyne	CALCRL	24	42
O=C([C@H](Cc1ccccc1)NC(=O)[C@@]12CCCC[C@@H]1C2)N1CCCC1	ZINC000875264985	EF	On-Demand	Anodyne	BRCA1	43	31
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264986	EF	On-Demand	Anodyne	ACE	73	42
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264986	EF	On-Demand	Anodyne	OPRM1	38	41
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264986	EF	On-Demand	Anodyne	OPRD1	28	40
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264986	EF	On-Demand	Anodyne	GHRHR	83	37
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264986	EF	On-Demand	Anodyne	MME	82	46
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264986	EF	On-Demand	Anodyne	UGCG	26	45
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264986	EF	On-Demand	Anodyne	MC4R	101	49
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264986	EF	On-Demand	Anodyne	CTRA_BOVIN	42	33
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264986	EF	On-Demand	Anodyne	TRY2_BOVIN	62	39
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264986	EF	On-Demand	Anodyne	TRY1_BOVIN	43	34
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264986	EF	On-Demand	Anodyne	CACNA1B	33	45
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264986	EF	On-Demand	Anodyne	NPFFR2	52	35
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264986	EF	On-Demand	Anodyne	CYP51A1	22	43
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264986	EF	On-Demand	Anodyne	TIMP3	82	39
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264986	EF	On-Demand	Anodyne	PREP	31	55
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264986	EF	On-Demand	Anodyne	MC3R	49	46
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264986	EF	On-Demand	Anodyne	MC5R	62	46
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264986	EF	On-Demand	Anodyne	ECE1	42	42
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264986	EF	On-Demand	Anodyne	CELA2A	42	33
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264986	EF	On-Demand	Anodyne	CCKBR	31	45
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264986	EF	On-Demand	Anodyne	CAPN1	30	40
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264986	EF	On-Demand	Anodyne	ACE2	70	40
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264986	EF	On-Demand	Anodyne	MC1R	35	46
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264986	EF	On-Demand	Anodyne	DPP7	56	38
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264986	EF	On-Demand	Anodyne	ST14	41	34
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264986	EF	On-Demand	Anodyne	CALCRL	24	42
O=C([C@H](Cc1ccccc1)NC(=O)[C@]12CCCC[C@H]1C2)N1CCCC1	ZINC000875264986	EF	On-Demand	Anodyne	BRCA1	43	31
NS(=O)(=O)c1ccc(OCCOC(=O)C2(c3ccc(F)cc3)CCC2)cc1	ZINC000875264989	GF	On-Demand	Anodyne	CA2	36	49
NS(=O)(=O)c1ccc(OCCOC(=O)C2(c3ccc(F)cc3)CCC2)cc1	ZINC000875264989	GF	On-Demand	Anodyne	PTGS2	15	43
NS(=O)(=O)c1ccc(OCCOC(=O)C2(c3ccc(F)cc3)CCC2)cc1	ZINC000875264989	GF	On-Demand	Anodyne	CA1	33	49
NS(=O)(=O)c1ccc(OCCOC(=O)C2(c3ccc(F)cc3)CCC2)cc1	ZINC000875264989	GF	On-Demand	Anodyne	CA7	31	49
NS(=O)(=O)c1ccc(OCCOC(=O)C2(c3ccc(F)cc3)CCC2)cc1	ZINC000875264989	GF	On-Demand	Anodyne	CA4	29	42
NS(=O)(=O)c1ccc(OCCOC(=O)C2(c3ccc(F)cc3)CCC2)cc1	ZINC000875264989	GF	On-Demand	Anodyne	CA12	30	49
NS(=O)(=O)c1ccc(OCCOC(=O)C2(c3ccc(F)cc3)CCC2)cc1	ZINC000875264989	GF	On-Demand	Anodyne	CA9	27	49
NS(=O)(=O)c1ccc(OCCOC(=O)C2(c3ccc(F)cc3)CCC2)cc1	ZINC000875264989	GF	On-Demand	Anodyne	P96878_MYCTU	15	41
COc1ccc2c(COC(=O)C3(c4cccc(F)c4)CCC3)cc(=O)oc2c1	ZINC000875265001	GI	On-Demand	Anodyne	MAOB	34	50
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)Nc1cc(C(F)(F)F)ccc1N1CCOCC1	ZINC000875265041	JI	On-Demand	Anodyne	KCNQ2	20	41
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)Nc1cc(C(F)(F)F)ccc1N1CCOCC1	ZINC000875265041	JI	On-Demand	Anodyne	TEK	17	41
CC(=O)C1CCN(C(=O)N[C@H]2CCN(c3ccccc3)C2=O)CC1	ZINC000875265042	ED	On-Demand	Anodyne	EPHX2	23	41
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(c3ccccc3)C2=O)CC1	ZINC000875265043	ED	On-Demand	Anodyne	EPHX2	23	41
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265046	GG	On-Demand	Bother	ACE	40	47
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265046	GG	On-Demand	Bother	P2RY12	66	35
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265046	GG	On-Demand	Bother	MME	58	47
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265046	GG	On-Demand	Bother	MC4R	74	41
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265046	GG	On-Demand	Bother	CTSB	15	43
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265046	GG	On-Demand	Bother	TRY2_BOVIN	69	37
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265046	GG	On-Demand	Bother	NPFFR2	53	34
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265046	GG	On-Demand	Bother	MC5R	45	33
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265046	GG	On-Demand	Bother	CAPN1	30	41
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265046	GG	On-Demand	Bother	ACE2	61	36
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265046	GG	On-Demand	Bother	DPP7	45	38
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265046	GG	On-Demand	Bother	BLA1_STEMA	42	36
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265046	GG	On-Demand	Bother	BRCA1	44	31
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265046	GG	On-Demand	Bother	NPFFR1	48	34
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265047	GG	On-Demand	Bother	ACE	40	47
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265047	GG	On-Demand	Bother	P2RY12	66	35
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265047	GG	On-Demand	Bother	MME	58	47
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265047	GG	On-Demand	Bother	MC4R	74	41
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265047	GG	On-Demand	Bother	CTSB	15	43
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265047	GG	On-Demand	Bother	TRY2_BOVIN	69	37
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265047	GG	On-Demand	Bother	NPFFR2	53	34
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265047	GG	On-Demand	Bother	MC5R	45	33
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265047	GG	On-Demand	Bother	CAPN1	30	41
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265047	GG	On-Demand	Bother	ACE2	61	36
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265047	GG	On-Demand	Bother	DPP7	45	38
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265047	GG	On-Demand	Bother	BLA1_STEMA	42	36
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265047	GG	On-Demand	Bother	BRCA1	44	31
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265047	GG	On-Demand	Bother	NPFFR1	48	34
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)NNC(=O)c1cccc([N+](=O)[O-])c1	ZINC000875265058	HE	On-Demand	Reactive	CACNA1D	53	38
Cc1cccc([C@@H](C)CNC(=O)C(=O)N2CCC(N3CCN(C)CC3)CC2)c1	ZINC000875265073	GD	On-Demand	Anodyne	L3MBTL3	54	39
CC[C@H]1CCCCN1C(=O)COC(=O)C1(c2cccc(F)c2)CCC1	ZINC000875265084	EH	On-Demand	Anodyne	CPT1A	54	37
CC[C@@H]1CCCCN1C(=O)COC(=O)C1(c2cccc(F)c2)CCC1	ZINC000875265086	EH	On-Demand	Anodyne	CPT1A	54	37
O=C(NC1CCN(CCO)CC1)N[C@@H]1CCCO[C@H]1c1ccc(Cl)cc1	ZINC000875265090	GE	On-Demand	Anodyne	DRD4	18	40
O=C(NC1CCN(CCO)CC1)N[C@@H]1CCCO[C@H]1c1ccc(Cl)cc1	ZINC000875265090	GE	On-Demand	Anodyne	SIGMAR1	20	43
O=C(OCc1cccc([N+](=O)[O-])c1)C1(c2cccc(F)c2)CCC1	ZINC000875265095	EH	On-Demand	Bother	CACNA1C	54	49
O=C(OCc1cccc([N+](=O)[O-])c1)C1(c2cccc(F)c2)CCC1	ZINC000875265095	EH	On-Demand	Bother	CACNA1D	83	49
O=C(OCc1cccc([N+](=O)[O-])c1)C1(c2cccc(F)c2)CCC1	ZINC000875265095	EH	On-Demand	Bother	SLC12A5	64	37
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)NC1CCCCCC1	ZINC000875265099	EH	On-Demand	Anodyne	FAAH	17	44
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)NCC1CCCCC1	ZINC000875265105	EG	On-Demand	Anodyne	CACNA1I	17	43
O=C(NCCOC(F)(F)C(F)(F)F)NC1CCN(CCO)CC1	ZINC000875265113	EC	On-Demand	Anodyne	SLC6A5	31	48
C[C@@H](NC(=O)NC1CCN(CCO)CC1)c1cc2cnccc2o1	ZINC000875265122	ED	On-Demand	Anodyne	SSTR5	42	34
C[C@@H](NC(=O)NC1CCN(CCO)CC1)c1cc2cnccc2o1	ZINC000875265122	ED	On-Demand	Anodyne	PDK1	45	34
C[C@H](NC(=O)NC1CCN(CCO)CC1)c1cc2cnccc2o1	ZINC000875265123	ED	On-Demand	Anodyne	SSTR5	42	34
C[C@H](NC(=O)NC1CCN(CCO)CC1)c1cc2cnccc2o1	ZINC000875265123	ED	On-Demand	Anodyne	PDK1	45	34
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)Nc1cccc2ccccc12	ZINC000875265189	GJ	On-Demand	Anodyne	KCNQ2	16	40
COc1ccccc1[C@H]1CCCN(C(=O)NCC(C)(C)NS(C)(=O)=O)CC1	ZINC000875265194	GE	On-Demand	Anodyne	RBP4	32	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCC(C)(C)NS(C)(=O)=O)CC1	ZINC000875265197	GE	On-Demand	Anodyne	RBP4	32	40
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)Nc1ccc(OC(F)(F)F)cc1	ZINC000875265207	HI	On-Demand	Anodyne	P2RY1	58	42
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)Nc1ccc(OC(F)(F)F)cc1	ZINC000875265207	HI	On-Demand	Anodyne	EPHX2	53	41
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000875265274	JE	On-Demand	Anodyne	TGM2	40	36
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000875265274	JE	On-Demand	Anodyne	F13A1	46	37
CONC(=O)C1CCN(C(=O)NCC2(Sc3ccccc3)CCCC2)CC1	ZINC000875265276	GG	On-Demand	Anodyne	HCN1	50	31
CONC(=O)C1CCN(C(=O)NCC2(Sc3ccccc3)CCCC2)CC1	ZINC000875265276	GG	On-Demand	Anodyne	HCN4	48	31
Cc1cccc(CN2CCO[C@@H](CNC(=O)NC3CCN(CCO)CC3)C2)c1	ZINC000875265310	GC	On-Demand	Anodyne	DRD4	38	47
Cc1cccc(CN2CCO[C@@H](CNC(=O)NC3CCN(CCO)CC3)C2)c1	ZINC000875265310	GC	On-Demand	Anodyne	SSTR5	43	35
Cc1cccc(CN2CCO[C@@H](CNC(=O)NC3CCN(CCO)CC3)C2)c1	ZINC000875265310	GC	On-Demand	Anodyne	CCR3	31	45
Cc1cccc(CN2CCO[C@@H](CNC(=O)NC3CCN(CCO)CC3)C2)c1	ZINC000875265310	GC	On-Demand	Anodyne	MCHR1	31	41
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCNC1=O	ZINC000875265311	FD	On-Demand	Anodyne	ACE	57	44
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCNC1=O	ZINC000875265311	FD	On-Demand	Anodyne	GHRHR	87	38
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCNC1=O	ZINC000875265311	FD	On-Demand	Anodyne	P2RY12	107	36
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCNC1=O	ZINC000875265311	FD	On-Demand	Anodyne	MME	86	44
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCNC1=O	ZINC000875265311	FD	On-Demand	Anodyne	UGCG	32	47
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCNC1=O	ZINC000875265311	FD	On-Demand	Anodyne	MC4R	100	46
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCNC1=O	ZINC000875265311	FD	On-Demand	Anodyne	TRY2_BOVIN	92	39
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCNC1=O	ZINC000875265311	FD	On-Demand	Anodyne	CACNA1B	22	41
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCNC1=O	ZINC000875265311	FD	On-Demand	Anodyne	TIMP3	82	37
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCNC1=O	ZINC000875265311	FD	On-Demand	Anodyne	MC3R	48	44
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCNC1=O	ZINC000875265311	FD	On-Demand	Anodyne	MC5R	61	40
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCNC1=O	ZINC000875265311	FD	On-Demand	Anodyne	ECE1	41	38
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCNC1=O	ZINC000875265311	FD	On-Demand	Anodyne	CCKBR	36	41
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCNC1=O	ZINC000875265311	FD	On-Demand	Anodyne	GHSR	23	42
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCNC1=O	ZINC000875265311	FD	On-Demand	Anodyne	ACE2	74	38
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCNC1=O	ZINC000875265311	FD	On-Demand	Anodyne	MC1R	39	45
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCNC1=O	ZINC000875265311	FD	On-Demand	Anodyne	DPP7	44	37
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCNC1=O	ZINC000875265311	FD	On-Demand	Anodyne	CALCRL	21	41
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCNC1=O	ZINC000875265311	FD	On-Demand	Anodyne	PSMB8	41	33
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)CCNC1=O	ZINC000875265311	FD	On-Demand	Anodyne	NPFFR1	49	33
Cc1cccc(CN2CCO[C@H](CNC(=O)NC3CCN(CCO)CC3)C2)c1	ZINC000875265313	GC	On-Demand	Anodyne	DRD4	38	47
Cc1cccc(CN2CCO[C@H](CNC(=O)NC3CCN(CCO)CC3)C2)c1	ZINC000875265313	GC	On-Demand	Anodyne	SSTR5	43	35
Cc1cccc(CN2CCO[C@H](CNC(=O)NC3CCN(CCO)CC3)C2)c1	ZINC000875265313	GC	On-Demand	Anodyne	CCR3	31	45
Cc1cccc(CN2CCO[C@H](CNC(=O)NC3CCN(CCO)CC3)C2)c1	ZINC000875265313	GC	On-Demand	Anodyne	MCHR1	31	41
COC(=O)c1ccc(COC(=O)C2(c3cccc(F)c3)CCC2)cc1	ZINC000875265314	EH	On-Demand	Anodyne	SLC12A5	67	39
Cc1cccc([C@@H](C)CNC(=O)C(=O)N[C@@H](C)c2ccc(C(F)(F)F)nc2)c1	ZINC000875265315	GH	On-Demand	Anodyne	TRPV1	40	36
Cc1cccc([C@@H](C)CNC(=O)C(=O)N[C@H](C)c2ccc(C(F)(F)F)nc2)c1	ZINC000875265321	GH	On-Demand	Anodyne	TRPV1	40	36
O=C(COC(=O)C1(c2ccc(F)cc2)CCC1)N[C@@H]1CCOc2ccccc21	ZINC000875265330	GG	On-Demand	Anodyne	BDKRB1	22	41
O=C(COC(=O)C1(c2ccc(F)cc2)CCC1)N[C@@H]1CCOc2ccccc21	ZINC000875265330	GG	On-Demand	Anodyne	LUXR	46	33
O=C(COC(=O)C1(c2ccc(F)cc2)CCC1)N[C@@H]1CCOc2ccccc21	ZINC000875265330	GG	On-Demand	Anodyne	TRAR	65	35
O=C(COC(=O)C1(c2ccc(F)cc2)CCC1)N[C@H]1CCOc2ccccc21	ZINC000875265340	GG	On-Demand	Anodyne	BDKRB1	22	41
O=C(COC(=O)C1(c2ccc(F)cc2)CCC1)N[C@H]1CCOc2ccccc21	ZINC000875265340	GG	On-Demand	Anodyne	LUXR	46	33
O=C(COC(=O)C1(c2ccc(F)cc2)CCC1)N[C@H]1CCOc2ccccc21	ZINC000875265340	GG	On-Demand	Anodyne	TRAR	65	35
CC(=O)c1cccc(NC(=O)COC(=O)C2(c3cccc(F)c3)CCC2)c1	ZINC000875265345	FH	On-Demand	Anodyne	KCNK3	42	39
CC[C@@H](NC(=O)C(=O)N1CCC(C(C)=O)CC1)C(C)(C)c1ccccc1	ZINC000875265419	FF	On-Demand	Anodyne	AMY2	44	32
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN(CCO)CC1	ZINC000875265456	ED	On-Demand	Anodyne	DRD4	16	40
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN(CCO)CC1	ZINC000875265456	ED	On-Demand	Anodyne	HTR4	24	44
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN(CCO)CC1	ZINC000875265456	ED	On-Demand	Anodyne	SIGMAR1	20	55
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN(CCO)CC1	ZINC000875265456	ED	On-Demand	Anodyne	CCR3	30	40
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN(CCO)CC1	ZINC000875265456	ED	On-Demand	Anodyne	SLC6A5	22	42
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN(CCO)CC1	ZINC000875265456	ED	On-Demand	Anodyne	EPHX2	19	41
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN(CCO)CC1	ZINC000875265456	ED	On-Demand	Anodyne	PDK1	47	35
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN(CCO)CC1	ZINC000875265456	ED	On-Demand	Anodyne	MCHR1	22	48
O=C(COC(=O)C1(c2ccc(F)cc2)CCC1)Nc1ccc(N2CCCCC2)nc1	ZINC000875265477	HH	On-Demand	Anodyne	DGAT1	37	41
O=C(COC(=O)C1(c2ccc(F)cc2)CCC1)Nc1ccc(N2CCCCC2)nc1	ZINC000875265477	HH	On-Demand	Anodyne	SLC27A1	48	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cn2c(C)cccc2n1	ZINC000875265479	ED	On-Demand	Anodyne	SLC6A3	44	35
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cn2c(C)cccc2n1	ZINC000875265480	ED	On-Demand	Anodyne	SLC6A3	44	35
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)c1scnc1C(F)F	ZINC000875265487	GG	On-Demand	Anodyne	ACE	30	43
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)c1scnc1C(F)F	ZINC000875265487	GG	On-Demand	Anodyne	P2RY12	95	36
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)c1scnc1C(F)F	ZINC000875265487	GG	On-Demand	Anodyne	MME	41	43
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)c1scnc1C(F)F	ZINC000875265487	GG	On-Demand	Anodyne	MC4R	69	41
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)c1scnc1C(F)F	ZINC000875265487	GG	On-Demand	Anodyne	TRY2_BOVIN	51	36
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)c1scnc1C(F)F	ZINC000875265487	GG	On-Demand	Anodyne	CACNA1B	18	40
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)c1scnc1C(F)F	ZINC000875265487	GG	On-Demand	Anodyne	NPFFR2	43	33
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)c1scnc1C(F)F	ZINC000875265487	GG	On-Demand	Anodyne	CYP51A1	22	43
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)c1scnc1C(F)F	ZINC000875265487	GG	On-Demand	Anodyne	PREP	15	56
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)c1scnc1C(F)F	ZINC000875265487	GG	On-Demand	Anodyne	ACE2	47	35
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)c1scnc1C(F)F	ZINC000875265487	GG	On-Demand	Anodyne	DPP7	41	37
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)c1scnc1C(F)F	ZINC000875265487	GG	On-Demand	Anodyne	CALCRL	19	40
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)c1scnc1C(F)F	ZINC000875265487	GG	On-Demand	Anodyne	BLA1_STEMA	41	37
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)c1scnc1C(F)F	ZINC000875265487	GG	On-Demand	Anodyne	GPR142	48	34
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)c1scnc1C(F)F	ZINC000875265488	GG	On-Demand	Anodyne	ACE	30	43
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)c1scnc1C(F)F	ZINC000875265488	GG	On-Demand	Anodyne	P2RY12	95	36
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)c1scnc1C(F)F	ZINC000875265488	GG	On-Demand	Anodyne	MME	41	43
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)c1scnc1C(F)F	ZINC000875265488	GG	On-Demand	Anodyne	MC4R	69	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)c1scnc1C(F)F	ZINC000875265488	GG	On-Demand	Anodyne	TRY2_BOVIN	51	36
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)c1scnc1C(F)F	ZINC000875265488	GG	On-Demand	Anodyne	CACNA1B	18	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)c1scnc1C(F)F	ZINC000875265488	GG	On-Demand	Anodyne	NPFFR2	43	33
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)c1scnc1C(F)F	ZINC000875265488	GG	On-Demand	Anodyne	CYP51A1	22	43
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)c1scnc1C(F)F	ZINC000875265488	GG	On-Demand	Anodyne	PREP	15	56
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)c1scnc1C(F)F	ZINC000875265488	GG	On-Demand	Anodyne	ACE2	47	35
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)c1scnc1C(F)F	ZINC000875265488	GG	On-Demand	Anodyne	DPP7	41	37
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)c1scnc1C(F)F	ZINC000875265488	GG	On-Demand	Anodyne	CALCRL	19	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)c1scnc1C(F)F	ZINC000875265488	GG	On-Demand	Anodyne	BLA1_STEMA	41	37
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)c1scnc1C(F)F	ZINC000875265488	GG	On-Demand	Anodyne	GPR142	48	34
C[C@@H]1Cc2ccccc2N1C(=O)COC(=O)C1(c2cccc(F)c2)CCC1	ZINC000875265502	FH	On-Demand	Anodyne	DRD4	24	53
O=C(NC1CCN(CCO)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875265506	EC	On-Demand	Anodyne	SLC6A5	16	40
O=C(NC1CCN(CCO)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875265508	EC	On-Demand	Anodyne	SLC6A5	16	40
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)COC(=O)C1(c2ccc(F)cc2)CCC1	ZINC000875265551	JK	On-Demand	Anodyne	NPY2R	44	37
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)COC(=O)C1(c2ccc(F)cc2)CCC1	ZINC000875265551	JK	On-Demand	Anodyne	MTTP	45	31
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)COC(=O)C1(c2ccc(F)cc2)CCC1	ZINC000875265551	JK	On-Demand	Anodyne	KCNK3	93	43
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)COC(=O)C1(c2ccc(F)cc2)CCC1	ZINC000875265551	JK	On-Demand	Anodyne	KCNK9	64	34
O=C(NCCN(Cc1ccccc1)c1ccccn1)NC1CCN(CCO)CC1	ZINC000875265558	GD	On-Demand	Anodyne	DRD4	20	48
O=C(NCCN(Cc1ccccc1)c1ccccn1)NC1CCN(CCO)CC1	ZINC000875265558	GD	On-Demand	Anodyne	SIGMAR1	17	42
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCC(=O)N1	ZINC000875265569	ED	On-Demand	Anodyne	ACE	65	46
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCC(=O)N1	ZINC000875265569	ED	On-Demand	Anodyne	OPRM1	35	41
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCC(=O)N1	ZINC000875265569	ED	On-Demand	Anodyne	OPRD1	31	41
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCC(=O)N1	ZINC000875265569	ED	On-Demand	Anodyne	GHRHR	83	41
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCC(=O)N1	ZINC000875265569	ED	On-Demand	Anodyne	MME	97	46
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCC(=O)N1	ZINC000875265569	ED	On-Demand	Anodyne	TRHR	22	43
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCC(=O)N1	ZINC000875265569	ED	On-Demand	Anodyne	UGCG	31	46
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCC(=O)N1	ZINC000875265569	ED	On-Demand	Anodyne	MC4R	98	43
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCC(=O)N1	ZINC000875265569	ED	On-Demand	Anodyne	CTRA_BOVIN	40	32
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCC(=O)N1	ZINC000875265569	ED	On-Demand	Anodyne	TACR2	49	33
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCC(=O)N1	ZINC000875265569	ED	On-Demand	Anodyne	TRY2_BOVIN	89	38
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCC(=O)N1	ZINC000875265569	ED	On-Demand	Anodyne	CACNA1B	20	42
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCC(=O)N1	ZINC000875265569	ED	On-Demand	Anodyne	CYP51A1	21	41
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCC(=O)N1	ZINC000875265569	ED	On-Demand	Anodyne	TIMP3	80	36
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCC(=O)N1	ZINC000875265569	ED	On-Demand	Anodyne	PREP	18	54
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCC(=O)N1	ZINC000875265569	ED	On-Demand	Anodyne	MC3R	44	40
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCC(=O)N1	ZINC000875265569	ED	On-Demand	Anodyne	MC5R	58	40
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCC(=O)N1	ZINC000875265569	ED	On-Demand	Anodyne	ECE1	43	39
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCC(=O)N1	ZINC000875265569	ED	On-Demand	Anodyne	CELA2A	40	32
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCC(=O)N1	ZINC000875265569	ED	On-Demand	Anodyne	CCKBR	28	42
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCC(=O)N1	ZINC000875265569	ED	On-Demand	Anodyne	GHSR	20	41
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCC(=O)N1	ZINC000875265569	ED	On-Demand	Anodyne	ACE2	73	37
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCC(=O)N1	ZINC000875265569	ED	On-Demand	Anodyne	MC1R	32	40
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCC(=O)N1	ZINC000875265569	ED	On-Demand	Anodyne	DPP7	47	40
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCC(=O)N1	ZINC000875265569	ED	On-Demand	Anodyne	CALCRL	29	44
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)CCC(=O)N1	ZINC000875265569	ED	On-Demand	Anodyne	PSMB8	44	32
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000875265595	IG	On-Demand	Anodyne	NAMPT	19	46
CC(=O)N(C)c1ccc(CNC(=O)N[C@H]2CCN(c3ccccc3)C2=O)cc1	ZINC000875265597	GE	On-Demand	Anodyne	PLG	55	33
CC(=O)N(C)c1ccc(CNC(=O)N[C@H]2CCN(c3ccccc3)C2=O)cc1	ZINC000875265597	GE	On-Demand	Anodyne	TRYP_PIG	48	33
COc1ccccc1[C@@H]1CSCCCN1C(=O)NC1CCN(CCO)CC1	ZINC000875265598	GE	On-Demand	Anodyne	DRD2	30	43
COc1ccccc1[C@@H]1CSCCCN1C(=O)NC1CCN(CCO)CC1	ZINC000875265598	GE	On-Demand	Anodyne	DRD4	26	40
COc1ccccc1[C@@H]1CSCCCN1C(=O)NC1CCN(CCO)CC1	ZINC000875265598	GE	On-Demand	Anodyne	HTR4	27	42
COc1ccccc1[C@@H]1CSCCCN1C(=O)NC1CCN(CCO)CC1	ZINC000875265598	GE	On-Demand	Anodyne	SIGMAR1	18	41
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H]2CCN(c3ccccc3)C2=O)cc1	ZINC000875265599	GE	On-Demand	Anodyne	PLG	55	33
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H]2CCN(c3ccccc3)C2=O)cc1	ZINC000875265599	GE	On-Demand	Anodyne	TRYP_PIG	48	33
O=C(Nc1cccc(C(F)(F)F)n1)c1cnn(CC2CC2)c1	ZINC000875265634	DF	On-Demand	Anodyne	MAP3K5	42	31
Cc1cccc([C@@H](C)CNC(=O)C(=O)NCc2ncc(Br)s2)c1	ZINC000875265686	GF	On-Demand	Anodyne	FBP1	18	41
CC(=O)N1CCC[C@@H]1C(=O)Nc1cccc(C(F)(F)F)n1	ZINC000875265704	DE	On-Demand	Anodyne	CELA1	47	36
CC(=O)N1CCC[C@@H]1C(=O)Nc1cccc(C(F)(F)F)n1	ZINC000875265704	DE	On-Demand	Anodyne	ELANE	71	39
CC(=O)N1CCC[C@@H]1C(=O)Nc1cccc(C(F)(F)F)n1	ZINC000875265704	DE	On-Demand	Anodyne	LGMN	54	33
CC(=O)N1CCC[C@@H]1C(=O)Nc1cccc(C(F)(F)F)n1	ZINC000875265704	DE	On-Demand	Anodyne	XIAP	34	43
CC(=O)N1CCC[C@@H]1C(=O)Nc1cccc(C(F)(F)F)n1	ZINC000875265704	DE	On-Demand	Anodyne	SFRP1	45	35
CC(=O)N1CCC[C@@H]1C(=O)Nc1cccc(C(F)(F)F)n1	ZINC000875265704	DE	On-Demand	Anodyne	WNT3	56	42
O=C(OCc1ccc(S(=O)(=O)C(F)F)cc1)C1(c2ccc(F)cc2)CCC1	ZINC000875265714	GH	On-Demand	Anodyne	SLC12A5	56	41
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)NCc1ccc2c(c1)OCO2	ZINC000875265737	GF	On-Demand	Anodyne	NOS2	87	38
CC(C)(C)OC(=O)C1CC(NC(=O)NC2CCN(CCO)CC2)C1	ZINC000875265751	EC	On-Demand	Anodyne	SLC6A5	19	40
O=C(NCc1ccc(OC(F)F)cc1F)NC1CCN(CCO)CC1	ZINC000875265754	FD	On-Demand	Anodyne	SLC6A5	28	43
O=C(NCc1ccc(OC(F)F)cc1F)NC1CCN(CCO)CC1	ZINC000875265754	FD	On-Demand	Anodyne	MCHR1	15	42
C[C@H]1CCCCN1C(=O)COC(=O)C1(c2cccc(F)c2)CCC1	ZINC000875265766	EG	On-Demand	Anodyne	CPT1A	67	38
C[C@H]1CCCCN1C(=O)COC(=O)C1(c2cccc(F)c2)CCC1	ZINC000875265766	EG	On-Demand	Anodyne	CPT2	42	33
C[C@@H]1CCCCN1C(=O)COC(=O)C1(c2cccc(F)c2)CCC1	ZINC000875265767	EG	On-Demand	Anodyne	CPT1A	67	38
C[C@@H]1CCCCN1C(=O)COC(=O)C1(c2cccc(F)c2)CCC1	ZINC000875265767	EG	On-Demand	Anodyne	CPT2	42	33
C[C@@H](NC(=O)NC1CCN(CCO)CC1)c1ccccc1O	ZINC000875265776	DD	On-Demand	Clean	SIGMAR1	18	43
C[C@@H](NC(=O)NC1CCN(CCO)CC1)c1ccccc1O	ZINC000875265776	DD	On-Demand	Clean	SLC6A5	20	40
C[C@H](NC(=O)NC1CCN(CCO)CC1)c1ccccc1O	ZINC000875265777	DD	On-Demand	Clean	SIGMAR1	18	43
C[C@H](NC(=O)NC1CCN(CCO)CC1)c1ccccc1O	ZINC000875265777	DD	On-Demand	Clean	SLC6A5	20	40
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCN(CCO)CC2)CC1	ZINC000875265779	GE	On-Demand	Anodyne	HTR1A	45	43
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCN(CCO)CC2)CC1	ZINC000875265779	GE	On-Demand	Anodyne	DRD2	46	53
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCN(CCO)CC2)CC1	ZINC000875265779	GE	On-Demand	Anodyne	DRD4	31	46
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCN(CCO)CC2)CC1	ZINC000875265779	GE	On-Demand	Anodyne	HTR2A	15	43
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCN(CCO)CC2)CC1	ZINC000875265779	GE	On-Demand	Anodyne	ADRA1A	31	41
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCN(CCO)CC2)CC1	ZINC000875265779	GE	On-Demand	Anodyne	ADRA1B	31	41
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCN(CCO)CC2)CC1	ZINC000875265779	GE	On-Demand	Anodyne	HTR4	37	44
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCN(CCO)CC2)CC1	ZINC000875265779	GE	On-Demand	Anodyne	HTR7	39	42
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCN(CCO)CC2)CC1	ZINC000875265779	GE	On-Demand	Anodyne	SIGMAR1	25	43
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCN(CCO)CC2)CC1	ZINC000875265779	GE	On-Demand	Anodyne	CCR3	24	40
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCN(CCO)CC2)CC1	ZINC000875265779	GE	On-Demand	Anodyne	MCHR1	18	41
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCN(CCO)CC2)CC1	ZINC000875265779	GE	On-Demand	Anodyne	SHH	18	40
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCN(CCO)CC2)CC1	ZINC000875265780	GE	On-Demand	Anodyne	HTR1A	45	43
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCN(CCO)CC2)CC1	ZINC000875265780	GE	On-Demand	Anodyne	DRD2	46	53
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCN(CCO)CC2)CC1	ZINC000875265780	GE	On-Demand	Anodyne	DRD4	31	46
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCN(CCO)CC2)CC1	ZINC000875265780	GE	On-Demand	Anodyne	HTR2A	15	43
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCN(CCO)CC2)CC1	ZINC000875265780	GE	On-Demand	Anodyne	ADRA1A	31	41
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCN(CCO)CC2)CC1	ZINC000875265780	GE	On-Demand	Anodyne	ADRA1B	31	41
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCN(CCO)CC2)CC1	ZINC000875265780	GE	On-Demand	Anodyne	HTR4	37	44
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCN(CCO)CC2)CC1	ZINC000875265780	GE	On-Demand	Anodyne	HTR7	39	42
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCN(CCO)CC2)CC1	ZINC000875265780	GE	On-Demand	Anodyne	SIGMAR1	25	43
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCN(CCO)CC2)CC1	ZINC000875265780	GE	On-Demand	Anodyne	CCR3	24	40
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCN(CCO)CC2)CC1	ZINC000875265780	GE	On-Demand	Anodyne	MCHR1	18	41
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCN(CCO)CC2)CC1	ZINC000875265780	GE	On-Demand	Anodyne	SHH	18	40
N#Cc1ccc2c(c1)C[C@@H](NC(=O)NC1CCN(CCO)CC1)C2	ZINC000875265803	EC	On-Demand	Mild	CCR3	22	42
N#Cc1ccc2c(c1)C[C@@H](NC(=O)NC1CCN(CCO)CC1)C2	ZINC000875265803	EC	On-Demand	Mild	SLC6A5	19	40
N#Cc1ccc2c(c1)C[C@@H](NC(=O)NC1CCN(CCO)CC1)C2	ZINC000875265803	EC	On-Demand	Mild	MCHR1	21	41
N#Cc1ccc2c(c1)C[C@H](NC(=O)NC1CCN(CCO)CC1)C2	ZINC000875265804	EC	On-Demand	Mild	CCR3	22	42
N#Cc1ccc2c(c1)C[C@H](NC(=O)NC1CCN(CCO)CC1)C2	ZINC000875265804	EC	On-Demand	Mild	SLC6A5	19	40
N#Cc1ccc2c(c1)C[C@H](NC(=O)NC1CCN(CCO)CC1)C2	ZINC000875265804	EC	On-Demand	Mild	MCHR1	21	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2c(C)cccc2F)C1	ZINC000875265810	DD	On-Demand	Anodyne	SLC6A1	49	36
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2c(C)cccc2F)C1	ZINC000875265811	DD	On-Demand	Anodyne	SLC6A1	49	36
Cn1c(=O)c(C(=O)COC(=O)C2(c3cccc(F)c3)CCC2)c(N)n(Cc2ccccc2)c1=O	ZINC000875265838	JE	On-Demand	Anodyne	SLC12A5	45	33
O=C(NC1CCN(CCO)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875265845	ED	On-Demand	Anodyne	CHRM1	19	40
O=C(NC1CCN(CCO)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875265845	ED	On-Demand	Anodyne	DRD2	22	55
O=C(NC1CCN(CCO)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875265845	ED	On-Demand	Anodyne	DRD4	24	55
O=C(NC1CCN(CCO)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875265845	ED	On-Demand	Anodyne	DRD3	19	45
O=C(NC1CCN(CCO)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875265845	ED	On-Demand	Anodyne	LTA4H	28	45
O=C(NC1CCN(CCO)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875265845	ED	On-Demand	Anodyne	SIGMAR1	35	51
O=C(NC1CCN(CCO)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875265845	ED	On-Demand	Anodyne	CCR3	41	42
O=C(NC1CCN(CCO)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875265845	ED	On-Demand	Anodyne	SLC6A5	24	41
O=C(NC1CCN(CCO)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875265845	ED	On-Demand	Anodyne	EPHX2	43	46
O=C(NC1CCN(CCO)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875265845	ED	On-Demand	Anodyne	MCHR1	20	41
N#CCc1ccsc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265861	FF	On-Demand	Mild	ACE	44	41
N#CCc1ccsc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265861	FF	On-Demand	Mild	GHRHR	56	32
N#CCc1ccsc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265861	FF	On-Demand	Mild	MME	43	45
N#CCc1ccsc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265861	FF	On-Demand	Mild	MC4R	75	41
N#CCc1ccsc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265861	FF	On-Demand	Mild	TRY2_BOVIN	63	36
N#CCc1ccsc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265861	FF	On-Demand	Mild	PAPA1_CARPA	30	44
N#CCc1ccsc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265861	FF	On-Demand	Mild	CTSL	35	44
N#CCc1ccsc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265861	FF	On-Demand	Mild	CACNA1B	21	41
N#CCc1ccsc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265861	FF	On-Demand	Mild	NPFFR2	46	32
N#CCc1ccsc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265861	FF	On-Demand	Mild	CYP51A1	22	42
N#CCc1ccsc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265861	FF	On-Demand	Mild	PREP	28	55
N#CCc1ccsc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265861	FF	On-Demand	Mild	MC5R	45	37
N#CCc1ccsc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265861	FF	On-Demand	Mild	CTSS	27	44
N#CCc1ccsc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265861	FF	On-Demand	Mild	ACE2	57	38
N#CCc1ccsc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265861	FF	On-Demand	Mild	DPP7	41	36
N#CCc1ccsc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265861	FF	On-Demand	Mild	CTSV	53	38
N#CCc1ccsc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265861	FF	On-Demand	Mild	NPFFR1	42	32
N#CCc1ccsc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265862	FF	On-Demand	Mild	ACE	44	41
N#CCc1ccsc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265862	FF	On-Demand	Mild	GHRHR	56	32
N#CCc1ccsc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265862	FF	On-Demand	Mild	MME	43	45
N#CCc1ccsc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265862	FF	On-Demand	Mild	MC4R	75	41
N#CCc1ccsc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265862	FF	On-Demand	Mild	TRY2_BOVIN	63	36
N#CCc1ccsc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265862	FF	On-Demand	Mild	PAPA1_CARPA	30	44
N#CCc1ccsc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265862	FF	On-Demand	Mild	CTSL	35	44
N#CCc1ccsc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265862	FF	On-Demand	Mild	CACNA1B	21	41
N#CCc1ccsc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265862	FF	On-Demand	Mild	NPFFR2	46	32
N#CCc1ccsc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265862	FF	On-Demand	Mild	CYP51A1	22	42
N#CCc1ccsc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265862	FF	On-Demand	Mild	PREP	28	55
N#CCc1ccsc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265862	FF	On-Demand	Mild	MC5R	45	37
N#CCc1ccsc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265862	FF	On-Demand	Mild	CTSS	27	44
N#CCc1ccsc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265862	FF	On-Demand	Mild	ACE2	57	38
N#CCc1ccsc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265862	FF	On-Demand	Mild	DPP7	41	36
N#CCc1ccsc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265862	FF	On-Demand	Mild	CTSV	53	38
N#CCc1ccsc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000875265862	FF	On-Demand	Mild	NPFFR1	42	32
O=C(NC1CCN(CCO)CC1)N[C@H]1COc2cccc(Br)c2C1	ZINC000875265880	GD	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NC1CCN(CCO)CC1)N[C@@H]1COc2cccc(Br)c2C1	ZINC000875265883	GD	On-Demand	Anodyne	SIGMAR1	15	40
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)NCCCc1ccccc1	ZINC000875265892	FH	On-Demand	Anodyne	CRTM	36	41
O=C([C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265896	ED	On-Demand	Anodyne	F2	25	40
O=C([C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265896	ED	On-Demand	Anodyne	ACE	50	46
O=C([C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265896	ED	On-Demand	Anodyne	OPRM1	23	40
O=C([C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265896	ED	On-Demand	Anodyne	GHRHR	66	37
O=C([C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265896	ED	On-Demand	Anodyne	MME	85	46
O=C([C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265896	ED	On-Demand	Anodyne	UGCG	30	40
O=C([C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265896	ED	On-Demand	Anodyne	MC4R	90	45
O=C([C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265896	ED	On-Demand	Anodyne	TACR2	41	41
O=C([C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265896	ED	On-Demand	Anodyne	TRY2_BOVIN	71	40
O=C([C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265896	ED	On-Demand	Anodyne	TRY1_BOVIN	26	40
O=C([C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265896	ED	On-Demand	Anodyne	CYSP_TRYCR	32	41
O=C([C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265896	ED	On-Demand	Anodyne	CACNA1B	24	41
O=C([C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265896	ED	On-Demand	Anodyne	NPFFR2	53	32
O=C([C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265896	ED	On-Demand	Anodyne	CYP51A1	21	40
O=C([C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265896	ED	On-Demand	Anodyne	TIMP3	79	36
O=C([C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265896	ED	On-Demand	Anodyne	PREP	16	57
O=C([C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265896	ED	On-Demand	Anodyne	MC5R	56	38
O=C([C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265896	ED	On-Demand	Anodyne	ECE1	42	41
O=C([C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265896	ED	On-Demand	Anodyne	CCKBR	25	44
O=C([C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265896	ED	On-Demand	Anodyne	CTSS	18	41
O=C([C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265896	ED	On-Demand	Anodyne	CAPN1	44	39
O=C([C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265896	ED	On-Demand	Anodyne	ACE2	65	36
O=C([C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265896	ED	On-Demand	Anodyne	TGM2	15	40
O=C([C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265896	ED	On-Demand	Anodyne	DPP7	53	40
O=C([C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265896	ED	On-Demand	Anodyne	PGA5	42	33
O=C([C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265896	ED	On-Demand	Anodyne	CTSC	19	41
O=C([C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265896	ED	On-Demand	Anodyne	CALCRL	19	40
O=C([C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265896	ED	On-Demand	Anodyne	PSMB8	49	35
O=C([C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265896	ED	On-Demand	Anodyne	NPFFR1	46	32
O=C([C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265897	ED	On-Demand	Anodyne	F2	25	40
O=C([C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265897	ED	On-Demand	Anodyne	ACE	50	46
O=C([C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265897	ED	On-Demand	Anodyne	OPRM1	23	40
O=C([C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265897	ED	On-Demand	Anodyne	GHRHR	66	37
O=C([C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265897	ED	On-Demand	Anodyne	MME	85	46
O=C([C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265897	ED	On-Demand	Anodyne	UGCG	30	40
O=C([C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265897	ED	On-Demand	Anodyne	MC4R	90	45
O=C([C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265897	ED	On-Demand	Anodyne	TACR2	41	41
O=C([C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265897	ED	On-Demand	Anodyne	TRY2_BOVIN	71	40
O=C([C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265897	ED	On-Demand	Anodyne	TRY1_BOVIN	26	40
O=C([C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265897	ED	On-Demand	Anodyne	CYSP_TRYCR	32	41
O=C([C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265897	ED	On-Demand	Anodyne	CACNA1B	24	41
O=C([C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265897	ED	On-Demand	Anodyne	NPFFR2	53	32
O=C([C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265897	ED	On-Demand	Anodyne	CYP51A1	21	40
O=C([C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265897	ED	On-Demand	Anodyne	TIMP3	79	36
O=C([C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265897	ED	On-Demand	Anodyne	PREP	16	57
O=C([C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265897	ED	On-Demand	Anodyne	MC5R	56	38
O=C([C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265897	ED	On-Demand	Anodyne	ECE1	42	41
O=C([C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265897	ED	On-Demand	Anodyne	CCKBR	25	44
O=C([C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265897	ED	On-Demand	Anodyne	CTSS	18	41
O=C([C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265897	ED	On-Demand	Anodyne	CAPN1	44	39
O=C([C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265897	ED	On-Demand	Anodyne	ACE2	65	36
O=C([C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265897	ED	On-Demand	Anodyne	TGM2	15	40
O=C([C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265897	ED	On-Demand	Anodyne	DPP7	53	40
O=C([C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265897	ED	On-Demand	Anodyne	PGA5	42	33
O=C([C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265897	ED	On-Demand	Anodyne	CTSC	19	41
O=C([C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265897	ED	On-Demand	Anodyne	CALCRL	19	40
O=C([C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265897	ED	On-Demand	Anodyne	PSMB8	49	35
O=C([C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)N1CCCC1	ZINC000875265897	ED	On-Demand	Anodyne	NPFFR1	46	32
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2CCN(c3ccccc3)C2=O)CC1	ZINC000875265934	FC	On-Demand	Anodyne	EPHX2	21	40
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2CCN(c3ccccc3)C2=O)CC1	ZINC000875265935	FC	On-Demand	Anodyne	EPHX2	21	40
CC1(C)[C@@H](c2ccccc2F)CCN1C(=O)NC1CCN(CCO)CC1	ZINC000875266026	FF	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NC1CCN(CCO)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875266031	FD	On-Demand	Anodyne	HTR2A	15	40
O=C(NC1CCN(CCO)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875266031	FD	On-Demand	Anodyne	SIGMAR1	18	40
O=C(NC1CCN(CCO)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875266031	FD	On-Demand	Anodyne	CCR3	64	46
O=C(NC1CCN(CCO)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875266031	FD	On-Demand	Anodyne	UTS2R	17	43
O=C(NC1CCN(CCO)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875266031	FD	On-Demand	Anodyne	MLNR	36	43
O=C(NC1CCN(CCO)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875266031	FD	On-Demand	Anodyne	SLC6A5	29	44
O=C(NC1CCN(CCO)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875266031	FD	On-Demand	Anodyne	EPHX2	46	49
O=C(NC1CCN(CCO)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875266031	FD	On-Demand	Anodyne	MCHR1	16	44
O=C(NC1CCN(CCO)CC1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875266045	ED	On-Demand	Anodyne	SLC6A5	28	44
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000875266046	JG	On-Demand	Anodyne	F13A1	37	41
N#Cc1cccc([C@H](NC(=O)NC2CCN(CCO)CC2)C(F)(F)F)c1	ZINC000875266071	FD	On-Demand	Mild	CCR3	26	40
N#Cc1cccc([C@H](NC(=O)NC2CCN(CCO)CC2)C(F)(F)F)c1	ZINC000875266071	FD	On-Demand	Mild	SLC6A5	30	45
N#Cc1cccc([C@H](NC(=O)NC2CCN(CCO)CC2)C(F)(F)F)c1	ZINC000875266071	FD	On-Demand	Mild	MCHR1	48	46
N#Cc1cccc([C@@H](NC(=O)NC2CCN(CCO)CC2)C(F)(F)F)c1	ZINC000875266077	FD	On-Demand	Mild	CCR3	26	40
N#Cc1cccc([C@@H](NC(=O)NC2CCN(CCO)CC2)C(F)(F)F)c1	ZINC000875266077	FD	On-Demand	Mild	SLC6A5	30	45
N#Cc1cccc([C@@H](NC(=O)NC2CCN(CCO)CC2)C(F)(F)F)c1	ZINC000875266077	FD	On-Demand	Mild	MCHR1	48	46
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)Nc1ccccc1C(=O)Nc1ccccc1	ZINC000875266078	IJ	On-Demand	Anodyne	KCNK3	45	32
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)Nc1ccccc1C(=O)Nc1ccccc1	ZINC000875266078	IJ	On-Demand	Anodyne	KCNK9	47	32
O=C(NCc1nc(-c2ccncc2)cs1)NC1CCN(CCO)CC1	ZINC000875266079	FD	On-Demand	Anodyne	ROCK1	23	41
O=C(NCc1nc(-c2ccncc2)cs1)NC1CCN(CCO)CC1	ZINC000875266079	FD	On-Demand	Anodyne	ROCK2	16	41
CC[C@@H](NC(=O)NC1CCN(CCO)CC1)[C@H](O)c1ccccc1	ZINC000875266089	ED	On-Demand	Anodyne	SIGMAR1	19	43
CC[C@@H](NC(=O)NC1CCN(CCO)CC1)[C@H](O)c1ccccc1	ZINC000875266089	ED	On-Demand	Anodyne	CCR5	45	46
CC[C@@H](NC(=O)NC1CCN(CCO)CC1)[C@H](O)c1ccccc1	ZINC000875266089	ED	On-Demand	Anodyne	EPHX2	24	40
CC[C@@H](NC(=O)NC1CCN(CCO)CC1)[C@H](O)c1ccccc1	ZINC000875266089	ED	On-Demand	Anodyne	XIAP	44	36
CC[C@@H](NC(=O)NC1CCN(CCO)CC1)[C@@H](O)c1ccccc1	ZINC000875266094	ED	On-Demand	Anodyne	SIGMAR1	19	43
CC[C@@H](NC(=O)NC1CCN(CCO)CC1)[C@@H](O)c1ccccc1	ZINC000875266094	ED	On-Demand	Anodyne	CCR5	45	46
CC[C@@H](NC(=O)NC1CCN(CCO)CC1)[C@@H](O)c1ccccc1	ZINC000875266094	ED	On-Demand	Anodyne	EPHX2	24	40
CC[C@@H](NC(=O)NC1CCN(CCO)CC1)[C@@H](O)c1ccccc1	ZINC000875266094	ED	On-Demand	Anodyne	XIAP	44	36
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)NC1CCN(CCO)CC1	ZINC000875266102	GG	On-Demand	Anodyne	DRD2	17	41
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)NC1CCN(CCO)CC1	ZINC000875266102	GG	On-Demand	Anodyne	DRD3	18	41
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)NC1CCN(CCO)CC1	ZINC000875266102	GG	On-Demand	Anodyne	HTR4	25	43
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)NC1CCN(CCO)CC1	ZINC000875266102	GG	On-Demand	Anodyne	SIGMAR1	16	44
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)NC1CCN(CCO)CC1	ZINC000875266102	GG	On-Demand	Anodyne	MDM2	63	33
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000875266127	JE	On-Demand	Anodyne	TGM2	60	40
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000875266127	JE	On-Demand	Anodyne	F13A1	80	40
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000875266127	JE	On-Demand	Anodyne	MERTK	27	40
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000875266127	JE	On-Demand	Anodyne	NAMPT	28	47
O=C(NC1CCN(CCO)CC1)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875266152	GD	On-Demand	Anodyne	CHRM2	17	41
O=C(NC1CCN(CCO)CC1)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875266152	GD	On-Demand	Anodyne	CHRM1	25	41
O=C(NC1CCN(CCO)CC1)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875266152	GD	On-Demand	Anodyne	DRD2	19	49
O=C(NC1CCN(CCO)CC1)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875266152	GD	On-Demand	Anodyne	FKBP1A	41	44
O=C(NC1CCN(CCO)CC1)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875266152	GD	On-Demand	Anodyne	DRD4	26	49
O=C(NC1CCN(CCO)CC1)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875266152	GD	On-Demand	Anodyne	HTR4	33	41
O=C(NC1CCN(CCO)CC1)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875266152	GD	On-Demand	Anodyne	CHRM3	28	41
O=C(NC1CCN(CCO)CC1)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875266152	GD	On-Demand	Anodyne	LTA4H	34	47
O=C(NC1CCN(CCO)CC1)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875266152	GD	On-Demand	Anodyne	SIGMAR1	42	51
O=C(NC1CCN(CCO)CC1)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875266152	GD	On-Demand	Anodyne	CTSB	16	46
O=C(NC1CCN(CCO)CC1)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875266152	GD	On-Demand	Anodyne	CTSK	21	46
O=C(NC1CCN(CCO)CC1)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875266152	GD	On-Demand	Anodyne	CTSL	23	46
O=C(NC1CCN(CCO)CC1)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875266152	GD	On-Demand	Anodyne	PREP	36	42
O=C(NC1CCN(CCO)CC1)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875266152	GD	On-Demand	Anodyne	SLC6A5	31	46
O=C(NC1CCN(CCO)CC1)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875266152	GD	On-Demand	Anodyne	EPHX2	38	47
O=C(NC1CCN(CCO)CC1)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875266152	GD	On-Demand	Anodyne	MCHR1	24	41
O=C(NC1CCN(CCO)CC1)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875266152	GD	On-Demand	Anodyne	SHH	18	40
O=C(NC1CCN(CCO)CC1)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875266152	GD	On-Demand	Anodyne	SLC12A5	66	37
CC(C)(C)OC(=O)NC[C@H](NC(=O)C(=O)NCc1cccc(F)c1F)C1CC1	ZINC000875266159	GE	On-Demand	Anodyne	PAPA1_CARPA	27	40
CC(C)(C)OC(=O)NC[C@@H](NC(=O)C(=O)NCc1cccc(F)c1F)C1CC1	ZINC000875266161	GE	On-Demand	Anodyne	PAPA1_CARPA	27	40
CC[C@@H](NC(=O)C(=O)N1CCC(CO)(CO)CC1)C(C)(C)c1ccccc1	ZINC000875266164	GD	On-Demand	Anodyne	GHRHR	48	31
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)NC(=O)NC1CCCCC1	ZINC000875266171	GF	On-Demand	Anodyne	EPHX2	21	40
O=C(OCc1cccc(F)c1)C1(c2cccc(F)c2)CCC1	ZINC000875266193	DI	On-Demand	Anodyne	SLC12A5	76	42
COC(=O)c1ccc(OC)c2c1CCN(C(=O)NC1CCN(CCO)CC1)C2	ZINC000875266224	GD	On-Demand	Anodyne	HTR4	39	46
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266240	GG	On-Demand	Anodyne	ACE	56	40
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266240	GG	On-Demand	Anodyne	GHRHR	71	35
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266240	GG	On-Demand	Anodyne	MME	52	41
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266240	GG	On-Demand	Anodyne	MC4R	88	45
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266240	GG	On-Demand	Anodyne	CTRA_BOVIN	42	33
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266240	GG	On-Demand	Anodyne	TRY2_BOVIN	64	38
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266240	GG	On-Demand	Anodyne	TRY1_BOVIN	40	34
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266240	GG	On-Demand	Anodyne	CACNA1B	29	43
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266240	GG	On-Demand	Anodyne	NPFFR2	58	35
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266240	GG	On-Demand	Anodyne	CYP51A1	21	41
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266240	GG	On-Demand	Anodyne	TIMP3	77	37
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266240	GG	On-Demand	Anodyne	PREP	30	53
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266240	GG	On-Demand	Anodyne	MC3R	40	40
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266240	GG	On-Demand	Anodyne	MC5R	55	40
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266240	GG	On-Demand	Anodyne	CELA2A	42	33
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266240	GG	On-Demand	Anodyne	CCKBR	25	43
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266240	GG	On-Demand	Anodyne	CAPN1	38	40
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266240	GG	On-Demand	Anodyne	ACE2	61	38
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266240	GG	On-Demand	Anodyne	MC1R	28	40
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266240	GG	On-Demand	Anodyne	DPP7	51	37
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266240	GG	On-Demand	Anodyne	ST14	50	34
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266240	GG	On-Demand	Anodyne	CALCRL	19	40
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266240	GG	On-Demand	Anodyne	NPFFR1	44	35
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266240	GG	On-Demand	Anodyne	SLC12A5	47	34
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266241	GG	On-Demand	Anodyne	ACE	56	40
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266241	GG	On-Demand	Anodyne	GHRHR	71	35
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266241	GG	On-Demand	Anodyne	MME	52	41
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266241	GG	On-Demand	Anodyne	MC4R	88	45
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266241	GG	On-Demand	Anodyne	CTRA_BOVIN	42	33
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266241	GG	On-Demand	Anodyne	TRY2_BOVIN	64	38
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266241	GG	On-Demand	Anodyne	TRY1_BOVIN	40	34
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266241	GG	On-Demand	Anodyne	CACNA1B	29	43
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266241	GG	On-Demand	Anodyne	NPFFR2	58	35
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266241	GG	On-Demand	Anodyne	CYP51A1	21	41
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266241	GG	On-Demand	Anodyne	TIMP3	77	37
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266241	GG	On-Demand	Anodyne	PREP	30	53
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266241	GG	On-Demand	Anodyne	MC3R	40	40
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266241	GG	On-Demand	Anodyne	MC5R	55	40
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266241	GG	On-Demand	Anodyne	CELA2A	42	33
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266241	GG	On-Demand	Anodyne	CCKBR	25	43
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266241	GG	On-Demand	Anodyne	CAPN1	38	40
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266241	GG	On-Demand	Anodyne	ACE2	61	38
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266241	GG	On-Demand	Anodyne	MC1R	28	40
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266241	GG	On-Demand	Anodyne	DPP7	51	37
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266241	GG	On-Demand	Anodyne	ST14	50	34
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266241	GG	On-Demand	Anodyne	CALCRL	19	40
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266241	GG	On-Demand	Anodyne	NPFFR1	44	35
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266241	GG	On-Demand	Anodyne	SLC12A5	47	34
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266242	GG	On-Demand	Anodyne	ACE	56	40
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266242	GG	On-Demand	Anodyne	GHRHR	71	35
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266242	GG	On-Demand	Anodyne	MME	52	41
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266242	GG	On-Demand	Anodyne	MC4R	88	45
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266242	GG	On-Demand	Anodyne	CTRA_BOVIN	42	33
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266242	GG	On-Demand	Anodyne	TRY2_BOVIN	64	38
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266242	GG	On-Demand	Anodyne	TRY1_BOVIN	40	34
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266242	GG	On-Demand	Anodyne	CACNA1B	29	43
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266242	GG	On-Demand	Anodyne	NPFFR2	58	35
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266242	GG	On-Demand	Anodyne	CYP51A1	21	41
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266242	GG	On-Demand	Anodyne	TIMP3	77	37
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266242	GG	On-Demand	Anodyne	PREP	30	53
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266242	GG	On-Demand	Anodyne	MC3R	40	40
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266242	GG	On-Demand	Anodyne	MC5R	55	40
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266242	GG	On-Demand	Anodyne	CELA2A	42	33
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266242	GG	On-Demand	Anodyne	CCKBR	25	43
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266242	GG	On-Demand	Anodyne	CAPN1	38	40
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266242	GG	On-Demand	Anodyne	ACE2	61	38
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266242	GG	On-Demand	Anodyne	MC1R	28	40
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266242	GG	On-Demand	Anodyne	DPP7	51	37
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266242	GG	On-Demand	Anodyne	ST14	50	34
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266242	GG	On-Demand	Anodyne	CALCRL	19	40
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266242	GG	On-Demand	Anodyne	NPFFR1	44	35
O=C([C@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266242	GG	On-Demand	Anodyne	SLC12A5	47	34
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266243	GG	On-Demand	Anodyne	ACE	56	40
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266243	GG	On-Demand	Anodyne	GHRHR	71	35
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266243	GG	On-Demand	Anodyne	MME	52	41
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266243	GG	On-Demand	Anodyne	MC4R	88	45
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266243	GG	On-Demand	Anodyne	CTRA_BOVIN	42	33
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266243	GG	On-Demand	Anodyne	TRY2_BOVIN	64	38
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266243	GG	On-Demand	Anodyne	TRY1_BOVIN	40	34
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266243	GG	On-Demand	Anodyne	CACNA1B	29	43
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266243	GG	On-Demand	Anodyne	NPFFR2	58	35
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266243	GG	On-Demand	Anodyne	CYP51A1	21	41
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266243	GG	On-Demand	Anodyne	TIMP3	77	37
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266243	GG	On-Demand	Anodyne	PREP	30	53
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266243	GG	On-Demand	Anodyne	MC3R	40	40
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266243	GG	On-Demand	Anodyne	MC5R	55	40
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266243	GG	On-Demand	Anodyne	CELA2A	42	33
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266243	GG	On-Demand	Anodyne	CCKBR	25	43
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266243	GG	On-Demand	Anodyne	CAPN1	38	40
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266243	GG	On-Demand	Anodyne	ACE2	61	38
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266243	GG	On-Demand	Anodyne	MC1R	28	40
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266243	GG	On-Demand	Anodyne	DPP7	51	37
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266243	GG	On-Demand	Anodyne	ST14	50	34
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266243	GG	On-Demand	Anodyne	CALCRL	19	40
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266243	GG	On-Demand	Anodyne	NPFFR1	44	35
O=C([C@@H](Cc1ccccc1)NC(=O)C1([C@H]2CCCCO2)CCC1)N1CCCC1	ZINC000875266243	GG	On-Demand	Anodyne	SLC12A5	47	34
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)Nc1ccccc1F	ZINC000875266244	EH	On-Demand	Anodyne	KCNQ2	25	41
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NC1CCN(CCO)CC1	ZINC000875266251	GE	On-Demand	Anodyne	DRD2	17	43
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NC1CCN(CCO)CC1	ZINC000875266251	GE	On-Demand	Anodyne	DRD4	24	43
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NC1CCN(CCO)CC1	ZINC000875266251	GE	On-Demand	Anodyne	ACHE	17	40
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NC1CCN(CCO)CC1	ZINC000875266251	GE	On-Demand	Anodyne	CHRM3	17	42
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NC1CCN(CCO)CC1	ZINC000875266251	GE	On-Demand	Anodyne	LTA4H	23	43
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NC1CCN(CCO)CC1	ZINC000875266251	GE	On-Demand	Anodyne	SIGMAR1	39	47
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NC1CCN(CCO)CC1	ZINC000875266251	GE	On-Demand	Anodyne	CCR5	27	40
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NC1CCN(CCO)CC1	ZINC000875266251	GE	On-Demand	Anodyne	MCHR1	23	40
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NC1CCN(CCO)CC1	ZINC000875266251	GE	On-Demand	Anodyne	CACNA1G	23	40
O=C(NCc1ccc(Br)cn1)NC1CCN(CCO)CC1	ZINC000875266253	FD	On-Demand	Anodyne	SLC6A5	19	40
O=C(NCCSCCC(F)(F)F)NC1CCN(CCO)CC1	ZINC000875266258	ED	On-Demand	Anodyne	SLC6A5	20	42
O=C(NC1CCN(CCO)CC1)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875266270	FD	On-Demand	Anodyne	CHRNA7	47	38
O=C(NC1CCN(CCO)CC1)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875266270	FD	On-Demand	Anodyne	C3AR1	49	48
O=C(NC1CCN(CCO)CC1)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875266270	FD	On-Demand	Anodyne	SLC6A5	20	40
O=C(NC1CCN(CCO)CC1)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875266271	FD	On-Demand	Anodyne	CHRNA7	47	38
O=C(NC1CCN(CCO)CC1)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875266271	FD	On-Demand	Anodyne	C3AR1	49	48
O=C(NC1CCN(CCO)CC1)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875266271	FD	On-Demand	Anodyne	SLC6A5	20	40
COc1ccc([N+](=O)[O-])cc1COC(=O)C1(c2cccc(F)c2)CCC1	ZINC000875266286	FH	On-Demand	Bother	CACNA1D	58	38
O=C(NC1CCN(CCO)CC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875266317	ED	On-Demand	Anodyne	DRD4	19	42
O=C(NC1CCN(CCO)CC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875266317	ED	On-Demand	Anodyne	SIGMAR1	17	45
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000875266318	JF	On-Demand	Anodyne	APP	56	40
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000875266318	JF	On-Demand	Anodyne	TGM2	40	36
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000875266318	JF	On-Demand	Anodyne	F13A1	43	36
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)NC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000875266338	IH	On-Demand	Anodyne	EPHX2	83	41
O=C(NCc1ccc(C(F)(F)F)s1)NC1CCN(CCO)CC1	ZINC000875266360	FE	On-Demand	Anodyne	SLC6A5	30	46
COCC(C)(C)CCNC(=O)NC1CCN(CCO)CC1	ZINC000875266391	DC	On-Demand	Anodyne	HTR4	15	44
COCC(C)(C)CCNC(=O)NC1CCN(CCO)CC1	ZINC000875266391	DC	On-Demand	Anodyne	SLC6A5	20	40
O=C(NCC(F)(F)c1ccc(F)cc1F)NC1CCN(CCO)CC1	ZINC000875266417	FD	On-Demand	Anodyne	CCR3	35	42
O=C(NCC(F)(F)c1ccc(F)cc1F)NC1CCN(CCO)CC1	ZINC000875266417	FD	On-Demand	Anodyne	SLC6A5	28	43
O=C(NCC(F)(F)c1ccc(F)cc1F)NC1CCN(CCO)CC1	ZINC000875266417	FD	On-Demand	Anodyne	MCHR1	18	41
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(CCO)CC1	ZINC000875266418	FC	On-Demand	Anodyne	DRD2	15	43
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(CCO)CC1	ZINC000875266418	FC	On-Demand	Anodyne	DRD4	22	45
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(CCO)CC1	ZINC000875266418	FC	On-Demand	Anodyne	SIGMAR1	19	51
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(CCO)CC1	ZINC000875266418	FC	On-Demand	Anodyne	EPHX2	22	43
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(CCO)CC1	ZINC000875266418	FC	On-Demand	Anodyne	MCHR1	27	41
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(CCO)CC1	ZINC000875266419	FC	On-Demand	Anodyne	DRD2	15	43
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(CCO)CC1	ZINC000875266419	FC	On-Demand	Anodyne	DRD4	22	45
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(CCO)CC1	ZINC000875266419	FC	On-Demand	Anodyne	SIGMAR1	19	51
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(CCO)CC1	ZINC000875266419	FC	On-Demand	Anodyne	EPHX2	22	43
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(CCO)CC1	ZINC000875266419	FC	On-Demand	Anodyne	MCHR1	27	41
O=C(OCc1ccccc1[N+](=O)[O-])C1(c2cccc(F)c2)CCC1	ZINC000875266423	EH	On-Demand	Bother	COLA	87	38
O=C(COC(=O)C1(c2ccc(F)cc2)CCC1)NCC1(c2ccccc2)CC1	ZINC000875266457	GH	On-Demand	Anodyne	KCNA3	49	38
CC[C@@H](NC(=O)NC1CCN(CC(=O)N(C)C)CC1)[C@H](O)c1ccccc1	ZINC000875266468	GD	On-Demand	Anodyne	CCR5	44	46
CC[C@@H](NC(=O)NC1CCN(CC(=O)N(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000875266469	GD	On-Demand	Anodyne	CCR5	44	46
C[C@@H](NC(=O)NC1CCN(CCO)CC1)c1ccc(C(F)(F)F)nc1	ZINC000875266482	FD	On-Demand	Anodyne	SLC6A5	30	45
C[C@H](NC(=O)NC1CCN(CCO)CC1)c1ccc(C(F)(F)F)nc1	ZINC000875266483	FD	On-Demand	Anodyne	SLC6A5	30	45
COC(=O)C1CCN(C(=O)COC(=O)C2(c3cccc(F)c3)CCC2)CC1	ZINC000875266510	GE	On-Demand	Anodyne	PTR1	43	30
CN(Cc1ccc2cc[nH]c2c1)C(=O)NC1CCN(CCO)CC1	ZINC000875266517	ED	On-Demand	Anodyne	MCHR1	18	45
C[C@H](NC(=O)NC1CCN(CCO)CC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875266520	GD	On-Demand	Anodyne	EPHX2	20	45
C[C@H](NC(=O)NC1CCN(CCO)CC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875266520	GD	On-Demand	Anodyne	GPR119	23	41
C[C@@H](NC(=O)NC1CCN(CCO)CC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875266521	GD	On-Demand	Anodyne	EPHX2	20	45
C[C@@H](NC(=O)NC1CCN(CCO)CC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875266521	GD	On-Demand	Anodyne	GPR119	23	41
CCn1nc(C)c(CN(C)C(=O)C(=O)NCc2c(C)cccc2F)c1C	ZINC000875266548	FE	On-Demand	Anodyne	P2RX7	18	42
O=C(OCc1cc(=O)oc2cc3c(cc12)CCC3)C1(c2cccc(F)c2)CCC1	ZINC000875266553	GJ	On-Demand	Anodyne	MAOB	15	43
O=C(NCc1nc(C(F)(F)F)n2c1CCCC2)NC1CCN(CCO)CC1	ZINC000875266588	GD	On-Demand	Anodyne	SLC6A5	23	40
Cc1cncc([C@@H]2CCCN2C(=O)NC2CCN(CCO)CC2)c1	ZINC000875266589	ED	On-Demand	Anodyne	SSTR5	37	44
Cc1cncc([C@H]2CCCN2C(=O)NC2CCN(CCO)CC2)c1	ZINC000875266590	ED	On-Demand	Anodyne	SSTR5	37	44
O=C(NC1CCN(CCO)CC1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875266593	ED	On-Demand	Anodyne	OXTR	51	37
O=C(NC1CCN(CCO)CC1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875266593	ED	On-Demand	Anodyne	SIGMAR1	28	45
O=C(NC1CCN(CCO)CC1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875266594	ED	On-Demand	Anodyne	OXTR	51	37
O=C(NC1CCN(CCO)CC1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875266594	ED	On-Demand	Anodyne	SIGMAR1	28	45
O=C(NCCCCCCc1ccccc1)NC1CCN(CCO)CC1	ZINC000875266646	EF	On-Demand	Anodyne	HTR1A	28	41
O=C(NCCCCCCc1ccccc1)NC1CCN(CCO)CC1	ZINC000875266646	EF	On-Demand	Anodyne	CHRM1	21	42
O=C(NCCCCCCc1ccccc1)NC1CCN(CCO)CC1	ZINC000875266646	EF	On-Demand	Anodyne	DRD2	42	49
O=C(NCCCCCCc1ccccc1)NC1CCN(CCO)CC1	ZINC000875266646	EF	On-Demand	Anodyne	FKBP1A	29	44
O=C(NCCCCCCc1ccccc1)NC1CCN(CCO)CC1	ZINC000875266646	EF	On-Demand	Anodyne	DRD4	35	57
O=C(NCCCCCCc1ccccc1)NC1CCN(CCO)CC1	ZINC000875266646	EF	On-Demand	Anodyne	HRH2	22	44
O=C(NCCCCCCc1ccccc1)NC1CCN(CCO)CC1	ZINC000875266646	EF	On-Demand	Anodyne	HTR2A	29	57
O=C(NCCCCCCc1ccccc1)NC1CCN(CCO)CC1	ZINC000875266646	EF	On-Demand	Anodyne	OPRM1	17	53
O=C(NCCCCCCc1ccccc1)NC1CCN(CCO)CC1	ZINC000875266646	EF	On-Demand	Anodyne	DRD3	50	41
O=C(NCCCCCCc1ccccc1)NC1CCN(CCO)CC1	ZINC000875266646	EF	On-Demand	Anodyne	LTA4H	15	42
O=C(NCCCCCCc1ccccc1)NC1CCN(CCO)CC1	ZINC000875266646	EF	On-Demand	Anodyne	SIGMAR1	65	56
O=C(NCCCCCCc1ccccc1)NC1CCN(CCO)CC1	ZINC000875266646	EF	On-Demand	Anodyne	CCR3	49	50
O=C(NCCCCCCc1ccccc1)NC1CCN(CCO)CC1	ZINC000875266646	EF	On-Demand	Anodyne	SCN2A	20	44
O=C(NCCCCCCc1ccccc1)NC1CCN(CCO)CC1	ZINC000875266646	EF	On-Demand	Anodyne	CCR5	15	42
O=C(NCCCCCCc1ccccc1)NC1CCN(CCO)CC1	ZINC000875266646	EF	On-Demand	Anodyne	PREP	48	36
O=C(NCCCCCCc1ccccc1)NC1CCN(CCO)CC1	ZINC000875266646	EF	On-Demand	Anodyne	MTNR1A	21	44
O=C(NCCCCCCc1ccccc1)NC1CCN(CCO)CC1	ZINC000875266646	EF	On-Demand	Anodyne	MTNR1B	21	44
O=C(NCCCCCCc1ccccc1)NC1CCN(CCO)CC1	ZINC000875266646	EF	On-Demand	Anodyne	FAAH	31	42
O=C(NCCCCCCc1ccccc1)NC1CCN(CCO)CC1	ZINC000875266646	EF	On-Demand	Anodyne	SLC6A5	45	43
O=C(NCCCCCCc1ccccc1)NC1CCN(CCO)CC1	ZINC000875266646	EF	On-Demand	Anodyne	EPHX2	35	54
O=C(NCCCCCCc1ccccc1)NC1CCN(CCO)CC1	ZINC000875266646	EF	On-Demand	Anodyne	TGM2	21	42
O=C(NCCCCCCc1ccccc1)NC1CCN(CCO)CC1	ZINC000875266646	EF	On-Demand	Anodyne	MCHR1	28	41
O=C(NCCCCCCc1ccccc1)NC1CCN(CCO)CC1	ZINC000875266646	EF	On-Demand	Anodyne	CACNA1G	18	41
O=C(NCCCCCCc1ccccc1)NC1CCN(CCO)CC1	ZINC000875266646	EF	On-Demand	Anodyne	CYP2J2	46	35
O=C(NC1CCN(CCO)CC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875266649	GD	On-Demand	Anodyne	SMO	38	46
O=C(NC1CCN(CCO)CC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875266649	GD	On-Demand	Anodyne	ETHR	56	49
CCOC(=O)C1=C(COC(=O)C2(c3cccc(F)c3)CCC2)NC(=O)N[C@@H]1c1ccc(OC)cc1	ZINC000875266652	JH	On-Demand	Anodyne	SLC27A4	71	32
CCOC(=O)C1=C(COC(=O)C2(c3cccc(F)c3)CCC2)NC(=O)N[C@H]1c1ccc(OC)cc1	ZINC000875266653	JH	On-Demand	Anodyne	SLC27A4	71	32
CCC(CC)(CNC(=O)NC1CCN(CCO)CC1)C(F)(F)F	ZINC000875266659	EE	On-Demand	Anodyne	SLC6A5	24	42
O=C(NC1CCN(CCO)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875266662	FC	On-Demand	Anodyne	CHRM2	20	44
O=C(NC1CCN(CCO)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875266662	FC	On-Demand	Anodyne	CHRM1	18	44
O=C(NC1CCN(CCO)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875266662	FC	On-Demand	Anodyne	DRD2	22	50
O=C(NC1CCN(CCO)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875266662	FC	On-Demand	Anodyne	DRD4	42	51
O=C(NC1CCN(CCO)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875266662	FC	On-Demand	Anodyne	ACHE	34	42
O=C(NC1CCN(CCO)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875266662	FC	On-Demand	Anodyne	DRD3	16	50
O=C(NC1CCN(CCO)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875266662	FC	On-Demand	Anodyne	HTR4	20	42
O=C(NC1CCN(CCO)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875266662	FC	On-Demand	Anodyne	CHRM3	30	44
O=C(NC1CCN(CCO)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875266662	FC	On-Demand	Anodyne	LTA4H	20	41
O=C(NC1CCN(CCO)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875266662	FC	On-Demand	Anodyne	SIGMAR1	62	54
O=C(NC1CCN(CCO)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875266662	FC	On-Demand	Anodyne	CCR3	36	48
O=C(NC1CCN(CCO)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875266662	FC	On-Demand	Anodyne	MCHR1	32	44
O=C(NC1CCN(CCO)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875266662	FC	On-Demand	Anodyne	CACNA1G	19	43
O=C(NC1CCN(CCO)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875266662	FC	On-Demand	Anodyne	CCR8	18	40
CC[C@@H](NC(=O)NC1CCN(CCO)CC1)c1cccc(OC)c1OC	ZINC000875266673	FD	On-Demand	Anodyne	DRD2	26	47
CC[C@@H](NC(=O)NC1CCN(CCO)CC1)c1cccc(OC)c1OC	ZINC000875266673	FD	On-Demand	Anodyne	DRD3	22	46
CC[C@@H](NC(=O)NC1CCN(CCO)CC1)c1cccc(OC)c1OC	ZINC000875266673	FD	On-Demand	Anodyne	HTR4	43	44
CC[C@@H](NC(=O)NC1CCN(CCO)CC1)c1cccc(OC)c1OC	ZINC000875266673	FD	On-Demand	Anodyne	HTR7	24	41
O=C(NCc1cn(C(F)F)c2ccccc12)NC1CCN(CCO)CC1	ZINC000875266674	FE	On-Demand	Anodyne	SIGMAR1	15	42
COC[C@H](NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1)C1CC1	ZINC000875266675	GD	On-Demand	Anodyne	ETHR	59	47
COC[C@@H](NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1)C1CC1	ZINC000875266676	GD	On-Demand	Anodyne	ETHR	59	47
COC[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875266700	GD	On-Demand	Anodyne	DRD2	25	46
COC[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875266700	GD	On-Demand	Anodyne	DRD4	44	46
COC[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875266700	GD	On-Demand	Anodyne	ACHE	63	56
COC[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875266700	GD	On-Demand	Anodyne	DRD3	19	45
COC[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875266700	GD	On-Demand	Anodyne	SLC6A3	27	50
COC[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875266700	GD	On-Demand	Anodyne	HTR4	31	44
COC[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875266700	GD	On-Demand	Anodyne	SIGMAR1	53	46
COC[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875266700	GD	On-Demand	Anodyne	BCHE	18	48
COC[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875266700	GD	On-Demand	Anodyne	MCHR1	23	42
COC[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875266700	GD	On-Demand	Anodyne	CACNA1I	50	36
COC[C@@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875266701	GD	On-Demand	Anodyne	DRD2	25	46
COC[C@@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875266701	GD	On-Demand	Anodyne	DRD4	44	46
COC[C@@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875266701	GD	On-Demand	Anodyne	ACHE	63	56
COC[C@@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875266701	GD	On-Demand	Anodyne	DRD3	19	45
COC[C@@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875266701	GD	On-Demand	Anodyne	SLC6A3	27	50
COC[C@@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875266701	GD	On-Demand	Anodyne	HTR4	31	44
COC[C@@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875266701	GD	On-Demand	Anodyne	SIGMAR1	53	46
COC[C@@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875266701	GD	On-Demand	Anodyne	BCHE	18	48
COC[C@@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875266701	GD	On-Demand	Anodyne	MCHR1	23	42
COC[C@@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000875266701	GD	On-Demand	Anodyne	CACNA1I	50	36
O=C(NC1CCN(CCO)CC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875266704	ED	On-Demand	Anodyne	DRD4	18	41
O=C(NC1CCN(CCO)CC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875266704	ED	On-Demand	Anodyne	SIGMAR1	24	41
O=C(NC1CCN(CCO)CC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875266704	ED	On-Demand	Anodyne	CCR5	32	42
O=C(NC1CCN(CCO)CC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875266704	ED	On-Demand	Anodyne	EPHX2	25	41
COC[C@H](NC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1)C1CC1	ZINC000875266711	GC	On-Demand	Clean	DRD2	21	41
COC[C@H](NC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1)C1CC1	ZINC000875266711	GC	On-Demand	Clean	ADRA1D	20	40
COC[C@H](NC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1)C1CC1	ZINC000875266711	GC	On-Demand	Clean	ADRA1A	17	40
COC[C@@H](NC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1)C1CC1	ZINC000875266712	GC	On-Demand	Clean	DRD2	21	41
COC[C@@H](NC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1)C1CC1	ZINC000875266712	GC	On-Demand	Clean	ADRA1D	20	40
COC[C@@H](NC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1)C1CC1	ZINC000875266712	GC	On-Demand	Clean	ADRA1A	17	40
O=C(NNc1cccc(F)c1Cl)NC1CCN(CCO)CC1	ZINC000875266718	ED	On-Demand	Reactive	SIGMAR1	17	44
O=C(NNc1cccc(F)c1Cl)NC1CCN(CCO)CC1	ZINC000875266718	ED	On-Demand	Reactive	SLC6A5	25	42
COc1ccccc1-c1nc(COC(=O)C2(c3cccc(F)c3)CCC2)cs1	ZINC000875266719	GK	On-Demand	Anodyne	SLC12A5	45	35
COC[C@@H](NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1)C1CC1	ZINC000875266721	FD	On-Demand	Anodyne	ROCK1	25	44
COC[C@@H](NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1)C1CC1	ZINC000875266721	FD	On-Demand	Anodyne	ROCK2	17	44
COC[C@H](NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1)C1CC1	ZINC000875266722	FD	On-Demand	Anodyne	ROCK1	25	44
COC[C@H](NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1)C1CC1	ZINC000875266722	FD	On-Demand	Anodyne	ROCK2	17	44
O=C(NCC1(c2cccc(Cl)c2)CCC1)NC1CCN(CCO)CC1	ZINC000875266727	FF	On-Demand	Anodyne	SIGMAR1	17	44
O=C(NCC1(c2cccc(Cl)c2)CCC1)NC1CCN(CCO)CC1	ZINC000875266727	FF	On-Demand	Anodyne	EPHX2	20	44
O=C(NCC1(c2cccc(Cl)c2)CCC1)NC1CCN(CCO)CC1	ZINC000875266727	FF	On-Demand	Anodyne	CXCR3	16	45
O=C(NCC1(c2cccc(Cl)c2)CCC1)NC1CCN(CCO)CC1	ZINC000875266727	FF	On-Demand	Anodyne	MCHR1	39	41
O=C(NCC1(c2cccc(Cl)c2)CCC1)NC1CCN(CCO)CC1	ZINC000875266727	FF	On-Demand	Anodyne	CACNA1I	30	47
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(OC(F)F)cn1	ZINC000875266730	GF	On-Demand	Anodyne	PDS	45	33
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(OC(F)F)cn1	ZINC000875266731	GF	On-Demand	Anodyne	PDS	45	33
O=C(NC1CCN(CCO)CC1)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875266732	FD	On-Demand	Anodyne	HTR1A	16	41
O=C(NC1CCN(CCO)CC1)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875266732	FD	On-Demand	Anodyne	DRD2	22	40
O=C(NC1CCN(CCO)CC1)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875266732	FD	On-Demand	Anodyne	ADRA1B	15	47
O=C(NC1CCN(CCO)CC1)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875266732	FD	On-Demand	Anodyne	DRD3	15	40
O=C(NC1CCN(CCO)CC1)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875266732	FD	On-Demand	Anodyne	HTR7	27	40
O=C(NC1CCN(CCO)CC1)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875266732	FD	On-Demand	Anodyne	SIGMAR1	16	44
O=C(NC1CCN(CCO)CC1)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875266732	FD	On-Demand	Anodyne	CCR3	55	47
COc1ccccc1[C@H]1CN(C(=O)NC2CCN(CCO)CC2)CCO1	ZINC000875266789	FD	On-Demand	Anodyne	DRD2	38	44
COc1ccccc1[C@H]1CN(C(=O)NC2CCN(CCO)CC2)CCO1	ZINC000875266789	FD	On-Demand	Anodyne	DRD4	37	41
COc1ccccc1[C@H]1CN(C(=O)NC2CCN(CCO)CC2)CCO1	ZINC000875266789	FD	On-Demand	Anodyne	ADRA1D	41	33
COc1ccccc1[C@H]1CN(C(=O)NC2CCN(CCO)CC2)CCO1	ZINC000875266789	FD	On-Demand	Anodyne	ADRA1B	40	33
COc1ccccc1[C@H]1CN(C(=O)NC2CCN(CCO)CC2)CCO1	ZINC000875266789	FD	On-Demand	Anodyne	HTR4	36	43
COc1ccccc1[C@H]1CN(C(=O)NC2CCN(CCO)CC2)CCO1	ZINC000875266789	FD	On-Demand	Anodyne	SIGMAR1	19	42
COc1ccccc1[C@H]1CN(C(=O)NC2CCN(CCO)CC2)CCO1	ZINC000875266789	FD	On-Demand	Anodyne	MCHR1	17	41
COc1ccccc1[C@H]1CN(C(=O)NC2CCN(CCO)CC2)CCO1	ZINC000875266789	FD	On-Demand	Anodyne	SHH	18	41
COc1ccccc1[C@@H]1CN(C(=O)NC2CCN(CCO)CC2)CCO1	ZINC000875266791	FD	On-Demand	Anodyne	DRD2	38	44
COc1ccccc1[C@@H]1CN(C(=O)NC2CCN(CCO)CC2)CCO1	ZINC000875266791	FD	On-Demand	Anodyne	DRD4	37	41
COc1ccccc1[C@@H]1CN(C(=O)NC2CCN(CCO)CC2)CCO1	ZINC000875266791	FD	On-Demand	Anodyne	ADRA1D	41	33
COc1ccccc1[C@@H]1CN(C(=O)NC2CCN(CCO)CC2)CCO1	ZINC000875266791	FD	On-Demand	Anodyne	ADRA1B	40	33
COc1ccccc1[C@@H]1CN(C(=O)NC2CCN(CCO)CC2)CCO1	ZINC000875266791	FD	On-Demand	Anodyne	HTR4	36	43
COc1ccccc1[C@@H]1CN(C(=O)NC2CCN(CCO)CC2)CCO1	ZINC000875266791	FD	On-Demand	Anodyne	SIGMAR1	19	42
COc1ccccc1[C@@H]1CN(C(=O)NC2CCN(CCO)CC2)CCO1	ZINC000875266791	FD	On-Demand	Anodyne	MCHR1	17	41
COc1ccccc1[C@@H]1CN(C(=O)NC2CCN(CCO)CC2)CCO1	ZINC000875266791	FD	On-Demand	Anodyne	SHH	18	41
O=CN1CCCN(C(=O)NCCCNC(=O)c2ccc(F)cc2)CC1	ZINC000875266792	FC	On-Demand	Anodyne	DRD3	22	45
O=CN1CCCN(C(=O)NCCCNC(=O)c2ccc(F)cc2)CC1	ZINC000875266792	FC	On-Demand	Anodyne	BCHE	21	42
O=C(NC1CCN(CCO)CC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875266793	ED	On-Demand	Anodyne	DRD4	17	40
O=C(NC1CCN(CCO)CC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875266793	ED	On-Demand	Anodyne	SIGMAR1	21	40
O=C(NC1CCN(CCO)CC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875266793	ED	On-Demand	Anodyne	CCR5	19	40
O=C(NC1CCN(CCO)CC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875266795	ED	On-Demand	Anodyne	DRD4	17	40
O=C(NC1CCN(CCO)CC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875266795	ED	On-Demand	Anodyne	SIGMAR1	21	40
O=C(NC1CCN(CCO)CC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875266795	ED	On-Demand	Anodyne	CCR5	19	40
O=C(NC1CCN(CCO)CC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875266797	ED	On-Demand	Anodyne	DRD4	17	40
O=C(NC1CCN(CCO)CC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875266797	ED	On-Demand	Anodyne	SIGMAR1	21	40
O=C(NC1CCN(CCO)CC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875266797	ED	On-Demand	Anodyne	CCR5	19	40
O=C(NC1CCN(CCO)CC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875266799	ED	On-Demand	Anodyne	DRD4	17	40
O=C(NC1CCN(CCO)CC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875266799	ED	On-Demand	Anodyne	SIGMAR1	21	40
O=C(NC1CCN(CCO)CC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875266799	ED	On-Demand	Anodyne	CCR5	19	40
CC[C@@H]1COCCN1CCNC(=O)NCCNC(=O)c1ccc(C)cc1	ZINC000875266815	FD	On-Demand	Anodyne	HPGDS	24	41
CN1CCC(CNC(=O)NC2CCN(CCO)CC2)(c2ccccc2)CC1	ZINC000875266824	FD	On-Demand	Anodyne	KCNA3	53	45
CN1CCC(CNC(=O)NC2CCN(CCO)CC2)(c2ccccc2)CC1	ZINC000875266824	FD	On-Demand	Anodyne	SOAT1	17	46
CN1CCC(CNC(=O)NC2CCN(CCO)CC2)(c2ccccc2)CC1	ZINC000875266824	FD	On-Demand	Anodyne	EPHX2	27	41
CN1CCC(CNC(=O)NC2CCN(CCO)CC2)(c2ccccc2)CC1	ZINC000875266824	FD	On-Demand	Anodyne	MCHR1	19	44
CN1CCC(CNC(=O)NC2CCN(CCO)CC2)(c2ccccc2)CC1	ZINC000875266824	FD	On-Demand	Anodyne	CACNA1G	17	42
O=C(N[C@H]1CCC[C@@H](c2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875266858	FD	On-Demand	Anodyne	EPHX2	22	41
O=C(N[C@@H]1CCC[C@@H](c2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875266859	FD	On-Demand	Anodyne	EPHX2	22	41
O=C(N[C@H]1CCC[C@H](c2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875266860	FD	On-Demand	Anodyne	EPHX2	22	41
O=C(N[C@@H]1CCC[C@H](c2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875266862	FD	On-Demand	Anodyne	EPHX2	22	41
O=C(NCCCNC(=O)N1Cc2cccc(O)c2C1)c1ccc(F)cc1	ZINC000875266886	FE	On-Demand	Clean	DRD3	25	43
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000875266891	JE	On-Demand	Anodyne	NAMPT	56	46
CCCCCCCNC(=O)C(=O)NCc1cc(CC)ccn1	ZINC000875266893	DE	On-Demand	Mild	S1PR2	44	33
CCCCCCCNC(=O)C(=O)NCc1cc(CC)ccn1	ZINC000875266893	DE	On-Demand	Mild	ASAH1	85	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875266898	FD	On-Demand	Anodyne	DRD4	23	45
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875266898	FD	On-Demand	Anodyne	SLC6A1	60	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875266898	FD	On-Demand	Anodyne	SIGMAR1	30	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875266898	FD	On-Demand	Anodyne	MLNR	47	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875266899	FD	On-Demand	Anodyne	DRD4	23	45
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875266899	FD	On-Demand	Anodyne	SLC6A1	60	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875266899	FD	On-Demand	Anodyne	SIGMAR1	30	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875266899	FD	On-Demand	Anodyne	MLNR	47	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875266900	FD	On-Demand	Anodyne	DRD4	23	45
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875266900	FD	On-Demand	Anodyne	SLC6A1	60	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875266900	FD	On-Demand	Anodyne	SIGMAR1	30	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875266900	FD	On-Demand	Anodyne	MLNR	47	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875266901	FD	On-Demand	Anodyne	DRD4	23	45
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875266901	FD	On-Demand	Anodyne	SLC6A1	60	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875266901	FD	On-Demand	Anodyne	SIGMAR1	30	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875266901	FD	On-Demand	Anodyne	MLNR	47	35
O=C(NC1CCN(CCO)CC1)N[C@H]1CCc2ccc(Cl)cc21	ZINC000875266915	EE	On-Demand	Anodyne	DRD2	15	42
O=C(NC1CCN(CCO)CC1)N[C@H]1CCc2ccc(Cl)cc21	ZINC000875266915	EE	On-Demand	Anodyne	HTR2A	23	42
O=C(NC1CCN(CCO)CC1)N[C@H]1CCc2ccc(Cl)cc21	ZINC000875266915	EE	On-Demand	Anodyne	HTR4	16	41
O=C(NC1CCN(CCO)CC1)N[C@H]1CCc2ccc(Cl)cc21	ZINC000875266915	EE	On-Demand	Anodyne	SIGMAR1	18	44
O=C(NC1CCN(CCO)CC1)N[C@@H]1CCc2ccc(Cl)cc21	ZINC000875266916	EE	On-Demand	Anodyne	DRD2	15	42
O=C(NC1CCN(CCO)CC1)N[C@@H]1CCc2ccc(Cl)cc21	ZINC000875266916	EE	On-Demand	Anodyne	HTR2A	23	42
O=C(NC1CCN(CCO)CC1)N[C@@H]1CCc2ccc(Cl)cc21	ZINC000875266916	EE	On-Demand	Anodyne	HTR4	16	41
O=C(NC1CCN(CCO)CC1)N[C@@H]1CCc2ccc(Cl)cc21	ZINC000875266916	EE	On-Demand	Anodyne	SIGMAR1	18	44
CS[C@@H]1C[C@@H](NC(=O)NC2CCN(CCO)CC2)C1	ZINC000875266925	CC	On-Demand	Anodyne	EPHX2	15	44
O=C(NCc1noc2ccc(F)cc12)NC1CCN(CCO)CC1	ZINC000875266927	ED	On-Demand	Anodyne	DRD2	21	41
O=C(NCc1noc2ccc(F)cc12)NC1CCN(CCO)CC1	ZINC000875266927	ED	On-Demand	Anodyne	CCR3	35	41
O=C(NCc1noc2ccc(F)cc12)NC1CCN(CCO)CC1	ZINC000875266927	ED	On-Demand	Anodyne	MCHR1	20	45
COc1ccc(N2CCN(C(=O)COC(=O)C3(c4cccc(F)c4)CCC3)CC2)cc1	ZINC000875266929	IG	On-Demand	Clean	NPBWR1	55	33
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)N1CCN(S(=O)(=O)c2cccc(F)c2)CC1	ZINC000875266968	JE	On-Demand	Anodyne	PKM	27	41
O=C(OCc1ccc(F)c(F)c1)C1(c2cccc(F)c2)CCC1	ZINC000875266976	DI	On-Demand	Anodyne	SLC12A5	63	38
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875266991	GC	On-Demand	Anodyne	DRD4	27	48
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875266991	GC	On-Demand	Anodyne	SIGMAR1	44	42
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875266992	GC	On-Demand	Anodyne	DRD4	27	48
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875266992	GC	On-Demand	Anodyne	SIGMAR1	44	42
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875266993	GC	On-Demand	Anodyne	DRD4	27	48
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875266993	GC	On-Demand	Anodyne	SIGMAR1	44	42
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875266994	GC	On-Demand	Anodyne	DRD4	27	48
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875266994	GC	On-Demand	Anodyne	SIGMAR1	44	42
O=C(NC1CCN(CCO)CC1)N1CC2(CC(=O)N2Cc2ccccc2)C1	ZINC000875267001	FC	On-Demand	Anodyne	CHRM1	17	40
O=C(NC1CCN(CCO)CC1)N1CC2(CC(=O)N2Cc2ccccc2)C1	ZINC000875267001	FC	On-Demand	Anodyne	DRD4	25	46
O=C(NC1CCN(CCO)CC1)N1CC2(CC(=O)N2Cc2ccccc2)C1	ZINC000875267001	FC	On-Demand	Anodyne	LTA4H	19	40
O=C(NC1CCN(CCO)CC1)N1CC2(CC(=O)N2Cc2ccccc2)C1	ZINC000875267001	FC	On-Demand	Anodyne	SIGMAR1	36	46
O=C(NC1CCN(CCO)CC1)N1CC2(CC(=O)N2Cc2ccccc2)C1	ZINC000875267001	FC	On-Demand	Anodyne	CCR3	34	44
O=C(NC1CCN(CCO)CC1)N1CC2(CC(=O)N2Cc2ccccc2)C1	ZINC000875267001	FC	On-Demand	Anodyne	MCHR1	23	41
O=C1c2ccccc2S(=O)(=O)N1CCOC(=O)C1(c2cccc(F)c2)CCC1	ZINC000875267005	HF	On-Demand	Anodyne	ELANE	17	44
COC[C@@H](NC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1C)C1CC1	ZINC000875267018	GD	On-Demand	Anodyne	SLC18A2	50	35
COC[C@H](NC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1C)C1CC1	ZINC000875267020	GD	On-Demand	Anodyne	SLC18A2	50	35
COC[C@@H](NC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1C)C1CC1	ZINC000875267021	GD	On-Demand	Anodyne	SLC18A2	50	35
COC[C@H](NC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1C)C1CC1	ZINC000875267022	GD	On-Demand	Anodyne	SLC18A2	50	35
O=C(NC1CCN(CCO)CC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875267037	FD	On-Demand	Anodyne	DRD4	17	41
O=C(NC1CCN(CCO)CC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875267037	FD	On-Demand	Anodyne	SIGMAR1	24	40
CN1CCN(C(=O)NCCCNC(=O)c2ccc(F)cc2)CCC1(C)C	ZINC000875267064	FE	On-Demand	Anodyne	DRD2	17	44
CN1CCN(C(=O)NCCCNC(=O)c2ccc(F)cc2)CCC1(C)C	ZINC000875267064	FE	On-Demand	Anodyne	DRD3	25	44
CN1CCN(C(=O)NCCCNC(=O)c2ccc(F)cc2)CCC1(C)C	ZINC000875267064	FE	On-Demand	Anodyne	PLD2	60	42
C[C@@H](CNC(=O)N1CCCN(C=O)CC1)N(C)Cc1ccccc1	ZINC000875267067	ED	On-Demand	Anodyne	Q6PRC7_IXORI	48	38
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NC1CCN(CCO)CC1	ZINC000875267071	FD	On-Demand	Anodyne	DRD4	15	41
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NC1CCN(CCO)CC1	ZINC000875267071	FD	On-Demand	Anodyne	HTR4	15	40
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NC1CCN(CCO)CC1	ZINC000875267071	FD	On-Demand	Anodyne	SIGMAR1	18	45
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NC1CCN(CCO)CC1	ZINC000875267071	FD	On-Demand	Anodyne	SLC6A5	30	43
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NC1CCN(CCO)CC1	ZINC000875267071	FD	On-Demand	Anodyne	EPHX2	22	41
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NC1CCN(CCO)CC1	ZINC000875267071	FD	On-Demand	Anodyne	MCHR1	25	42
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NC1CCN(CCO)CC1	ZINC000875267071	FD	On-Demand	Anodyne	CACNA1I	42	33
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)N1CCN(S(=O)(=O)c2c(F)cccc2F)CC1	ZINC000875267077	JF	On-Demand	Anodyne	PKM	22	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)N(C)Cc1ccccc1	ZINC000875267084	FE	On-Demand	Anodyne	SLC6A4	22	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)N(C)Cc1ccccc1	ZINC000875267084	FE	On-Demand	Anodyne	SLC6A3	51	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)N(C)Cc1ccccc1	ZINC000875267085	FE	On-Demand	Anodyne	SLC6A4	22	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)N(C)Cc1ccccc1	ZINC000875267085	FE	On-Demand	Anodyne	SLC6A3	51	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)N(C)Cc1ccccc1	ZINC000875267086	FE	On-Demand	Anodyne	SLC6A4	22	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)N(C)Cc1ccccc1	ZINC000875267086	FE	On-Demand	Anodyne	SLC6A3	51	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)N(C)Cc1ccccc1	ZINC000875267087	FE	On-Demand	Anodyne	SLC6A4	22	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)N(C)Cc1ccccc1	ZINC000875267087	FE	On-Demand	Anodyne	SLC6A3	51	42
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H](C)N(C)Cc2ccccc2)C1	ZINC000875267093	FE	On-Demand	Anodyne	CAPN2	40	33
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H](C)N(C)Cc2ccccc2)C1	ZINC000875267094	FE	On-Demand	Anodyne	CAPN2	40	33
COCCN(CC1CCN(C)CC1)C(=O)NCCNC(=O)c1ccc(C)cc1	ZINC000875267106	GD	On-Demand	Anodyne	CACNA1I	59	42
O=C(NC1CCN(CCO)CC1)N1CCC[C@@](F)(c2ccccc2)C1	ZINC000875267146	EE	On-Demand	Anodyne	CCR3	18	41
O=C(NC1CCN(CCO)CC1)N1CCC[C@@](F)(c2ccccc2)C1	ZINC000875267146	EE	On-Demand	Anodyne	EPHX2	19	43
O=C(NC1CCN(CCO)CC1)N1CCC[C@](F)(c2ccccc2)C1	ZINC000875267148	EE	On-Demand	Anodyne	CCR3	18	41
O=C(NC1CCN(CCO)CC1)N1CCC[C@](F)(c2ccccc2)C1	ZINC000875267148	EE	On-Demand	Anodyne	EPHX2	19	43
O=C(NCCCCC1CC1)NC1CCN(CCO)CC1	ZINC000875267207	CD	On-Demand	Anodyne	SLC6A5	16	41
O=C(NC1CCN(CCO)CC1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000875267218	GF	On-Demand	Anodyne	DRD2	17	42
O=C(NC1CCN(CCO)CC1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000875267218	GF	On-Demand	Anodyne	DRD4	25	49
O=C(NC1CCN(CCO)CC1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000875267218	GF	On-Demand	Anodyne	DRD3	17	42
O=C(NC1CCN(CCO)CC1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000875267218	GF	On-Demand	Anodyne	HTR4	48	42
O=C(NC1CCN(CCO)CC1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000875267218	GF	On-Demand	Anodyne	SIGMAR1	27	52
O=C(NC1CCN(CCO)CC1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000875267218	GF	On-Demand	Anodyne	CCR3	43	41
O=C(NC1CCN(CCO)CC1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000875267218	GF	On-Demand	Anodyne	EPHX2	39	40
O=C(NC1CCN(CCO)CC1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000875267218	GF	On-Demand	Anodyne	MCHR1	17	40
O=C(NC1CCN(CCO)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875267222	ED	On-Demand	Anodyne	EPHX2	19	44
O=C(NC1CCN(CCO)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875267223	ED	On-Demand	Anodyne	EPHX2	19	44
COc1ccc([C@@H]2CN(C(=O)NC3CCN(CCO)CC3)CCO2)cc1	ZINC000875267268	FD	On-Demand	Anodyne	HTR4	16	41
COc1ccc([C@@H]2CN(C(=O)NC3CCN(CCO)CC3)CCO2)cc1	ZINC000875267268	FD	On-Demand	Anodyne	PDK1	40	33
COc1ccc([C@@H]2CN(C(=O)NC3CCN(CCO)CC3)CCO2)cc1	ZINC000875267268	FD	On-Demand	Anodyne	MCHR1	23	42
O=C(OCc1nc(-c2cccc(Cl)c2)no1)C1(c2cccc(F)c2)CCC1	ZINC000875267292	GJ	On-Demand	Anodyne	GRM5	16	46
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)C1(c2cccc(F)c2)CCC1	ZINC000875267304	FD	On-Demand	Anodyne	CPT1A	53	38
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)C1(c2cccc(F)c2)CCC1	ZINC000875267304	FD	On-Demand	Anodyne	CPT2	48	37
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)C1(c2cccc(F)c2)CCC1	ZINC000875267305	FD	On-Demand	Anodyne	CPT1A	53	38
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)C1(c2cccc(F)c2)CCC1	ZINC000875267305	FD	On-Demand	Anodyne	CPT2	48	37
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](C)N(C)Cc1ccccc1	ZINC000875267307	DE	On-Demand	Anodyne	FCER2	44	31
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](C)N(C)Cc1ccccc1	ZINC000875267307	DE	On-Demand	Anodyne	CAPN2	55	34
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](C)N(C)Cc1ccccc1	ZINC000875267307	DE	On-Demand	Anodyne	NPR	40	32
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](C)N(C)Cc1ccccc1	ZINC000875267307	DE	On-Demand	Anodyne	PDS	40	32
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](C)N(C)Cc1ccccc1	ZINC000875267308	DE	On-Demand	Anodyne	FCER2	44	31
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](C)N(C)Cc1ccccc1	ZINC000875267308	DE	On-Demand	Anodyne	CAPN2	55	34
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](C)N(C)Cc1ccccc1	ZINC000875267308	DE	On-Demand	Anodyne	NPR	40	32
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](C)N(C)Cc1ccccc1	ZINC000875267308	DE	On-Demand	Anodyne	PDS	40	32
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)NC1CCN(CCO)CC1	ZINC000875267322	EC	On-Demand	Anodyne	SLC6A5	24	41
O=C(NC[C@H]1CC(C(F)(F)F)=NO1)NC1CCN(CCO)CC1	ZINC000875267323	EC	On-Demand	Anodyne	SLC6A5	24	41
O=C(NC1CCN(CCO)CC1)N1Cc2cccc(O)c2C1	ZINC000875267344	DC	On-Demand	Clean	DRD4	17	42
O=C(NC1CCN(CCO)CC1)N1Cc2cccc(O)c2C1	ZINC000875267344	DC	On-Demand	Clean	SIGMAR1	15	43
COC[C@H](NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1)C1CC1	ZINC000875267350	FD	On-Demand	Anodyne	PTAFR	23	42
COC[C@H](NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1)C1CC1	ZINC000875267350	FD	On-Demand	Anodyne	C3AR1	40	41
COC[C@@H](NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1)C1CC1	ZINC000875267351	FD	On-Demand	Anodyne	PTAFR	23	42
COC[C@@H](NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1)C1CC1	ZINC000875267351	FD	On-Demand	Anodyne	C3AR1	40	41
COC[C@H](NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1)C1CC1	ZINC000875267352	FD	On-Demand	Anodyne	PTAFR	23	42
COC[C@H](NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1)C1CC1	ZINC000875267352	FD	On-Demand	Anodyne	C3AR1	40	41
COC[C@@H](NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1)C1CC1	ZINC000875267353	FD	On-Demand	Anodyne	PTAFR	23	42
COC[C@@H](NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1)C1CC1	ZINC000875267353	FD	On-Demand	Anodyne	C3AR1	40	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(c3ccccc3Cl)C2=O)C1	ZINC000875267420	GE	On-Demand	Anodyne	ACE	29	47
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(c3ccccc3Cl)C2=O)C1	ZINC000875267421	GE	On-Demand	Anodyne	ACE	29	47
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(Br)cc1C	ZINC000875267429	EG	On-Demand	Anodyne	ANPEP	15	44
COC(=O)c1cccc(COC(=O)C2(c3cccc(F)c3)CCC2)c1	ZINC000875267444	EH	On-Demand	Anodyne	SLC12A5	64	37
O=C(NC1CCN(CCO)CC1)N[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1	ZINC000875267448	GC	On-Demand	Anodyne	DRD4	17	47
O=C(NC1CCN(CCO)CC1)N[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1	ZINC000875267448	GC	On-Demand	Anodyne	SIGMAR1	26	48
O=C(NC1CCN(CCO)CC1)N[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1	ZINC000875267448	GC	On-Demand	Anodyne	CCR5	30	48
O=C(NC1CCN(CCO)CC1)N[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1	ZINC000875267448	GC	On-Demand	Anodyne	EPHX2	28	44
O=C(NC1CCN(CCO)CC1)N[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1	ZINC000875267448	GC	On-Demand	Anodyne	SHH	18	42
O=C(NC1CCN(CCO)CC1)N[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1	ZINC000875267448	GC	On-Demand	Anodyne	SFRP1	47	41
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCC[C@@H](c3ccccc3)C2)CC1	ZINC000875267456	FF	On-Demand	Anodyne	EPHX2	31	41
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCC[C@H](c3ccccc3)C2)CC1	ZINC000875267458	FF	On-Demand	Anodyne	EPHX2	31	41
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCC[C@H](c3ccccc3)C2)CC1	ZINC000875267459	FF	On-Demand	Anodyne	EPHX2	31	41
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCC[C@@H](c3ccccc3)C2)CC1	ZINC000875267461	FF	On-Demand	Anodyne	EPHX2	31	41
C[C@@H](CNC(=O)N1CC[C@@H](C(C)(C)O)C1)N(C)Cc1ccccc1	ZINC000875267467	EE	On-Demand	Anodyne	AMY2	44	31
CN(Cc1ccc(F)cc1)C(=O)COC(=O)C1(c2cccc(F)c2)CCC1	ZINC000875267468	FH	On-Demand	Anodyne	TACR3	18	42
C[C@@H](CNC(=O)N1CC[C@H](C(C)(C)O)C1)N(C)Cc1ccccc1	ZINC000875267470	EE	On-Demand	Anodyne	AMY2	44	31
O=C(NC1CCN(CCO)CC1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875267497	FD	On-Demand	Anodyne	DRD4	16	40
O=C(NC1CCN(CCO)CC1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875267497	FD	On-Demand	Anodyne	SIGMAR1	20	45
O=C(NC1CCN(CCO)CC1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875267497	FD	On-Demand	Anodyne	CCR5	26	41
O=C(NC1CCN(CCO)CC1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875267498	FD	On-Demand	Anodyne	DRD4	16	40
O=C(NC1CCN(CCO)CC1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875267498	FD	On-Demand	Anodyne	SIGMAR1	20	45
O=C(NC1CCN(CCO)CC1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875267498	FD	On-Demand	Anodyne	CCR5	26	41
O=C(NC1CCN(CCO)CC1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875267499	FD	On-Demand	Anodyne	DRD4	16	40
O=C(NC1CCN(CCO)CC1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875267499	FD	On-Demand	Anodyne	SIGMAR1	20	45
O=C(NC1CCN(CCO)CC1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875267499	FD	On-Demand	Anodyne	CCR5	26	41
O=C(NC1CCN(CCO)CC1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875267500	FD	On-Demand	Anodyne	DRD4	16	40
O=C(NC1CCN(CCO)CC1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875267500	FD	On-Demand	Anodyne	SIGMAR1	20	45
O=C(NC1CCN(CCO)CC1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875267500	FD	On-Demand	Anodyne	CCR5	26	41
CCOC(=O)C1=CC[C@H](NC(=O)NC2CCN(CCO)CC2)C1	ZINC000875267501	EC	On-Demand	Anodyne	HTR4	22	42
COC[C@H](NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)C1CC1	ZINC000875267504	ED	On-Demand	Anodyne	OXTR	58	38
COC[C@H](NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)C1CC1	ZINC000875267504	ED	On-Demand	Anodyne	GHRHR	59	42
COC[C@H](NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)C1CC1	ZINC000875267505	ED	On-Demand	Anodyne	OXTR	58	38
COC[C@H](NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)C1CC1	ZINC000875267505	ED	On-Demand	Anodyne	GHRHR	59	42
COC[C@@H](NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)C1CC1	ZINC000875267506	ED	On-Demand	Anodyne	OXTR	58	38
COC[C@@H](NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)C1CC1	ZINC000875267506	ED	On-Demand	Anodyne	GHRHR	59	42
COC[C@@H](NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)C1CC1	ZINC000875267507	ED	On-Demand	Anodyne	OXTR	58	38
COC[C@@H](NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)C1CC1	ZINC000875267507	ED	On-Demand	Anodyne	GHRHR	59	42
O=C(NCc1ccnc(F)c1)NC1CCN(CCO)CC1	ZINC000875267514	CC	On-Demand	Anodyne	CCR3	29	44
O=C(NCc1ccnc(F)c1)NC1CCN(CCO)CC1	ZINC000875267514	CC	On-Demand	Anodyne	SLC6A5	29	44
O=C(NCc1ccnc(F)c1)NC1CCN(CCO)CC1	ZINC000875267514	CC	On-Demand	Anodyne	MCHR1	21	47
CCOC(=O)C1=C(COC(=O)C2(c3cccc(F)c3)CCC2)NC(=O)N[C@H]1c1ccccc1	ZINC000875267515	JH	On-Demand	Anodyne	SLC27A4	71	32
CCOC(=O)C1=C(COC(=O)C2(c3cccc(F)c3)CCC2)NC(=O)N[C@@H]1c1ccccc1	ZINC000875267516	JH	On-Demand	Anodyne	SLC27A4	71	32
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000875267522	GD	On-Demand	Anodyne	DRD4	25	49
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000875267523	GD	On-Demand	Anodyne	DRD4	25	49
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000875267524	GD	On-Demand	Anodyne	DRD4	25	49
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000875267525	GD	On-Demand	Anodyne	DRD4	25	49
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC1CCN(CCO)CC1	ZINC000875267542	GE	On-Demand	Anodyne	CHRM2	19	48
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC1CCN(CCO)CC1	ZINC000875267542	GE	On-Demand	Anodyne	CHRM1	20	48
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC1CCN(CCO)CC1	ZINC000875267542	GE	On-Demand	Anodyne	DRD2	33	58
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC1CCN(CCO)CC1	ZINC000875267542	GE	On-Demand	Anodyne	DRD4	51	58
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC1CCN(CCO)CC1	ZINC000875267542	GE	On-Demand	Anodyne	ACHE	66	63
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC1CCN(CCO)CC1	ZINC000875267542	GE	On-Demand	Anodyne	HRH2	20	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC1CCN(CCO)CC1	ZINC000875267542	GE	On-Demand	Anodyne	HTR2A	15	51
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC1CCN(CCO)CC1	ZINC000875267542	GE	On-Demand	Anodyne	HRH1	15	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC1CCN(CCO)CC1	ZINC000875267542	GE	On-Demand	Anodyne	DRD3	28	58
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC1CCN(CCO)CC1	ZINC000875267542	GE	On-Demand	Anodyne	SLC6A3	18	49
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC1CCN(CCO)CC1	ZINC000875267542	GE	On-Demand	Anodyne	KCNH2	16	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC1CCN(CCO)CC1	ZINC000875267542	GE	On-Demand	Anodyne	HTR4	41	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC1CCN(CCO)CC1	ZINC000875267542	GE	On-Demand	Anodyne	CHRM3	29	48
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC1CCN(CCO)CC1	ZINC000875267542	GE	On-Demand	Anodyne	GRIN2B	46	37
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC1CCN(CCO)CC1	ZINC000875267542	GE	On-Demand	Anodyne	LTA4H	23	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC1CCN(CCO)CC1	ZINC000875267542	GE	On-Demand	Anodyne	SIGMAR1	75	56
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC1CCN(CCO)CC1	ZINC000875267542	GE	On-Demand	Anodyne	SSTR5	50	39
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC1CCN(CCO)CC1	ZINC000875267542	GE	On-Demand	Anodyne	BCHE	20	50
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC1CCN(CCO)CC1	ZINC000875267542	GE	On-Demand	Anodyne	CCR3	65	47
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC1CCN(CCO)CC1	ZINC000875267542	GE	On-Demand	Anodyne	SLC6A5	31	47
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC1CCN(CCO)CC1	ZINC000875267542	GE	On-Demand	Anodyne	EPHX2	26	52
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC1CCN(CCO)CC1	ZINC000875267542	GE	On-Demand	Anodyne	MCHR1	53	48
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC1CCN(CCO)CC1	ZINC000875267542	GE	On-Demand	Anodyne	CACNA1G	35	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC1CCN(CCO)CC1	ZINC000875267542	GE	On-Demand	Anodyne	CCR8	18	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC1CCN(CCO)CC1	ZINC000875267542	GE	On-Demand	Anodyne	CYP2J2	42	30
COC[C@H](NC(=O)C(=O)NCC1(c2ccc(Br)cc2)CC1)C1CC1	ZINC000875267554	GE	On-Demand	Anodyne	KCNA3	40	35
COC[C@@H](NC(=O)C(=O)NCC1(c2ccc(Br)cc2)CC1)C1CC1	ZINC000875267555	GE	On-Demand	Anodyne	KCNA3	40	35
COc1cc2c(cc1OC)CN(C(=O)COC(=O)C1(c3cccc(F)c3)CCC1)CC2	ZINC000875267556	IG	On-Demand	Anodyne	ABCB1	19	44
CC(=O)c1ccccc1OCCOC(=O)C1(c2cccc(F)c2)CCC1	ZINC000875267567	FI	On-Demand	Anodyne	HCN1	42	31
COC[C@H](NC(=O)C(=O)NC[C@@H]1CN(Cc2ccc(C)cc2)CCO1)C1CC1	ZINC000875267577	GC	On-Demand	Anodyne	DRD4	15	41
COC[C@H](NC(=O)C(=O)NC[C@H]1CN(Cc2ccc(C)cc2)CCO1)C1CC1	ZINC000875267578	GC	On-Demand	Anodyne	DRD4	15	41
COC[C@@H](NC(=O)C(=O)NC[C@H]1CN(Cc2ccc(C)cc2)CCO1)C1CC1	ZINC000875267579	GC	On-Demand	Anodyne	DRD4	15	41
COC[C@@H](NC(=O)C(=O)NC[C@@H]1CN(Cc2ccc(C)cc2)CCO1)C1CC1	ZINC000875267580	GC	On-Demand	Anodyne	DRD4	15	41
O=C(NNc1ccc(OCc2ccccc2)cc1)NC1CCN(CCO)CC1	ZINC000875267586	GE	On-Demand	Reactive	CHRM1	17	40
O=C(NNc1ccc(OCc2ccccc2)cc1)NC1CCN(CCO)CC1	ZINC000875267586	GE	On-Demand	Reactive	DRD2	17	48
O=C(NNc1ccc(OCc2ccccc2)cc1)NC1CCN(CCO)CC1	ZINC000875267586	GE	On-Demand	Reactive	DRD4	24	48
O=C(NNc1ccc(OCc2ccccc2)cc1)NC1CCN(CCO)CC1	ZINC000875267586	GE	On-Demand	Reactive	KCNH2	19	40
O=C(NNc1ccc(OCc2ccccc2)cc1)NC1CCN(CCO)CC1	ZINC000875267586	GE	On-Demand	Reactive	LTA4H	76	52
O=C(NNc1ccc(OCc2ccccc2)cc1)NC1CCN(CCO)CC1	ZINC000875267586	GE	On-Demand	Reactive	HRH3	23	44
O=C(NNc1ccc(OCc2ccccc2)cc1)NC1CCN(CCO)CC1	ZINC000875267586	GE	On-Demand	Reactive	SIGMAR1	36	47
O=C(NNc1ccc(OCc2ccccc2)cc1)NC1CCN(CCO)CC1	ZINC000875267586	GE	On-Demand	Reactive	CACNA1B	20	43
O=C(NNc1ccc(OCc2ccccc2)cc1)NC1CCN(CCO)CC1	ZINC000875267586	GE	On-Demand	Reactive	CCR3	33	42
O=C(NNc1ccc(OCc2ccccc2)cc1)NC1CCN(CCO)CC1	ZINC000875267586	GE	On-Demand	Reactive	ADAM17	24	44
O=C(NNc1ccc(OCc2ccccc2)cc1)NC1CCN(CCO)CC1	ZINC000875267586	GE	On-Demand	Reactive	SLC6A5	43	57
O=C(NNc1ccc(OCc2ccccc2)cc1)NC1CCN(CCO)CC1	ZINC000875267586	GE	On-Demand	Reactive	EPHX2	49	44
O=C(NNc1ccc(OCc2ccccc2)cc1)NC1CCN(CCO)CC1	ZINC000875267586	GE	On-Demand	Reactive	PLAU	17	45
O=C(NNc1ccc(OCc2ccccc2)cc1)NC1CCN(CCO)CC1	ZINC000875267586	GE	On-Demand	Reactive	ST14	16	45
O=C(NNc1ccc(OCc2ccccc2)cc1)NC1CCN(CCO)CC1	ZINC000875267586	GE	On-Demand	Reactive	MCHR1	36	44
N#CCc1ccsc1C(=O)N1CCCC[C@H]1Cc1ccccc1	ZINC000875267587	DI	On-Demand	Mild	HCRTR1	21	40
N#CCc1ccsc1C(=O)N1CCCC[C@H]1Cc1ccccc1	ZINC000875267587	DI	On-Demand	Mild	PREP	61	36
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)N1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000875267590	JE	On-Demand	Anodyne	SLC12A5	42	33
N#CCc1ccsc1C(=O)N1CCCC[C@@H]1Cc1ccccc1	ZINC000875267598	DI	On-Demand	Mild	HCRTR1	21	40
N#CCc1ccsc1C(=O)N1CCCC[C@@H]1Cc1ccccc1	ZINC000875267598	DI	On-Demand	Mild	PREP	61	36
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875267620	GD	On-Demand	Anodyne	DRD4	21	44
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875267620	GD	On-Demand	Anodyne	SIGMAR1	27	41
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875267620	GD	On-Demand	Anodyne	MLNR	48	38
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875267623	GD	On-Demand	Anodyne	DRD4	21	44
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875267623	GD	On-Demand	Anodyne	SIGMAR1	27	41
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875267623	GD	On-Demand	Anodyne	MLNR	48	38
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875267625	GD	On-Demand	Anodyne	DRD4	21	44
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875267625	GD	On-Demand	Anodyne	SIGMAR1	27	41
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875267625	GD	On-Demand	Anodyne	MLNR	48	38
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875267627	GD	On-Demand	Anodyne	DRD4	21	44
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875267627	GD	On-Demand	Anodyne	SIGMAR1	27	41
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875267627	GD	On-Demand	Anodyne	MLNR	48	38
CC(C)(C)OC(=O)CN1CCC(NC(=O)NC2CCN(CCO)CC2)CC1	ZINC000875267628	GC	On-Demand	Anodyne	SLC6A5	20	40
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000875267629	IJ	On-Demand	Anodyne	PRNP	54	40
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000875267629	IJ	On-Demand	Anodyne	KCNK3	57	45
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875267641	FD	On-Demand	Anodyne	DRD4	36	47
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875267641	FD	On-Demand	Anodyne	SIGMAR1	37	45
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875267641	FD	On-Demand	Anodyne	MLNR	46	36
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875267644	FD	On-Demand	Anodyne	DRD4	36	47
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875267644	FD	On-Demand	Anodyne	SIGMAR1	37	45
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875267644	FD	On-Demand	Anodyne	MLNR	46	36
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000875267646	FD	On-Demand	Anodyne	DRD4	36	47
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000875267646	FD	On-Demand	Anodyne	SIGMAR1	37	45
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000875267646	FD	On-Demand	Anodyne	MLNR	46	36
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000875267649	FD	On-Demand	Anodyne	DRD4	36	47
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000875267649	FD	On-Demand	Anodyne	SIGMAR1	37	45
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000875267649	FD	On-Demand	Anodyne	MLNR	46	36
CCn1c(=O)c(C(=O)COC(=O)C2(c3cccc(F)c3)CCC2)c(N)n(Cc2ccccc2)c1=O	ZINC000875267670	JF	On-Demand	Anodyne	SLC12A5	44	33
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(c2ccccc2Cl)C1=O	ZINC000875267679	FE	On-Demand	Anodyne	KCNQ2	51	35
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(c2ccccc2Cl)C1=O	ZINC000875267679	FE	On-Demand	Anodyne	REN	17	44
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(c2ccccc2Cl)C1=O	ZINC000875267680	FE	On-Demand	Anodyne	KCNQ2	51	35
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(c2ccccc2Cl)C1=O	ZINC000875267680	FE	On-Demand	Anodyne	REN	17	44
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)Nc1ccc(CN2CCOCC2)cc1	ZINC000875267683	IG	On-Demand	Anodyne	EPHX2	22	41
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875267686	ED	On-Demand	Anodyne	DRD4	23	48
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875267687	ED	On-Demand	Anodyne	DRD4	23	48
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875267688	ED	On-Demand	Anodyne	DRD4	23	48
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875267689	ED	On-Demand	Anodyne	DRD4	23	48
O=C1CCN(C(=O)NCCCNC(=O)c2ccc(F)cc2)CCCCCCN1	ZINC000875267691	GE	On-Demand	Anodyne	DRD3	15	40
O=C1CCN(C(=O)NCCCNC(=O)c2ccc(F)cc2)CCCCCCN1	ZINC000875267691	GE	On-Demand	Anodyne	PLD2	46	41
N#Cc1ccccc1N1CCC(NC(=O)NC2CCN(CCO)CC2)CC1	ZINC000875267735	FD	On-Demand	Mild	HTR1A	45	48
N#Cc1ccccc1N1CCC(NC(=O)NC2CCN(CCO)CC2)CC1	ZINC000875267735	FD	On-Demand	Mild	CHRM1	16	40
N#Cc1ccccc1N1CCC(NC(=O)NC2CCN(CCO)CC2)CC1	ZINC000875267735	FD	On-Demand	Mild	DRD2	42	48
N#Cc1ccccc1N1CCC(NC(=O)NC2CCN(CCO)CC2)CC1	ZINC000875267735	FD	On-Demand	Mild	DRD4	37	47
N#Cc1ccccc1N1CCC(NC(=O)NC2CCN(CCO)CC2)CC1	ZINC000875267735	FD	On-Demand	Mild	ADRA1D	18	41
N#Cc1ccccc1N1CCC(NC(=O)NC2CCN(CCO)CC2)CC1	ZINC000875267735	FD	On-Demand	Mild	HTR1D	18	40
N#Cc1ccccc1N1CCC(NC(=O)NC2CCN(CCO)CC2)CC1	ZINC000875267735	FD	On-Demand	Mild	HTR1B	18	40
N#Cc1ccccc1N1CCC(NC(=O)NC2CCN(CCO)CC2)CC1	ZINC000875267735	FD	On-Demand	Mild	HTR2A	17	48
N#Cc1ccccc1N1CCC(NC(=O)NC2CCN(CCO)CC2)CC1	ZINC000875267735	FD	On-Demand	Mild	ADRA1A	19	40
N#Cc1ccccc1N1CCC(NC(=O)NC2CCN(CCO)CC2)CC1	ZINC000875267735	FD	On-Demand	Mild	ADRA1B	15	41
N#Cc1ccccc1N1CCC(NC(=O)NC2CCN(CCO)CC2)CC1	ZINC000875267735	FD	On-Demand	Mild	DRD3	44	41
N#Cc1ccccc1N1CCC(NC(=O)NC2CCN(CCO)CC2)CC1	ZINC000875267735	FD	On-Demand	Mild	HTR7	33	48
N#Cc1ccccc1N1CCC(NC(=O)NC2CCN(CCO)CC2)CC1	ZINC000875267735	FD	On-Demand	Mild	SIGMAR1	22	42
N#Cc1ccccc1N1CCC(NC(=O)NC2CCN(CCO)CC2)CC1	ZINC000875267735	FD	On-Demand	Mild	SLC6A5	24	42
N#Cc1ccccc1N1CCC(NC(=O)NC2CCN(CCO)CC2)CC1	ZINC000875267735	FD	On-Demand	Mild	EPHX2	20	40
N#Cc1ccc(OCCOC(=O)C2(c3cccc(F)c3)CCC2)cc1	ZINC000875267738	EH	On-Demand	Mild	MEN1	38	41
CC[C@H](C[C@H](C)O)NC(=O)NCCCNC(=O)c1ccc(F)cc1	ZINC000875267765	ED	On-Demand	Anodyne	FOLH1	30	45
COC(=O)N(C)NC(=O)NCCCNC(=O)c1ccc(F)cc1	ZINC000875267769	EC	On-Demand	Reactive	DRD3	16	43
COC(=O)N(C)NC(=O)NCCCNC(=O)c1ccc(F)cc1	ZINC000875267769	EC	On-Demand	Reactive	FOLH1	19	42
O=C(NCCCNC(=O)c1ccc(F)cc1)NCC[C@H](O)C1CCCC1	ZINC000875267773	FE	On-Demand	Anodyne	FOLH1	27	45
O=C(NCCCNC(=O)c1ccc(F)cc1)NCC[C@H](O)C1CCCC1	ZINC000875267773	FE	On-Demand	Anodyne	BCHE	20	40
O=C(NCCCNC(=O)c1ccc(F)cc1)NCC[C@H](O)C1CCCC1	ZINC000875267773	FE	On-Demand	Anodyne	CCR3	24	40
O=C(NCCCNC(=O)c1ccc(F)cc1)NCC[C@@H](O)C1CCCC1	ZINC000875267775	FE	On-Demand	Anodyne	FOLH1	27	45
O=C(NCCCNC(=O)c1ccc(F)cc1)NCC[C@@H](O)C1CCCC1	ZINC000875267775	FE	On-Demand	Anodyne	BCHE	20	40
O=C(NCCCNC(=O)c1ccc(F)cc1)NCC[C@@H](O)C1CCCC1	ZINC000875267775	FE	On-Demand	Anodyne	CCR3	24	40
O=C(NC1CCN(CCO)CC1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000875267781	GF	On-Demand	Anodyne	DRD4	25	43
O=C(NC1CCN(CCO)CC1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000875267781	GF	On-Demand	Anodyne	HTR4	24	41
O=C(NC1CCN(CCO)CC1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000875267781	GF	On-Demand	Anodyne	GRIN2B	56	43
O=C(NC1CCN(CCO)CC1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000875267781	GF	On-Demand	Anodyne	SIGMAR1	31	48
O=C(NC1CCN(CCO)CC1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000875267781	GF	On-Demand	Anodyne	CCR3	72	44
O=C(NC1CCN(CCO)CC1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000875267781	GF	On-Demand	Anodyne	SLC6A5	20	42
O=C(NC1CCN(CCO)CC1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000875267781	GF	On-Demand	Anodyne	EPHX2	26	41
O=C(NC1CCN(CCO)CC1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000875267781	GF	On-Demand	Anodyne	MCHR1	33	42
O=C(NC1CCN(CCO)CC1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000875267781	GF	On-Demand	Anodyne	CACNA1I	40	34
COc1ccc(N2CCN(C(=O)NC3CCN(CCO)CC3)CC2)c(OC)c1	ZINC000875267782	GC	On-Demand	Clean	HTR1A	82	45
COc1ccc(N2CCN(C(=O)NC3CCN(CCO)CC3)CC2)c(OC)c1	ZINC000875267782	GC	On-Demand	Clean	DRD2	68	47
COc1ccc(N2CCN(C(=O)NC3CCN(CCO)CC3)CC2)c(OC)c1	ZINC000875267782	GC	On-Demand	Clean	DRD4	48	47
COc1ccc(N2CCN(C(=O)NC3CCN(CCO)CC3)CC2)c(OC)c1	ZINC000875267782	GC	On-Demand	Clean	ADRA1D	53	44
COc1ccc(N2CCN(C(=O)NC3CCN(CCO)CC3)CC2)c(OC)c1	ZINC000875267782	GC	On-Demand	Clean	HTR1D	17	41
COc1ccc(N2CCN(C(=O)NC3CCN(CCO)CC3)CC2)c(OC)c1	ZINC000875267782	GC	On-Demand	Clean	HTR1B	21	41
COc1ccc(N2CCN(C(=O)NC3CCN(CCO)CC3)CC2)c(OC)c1	ZINC000875267782	GC	On-Demand	Clean	HTR2A	27	42
COc1ccc(N2CCN(C(=O)NC3CCN(CCO)CC3)CC2)c(OC)c1	ZINC000875267782	GC	On-Demand	Clean	ADRA1A	51	44
COc1ccc(N2CCN(C(=O)NC3CCN(CCO)CC3)CC2)c(OC)c1	ZINC000875267782	GC	On-Demand	Clean	ADRA1B	40	44
COc1ccc(N2CCN(C(=O)NC3CCN(CCO)CC3)CC2)c(OC)c1	ZINC000875267782	GC	On-Demand	Clean	DRD3	80	43
COc1ccc(N2CCN(C(=O)NC3CCN(CCO)CC3)CC2)c(OC)c1	ZINC000875267782	GC	On-Demand	Clean	HTR4	47	47
COc1ccc(N2CCN(C(=O)NC3CCN(CCO)CC3)CC2)c(OC)c1	ZINC000875267782	GC	On-Demand	Clean	PDGFRB	44	41
COc1ccc(N2CCN(C(=O)NC3CCN(CCO)CC3)CC2)c(OC)c1	ZINC000875267782	GC	On-Demand	Clean	HTR7	62	45
COc1ccc(N2CCN(C(=O)NC3CCN(CCO)CC3)CC2)c(OC)c1	ZINC000875267782	GC	On-Demand	Clean	SIGMAR1	16	46
COc1ccc(N2CCN(C(=O)NC3CCN(CCO)CC3)CC2)c(OC)c1	ZINC000875267782	GC	On-Demand	Clean	MTNR1B	19	43
COc1ccc(N2CCN(C(=O)NC3CCN(CCO)CC3)CC2)c(OC)c1	ZINC000875267782	GC	On-Demand	Clean	MCHR1	18	41
COc1ccc(N2CCN(C(=O)NC3CCN(CCO)CC3)CC2)c(OC)c1	ZINC000875267782	GC	On-Demand	Clean	EHMT2	52	33
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000875267791	IG	On-Demand	Bother	SSTR1	48	41
N#Cc1cc(F)ccc1N1CCN(C(=O)NC2CCN(CCO)CC2)CC1	ZINC000875267793	GC	On-Demand	Mild	HTR7	15	40
N#Cc1cc(F)ccc1N1CCN(C(=O)NC2CCN(CCO)CC2)CC1	ZINC000875267793	GC	On-Demand	Mild	CCR3	47	44
COc1cccc([C@H](O)C2CCN(C(=O)NC3CCN(CCO)CC3)CC2)c1	ZINC000875267811	GD	On-Demand	Anodyne	DRD4	45	35
COc1cccc([C@H](O)C2CCN(C(=O)NC3CCN(CCO)CC3)CC2)c1	ZINC000875267811	GD	On-Demand	Anodyne	HTR4	26	41
COc1cccc([C@H](O)C2CCN(C(=O)NC3CCN(CCO)CC3)CC2)c1	ZINC000875267811	GD	On-Demand	Anodyne	CCR5	17	42
COc1cccc([C@H](O)C2CCN(C(=O)NC3CCN(CCO)CC3)CC2)c1	ZINC000875267811	GD	On-Demand	Anodyne	MTNR1A	15	41
COc1cccc([C@H](O)C2CCN(C(=O)NC3CCN(CCO)CC3)CC2)c1	ZINC000875267811	GD	On-Demand	Anodyne	MTNR1B	21	41
COc1cccc([C@H](O)C2CCN(C(=O)NC3CCN(CCO)CC3)CC2)c1	ZINC000875267811	GD	On-Demand	Anodyne	EPHX2	17	40
COc1cccc([C@H](O)C2CCN(C(=O)NC3CCN(CCO)CC3)CC2)c1	ZINC000875267811	GD	On-Demand	Anodyne	MCHR1	23	50
CC(=O)N(C)c1ccc(CNC(=O)NC2CCN(CCO)CC2)cc1	ZINC000875267814	EC	On-Demand	Anodyne	SLC6A5	25	42
CC(=O)N(C)c1ccc(CNC(=O)NC2CCN(CCO)CC2)cc1	ZINC000875267814	EC	On-Demand	Anodyne	EPHX2	20	41
CC(=O)N(C)c1ccc(CNC(=O)NC2CCN(CCO)CC2)cc1	ZINC000875267814	EC	On-Demand	Anodyne	MCHR1	15	49
C[C@@H](CNC(=O)N1CCC[C@@H](C(C)(C)O)C1)N(C)Cc1ccccc1	ZINC000875267897	EF	On-Demand	Anodyne	AMY2	47	32
C[C@@H](CNC(=O)N1CCC[C@H](C(C)(C)O)C1)N(C)Cc1ccccc1	ZINC000875267899	EF	On-Demand	Anodyne	AMY2	47	32
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)N1CCN(C(=O)Nc2ccccc2)CC1	ZINC000875267921	IG	On-Demand	Anodyne	CACNA1H	57	36
O=C(NC1CC(N2CCCCC2)C1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875267952	FD	On-Demand	Anodyne	L3MBTL3	40	33
O=C(NC1CC(N2CCCCC2)C1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875267953	FD	On-Demand	Anodyne	L3MBTL3	40	33
O=C(NC1CC(N2CCCCC2)C1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875267954	FD	On-Demand	Anodyne	L3MBTL3	40	33
O=C(NC1CC(N2CCCCC2)C1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875267955	FD	On-Demand	Anodyne	L3MBTL3	40	33
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000875267959	FD	On-Demand	Mild	DRD4	19	50
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000875267960	FD	On-Demand	Mild	DRD4	19	50
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000875267961	FD	On-Demand	Mild	DRD4	19	50
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000875267962	FD	On-Demand	Mild	DRD4	19	50
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H](C)C1CCOCC1)CC2	ZINC000875267972	GE	On-Demand	Anodyne	SLC18A2	48	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H](C)C1CCOCC1)CC2	ZINC000875267973	GE	On-Demand	Anodyne	SLC18A2	48	35
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@@H](C)C1CCOCC1)CC2	ZINC000875267974	GE	On-Demand	Anodyne	SLC18A2	48	35
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@H](C)C1CCOCC1)CC2	ZINC000875267975	GE	On-Demand	Anodyne	SLC18A2	48	35
CC(=O)N(C)c1ccc(CNC(=O)NC[C@H]2CCc3ccccc32)cc1	ZINC000875267976	FG	On-Demand	Anodyne	MTNR1A	21	40
CC(=O)N(C)c1ccc(CNC(=O)NC[C@H]2CCc3ccccc32)cc1	ZINC000875267976	FG	On-Demand	Anodyne	MTNR1B	24	47
CC(=O)N(C)c1ccc(CNC(=O)NC[C@@H]2CCc3ccccc32)cc1	ZINC000875267977	FG	On-Demand	Anodyne	MTNR1A	21	40
CC(=O)N(C)c1ccc(CNC(=O)NC[C@@H]2CCc3ccccc32)cc1	ZINC000875267977	FG	On-Demand	Anodyne	MTNR1B	24	47
CC[C@@H]1COCCN1CCNC(=O)NCCCNC(=O)c1cccc(F)c1	ZINC000875267987	GD	On-Demand	Anodyne	DRD4	44	35
CC[C@@H]1COCCN1CCNC(=O)NCCCNC(=O)c1cccc(F)c1	ZINC000875267987	GD	On-Demand	Anodyne	PLD2	45	36
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCNC(=O)c2ccc(F)cc2)C1	ZINC000875268035	GD	On-Demand	Anodyne	FOLH1	16	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCNC(=O)c2ccc(F)cc2)C1	ZINC000875268035	GD	On-Demand	Anodyne	ASAH1	51	34
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@@H]2[C@@H](CCN2C)C1	ZINC000875268050	GD	On-Demand	Anodyne	DRD4	28	46
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@@H]2[C@@H](CCN2C)C1	ZINC000875268050	GD	On-Demand	Anodyne	SIGMAR1	26	40
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@@H]2[C@@H](CCN2C)C1	ZINC000875268050	GD	On-Demand	Anodyne	MLNR	47	38
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@H]2[C@@H](CCN2C)C1	ZINC000875268052	GD	On-Demand	Anodyne	DRD4	28	46
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@H]2[C@@H](CCN2C)C1	ZINC000875268052	GD	On-Demand	Anodyne	SIGMAR1	26	40
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@H]2[C@@H](CCN2C)C1	ZINC000875268052	GD	On-Demand	Anodyne	MLNR	47	38
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@H]2[C@H](CCN2C)C1	ZINC000875268053	GD	On-Demand	Anodyne	DRD4	28	46
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@H]2[C@H](CCN2C)C1	ZINC000875268053	GD	On-Demand	Anodyne	SIGMAR1	26	40
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@H]2[C@H](CCN2C)C1	ZINC000875268053	GD	On-Demand	Anodyne	MLNR	47	38
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@@H]2[C@H](CCN2C)C1	ZINC000875268054	GD	On-Demand	Anodyne	DRD4	28	46
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@@H]2[C@H](CCN2C)C1	ZINC000875268054	GD	On-Demand	Anodyne	SIGMAR1	26	40
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@@H]2[C@H](CCN2C)C1	ZINC000875268054	GD	On-Demand	Anodyne	MLNR	47	38
COC[C@@H](NC(=O)C(=O)NCc1cc(C(F)(F)F)cc(Cl)n1)C1CC1	ZINC000875268057	GD	On-Demand	Anodyne	CRHR1	18	44
COC[C@H](NC(=O)C(=O)NCc1cc(C(F)(F)F)cc(Cl)n1)C1CC1	ZINC000875268059	GD	On-Demand	Anodyne	CRHR1	18	44
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(=O)NCc1ncc(Cl)s1	ZINC000875268066	GE	On-Demand	Anodyne	DRD4	23	44
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)NCc1ncc(Cl)s1	ZINC000875268068	GE	On-Demand	Anodyne	DRD4	23	44
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)NCc1ncc(Cl)s1	ZINC000875268069	GE	On-Demand	Anodyne	DRD4	23	44
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(=O)NCc1ncc(Cl)s1	ZINC000875268070	GE	On-Demand	Anodyne	DRD4	23	44
C[C@@H](CNC(=O)N[C@H]1CCN(CC(C)(C)O)C1)N(C)Cc1ccccc1	ZINC000875268102	FD	On-Demand	Anodyne	CCR5	22	41
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875268106	FD	On-Demand	Anodyne	CHRM2	15	41
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875268106	FD	On-Demand	Anodyne	DRD4	27	46
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875268106	FD	On-Demand	Anodyne	CHRM3	17	42
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875268106	FD	On-Demand	Anodyne	SIGMAR1	30	42
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875268106	FD	On-Demand	Anodyne	MLNR	62	37
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875268108	FD	On-Demand	Anodyne	CHRM2	15	41
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875268108	FD	On-Demand	Anodyne	DRD4	27	46
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875268108	FD	On-Demand	Anodyne	CHRM3	17	42
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875268108	FD	On-Demand	Anodyne	SIGMAR1	30	42
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875268108	FD	On-Demand	Anodyne	MLNR	62	37
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875268111	FD	On-Demand	Anodyne	CHRM2	15	41
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875268111	FD	On-Demand	Anodyne	DRD4	27	46
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875268111	FD	On-Demand	Anodyne	CHRM3	17	42
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875268111	FD	On-Demand	Anodyne	SIGMAR1	30	42
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875268111	FD	On-Demand	Anodyne	MLNR	62	37
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875268113	FD	On-Demand	Anodyne	CHRM2	15	41
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875268113	FD	On-Demand	Anodyne	DRD4	27	46
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875268113	FD	On-Demand	Anodyne	CHRM3	17	42
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875268113	FD	On-Demand	Anodyne	SIGMAR1	30	42
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875268113	FD	On-Demand	Anodyne	MLNR	62	37
CCOC(=O)C1=C(COC(=O)C2(c3cccc(F)c3)CCC2)NC(=O)N[C@@H]1C	ZINC000875268130	GE	On-Demand	Anodyne	CACNA1C	20	40
CCOC(=O)C1=C(COC(=O)C2(c3cccc(F)c3)CCC2)NC(=O)N[C@@H]1C	ZINC000875268130	GE	On-Demand	Anodyne	CACNA1D	33	40
CCOC(=O)C1=C(COC(=O)C2(c3cccc(F)c3)CCC2)NC(=O)N[C@H]1C	ZINC000875268132	GE	On-Demand	Anodyne	CACNA1C	20	40
CCOC(=O)C1=C(COC(=O)C2(c3cccc(F)c3)CCC2)NC(=O)N[C@H]1C	ZINC000875268132	GE	On-Demand	Anodyne	CACNA1D	33	40
Cc1nn(-c2ccccc2)c(C)c1NC(=O)COC(=O)C1(c2cccc(F)c2)CCC1	ZINC000875268148	HI	On-Demand	Anodyne	P2RX7	16	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCNC(=O)c1ccc(F)cc1	ZINC000875268178	GD	On-Demand	Anodyne	SLC6A4	24	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCNC(=O)c1ccc(F)cc1	ZINC000875268178	GD	On-Demand	Anodyne	DRD3	18	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCNC(=O)c1ccc(F)cc1	ZINC000875268178	GD	On-Demand	Anodyne	SLC6A3	47	43
O=C(NCc1noc2cc(F)ccc12)NC1CCN(CCO)CC1	ZINC000875268181	ED	On-Demand	Anodyne	DRD2	22	45
O=C(NCc1noc2cc(F)ccc12)NC1CCN(CCO)CC1	ZINC000875268181	ED	On-Demand	Anodyne	HTR2A	27	42
O=C(NCc1noc2cc(F)ccc12)NC1CCN(CCO)CC1	ZINC000875268181	ED	On-Demand	Anodyne	HTR7	26	42
O=C(NCc1noc2cc(F)ccc12)NC1CCN(CCO)CC1	ZINC000875268181	ED	On-Demand	Anodyne	CCR3	34	40
O=C(NCc1noc2cc(F)ccc12)NC1CCN(CCO)CC1	ZINC000875268181	ED	On-Demand	Anodyne	MCHR1	20	45
C[C@H](NC(=O)COC(=O)C1(c2cccc(F)c2)CCC1)c1ccc(Cl)cc1	ZINC000875268186	GI	On-Demand	Anodyne	CACNA1H	30	42
C[C@@H](NC(=O)COC(=O)C1(c2cccc(F)c2)CCC1)c1ccc(Cl)cc1	ZINC000875268187	GI	On-Demand	Anodyne	CACNA1H	30	42
O=C(NCc1ccc(CN2CCNC2=O)cc1)NC1CCN(CCO)CC1	ZINC000875268188	GC	On-Demand	Anodyne	SIGMAR1	17	40
O=C(NCc1ccc(CN2CCNC2=O)cc1)NC1CCN(CCO)CC1	ZINC000875268188	GC	On-Demand	Anodyne	CCR3	21	41
O=C(NCc1ccc(CN2CCNC2=O)cc1)NC1CCN(CCO)CC1	ZINC000875268188	GC	On-Demand	Anodyne	SLC6A5	24	41
O=C(NCc1ccc(CN2CCNC2=O)cc1)NC1CCN(CCO)CC1	ZINC000875268188	GC	On-Demand	Anodyne	MCHR1	21	53
Cc1cncc([C@@H]2CCCN2C(=O)NCCCNC(=O)c2cccc(F)c2)c1	ZINC000875268190	GG	On-Demand	Anodyne	DRD4	41	32
Cc1cncc([C@@H]2CCCN2C(=O)NCCCNC(=O)c2cccc(F)c2)c1	ZINC000875268190	GG	On-Demand	Anodyne	PREP	31	41
Cc1cncc([C@H]2CCCN2C(=O)NCCCNC(=O)c2cccc(F)c2)c1	ZINC000875268194	GG	On-Demand	Anodyne	DRD4	41	32
Cc1cncc([C@H]2CCCN2C(=O)NCCCNC(=O)c2cccc(F)c2)c1	ZINC000875268194	GG	On-Demand	Anodyne	PREP	31	41
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)Nc1ccc(N2CCCCC2)nc1	ZINC000875268196	HH	On-Demand	Anodyne	DGAT1	41	42
NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)COC(=O)C1(c2cccc(F)c2)CCC1	ZINC000875268231	IE	On-Demand	Anodyne	CA7	20	48
NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)COC(=O)C1(c2cccc(F)c2)CCC1	ZINC000875268231	IE	On-Demand	Anodyne	EIF2AK3	53	36
C[C@]1(C(F)(F)F)CCN(C(=O)NCCCNC(=O)c2cccc(F)c2)C1	ZINC000875268274	GF	On-Demand	Anodyne	DRD4	43	33
C[C@]1(C(F)(F)F)CCN(C(=O)NCCCNC(=O)c2cccc(F)c2)C1	ZINC000875268274	GF	On-Demand	Anodyne	PLD2	43	36
CCCCCCCNC(=O)C(=O)NCc1ncoc1C	ZINC000875268280	CD	On-Demand	Mild	ASAH1	81	34
C[S@](=N)(=O)N1CCN(C(=O)C(=O)N[C@@H]2CCC[C@H](c3ccccc3)C2)CC1	ZINC000875268310	GD	On-Demand	Anodyne	EPHX2	24	41
C[S@](=N)(=O)N1CCN(C(=O)C(=O)N[C@@H]2CCC[C@H](c3ccccc3)C2)CC1	ZINC000875268310	GD	On-Demand	Anodyne	WNT3	47	32
C[S@](=N)(=O)N1CCN(C(=O)C(=O)N[C@@H]2CCC[C@@H](c3ccccc3)C2)CC1	ZINC000875268311	GD	On-Demand	Anodyne	EPHX2	24	41
C[S@](=N)(=O)N1CCN(C(=O)C(=O)N[C@@H]2CCC[C@@H](c3ccccc3)C2)CC1	ZINC000875268311	GD	On-Demand	Anodyne	WNT3	47	32
C[S@](=N)(=O)N1CCN(C(=O)C(=O)N[C@H]2CCC[C@H](c3ccccc3)C2)CC1	ZINC000875268312	GD	On-Demand	Anodyne	EPHX2	24	41
C[S@](=N)(=O)N1CCN(C(=O)C(=O)N[C@H]2CCC[C@H](c3ccccc3)C2)CC1	ZINC000875268312	GD	On-Demand	Anodyne	WNT3	47	32
C[S@](=N)(=O)N1CCN(C(=O)C(=O)N[C@H]2CCC[C@@H](c3ccccc3)C2)CC1	ZINC000875268313	GD	On-Demand	Anodyne	EPHX2	24	41
C[S@](=N)(=O)N1CCN(C(=O)C(=O)N[C@H]2CCC[C@@H](c3ccccc3)C2)CC1	ZINC000875268313	GD	On-Demand	Anodyne	WNT3	47	32
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000875268315	JE	On-Demand	Anodyne	TGM2	44	39
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000875268315	JE	On-Demand	Anodyne	F13A1	50	39
O=C(NCCCNC(=O)c1ccc(F)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875268335	DD	On-Demand	Anodyne	FOLH1	18	42
O=C(NCCCNC(=O)c1ccc(F)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875268335	DD	On-Demand	Anodyne	BCHE	20	40
O=C(NCCCNC(=O)c1ccc(F)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875268335	DD	On-Demand	Anodyne	CCR3	20	46
O=C(NCCCNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000875268337	GG	On-Demand	Anodyne	CCR3	16	45
O=C(NCCCNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000875268337	GG	On-Demand	Anodyne	PLD1	43	39
O=C(NCCCNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000875268337	GG	On-Demand	Anodyne	EPHX2	20	43
O=C(NCCCNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000875268337	GG	On-Demand	Anodyne	PLD2	46	39
O=C(NCCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000875268338	GG	On-Demand	Anodyne	CCR3	16	45
O=C(NCCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000875268338	GG	On-Demand	Anodyne	PLD1	43	39
O=C(NCCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000875268338	GG	On-Demand	Anodyne	EPHX2	20	43
O=C(NCCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccc(F)cc1	ZINC000875268338	GG	On-Demand	Anodyne	PLD2	46	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCNC(=O)c1ccc(C)cc1	ZINC000875268362	FD	On-Demand	Anodyne	SLC6A4	26	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCNC(=O)c1ccc(C)cc1	ZINC000875268362	FD	On-Demand	Anodyne	SLC6A3	51	42
O=C(NCCCNC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1ccc(F)cc1	ZINC000875268363	GE	On-Demand	Anodyne	CCR3	19	46
Cc1ccccc1CNC(=O)COC(=O)C1(c2cccc(F)c2)CCC1	ZINC000875268368	FG	On-Demand	Anodyne	P2RX7	31	40
CC(C)(C)C(=O)Nc1ccc(C(=O)COC(=O)C2(c3cccc(F)c3)CCC2)cc1	ZINC000875268370	HJ	On-Demand	Anodyne	NPY2R	15	40
CC[C@@H]1COCCN1CCNC(=O)NCCCNC(=O)c1ccc(F)cc1	ZINC000875268392	GD	On-Demand	Anodyne	CCR3	21	42
CC[C@@H]1COCCN1CCNC(=O)NCCCNC(=O)c1ccc(F)cc1	ZINC000875268392	GD	On-Demand	Anodyne	PLD2	46	39
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCCNC(=O)c2cccc(F)c2)C1	ZINC000875268415	FE	On-Demand	Anodyne	DRD4	47	36
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCCNC(=O)c2cccc(F)c2)C1	ZINC000875268415	FE	On-Demand	Anodyne	PLD1	40	36
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCCNC(=O)c2cccc(F)c2)C1	ZINC000875268415	FE	On-Demand	Anodyne	PLD2	43	36
CN1CCN(C(=O)NCCCNC(=O)c2cccc(F)c2)CCC1(C)C	ZINC000875268419	FE	On-Demand	Anodyne	DRD4	44	33
CN1CCN(C(=O)NCCCNC(=O)c2cccc(F)c2)CCC1(C)C	ZINC000875268419	FE	On-Demand	Anodyne	PLD2	58	38
COC(=O)N(C)NC(=O)NC[C@H]1CCc2ccccc21	ZINC000875268440	CD	On-Demand	Reactive	NQO2	19	42
COC(=O)N(C)NC(=O)NC[C@H]1CCc2ccccc21	ZINC000875268440	CD	On-Demand	Reactive	MTNR1A	26	43
COC(=O)N(C)NC(=O)NC[C@H]1CCc2ccccc21	ZINC000875268440	CD	On-Demand	Reactive	MTNR1B	30	49
COC(=O)N(C)NC(=O)NC[C@@H]1CCc2ccccc21	ZINC000875268442	CD	On-Demand	Reactive	NQO2	19	42
COC(=O)N(C)NC(=O)NC[C@@H]1CCc2ccccc21	ZINC000875268442	CD	On-Demand	Reactive	MTNR1A	26	43
COC(=O)N(C)NC(=O)NC[C@@H]1CCc2ccccc21	ZINC000875268442	CD	On-Demand	Reactive	MTNR1B	30	49
COC(=O)N(C)NC(=O)NCCCNC(=O)c1cccc(F)c1	ZINC000875268466	EC	On-Demand	Reactive	DRD4	42	32
O=C(NC1CC(N2CCCCC2)C1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875268500	GE	On-Demand	Anodyne	CHRNA7	46	38
O=C(NC1CC(N2CCCCC2)C1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875268500	GE	On-Demand	Anodyne	C3AR1	46	45
O=C(NC1CC(N2CCCCC2)C1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875268502	GE	On-Demand	Anodyne	CHRNA7	46	38
O=C(NC1CC(N2CCCCC2)C1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875268502	GE	On-Demand	Anodyne	C3AR1	46	45
C=CCOc1ccccc1CNC(=O)NC1CC(C(=O)OC)C1	ZINC000875268574	DE	On-Demand	Mild	KCNA3	22	41
C=CCOc1ccccc1CNC(=O)N(CCOC)CC1CCN(C)CC1	ZINC000875268583	GF	On-Demand	Mild	ACKR3	63	32
COc1ccc(N2CCN(C(=O)C(=O)N[C@H]3CCCOCC3)CC2)c(OC)c1	ZINC000875268585	GD	On-Demand	Clean	HTR1A	16	40
COc1ccc(N2CCN(C(=O)C(=O)N[C@H]3CCCOCC3)CC2)c(OC)c1	ZINC000875268585	GD	On-Demand	Clean	HTR7	15	40
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H]3CCCOCC3)CC2)c(OC)c1	ZINC000875268586	GD	On-Demand	Clean	HTR1A	16	40
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H]3CCCOCC3)CC2)c(OC)c1	ZINC000875268586	GD	On-Demand	Clean	HTR7	15	40
CN1CC[C@H]2CN(C(=O)C(=O)NC3CC(N4CCCCC4)C3)CC[C@@H]21	ZINC000875268629	EC	On-Demand	Anodyne	L3MBTL3	58	34
CN1CC[C@H]2CN(C(=O)C(=O)NC3CC(N4CCCCC4)C3)CC[C@H]21	ZINC000875268632	EC	On-Demand	Anodyne	L3MBTL3	58	34
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000875268635	FC	On-Demand	Mild	DRD4	16	48
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000875268636	FC	On-Demand	Mild	DRD4	16	48
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000875268637	FC	On-Demand	Mild	DRD4	16	48
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000875268638	FC	On-Demand	Mild	DRD4	16	48
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)NC1CCC2(CC1)CC2	ZINC000875268645	FF	On-Demand	Anodyne	ROCK1	22	43
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)NC1CCC2(CC1)CC2	ZINC000875268645	FF	On-Demand	Anodyne	ROCK2	15	43
CC(=O)C1CCN(C(=O)NCCCNC(=O)c2cccc(F)c2)CC1	ZINC000875268646	ED	On-Demand	Anodyne	DRD4	44	34
CC(=O)C1CCN(C(=O)NCCCNC(=O)c2cccc(F)c2)CC1	ZINC000875268646	ED	On-Demand	Anodyne	CCR3	37	42
CC(=O)C1CCN(C(=O)NCCCNC(=O)c2cccc(F)c2)CC1	ZINC000875268646	ED	On-Demand	Anodyne	CCR2	25	40
CC(=O)C1CCN(C(=O)NCCCNC(=O)c2cccc(F)c2)CC1	ZINC000875268646	ED	On-Demand	Anodyne	PLD2	51	36
CC(=O)c1ccc(N2CCN(C(=O)COC(=O)C3(c4cccc(F)c4)CCC3)CC2)c(F)c1	ZINC000875268647	JG	On-Demand	Anodyne	SLC6A9	17	47
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(=O)NCC[C@H]1CCSC1	ZINC000875268675	GD	On-Demand	Anodyne	DRD4	19	44
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(=O)NCC[C@H]1CCSC1	ZINC000875268675	GD	On-Demand	Anodyne	ACHE	25	44
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(=O)NCC[C@@H]1CCSC1	ZINC000875268676	GD	On-Demand	Anodyne	DRD4	19	44
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(=O)NCC[C@@H]1CCSC1	ZINC000875268676	GD	On-Demand	Anodyne	ACHE	25	44
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)NCC[C@H]1CCSC1	ZINC000875268677	GD	On-Demand	Anodyne	DRD4	19	44
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)NCC[C@H]1CCSC1	ZINC000875268677	GD	On-Demand	Anodyne	ACHE	25	44
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)NCC[C@@H]1CCSC1	ZINC000875268678	GD	On-Demand	Anodyne	DRD4	19	44
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(=O)NCC[C@@H]1CCSC1	ZINC000875268678	GD	On-Demand	Anodyne	ACHE	25	44
O=C1CCN(C(=O)NCCCNC(=O)c2cccc(F)c2)CCCCCCN1	ZINC000875268683	GE	On-Demand	Anodyne	DRD4	41	32
O=C1CCN(C(=O)NCCCNC(=O)c2cccc(F)c2)CCCCCCN1	ZINC000875268683	GE	On-Demand	Anodyne	PLD2	62	39
N#Cc1ccc(N2CCN(C(=O)C(=O)NC3CC(N4CCCCC4)C3)CC2)cc1	ZINC000875268686	GD	On-Demand	Mild	L3MBTL3	51	39
Cc1nnc(NNC(=O)NC2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)n1C	ZINC000875268700	FD	On-Demand	Reactive	DRD2	15	43
Cc1nnc(NNC(=O)NC[C@H]2CCc3ccccc32)n1C	ZINC000875268710	DD	On-Demand	Reactive	MTNR1B	18	42
Cc1nnc(NNC(=O)NC[C@@H]2CCc3ccccc32)n1C	ZINC000875268711	DD	On-Demand	Reactive	MTNR1B	18	42
CC(=O)[C@H]1CCCN(C(=O)NCCCNC(=O)c2cccc(F)c2)C1	ZINC000875268713	ED	On-Demand	Anodyne	DRD4	43	33
CC(=O)[C@H]1CCCN(C(=O)NCCCNC(=O)c2cccc(F)c2)C1	ZINC000875268713	ED	On-Demand	Anodyne	SLC6A1	56	38
CC(=O)[C@H]1CCCN(C(=O)NCCCNC(=O)c2cccc(F)c2)C1	ZINC000875268713	ED	On-Demand	Anodyne	CCR3	43	40
CC(=O)[C@H]1CCCN(C(=O)NCCCNC(=O)c2cccc(F)c2)C1	ZINC000875268713	ED	On-Demand	Anodyne	DPP7	15	41
CC(=O)[C@H]1CCCN(C(=O)NCCCNC(=O)c2cccc(F)c2)C1	ZINC000875268713	ED	On-Demand	Anodyne	ACKR3	45	32
CC(=O)[C@@H]1CCCN(C(=O)NCCCNC(=O)c2cccc(F)c2)C1	ZINC000875268714	ED	On-Demand	Anodyne	DRD4	43	33
CC(=O)[C@@H]1CCCN(C(=O)NCCCNC(=O)c2cccc(F)c2)C1	ZINC000875268714	ED	On-Demand	Anodyne	SLC6A1	56	38
CC(=O)[C@@H]1CCCN(C(=O)NCCCNC(=O)c2cccc(F)c2)C1	ZINC000875268714	ED	On-Demand	Anodyne	CCR3	43	40
CC(=O)[C@@H]1CCCN(C(=O)NCCCNC(=O)c2cccc(F)c2)C1	ZINC000875268714	ED	On-Demand	Anodyne	DPP7	15	41
CC(=O)[C@@H]1CCCN(C(=O)NCCCNC(=O)c2cccc(F)c2)C1	ZINC000875268714	ED	On-Demand	Anodyne	ACKR3	45	32
O=C(NCCCNC(=O)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1)c1cccc(F)c1	ZINC000875268721	GD	On-Demand	Anodyne	DRD4	40	30
O=C(NCCCNC(=O)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1)c1cccc(F)c1	ZINC000875268721	GD	On-Demand	Anodyne	CCR3	41	43
O=C(NCCCNC(=O)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1)c1cccc(F)c1	ZINC000875268721	GD	On-Demand	Anodyne	CCR2	26	44
O=C(NCCCNC(=O)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1)c1cccc(F)c1	ZINC000875268722	GD	On-Demand	Anodyne	DRD4	40	30
O=C(NCCCNC(=O)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1)c1cccc(F)c1	ZINC000875268722	GD	On-Demand	Anodyne	CCR3	41	43
O=C(NCCCNC(=O)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1)c1cccc(F)c1	ZINC000875268722	GD	On-Demand	Anodyne	CCR2	26	44
O=C(NCCCNC(=O)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1)c1cccc(F)c1	ZINC000875268723	GD	On-Demand	Anodyne	DRD4	40	30
O=C(NCCCNC(=O)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1)c1cccc(F)c1	ZINC000875268723	GD	On-Demand	Anodyne	CCR3	41	43
O=C(NCCCNC(=O)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1)c1cccc(F)c1	ZINC000875268723	GD	On-Demand	Anodyne	CCR2	26	44
O=C(NCCCNC(=O)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1)c1cccc(F)c1	ZINC000875268724	GD	On-Demand	Anodyne	DRD4	40	30
O=C(NCCCNC(=O)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1)c1cccc(F)c1	ZINC000875268724	GD	On-Demand	Anodyne	CCR3	41	43
O=C(NCCCNC(=O)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1)c1cccc(F)c1	ZINC000875268724	GD	On-Demand	Anodyne	CCR2	26	44
O=CN1CCCN(C(=O)N[C@H](c2ccccc2)c2cccc3ccccc23)CC1	ZINC000875268730	GH	On-Demand	Anodyne	Q6PRC7_IXORI	43	35
O=CN1CCCN(C(=O)N[C@@H](c2ccccc2)c2cccc3ccccc23)CC1	ZINC000875268731	GH	On-Demand	Anodyne	Q6PRC7_IXORI	43	35
C=CCOc1ccccc1CNC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875268778	EE	On-Demand	Mild	SLC6A3	46	40
C=CCOc1ccccc1CNC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875268779	EE	On-Demand	Mild	SLC6A3	46	40
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)C(=O)N[C@H]1CCCOCC1	ZINC000875268781	GE	On-Demand	Anodyne	SIGMAR1	19	44
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)C(=O)N[C@@H]1CCCOCC1	ZINC000875268782	GE	On-Demand	Anodyne	SIGMAR1	19	44
COc1ccc2c(COC(=O)C3(c4cccc(C)c4)CCC3)cc(=O)oc2c1	ZINC000875268786	GI	On-Demand	Anodyne	CYP11B1	15	40
COc1ccc2c(COC(=O)C3(c4cccc(C)c4)CCC3)cc(=O)oc2c1	ZINC000875268786	GI	On-Demand	Anodyne	MAOB	38	41
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)N[C@@H]3CCCOCC3)C2)c1	ZINC000875268814	GC	On-Demand	Anodyne	DRD4	32	42
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)N[C@@H]3CCCOCC3)C2)c1	ZINC000875268814	GC	On-Demand	Anodyne	CCR3	20	41
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)N[C@H]3CCCOCC3)C2)c1	ZINC000875268815	GC	On-Demand	Anodyne	DRD4	32	42
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)N[C@H]3CCCOCC3)C2)c1	ZINC000875268815	GC	On-Demand	Anodyne	CCR3	20	41
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)N[C@H]3CCCOCC3)C2)c1	ZINC000875268816	GC	On-Demand	Anodyne	DRD4	32	42
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)N[C@H]3CCCOCC3)C2)c1	ZINC000875268816	GC	On-Demand	Anodyne	CCR3	20	41
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)N[C@@H]3CCCOCC3)C2)c1	ZINC000875268817	GC	On-Demand	Anodyne	DRD4	32	42
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)N[C@@H]3CCCOCC3)C2)c1	ZINC000875268817	GC	On-Demand	Anodyne	CCR3	20	41
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)c1cccc([N+](=O)[O-])c1	ZINC000875268828	FH	On-Demand	Bother	CACNA1D	50	36
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)C1CCOCC1	ZINC000875268830	FF	On-Demand	Anodyne	CTSB	23	40
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)C1CCOCC1	ZINC000875268830	FF	On-Demand	Anodyne	MTNR1A	26	40
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)C1CCOCC1	ZINC000875268830	FF	On-Demand	Anodyne	MTNR1B	27	40
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)C1CCOCC1	ZINC000875268830	FF	On-Demand	Anodyne	FAAH	41	38
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)C1CCOCC1	ZINC000875268830	FF	On-Demand	Anodyne	CAPN1	41	42
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)C1CCOCC1	ZINC000875268830	FF	On-Demand	Anodyne	CES1	40	35
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)C1CCOCC1	ZINC000875268830	FF	On-Demand	Anodyne	CAPN2	59	42
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)C1CCOCC1	ZINC000875268830	FF	On-Demand	Anodyne	AMP1_PLAFQ	23	45
CN1CC[C@H]2CN(C(=O)NCCCNC(=O)c3cccc(F)c3)CC[C@H]21	ZINC000875268864	FD	On-Demand	Anodyne	DRD2	20	40
CN1CC[C@H]2CN(C(=O)NCCCNC(=O)c3cccc(F)c3)CC[C@H]21	ZINC000875268864	FD	On-Demand	Anodyne	DRD4	44	34
CN1CC[C@H]2CN(C(=O)NCCCNC(=O)c3cccc(F)c3)CC[C@H]21	ZINC000875268864	FD	On-Demand	Anodyne	HTR2A	19	40
CN1CC[C@H]2CN(C(=O)NCCCNC(=O)c3cccc(F)c3)CC[C@H]21	ZINC000875268864	FD	On-Demand	Anodyne	CCR3	37	40
CN1CC[C@H]2CN(C(=O)NCCCNC(=O)c3cccc(F)c3)CC[C@H]21	ZINC000875268864	FD	On-Demand	Anodyne	PLD1	63	38
CN1CC[C@H]2CN(C(=O)NCCCNC(=O)c3cccc(F)c3)CC[C@H]21	ZINC000875268864	FD	On-Demand	Anodyne	CCR2	23	43
CN1CC[C@H]2CN(C(=O)NCCCNC(=O)c3cccc(F)c3)CC[C@H]21	ZINC000875268864	FD	On-Demand	Anodyne	PLD2	65	38
CN1CC[C@H]2CN(C(=O)NCCCNC(=O)c3cccc(F)c3)CC[C@@H]21	ZINC000875268866	FD	On-Demand	Anodyne	DRD2	20	40
CN1CC[C@H]2CN(C(=O)NCCCNC(=O)c3cccc(F)c3)CC[C@@H]21	ZINC000875268866	FD	On-Demand	Anodyne	DRD4	44	34
CN1CC[C@H]2CN(C(=O)NCCCNC(=O)c3cccc(F)c3)CC[C@@H]21	ZINC000875268866	FD	On-Demand	Anodyne	HTR2A	19	40
CN1CC[C@H]2CN(C(=O)NCCCNC(=O)c3cccc(F)c3)CC[C@@H]21	ZINC000875268866	FD	On-Demand	Anodyne	CCR3	37	40
CN1CC[C@H]2CN(C(=O)NCCCNC(=O)c3cccc(F)c3)CC[C@@H]21	ZINC000875268866	FD	On-Demand	Anodyne	PLD1	63	38
CN1CC[C@H]2CN(C(=O)NCCCNC(=O)c3cccc(F)c3)CC[C@@H]21	ZINC000875268866	FD	On-Demand	Anodyne	CCR2	23	43
CN1CC[C@H]2CN(C(=O)NCCCNC(=O)c3cccc(F)c3)CC[C@@H]21	ZINC000875268866	FD	On-Demand	Anodyne	PLD2	65	38
CN1CCN(C(=O)NCCCNC(=O)c2cccc(F)c2)Cc2cccnc21	ZINC000875268879	GE	On-Demand	Anodyne	HTR1A	15	42
CN1CCN(C(=O)NCCCNC(=O)c2cccc(F)c2)Cc2cccnc21	ZINC000875268879	GE	On-Demand	Anodyne	DRD4	42	32
CN1CCN(C(=O)NCCCNC(=O)c2cccc(F)c2)Cc2cccnc21	ZINC000875268879	GE	On-Demand	Anodyne	DRD3	25	42
Cc1nnc(NNC(=O)N[C@@H]2CCCN(Cc3c(F)cccc3F)C2)n1C	ZINC000875268884	GD	On-Demand	Reactive	SLC6A1	41	35
Cc1nnc(NNC(=O)N[C@@H]2CCCN(Cc3c(F)cccc3F)C2)n1C	ZINC000875268884	GD	On-Demand	Reactive	CCR3	59	36
Cc1nnc(NNC(=O)N[C@H]2CCCN(Cc3c(F)cccc3F)C2)n1C	ZINC000875268885	GD	On-Demand	Reactive	SLC6A1	41	35
Cc1nnc(NNC(=O)N[C@H]2CCCN(Cc3c(F)cccc3F)C2)n1C	ZINC000875268885	GD	On-Demand	Reactive	CCR3	59	36
O=C(NCCCNC(=O)N1CCC2(CCNC2=O)CC1)c1cccc(F)c1	ZINC000875268918	GD	On-Demand	Anodyne	CACNA1H	50	37
O=C(NCCCNC(=O)N1CCC2(CCNC2=O)CC1)c1cccc(F)c1	ZINC000875268918	GD	On-Demand	Anodyne	DRD4	41	31
O=C(NCCCNC(=O)N1CCC2(CCNC2=O)CC1)c1cccc(F)c1	ZINC000875268918	GD	On-Demand	Anodyne	PLD1	48	36
O=C(NCCCNC(=O)N1CCC2(CCNC2=O)CC1)c1cccc(F)c1	ZINC000875268918	GD	On-Demand	Anodyne	PLD2	82	44
CCCCCCCNC(=O)C(=O)N[C@@H]1CCCOCC1	ZINC000875268928	CD	On-Demand	Mild	EPHX2	15	56
CCCCCCCNC(=O)C(=O)N[C@@H]1CCCOCC1	ZINC000875268928	CD	On-Demand	Mild	LASR	55	37
CCCCCCCNC(=O)C(=O)N[C@H]1CCCOCC1	ZINC000875268929	CD	On-Demand	Mild	EPHX2	15	56
CCCCCCCNC(=O)C(=O)N[C@H]1CCCOCC1	ZINC000875268929	CD	On-Demand	Mild	LASR	55	37
C=CCOc1ccccc1CNC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875268955	FD	On-Demand	Mild	EPHX2	24	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccc(C)nc1	ZINC000875268984	DD	On-Demand	Anodyne	SLC6A3	49	39
C[C@H]1Cc2cc(S(N)(=O)=O)ccc2N1C(=O)COC(=O)C1(c2cccc(F)c2)CCC1	ZINC000875269027	IE	On-Demand	Anodyne	DRD4	15	41
C[C@@H]1Cc2cc(S(N)(=O)=O)ccc2N1C(=O)COC(=O)C1(c2cccc(F)c2)CCC1	ZINC000875269028	IE	On-Demand	Anodyne	DRD4	15	41
C[C@H](NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)C1CCOCC1	ZINC000875269049	FE	On-Demand	Anodyne	OXTR	58	39
C[C@H](NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)C1CCOCC1	ZINC000875269052	FE	On-Demand	Anodyne	OXTR	58	39
O=C(OCc1ccc(S(=O)(=O)C(F)F)cc1)C1(c2cccc(F)c2)CCC1	ZINC000875269054	GH	On-Demand	Anodyne	SLC12A5	59	37
COC(=O)N(C)NC(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000875269058	EE	On-Demand	Reactive	DRD2	26	52
COC(=O)N(C)NC(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000875269058	EE	On-Demand	Reactive	DRD4	20	40
COC(=O)N(C)NC(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000875269058	EE	On-Demand	Reactive	DRD3	17	49
COC(=O)N(C)NC(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000875269058	EE	On-Demand	Reactive	SLC6A3	33	45
COC(=O)N(C)NC(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000875269058	EE	On-Demand	Reactive	KCNH2	32	42
COC(=O)N(C)NC(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000875269058	EE	On-Demand	Reactive	HTR4	36	41
COC(=O)N(C)NC(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000875269058	EE	On-Demand	Reactive	LTA4H	29	43
COC(=O)N(C)NC(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000875269058	EE	On-Demand	Reactive	SIGMAR1	25	49
COC(=O)N(C)NC(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000875269058	EE	On-Demand	Reactive	CCR3	26	41
COC(=O)N(C)NC(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000875269058	EE	On-Demand	Reactive	ARG1	30	41
COC(=O)N(C)NC(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000875269058	EE	On-Demand	Reactive	ARG2	30	41
O=C(NCCCNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1cccc(F)c1	ZINC000875269063	GG	On-Demand	Anodyne	DRD4	41	31
O=C(NCCCNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1cccc(F)c1	ZINC000875269063	GG	On-Demand	Anodyne	CCR3	20	40
O=C(NCCCNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1cccc(F)c1	ZINC000875269063	GG	On-Demand	Anodyne	SCD1	17	45
O=C(NCCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1cccc(F)c1	ZINC000875269064	GG	On-Demand	Anodyne	DRD4	41	31
O=C(NCCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1cccc(F)c1	ZINC000875269064	GG	On-Demand	Anodyne	CCR3	20	40
O=C(NCCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1cccc(F)c1	ZINC000875269064	GG	On-Demand	Anodyne	SCD1	17	45
O=CN1CCCN(C(=O)NCCCNC(=O)c2cccc(F)c2)CC1	ZINC000875269087	FC	On-Demand	Anodyne	DRD4	41	32
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCCOCC1	ZINC000875269131	GE	On-Demand	Anodyne	CHRM2	16	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCCOCC1	ZINC000875269131	GE	On-Demand	Anodyne	DRD2	27	46
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCCOCC1	ZINC000875269131	GE	On-Demand	Anodyne	DRD4	46	46
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCCOCC1	ZINC000875269131	GE	On-Demand	Anodyne	ACHE	63	57
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCCOCC1	ZINC000875269131	GE	On-Demand	Anodyne	DRD3	23	46
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCCOCC1	ZINC000875269131	GE	On-Demand	Anodyne	SLC6A3	16	46
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCCOCC1	ZINC000875269131	GE	On-Demand	Anodyne	CHRM3	20	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCCOCC1	ZINC000875269131	GE	On-Demand	Anodyne	SIGMAR1	59	49
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCCOCC1	ZINC000875269131	GE	On-Demand	Anodyne	SSTR5	42	34
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCCOCC1	ZINC000875269131	GE	On-Demand	Anodyne	BCHE	15	52
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCCOCC1	ZINC000875269131	GE	On-Demand	Anodyne	CCR3	36	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCCOCC1	ZINC000875269131	GE	On-Demand	Anodyne	SLC6A5	16	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCCOCC1	ZINC000875269131	GE	On-Demand	Anodyne	MCHR1	42	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCCOCC1	ZINC000875269131	GE	On-Demand	Anodyne	CACNA1G	26	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCCOCC1	ZINC000875269131	GE	On-Demand	Anodyne	SIRT2	44	31
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1CCCOCC1	ZINC000875269131	GE	On-Demand	Anodyne	SIRT1	40	34
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCCOCC1	ZINC000875269132	GE	On-Demand	Anodyne	CHRM2	16	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCCOCC1	ZINC000875269132	GE	On-Demand	Anodyne	DRD2	27	46
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCCOCC1	ZINC000875269132	GE	On-Demand	Anodyne	DRD4	46	46
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCCOCC1	ZINC000875269132	GE	On-Demand	Anodyne	ACHE	63	57
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCCOCC1	ZINC000875269132	GE	On-Demand	Anodyne	DRD3	23	46
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCCOCC1	ZINC000875269132	GE	On-Demand	Anodyne	SLC6A3	16	46
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCCOCC1	ZINC000875269132	GE	On-Demand	Anodyne	CHRM3	20	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCCOCC1	ZINC000875269132	GE	On-Demand	Anodyne	SIGMAR1	59	49
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCCOCC1	ZINC000875269132	GE	On-Demand	Anodyne	SSTR5	42	34
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCCOCC1	ZINC000875269132	GE	On-Demand	Anodyne	BCHE	15	52
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCCOCC1	ZINC000875269132	GE	On-Demand	Anodyne	CCR3	36	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCCOCC1	ZINC000875269132	GE	On-Demand	Anodyne	SLC6A5	16	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCCOCC1	ZINC000875269132	GE	On-Demand	Anodyne	MCHR1	42	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCCOCC1	ZINC000875269132	GE	On-Demand	Anodyne	CACNA1G	26	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCCOCC1	ZINC000875269132	GE	On-Demand	Anodyne	SIRT2	44	31
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CCCOCC1	ZINC000875269132	GE	On-Demand	Anodyne	SIRT1	40	34
Cc1nonc1NC(=O)[C@H](C)CCc1ccc(F)cc1	ZINC000875269203	CF	On-Demand	Anodyne	LEF	42	36
Cc1nonc1NC(=O)[C@@H](C)CCc1ccc(F)cc1	ZINC000875269205	CF	On-Demand	Anodyne	LEF	42	36
C=CCOc1ccccc1CNC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875269225	DF	On-Demand	Mild	EPHX2	17	49
C=CCOc1ccccc1CNC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875269227	DF	On-Demand	Mild	EPHX2	17	49
Cc1nonc1NC(=O)[C@H](F)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000875269236	ED	On-Demand	Anodyne	GPR119	28	41
Cc1nonc1NC(=O)[C@@H](F)[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000875269238	ED	On-Demand	Anodyne	GPR119	28	41
Cc1nonc1NC(=O)[C@H](F)[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000875269239	ED	On-Demand	Anodyne	GPR119	28	41
Cc1nonc1NC(=O)[C@@H](F)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000875269241	ED	On-Demand	Anodyne	GPR119	28	41
CCn1ncnc1-c1ccc(C(=O)N(C(C)C)C2CCCCC2)cc1	ZINC000875269269	EI	On-Demand	Anodyne	SCARB1	38	41
Cc1sc(NC(=O)[C@H]2CCN(Cc3ccccc3)C2)c(C(N)=O)c1C	ZINC000875269270	FF	On-Demand	Anodyne	DRD4	40	40
Cc1sc(NC(=O)[C@H]2CCN(Cc3ccccc3)C2)c(C(N)=O)c1C	ZINC000875269270	FF	On-Demand	Anodyne	ACHE	40	39
Cc1sc(NC(=O)[C@H]2CCN(Cc3ccccc3)C2)c(C(N)=O)c1C	ZINC000875269270	FF	On-Demand	Anodyne	SIGMAR1	43	51
Cc1sc(NC(=O)[C@H]2CCN(Cc3ccccc3)C2)c(C(N)=O)c1C	ZINC000875269270	FF	On-Demand	Anodyne	CACNA1G	26	40
Cc1sc(NC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c(C(N)=O)c1C	ZINC000875269271	FF	On-Demand	Anodyne	DRD4	40	40
Cc1sc(NC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c(C(N)=O)c1C	ZINC000875269271	FF	On-Demand	Anodyne	ACHE	40	39
Cc1sc(NC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c(C(N)=O)c1C	ZINC000875269271	FF	On-Demand	Anodyne	SIGMAR1	43	51
Cc1sc(NC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c(C(N)=O)c1C	ZINC000875269271	FF	On-Demand	Anodyne	CACNA1G	26	40
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NCCC(C)(C)O)C2)c1	ZINC000875269303	GC	On-Demand	Anodyne	DRD4	24	40
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NCCC(C)(C)O)C2)c1	ZINC000875269304	GC	On-Demand	Anodyne	DRD4	24	40
Cc1nonc1NC(=O)Cn1cncc1C	ZINC000875269312	BC	On-Demand	Anodyne	QPCT	50	34
O=C(COC(=O)C1(c2cccc(F)c2)CCC1)c1cnc(N2CCCCC2)s1	ZINC000875269328	HI	On-Demand	Anodyne	MLYCD	47	39
C[C@H](NC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1)C1CCOCC1	ZINC000875269335	GD	On-Demand	Anodyne	NPY2R	55	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCNC(=O)c2cccc(F)c2)C1	ZINC000875269346	GD	On-Demand	Anodyne	DRD4	40	32
COC(=O)N(C)NC(=O)N[C@@H]1CCCN(Cc2c(F)cccc2F)C1	ZINC000875269349	FD	On-Demand	Reactive	DRD4	17	40
COC(=O)N(C)NC(=O)N[C@@H]1CCCN(Cc2c(F)cccc2F)C1	ZINC000875269349	FD	On-Demand	Reactive	SLC6A1	65	36
COC(=O)N(C)NC(=O)N[C@@H]1CCCN(Cc2c(F)cccc2F)C1	ZINC000875269349	FD	On-Demand	Reactive	CCR3	41	40
COC(=O)N(C)NC(=O)N[C@H]1CCCN(Cc2c(F)cccc2F)C1	ZINC000875269350	FD	On-Demand	Reactive	DRD4	17	40
COC(=O)N(C)NC(=O)N[C@H]1CCCN(Cc2c(F)cccc2F)C1	ZINC000875269350	FD	On-Demand	Reactive	SLC6A1	65	36
COC(=O)N(C)NC(=O)N[C@H]1CCCN(Cc2c(F)cccc2F)C1	ZINC000875269350	FD	On-Demand	Reactive	CCR3	41	40
C[C@H](NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1)C1CCOCC1	ZINC000875269352	GD	On-Demand	Anodyne	ETHR	48	46
COc1ccc(N2CCN(C(=O)C(=O)NCc3ncoc3C)CC2)c(OC)c1	ZINC000875269359	GC	On-Demand	Clean	DRD3	43	37
COc1ccc(N2CCN(C(=O)C(=O)NCc3ncoc3C)CC2)c(OC)c1	ZINC000875269359	GC	On-Demand	Clean	PDGFRB	41	35
C[C@H](NC(=O)C(=O)N1CCN(c2ccc(F)cc2C#N)CC1)C1CCOCC1	ZINC000875269376	GD	On-Demand	Mild	CTSS	18	44
O=C(NCCCNC(=O)N1CC[C@@H]2CSC[C@@H]2C1)c1cccc(F)c1	ZINC000875269381	FE	On-Demand	Anodyne	CCR3	20	40
O=C(NCCCNC(=O)N1CC[C@@H]2CSC[C@@H]2C1)c1cccc(F)c1	ZINC000875269381	FE	On-Demand	Anodyne	CCR2	25	42
O=C(NCCCNC(=O)N1CC[C@H]2CSC[C@@H]2C1)c1cccc(F)c1	ZINC000875269382	FE	On-Demand	Anodyne	CCR3	20	40
O=C(NCCCNC(=O)N1CC[C@H]2CSC[C@@H]2C1)c1cccc(F)c1	ZINC000875269382	FE	On-Demand	Anodyne	CCR2	25	42
O=C(NCCCNC(=O)N1CC[C@@H]2CSC[C@H]2C1)c1cccc(F)c1	ZINC000875269383	FE	On-Demand	Anodyne	CCR3	20	40
O=C(NCCCNC(=O)N1CC[C@@H]2CSC[C@H]2C1)c1cccc(F)c1	ZINC000875269383	FE	On-Demand	Anodyne	CCR2	25	42
O=C(NCCCNC(=O)N1CC[C@H]2CSC[C@H]2C1)c1cccc(F)c1	ZINC000875269384	FE	On-Demand	Anodyne	CCR3	20	40
O=C(NCCCNC(=O)N1CC[C@H]2CSC[C@H]2C1)c1cccc(F)c1	ZINC000875269384	FE	On-Demand	Anodyne	CCR2	25	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCNC(=O)c1cccc(F)c1	ZINC000875269403	GD	On-Demand	Anodyne	DRD4	42	32
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCNC(=O)c1cccc(F)c1	ZINC000875269403	GD	On-Demand	Anodyne	SLC6A4	19	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCNC(=O)c1cccc(F)c1	ZINC000875269403	GD	On-Demand	Anodyne	SLC6A3	37	43
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCCOCC1	ZINC000875269451	EF	On-Demand	Anodyne	FKBP1A	15	41
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCCOCC1	ZINC000875269451	EF	On-Demand	Anodyne	SIGMAR1	19	40
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCCOCC1	ZINC000875269451	EF	On-Demand	Anodyne	FAAH	66	38
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCCOCC1	ZINC000875269451	EF	On-Demand	Anodyne	CES1	70	41
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCCOCC1	ZINC000875269451	EF	On-Demand	Anodyne	AMP1_PLAFQ	19	42
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCCOCC1	ZINC000875269453	EF	On-Demand	Anodyne	FKBP1A	15	41
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCCOCC1	ZINC000875269453	EF	On-Demand	Anodyne	SIGMAR1	19	40
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCCOCC1	ZINC000875269453	EF	On-Demand	Anodyne	FAAH	66	38
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCCOCC1	ZINC000875269453	EF	On-Demand	Anodyne	CES1	70	41
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCCOCC1	ZINC000875269453	EF	On-Demand	Anodyne	AMP1_PLAFQ	19	42
Cc1nonc1NC(=O)CCc1ccccc1C(F)(F)F	ZINC000875269493	CF	On-Demand	Anodyne	P2RX7	22	41
CCCCCCCNC(=O)C(=O)N[C@H](C)C1CCOCC1	ZINC000875269515	CE	On-Demand	Mild	LASR	44	31
CCCCCCCNC(=O)C(=O)N[C@@H](C)C1CCOCC1	ZINC000875269517	CE	On-Demand	Mild	LASR	44	31
O=C(Nc1ccccc1)C1CCN(C(=O)COC(=O)C2(c3cccc(F)c3)CCC2)CC1	ZINC000875269519	IH	On-Demand	Anodyne	NPY5R	18	40
O=C(Nc1ccccc1)C1CCN(C(=O)COC(=O)C2(c3cccc(F)c3)CCC2)CC1	ZINC000875269519	IH	On-Demand	Anodyne	EPHX2	18	41
O=C(NCCCNC(=O)c1cccc(F)c1)NCC[C@H](O)C1CCCC1	ZINC000875269523	FE	On-Demand	Anodyne	CCR3	22	40
O=C(NCCCNC(=O)c1cccc(F)c1)NCC[C@@H](O)C1CCCC1	ZINC000875269526	FE	On-Demand	Anodyne	CCR3	22	40
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCNC(=O)c3cccc(F)c3)C[C@@H]1C2	ZINC000875269529	GD	On-Demand	Anodyne	DRD4	42	32
Cc1oc(-c2ccccc2)nc1COC(=O)C1(c2cccc(F)c2)CCC1	ZINC000875269546	FJ	On-Demand	Anodyne	PPARG	88	44
Cc1oc(-c2ccccc2)nc1COC(=O)C1(c2cccc(F)c2)CCC1	ZINC000875269546	FJ	On-Demand	Anodyne	PPARA	94	43
Cc1oc(-c2ccccc2)nc1COC(=O)C1(c2cccc(F)c2)CCC1	ZINC000875269546	FJ	On-Demand	Anodyne	PDE8B	60	34
Cc1oc(-c2ccccc2)nc1COC(=O)C1(c2cccc(F)c2)CCC1	ZINC000875269546	FJ	On-Demand	Anodyne	SLC12A5	45	34
CONC(=O)C1CCN(C(=O)NCCCNC(=O)c2cccc(F)c2)CC1	ZINC000875269548	GD	On-Demand	Anodyne	DRD4	46	36
O=C(NCc1cccc2ncccc12)C(=O)NC1CC(N2CCCCC2)C1	ZINC000875269554	FD	On-Demand	Anodyne	HNMT	46	35
O=C(NCCCNC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1cccc(F)c1	ZINC000875269597	GE	On-Demand	Anodyne	CCR2	30	41
O=C(NCCCNC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1cccc(F)c1	ZINC000875269600	GE	On-Demand	Anodyne	CCR2	30	41
O=CN1CCCN(C(=O)NC2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)CC1	ZINC000875269615	FE	On-Demand	Anodyne	DRD2	19	45
O=CN1CCCN(C(=O)NC2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)CC1	ZINC000875269615	FE	On-Demand	Anodyne	SIGMAR1	23	43
O=CN1CCCN(C(=O)NC2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)CC1	ZINC000875269615	FE	On-Demand	Anodyne	CCR3	23	55
O=C(N[C@H]1CCCOCC1)C(=O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000875269617	GF	On-Demand	Anodyne	EPHX2	21	45
O=C(N[C@@H]1CCCOCC1)C(=O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000875269620	GF	On-Demand	Anodyne	EPHX2	21	45
CC(=O)C1CCN(C(=O)C(=O)NC2CC(N3CCCCC3)C2)CC1	ZINC000875269627	EC	On-Demand	Anodyne	L3MBTL3	60	37
O=C(NC1CCC2(CC1)CC2)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875269666	GF	On-Demand	Anodyne	SMO	29	40
O=C(NC1CCC2(CC1)CC2)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875269666	GF	On-Demand	Anodyne	ETHR	54	48
Cc1nonc1NC(=O)[C@@H]1CN(Cc2ccccc2)C[C@H]1C1CC1	ZINC000875269668	EE	On-Demand	Anodyne	SIGMAR1	20	41
Cc1ncc(C(F)(F)F)cc1C(=O)Nc1nonc1C	ZINC000875269687	CE	On-Demand	Anodyne	JUN	23	42
Cc1ncc(C(F)(F)F)cc1C(=O)Nc1nonc1C	ZINC000875269687	CE	On-Demand	Anodyne	ATF1	47	35
Cc1ncc(C(F)(F)F)cc1C(=O)Nc1nonc1C	ZINC000875269687	CE	On-Demand	Anodyne	NFKB1	44	35
C=CCOc1ccccc1CNC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875269695	EF	On-Demand	Mild	EPHX2	15	48
C=CCOc1ccccc1CNC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875269696	EF	On-Demand	Mild	EPHX2	15	48
CC[C@@H](NC(C)=O)C(=O)Nc1nonc1C	ZINC000875269721	BC	On-Demand	Anodyne	CASP7	40	34
Cc1nonc1NC(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875269724	CD	On-Demand	Anodyne	DRD2	17	42
Cc1nonc1NC(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875269724	CD	On-Demand	Anodyne	DRD4	58	42
Cc1nonc1NC(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875269724	CD	On-Demand	Anodyne	ACHE	47	43
Cc1nonc1NC(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875269724	CD	On-Demand	Anodyne	SLC6A1	46	33
Cc1nonc1NC(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875269724	CD	On-Demand	Anodyne	DRD3	15	42
Cc1nonc1NC(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875269724	CD	On-Demand	Anodyne	LTA4H	19	42
Cc1nonc1NC(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875269724	CD	On-Demand	Anodyne	SIGMAR1	54	54
Cc1nonc1NC(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875269724	CD	On-Demand	Anodyne	SLC18A3	18	40
Cc1nonc1NC(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875269724	CD	On-Demand	Anodyne	S1PR1	18	42
Cc1nonc1NC(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875269724	CD	On-Demand	Anodyne	MCHR1	15	41
Cc1nonc1NC(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875269724	CD	On-Demand	Anodyne	CACNA1G	31	42
Cc1nonc1NC(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875269726	CD	On-Demand	Anodyne	DRD2	17	42
Cc1nonc1NC(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875269726	CD	On-Demand	Anodyne	DRD4	58	42
Cc1nonc1NC(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875269726	CD	On-Demand	Anodyne	ACHE	47	43
Cc1nonc1NC(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875269726	CD	On-Demand	Anodyne	SLC6A1	46	33
Cc1nonc1NC(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875269726	CD	On-Demand	Anodyne	DRD3	15	42
Cc1nonc1NC(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875269726	CD	On-Demand	Anodyne	LTA4H	19	42
Cc1nonc1NC(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875269726	CD	On-Demand	Anodyne	SIGMAR1	54	54
Cc1nonc1NC(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875269726	CD	On-Demand	Anodyne	SLC18A3	18	40
Cc1nonc1NC(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875269726	CD	On-Demand	Anodyne	S1PR1	18	42
Cc1nonc1NC(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875269726	CD	On-Demand	Anodyne	MCHR1	15	41
Cc1nonc1NC(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875269726	CD	On-Demand	Anodyne	CACNA1G	31	42
Cc1nonc1NC(=O)c1cccc(OC(C)(C)C)c1	ZINC000875269759	CF	On-Demand	Anodyne	KCNK3	75	41
Cc1nonc1NC(=O)c1cccc(OC(C)(C)C)c1	ZINC000875269759	CF	On-Demand	Anodyne	KCNK9	42	36
Cc1nonc1NC(=O)[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875269763	DF	On-Demand	Anodyne	C3AR1	45	45
Cc1nonc1NC(=O)[C@H](Cc1cccnc1)C1CCCC1	ZINC000875269767	DF	On-Demand	Anodyne	C3AR1	45	45
C=CCOc1ccccc1CNC(=O)N[C@H](CC)C[C@H](C)O	ZINC000875269777	DF	On-Demand	Mild	ANPEP	15	47
C=CCOc1ccccc1CNC(=O)N[C@@H](CC)C[C@@H](C)O	ZINC000875269779	DF	On-Demand	Mild	ANPEP	15	47
C=CCOc1ccccc1CNC(=O)N[C@H](CC)C[C@@H](C)O	ZINC000875269781	DF	On-Demand	Mild	ANPEP	15	47
C=CCOc1ccccc1CNC(=O)N[C@@H](CC)C[C@H](C)O	ZINC000875269782	DF	On-Demand	Mild	ANPEP	15	47
COC(=O)C1CCN(C(=O)COC(=O)C2(c3cccc(C)c3)CCC2)CC1	ZINC000875269802	FE	On-Demand	Anodyne	PTR1	43	30
CCc1ccc(F)cc1C(=O)Nc1nonc1C	ZINC000875269819	BE	On-Demand	Anodyne	P2RX7	30	43
COc1ccc([N+](=O)[O-])cc1COC(=O)C1(c2cccc(C)c2)CCC1	ZINC000875269843	FI	On-Demand	Bother	CACNA1C	52	38
COc1ccc([N+](=O)[O-])cc1COC(=O)C1(c2cccc(C)c2)CCC1	ZINC000875269843	FI	On-Demand	Bother	CACNA1D	80	38
O=C(N[C@H]1CCCOCC1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875269858	GD	On-Demand	Anodyne	SMO	32	41
O=C(N[C@H]1CCCOCC1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875269858	GD	On-Demand	Anodyne	ETHR	56	49
O=C(N[C@@H]1CCCOCC1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875269860	GD	On-Demand	Anodyne	SMO	32	41
O=C(N[C@@H]1CCCOCC1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875269860	GD	On-Demand	Anodyne	ETHR	56	49
COc1ccc(N2CCN(C(=O)COC(=O)C3(c4cccc(C)c4)CCC3)CC2)cc1	ZINC000875269868	HG	On-Demand	Clean	NPBWR1	45	33
COc1ccccc1-c1nc(COC(=O)C2(c3cccc(C)c3)CCC2)cs1	ZINC000875269892	GK	On-Demand	Anodyne	SLC12A5	43	33
C=CCOc1ccccc1CNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875269921	ED	On-Demand	Mild	HCN1	52	32
C=CCOc1ccccc1CNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875269921	ED	On-Demand	Mild	HCN4	41	32
Cc1nonc1NC(=O)[C@@H]1C[C@H]1c1ccsc1	ZINC000875269945	BE	On-Demand	Anodyne	NPBWR1	78	33
Cc1nonc1NC(=O)[C@H](c1cccnc1)C1CCCCC1	ZINC000875269979	DG	On-Demand	Anodyne	C3AR1	46	45
Cc1nonc1NC(=O)[C@@H](c1cccnc1)C1CCCCC1	ZINC000875269980	DG	On-Demand	Anodyne	C3AR1	46	45
C=CCOc1ccccc1CNC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875270028	FG	On-Demand	Mild	EPHX2	18	49
C=CCOc1ccccc1CNC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875270031	FG	On-Demand	Mild	EPHX2	18	49
COC(=O)c1cccc(COC(=O)C2(c3cccc(C)c3)CCC2)c1	ZINC000875270075	EH	On-Demand	Anodyne	SLC12A5	64	36
CCCc1ccc(C(=O)Nc2sc(C)c(C)c2C(N)=O)s1	ZINC000875270122	DH	On-Demand	Anodyne	FOLR1	49	36
CCCc1ccc(C(=O)Nc2sc(C)c(C)c2C(N)=O)s1	ZINC000875270122	DH	On-Demand	Anodyne	SLC46A1	40	31
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H]1CCCOCC1	ZINC000875270131	FD	On-Demand	Anodyne	C3AR1	47	46
O=C(N[C@@H]1CCCOCC1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875270132	FD	On-Demand	Anodyne	C3AR1	47	46
CCCCCCCNC(=O)C(=O)NCCC(C)(C)O	ZINC000875270133	CD	On-Demand	Mild	CES2	49	41
CCCCCCCNC(=O)C(=O)NCCC(C)(C)O	ZINC000875270133	CD	On-Demand	Mild	CES1	46	34
CCCCCCCNC(=O)C(=O)NCCC(C)(C)O	ZINC000875270133	CD	On-Demand	Mild	EST1_PIG	66	41
CCCCCCCNC(=O)C(=O)NCCC(C)(C)O	ZINC000875270133	CD	On-Demand	Mild	CES2C	59	41
CCCCCCCNC(=O)C(=O)NCCC(C)(C)O	ZINC000875270133	CD	On-Demand	Mild	ASAH1	92	36
CCCCCCCNC(=O)C(=O)NCCC(C)(C)O	ZINC000875270133	CD	On-Demand	Mild	CQSS	50	31
O=C(N[C@H]1CCCOCC1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875270134	FD	On-Demand	Anodyne	C3AR1	47	46
Cc1sc(NC(=O)[C@@H]2C[C@H]2c2ccsc2)c(C(N)=O)c1C	ZINC000875270135	DG	On-Demand	Anodyne	NPBWR1	46	32
O=C(N[C@H]1CCCOCC1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875270136	FD	On-Demand	Anodyne	C3AR1	47	46
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCC(C)(C)O)CC2	ZINC000875270147	FD	On-Demand	Anodyne	SLC18A2	50	38
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCC(C)(C)O)CC2	ZINC000875270148	FD	On-Demand	Anodyne	SLC18A2	50	38
Cc1ccnn1CC(=O)N(C(C)C)C1CCCCC1	ZINC000875270156	CF	On-Demand	Anodyne	SCARB1	40	42
Cc1nonc1NC(=O)c1ccc(C(=O)N2CCOCC2)cc1	ZINC000875270172	DD	On-Demand	Anodyne	MTOR	20	40
Cc1nonc1NC(=O)c1ccc(C(=O)N2CCOCC2)cc1	ZINC000875270172	DD	On-Demand	Anodyne	BTK	45	45
Cc1nonc1NC(=O)c1ccc(C(=O)N2CCOCC2)cc1	ZINC000875270172	DD	On-Demand	Anodyne	LRRK2	18	43
Cc1sc(NC(=O)[C@H]2CCN(C(=O)c3ccccc3)C2)c(C(N)=O)c1C	ZINC000875270182	FF	On-Demand	Anodyne	L3MBTL3	51	34
Cc1sc(NC(=O)[C@@H]2CCN(C(=O)c3ccccc3)C2)c(C(N)=O)c1C	ZINC000875270183	FF	On-Demand	Anodyne	L3MBTL3	51	34
COc1ccc(N2CCN(C(=O)C(=O)NCCC(C)(C)O)CC2)c(OC)c1	ZINC000875270200	GC	On-Demand	Clean	HTR1A	38	41
COc1ccc(N2CCN(C(=O)C(=O)NCCC(C)(C)O)CC2)c(OC)c1	ZINC000875270200	GC	On-Demand	Clean	DRD2	33	43
COc1ccc(N2CCN(C(=O)C(=O)NCCC(C)(C)O)CC2)c(OC)c1	ZINC000875270200	GC	On-Demand	Clean	DRD4	44	35
COc1ccc(N2CCN(C(=O)C(=O)NCCC(C)(C)O)CC2)c(OC)c1	ZINC000875270200	GC	On-Demand	Clean	ADRA1D	24	41
COc1ccc(N2CCN(C(=O)C(=O)NCCC(C)(C)O)CC2)c(OC)c1	ZINC000875270200	GC	On-Demand	Clean	ADRA1A	22	41
COc1ccc(N2CCN(C(=O)C(=O)NCCC(C)(C)O)CC2)c(OC)c1	ZINC000875270200	GC	On-Demand	Clean	DRD3	56	41
COc1ccc(N2CCN(C(=O)C(=O)NCCC(C)(C)O)CC2)c(OC)c1	ZINC000875270200	GC	On-Demand	Clean	MTNR1B	40	38
Cc1sc(NC(=O)[C@@H](C)n2ccc(C(F)(F)F)n2)c(C(N)=O)c1C	ZINC000875270203	FF	On-Demand	Anodyne	CARM1	45	33
Cc1sc(NC(=O)[C@H](C)n2ccc(C(F)(F)F)n2)c(C(N)=O)c1C	ZINC000875270204	FF	On-Demand	Anodyne	CARM1	45	33
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1nonc1C	ZINC000875270229	CE	On-Demand	Anodyne	MTNR1A	15	40
CC(=O)N[C@H](CC(C)C)C(=O)Nc1nonc1C	ZINC000875270288	CC	On-Demand	Anodyne	CTSB	15	41
CC(=O)N[C@H](CC(C)C)C(=O)Nc1nonc1C	ZINC000875270288	CC	On-Demand	Anodyne	CAPN1	24	44
CC(=O)N[C@H](CC(C)C)C(=O)Nc1nonc1C	ZINC000875270288	CC	On-Demand	Anodyne	Q9NAW4_PLAFA	23	40
CC(=O)N[C@H](CC(C)C)C(=O)Nc1nonc1C	ZINC000875270288	CC	On-Demand	Anodyne	HPN	49	33
Cc1sc(NC(=O)[C@H]2COc3cc(F)ccc3C2)c(C(N)=O)c1C	ZINC000875270295	EF	On-Demand	Anodyne	ROCK2	20	40
Cc1sc(NC(=O)[C@@H]2COc3cc(F)ccc3C2)c(C(N)=O)c1C	ZINC000875270296	EF	On-Demand	Anodyne	ROCK2	20	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)C1(c2cccc(C)c2)CCC1	ZINC000875270317	GG	On-Demand	Anodyne	CMA1	32	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)C1(c2cccc(C)c2)CCC1	ZINC000875270317	GG	On-Demand	Anodyne	CTSB	44	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)C1(c2cccc(C)c2)CCC1	ZINC000875270317	GG	On-Demand	Anodyne	TIMP3	51	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)C1(c2cccc(C)c2)CCC1	ZINC000875270317	GG	On-Demand	Anodyne	CAPNS1	63	31
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)C1(c2cccc(C)c2)CCC1	ZINC000875270317	GG	On-Demand	Anodyne	HLA-DRB1	56	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)C1(c2cccc(C)c2)CCC1	ZINC000875270317	GG	On-Demand	Anodyne	CAPN1	41	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)C1(c2cccc(C)c2)CCC1	ZINC000875270317	GG	On-Demand	Anodyne	SLC12A5	51	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)C1(c2cccc(C)c2)CCC1	ZINC000875270318	GG	On-Demand	Anodyne	CMA1	32	42
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)C1(c2cccc(C)c2)CCC1	ZINC000875270318	GG	On-Demand	Anodyne	CTSB	44	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)C1(c2cccc(C)c2)CCC1	ZINC000875270318	GG	On-Demand	Anodyne	TIMP3	51	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)C1(c2cccc(C)c2)CCC1	ZINC000875270318	GG	On-Demand	Anodyne	CAPNS1	63	31
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)C1(c2cccc(C)c2)CCC1	ZINC000875270318	GG	On-Demand	Anodyne	HLA-DRB1	56	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)C1(c2cccc(C)c2)CCC1	ZINC000875270318	GG	On-Demand	Anodyne	CAPN1	41	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)C1(c2cccc(C)c2)CCC1	ZINC000875270318	GG	On-Demand	Anodyne	SLC12A5	51	33
CC(=O)N1CCC[C@@H]1C(=O)Nc1sc(C)c(C)c1C(N)=O	ZINC000875270327	DD	On-Demand	Anodyne	LGMN	62	41
Cc1nonc1NC(=O)c1ccc(N2C[C@@H](C)O[C@H](C)C2)cc1	ZINC000875270339	DE	On-Demand	Anodyne	PRNP	40	33
Cc1nonc1NC(=O)c1ccc(N2C[C@H](C)O[C@H](C)C2)cc1	ZINC000875270340	DE	On-Demand	Anodyne	PRNP	40	33
Cc1nonc1NC(=O)c1ccc(N2C[C@H](C)O[C@@H](C)C2)cc1	ZINC000875270341	DE	On-Demand	Anodyne	PRNP	40	33
Cc1nonc1NC(=O)[C@H]1COc2cc(F)ccc2C1	ZINC000875270345	CD	On-Demand	Anodyne	ROCK2	25	45
Cc1nonc1NC(=O)[C@@H]1COc2cc(F)ccc2C1	ZINC000875270346	CD	On-Demand	Anodyne	ROCK2	25	45
Cc1nonc1NC(=O)[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000875270371	DD	On-Demand	Anodyne	EPHX2	15	47
Cc1nonc1NC(=O)[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000875270371	DD	On-Demand	Anodyne	L3MBTL3	59	36
Cc1nonc1NC(=O)[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000875270372	DD	On-Demand	Anodyne	EPHX2	15	47
Cc1nonc1NC(=O)[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000875270372	DD	On-Demand	Anodyne	L3MBTL3	59	36
CC(=O)N1CCC[C@@H]1C(=O)Nc1nonc1C	ZINC000875270377	BC	On-Demand	Anodyne	CELA1	23	40
CC(=O)N1CCC[C@@H]1C(=O)Nc1nonc1C	ZINC000875270377	BC	On-Demand	Anodyne	LGMN	40	40
COC(=O)c1ccc(CC(=O)N(C(C)C)C2CCCCC2)cn1	ZINC000875270399	DF	On-Demand	Anodyne	SCARB1	38	41
Cc1nonc1NC(=O)[C@H](C)n1ccc(C(F)(F)F)n1	ZINC000875270427	CD	On-Demand	Anodyne	CARM1	46	33
Cc1nonc1NC(=O)[C@@H](C)n1ccc(C(F)(F)F)n1	ZINC000875270428	CD	On-Demand	Anodyne	CARM1	46	33
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Br)cc1F	ZINC000875270506	FG	On-Demand	Anodyne	P2RX7	34	52
C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Br)cc1F	ZINC000875270507	FG	On-Demand	Anodyne	P2RX7	34	52
C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Br)cc1F	ZINC000875270508	FG	On-Demand	Anodyne	P2RX7	34	52
O=C(NCCCC(=O)N1Cc2ccccc2C1)NCC[C@H](O)C1CCCC1	ZINC000875270523	FF	On-Demand	Anodyne	PREP	17	41
O=C(NCCCC(=O)N1Cc2ccccc2C1)NCC[C@H](O)C1CCCC1	ZINC000875270523	FF	On-Demand	Anodyne	DPP8	19	43
O=C(NCCCC(=O)N1Cc2ccccc2C1)NCC[C@@H](O)C1CCCC1	ZINC000875270524	FF	On-Demand	Anodyne	PREP	17	41
O=C(NCCCC(=O)N1Cc2ccccc2C1)NCC[C@@H](O)C1CCCC1	ZINC000875270524	FF	On-Demand	Anodyne	DPP8	19	43
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCCC(=O)N2Cc3ccccc3C2)C1	ZINC000875270525	FF	On-Demand	Anodyne	PREP	18	46
COC(=O)N(C)NC(=O)NCc1ccc(Br)cc1F	ZINC000875270541	EE	On-Demand	Reactive	AKR1B1	19	43
CC(=O)C1CCN(C(=O)C(=O)NCCCCCc2ccc(F)cc2)CC1	ZINC000875270545	FE	On-Demand	Anodyne	CCR3	43	40
CC(=O)C1CCN(C(=O)C(=O)NCCCCCc2ccc(F)cc2)CC1	ZINC000875270545	FE	On-Demand	Anodyne	CACNA1G	36	41
O=C(NCc1ccc(Br)cc1F)N[C@@H]1C[C@H](CO)C1	ZINC000875270580	EE	On-Demand	Anodyne	AKR1B1	19	42
O=C(NCc1ccc(Br)cc1F)NC[C@@H]1C[C@H](O)C1	ZINC000875270589	EE	On-Demand	Anodyne	AKR1B1	19	40
O=C(NCc1ccc(Br)cc1F)NC[C@H]1C[C@H](O)C1	ZINC000875270590	EE	On-Demand	Anodyne	AKR1B1	19	40
O=C(NCc1ccc(Br)cc1F)NCC1CC(O)C1	ZINC000875270591	EE	On-Demand	Anodyne	AKR1B1	19	40
O=C(NCc1ccc(Br)cc1F)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875270603	GG	On-Demand	Anodyne	P2RX7	21	48
O=C(NCc1ccc(Br)cc1F)N[C@H]1COC[C@H]1O	ZINC000875270604	ED	On-Demand	Anodyne	AKR1B1	19	40
CC(=O)N1CCC[C@@H]1C(=O)N(c1ccc(C)cc1)C(C)C	ZINC000875270607	CF	On-Demand	Anodyne	ELANE	40	37
C[C@]1(C(F)(F)F)CCN(C(=O)NCCCC(=O)N2Cc3ccccc3C2)C1	ZINC000875270630	GG	On-Demand	Anodyne	EPHX2	26	43
O=C(NCCCC(=O)N1Cc2ccccc2C1)NCc1ccc(O)c(Cl)c1	ZINC000875270638	GG	On-Demand	Anodyne	NCE103	15	46
COC(=O)c1sccc1NC(=O)COC(=O)C1(c2cccc(C)c2)CCC1	ZINC000875270664	GG	On-Demand	Anodyne	FAS	36	45
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCC(=O)N2Cc3ccccc3C2)C1	ZINC000875270674	GE	On-Demand	Anodyne	ACE	19	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCC(=O)N2Cc3ccccc3C2)C1	ZINC000875270674	GE	On-Demand	Anodyne	DPP8	20	43
C[C@@H](NC(=O)NCc1ccc(Br)cc1F)[C@H](O)C(F)(F)F	ZINC000875270678	FF	On-Demand	Anodyne	TRPV1	53	32
C[C@@H](NC(=O)NCc1ccc(Br)cc1F)[C@@H](O)C(F)(F)F	ZINC000875270679	FF	On-Demand	Anodyne	TRPV1	53	32
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(Cl)c(C)c2)CC1	ZINC000875270686	EE	On-Demand	Anodyne	EPHX2	24	47
O=C(NCCCCCc1ccc(F)cc1)C(=O)NCc1ncc(Cl)s1	ZINC000875270710	GG	On-Demand	Anodyne	SCNN1A	50	33
O=C(NCc1ccc(Br)cc1F)N1C[C@@H](O)C[C@@H]1C1CC1	ZINC000875270719	FF	On-Demand	Anodyne	P2RX7	27	48
O=C(NCc1ccc(Br)cc1F)N1C[C@@H](O)C[C@H]1C1CC1	ZINC000875270720	FF	On-Demand	Anodyne	P2RX7	27	48
O=C(NCc1ccc(Br)cc1F)N1C[C@H](O)C[C@H]1C1CC1	ZINC000875270721	FF	On-Demand	Anodyne	P2RX7	27	48
O=C(NCc1ccc(Br)cc1F)N1C[C@H](O)C[C@@H]1C1CC1	ZINC000875270722	FF	On-Demand	Anodyne	P2RX7	27	48
Cc1ccncc1[C@H](C)NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875270730	FC	On-Demand	Anodyne	L3MBTL3	48	41
Cc1ccncc1[C@@H](C)NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875270731	FC	On-Demand	Anodyne	L3MBTL3	48	41
O=C(CCCNC(=O)N1CCO[C@H](C(F)(F)F)CC1)N1Cc2ccccc2C1	ZINC000875270738	GF	On-Demand	Anodyne	ETHR	41	34
O=C(CCCNC(=O)N1CCO[C@@H](C(F)(F)F)CC1)N1Cc2ccccc2C1	ZINC000875270739	GF	On-Demand	Anodyne	ETHR	41	34
O=C(NCc1ccc(Br)cc1F)N[C@H]1CCC[C@@H]1O	ZINC000875270749	EE	On-Demand	Anodyne	AKR1B1	19	40
O=C(NCc1ccc(Br)cc1F)N[C@H]1CCC[C@@H]1O	ZINC000875270749	EE	On-Demand	Anodyne	P2RX7	18	47
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1cnccc1C	ZINC000875270758	DF	On-Demand	Mild	ASAH1	79	36
CCCCCCCNC(=O)C(=O)N[C@H](C)c1cnccc1C	ZINC000875270759	DF	On-Demand	Mild	ASAH1	79	36
CN1CCO[C@H](CN(C)C(=O)NCc2ccc(Br)cc2F)C1	ZINC000875270771	FE	On-Demand	Anodyne	P2RX7	18	42
C[C@H](NC(=O)C(=O)NCCCCCc1ccc(F)cc1)c1ccnn1C	ZINC000875270774	FE	On-Demand	Anodyne	SCNN1A	41	32
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H](C)c1cnccc1C)CC2	ZINC000875270793	GF	On-Demand	Anodyne	SLC18A2	46	32
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H](C)c1cnccc1C)CC2	ZINC000875270794	GF	On-Demand	Anodyne	SLC18A2	46	32
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@H](C)c1cnccc1C)CC2	ZINC000875270795	GF	On-Demand	Anodyne	SLC18A2	46	32
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@@H](C)c1cnccc1C)CC2	ZINC000875270796	GF	On-Demand	Anodyne	SLC18A2	46	32
C[C@@]1(CO)CN(C(=O)NCc2ccc(Br)cc2F)C[C@]1(C)CO	ZINC000875270812	GE	On-Demand	Anodyne	AKR1B1	21	43
C[C@@]1(CO)CN(C(=O)NCc2ccc(Br)cc2F)C[C@]1(C)CO	ZINC000875270812	GE	On-Demand	Anodyne	P2RX7	20	48
Cc1cncc([C@@H]2CCCN2C(=O)NCCCC(=O)N2Cc3ccccc3C2)c1	ZINC000875270820	GH	On-Demand	Anodyne	PREP	70	42
Cc1cncc([C@H]2CCCN2C(=O)NCCCC(=O)N2Cc3ccccc3C2)c1	ZINC000875270821	GH	On-Demand	Anodyne	PREP	70	42
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc(Br)cc1F	ZINC000875270840	FD	On-Demand	Anodyne	P2RX7	26	48
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc(Br)cc1F	ZINC000875270840	FD	On-Demand	Anodyne	PLD1	48	40
O=C(NCCN1CC[C@@H](O)C1)NCc1ccc(Br)cc1F	ZINC000875270840	FD	On-Demand	Anodyne	PLD2	50	40
O=C(NCCN1CC[C@H](O)C1)NCc1ccc(Br)cc1F	ZINC000875270841	FD	On-Demand	Anodyne	P2RX7	26	48
O=C(NCCN1CC[C@H](O)C1)NCc1ccc(Br)cc1F	ZINC000875270841	FD	On-Demand	Anodyne	PLD1	48	40
O=C(NCCN1CC[C@H](O)C1)NCc1ccc(Br)cc1F	ZINC000875270841	FD	On-Demand	Anodyne	PLD2	50	40
Cc1ccncc1[C@H](C)NC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875270856	GE	On-Demand	Anodyne	NPY2R	68	38
Cc1ccncc1[C@@H](C)NC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875270857	GE	On-Demand	Anodyne	NPY2R	68	38
Cc1ccncc1[C@H](C)NC(=O)C(=O)N1CCC(C)(N2CCCCC2)CC1	ZINC000875270879	FE	On-Demand	Anodyne	CCR5	23	41
Cc1ccncc1[C@@H](C)NC(=O)C(=O)N1CCC(C)(N2CCCCC2)CC1	ZINC000875270880	FE	On-Demand	Anodyne	CCR5	23	41
CN1CCN(C)[C@H](CNC(=O)N[C@](C)(CO)Cc2ccc(Cl)cc2)C1	ZINC000875270883	FD	On-Demand	Anodyne	CACNA1I	50	34
CN1CCN(C)[C@@H](CNC(=O)N[C@@](C)(CO)Cc2ccc(Cl)cc2)C1	ZINC000875270884	FD	On-Demand	Anodyne	CACNA1I	50	34
CN1CCN(C)[C@H](CNC(=O)N[C@@](C)(CO)Cc2ccc(Cl)cc2)C1	ZINC000875270885	FD	On-Demand	Anodyne	CACNA1I	50	34
CN1CCN(C)[C@@H](CNC(=O)N[C@](C)(CO)Cc2ccc(Cl)cc2)C1	ZINC000875270886	FD	On-Demand	Anodyne	CACNA1I	50	34
COC(=O)N(C)NC(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000875270929	FD	On-Demand	Reactive	ESR1	90	41
COC(=O)N(C)NC(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000875270929	FD	On-Demand	Reactive	ACHE	15	44
COC(=O)N(C)NC(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000875270929	FD	On-Demand	Reactive	HRH2	29	41
COC(=O)N(C)NC(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000875270929	FD	On-Demand	Reactive	KCNH2	16	42
COC(=O)N(C)NC(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000875270929	FD	On-Demand	Reactive	ESR2	63	41
COC(=O)N(C)NC(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000875270929	FD	On-Demand	Reactive	LTA4H	78	50
COC(=O)N(C)NC(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000875270929	FD	On-Demand	Reactive	HRH3	77	50
COC(=O)N(C)NC(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000875270929	FD	On-Demand	Reactive	PSMB2	47	48
COC(=O)N(C)NC(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000875270929	FD	On-Demand	Reactive	PSMB1	51	48
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@H]2CN(C)CCN2C)CC1	ZINC000875270951	FE	On-Demand	Anodyne	HTR1A	25	41
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@H]2CN(C)CCN2C)CC1	ZINC000875270951	FE	On-Demand	Anodyne	DRD2	36	45
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@H]2CN(C)CCN2C)CC1	ZINC000875270951	FE	On-Demand	Anodyne	DRD4	18	45
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@H]2CN(C)CCN2C)CC1	ZINC000875270951	FE	On-Demand	Anodyne	ACKR3	66	34
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@@H]2CN(C)CCN2C)CC1	ZINC000875270952	FE	On-Demand	Anodyne	HTR1A	25	41
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@@H]2CN(C)CCN2C)CC1	ZINC000875270952	FE	On-Demand	Anodyne	DRD2	36	45
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@@H]2CN(C)CCN2C)CC1	ZINC000875270952	FE	On-Demand	Anodyne	DRD4	18	45
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@@H]2CN(C)CCN2C)CC1	ZINC000875270952	FE	On-Demand	Anodyne	ACKR3	66	34
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@H]2CN(C)CCN2C)CC1	ZINC000875270953	FE	On-Demand	Anodyne	HTR1A	25	41
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@H]2CN(C)CCN2C)CC1	ZINC000875270953	FE	On-Demand	Anodyne	DRD2	36	45
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@H]2CN(C)CCN2C)CC1	ZINC000875270953	FE	On-Demand	Anodyne	DRD4	18	45
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@H]2CN(C)CCN2C)CC1	ZINC000875270953	FE	On-Demand	Anodyne	ACKR3	66	34
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@@H]2CN(C)CCN2C)CC1	ZINC000875270954	FE	On-Demand	Anodyne	HTR1A	25	41
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@@H]2CN(C)CCN2C)CC1	ZINC000875270954	FE	On-Demand	Anodyne	DRD2	36	45
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@@H]2CN(C)CCN2C)CC1	ZINC000875270954	FE	On-Demand	Anodyne	DRD4	18	45
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@@H]2CN(C)CCN2C)CC1	ZINC000875270954	FE	On-Demand	Anodyne	ACKR3	66	34
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000875270973	FF	On-Demand	Anodyne	ESR1	78	39
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000875270973	FF	On-Demand	Anodyne	HRH2	26	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000875270973	FF	On-Demand	Anodyne	ESR2	54	39
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000875270973	FF	On-Demand	Anodyne	LTA4H	54	46
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000875270973	FF	On-Demand	Anodyne	HRH3	60	49
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000875270973	FF	On-Demand	Anodyne	PSMB2	45	44
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000875270973	FF	On-Demand	Anodyne	PSMB1	49	45
CCCCCCCNC(=O)C(=O)NCc1cn(C)nc1C(F)(F)F	ZINC000875270980	EE	On-Demand	Mild	ASAH1	98	41
O=C(NCc1ccc(Br)cc1F)N1OC2CCC1CC2	ZINC000875271062	EG	On-Demand	Anodyne	AKR1B1	21	42
O=C(NCc1ccc(Br)cc1F)N1OC2CCC1CC2	ZINC000875271062	EG	On-Demand	Anodyne	P2RX7	26	50
CC(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)COC(=O)C3(c4cccc(C)c4)CCC3)CC2)cc1	ZINC000875271074	JF	On-Demand	Anodyne	TGM2	41	35
CC(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)COC(=O)C3(c4cccc(C)c4)CCC3)CC2)cc1	ZINC000875271074	JF	On-Demand	Anodyne	F13A1	47	35
CC(=O)[C@H]1CCCN(C(=O)NCCCC(=O)N2Cc3ccccc3C2)C1	ZINC000875271080	FE	On-Demand	Anodyne	PREP	62	46
CC(=O)[C@H]1CCCN(C(=O)NCCCC(=O)N2Cc3ccccc3C2)C1	ZINC000875271080	FE	On-Demand	Anodyne	DPP8	21	43
O=C(NCc1ccc2c(n1)CCCC2)C(=O)NCc1cccc2ncccc12	ZINC000875271092	FE	On-Demand	Anodyne	ACHE	27	40
O=C(NCc1ccc2c(n1)CCCC2)C(=O)NCc1cccc2ncccc12	ZINC000875271092	FE	On-Demand	Anodyne	BCHE	45	40
O=C(NCc1ccc(OCCN2CCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875271107	ED	On-Demand	Anodyne	ESR1	93	40
O=C(NCc1ccc(OCCN2CCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875271107	ED	On-Demand	Anodyne	HRH2	30	43
O=C(NCc1ccc(OCCN2CCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875271107	ED	On-Demand	Anodyne	ESR2	64	40
O=C(NCc1ccc(OCCN2CCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875271107	ED	On-Demand	Anodyne	LTA4H	69	49
O=C(NCc1ccc(OCCN2CCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875271107	ED	On-Demand	Anodyne	HRH3	69	47
O=C(NCc1ccc(OCCN2CCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875271107	ED	On-Demand	Anodyne	PSMB2	46	48
O=C(NCc1ccc(OCCN2CCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875271107	ED	On-Demand	Anodyne	PSMB1	50	48
O=C(NC[C@H]1CCC(F)(F)C1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875271125	FF	On-Demand	Anodyne	OXTR	51	36
O=C(NC[C@H]1CCC(F)(F)C1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875271127	FF	On-Demand	Anodyne	OXTR	51	36
CN1CCN(C)[C@H](CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)C1	ZINC000875271128	FD	On-Demand	Anodyne	FKBP1A	18	40
CN1CCN(C)[C@H](CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)C1	ZINC000875271129	FD	On-Demand	Anodyne	FKBP1A	18	40
CN1CCN(C)[C@H](CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)C1	ZINC000875271130	FD	On-Demand	Anodyne	FKBP1A	18	40
CN1CCN(C)[C@H](CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)C1	ZINC000875271131	FD	On-Demand	Anodyne	FKBP1A	18	40
CC(=O)[C@@H]1CCCN(C(=O)NCCCC(=O)N2Cc3ccccc3C2)C1	ZINC000875271181	FE	On-Demand	Anodyne	PREP	62	46
CC(=O)[C@@H]1CCCN(C(=O)NCCCC(=O)N2Cc3ccccc3C2)C1	ZINC000875271181	FE	On-Demand	Anodyne	DPP8	21	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCC(=O)N1Cc2ccccc2C1	ZINC000875271197	GE	On-Demand	Anodyne	SLC6A3	40	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCC(=O)N1Cc2ccccc2C1	ZINC000875271197	GE	On-Demand	Anodyne	ADAM9	43	31
CN(C[C@@H]1C[C@H](O)C1)C(=O)NCc1ccc(Br)cc1F	ZINC000875271209	EF	On-Demand	Anodyne	AKR1B1	17	40
COC(=O)C1(O)CN(C(=O)NCc2ccc(Br)cc2F)C1	ZINC000875271216	FD	On-Demand	Anodyne	AKR1B1	20	40
O=C(NCC[C@H](O)C(F)F)NCc1ccc(Br)cc1F	ZINC000875271237	FE	On-Demand	Anodyne	AKR1B1	18	40
O=C(NCC[C@@H](O)C(F)F)NCc1ccc(Br)cc1F	ZINC000875271238	FE	On-Demand	Anodyne	AKR1B1	18	40
O=C(CCCNC(=O)N1CCC[C@H](OC2CCC2)CC1)N1Cc2ccccc2C1	ZINC000875271243	GG	On-Demand	Anodyne	PREP	46	45
O=C(CCCNC(=O)N1CCC[C@H](OC2CCC2)CC1)N1Cc2ccccc2C1	ZINC000875271243	GG	On-Demand	Anodyne	DPP8	16	40
O=C(CCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)N1Cc2ccccc2C1	ZINC000875271244	GG	On-Demand	Anodyne	PREP	46	45
O=C(CCCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)N1Cc2ccccc2C1	ZINC000875271244	GG	On-Demand	Anodyne	DPP8	16	40
CONC(=O)C1CCN(C(=O)NCCCC(=O)N2Cc3ccccc3C2)CC1	ZINC000875271251	GD	On-Demand	Anodyne	PREP	23	43
Cc1nnc(NNC(=O)NCc2ccc(Br)cc2F)n1C	ZINC000875271269	FD	On-Demand	Reactive	P2RX7	24	46
Cc1nnc(NNC(=O)NCc2ccc(OCCN3CCCC3)cc2)n1C	ZINC000875271293	FD	On-Demand	Reactive	ESR1	81	38
Cc1nnc(NNC(=O)NCc2ccc(OCCN3CCCC3)cc2)n1C	ZINC000875271293	FD	On-Demand	Reactive	KCNH2	15	41
Cc1nnc(NNC(=O)NCc2ccc(OCCN3CCCC3)cc2)n1C	ZINC000875271293	FD	On-Demand	Reactive	ESR2	56	39
Cc1nnc(NNC(=O)NCc2ccc(OCCN3CCCC3)cc2)n1C	ZINC000875271293	FD	On-Demand	Reactive	LTA4H	55	45
Cc1nnc(NNC(=O)NCc2ccc(OCCN3CCCC3)cc2)n1C	ZINC000875271293	FD	On-Demand	Reactive	HRH3	60	46
Cc1nnc(NNC(=O)NCc2ccc(OCCN3CCCC3)cc2)n1C	ZINC000875271293	FD	On-Demand	Reactive	FLT3	17	42
Cc1nnc(NNC(=O)NCc2ccc(OCCN3CCCC3)cc2)n1C	ZINC000875271293	FD	On-Demand	Reactive	PSMB2	43	44
Cc1nnc(NNC(=O)NCc2ccc(OCCN3CCCC3)cc2)n1C	ZINC000875271293	FD	On-Demand	Reactive	PSMB1	47	44
COC(=O)C1(O)CN(C(=O)NCc2ccc(OCCN3CCCC3)cc2)C1	ZINC000875271306	GC	On-Demand	Anodyne	ESR1	81	39
COC(=O)C1(O)CN(C(=O)NCc2ccc(OCCN3CCCC3)cc2)C1	ZINC000875271306	GC	On-Demand	Anodyne	KCNH2	15	41
COC(=O)C1(O)CN(C(=O)NCc2ccc(OCCN3CCCC3)cc2)C1	ZINC000875271306	GC	On-Demand	Anodyne	ESR2	56	37
COC(=O)C1(O)CN(C(=O)NCc2ccc(OCCN3CCCC3)cc2)C1	ZINC000875271306	GC	On-Demand	Anodyne	LTA4H	64	49
COC(=O)C1(O)CN(C(=O)NCc2ccc(OCCN3CCCC3)cc2)C1	ZINC000875271306	GC	On-Demand	Anodyne	HRH3	72	47
COC(=O)C1(O)CN(C(=O)NCc2ccc(OCCN3CCCC3)cc2)C1	ZINC000875271306	GC	On-Demand	Anodyne	PSMB2	46	47
COC(=O)C1(O)CN(C(=O)NCc2ccc(OCCN3CCCC3)cc2)C1	ZINC000875271306	GC	On-Demand	Anodyne	PSMB1	50	47
O=C(NC[C@H]1CCC(F)(F)C1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875271333	GF	On-Demand	Anodyne	ETHR	55	48
CN1CCN(C)[C@H](CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000875271375	FC	On-Demand	Anodyne	PTGER4	21	41
CN1CCN(C)[C@H](CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000875271375	FC	On-Demand	Anodyne	CACNA1I	45	39
CN1CCN(C)[C@@H](CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000875271376	FC	On-Demand	Anodyne	PTGER4	21	41
CN1CCN(C)[C@@H](CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000875271376	FC	On-Demand	Anodyne	CACNA1I	45	39
CN1CCN(C)[C@H](CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000875271377	FC	On-Demand	Anodyne	PTGER4	21	41
CN1CCN(C)[C@H](CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000875271377	FC	On-Demand	Anodyne	CACNA1I	45	39
CN1CCN(C)[C@@H](CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000875271378	FC	On-Demand	Anodyne	PTGER4	21	41
CN1CCN(C)[C@@H](CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000875271378	FC	On-Demand	Anodyne	CACNA1I	45	39
O=CN1CCCN(C(=O)NCCCC(=O)N2Cc3ccccc3C2)CC1	ZINC000875271386	FD	On-Demand	Anodyne	PREP	24	42
CC(=O)NC[C@@H]1CCCCN1C(=O)NCc1ccc(Br)cc1F	ZINC000875271410	GF	On-Demand	Anodyne	P2RX7	25	48
CS(=O)(=O)NC1CN(C(=O)NCc2ccc(Br)cc2F)C1	ZINC000875271435	GD	On-Demand	Anodyne	TRPV1	60	34
CS(=O)(=O)NC1CN(C(=O)NCc2ccc(Br)cc2F)C1	ZINC000875271435	GD	On-Demand	Anodyne	P2RX7	16	47
O=C(NCc1ccc(Br)cc1F)N(C1CC1)C1CC1	ZINC000875271460	EG	On-Demand	Anodyne	AKR1B1	19	42
O=C(NCc1ccc(Br)cc1F)N(C1CC1)C1CC1	ZINC000875271460	EG	On-Demand	Anodyne	TRPV1	47	33
O=C(NCc1ccc(Br)cc1F)N(C1CC1)C1CC1	ZINC000875271460	EG	On-Demand	Anodyne	P2RX7	23	51
O=C(NCc1ccc(Br)cc1F)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875271462	FF	On-Demand	Anodyne	P2RX7	22	50
O=C(NCc1ccc(Br)cc1F)N1CC=CC1	ZINC000875271466	CF	On-Demand	Anodyne	AKR1B1	21	43
CN1CCN(C2CCN(C(=O)C(=O)NCc3ccc4c(n3)CCCC4)CC2)CC1	ZINC000875271492	GC	On-Demand	Anodyne	L3MBTL3	59	40
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NC[C@@H]1CCC(F)(F)C1)CC2	ZINC000875271503	GF	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NC[C@H]1CCC(F)(F)C1)CC2	ZINC000875271504	GF	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NC[C@@H]1CCC(F)(F)C1)CC2	ZINC000875271505	GF	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NC[C@H]1CCC(F)(F)C1)CC2	ZINC000875271506	GF	On-Demand	Anodyne	SLC18A2	49	36
CN1CCN(C)[C@@H](CNC(=O)NNc2ccc(OCc3ccccc3)cc2)C1	ZINC000875271507	GE	On-Demand	Reactive	LTA4H	45	41
CN1CCN(C)[C@@H](CNC(=O)NNc2ccc(OCc3ccccc3)cc2)C1	ZINC000875271507	GE	On-Demand	Reactive	ADAM17	28	40
CN1CCN(C)[C@@H](CNC(=O)NNc2ccc(OCc3ccccc3)cc2)C1	ZINC000875271507	GE	On-Demand	Reactive	GYS1	40	33
CN1CCN(C)[C@@H](CNC(=O)NNc2ccc(OCc3ccccc3)cc2)C1	ZINC000875271507	GE	On-Demand	Reactive	SLC6A5	38	41
CN1CCN(C)[C@H](CNC(=O)NNc2ccc(OCc3ccccc3)cc2)C1	ZINC000875271508	GE	On-Demand	Reactive	LTA4H	45	41
CN1CCN(C)[C@H](CNC(=O)NNc2ccc(OCc3ccccc3)cc2)C1	ZINC000875271508	GE	On-Demand	Reactive	ADAM17	28	40
CN1CCN(C)[C@H](CNC(=O)NNc2ccc(OCc3ccccc3)cc2)C1	ZINC000875271508	GE	On-Demand	Reactive	GYS1	40	33
CN1CCN(C)[C@H](CNC(=O)NNc2ccc(OCc3ccccc3)cc2)C1	ZINC000875271508	GE	On-Demand	Reactive	SLC6A5	38	41
CCCCCCCNC(=O)C(=O)NCc1ccc2c(n1)CCCC2	ZINC000875271514	EF	On-Demand	Mild	ASAH1	58	33
CN1CCN(C)[C@H](CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C1	ZINC000875271524	FD	On-Demand	Mild	CCR3	31	41
CN1CCN(C)[C@H](CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C1	ZINC000875271524	FD	On-Demand	Mild	ITK	20	49
CN1CCN(C)[C@H](CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C1	ZINC000875271524	FD	On-Demand	Mild	PANC	54	37
CN1CCN(C)[C@@H](CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C1	ZINC000875271525	FD	On-Demand	Mild	CCR3	31	41
CN1CCN(C)[C@@H](CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C1	ZINC000875271525	FD	On-Demand	Mild	ITK	20	49
CN1CCN(C)[C@@H](CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C1	ZINC000875271525	FD	On-Demand	Mild	PANC	54	37
CN1CCN(C)[C@H](CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875271533	FC	On-Demand	Anodyne	SIGMAR1	43	38
CN1CCN(C)[C@@H](CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875271534	FC	On-Demand	Anodyne	SIGMAR1	43	38
Cc1ccncc1[C@H](C)NC(=O)C(=O)N1CCN(c2ccc(F)cc2C#N)CC1	ZINC000875271614	GD	On-Demand	Mild	NPY2R	20	40
Cc1ccncc1[C@@H](C)NC(=O)C(=O)N1CCN(c2ccc(F)cc2C#N)CC1	ZINC000875271615	GD	On-Demand	Mild	NPY2R	20	40
O=C(NCc1ccc(Br)cc1F)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875271632	GF	On-Demand	Anodyne	P2RX7	33	49
O=C(NCc1ccc(Br)cc1F)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875271633	GF	On-Demand	Anodyne	P2RX7	33	49
O=C(NCc1ccc(Br)cc1F)N1CCC(CO)(CO)CC1	ZINC000875271654	GD	On-Demand	Anodyne	AKR1B1	21	41
CC(=O)C1CCN(C(=O)NCCCC(=O)N2Cc3ccccc3C2)CC1	ZINC000875271669	FE	On-Demand	Anodyne	PREP	26	43
COC(=O)c1cccc(NC(=O)COC(=O)C2(c3cccc(C)c3)CCC2)c1	ZINC000875271740	GG	On-Demand	Anodyne	HIF1A	18	48
COC(=O)c1cccc(NC(=O)COC(=O)C2(c3cccc(C)c3)CCC2)c1	ZINC000875271740	GG	On-Demand	Anodyne	KCNK3	61	38
COC(=O)c1cccc(NC(=O)COC(=O)C2(c3cccc(C)c3)CCC2)c1	ZINC000875271740	GG	On-Demand	Anodyne	KCNK9	44	38
COc1cc2c(cc1OC)CN(C(=O)COC(=O)C1(c3cccc(C)c3)CCC1)CC2	ZINC000875271758	HH	On-Demand	Anodyne	ABCB1B	41	33
COc1cc2c(cc1OC)CN(C(=O)COC(=O)C1(c3cccc(C)c3)CCC1)CC2	ZINC000875271758	HH	On-Demand	Anodyne	ABCB1	16	45
O=C(NCc1ccc(OCCN2CCCC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875271815	GD	On-Demand	Anodyne	ESR1	80	38
O=C(NCc1ccc(OCCN2CCCC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875271815	GD	On-Demand	Anodyne	HRH2	26	41
O=C(NCc1ccc(OCCN2CCCC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875271815	GD	On-Demand	Anodyne	ESR2	56	38
O=C(NCc1ccc(OCCN2CCCC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875271815	GD	On-Demand	Anodyne	LTA4H	68	52
O=C(NCc1ccc(OCCN2CCCC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875271815	GD	On-Demand	Anodyne	HRH3	68	47
O=C(NCc1ccc(OCCN2CCCC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875271815	GD	On-Demand	Anodyne	PSMB2	47	48
O=C(NCc1ccc(OCCN2CCCC2)cc1)N1CCC(CO)(CO)CC1	ZINC000875271815	GD	On-Demand	Anodyne	PSMB1	51	48
O=C(NCc1ccc(OCCN2CCCC2)cc1)N1Cc2cccc(O)c2C1	ZINC000875271833	GG	On-Demand	Clean	ESR1	107	42
O=C(NCc1ccc(OCCN2CCCC2)cc1)N1Cc2cccc(O)c2C1	ZINC000875271833	GG	On-Demand	Clean	ESR2	72	42
O=C(NCc1ccc(OCCN2CCCC2)cc1)N1Cc2cccc(O)c2C1	ZINC000875271833	GG	On-Demand	Clean	LTA4H	63	48
O=C(NCc1ccc(OCCN2CCCC2)cc1)N1Cc2cccc(O)c2C1	ZINC000875271833	GG	On-Demand	Clean	HRH3	74	44
O=C(NCc1ccc(OCCN2CCCC2)cc1)N1Cc2cccc(O)c2C1	ZINC000875271833	GG	On-Demand	Clean	PSMB2	46	44
O=C(NCc1ccc(OCCN2CCCC2)cc1)N1Cc2cccc(O)c2C1	ZINC000875271833	GG	On-Demand	Clean	PSMB1	50	44
O=C(NCc1ccc(OCCN2CCCC2)cc1)N1Cc2cccc(O)c2C1	ZINC000875271833	GG	On-Demand	Clean	NAMPT	25	45
Cc1ncc(C(F)(F)F)cc1C(=O)Nc1sc(C)c(C)c1C(N)=O	ZINC000875271861	FG	On-Demand	Anodyne	JUN	23	40
Cc1ncc(C(F)(F)F)cc1C(=O)Nc1sc(C)c(C)c1C(N)=O	ZINC000875271861	FG	On-Demand	Anodyne	ATF1	55	35
Cc1ncc(C(F)(F)F)cc1C(=O)Nc1sc(C)c(C)c1C(N)=O	ZINC000875271861	FG	On-Demand	Anodyne	NFKB1	50	35
CCC[C@H](CCc1ccccc1)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875271938	GD	On-Demand	Anodyne	ACE	43	36
CCC[C@H](CCc1ccccc1)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875271938	GD	On-Demand	Anodyne	GHRHR	60	36
CCC[C@H](CCc1ccccc1)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875271938	GD	On-Demand	Anodyne	MME	32	40
CCC[C@H](CCc1ccccc1)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875271938	GD	On-Demand	Anodyne	CAPNS1	50	33
CCC[C@H](CCc1ccccc1)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875271938	GD	On-Demand	Anodyne	CAPN1	48	35
CCC[C@H](CCc1ccccc1)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875271938	GD	On-Demand	Anodyne	CAPN2	88	36
CCC[C@@H](CCc1ccccc1)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875271939	GD	On-Demand	Anodyne	ACE	43	36
CCC[C@@H](CCc1ccccc1)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875271939	GD	On-Demand	Anodyne	GHRHR	60	36
CCC[C@@H](CCc1ccccc1)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875271939	GD	On-Demand	Anodyne	MME	32	40
CCC[C@@H](CCc1ccccc1)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875271939	GD	On-Demand	Anodyne	CAPNS1	50	33
CCC[C@@H](CCc1ccccc1)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875271939	GD	On-Demand	Anodyne	CAPN1	48	35
CCC[C@@H](CCc1ccccc1)NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875271939	GD	On-Demand	Anodyne	CAPN2	88	36
CCC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1cnn(CC)n1	ZINC000875271975	FD	On-Demand	Anodyne	CAPNS1	47	33
CCC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1cnn(CC)n1	ZINC000875271975	FD	On-Demand	Anodyne	CAPN2	71	36
CCC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1cnn(CC)n1	ZINC000875271976	FD	On-Demand	Anodyne	CAPNS1	47	33
CCC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1cnn(CC)n1	ZINC000875271976	FD	On-Demand	Anodyne	CAPN2	71	36
COC(=O)N(C)NC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	ZINC000875272006	FC	On-Demand	Reactive	CASR	43	39
COC(=O)N(C)NC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	ZINC000875272006	FC	On-Demand	Reactive	PSMB8	48	39
COC(=O)N(C)NC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	ZINC000875272007	FC	On-Demand	Reactive	CASR	43	39
COC(=O)N(C)NC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	ZINC000875272007	FC	On-Demand	Reactive	PSMB8	48	39
CN1CCN(C)[C@H](CNC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875272011	DC	On-Demand	Clean	SSTR1	53	38
CN1CCN(C)[C@@H](CNC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875272012	DC	On-Demand	Clean	SSTR1	53	38
CN1CCN(C)[C@H](CNC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875272032	CC	On-Demand	Anodyne	CACNA1I	48	32
CN1CCN(C)[C@@H](CNC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875272033	CC	On-Demand	Anodyne	CACNA1I	48	32
CN1CCN(C)[C@H](CNC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875272034	CC	On-Demand	Anodyne	CACNA1I	48	32
CN1CCN(C)[C@@H](CNC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875272035	CC	On-Demand	Anodyne	CACNA1I	48	32
CC(=O)N1CCC[C@@H]1C(=O)Oc1cccc(Oc2ncccn2)c1	ZINC000875272116	EE	On-Demand	Anodyne	FKBP1A	43	40
CC(=O)N1CCC[C@@H]1C(=O)Oc1cccc(Oc2ncccn2)c1	ZINC000875272116	EE	On-Demand	Anodyne	PREP	48	40
C[C@H](C[C@@H]1CCOC1)NC(=O)C(=O)N1CCN(c2ccc(F)cc2C#N)CC1	ZINC000875272119	GD	On-Demand	Mild	CTSS	15	44
C[C@@H](C[C@@H]1CCOC1)NC(=O)C(=O)N1CCN(c2ccc(F)cc2C#N)CC1	ZINC000875272120	GD	On-Demand	Mild	CTSS	15	44
C[C@@H](C[C@H]1CCOC1)NC(=O)C(=O)N1CCN(c2ccc(F)cc2C#N)CC1	ZINC000875272122	GD	On-Demand	Mild	CTSS	15	44
CCC1(CC)CCCN1C(=O)NCC1CCN(Cc2nc(C)c(C)o2)CC1	ZINC000875272180	GH	On-Demand	Anodyne	CACNA1I	55	35
CC(=O)C1CCN(C(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)CC1	ZINC000875272207	FD	On-Demand	Anodyne	TACR2	41	38
CC(=O)C1CCN(C(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)CC1	ZINC000875272207	FD	On-Demand	Anodyne	CTSS	29	41
CC(=O)C1CCN(C(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)CC1	ZINC000875272207	FD	On-Demand	Anodyne	CAPN1	22	41
CC(=O)C1CCN(C(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)CC1	ZINC000875272207	FD	On-Demand	Anodyne	PGA5	41	31
CC(=O)C1CCN(C(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)CC1	ZINC000875272209	FD	On-Demand	Anodyne	TACR2	41	38
CC(=O)C1CCN(C(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)CC1	ZINC000875272209	FD	On-Demand	Anodyne	CTSS	29	41
CC(=O)C1CCN(C(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)CC1	ZINC000875272209	FD	On-Demand	Anodyne	CAPN1	22	41
CC(=O)C1CCN(C(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)CC1	ZINC000875272209	FD	On-Demand	Anodyne	PGA5	41	31
CCn1ncc(CNC(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)n1	ZINC000875272211	FD	On-Demand	Anodyne	PGA5	42	32
CCn1ncc(CNC(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)n1	ZINC000875272211	FD	On-Demand	Anodyne	PSMB8	41	37
CCn1ncc(CNC(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)n1	ZINC000875272212	FD	On-Demand	Anodyne	PGA5	42	32
CCn1ncc(CNC(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)n1	ZINC000875272212	FD	On-Demand	Anodyne	PSMB8	41	37
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(COC2CCOCC2)c1	ZINC000875272237	FF	On-Demand	Anodyne	ANPEP	16	40
CC(=O)c1cccc(S(=O)(=O)N2CCN(C(=O)COC(=O)C3(c4cccc(C)c4)CCC3)CC2)c1	ZINC000875272241	JF	On-Demand	Anodyne	AKR1C3	52	39
Cc1nccnc1[C@H](C)NC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	ZINC000875272242	GE	On-Demand	Anodyne	PGA5	42	32
Cc1nccnc1[C@@H](C)NC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	ZINC000875272243	GE	On-Demand	Anodyne	PGA5	42	32
Cc1nccnc1[C@@H](C)NC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	ZINC000875272244	GE	On-Demand	Anodyne	PGA5	42	32
Cc1nccnc1[C@H](C)NC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	ZINC000875272245	GE	On-Demand	Anodyne	PGA5	42	32
COc1ccc(N2CCN(C(=O)C(=O)NCCn3cccc3)CC2)c(OC)c1	ZINC000875272261	GC	On-Demand	Clean	HTR1A	64	47
COc1ccc(N2CCN(C(=O)C(=O)NCCn3cccc3)CC2)c(OC)c1	ZINC000875272261	GC	On-Demand	Clean	DRD2	49	49
COc1ccc(N2CCN(C(=O)C(=O)NCCn3cccc3)CC2)c(OC)c1	ZINC000875272261	GC	On-Demand	Clean	DRD1	15	40
COc1ccc(N2CCN(C(=O)C(=O)NCCn3cccc3)CC2)c(OC)c1	ZINC000875272261	GC	On-Demand	Clean	DRD4	51	41
COc1ccc(N2CCN(C(=O)C(=O)NCCn3cccc3)CC2)c(OC)c1	ZINC000875272261	GC	On-Demand	Clean	ADRA1D	37	42
COc1ccc(N2CCN(C(=O)C(=O)NCCn3cccc3)CC2)c(OC)c1	ZINC000875272261	GC	On-Demand	Clean	HTR1B	16	40
COc1ccc(N2CCN(C(=O)C(=O)NCCn3cccc3)CC2)c(OC)c1	ZINC000875272261	GC	On-Demand	Clean	HTR2A	17	40
COc1ccc(N2CCN(C(=O)C(=O)NCCn3cccc3)CC2)c(OC)c1	ZINC000875272261	GC	On-Demand	Clean	ADRA1A	37	42
COc1ccc(N2CCN(C(=O)C(=O)NCCn3cccc3)CC2)c(OC)c1	ZINC000875272261	GC	On-Demand	Clean	DRD3	70	43
COc1ccc(N2CCN(C(=O)C(=O)NCCn3cccc3)CC2)c(OC)c1	ZINC000875272261	GC	On-Demand	Clean	HTR7	48	41
COc1ccc(N2CCN(C(=O)C(=O)NCCn3cccc3)CC2)c(OC)c1	ZINC000875272261	GC	On-Demand	Clean	MTNR1A	40	32
CCC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875272262	FF	On-Demand	Anodyne	CAPNS1	55	34
CCC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875272262	FF	On-Demand	Anodyne	CAPN1	68	35
CCC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875272262	FF	On-Demand	Anodyne	CAPN2	110	37
CCC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875272262	FF	On-Demand	Anodyne	ACE2	42	35
CCC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875272263	FF	On-Demand	Anodyne	CAPNS1	55	34
CCC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875272263	FF	On-Demand	Anodyne	CAPN1	68	35
CCC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875272263	FF	On-Demand	Anodyne	CAPN2	110	37
CCC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875272263	FF	On-Demand	Anodyne	ACE2	42	35
CCC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875272264	FF	On-Demand	Anodyne	CAPNS1	55	34
CCC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875272264	FF	On-Demand	Anodyne	CAPN1	68	35
CCC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875272264	FF	On-Demand	Anodyne	CAPN2	110	37
CCC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875272264	FF	On-Demand	Anodyne	ACE2	42	35
CCC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875272265	FF	On-Demand	Anodyne	CAPNS1	55	34
CCC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875272265	FF	On-Demand	Anodyne	CAPN1	68	35
CCC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875272265	FF	On-Demand	Anodyne	CAPN2	110	37
CCC[C@@H](CCc1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875272265	FF	On-Demand	Anodyne	ACE2	42	35
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCC(=O)N2CCc3ccccc32)C1	ZINC000875272273	GE	On-Demand	Anodyne	ACE	22	46
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(Cc2nc(C)c(C)o2)CC1	ZINC000875272323	FE	On-Demand	Anodyne	CACNA1I	46	36
CCCCCCCNC(=O)C(=O)NC[C@@H]1CCC(F)(F)C1	ZINC000875272356	DF	On-Demand	Mild	EPHX2	17	41
CCCCCCCNC(=O)C(=O)NC[C@H]1CCC(F)(F)C1	ZINC000875272358	DF	On-Demand	Mild	EPHX2	17	41
COC(=O)c1ccc(OC)c2c1CCN(C(=O)NC[C@H]1CN(C)CCN1C)C2	ZINC000875272381	GC	On-Demand	Anodyne	SSTR1	40	35
COC(=O)c1ccc(OC)c2c1CCN(C(=O)NC[C@@H]1CN(C)CCN1C)C2	ZINC000875272384	GC	On-Demand	Anodyne	SSTR1	40	35
C[C@@H](C[C@@H]1CCOC1)NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875272400	GD	On-Demand	Anodyne	ETHR	43	45
C[C@H](C[C@@H]1CCOC1)NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875272402	GD	On-Demand	Anodyne	ETHR	43	45
C[C@@H](C[C@H]1CCOC1)NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875272404	GD	On-Demand	Anodyne	ETHR	43	45
O=CN1CCCN(C(=O)NCc2ccc(OCCN3CCCC3)cc2)CC1	ZINC000875272414	FD	On-Demand	Anodyne	ESR1	76	37
O=CN1CCCN(C(=O)NCc2ccc(OCCN3CCCC3)cc2)CC1	ZINC000875272414	FD	On-Demand	Anodyne	ESR2	53	37
O=CN1CCCN(C(=O)NCc2ccc(OCCN3CCCC3)cc2)CC1	ZINC000875272414	FD	On-Demand	Anodyne	LTA4H	68	51
O=CN1CCCN(C(=O)NCc2ccc(OCCN3CCCC3)cc2)CC1	ZINC000875272414	FD	On-Demand	Anodyne	HRH3	67	46
O=CN1CCCN(C(=O)NCc2ccc(OCCN3CCCC3)cc2)CC1	ZINC000875272414	FD	On-Demand	Anodyne	PSMB2	47	47
O=CN1CCCN(C(=O)NCc2ccc(OCCN3CCCC3)cc2)CC1	ZINC000875272414	FD	On-Demand	Anodyne	PSMB1	51	47
Cc1nc(CN2CCC(CNC(=O)NN=c3cc[nH]cc3C)CC2)oc1C	ZINC000875272417	FD	On-Demand	Reactive	CACNA1I	47	34
CN1CCN(C)[C@H](CNC(=O)N(C)C[C@H]2CCCCN2Cc2ccccc2)C1	ZINC000875272450	GD	On-Demand	Anodyne	DRD2	22	43
CN1CCN(C)[C@H](CNC(=O)N(C)C[C@H]2CCCCN2Cc2ccccc2)C1	ZINC000875272450	GD	On-Demand	Anodyne	SIGMAR1	21	45
CN1CCN(C)[C@@H](CNC(=O)N(C)C[C@H]2CCCCN2Cc2ccccc2)C1	ZINC000875272452	GD	On-Demand	Anodyne	DRD2	22	43
CN1CCN(C)[C@@H](CNC(=O)N(C)C[C@H]2CCCCN2Cc2ccccc2)C1	ZINC000875272452	GD	On-Demand	Anodyne	SIGMAR1	21	45
CC(C)(C)OC(=O)NC[C@H](NC(=O)N1CCCN(C=O)CC1)C1CCCCC1	ZINC000875272480	GE	On-Demand	Anodyne	REN	38	41
CC(C)(C)OC(=O)NC[C@@H](NC(=O)N1CCCN(C=O)CC1)C1CCCCC1	ZINC000875272482	GE	On-Demand	Anodyne	REN	38	41
C[C@H](C[C@@H]1CCOC1)NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875272489	FE	On-Demand	Anodyne	OXTR	54	36
C[C@H](C[C@@H]1CCOC1)NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875272493	FE	On-Demand	Anodyne	OXTR	54	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCn1cccc1)CC2	ZINC000875272548	FD	On-Demand	Anodyne	SLC18A2	48	37
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCn1cccc1)CC2	ZINC000875272549	FD	On-Demand	Anodyne	SLC18A2	48	37
COC[C@H](NC(=O)C(=O)NCCn1cccc1)c1cccc(Br)c1	ZINC000875272558	GD	On-Demand	Anodyne	DRD4	40	31
COC[C@@H](NC(=O)C(=O)NCCn1cccc1)c1cccc(Br)c1	ZINC000875272559	GD	On-Demand	Anodyne	DRD4	40	31
CN1CCN(C2CCN(C(=O)C(=O)NCCn3cccc3)CC2)CC1	ZINC000875272566	EB	On-Demand	Anodyne	L3MBTL3	46	40
O=C(N[C@@H](Cc1ccccc1)CN1CCOCC1)N1CCC(CO)(CO)CC1	ZINC000875272596	GC	On-Demand	Anodyne	CTSS	23	40
O=C(N[C@H](Cc1ccccc1)CN1CCOCC1)N1CCC(CO)(CO)CC1	ZINC000875272597	GC	On-Demand	Anodyne	CTSS	23	40
Cc1nc(CN2CCC(CNC(=O)N3Cc4cccc(O)c4C3)CC2)oc1C	ZINC000875272642	GF	On-Demand	Clean	HTR4	48	36
Cc1nc(CN2CCC(CNC(=O)N3Cc4cccc(O)c4C3)CC2)oc1C	ZINC000875272642	GF	On-Demand	Clean	PDE8B	47	33
Cc1nc(CN2CCC(CNC(=O)N3Cc4cccc(O)c4C3)CC2)oc1C	ZINC000875272642	GF	On-Demand	Clean	CACNA1I	56	38
Cc1nc(CN2CCC(CNC(=O)N(C)OCC(F)(F)F)CC2)oc1C	ZINC000875272696	GF	On-Demand	Anodyne	CACNA1I	55	36
CO[C@H](CNC(=O)C(=O)NCc1ncc(Cl)s1)c1ccc(Cl)cc1	ZINC000875272799	GF	On-Demand	Anodyne	MAP1	16	42
CO[C@H](CNC(=O)C(=O)NCc1ncc(Cl)s1)c1ccc(Cl)cc1	ZINC000875272799	GF	On-Demand	Anodyne	FFAR2	24	42
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	ZINC000875272837	GE	On-Demand	Anodyne	TIMP3	83	37
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	ZINC000875272840	GE	On-Demand	Anodyne	TIMP3	83	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H](C)C[C@@H]1CCOC1)CC2	ZINC000875272858	GE	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H](C)C[C@@H]1CCOC1)CC2	ZINC000875272859	GE	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H](C)C[C@H]1CCOC1)CC2	ZINC000875272860	GE	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H](C)C[C@H]1CCOC1)CC2	ZINC000875272861	GE	On-Demand	Anodyne	SLC18A2	49	36
Cc1nc(CN2CCC(CNC(=O)N[C@@H]3CC(C)(C)CC[C@H]3O)CC2)oc1C	ZINC000875272922	GF	On-Demand	Anodyne	CACNA1I	59	37
Cc1cncc([C@@H]2CCCN2C(=O)NCCCC(=O)N2CCc3ccccc32)c1	ZINC000875273020	GH	On-Demand	Anodyne	AVPR2	26	40
Cc1cncc([C@@H]2CCCN2C(=O)NCCCC(=O)N2CCc3ccccc32)c1	ZINC000875273020	GH	On-Demand	Anodyne	PREP	43	36
Cc1cncc([C@H]2CCCN2C(=O)NCCCC(=O)N2CCc3ccccc32)c1	ZINC000875273021	GH	On-Demand	Anodyne	AVPR2	26	40
Cc1cncc([C@H]2CCCN2C(=O)NCCCC(=O)N2CCc3ccccc32)c1	ZINC000875273021	GH	On-Demand	Anodyne	PREP	43	36
COCC(C)(C)CCNC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	ZINC000875273026	GE	On-Demand	Anodyne	TACR2	22	44
COCC(C)(C)CCNC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	ZINC000875273027	GE	On-Demand	Anodyne	TACR2	22	44
C[C@@H](Cc1ccc(C(F)(F)F)cc1)NC(=O)N1CCCN(C=O)CC1	ZINC000875273054	FF	On-Demand	Anodyne	TRPM8	28	40
C[C@@H](Cc1ccc(C(F)(F)F)cc1)NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875273061	EE	On-Demand	Anodyne	CCR2	23	45
N#C[C@]1(C(=O)Oc2cccc(C(=O)N3CCc4ccccc4C3)c2)CCCOC1	ZINC000875273143	GG	On-Demand	Mild	AKR1C3	16	44
N#C[C@@]1(C(=O)Oc2cccc(C(=O)N3CCc4ccccc4C3)c2)CCCOC1	ZINC000875273144	GG	On-Demand	Mild	AKR1C3	16	44
C[C@H](C[C@@H]1CCOC1)NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875273150	FE	On-Demand	Anodyne	C3AR1	40	40
C[C@H](C[C@@H]1CCOC1)NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875273151	FE	On-Demand	Anodyne	C3AR1	40	40
C#CC[C@@H](CCOC)NC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	ZINC000875273239	FD	On-Demand	Mild	TACR2	41	34
C#CC[C@@H](CCOC)NC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	ZINC000875273239	FD	On-Demand	Mild	PSMB8	43	36
C#CC[C@H](CCOC)NC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	ZINC000875273240	FD	On-Demand	Mild	TACR2	41	34
C#CC[C@H](CCOC)NC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	ZINC000875273240	FD	On-Demand	Mild	PSMB8	43	36
C#CC[C@@H](CCOC)NC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	ZINC000875273241	FD	On-Demand	Mild	TACR2	41	34
C#CC[C@@H](CCOC)NC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	ZINC000875273241	FD	On-Demand	Mild	PSMB8	43	36
C#CC[C@H](CCOC)NC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	ZINC000875273242	FD	On-Demand	Mild	TACR2	41	34
C#CC[C@H](CCOC)NC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	ZINC000875273242	FD	On-Demand	Mild	PSMB8	43	36
NC(=O)C1CC(NC(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000875273255	FC	On-Demand	Anodyne	MME	24	41
NC(=O)C1CC(NC(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000875273256	FC	On-Demand	Anodyne	MME	24	41
CCC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ncc(Cl)s1	ZINC000875273257	GG	On-Demand	Anodyne	CAPN2	71	37
CCC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ncc(Cl)s1	ZINC000875273258	GG	On-Demand	Anodyne	CAPN2	71	37
COC(=O)C1(O)CN(C(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000875273259	GB	On-Demand	Anodyne	PSMB8	45	38
COC(=O)C1(O)CN(C(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000875273260	GB	On-Demand	Anodyne	PSMB8	45	38
CCCCCCCNC(=O)C(=O)NCCn1cccc1	ZINC000875273268	CD	On-Demand	Mild	ASAH1	102	44
O=C(N[C@H](Cc1ccccc1)CN1CCOCC1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875273282	GE	On-Demand	Anodyne	TACR2	40	38
O=C(N[C@H](Cc1ccccc1)CN1CCOCC1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875273282	GE	On-Demand	Anodyne	PGA5	42	32
O=C(N[C@H](Cc1ccccc1)CN1CCOCC1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875273283	GE	On-Demand	Anodyne	TACR2	40	38
O=C(N[C@H](Cc1ccccc1)CN1CCOCC1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875273283	GE	On-Demand	Anodyne	PGA5	42	32
O=C(N[C@H](Cc1ccccc1)CN1CCOCC1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875273284	GE	On-Demand	Anodyne	TACR2	40	38
O=C(N[C@H](Cc1ccccc1)CN1CCOCC1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875273284	GE	On-Demand	Anodyne	PGA5	42	32
O=C(N[C@H](Cc1ccccc1)CN1CCOCC1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875273285	GE	On-Demand	Anodyne	TACR2	40	38
O=C(N[C@H](Cc1ccccc1)CN1CCOCC1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875273285	GE	On-Demand	Anodyne	PGA5	42	32
C[C@@H](C[C@H]1CCOC1)NC(=O)C(=O)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000875273315	GE	On-Demand	Anodyne	DRD2	24	43
C[C@@H](C[C@@H]1CCOC1)NC(=O)C(=O)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000875273316	GE	On-Demand	Anodyne	DRD2	24	43
C[C@@H](C[C@H]1CCOC1)NC(=O)C(=O)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000875273317	GE	On-Demand	Anodyne	DRD2	24	43
C[C@@H](C[C@@H]1CCOC1)NC(=O)C(=O)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000875273318	GE	On-Demand	Anodyne	DRD2	24	43
COC(=O)N(C)NC(=O)N[C@H]1c2ccccc2C[C@H]1C	ZINC000875273337	CD	On-Demand	Reactive	PLM1_PLAFA	41	39
COC(=O)N(C)NC(=O)N[C@@H]1c2ccccc2C[C@@H]1C	ZINC000875273338	CD	On-Demand	Reactive	PLM1_PLAFA	41	39
COC(=O)N(C)NC(=O)N[C@H]1c2ccccc2C[C@@H]1C	ZINC000875273339	CD	On-Demand	Reactive	PLM1_PLAFA	41	39
COC(=O)N(C)NC(=O)N[C@@H]1c2ccccc2C[C@H]1C	ZINC000875273340	CD	On-Demand	Reactive	PLM1_PLAFA	41	39
Cc1nc(CN2CCC(CNC(=O)N3CCN(C)C(C)(C)CC3)CC2)oc1C	ZINC000875273385	GF	On-Demand	Anodyne	CACNA1I	42	34
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000875273432	FD	On-Demand	Anodyne	OPRM1	29	42
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000875273432	FD	On-Demand	Anodyne	TACR2	52	38
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000875273432	FD	On-Demand	Anodyne	REN	53	41
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000875273432	FD	On-Demand	Anodyne	CTSS	26	42
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000875273432	FD	On-Demand	Anodyne	DPP7	54	38
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000875273432	FD	On-Demand	Anodyne	PGA5	44	33
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000875273433	FD	On-Demand	Anodyne	OPRM1	29	42
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000875273433	FD	On-Demand	Anodyne	TACR2	52	38
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000875273433	FD	On-Demand	Anodyne	REN	53	41
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000875273433	FD	On-Demand	Anodyne	CTSS	26	42
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000875273433	FD	On-Demand	Anodyne	DPP7	54	38
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000875273433	FD	On-Demand	Anodyne	PGA5	44	33
CC(=O)[C@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000875273434	FD	On-Demand	Anodyne	OPRM1	29	42
CC(=O)[C@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000875273434	FD	On-Demand	Anodyne	TACR2	52	38
CC(=O)[C@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000875273434	FD	On-Demand	Anodyne	REN	53	41
CC(=O)[C@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000875273434	FD	On-Demand	Anodyne	CTSS	26	42
CC(=O)[C@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000875273434	FD	On-Demand	Anodyne	DPP7	54	38
CC(=O)[C@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000875273434	FD	On-Demand	Anodyne	PGA5	44	33
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000875273435	FD	On-Demand	Anodyne	OPRM1	29	42
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000875273435	FD	On-Demand	Anodyne	TACR2	52	38
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000875273435	FD	On-Demand	Anodyne	REN	53	41
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000875273435	FD	On-Demand	Anodyne	CTSS	26	42
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000875273435	FD	On-Demand	Anodyne	DPP7	54	38
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000875273435	FD	On-Demand	Anodyne	PGA5	44	33
COCC1CC(NC(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000875273444	FD	On-Demand	Anodyne	MME	16	42
COCC1CC(NC(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000875273444	FD	On-Demand	Anodyne	PSMB8	48	38
COCC1CC(NC(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000875273445	FD	On-Demand	Anodyne	MME	16	42
COCC1CC(NC(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000875273445	FD	On-Demand	Anodyne	PSMB8	48	38
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H](C)C(=O)Nc2ccccc2)cc1	ZINC000875273542	FE	On-Demand	Anodyne	ANPEP	30	44
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H](C)C(=O)Nc2ccccc2)cc1	ZINC000875273542	FE	On-Demand	Anodyne	TIMP3	48	35
CC(=O)N(C)c1ccc(CNC(=O)N[C@H](C)C(=O)Nc2ccccc2)cc1	ZINC000875273543	FE	On-Demand	Anodyne	ANPEP	30	44
CC(=O)N(C)c1ccc(CNC(=O)N[C@H](C)C(=O)Nc2ccccc2)cc1	ZINC000875273543	FE	On-Demand	Anodyne	TIMP3	48	35
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cccc(Oc2ncccn2)c1	ZINC000875273545	EF	On-Demand	Anodyne	ANPEP	24	40
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cccc(Oc2ncccn2)c1	ZINC000875273545	EF	On-Demand	Anodyne	ACACA	36	44
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cccc(Oc2ncccn2)c1	ZINC000875273545	EF	On-Demand	Anodyne	ACACB	59	45
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cccc(Oc2ncccn2)c1	ZINC000875273545	EF	On-Demand	Anodyne	CAPNS1	50	30
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cccc(Oc2ncccn2)c1	ZINC000875273545	EF	On-Demand	Anodyne	MTNR1A	16	46
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cccc(Oc2ncccn2)c1	ZINC000875273545	EF	On-Demand	Anodyne	MTNR1B	20	46
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cccc(Oc2ncccn2)c1	ZINC000875273545	EF	On-Demand	Anodyne	CAPN1	55	40
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cccc(Oc2ncccn2)c1	ZINC000875273545	EF	On-Demand	Anodyne	CAPN2	58	34
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cccc(Oc2ncccn2)c1	ZINC000875273545	EF	On-Demand	Anodyne	HPN	67	34
CCO[C@@H](C(=O)Oc1ccc([N+](=O)[O-])cc1OC)C(C)C	ZINC000875273556	CF	On-Demand	Reactive	CACNA1D	46	36
CO[C@H](CNC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(Cl)cc1	ZINC000875273621	FD	On-Demand	Anodyne	CACNA1I	42	33
CO[C@H](CNC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(Cl)cc1	ZINC000875273623	FD	On-Demand	Anodyne	CACNA1I	42	33
O=C(NCCn1cccc1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875273633	FD	On-Demand	Anodyne	ETHR	59	48
Cc1nc(CN2CCC(CNC(=O)N3CC[C@H](C(C)(C)O)C3)CC2)oc1C	ZINC000875273649	GE	On-Demand	Anodyne	HTR4	53	36
Cc1nc(CN2CCC(CNC(=O)N3CC[C@H](C(C)(C)O)C3)CC2)oc1C	ZINC000875273649	GE	On-Demand	Anodyne	CACNA1I	67	37
Cc1nc(CN2CCC(CNC(=O)N3CC[C@@H](C(C)(C)O)C3)CC2)oc1C	ZINC000875273650	GE	On-Demand	Anodyne	HTR4	53	36
Cc1nc(CN2CCC(CNC(=O)N3CC[C@@H](C(C)(C)O)C3)CC2)oc1C	ZINC000875273650	GE	On-Demand	Anodyne	CACNA1I	67	37
CC(=O)C1CCN(C(=O)C(=O)NC2CC(c3cccc(Cl)c3)C2)CC1	ZINC000875273697	FF	On-Demand	Anodyne	EPHX2	21	40
Cc1nc(CN2CCC(CNC(=O)NC[C@H]3C[C@H](O)C3)CC2)oc1C	ZINC000875273741	FD	On-Demand	Anodyne	HTR4	41	36
Cc1nc(CN2CCC(CNC(=O)NC[C@H]3C[C@H](O)C3)CC2)oc1C	ZINC000875273741	FD	On-Demand	Anodyne	CACNA1I	60	38
O=C(NCc1cccc(COC2CCOCC2)c1)N1Cc2cccc(O)c2C1	ZINC000875273749	GG	On-Demand	Clean	NAMPT	19	41
O=C(N[C@H]1CC12CCC2)N[C@H](Cc1ccccc1)CN1CCOCC1	ZINC000875273756	EE	On-Demand	Anodyne	TACR2	40	37
O=C(N[C@H](Cc1ccccc1)CN1CCOCC1)N[C@@H]1CC12CCC2	ZINC000875273757	EE	On-Demand	Anodyne	TACR2	40	37
O=C(N[C@@H](Cc1ccccc1)CN1CCOCC1)N[C@H]1CC12CCC2	ZINC000875273758	EE	On-Demand	Anodyne	TACR2	40	37
O=C(N[C@@H](Cc1ccccc1)CN1CCOCC1)N[C@@H]1CC12CCC2	ZINC000875273759	EE	On-Demand	Anodyne	TACR2	40	37
Cc1nc(CN2CCC(CNC(=O)NC(C)(C)[C@H]3CCCCO3)CC2)oc1C	ZINC000875273789	GG	On-Demand	Anodyne	CACNA1I	64	36
Cc1nc(CN2CCC(CNC(=O)NC(C)(C)[C@@H]3CCCCO3)CC2)oc1C	ZINC000875273794	GG	On-Demand	Anodyne	CACNA1I	64	36
Cc1nc(CN2CCC(CNC(=O)N3CCC[C@@H](C(C)(C)O)C3)CC2)oc1C	ZINC000875273795	GF	On-Demand	Anodyne	HTR4	46	35
Cc1nc(CN2CCC(CNC(=O)N3CCC[C@@H](C(C)(C)O)C3)CC2)oc1C	ZINC000875273795	GF	On-Demand	Anodyne	CACNA1I	66	38
Cc1nc(CN2CCC(CNC(=O)N3CCC[C@H](C(C)(C)O)C3)CC2)oc1C	ZINC000875273796	GF	On-Demand	Anodyne	HTR4	46	35
Cc1nc(CN2CCC(CNC(=O)N3CCC[C@H](C(C)(C)O)C3)CC2)oc1C	ZINC000875273796	GF	On-Demand	Anodyne	CACNA1I	66	38
CCC[C@@H](CCc1ccccc1)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875273842	FF	On-Demand	Anodyne	ACE	58	37
CCC[C@@H](CCc1ccccc1)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875273842	FF	On-Demand	Anodyne	SIGMAR1	22	44
CCC[C@@H](CCc1ccccc1)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875273842	FF	On-Demand	Anodyne	CAPNS1	61	32
CCC[C@@H](CCc1ccccc1)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875273842	FF	On-Demand	Anodyne	CAPN1	52	36
CCC[C@@H](CCc1ccccc1)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875273842	FF	On-Demand	Anodyne	CAPN2	73	35
CCC[C@H](CCc1ccccc1)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875273843	FF	On-Demand	Anodyne	ACE	58	37
CCC[C@H](CCc1ccccc1)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875273843	FF	On-Demand	Anodyne	SIGMAR1	22	44
CCC[C@H](CCc1ccccc1)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875273843	FF	On-Demand	Anodyne	CAPNS1	61	32
CCC[C@H](CCc1ccccc1)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875273843	FF	On-Demand	Anodyne	CAPN1	52	36
CCC[C@H](CCc1ccccc1)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875273843	FF	On-Demand	Anodyne	CAPN2	73	35
CCC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1nn(C)cc1C(F)F	ZINC000875273854	GF	On-Demand	Anodyne	CAPN2	49	32
CCC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1nn(C)cc1C(F)F	ZINC000875273855	GF	On-Demand	Anodyne	CAPN2	49	32
O=CN1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)CC1	ZINC000875273867	FC	On-Demand	Anodyne	CTSH	19	40
O=CN1CCCN(C(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)CC1	ZINC000875273868	FC	On-Demand	Anodyne	CTSH	19	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	ZINC000875273887	FD	On-Demand	Anodyne	MME	57	39
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	ZINC000875273887	FD	On-Demand	Anodyne	CAPN1	23	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	ZINC000875273887	FD	On-Demand	Anodyne	CAPN2	22	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	ZINC000875273887	FD	On-Demand	Anodyne	PGA5	43	34
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	ZINC000875273888	FD	On-Demand	Anodyne	MME	57	39
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	ZINC000875273888	FD	On-Demand	Anodyne	CAPN1	23	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	ZINC000875273888	FD	On-Demand	Anodyne	CAPN2	22	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	ZINC000875273888	FD	On-Demand	Anodyne	PGA5	43	34
O=C(N[C@@H](Cc1ccccc1)CN1CCOCC1)N[C@@H]1CCOC[C@H]1O	ZINC000875273906	FC	On-Demand	Anodyne	TACR2	40	37
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCCn1cccc1	ZINC000875273907	GE	On-Demand	Anodyne	CHRM2	18	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCCn1cccc1	ZINC000875273907	GE	On-Demand	Anodyne	DRD2	33	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCCn1cccc1	ZINC000875273907	GE	On-Demand	Anodyne	DRD4	53	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCCn1cccc1	ZINC000875273907	GE	On-Demand	Anodyne	ACHE	70	65
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCCn1cccc1	ZINC000875273907	GE	On-Demand	Anodyne	HRH1	16	47
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCCn1cccc1	ZINC000875273907	GE	On-Demand	Anodyne	DRD3	29	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCCn1cccc1	ZINC000875273907	GE	On-Demand	Anodyne	SLC6A3	20	52
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCCn1cccc1	ZINC000875273907	GE	On-Demand	Anodyne	HTR4	44	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCCn1cccc1	ZINC000875273907	GE	On-Demand	Anodyne	CHRM3	21	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCCn1cccc1	ZINC000875273907	GE	On-Demand	Anodyne	SIGMAR1	76	50
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCCn1cccc1	ZINC000875273907	GE	On-Demand	Anodyne	BCHE	21	52
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCCn1cccc1	ZINC000875273907	GE	On-Demand	Anodyne	CCR3	42	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCCn1cccc1	ZINC000875273907	GE	On-Demand	Anodyne	MCHR1	26	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCCn1cccc1	ZINC000875273907	GE	On-Demand	Anodyne	CACNA1G	32	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)NCCn1cccc1	ZINC000875273907	GE	On-Demand	Anodyne	CYP2J2	44	31
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCCC(=O)N2CCc3ccccc32)C1	ZINC000875273931	FF	On-Demand	Anodyne	DRD4	22	41
C#CC[C@H](COC)NC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	ZINC000875273961	FD	On-Demand	Mild	PSMB8	44	36
C#CC[C@@H](COC)NC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	ZINC000875273963	FD	On-Demand	Mild	PSMB8	44	36
C#CC[C@@H](COC)NC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	ZINC000875273965	FD	On-Demand	Mild	PSMB8	44	36
C#CC[C@H](COC)NC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	ZINC000875273967	FD	On-Demand	Mild	PSMB8	44	36
CC(=O)c1ccc(N2CCN(C(=O)COC(=O)C3(c4cccc(C)c4)CCC3)CC2)c(F)c1	ZINC000875274008	JH	On-Demand	Anodyne	SLC6A9	15	43
O=C(NCCn1cccc1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875274016	FD	On-Demand	Anodyne	C3AR1	39	40
O=C(NCCn1cccc1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875274018	FD	On-Demand	Anodyne	C3AR1	39	40
Cc1nc(CN2CCC(CNC(=O)NC3(C)CC(F)(F)C3)CC2)oc1C	ZINC000875274019	FF	On-Demand	Anodyne	CACNA1I	64	37
C/C=C\C(=O)N[C@H](C)c1ccc2ccccc2c1	ZINC000875274045	BH	On-Demand	Anodyne	KCNQ2	57	44
C/C=C/C(=O)N[C@H](C)c1ccc2ccccc2c1	ZINC000875274049	BH	On-Demand	Anodyne	KCNQ2	57	44
C/C=C\C(=O)N[C@@H](C)c1ccc2ccccc2c1	ZINC000875274050	BH	On-Demand	Anodyne	KCNQ2	57	44
C/C=C/C(=O)N[C@@H](C)c1ccc2ccccc2c1	ZINC000875274052	BH	On-Demand	Anodyne	KCNQ2	57	44
C[C@H](NC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)C(C)(C)CN(C)C	ZINC000875274091	GD	On-Demand	Anodyne	XIAP	43	36
C[C@H](NC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)C(C)(C)CN(C)C	ZINC000875274092	GD	On-Demand	Anodyne	XIAP	43	36
C[C@H](NC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)C(C)(C)CN(C)C	ZINC000875274093	GD	On-Demand	Anodyne	XIAP	43	36
C[C@H](NC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)C(C)(C)CN(C)C	ZINC000875274094	GD	On-Demand	Anodyne	XIAP	43	36
COC(=O)N(C)NC(=O)NCC1CCN(Cc2nc(C)c(C)o2)CC1	ZINC000875274153	FD	On-Demand	Reactive	CACNA1I	54	36
C[C@@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)C(=O)Nc1ccccc1	ZINC000875274175	GF	On-Demand	Anodyne	KCNA3	47	39
C[C@@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)C(=O)Nc1ccccc1	ZINC000875274175	GF	On-Demand	Anodyne	TIMP3	40	32
C[C@@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)C(=O)Nc1ccccc1	ZINC000875274175	GF	On-Demand	Anodyne	SOAT1	19	50
C[C@@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)C(=O)Nc1ccccc1	ZINC000875274175	GF	On-Demand	Anodyne	NPFFR1	23	42
C[C@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)C(=O)Nc1ccccc1	ZINC000875274176	GF	On-Demand	Anodyne	KCNA3	47	39
C[C@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)C(=O)Nc1ccccc1	ZINC000875274176	GF	On-Demand	Anodyne	TIMP3	40	32
C[C@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)C(=O)Nc1ccccc1	ZINC000875274176	GF	On-Demand	Anodyne	SOAT1	19	50
C[C@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)C(=O)Nc1ccccc1	ZINC000875274176	GF	On-Demand	Anodyne	NPFFR1	23	42
COC(=O)c1oc(C(=O)N(c2ccc(N3CCOCC3)cc2)C(C)C)cc1C	ZINC000875274178	GG	On-Demand	Anodyne	EPHB4	44	32
Cc1nc(CN2CCC(CNC(=O)NCC[C@H](O)C3CCCC3)CC2)oc1C	ZINC000875274208	GF	On-Demand	Anodyne	HTR4	41	34
Cc1nc(CN2CCC(CNC(=O)NCC[C@H](O)C3CCCC3)CC2)oc1C	ZINC000875274208	GF	On-Demand	Anodyne	CACNA1I	45	34
Cc1nc(CN2CCC(CNC(=O)NCC[C@@H](O)C3CCCC3)CC2)oc1C	ZINC000875274209	GF	On-Demand	Anodyne	HTR4	41	34
Cc1nc(CN2CCC(CNC(=O)NCC[C@@H](O)C3CCCC3)CC2)oc1C	ZINC000875274209	GF	On-Demand	Anodyne	CACNA1I	45	34
COc1cnc(C(=O)N(c2ccc(N3CCOCC3)cc2)C(C)C)c(F)c1	ZINC000875274293	FG	On-Demand	Anodyne	STAT6	43	32
Cc1nc(CN2CCC(CNC(=O)N3CCCN(C=O)CC3)CC2)oc1C	ZINC000875274309	GD	On-Demand	Anodyne	CACNA1I	45	34
COc1cccc(O[C@@H](C)CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875274311	FD	On-Demand	Anodyne	DRD4	43	32
COc1cccc(O[C@@H](C)CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875274311	FD	On-Demand	Anodyne	MTNR1A	42	56
COc1cccc(O[C@@H](C)CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875274311	FD	On-Demand	Anodyne	MTNR1B	44	56
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875274312	FD	On-Demand	Anodyne	DRD4	43	32
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875274312	FD	On-Demand	Anodyne	MTNR1A	42	56
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875274312	FD	On-Demand	Anodyne	MTNR1B	44	56
COc1cccc(O[C@@H](C)CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875274313	FD	On-Demand	Anodyne	DRD4	43	32
COc1cccc(O[C@@H](C)CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875274313	FD	On-Demand	Anodyne	MTNR1A	42	56
COc1cccc(O[C@@H](C)CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875274313	FD	On-Demand	Anodyne	MTNR1B	44	56
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875274314	FD	On-Demand	Anodyne	DRD4	43	32
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875274314	FD	On-Demand	Anodyne	MTNR1A	42	56
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875274314	FD	On-Demand	Anodyne	MTNR1B	44	56
CCCCCCCNC(=O)C(=O)N[C@H](c1ncc(C)s1)C1CC1	ZINC000875274322	EG	On-Demand	Mild	ASAH1	47	31
CCCCCCCNC(=O)C(=O)N[C@@H](c1ncc(C)s1)C1CC1	ZINC000875274323	EG	On-Demand	Mild	ASAH1	47	31
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H](C)Oc2cccc(F)c2)CC1	ZINC000875274331	FD	On-Demand	Anodyne	CCR5	40	31
CC(=O)C1CCN(C(=O)C(=O)NC[C@H](C)Oc2cccc(F)c2)CC1	ZINC000875274332	FD	On-Demand	Anodyne	CCR5	40	31
C[C@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)c1cccc(O)c1	ZINC000875274350	FG	On-Demand	Anodyne	KCNA3	43	37
C[C@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)c1cccc(O)c1	ZINC000875274350	FG	On-Demand	Anodyne	SOAT1	32	51
C[C@@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)c1cccc(O)c1	ZINC000875274351	FG	On-Demand	Anodyne	KCNA3	43	37
C[C@@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)c1cccc(O)c1	ZINC000875274351	FG	On-Demand	Anodyne	SOAT1	32	51
O=C(NCCN1CCSCC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875274365	GE	On-Demand	Anodyne	PLD1	46	36
O=C(NCCN1CCSCC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875274365	GE	On-Demand	Anodyne	PLD2	47	36
COc1cccc(O[C@H](C)CNC(=O)C(=O)N[C@H](C)c2ccnn2C)c1	ZINC000875274370	FD	On-Demand	Anodyne	DRD4	42	32
COc1cccc(O[C@H](C)CNC(=O)C(=O)N[C@H](C)c2ccnn2C)c1	ZINC000875274370	FD	On-Demand	Anodyne	MTNR1A	41	56
COc1cccc(O[C@H](C)CNC(=O)C(=O)N[C@H](C)c2ccnn2C)c1	ZINC000875274370	FD	On-Demand	Anodyne	MTNR1B	41	56
COc1cccc(O[C@H](C)CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)c1	ZINC000875274371	FD	On-Demand	Anodyne	DRD4	42	32
COc1cccc(O[C@H](C)CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)c1	ZINC000875274371	FD	On-Demand	Anodyne	MTNR1A	41	56
COc1cccc(O[C@H](C)CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)c1	ZINC000875274371	FD	On-Demand	Anodyne	MTNR1B	41	56
COc1cccc(O[C@@H](C)CNC(=O)C(=O)N[C@H](C)c2ccnn2C)c1	ZINC000875274372	FD	On-Demand	Anodyne	DRD4	42	32
COc1cccc(O[C@@H](C)CNC(=O)C(=O)N[C@H](C)c2ccnn2C)c1	ZINC000875274372	FD	On-Demand	Anodyne	MTNR1A	41	56
COc1cccc(O[C@@H](C)CNC(=O)C(=O)N[C@H](C)c2ccnn2C)c1	ZINC000875274372	FD	On-Demand	Anodyne	MTNR1B	41	56
COc1cccc(O[C@@H](C)CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)c1	ZINC000875274373	FD	On-Demand	Anodyne	DRD4	42	32
COc1cccc(O[C@@H](C)CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)c1	ZINC000875274373	FD	On-Demand	Anodyne	MTNR1A	41	56
COc1cccc(O[C@@H](C)CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)c1	ZINC000875274373	FD	On-Demand	Anodyne	MTNR1B	41	56
O=C(NCCN1CCSCC1)NNc1cccc(F)c1Cl	ZINC000875274382	EE	On-Demand	Reactive	DRD4	44	35
O=C(NCCN1CCSCC1)NNc1cccc(F)c1Cl	ZINC000875274382	EE	On-Demand	Reactive	PLD2	47	34
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)c1cccc(O)c1	ZINC000875274403	FH	On-Demand	Anodyne	OPRM1	25	49
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)c1cccc(O)c1	ZINC000875274403	FH	On-Demand	Anodyne	OPRK1	22	42
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)c1cccc(O)c1	ZINC000875274403	FH	On-Demand	Anodyne	OPRL1	17	49
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)c1cccc(O)c1	ZINC000875274404	FH	On-Demand	Anodyne	OPRM1	25	49
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)c1cccc(O)c1	ZINC000875274404	FH	On-Demand	Anodyne	OPRK1	22	42
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)c1cccc(O)c1	ZINC000875274404	FH	On-Demand	Anodyne	OPRL1	17	49
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H](C)Oc1cccc(F)c1	ZINC000875274431	EC	On-Demand	Mild	GCK	15	42
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H](C)Oc1cccc(F)c1	ZINC000875274432	EC	On-Demand	Mild	GCK	15	42
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H](C)Oc1cccc(F)c1	ZINC000875274433	EC	On-Demand	Mild	GCK	15	42
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H](C)Oc1cccc(F)c1	ZINC000875274434	EC	On-Demand	Mild	GCK	15	42
C[C@@H](NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1)c1cccc(O)c1	ZINC000875274470	FH	On-Demand	Anodyne	SMO	40	40
C[C@@H](NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1)c1cccc(O)c1	ZINC000875274470	FH	On-Demand	Anodyne	ETHR	62	43
CCOC(=O)[C@@H]1CN(C(=O)N[C@H](C)c2cccc(O)c2)C[C@H]1C(F)(F)F	ZINC000875274474	FF	On-Demand	Anodyne	P2RY12	15	40
CCOC(=O)[C@@H]1CN(C(=O)N[C@@H](C)c2cccc(O)c2)C[C@H]1C(F)(F)F	ZINC000875274475	FF	On-Demand	Anodyne	P2RY12	15	40
N#Cc1ccc(Cn2cc(NC(=O)NCCN3CCSCC3)cn2)cc1	ZINC000875274510	FD	On-Demand	Mild	CCR3	29	48
N#Cc1ccc(Cn2cc(NC(=O)NCCN3CCSCC3)cn2)cc1	ZINC000875274510	FD	On-Demand	Mild	ITK	15	50
N#Cc1ccc(Cn2cc(NC(=O)NCCN3CCSCC3)cn2)cc1	ZINC000875274510	FD	On-Demand	Mild	PANC	41	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@@H](C)c1cccc(O)c1)CC2	ZINC000875274511	FH	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@@H](C)c1cccc(O)c1)CC2	ZINC000875274511	FH	On-Demand	Anodyne	HCRTR1	15	54
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@@H](C)c1cccc(O)c1)CC2	ZINC000875274511	FH	On-Demand	Anodyne	MTNR1B	16	52
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@H](C)c1cccc(O)c1)CC2	ZINC000875274512	FH	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@H](C)c1cccc(O)c1)CC2	ZINC000875274512	FH	On-Demand	Anodyne	HCRTR1	15	54
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@H](C)c1cccc(O)c1)CC2	ZINC000875274512	FH	On-Demand	Anodyne	MTNR1B	16	52
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)N[C@@H](C)c1cccc(O)c1)CC2	ZINC000875274513	FH	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)N[C@@H](C)c1cccc(O)c1)CC2	ZINC000875274513	FH	On-Demand	Anodyne	HCRTR1	15	54
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)N[C@@H](C)c1cccc(O)c1)CC2	ZINC000875274513	FH	On-Demand	Anodyne	MTNR1B	16	52
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)N[C@H](C)c1cccc(O)c1)CC2	ZINC000875274514	FH	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)N[C@H](C)c1cccc(O)c1)CC2	ZINC000875274514	FH	On-Demand	Anodyne	HCRTR1	15	54
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)N[C@H](C)c1cccc(O)c1)CC2	ZINC000875274514	FH	On-Demand	Anodyne	MTNR1B	16	52
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H](C)Oc2ccc(Cl)cc2)CC1	ZINC000875274525	FE	On-Demand	Anodyne	CCR1	41	36
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H](C)Oc2ccc(Cl)cc2)CC1	ZINC000875274525	FE	On-Demand	Anodyne	EBP	19	46
CC(=O)C1CCN(C(=O)C(=O)NC[C@H](C)Oc2ccc(Cl)cc2)CC1	ZINC000875274526	FE	On-Demand	Anodyne	CCR1	41	36
CC(=O)C1CCN(C(=O)C(=O)NC[C@H](C)Oc2ccc(Cl)cc2)CC1	ZINC000875274526	FE	On-Demand	Anodyne	EBP	19	46
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CC[C@@H]3[C@H](CCN3C)C2)c1	ZINC000875274612	GD	On-Demand	Anodyne	DRD4	44	34
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CC[C@@H]3[C@H](CCN3C)C2)c1	ZINC000875274612	GD	On-Demand	Anodyne	MTNR1A	27	53
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CC[C@@H]3[C@H](CCN3C)C2)c1	ZINC000875274612	GD	On-Demand	Anodyne	MTNR1B	31	53
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CC[C@H]3[C@H](CCN3C)C2)c1	ZINC000875274613	GD	On-Demand	Anodyne	DRD4	44	34
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CC[C@H]3[C@H](CCN3C)C2)c1	ZINC000875274613	GD	On-Demand	Anodyne	MTNR1A	27	53
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CC[C@H]3[C@H](CCN3C)C2)c1	ZINC000875274613	GD	On-Demand	Anodyne	MTNR1B	31	53
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CC[C@@H]3[C@@H](CCN3C)C2)c1	ZINC000875274614	GD	On-Demand	Anodyne	DRD4	44	34
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CC[C@@H]3[C@@H](CCN3C)C2)c1	ZINC000875274614	GD	On-Demand	Anodyne	MTNR1A	27	53
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CC[C@@H]3[C@@H](CCN3C)C2)c1	ZINC000875274614	GD	On-Demand	Anodyne	MTNR1B	31	53
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CC[C@H]3[C@@H](CCN3C)C2)c1	ZINC000875274615	GD	On-Demand	Anodyne	DRD4	44	34
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CC[C@H]3[C@@H](CCN3C)C2)c1	ZINC000875274615	GD	On-Demand	Anodyne	MTNR1A	27	53
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CC[C@H]3[C@@H](CCN3C)C2)c1	ZINC000875274615	GD	On-Demand	Anodyne	MTNR1B	31	53
CCC(CC)c1cc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)on1	ZINC000875274620	GF	On-Demand	Anodyne	SLC5A7	33	46
N#Cc1cccc([C@H](NC(=O)NCCN2CCSCC2)C(F)(F)F)c1	ZINC000875274629	FF	On-Demand	Mild	DRD4	40	30
N#Cc1cccc([C@H](NC(=O)NCCN2CCSCC2)C(F)(F)F)c1	ZINC000875274629	FF	On-Demand	Mild	CCR3	16	46
N#Cc1cccc([C@@H](NC(=O)NCCN2CCSCC2)C(F)(F)F)c1	ZINC000875274630	FF	On-Demand	Mild	DRD4	40	30
N#Cc1cccc([C@@H](NC(=O)NCCN2CCSCC2)C(F)(F)F)c1	ZINC000875274630	FF	On-Demand	Mild	CCR3	16	46
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccc(O)c1	ZINC000875274633	GH	On-Demand	Anodyne	OPRM1	39	41
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccc(O)c1	ZINC000875274633	GH	On-Demand	Anodyne	OPRD1	35	41
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccc(O)c1	ZINC000875274633	GH	On-Demand	Anodyne	OPRK1	18	40
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccc(O)c1	ZINC000875274633	GH	On-Demand	Anodyne	GRIN2B	42	37
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccc(O)c1	ZINC000875274633	GH	On-Demand	Anodyne	ELANE	34	41
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccc(O)c1	ZINC000875274633	GH	On-Demand	Anodyne	CTRA_BOVIN	59	32
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccc(O)c1	ZINC000875274633	GH	On-Demand	Anodyne	KLK3	70	36
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccc(O)c1	ZINC000875274633	GH	On-Demand	Anodyne	CTSB	64	48
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccc(O)c1	ZINC000875274633	GH	On-Demand	Anodyne	PAPA1_CARPA	46	35
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccc(O)c1	ZINC000875274633	GH	On-Demand	Anodyne	CYSP_TRYCR	56	38
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccc(O)c1	ZINC000875274633	GH	On-Demand	Anodyne	CTSG	41	32
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccc(O)c1	ZINC000875274633	GH	On-Demand	Anodyne	CTSK	55	48
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccc(O)c1	ZINC000875274633	GH	On-Demand	Anodyne	CTSL	47	48
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccc(O)c1	ZINC000875274633	GH	On-Demand	Anodyne	PREP	25	43
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccc(O)c1	ZINC000875274633	GH	On-Demand	Anodyne	CAPNS1	62	35
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccc(O)c1	ZINC000875274633	GH	On-Demand	Anodyne	CELA2A	48	32
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccc(O)c1	ZINC000875274633	GH	On-Demand	Anodyne	CAPN1	83	40
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccc(O)c1	ZINC000875274633	GH	On-Demand	Anodyne	CAPN2	134	38
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccc(O)c1	ZINC000875274633	GH	On-Demand	Anodyne	TGM2	36	42
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccc(O)c1	ZINC000875274633	GH	On-Demand	Anodyne	NPR	56	32
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccc(O)c1	ZINC000875274633	GH	On-Demand	Anodyne	XIAP	42	34
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccc(O)c1	ZINC000875274633	GH	On-Demand	Anodyne	F13A1	21	42
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccc(O)c1	ZINC000875274633	GH	On-Demand	Anodyne	BIRC2	31	43
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccc(O)c1	ZINC000875274633	GH	On-Demand	Anodyne	BIRC8	40	33
C[C@@H](NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)c1cccc(O)c1	ZINC000875274633	GH	On-Demand	Anodyne	Q6PRC7_IXORI	56	36
COc1ccc(N2CCN(C(=O)N[C@@H](C)c3cccc(O)c3)CC2)c(OC)c1	ZINC000875274650	GG	On-Demand	Clean	HTR1A	30	43
COc1ccc(N2CCN(C(=O)N[C@@H](C)c3cccc(O)c3)CC2)c(OC)c1	ZINC000875274650	GG	On-Demand	Clean	DRD2	24	40
COc1ccc(N2CCN(C(=O)N[C@@H](C)c3cccc(O)c3)CC2)c(OC)c1	ZINC000875274650	GG	On-Demand	Clean	DRD4	42	32
COc1ccc(N2CCN(C(=O)N[C@@H](C)c3cccc(O)c3)CC2)c(OC)c1	ZINC000875274650	GG	On-Demand	Clean	PDGFRB	35	40
COc1ccc(N2CCN(C(=O)N[C@@H](C)c3cccc(O)c3)CC2)c(OC)c1	ZINC000875274650	GG	On-Demand	Clean	MTNR1B	17	41
COc1ccc(N2CCN(C(=O)N[C@H](C)c3cccc(O)c3)CC2)c(OC)c1	ZINC000875274651	GG	On-Demand	Clean	HTR1A	30	43
COc1ccc(N2CCN(C(=O)N[C@H](C)c3cccc(O)c3)CC2)c(OC)c1	ZINC000875274651	GG	On-Demand	Clean	DRD2	24	40
COc1ccc(N2CCN(C(=O)N[C@H](C)c3cccc(O)c3)CC2)c(OC)c1	ZINC000875274651	GG	On-Demand	Clean	DRD4	42	32
COc1ccc(N2CCN(C(=O)N[C@H](C)c3cccc(O)c3)CC2)c(OC)c1	ZINC000875274651	GG	On-Demand	Clean	PDGFRB	35	40
COc1ccc(N2CCN(C(=O)N[C@H](C)c3cccc(O)c3)CC2)c(OC)c1	ZINC000875274651	GG	On-Demand	Clean	MTNR1B	17	41
C[C@@H](NC(=O)NC[C@@H](O)Cc1cccc(Cl)c1)c1cccc(O)c1	ZINC000875274657	EG	On-Demand	Anodyne	CTSB	19	45
C[C@@H](NC(=O)NC[C@@H](O)Cc1cccc(Cl)c1)c1cccc(O)c1	ZINC000875274657	EG	On-Demand	Anodyne	CTSL	17	44
C[C@@H](NC(=O)NC[C@@H](O)Cc1cccc(Cl)c1)c1cccc(O)c1	ZINC000875274657	EG	On-Demand	Anodyne	CTSV	39	44
C[C@@H](NC(=O)NC[C@H](O)Cc1cccc(Cl)c1)c1cccc(O)c1	ZINC000875274659	EG	On-Demand	Anodyne	CTSB	19	45
C[C@@H](NC(=O)NC[C@H](O)Cc1cccc(Cl)c1)c1cccc(O)c1	ZINC000875274659	EG	On-Demand	Anodyne	CTSL	17	44
C[C@@H](NC(=O)NC[C@H](O)Cc1cccc(Cl)c1)c1cccc(O)c1	ZINC000875274659	EG	On-Demand	Anodyne	CTSV	39	44
C[C@H](NC(=O)NC[C@H](O)Cc1cccc(Cl)c1)c1cccc(O)c1	ZINC000875274660	EG	On-Demand	Anodyne	CTSB	19	45
C[C@H](NC(=O)NC[C@H](O)Cc1cccc(Cl)c1)c1cccc(O)c1	ZINC000875274660	EG	On-Demand	Anodyne	CTSL	17	44
C[C@H](NC(=O)NC[C@H](O)Cc1cccc(Cl)c1)c1cccc(O)c1	ZINC000875274660	EG	On-Demand	Anodyne	CTSV	39	44
CCOC(=O)C1=CC[C@@H](NC(=O)N[C@H](C)c2cccc(O)c2)C1	ZINC000875274669	DE	On-Demand	Anodyne	CAPN2	59	33
CCOC(=O)C1=CC[C@H](NC(=O)N[C@@H](C)c2cccc(O)c2)C1	ZINC000875274670	DE	On-Demand	Anodyne	CAPN2	59	33
CCOC(=O)C1=CC[C@H](NC(=O)N[C@H](C)c2cccc(O)c2)C1	ZINC000875274671	DE	On-Demand	Anodyne	CAPN2	59	33
CCOC(=O)C1=CC[C@@H](NC(=O)N[C@@H](C)c2cccc(O)c2)C1	ZINC000875274672	DE	On-Demand	Anodyne	CAPN2	59	33
O=C(NCCN1CCSCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875274709	ED	On-Demand	Anodyne	PLD1	42	35
O=C(NCCN1CCSCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875274709	ED	On-Demand	Anodyne	PLD2	41	35
O=C(NCCN1CCSCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875274710	ED	On-Demand	Anodyne	PLD1	42	35
O=C(NCCN1CCSCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875274710	ED	On-Demand	Anodyne	PLD2	41	35
O=C(NCCN1CCSCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875274711	ED	On-Demand	Anodyne	PLD1	42	35
O=C(NCCN1CCSCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875274711	ED	On-Demand	Anodyne	PLD2	41	35
O=C(NCCN1CCSCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875274712	ED	On-Demand	Anodyne	PLD1	42	35
O=C(NCCN1CCSCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875274712	ED	On-Demand	Anodyne	PLD2	41	35
COc1cccc(O[C@H](C)CNC(=O)C(=O)NCc2nn(C)cc2C(F)F)c1	ZINC000875274764	GD	On-Demand	Anodyne	DRD4	42	32
COc1cccc(O[C@H](C)CNC(=O)C(=O)NCc2nn(C)cc2C(F)F)c1	ZINC000875274764	GD	On-Demand	Anodyne	MTNR1A	26	53
COc1cccc(O[C@H](C)CNC(=O)C(=O)NCc2nn(C)cc2C(F)F)c1	ZINC000875274764	GD	On-Demand	Anodyne	MTNR1B	27	53
COc1cccc(O[C@@H](C)CNC(=O)C(=O)NCc2nn(C)cc2C(F)F)c1	ZINC000875274765	GD	On-Demand	Anodyne	DRD4	42	32
COc1cccc(O[C@@H](C)CNC(=O)C(=O)NCc2nn(C)cc2C(F)F)c1	ZINC000875274765	GD	On-Demand	Anodyne	MTNR1A	26	53
COc1cccc(O[C@@H](C)CNC(=O)C(=O)NCc2nn(C)cc2C(F)F)c1	ZINC000875274765	GD	On-Demand	Anodyne	MTNR1B	27	53
O=C(NCCN1CCSCC1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875274769	FD	On-Demand	Anodyne	DRD4	42	34
O=C(NCCN1CCSCC1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875274769	FD	On-Demand	Anodyne	PTGER4	16	41
O=C(NCCN1CCSCC1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875274770	FD	On-Demand	Anodyne	DRD4	42	34
O=C(NCCN1CCSCC1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875274770	FD	On-Demand	Anodyne	PTGER4	16	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(c3ccccc3F)C2=O)C1	ZINC000875274873	GD	On-Demand	Anodyne	ACE	31	47
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(c3ccccc3F)C2=O)C1	ZINC000875274874	GD	On-Demand	Anodyne	ACE	31	47
Cc1ccccc1[C@H](CC(C)C)NC(=O)NNC(=O)c1ccc(=O)n(C)c1	ZINC000875274900	FE	On-Demand	Reactive	CTSA	46	36
Cc1ccccc1[C@@H](CC(C)C)NC(=O)NNC(=O)c1ccc(=O)n(C)c1	ZINC000875274901	FE	On-Demand	Reactive	CTSA	46	36
CONC(=O)C1CCN(C(=O)N[C@H](CC(C)C)c2ccccc2C)CC1	ZINC000875274908	FG	On-Demand	Anodyne	CTSA	43	33
CONC(=O)C1CCN(C(=O)N[C@@H](CC(C)C)c2ccccc2C)CC1	ZINC000875274909	FG	On-Demand	Anodyne	CTSA	43	33
C[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1cccc(O)c1	ZINC000875274924	ED	On-Demand	Anodyne	L3MBTL3	76	43
COc1cccc(O[C@H](C)CNC(=O)C(=O)N[C@H]2CC23CCC3)c1	ZINC000875274931	ED	On-Demand	Anodyne	DRD4	42	32
COc1cccc(O[C@H](C)CNC(=O)C(=O)N[C@H]2CC23CCC3)c1	ZINC000875274931	ED	On-Demand	Anodyne	MTNR1A	46	56
COc1cccc(O[C@H](C)CNC(=O)C(=O)N[C@H]2CC23CCC3)c1	ZINC000875274931	ED	On-Demand	Anodyne	MTNR1B	45	56
COc1cccc(O[C@H](C)CNC(=O)C(=O)N[C@@H]2CC23CCC3)c1	ZINC000875274932	ED	On-Demand	Anodyne	DRD4	42	32
COc1cccc(O[C@H](C)CNC(=O)C(=O)N[C@@H]2CC23CCC3)c1	ZINC000875274932	ED	On-Demand	Anodyne	MTNR1A	46	56
COc1cccc(O[C@H](C)CNC(=O)C(=O)N[C@@H]2CC23CCC3)c1	ZINC000875274932	ED	On-Demand	Anodyne	MTNR1B	45	56
COc1cccc(O[C@@H](C)CNC(=O)C(=O)N[C@@H]2CC23CCC3)c1	ZINC000875274933	ED	On-Demand	Anodyne	DRD4	42	32
COc1cccc(O[C@@H](C)CNC(=O)C(=O)N[C@@H]2CC23CCC3)c1	ZINC000875274933	ED	On-Demand	Anodyne	MTNR1A	46	56
COc1cccc(O[C@@H](C)CNC(=O)C(=O)N[C@@H]2CC23CCC3)c1	ZINC000875274933	ED	On-Demand	Anodyne	MTNR1B	45	56
COc1cccc(O[C@@H](C)CNC(=O)C(=O)N[C@H]2CC23CCC3)c1	ZINC000875274934	ED	On-Demand	Anodyne	DRD4	42	32
COc1cccc(O[C@@H](C)CNC(=O)C(=O)N[C@H]2CC23CCC3)c1	ZINC000875274934	ED	On-Demand	Anodyne	MTNR1A	46	56
COc1cccc(O[C@@H](C)CNC(=O)C(=O)N[C@H]2CC23CCC3)c1	ZINC000875274934	ED	On-Demand	Anodyne	MTNR1B	45	56
COc1cccc(O[C@@H](C)CNC(=O)C(=O)NCc2ncc(Cl)s2)c1	ZINC000875274948	GE	On-Demand	Anodyne	MTNR1A	31	55
COc1cccc(O[C@@H](C)CNC(=O)C(=O)NCc2ncc(Cl)s2)c1	ZINC000875274948	GE	On-Demand	Anodyne	MTNR1B	30	55
COc1cccc(O[C@H](C)CNC(=O)C(=O)NCc2ncc(Cl)s2)c1	ZINC000875274949	GE	On-Demand	Anodyne	MTNR1A	31	55
COc1cccc(O[C@H](C)CNC(=O)C(=O)NCc2ncc(Cl)s2)c1	ZINC000875274949	GE	On-Demand	Anodyne	MTNR1B	30	55
C[C@H](NC(=O)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1)c1cccc(O)c1	ZINC000875274952	EH	On-Demand	Anodyne	RBP4	43	37
C[C@@H](NC(=O)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1)c1cccc(O)c1	ZINC000875274953	EH	On-Demand	Anodyne	RBP4	43	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H](C)Oc2cccc(F)c2)C1	ZINC000875275005	FD	On-Demand	Anodyne	CCR5	50	32
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H](C)Oc2cccc(F)c2)C1	ZINC000875275006	FD	On-Demand	Anodyne	CCR5	50	32
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H](C)Oc2cccc(F)c2)C1	ZINC000875275007	FD	On-Demand	Anodyne	CCR5	50	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H](C)Oc2cccc(F)c2)C1	ZINC000875275008	FD	On-Demand	Anodyne	CCR5	50	32
COC(=O)C1(O)CN(C(=O)N[C@@H](CC(C)C)c2ccccc2C)C1	ZINC000875275010	EE	On-Demand	Anodyne	PTGER3	18	43
COC(=O)C1(O)CN(C(=O)N[C@@H](CC(C)C)c2ccccc2C)C1	ZINC000875275010	EE	On-Demand	Anodyne	CTSA	53	35
COC(=O)C1(O)CN(C(=O)N[C@H](CC(C)C)c2ccccc2C)C1	ZINC000875275011	EE	On-Demand	Anodyne	PTGER3	18	43
COC(=O)C1(O)CN(C(=O)N[C@H](CC(C)C)c2ccccc2C)C1	ZINC000875275011	EE	On-Demand	Anodyne	CTSA	53	35
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(c2ccccc2F)C1=O	ZINC000875275037	ED	On-Demand	Anodyne	XIAP	41	35
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(c2ccccc2F)C1=O	ZINC000875275038	ED	On-Demand	Anodyne	XIAP	41	35
COC(=O)N(C)NC(=O)NCCc1cccc(F)c1F	ZINC000875275049	CD	On-Demand	Reactive	NQO2	33	40
COC(=O)N(C)NC(=O)NCCc1cccc(F)c1F	ZINC000875275049	CD	On-Demand	Reactive	MTNR1A	49	44
COC(=O)N(C)NC(=O)NCCc1cccc(F)c1F	ZINC000875275049	CD	On-Demand	Reactive	MTNR1B	25	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1C)C1CC1	ZINC000875275057	EG	On-Demand	Anodyne	SLC6A4	23	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1C)C1CC1	ZINC000875275057	EG	On-Demand	Anodyne	SLC6A3	50	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1C)C1CC1	ZINC000875275058	EG	On-Demand	Anodyne	SLC6A4	23	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1C)C1CC1	ZINC000875275058	EG	On-Demand	Anodyne	SLC6A3	50	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1C)C1CC1	ZINC000875275059	EG	On-Demand	Anodyne	SLC6A4	23	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1C)C1CC1	ZINC000875275059	EG	On-Demand	Anodyne	SLC6A3	50	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1C)C1CC1	ZINC000875275060	EG	On-Demand	Anodyne	SLC6A4	23	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1C)C1CC1	ZINC000875275060	EG	On-Demand	Anodyne	SLC6A3	50	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H](C)Oc2ccccc2C)C1	ZINC000875275075	ED	On-Demand	Anodyne	SLC6A1	42	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H](C)Oc2ccccc2C)C1	ZINC000875275076	ED	On-Demand	Anodyne	SLC6A1	42	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H](C)Oc2ccccc2C)C1	ZINC000875275077	ED	On-Demand	Anodyne	SLC6A1	42	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H](C)Oc2ccccc2C)C1	ZINC000875275078	ED	On-Demand	Anodyne	SLC6A1	42	34
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](c2ccccc2C)C2CC2)C1	ZINC000875275079	DG	On-Demand	Anodyne	SLC6A1	44	39
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](c2ccccc2C)C2CC2)C1	ZINC000875275080	DG	On-Demand	Anodyne	SLC6A1	44	39
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](c2ccccc2C)C2CC2)C1	ZINC000875275081	DG	On-Demand	Anodyne	SLC6A1	44	39
CC(=O)[C@H]1CCCN(C(=O)N[C@H](c2ccccc2C)C2CC2)C1	ZINC000875275082	DG	On-Demand	Anodyne	SLC6A1	44	39
C[C@@H](CC(=O)N(Cc1ccsc1)c1cccnc1)NC(=O)OC(C)(C)C	ZINC000875275099	GH	On-Demand	Anodyne	PAPA1_CARPA	28	42
Cc1ccccc1[C@@H](NC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)C1CC1	ZINC000875275123	GG	On-Demand	Anodyne	SMO	39	42
Cc1ccccc1[C@@H](NC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)C1CC1	ZINC000875275123	GG	On-Demand	Anodyne	ETHR	47	35
Cc1ccccc1[C@H](NC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)C1CC1	ZINC000875275125	GG	On-Demand	Anodyne	SMO	39	42
Cc1ccccc1[C@H](NC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)C1CC1	ZINC000875275125	GG	On-Demand	Anodyne	ETHR	47	35
Cc1ccccc1[C@@H](NC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)C1CC1	ZINC000875275128	GG	On-Demand	Anodyne	SMO	39	42
Cc1ccccc1[C@@H](NC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)C1CC1	ZINC000875275128	GG	On-Demand	Anodyne	ETHR	47	35
COC(=O)c1ccc(OC)c2c1CCN(C(=O)NCCN1CCSCC1)C2	ZINC000875275129	GD	On-Demand	Anodyne	DRD4	41	31
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1cccc2ccccc12	ZINC000875275191	GI	On-Demand	Anodyne	LTA4H	16	40
O=C(COC(=O)CCCOc1ccc(F)cc1)N[C@H]1CCCc2ccccc21	ZINC000875275217	GH	On-Demand	Anodyne	HTR7	15	46
O=C(COC(=O)CCCOc1ccc(F)cc1)N[C@H]1CCCc2ccccc21	ZINC000875275217	GH	On-Demand	Anodyne	BDKRB1	30	41
O=C(COC(=O)CCCOc1ccc(F)cc1)N[C@@H]1CCCc2ccccc21	ZINC000875275222	GH	On-Demand	Anodyne	HTR7	15	46
O=C(COC(=O)CCCOc1ccc(F)cc1)N[C@@H]1CCCc2ccccc21	ZINC000875275222	GH	On-Demand	Anodyne	BDKRB1	30	41
COc1cccc(O[C@@H](C)CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)c1	ZINC000875275230	FD	On-Demand	Anodyne	DRD4	41	32
COc1cccc(O[C@@H](C)CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)c1	ZINC000875275230	FD	On-Demand	Anodyne	MTNR1A	52	58
COc1cccc(O[C@@H](C)CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)c1	ZINC000875275230	FD	On-Demand	Anodyne	MTNR1B	50	58
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)c1	ZINC000875275232	FD	On-Demand	Anodyne	DRD4	41	32
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)c1	ZINC000875275232	FD	On-Demand	Anodyne	MTNR1A	52	58
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)c1	ZINC000875275232	FD	On-Demand	Anodyne	MTNR1B	50	58
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)c1	ZINC000875275234	FD	On-Demand	Anodyne	DRD4	41	32
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)c1	ZINC000875275234	FD	On-Demand	Anodyne	MTNR1A	52	58
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)c1	ZINC000875275234	FD	On-Demand	Anodyne	MTNR1B	50	58
COc1cccc(O[C@@H](C)CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)c1	ZINC000875275236	FD	On-Demand	Anodyne	DRD4	41	32
COc1cccc(O[C@@H](C)CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)c1	ZINC000875275236	FD	On-Demand	Anodyne	MTNR1A	52	58
COc1cccc(O[C@@H](C)CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)c1	ZINC000875275236	FD	On-Demand	Anodyne	MTNR1B	50	58
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccccc1I	ZINC000875275249	JH	On-Demand	Anodyne	LTA4H	16	40
C[C@@H]1Cc2ccccc2N1C(=O)COC(=O)[C@@H]1CCN(C)C[C@@H]1c1cnn(C)c1	ZINC000875275256	GD	On-Demand	Anodyne	DRD4	22	40
C[C@@H]1Cc2ccccc2N1C(=O)COC(=O)[C@H]1CCN(C)C[C@@H]1c1cnn(C)c1	ZINC000875275257	GD	On-Demand	Anodyne	DRD4	22	40
C[C@@H]1Cc2ccccc2N1C(=O)COC(=O)[C@@H]1CCN(C)C[C@H]1c1cnn(C)c1	ZINC000875275258	GD	On-Demand	Anodyne	DRD4	22	40
C[C@@H]1Cc2ccccc2N1C(=O)COC(=O)[C@H]1CCN(C)C[C@H]1c1cnn(C)c1	ZINC000875275259	GD	On-Demand	Anodyne	DRD4	22	40
C[C@@H]1Cc2ccccc2N1C(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875275271	FH	On-Demand	Anodyne	DRD4	27	51
C[C@@H]1Cc2ccccc2N1C(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875275271	FH	On-Demand	Anodyne	TPP2	60	34
CCN(CC)C(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875275284	DE	On-Demand	Anodyne	LTA4H	17	48
CCN(CC)C(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875275284	DE	On-Demand	Anodyne	PLA2G4B	77	36
Cc1ccccc1[C@H](NC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)C1CC1	ZINC000875275310	GG	On-Demand	Anodyne	SMO	39	42
Cc1ccccc1[C@H](NC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)C1CC1	ZINC000875275310	GG	On-Demand	Anodyne	ETHR	47	35
CC(=O)C1CCN(C(=O)N[C@@H](CC(C)C)c2ccccc2C)CC1	ZINC000875275313	EI	On-Demand	Anodyne	CTSA	44	33
CC(=O)C1CCN(C(=O)N[C@H](CC(C)C)c2ccccc2C)CC1	ZINC000875275314	EI	On-Demand	Anodyne	CTSA	44	33
O=C(CCCOc1ccc(F)cc1)O[C@@H]1CCOC1=O	ZINC000875275343	CD	On-Demand	Anodyne	LUXR	61	32
O=C(CCCOc1ccc(F)cc1)O[C@@H]1CCOC1=O	ZINC000875275343	CD	On-Demand	Anodyne	TRAR	74	40
O=C(CCCOc1ccc(F)cc1)O[C@@H]1CCOC1=O	ZINC000875275343	CD	On-Demand	Anodyne	LASR	40	32
O=C(CCCOc1ccc(F)cc1)O[C@H]1CCOC1=O	ZINC000875275344	CD	On-Demand	Anodyne	LUXR	61	32
O=C(CCCOc1ccc(F)cc1)O[C@H]1CCOC1=O	ZINC000875275344	CD	On-Demand	Anodyne	TRAR	74	40
O=C(CCCOc1ccc(F)cc1)O[C@H]1CCOC1=O	ZINC000875275344	CD	On-Demand	Anodyne	LASR	40	32
Cc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875275347	EF	On-Demand	Anodyne	CTSA	55	35
Cc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875275348	EF	On-Demand	Anodyne	CTSA	55	35
COCCN(CC(F)F)C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875275352	FE	On-Demand	Anodyne	CTSK	24	46
COCCN(CC(F)F)C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875275352	FE	On-Demand	Anodyne	CTSL	21	42
COCCN(CC(F)F)C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875275352	FE	On-Demand	Anodyne	CAPNS1	57	33
COCCN(CC(F)F)C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875275352	FE	On-Demand	Anodyne	CAPN1	43	37
COCCN(CC(F)F)C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875275352	FE	On-Demand	Anodyne	CAPN2	60	33
COCCN(CC(F)F)C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875275352	FE	On-Demand	Anodyne	NPR	64	36
COCCN(CC(F)F)C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875275352	FE	On-Demand	Anodyne	SLC12A5	64	36
Cc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875275354	FG	On-Demand	Anodyne	GHRHR	71	34
Cc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875275354	FG	On-Demand	Anodyne	CTSA	54	36
Cc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875275355	FG	On-Demand	Anodyne	GHRHR	71	34
Cc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875275355	FG	On-Demand	Anodyne	CTSA	54	36
O=C(NCCO)C1CCN(C(=O)NCCc2cccc(F)c2F)CC1	ZINC000875275356	FD	On-Demand	Anodyne	MTNR1A	15	40
O=C(NCCO)C1CCN(C(=O)NCCc2cccc(F)c2F)CC1	ZINC000875275356	FD	On-Demand	Anodyne	EPHX2	20	42
O=C(NCCO)C1CCN(C(=O)NCCc2cccc(F)c2F)CC1	ZINC000875275356	FD	On-Demand	Anodyne	CACNA1G	31	40
Cc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875275374	GI	On-Demand	Anodyne	ETHR	58	39
Cc1ccccc1[C@H](CC(C)C)NC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875275375	GI	On-Demand	Anodyne	ETHR	58	39
Cc1ccccc1[C@H](CC(C)C)NC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875275376	GI	On-Demand	Anodyne	ETHR	58	39
Cc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875275377	GI	On-Demand	Anodyne	ETHR	58	39
CCC(CC)c1cc(CNC(=O)C(=O)N2CCC[C@H](OC3CCC3)CC2)on1	ZINC000875275442	GG	On-Demand	Anodyne	SLC5A7	24	42
CCC(CC)c1cc(CNC(=O)C(=O)N2CCC[C@@H](OC3CCC3)CC2)on1	ZINC000875275443	GG	On-Demand	Anodyne	SLC5A7	24	42
COc1cccc(O[C@@H](C)CNC(=O)C(=O)NCC[C@H]2CCSC2)c1	ZINC000875275444	FD	On-Demand	Anodyne	DRD4	41	31
COc1cccc(O[C@@H](C)CNC(=O)C(=O)NCC[C@H]2CCSC2)c1	ZINC000875275444	FD	On-Demand	Anodyne	MTNR1A	40	57
COc1cccc(O[C@@H](C)CNC(=O)C(=O)NCC[C@H]2CCSC2)c1	ZINC000875275444	FD	On-Demand	Anodyne	MTNR1B	34	57
COc1cccc(O[C@H](C)CNC(=O)C(=O)NCC[C@H]2CCSC2)c1	ZINC000875275445	FD	On-Demand	Anodyne	DRD4	41	31
COc1cccc(O[C@H](C)CNC(=O)C(=O)NCC[C@H]2CCSC2)c1	ZINC000875275445	FD	On-Demand	Anodyne	MTNR1A	40	57
COc1cccc(O[C@H](C)CNC(=O)C(=O)NCC[C@H]2CCSC2)c1	ZINC000875275445	FD	On-Demand	Anodyne	MTNR1B	34	57
COc1cccc(O[C@@H](C)CNC(=O)C(=O)NCC[C@@H]2CCSC2)c1	ZINC000875275446	FD	On-Demand	Anodyne	DRD4	41	31
COc1cccc(O[C@@H](C)CNC(=O)C(=O)NCC[C@@H]2CCSC2)c1	ZINC000875275446	FD	On-Demand	Anodyne	MTNR1A	40	57
COc1cccc(O[C@@H](C)CNC(=O)C(=O)NCC[C@@H]2CCSC2)c1	ZINC000875275446	FD	On-Demand	Anodyne	MTNR1B	34	57
COc1cccc(O[C@H](C)CNC(=O)C(=O)NCC[C@@H]2CCSC2)c1	ZINC000875275447	FD	On-Demand	Anodyne	DRD4	41	31
COc1cccc(O[C@H](C)CNC(=O)C(=O)NCC[C@@H]2CCSC2)c1	ZINC000875275447	FD	On-Demand	Anodyne	MTNR1A	40	57
COc1cccc(O[C@H](C)CNC(=O)C(=O)NCC[C@@H]2CCSC2)c1	ZINC000875275447	FD	On-Demand	Anodyne	MTNR1B	34	57
O=C(COC(=O)CCCOc1ccc(F)cc1)NC1CC1	ZINC000875275460	CD	On-Demand	Anodyne	LTA4H	18	43
COc1ccc([C@@H]2CN(C(=O)N[C@H](C)c3cccc(O)c3)CCO2)cc1	ZINC000875275474	FG	On-Demand	Anodyne	EDNRA	15	41
COc1ccc([C@@H]2CN(C(=O)N[C@@H](C)c3cccc(O)c3)CCO2)cc1	ZINC000875275475	FG	On-Demand	Anodyne	EDNRA	15	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2cccc(O)c2)C1	ZINC000875275503	DE	On-Demand	Anodyne	P2RY12	19	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2cccc(O)c2)C1	ZINC000875275506	DE	On-Demand	Anodyne	P2RY12	19	41
O=C(CCCOc1ccc(F)cc1)OCC(=O)c1ccccc1F	ZINC000875275511	EH	On-Demand	Anodyne	LTA4H	17	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H](C)Sc2ccccc2)C1	ZINC000875275521	EE	On-Demand	Anodyne	SLC6A1	50	33
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccc2nc(O)[nH]c2c1	ZINC000875275522	GF	On-Demand	Anodyne	MCHR1	18	45
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H](C)Sc2ccccc2)C1	ZINC000875275523	EE	On-Demand	Anodyne	SLC6A1	50	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H](C)Sc2ccccc2)C1	ZINC000875275524	EE	On-Demand	Anodyne	SLC6A1	50	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H](C)Sc2ccccc2)C1	ZINC000875275525	EE	On-Demand	Anodyne	SLC6A1	50	33
Cc1ccc(C(=O)COC(=O)CCCOc2ccc(F)cc2)cc1	ZINC000875275533	EH	On-Demand	Anodyne	PLA2G4B	70	36
N#Cc1ccc(NC(=O)COC(=O)CCCOc2ccc(F)cc2)cc1	ZINC000875275541	FG	On-Demand	Mild	LTA4H	22	40
N#Cc1ccc(NC(=O)COC(=O)CCCOc2ccc(F)cc2)cc1	ZINC000875275541	FG	On-Demand	Mild	ADORA2B	32	41
N#Cc1ccc(NC(=O)COC(=O)CCCOc2ccc(F)cc2)cc1	ZINC000875275541	FG	On-Demand	Mild	FAAH	16	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cccc(F)c1F	ZINC000875275546	EE	On-Demand	Anodyne	SLC6A3	41	37
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	ZINC000875275547	JF	On-Demand	Anodyne	EPHX2	26	47
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1c(F)cccc1F	ZINC000875275556	FG	On-Demand	Anodyne	LTA4H	17	43
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccc(F)c(F)c1	ZINC000875275557	FG	On-Demand	Anodyne	LTA4H	23	41
Cc1cc(C)cc(NC(=O)COC(=O)CCCOc2ccc(F)cc2)c1	ZINC000875275561	FH	On-Demand	Anodyne	LTA4H	22	44
O=C(CCCOc1ccc(F)cc1)OCC(=O)c1ccc(F)c(F)c1	ZINC000875275563	FH	On-Demand	Anodyne	PLA2G4B	49	33
O=C(COC(=O)CCCOc1ccc(F)cc1)NC1CCCCCCC1	ZINC000875275566	FH	On-Demand	Anodyne	LTA4H	15	42
O=C(COC(=O)CCCOc1ccc(F)cc1)NC1CCCCCCC1	ZINC000875275566	FH	On-Demand	Anodyne	FAAH	23	41
O=C(COC(=O)CCCOc1ccc(F)cc1)NC1CCCCCCC1	ZINC000875275566	FH	On-Demand	Anodyne	EPHX2	20	48
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cccc(-c2nc(C)cs2)c1	ZINC000875275599	EH	On-Demand	Anodyne	HPN	52	32
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCCCC1	ZINC000875275601	DF	On-Demand	Anodyne	LTA4H	28	43
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCCCC1	ZINC000875275601	DF	On-Demand	Anodyne	HRH3	42	46
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H]2CCN(c3ccccc3F)C2=O)cc1	ZINC000875275626	GE	On-Demand	Anodyne	PLG	44	31
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H]2CCN(c3ccccc3F)C2=O)cc1	ZINC000875275626	GE	On-Demand	Anodyne	TRYP_PIG	46	31
CC(=O)N(C)c1ccc(CNC(=O)N[C@H]2CCN(c3ccccc3F)C2=O)cc1	ZINC000875275627	GE	On-Demand	Anodyne	PLG	44	31
CC(=O)N(C)c1ccc(CNC(=O)N[C@H]2CCN(c3ccccc3F)C2=O)cc1	ZINC000875275627	GE	On-Demand	Anodyne	TRYP_PIG	46	31
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccccc1-c1ccccc1	ZINC000875275643	HJ	On-Demand	Anodyne	LTA4H	22	41
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccccc1-c1ccccc1	ZINC000875275643	HJ	On-Demand	Anodyne	FFAR4	35	40
C[C@@H](NC(=O)N1CCC(c2nnnn2C)CC1)c1cccc(O)c1	ZINC000875275654	ED	On-Demand	Anodyne	IL2RA	40	34
C[C@@H](NC(=O)N(C)CCN1CC2(CCOCC2)C1)c1cccc(O)c1	ZINC000875275675	EE	On-Demand	Anodyne	CASR	41	36
COCCCOc1cccc(CNC(=O)C(=O)N2CCN(C)C(C)(C)CC2)c1	ZINC000875275691	GD	On-Demand	Anodyne	HRH2	33	40
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1cccc(Cl)c1	ZINC000875275694	FH	On-Demand	Anodyne	EPHX2	18	49
Cc1ccc(CNC(=O)C(=O)NCCCCC2CC2)c(N2CCCC2)n1	ZINC000875275699	FE	On-Demand	Anodyne	SIRT3	57	37
Cc1ccc(CNC(=O)C(=O)NCCCCC2CC2)c(N2CCCC2)n1	ZINC000875275699	FE	On-Demand	Anodyne	SIRT2	53	37
Cc1ccc(CNC(=O)C(=O)NCCCCC2CC2)c(N2CCCC2)n1	ZINC000875275699	FE	On-Demand	Anodyne	SIRT1	51	37
O=C(CCCOc1ccc(F)cc1)OCCOc1ccccc1F	ZINC000875275735	EH	On-Demand	Anodyne	PPARA	19	42
O=C(CCCOc1ccc(F)cc1)OCCOc1ccccc1F	ZINC000875275735	EH	On-Demand	Anodyne	LTA4H	21	44
O=C(COC(=O)CCCOc1ccc(F)cc1)NC1CCCC1	ZINC000875275739	DF	On-Demand	Anodyne	LTA4H	18	43
O=C(COC(=O)CCCOc1ccc(F)cc1)NC1CCCC1	ZINC000875275739	DF	On-Demand	Anodyne	FAAH	18	40
O=C(COC(=O)CCCOc1ccc(F)cc1)NC1CCCC1	ZINC000875275739	DF	On-Demand	Anodyne	EPHX2	17	46
COc1cccc(O[C@H](C)CNC(=O)C(=O)N[C@@H](C2CCC2)[C@H]2CCOC2)c1	ZINC000875275743	GD	On-Demand	Anodyne	MTNR1A	36	53
COc1cccc(O[C@H](C)CNC(=O)C(=O)N[C@@H](C2CCC2)[C@H]2CCOC2)c1	ZINC000875275743	GD	On-Demand	Anodyne	MTNR1B	34	53
COc1cccc(O[C@H](C)CNC(=O)C(=O)N[C@H](C2CCC2)[C@@H]2CCOC2)c1	ZINC000875275746	GD	On-Demand	Anodyne	MTNR1A	36	53
COc1cccc(O[C@H](C)CNC(=O)C(=O)N[C@H](C2CCC2)[C@@H]2CCOC2)c1	ZINC000875275746	GD	On-Demand	Anodyne	MTNR1B	34	53
COc1cccc(O[C@H](C)CNC(=O)C(=O)N[C@@H](C2CCC2)[C@@H]2CCOC2)c1	ZINC000875275748	GD	On-Demand	Anodyne	MTNR1A	36	53
COc1cccc(O[C@H](C)CNC(=O)C(=O)N[C@@H](C2CCC2)[C@@H]2CCOC2)c1	ZINC000875275748	GD	On-Demand	Anodyne	MTNR1B	34	53
COc1cccc(O[C@H](C)CNC(=O)C(=O)N[C@H](C2CCC2)[C@H]2CCOC2)c1	ZINC000875275749	GD	On-Demand	Anodyne	MTNR1A	36	53
COc1cccc(O[C@H](C)CNC(=O)C(=O)N[C@H](C2CCC2)[C@H]2CCOC2)c1	ZINC000875275749	GD	On-Demand	Anodyne	MTNR1B	34	53
CC(=O)N1CCC[C@@H]1C(=O)Oc1cccc(-c2nc(C)cs2)c1	ZINC000875275751	EG	On-Demand	Anodyne	CPT1A	42	41
O=C(CCCOc1ccc(F)cc1)OCC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000875275772	FG	On-Demand	Bother	ACR	30	52
O=C(NCCN1CCSCC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875275827	ED	On-Demand	Anodyne	PLD1	56	36
O=C(NCCN1CCSCC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875275827	ED	On-Demand	Anodyne	PLD2	60	38
O=C(NCCc1cccc(F)c1F)N1CCC[C@H](OC2CCC2)CC1	ZINC000875275828	FH	On-Demand	Anodyne	EPHX2	21	40
O=C(NCCc1cccc(F)c1F)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875275830	FH	On-Demand	Anodyne	EPHX2	21	40
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)c1ccccc1	ZINC000875275844	EH	On-Demand	Anodyne	LTA4H	28	44
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)c1ccccc1	ZINC000875275844	EH	On-Demand	Anodyne	PLA2G4B	85	35
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)c1ccccc1	ZINC000875275844	EH	On-Demand	Anodyne	ESRRG	45	32
O=C(CCCOc1ccc(F)cc1)OCC(=O)c1cccc(Br)c1	ZINC000875275860	GI	On-Demand	Anodyne	PLA2G4B	59	37
O=C(CCCOc1ccc(F)cc1)OCC(=O)c1cccc(C(F)(F)F)c1	ZINC000875275873	GI	On-Demand	Anodyne	PLA2G4B	45	36
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccc(C(F)(F)F)cc1	ZINC000875275875	GI	On-Demand	Anodyne	LTA4H	26	40
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccc(C(F)(F)F)cc1	ZINC000875275875	GI	On-Demand	Anodyne	ADORA2B	21	41
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccc(C(F)(F)F)cc1	ZINC000875275875	GI	On-Demand	Anodyne	FAAH	16	40
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccc(C(F)(F)F)cc1	ZINC000875275875	GI	On-Demand	Anodyne	EPHX2	26	48
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccc(C(F)(F)F)cc1	ZINC000875275875	GI	On-Demand	Anodyne	ACR	17	42
O=C(CCCOc1ccc(F)cc1)OCC(=O)c1ccccc1	ZINC000875275889	DG	On-Demand	Anodyne	LTA4H	29	46
O=C(CCCOc1ccc(F)cc1)OCC(=O)c1ccccc1	ZINC000875275889	DG	On-Demand	Anodyne	PLA2G4B	80	38
O=C(CCCOc1ccc(F)cc1)OCC(=O)c1ccccc1	ZINC000875275889	DG	On-Demand	Anodyne	ESRRG	43	31
O=C(CCCOc1ccc(F)cc1)OCC(=O)c1ccccc1	ZINC000875275889	DG	On-Demand	Anodyne	FAAH	21	40
O=C(CCCOc1ccc(F)cc1)OCC(=O)c1ccc(Br)cc1	ZINC000875275905	GI	On-Demand	Anodyne	PLA2G4B	40	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cccc(O)c1	ZINC000875275950	DE	On-Demand	Anodyne	SLC6A4	23	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cccc(O)c1	ZINC000875275950	DE	On-Demand	Anodyne	SLC6A3	46	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cccc(O)c1	ZINC000875275952	DE	On-Demand	Anodyne	SLC6A4	23	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cccc(O)c1	ZINC000875275952	DE	On-Demand	Anodyne	SLC6A3	46	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cccc(O)c1	ZINC000875275954	DE	On-Demand	Anodyne	SLC6A4	23	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cccc(O)c1	ZINC000875275954	DE	On-Demand	Anodyne	SLC6A3	46	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cccc(O)c1	ZINC000875275956	DE	On-Demand	Anodyne	SLC6A4	23	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cccc(O)c1	ZINC000875275956	DE	On-Demand	Anodyne	SLC6A3	46	43
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)c1	ZINC000875275958	GD	On-Demand	Anodyne	DRD4	40	32
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)c1	ZINC000875275958	GD	On-Demand	Anodyne	MTNR1A	29	52
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)c1	ZINC000875275958	GD	On-Demand	Anodyne	MTNR1B	30	52
COc1cccc(O[C@@H](C)CNC(=O)C(=O)N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)c1	ZINC000875275960	GD	On-Demand	Anodyne	DRD4	40	32
COc1cccc(O[C@@H](C)CNC(=O)C(=O)N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)c1	ZINC000875275960	GD	On-Demand	Anodyne	MTNR1A	29	52
COc1cccc(O[C@@H](C)CNC(=O)C(=O)N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)c1	ZINC000875275960	GD	On-Demand	Anodyne	MTNR1B	30	52
C[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1cccc(O)c1	ZINC000875275967	DD	On-Demand	Anodyne	CACNA1H	46	45
O=C(NCCN1CCSCC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875275973	ED	On-Demand	Anodyne	CCR1	31	40
O=C(NCCN1CCSCC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875275973	ED	On-Demand	Anodyne	UTS2R	15	40
O=C(NCCN1CCSCC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875275974	ED	On-Demand	Anodyne	CCR1	31	40
O=C(NCCN1CCSCC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875275974	ED	On-Demand	Anodyne	UTS2R	15	40
O=C(NCCN1CCSCC1)N1Cc2cccc(O)c2C1	ZINC000875275994	DD	On-Demand	Clean	DRD4	43	33
C=CCNC(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875276028	CD	On-Demand	Mild	LTA4H	15	45
C=CCNC(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875276028	CD	On-Demand	Mild	LSS	22	43
CN(C)S(=O)(=O)c1cccc(NC(=O)COC(=O)CCCOc2ccc(F)cc2)c1	ZINC000875276030	IE	On-Demand	Anodyne	LTA4H	19	41
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000875276033	JE	On-Demand	Anodyne	MMP13	32	45
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000875276033	JE	On-Demand	Anodyne	EPHX2	24	46
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000875276033	JE	On-Demand	Anodyne	TGM2	62	44
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000875276033	JE	On-Demand	Anodyne	F13A1	81	44
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000875276033	JE	On-Demand	Anodyne	MERTK	31	44
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000875276033	JE	On-Demand	Anodyne	NAMPT	20	41
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CC[C@H]3CSC[C@@H]3C2)c1	ZINC000875276050	GD	On-Demand	Anodyne	MTNR1A	28	54
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CC[C@H]3CSC[C@@H]3C2)c1	ZINC000875276050	GD	On-Demand	Anodyne	MTNR1B	32	54
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CC[C@@H]3CSC[C@@H]3C2)c1	ZINC000875276052	GD	On-Demand	Anodyne	MTNR1A	28	54
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CC[C@@H]3CSC[C@@H]3C2)c1	ZINC000875276052	GD	On-Demand	Anodyne	MTNR1B	32	54
CC[C@H](C)NC(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875276054	DE	On-Demand	Anodyne	LTA4H	16	44
CC[C@H](C)NC(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875276054	DE	On-Demand	Anodyne	PLA2G4B	67	34
CC[C@H](C)NC(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875276054	DE	On-Demand	Anodyne	FAAH	15	46
CC[C@H](C)NC(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875276054	DE	On-Demand	Anodyne	PPO2	17	40
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CC[C@H]3CSC[C@H]3C2)c1	ZINC000875276055	GD	On-Demand	Anodyne	MTNR1A	28	54
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CC[C@H]3CSC[C@H]3C2)c1	ZINC000875276055	GD	On-Demand	Anodyne	MTNR1B	32	54
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CC[C@@H]3CSC[C@H]3C2)c1	ZINC000875276057	GD	On-Demand	Anodyne	MTNR1A	28	54
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CC[C@@H]3CSC[C@H]3C2)c1	ZINC000875276057	GD	On-Demand	Anodyne	MTNR1B	32	54
CCOC(=O)N1CCN(C(=O)COC(=O)CCCOc2ccc(F)cc2)CC1	ZINC000875276065	GD	On-Demand	Anodyne	P2RY12	49	43
CCOC(=O)N1CCN(C(=O)COC(=O)CCCOc2ccc(F)cc2)CC1	ZINC000875276065	GD	On-Demand	Anodyne	PLA2G4B	62	33
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccc2ccccc2c1	ZINC000875276084	GI	On-Demand	Anodyne	LTA4H	34	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H](C)Oc2ccccc2F)C1	ZINC000875276124	FD	On-Demand	Anodyne	SLC6A1	41	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H](C)Oc2ccccc2F)C1	ZINC000875276126	FD	On-Demand	Anodyne	SLC6A1	41	35
COCCCOc1cccc(CNC(=O)C(=O)NCc2ncc(Cl)s2)c1	ZINC000875276127	GE	On-Demand	Anodyne	ROCK2	26	44
COCCCOc1cccc(CNC(=O)C(=O)NCc2ncc(Cl)s2)c1	ZINC000875276127	GE	On-Demand	Anodyne	PDS	55	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H](C)Oc2ccccc2F)C1	ZINC000875276128	FD	On-Demand	Anodyne	SLC6A1	41	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H](C)Oc2ccccc2F)C1	ZINC000875276130	FD	On-Demand	Anodyne	SLC6A1	41	35
CCNC(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875276132	CD	On-Demand	Anodyne	LTA4H	17	48
CCNC(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875276132	CD	On-Demand	Anodyne	PLA2G4B	76	36
CCNC(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875276132	CD	On-Demand	Anodyne	FAAH	17	47
CCNC(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875276132	CD	On-Demand	Anodyne	PPO2	21	42
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccc(N2CCCCC2)cc1	ZINC000875276137	HI	On-Demand	Anodyne	HRH3	17	45
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccc(N2CCCCC2)cc1	ZINC000875276137	HI	On-Demand	Anodyne	MCHR1	15	40
CC(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875276139	CE	On-Demand	Anodyne	LTA4H	18	50
CC(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875276139	CE	On-Demand	Anodyne	PLA2G4B	77	37
CC(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875276139	CE	On-Demand	Anodyne	PPO2	19	42
O=C(CCCOc1ccc(F)cc1)OCC(=O)c1ccc(Cl)cc1	ZINC000875276147	FI	On-Demand	Anodyne	PLA2G4B	40	33
NC(=O)c1c(NC(=O)COC(=O)CCCOc2ccc(F)cc2)sc2c1CCCC2	ZINC000875276151	IG	On-Demand	Anodyne	VIPR1	24	40
Cc1ccccc1[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)C1CC1	ZINC000875276155	FF	On-Demand	Anodyne	CHRM2	17	40
Cc1ccccc1[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)C1CC1	ZINC000875276155	FF	On-Demand	Anodyne	L3MBTL3	82	44
Cc1ccccc1[C@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)C1CC1	ZINC000875276157	FF	On-Demand	Anodyne	CHRM2	17	40
Cc1ccccc1[C@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)C1CC1	ZINC000875276157	FF	On-Demand	Anodyne	L3MBTL3	82	44
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCOCC1	ZINC000875276164	ED	On-Demand	Anodyne	EPHX2	15	41
COC(=O)c1ccc(COC(=O)CCCOc2ccc(F)cc2)cc1	ZINC000875276184	EH	On-Demand	Anodyne	LTA4H	29	49
COC(=O)c1ccc(COC(=O)CCCOc2ccc(F)cc2)cc1	ZINC000875276184	EH	On-Demand	Anodyne	PLA2G4B	42	37
COC(=O)c1ccc(COC(=O)CCCOc2ccc(F)cc2)cc1	ZINC000875276184	EH	On-Demand	Anodyne	PPO2	21	41
Cc1c(NC(=O)[C@H](C)OC(=O)CCCOc2ccc(F)cc2)c(=O)n(-c2ccccc2)n1C	ZINC000875276225	JG	On-Demand	Anodyne	FPR2	58	42
COc1cccc(O[C@@H](C)CNC(=O)C(=O)NC2CCC(C)(N(C)C)CC2)c1	ZINC000875276240	GD	On-Demand	Anodyne	DRD4	42	32
COc1cccc(O[C@@H](C)CNC(=O)C(=O)NC2CCC(C)(N(C)C)CC2)c1	ZINC000875276240	GD	On-Demand	Anodyne	MTNR1A	46	57
COc1cccc(O[C@@H](C)CNC(=O)C(=O)NC2CCC(C)(N(C)C)CC2)c1	ZINC000875276240	GD	On-Demand	Anodyne	MTNR1B	42	57
COc1cccc(O[C@H](C)CNC(=O)C(=O)NC2CCC(C)(N(C)C)CC2)c1	ZINC000875276241	GD	On-Demand	Anodyne	DRD4	42	32
COc1cccc(O[C@H](C)CNC(=O)C(=O)NC2CCC(C)(N(C)C)CC2)c1	ZINC000875276241	GD	On-Demand	Anodyne	MTNR1A	46	57
COc1cccc(O[C@H](C)CNC(=O)C(=O)NC2CCC(C)(N(C)C)CC2)c1	ZINC000875276241	GD	On-Demand	Anodyne	MTNR1B	42	57
O=C(NCCN1CCSCC1)NC1CC(Nc2ccccc2)C1	ZINC000875276256	ED	On-Demand	Anodyne	HTR1A	16	43
O=C(NCCN1CCSCC1)NC1CC(Nc2ccccc2)C1	ZINC000875276256	ED	On-Demand	Anodyne	CCR3	21	41
O=C(NCCN1CCSCC1)NC1CC(Nc2ccccc2)C1	ZINC000875276256	ED	On-Demand	Anodyne	EPHX2	28	41
Cc1c(NC(=O)[C@@H](C)OC(=O)CCCOc2ccc(F)cc2)c(=O)n(-c2ccccc2)n1C	ZINC000875276258	JG	On-Demand	Anodyne	FPR2	58	42
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000875276272	GG	On-Demand	Bother	CACNA1C	40	38
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000875276272	GG	On-Demand	Bother	CACNA1D	63	38
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000875276272	GG	On-Demand	Bother	TAAR1	18	42
COCCCOc1cccc(CNC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)c1	ZINC000875276278	FE	On-Demand	Anodyne	HRH2	29	40
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	ZINC000875276296	JE	On-Demand	Anodyne	EPHX2	27	50
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	ZINC000875276296	JE	On-Demand	Anodyne	F13A1	34	40
CCC(CC)c1cc(CNC(=O)C(=O)N2CCC(C(C)=O)CC2)on1	ZINC000875276316	EE	On-Demand	Anodyne	SLC5A7	24	42
C[C@@H](NC(=O)N1CC[C@]2(CCc3ccccc32)C1)c1cccc(O)c1	ZINC000875276327	EH	On-Demand	Anodyne	GHRHR	18	42
C[C@@H](NC(=O)N1CC[C@@]2(CCc3ccccc32)C1)c1cccc(O)c1	ZINC000875276329	EH	On-Demand	Anodyne	GHRHR	18	42
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H](C)Oc1cccc(OC)c1	ZINC000875276361	EC	On-Demand	Mild	MTNR1A	39	56
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H](C)Oc1cccc(OC)c1	ZINC000875276361	EC	On-Demand	Mild	MTNR1B	39	56
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H](C)Oc1cccc(OC)c1	ZINC000875276361	EC	On-Demand	Mild	GCK	18	41
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H](C)Oc1cccc(OC)c1	ZINC000875276363	EC	On-Demand	Mild	MTNR1A	39	56
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H](C)Oc1cccc(OC)c1	ZINC000875276363	EC	On-Demand	Mild	MTNR1B	39	56
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H](C)Oc1cccc(OC)c1	ZINC000875276363	EC	On-Demand	Mild	GCK	18	41
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H](C)Oc1cccc(OC)c1	ZINC000875276364	EC	On-Demand	Mild	MTNR1A	39	56
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H](C)Oc1cccc(OC)c1	ZINC000875276364	EC	On-Demand	Mild	MTNR1B	39	56
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H](C)Oc1cccc(OC)c1	ZINC000875276364	EC	On-Demand	Mild	GCK	18	41
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H](C)Oc1cccc(OC)c1	ZINC000875276366	EC	On-Demand	Mild	MTNR1A	39	56
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H](C)Oc1cccc(OC)c1	ZINC000875276366	EC	On-Demand	Mild	MTNR1B	39	56
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H](C)Oc1cccc(OC)c1	ZINC000875276366	EC	On-Demand	Mild	GCK	18	41
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1cccc(Cl)c1	ZINC000875276367	GI	On-Demand	Anodyne	EPHX2	17	45
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@H](C)c1cccc(O)c1)CC2	ZINC000875276368	FG	On-Demand	Anodyne	MAPK1	39	40
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@@H](C)c1cccc(O)c1)CC2	ZINC000875276371	FG	On-Demand	Anodyne	MAPK1	39	40
C[C@@H](NC(=O)N1CCN(c2ccc(F)cc2C#N)CC1)c1cccc(O)c1	ZINC000875276377	FF	On-Demand	Mild	NPY2R	49	44
COCCCOc1cccc(CNC(=O)C(=O)N[C@H]2CC23CCC3)c1	ZINC000875276389	ED	On-Demand	Anodyne	HRH2	29	40
COCCCOc1cccc(CNC(=O)C(=O)N[C@@H]2CC23CCC3)c1	ZINC000875276390	ED	On-Demand	Anodyne	HRH2	29	40
C[C@@H]1CCCN(C(=O)COC(=O)CCCOc2ccc(F)cc2)C1	ZINC000875276395	EF	On-Demand	Anodyne	HRH3	36	42
COCCCOc1cccc(CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)c1	ZINC000875276400	FD	On-Demand	Anodyne	ROCK2	20	43
COCCCOc1cccc(CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)c1	ZINC000875276400	FD	On-Demand	Anodyne	CTSV	40	32
COCCCOc1cccc(CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)c1	ZINC000875276400	FD	On-Demand	Anodyne	PDS	52	35
COCCCOc1cccc(CNC(=O)C(=O)N[C@H](C)c2ccnn2C)c1	ZINC000875276401	FD	On-Demand	Anodyne	ROCK2	20	43
COCCCOc1cccc(CNC(=O)C(=O)N[C@H](C)c2ccnn2C)c1	ZINC000875276401	FD	On-Demand	Anodyne	CTSV	40	32
COCCCOc1cccc(CNC(=O)C(=O)N[C@H](C)c2ccnn2C)c1	ZINC000875276401	FD	On-Demand	Anodyne	PDS	52	35
CC1(C)C[C@@H]1CNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875276406	DF	On-Demand	Mild	ITK	19	51
CC1(C)C[C@@H]1CNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875276406	DF	On-Demand	Mild	PANC	54	36
Cc1ccccc1[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)C1CC1	ZINC000875276416	EF	On-Demand	Anodyne	CACNA1H	42	33
Cc1ccccc1[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)C1CC1	ZINC000875276416	EF	On-Demand	Anodyne	GHRHR	44	30
Cc1ccccc1[C@H](NC(=O)N1CCC2(CCNC2=O)CC1)C1CC1	ZINC000875276417	EF	On-Demand	Anodyne	CACNA1H	42	33
Cc1ccccc1[C@H](NC(=O)N1CCC2(CCNC2=O)CC1)C1CC1	ZINC000875276417	EF	On-Demand	Anodyne	GHRHR	44	30
Cc1ccccc1[C@H](CC(C)C)NC(=O)N1C[C@H]2C(=O)N(C)C(=O)[C@H]2C1	ZINC000875276418	FE	On-Demand	Anodyne	CTSA	55	35
Cc1ccccc1[C@@H](CC(C)C)NC(=O)N1C[C@H]2C(=O)N(C)C(=O)[C@H]2C1	ZINC000875276419	FE	On-Demand	Anodyne	CTSA	55	35
O=C(N[C@H]1CCN(c2ccccc2F)C1=O)N1CCC2(CCNC2=O)CC1	ZINC000875276433	FD	On-Demand	Anodyne	CALCRL	35	56
O=C(N[C@@H]1CCN(c2ccccc2F)C1=O)N1CCC2(CCNC2=O)CC1	ZINC000875276434	FD	On-Demand	Anodyne	CALCRL	35	56
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccc(Br)cc1	ZINC000875276437	HH	On-Demand	Anodyne	LTA4H	30	42
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccc(Br)cc1	ZINC000875276437	HH	On-Demand	Anodyne	ADORA2B	30	40
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccc(Br)cc1	ZINC000875276437	HH	On-Demand	Anodyne	FAAH	18	42
Cc1ccccc1[C@H](NC(=O)N1CCc2c(CC(N)=O)cccc2C1)C1CC1	ZINC000875276481	GG	On-Demand	Anodyne	Q6PRC7_IXORI	44	37
Cc1ccccc1[C@@H](NC(=O)N1CCc2c(CC(N)=O)cccc2C1)C1CC1	ZINC000875276482	GG	On-Demand	Anodyne	Q6PRC7_IXORI	44	37
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CCC(C(C)=O)CC2)c1	ZINC000875276537	FD	On-Demand	Anodyne	DRD4	43	33
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CCC(C(C)=O)CC2)c1	ZINC000875276537	FD	On-Demand	Anodyne	MTNR1A	62	62
COc1cccc(O[C@H](C)CNC(=O)C(=O)N2CCC(C(C)=O)CC2)c1	ZINC000875276537	FD	On-Demand	Anodyne	MTNR1B	60	62
COc1cccc(O[C@@H](C)CNC(=O)C(=O)N2CCC(C(C)=O)CC2)c1	ZINC000875276538	FD	On-Demand	Anodyne	DRD4	43	33
COc1cccc(O[C@@H](C)CNC(=O)C(=O)N2CCC(C(C)=O)CC2)c1	ZINC000875276538	FD	On-Demand	Anodyne	MTNR1A	62	62
COc1cccc(O[C@@H](C)CNC(=O)C(=O)N2CCC(C(C)=O)CC2)c1	ZINC000875276538	FD	On-Demand	Anodyne	MTNR1B	60	62
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1cccc(O)c1	ZINC000875276543	DD	On-Demand	Anodyne	CACNA1H	35	42
O=C(c1cccn(C2CC2)c1=O)N1CCCc2cccc(Cl)c21	ZINC000875276575	EG	On-Demand	Anodyne	AVPR2	31	40
CN(C(=O)[C@H](F)[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccc(C#N)cc1F	ZINC000875276579	GG	On-Demand	Mild	GPR119	34	41
CN(C(=O)[C@H](F)[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccc(C#N)cc1F	ZINC000875276580	GG	On-Demand	Mild	GPR119	34	41
Cc1ccc(CNC(=O)C(=O)NCC[C@H]2CCSC2)c(N2CCCC2)n1	ZINC000875276608	GD	On-Demand	Anodyne	SIRT3	55	35
Cc1ccc(CNC(=O)C(=O)NCC[C@H]2CCSC2)c(N2CCCC2)n1	ZINC000875276608	GD	On-Demand	Anodyne	SIRT2	55	34
Cc1ccc(CNC(=O)C(=O)NCC[C@H]2CCSC2)c(N2CCCC2)n1	ZINC000875276608	GD	On-Demand	Anodyne	SIRT1	53	33
Cc1ccc(CNC(=O)C(=O)NCC[C@@H]2CCSC2)c(N2CCCC2)n1	ZINC000875276609	GD	On-Demand	Anodyne	SIRT3	55	35
Cc1ccc(CNC(=O)C(=O)NCC[C@@H]2CCSC2)c(N2CCCC2)n1	ZINC000875276609	GD	On-Demand	Anodyne	SIRT2	55	34
Cc1ccc(CNC(=O)C(=O)NCC[C@@H]2CCSC2)c(N2CCCC2)n1	ZINC000875276609	GD	On-Demand	Anodyne	SIRT1	53	33
O=C(COC(=O)CCCOc1ccc(F)cc1)NCc1cccc(Cl)c1	ZINC000875276636	GG	On-Demand	Anodyne	MAOB	29	40
O=C(COC(=O)CCCOc1ccc(F)cc1)NCc1cccc(Cl)c1	ZINC000875276636	GG	On-Demand	Anodyne	PDS	45	38
C[C@H]1CCC[C@H](C)N1C(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875276646	FG	On-Demand	Anodyne	LTA4H	18	41
C[C@H]1CCC[C@H](C)N1C(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875276646	FG	On-Demand	Anodyne	HRH3	34	42
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccccc1F	ZINC000875276652	EG	On-Demand	Anodyne	LTA4H	21	42
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccc(Cl)cc1	ZINC000875276659	FH	On-Demand	Anodyne	LTA4H	31	42
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccc(Cl)cc1	ZINC000875276659	FH	On-Demand	Anodyne	FAAH	18	42
O=C(c1ccc(CNC(=O)C(F)(F)F)o1)N1CCCc2cccc(Cl)c21	ZINC000875276661	GH	On-Demand	Anodyne	AVPR2	24	41
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1cccc([N+](=O)[O-])c1	ZINC000875276670	GG	On-Demand	Bother	CACNA1C	45	39
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1cccc([N+](=O)[O-])c1	ZINC000875276670	GG	On-Demand	Bother	CACNA1D	72	39
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1cccc([N+](=O)[O-])c1	ZINC000875276670	GG	On-Demand	Bother	TAAR1	15	41
CC(C)(C)NC(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875276671	DE	On-Demand	Anodyne	LTA4H	16	47
CC(C)(C)NC(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875276671	DE	On-Demand	Anodyne	PLA2G4B	68	33
COCCN(CC1CCN(C)CC1)C(=O)NCCc1cccc(F)c1F	ZINC000875276690	FF	On-Demand	Anodyne	ACKR3	50	32
O=C(N[C@H]1CCN(c2ccccc2F)C1=O)N1CCC(CO)(CO)CC1	ZINC000875276737	FC	On-Demand	Anodyne	CALCRL	45	43
O=C(N[C@@H]1CCN(c2ccccc2F)C1=O)N1CCC(CO)(CO)CC1	ZINC000875276738	FC	On-Demand	Anodyne	CALCRL	45	43
Cc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCC(c2nnnn2C)CC1	ZINC000875276747	FG	On-Demand	Anodyne	IL2RA	51	34
Cc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCC(c2nnnn2C)CC1	ZINC000875276747	FG	On-Demand	Anodyne	CCR1	16	40
Cc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC(c2nnnn2C)CC1	ZINC000875276748	FG	On-Demand	Anodyne	IL2RA	51	34
Cc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC(c2nnnn2C)CC1	ZINC000875276748	FG	On-Demand	Anodyne	CCR1	16	40
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000875276782	JF	On-Demand	Anodyne	EPHX2	22	42
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000875276782	JF	On-Demand	Anodyne	F13A1	38	41
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCc2ccccc2C1	ZINC000875276798	FG	On-Demand	Anodyne	DPP8	23	44
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCc2ccccc2C1	ZINC000875276798	FG	On-Demand	Anodyne	NR1D1	24	40
CC(C)c1ccccc1NC(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875276803	FI	On-Demand	Anodyne	LTA4H	28	41
Cc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCCN(C=O)CC1	ZINC000875276852	EF	On-Demand	Anodyne	CTSA	43	33
Cc1ccccc1[C@H](CC(C)C)NC(=O)N1CCCN(C=O)CC1	ZINC000875276854	EF	On-Demand	Anodyne	CTSA	43	33
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000875276856	GI	On-Demand	Anodyne	KDR	16	40
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000875276856	GI	On-Demand	Anodyne	EPHX2	21	46
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000875276856	GI	On-Demand	Anodyne	TEK	25	40
O=C(COC(=O)CCCOc1ccc(F)cc1)NCc1ccc2c(c1)OCO2	ZINC000875276864	GF	On-Demand	Anodyne	BMP1	48	36
O=C(COC(=O)CCCOc1ccc(F)cc1)NCc1ccc2c(c1)OCO2	ZINC000875276864	GF	On-Demand	Anodyne	NOS2	101	38
COCCCOc1cccc(CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)c1	ZINC000875276933	GD	On-Demand	Anodyne	HRH2	42	44
COCCCOc1cccc(CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)c1	ZINC000875276933	GD	On-Demand	Anodyne	HRH3	19	44
COCCCOc1cccc(CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)c1	ZINC000875276933	GD	On-Demand	Anodyne	DPP7	20	42
COCCCOc1cccc(CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)c1	ZINC000875276935	GD	On-Demand	Anodyne	HRH2	42	44
COCCCOc1cccc(CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)c1	ZINC000875276935	GD	On-Demand	Anodyne	HRH3	19	44
COCCCOc1cccc(CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)c1	ZINC000875276935	GD	On-Demand	Anodyne	DPP7	20	42
C[C@@H]1Cc2ccccc2N1C(=O)COC(=O)COCc1ccnc(O)c1	ZINC000875276937	FD	On-Demand	Anodyne	DRD4	23	46
C[C@@H]1Cc2ccccc2N1C(=O)COC(=O)COCc1ccnc(O)c1	ZINC000875276937	FD	On-Demand	Anodyne	TPP2	54	32
O=C(COC(=O)CCCOc1ccc(F)cc1)NCc1ccc(Cl)cc1	ZINC000875276938	GG	On-Demand	Anodyne	LTA4H	15	44
O=C(COC(=O)CCCOc1ccc(F)cc1)NCc1ccc(Cl)cc1	ZINC000875276938	GG	On-Demand	Anodyne	TPSAB1	56	37
N#Cc1c(NC(=O)COC(=O)CCCOc2ccc(F)cc2)sc2c1CCCCC2	ZINC000875276942	II	On-Demand	Mild	VIPR1	34	55
CN(C)c1ccc(N2CCC(NC(=O)C(=O)NCCCCC3CC3)CC2)cc1	ZINC000875276945	GF	On-Demand	Anodyne	DRD3	16	46
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCc2ccccc21	ZINC000875276952	FG	On-Demand	Anodyne	EIF2AK3	48	31
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000875276982	JG	On-Demand	Anodyne	TGM2	65	45
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000875276982	JG	On-Demand	Anodyne	F13A1	84	45
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000875276982	JG	On-Demand	Anodyne	NAMPT	28	45
COCCCOc1cccc(CNC(=O)C(=O)N2CCC(C(C)=O)CC2)c1	ZINC000875276983	GD	On-Demand	Anodyne	HRH2	40	42
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000875277001	HF	On-Demand	Anodyne	DRD2	21	51
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000875277001	HF	On-Demand	Anodyne	DRD4	26	43
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000875277001	HF	On-Demand	Anodyne	DRD3	15	43
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000875277001	HF	On-Demand	Anodyne	SLC6A3	26	40
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000875277001	HF	On-Demand	Anodyne	LTA4H	56	40
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000875277001	HF	On-Demand	Anodyne	HRH3	31	40
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000875277001	HF	On-Demand	Anodyne	SIGMAR1	54	51
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000875277001	HF	On-Demand	Anodyne	PLA2G2A	27	40
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000875277001	HF	On-Demand	Anodyne	FAAH	36	43
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000875277001	HF	On-Demand	Anodyne	CACNA1G	37	41
Cc1ccc(C(=O)COC(=O)CCCOc2ccc(F)cc2)cc1C	ZINC000875277002	EI	On-Demand	Anodyne	PLA2G4B	68	34
O=C(COC(=O)CCCOc1ccc(F)cc1)NC1CCCCCC1	ZINC000875277023	FG	On-Demand	Anodyne	LTA4H	15	42
O=C(COC(=O)CCCOc1ccc(F)cc1)NC1CCCCCC1	ZINC000875277023	FG	On-Demand	Anodyne	FAAH	23	41
O=C(COC(=O)CCCOc1ccc(F)cc1)NC1CCCCCC1	ZINC000875277023	FG	On-Demand	Anodyne	EPHX2	20	48
CN(C(=O)[C@@H]1OCCO[C@@H]1C(F)(F)F)c1ccc(C#N)cc1F	ZINC000875277031	EE	On-Demand	Mild	ABCC9	43	35
O=C(OCc1nc2cccnc2[nH]1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875277045	EF	On-Demand	Anodyne	DRD4	39	40
O=C(OCc1nc2cccnc2[nH]1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875277045	EF	On-Demand	Anodyne	LTA4H	23	42
O=C(OCc1nc2cccnc2[nH]1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875277045	EF	On-Demand	Anodyne	SIGMAR1	33	41
O=C(OCc1nc2cccnc2[nH]1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875277045	EF	On-Demand	Anodyne	PDE6D	56	39
O=C(OCc1nc2cccnc2[nH]1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875277046	EF	On-Demand	Anodyne	DRD4	39	40
O=C(OCc1nc2cccnc2[nH]1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875277046	EF	On-Demand	Anodyne	LTA4H	23	42
O=C(OCc1nc2cccnc2[nH]1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875277046	EF	On-Demand	Anodyne	SIGMAR1	33	41
O=C(OCc1nc2cccnc2[nH]1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875277046	EF	On-Demand	Anodyne	PDE6D	56	39
CC1(C)C[C@@H]1CNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875277049	EG	On-Demand	Anodyne	OPRL1	15	46
O=C(CCCOc1ccc(F)cc1)OCC(=O)c1c[nH]c2ccccc12	ZINC000875277051	FH	On-Demand	Anodyne	MPO	41	36
Cc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875277057	GH	On-Demand	Anodyne	CHRM2	17	40
Cc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875277057	GH	On-Demand	Anodyne	CCR5	15	45
Cc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875277057	GH	On-Demand	Anodyne	L3MBTL3	55	39
Cc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875277058	GH	On-Demand	Anodyne	CHRM2	17	40
Cc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875277058	GH	On-Demand	Anodyne	CCR5	15	45
Cc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875277058	GH	On-Demand	Anodyne	L3MBTL3	55	39
CCCCCCCNC(=O)C(=O)N[C@H](C)Cc1c(C)nn(C)c1C	ZINC000875277151	EE	On-Demand	Mild	ASAH1	61	34
CCCCCCCNC(=O)C(=O)N[C@@H](C)Cc1c(C)nn(C)c1C	ZINC000875277152	EE	On-Demand	Mild	ASAH1	61	34
O=C(COC(=O)CCCOc1ccc(F)cc1)NC12CC3CC(CC(C3)C1)C2	ZINC000875277185	GH	On-Demand	Anodyne	EPHX2	94	61
O=C(CCCOc1ccc(F)cc1)OCC(=O)c1ccc(F)cc1	ZINC000875277215	EH	On-Demand	Anodyne	PLA2G4B	75	37
Cc1ccccc1[C@@H](CC(C)C)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875277221	DG	On-Demand	Anodyne	ANPEP	23	41
Cc1ccccc1[C@H](CC(C)C)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875277222	DG	On-Demand	Anodyne	ANPEP	23	41
CC(C)(C)C(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875277227	CG	On-Demand	Anodyne	LTA4H	15	47
CC(C)(C)C(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875277227	CG	On-Demand	Anodyne	PLA2G4B	79	35
CC[C@H]1CCCCN1C(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875277249	FG	On-Demand	Anodyne	HRH3	24	40
CC[C@H]1CCCCN1C(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875277249	FG	On-Demand	Anodyne	CPT1A	104	40
CC[C@H]1CCCCN1C(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875277249	FG	On-Demand	Anodyne	CPT2	44	36
CC[C@@H]1CCCCN1C(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875277250	FG	On-Demand	Anodyne	HRH3	24	40
CC[C@@H]1CCCCN1C(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875277250	FG	On-Demand	Anodyne	CPT1A	104	40
CC[C@@H]1CCCCN1C(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875277250	FG	On-Demand	Anodyne	CPT2	44	36
CC(=O)c1cccc(NC(=O)COC(=O)CCCOc2ccc(F)cc2)c1	ZINC000875277291	FG	On-Demand	Anodyne	LTA4H	22	41
CC(=O)c1cccc(NC(=O)COC(=O)CCCOc2ccc(F)cc2)c1	ZINC000875277291	FG	On-Demand	Anodyne	ADORA2B	15	42
CC(=O)c1cccc(NC(=O)COC(=O)CCCOc2ccc(F)cc2)c1	ZINC000875277291	FG	On-Demand	Anodyne	CCR3	22	41
CC(=O)c1cccc(NC(=O)COC(=O)CCCOc2ccc(F)cc2)c1	ZINC000875277291	FG	On-Demand	Anodyne	PLA2G4B	47	35
CC(=O)c1cccc(NC(=O)COC(=O)CCCOc2ccc(F)cc2)c1	ZINC000875277291	FG	On-Demand	Anodyne	EPHX2	16	41
CN1CCN(C(=O)N[C@H]2CCN(c3ccccc3F)C2=O)Cc2cccnc21	ZINC000875277298	GD	On-Demand	Anodyne	CALCRL	39	40
CN1CCN(C(=O)N[C@@H]2CCN(c3ccccc3F)C2=O)Cc2cccnc21	ZINC000875277299	GD	On-Demand	Anodyne	CALCRL	39	40
O=C(CCCOc1ccc(F)cc1)OCCOc1ccc(F)cc1	ZINC000875277332	EH	On-Demand	Anodyne	PPARA	15	43
O=C(CCCOc1ccc(F)cc1)OCCOc1ccc(F)cc1	ZINC000875277332	EH	On-Demand	Anodyne	LTA4H	22	52
O=C(CCCOc1ccc(F)cc1)OCCOc1ccc(F)cc1	ZINC000875277332	EH	On-Demand	Anodyne	HRH3	18	45
O=C(CCCOc1ccc(F)cc1)OCCOc1ccc(F)cc1	ZINC000875277332	EH	On-Demand	Anodyne	PLA2G4B	61	35
O=C(CCCOc1ccc(F)cc1)OCCOc1ccc(F)cc1	ZINC000875277332	EH	On-Demand	Anodyne	PPO2	19	42
CC[C@H](C[C@H](C)O)NC(=O)NCCNC(=O)c1c(F)cccc1F	ZINC000875277342	ED	On-Demand	Anodyne	DAC	25	47
Cc1ccc(CNC(=O)COC(=O)CCCOc2ccc(F)cc2)cc1	ZINC000875277360	FG	On-Demand	Anodyne	LTA4H	18	46
Cc1ccc(CNC(=O)COC(=O)CCCOc2ccc(F)cc2)cc1	ZINC000875277360	FG	On-Demand	Anodyne	PPO2	19	43
Cc1ccc(CNC(=O)COC(=O)CCCOc2ccc(F)cc2)cc1	ZINC000875277360	FG	On-Demand	Anodyne	FFAR4	17	40
O=C(CCCOc1ccc(F)cc1)OCc1cc(=O)oc2cc3c(cc12)CCC3	ZINC000875277380	GI	On-Demand	Anodyne	MAOB	32	42
COc1cccc(C[C@H](C)NC(=O)N(C)OCC(F)(F)F)c1	ZINC000875277406	DF	On-Demand	Anodyne	MTNR1A	27	40
COc1cccc(C[C@H](C)NC(=O)N(C)OCC(F)(F)F)c1	ZINC000875277406	DF	On-Demand	Anodyne	MTNR1B	31	40
COc1cccc(C[C@@H](C)NC(=O)N(C)OCC(F)(F)F)c1	ZINC000875277407	DF	On-Demand	Anodyne	MTNR1A	27	40
COc1cccc(C[C@@H](C)NC(=O)N(C)OCC(F)(F)F)c1	ZINC000875277407	DF	On-Demand	Anodyne	MTNR1B	31	40
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccccc1-c1ccccc1	ZINC000875277408	HK	On-Demand	Anodyne	FFAR4	35	41
CCCCNC(=O)C1(NC(=O)c2sccc2CC#N)CCCCC1	ZINC000875277430	EG	On-Demand	Mild	CTSK	27	43
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000875277441	JF	On-Demand	Anodyne	TGM2	45	40
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000875277441	JF	On-Demand	Anodyne	F13A1	46	40
O=C(CCCOc1ccc(F)cc1)OCc1ccccc1[N+](=O)[O-]	ZINC000875277442	EH	On-Demand	Bother	COLA	68	38
O=C(NC/C=C\c1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875277446	EH	On-Demand	Anodyne	EPHX2	26	41
O=C(NC/C=C/c1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875277447	EH	On-Demand	Anodyne	EPHX2	26	41
O=C(NC/C=C/c1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875277448	EH	On-Demand	Anodyne	EPHX2	26	41
O=C(NC/C=C\c1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875277449	EH	On-Demand	Anodyne	EPHX2	26	41
C[C@@H](C#N)OC(=O)CCCOc1ccc(F)cc1	ZINC000875277454	CE	On-Demand	Mild	PLA2G4B	50	32
C[C@H](C#N)OC(=O)CCCOc1ccc(F)cc1	ZINC000875277455	CE	On-Demand	Mild	PLA2G4B	50	32
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)NC1CCCC1	ZINC000875277488	EF	On-Demand	Anodyne	LTA4H	15	41
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)NC1CCCC1	ZINC000875277488	EF	On-Demand	Anodyne	FAAH	18	41
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)NC1CCCC1	ZINC000875277488	EF	On-Demand	Anodyne	EPHX2	19	44
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)NC(=O)NC1CCCCC1	ZINC000875277501	GG	On-Demand	Anodyne	EPHX2	29	47
O=C(CCCOc1ccc(F)cc1)OCc1cc(=O)oc2cc(O)ccc12	ZINC000875277508	FH	On-Demand	Anodyne	ALDH2	63	39
O=C(CCCOc1ccc(F)cc1)OCc1cc(=O)oc2cc(O)ccc12	ZINC000875277508	FH	On-Demand	Anodyne	MAOB	34	47
O=C(CCCOc1ccc(F)cc1)OCc1cc(=O)oc2cc(O)ccc12	ZINC000875277508	FH	On-Demand	Anodyne	HSD17B3	37	48
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)NC1CC1	ZINC000875277523	DE	On-Demand	Anodyne	LTA4H	16	42
O=C(CCCOc1ccc(F)cc1)OCc1cccc(F)c1	ZINC000875277525	DH	On-Demand	Anodyne	MAOB	22	47
O=C(CCCOc1ccc(F)cc1)OCc1cccc(F)c1	ZINC000875277525	DH	On-Demand	Anodyne	LTA4H	28	43
O=C(CCCOc1ccc(F)cc1)OCc1cccc(F)c1	ZINC000875277525	DH	On-Demand	Anodyne	FFAR1	41	43
O=C(CCCOc1ccc(F)cc1)OCN1C(=O)c2ccccc2C1=O	ZINC000875277538	FF	On-Demand	Anodyne	LTA4H	15	41
O=C(CCCOc1ccc(F)cc1)OCN1C(=O)c2ccccc2C1=O	ZINC000875277538	FF	On-Demand	Anodyne	FFAR4	27	40
CC(=O)NC[C@@H]1CCCCN1C(=O)NC/C=C/c1ccccc1	ZINC000875277564	DE	On-Demand	Anodyne	FKBP1A	20	40
CC(=O)NC[C@@H]1CCCCN1C(=O)NC/C=C/c1ccccc1	ZINC000875277564	DE	On-Demand	Anodyne	HCRTR1	22	43
CC(=O)NC[C@@H]1CCCCN1C(=O)NC/C=C\c1ccccc1	ZINC000875277565	DE	On-Demand	Anodyne	FKBP1A	20	40
CC(=O)NC[C@@H]1CCCCN1C(=O)NC/C=C\c1ccccc1	ZINC000875277565	DE	On-Demand	Anodyne	HCRTR1	22	43
O=C(NC/C=C\c1ccccc1)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875277570	DH	On-Demand	Anodyne	ADAM10	19	40
O=C(NC/C=C\c1ccccc1)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875277571	DH	On-Demand	Anodyne	ADAM10	19	40
O=C(NC/C=C/c1ccccc1)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875277572	DH	On-Demand	Anodyne	ADAM10	19	40
O=C(NC/C=C/c1ccccc1)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875277573	DH	On-Demand	Anodyne	ADAM10	19	40
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)N(C)c1ccccc1	ZINC000875277582	FH	On-Demand	Anodyne	LTA4H	21	45
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)N(C)c1ccccc1	ZINC000875277582	FH	On-Demand	Anodyne	PLA2G4B	45	31
C[C@H]1CCCCN1C(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875277584	EF	On-Demand	Anodyne	LTA4H	23	41
C[C@H]1CCCCN1C(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875277584	EF	On-Demand	Anodyne	HRH3	47	42
C[C@H]1CCCCN1C(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875277584	EF	On-Demand	Anodyne	CPT1A	112	41
C[C@H]1CCCCN1C(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875277584	EF	On-Demand	Anodyne	CPT2	45	35
C[C@@H]1CCCCN1C(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875277585	EF	On-Demand	Anodyne	LTA4H	23	41
C[C@@H]1CCCCN1C(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875277585	EF	On-Demand	Anodyne	HRH3	47	42
C[C@@H]1CCCCN1C(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875277585	EF	On-Demand	Anodyne	CPT1A	112	41
C[C@@H]1CCCCN1C(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875277585	EF	On-Demand	Anodyne	CPT2	45	35
COc1cccc(C[C@H](C)NC(=O)N2CCCN(C=O)CC2)c1	ZINC000875277605	DD	On-Demand	Anodyne	DRD4	40	31
COc1cccc(C[C@H](C)NC(=O)N2CCCN(C=O)CC2)c1	ZINC000875277605	DD	On-Demand	Anodyne	TRY2_BOVIN	49	38
COc1cccc(C[C@H](C)NC(=O)N2CCCN(C=O)CC2)c1	ZINC000875277605	DD	On-Demand	Anodyne	MTNR1B	40	39
COc1cccc(C[C@H](C)NC(=O)N2CCCN(C=O)CC2)c1	ZINC000875277605	DD	On-Demand	Anodyne	DPP7	25	48
COc1cccc(C[C@@H](C)NC(=O)N2CCCN(C=O)CC2)c1	ZINC000875277606	DD	On-Demand	Anodyne	DRD4	40	31
COc1cccc(C[C@@H](C)NC(=O)N2CCCN(C=O)CC2)c1	ZINC000875277606	DD	On-Demand	Anodyne	TRY2_BOVIN	49	38
COc1cccc(C[C@@H](C)NC(=O)N2CCCN(C=O)CC2)c1	ZINC000875277606	DD	On-Demand	Anodyne	MTNR1B	40	39
COc1cccc(C[C@@H](C)NC(=O)N2CCCN(C=O)CC2)c1	ZINC000875277606	DD	On-Demand	Anodyne	DPP7	25	48
O=C(NCc1ccccc1CN1CCCCCC1)NC[C@H]1C[C@H](O)C1	ZINC000875277611	EF	On-Demand	Anodyne	HRH2	20	40
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccc(N(C)C)cc1	ZINC000875277617	GH	On-Demand	Anodyne	LTA4H	22	43
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccc(N(C)C)cc1	ZINC000875277617	GH	On-Demand	Anodyne	FAAH	17	41
CC[C@@H](NC(=O)NCCNC(=O)c1c(F)cccc1F)[C@@H](O)c1ccccc1	ZINC000875277640	GF	On-Demand	Anodyne	TACR3	42	38
CC[C@@H](NC(=O)NCCNC(=O)c1c(F)cccc1F)[C@@H](O)c1ccccc1	ZINC000875277640	GF	On-Demand	Anodyne	DAC	24	42
CC[C@@H](NC(=O)NCCNC(=O)c1c(F)cccc1F)[C@H](O)c1ccccc1	ZINC000875277642	GF	On-Demand	Anodyne	TACR3	42	38
CC[C@@H](NC(=O)NCCNC(=O)c1c(F)cccc1F)[C@H](O)c1ccccc1	ZINC000875277642	GF	On-Demand	Anodyne	DAC	24	42
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000875277645	IG	On-Demand	Anodyne	EPHX2	25	46
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000875277645	IG	On-Demand	Anodyne	STAT6	55	34
O=C(CCCOc1ccc(F)cc1)OCCOc1ccccc1	ZINC000875277659	DH	On-Demand	Anodyne	ALOX5	19	43
O=C(CCCOc1ccc(F)cc1)OCCOc1ccccc1	ZINC000875277659	DH	On-Demand	Anodyne	PPARG	41	38
O=C(CCCOc1ccc(F)cc1)OCCOc1ccccc1	ZINC000875277659	DH	On-Demand	Anodyne	PPARA	44	43
O=C(CCCOc1ccc(F)cc1)OCCOc1ccccc1	ZINC000875277659	DH	On-Demand	Anodyne	LTA4H	50	51
O=C(CCCOc1ccc(F)cc1)OCCOc1ccccc1	ZINC000875277659	DH	On-Demand	Anodyne	HRH3	17	41
O=C(CCCOc1ccc(F)cc1)OCCOc1ccccc1	ZINC000875277659	DH	On-Demand	Anodyne	LTB4R	29	40
O=C(CCCOc1ccc(F)cc1)OCCOc1ccccc1	ZINC000875277659	DH	On-Demand	Anodyne	PLA2G4B	87	39
O=C(CCCOc1ccc(F)cc1)OCCOc1ccccc1	ZINC000875277659	DH	On-Demand	Anodyne	FAAH	26	44
O=C(CCCOc1ccc(F)cc1)OCCOc1ccccc1	ZINC000875277659	DH	On-Demand	Anodyne	ACR	19	44
O=C(CCCOc1ccc(F)cc1)OCCOc1ccccc1	ZINC000875277659	DH	On-Demand	Anodyne	TAAR1	15	44
O=C(CCCOc1ccc(F)cc1)OCCOc1ccccc1	ZINC000875277659	DH	On-Demand	Anodyne	FFAR1	34	43
O=C(CCCOc1ccc(F)cc1)OCCOc1ccccc1	ZINC000875277659	DH	On-Demand	Anodyne	FFAR4	45	43
O=C(COC(=O)CCCOc1ccc(F)cc1)NC(=O)Nc1ccc2c(c1)OCCO2	ZINC000875277671	IF	On-Demand	Anodyne	EPHX2	17	43
CN1CCCC[C@H](N(C)C(=O)NC/C=C\c2ccccc2)C1=O	ZINC000875277680	DE	On-Demand	Anodyne	ACKR3	40	37
CN1CCCC[C@@H](N(C)C(=O)NC/C=C\c2ccccc2)C1=O	ZINC000875277681	DE	On-Demand	Anodyne	ACKR3	40	37
CN1CCCC[C@H](N(C)C(=O)NC/C=C/c2ccccc2)C1=O	ZINC000875277682	DE	On-Demand	Anodyne	ACKR3	40	37
CN1CCCC[C@@H](N(C)C(=O)NC/C=C/c2ccccc2)C1=O	ZINC000875277683	DE	On-Demand	Anodyne	ACKR3	40	37
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000875277813	JH	On-Demand	Anodyne	EPHX2	25	40
O=C(COC(=O)CCCOc1ccc(F)cc1)NC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000875277827	IG	On-Demand	Anodyne	EPHX2	111	64
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccc(Cl)cc1	ZINC000875277854	GI	On-Demand	Anodyne	LTA4H	21	40
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccc(Cl)cc1	ZINC000875277854	GI	On-Demand	Anodyne	FAAH	21	42
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)NCc1ccccc1	ZINC000875277861	FG	On-Demand	Anodyne	LTA4H	43	43
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)NCc1ccccc1	ZINC000875277861	FG	On-Demand	Anodyne	FAAH	17	49
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)NCc1ccccc1	ZINC000875277861	FG	On-Demand	Anodyne	FURIN	40	32
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)NCc1ccccc1	ZINC000875277861	FG	On-Demand	Anodyne	AMP1_PLAFQ	55	45
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)NCc1ccccc1	ZINC000875277861	FG	On-Demand	Anodyne	PDS	71	42
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NC/C=C\c1ccccc1	ZINC000875277873	DF	On-Demand	Anodyne	SLC6A3	17	41
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NC/C=C/c1ccccc1	ZINC000875277874	DF	On-Demand	Anodyne	SLC6A3	17	41
N#Cc1ccc(NC(=O)COC(=O)CCCOc2ccc(F)cc2)cc1Cl	ZINC000875277882	GH	On-Demand	Mild	TRPV4	41	32
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000875277887	HE	On-Demand	Anodyne	CA2	82	55
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000875277887	HE	On-Demand	Anodyne	CA1	77	55
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000875277887	HE	On-Demand	Anodyne	CA7	43	48
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000875277887	HE	On-Demand	Anodyne	CA4	64	44
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000875277887	HE	On-Demand	Anodyne	CA14	41	47
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000875277887	HE	On-Demand	Anodyne	CA12	63	55
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000875277887	HE	On-Demand	Anodyne	CA9	67	55
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000875277887	HE	On-Demand	Anodyne	NCE103	18	42
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000875277887	HE	On-Demand	Anodyne	MTCA1	50	55
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000875277887	HE	On-Demand	Anodyne	P96878_MYCTU	62	55
O=C(CCCOc1ccc(F)cc1)OCc1nc(-c2ccc(F)cc2)no1	ZINC000875277924	FH	On-Demand	Anodyne	TPSAB1	51	36
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)c1nc(O)c2ccccc2n1	ZINC000875277933	FH	On-Demand	Anodyne	TNKS	46	39
C[C@@H](CCc1cccn1C)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875277954	GE	On-Demand	Anodyne	ROCK1	24	41
C[C@@H](CCc1cccn1C)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875277954	GE	On-Demand	Anodyne	ROCK2	16	41
C[C@H](CCc1cccn1C)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875277955	GE	On-Demand	Anodyne	ROCK1	24	41
C[C@H](CCc1cccn1C)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875277955	GE	On-Demand	Anodyne	ROCK2	16	41
O=C(CCCOc1ccc(F)cc1)OCc1coc(-c2ccccc2)n1	ZINC000875277965	FI	On-Demand	Anodyne	PPARG	51	42
O=C(CCCOc1ccc(F)cc1)OCc1coc(-c2ccccc2)n1	ZINC000875277965	FI	On-Demand	Anodyne	PPARA	58	44
CSc1ccc(C(=O)COC(=O)CCCOc2ccc(F)cc2)cc1	ZINC000875277984	FI	On-Demand	Anodyne	PLA2G4B	66	35
C[C@@H](NC(=O)COC(=O)CCCOc1ccc(F)cc1)c1ccc(Br)cc1	ZINC000875277988	II	On-Demand	Anodyne	ACACA	20	46
C[C@@H](NC(=O)COC(=O)CCCOc1ccc(F)cc1)c1ccc(Br)cc1	ZINC000875277988	II	On-Demand	Anodyne	ACACB	20	46
CC(=O)[C@H](OC(=O)CCCOc1ccc(F)cc1)c1ccccc1	ZINC000875277997	EH	On-Demand	Anodyne	ALOX5	15	47
CC(=O)[C@H](OC(=O)CCCOc1ccc(F)cc1)c1ccccc1	ZINC000875277997	EH	On-Demand	Anodyne	PPARA	20	41
CC(=O)[C@H](OC(=O)CCCOc1ccc(F)cc1)c1ccccc1	ZINC000875277997	EH	On-Demand	Anodyne	LTA4H	24	43
CC(=O)[C@H](OC(=O)CCCOc1ccc(F)cc1)c1ccccc1	ZINC000875277997	EH	On-Demand	Anodyne	PLA2G4B	64	33
CC(=O)[C@H](OC(=O)CCCOc1ccc(F)cc1)c1ccccc1	ZINC000875277997	EH	On-Demand	Anodyne	FAAH	18	40
CC(=O)[C@@H](OC(=O)CCCOc1ccc(F)cc1)c1ccccc1	ZINC000875277998	EH	On-Demand	Anodyne	ALOX5	15	47
CC(=O)[C@@H](OC(=O)CCCOc1ccc(F)cc1)c1ccccc1	ZINC000875277998	EH	On-Demand	Anodyne	PPARA	20	41
CC(=O)[C@@H](OC(=O)CCCOc1ccc(F)cc1)c1ccccc1	ZINC000875277998	EH	On-Demand	Anodyne	LTA4H	24	43
CC(=O)[C@@H](OC(=O)CCCOc1ccc(F)cc1)c1ccccc1	ZINC000875277998	EH	On-Demand	Anodyne	PLA2G4B	64	33
CC(=O)[C@@H](OC(=O)CCCOc1ccc(F)cc1)c1ccccc1	ZINC000875277998	EH	On-Demand	Anodyne	FAAH	18	40
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000875278049	JF	On-Demand	Anodyne	MMP13	41	42
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000875278049	JF	On-Demand	Anodyne	MMP2	21	42
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000875278049	JF	On-Demand	Anodyne	MMP8	19	42
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000875278049	JF	On-Demand	Anodyne	MMP9	15	42
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000875278049	JF	On-Demand	Anodyne	EPHX2	24	45
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000875278049	JF	On-Demand	Anodyne	TGM2	51	39
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000875278049	JF	On-Demand	Anodyne	F13A1	68	39
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000875278049	JF	On-Demand	Anodyne	MERTK	31	41
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000875278049	JF	On-Demand	Anodyne	NAMPT	18	40
Cc1cccc(NC(=O)[C@H](C)OC(=O)CCCOc2ccc(F)cc2)c1	ZINC000875278073	FH	On-Demand	Anodyne	EPHX2	15	40
Cc1cccc(NC(=O)[C@H](C)OC(=O)CCCOc2ccc(F)cc2)c1	ZINC000875278073	FH	On-Demand	Anodyne	KCNK3	64	37
Cc1cccc(NC(=O)[C@H](C)OC(=O)CCCOc2ccc(F)cc2)c1	ZINC000875278073	FH	On-Demand	Anodyne	KCNK9	63	37
Cc1cccc(NC(=O)[C@@H](C)OC(=O)CCCOc2ccc(F)cc2)c1	ZINC000875278074	FH	On-Demand	Anodyne	EPHX2	15	40
Cc1cccc(NC(=O)[C@@H](C)OC(=O)CCCOc2ccc(F)cc2)c1	ZINC000875278074	FH	On-Demand	Anodyne	KCNK3	64	37
Cc1cccc(NC(=O)[C@@H](C)OC(=O)CCCOc2ccc(F)cc2)c1	ZINC000875278074	FH	On-Demand	Anodyne	KCNK9	63	37
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccc2c(c1)CCC2	ZINC000875278075	FH	On-Demand	Anodyne	LTA4H	15	40
O=C(NC/C=C\c1ccccc1)NCCN1CC[C@@H](O)C1	ZINC000875278088	CD	On-Demand	Anodyne	SLC6A1	55	34
O=C(NC/C=C\c1ccccc1)NCCN1CC[C@@H](O)C1	ZINC000875278088	CD	On-Demand	Anodyne	OPRK1	21	42
O=C(NC/C=C/c1ccccc1)NCCN1CC[C@@H](O)C1	ZINC000875278089	CD	On-Demand	Anodyne	SLC6A1	55	34
O=C(NC/C=C/c1ccccc1)NCCN1CC[C@@H](O)C1	ZINC000875278089	CD	On-Demand	Anodyne	OPRK1	21	42
O=C(NC/C=C\c1ccccc1)NCCN1CC[C@H](O)C1	ZINC000875278090	CD	On-Demand	Anodyne	SLC6A1	55	34
O=C(NC/C=C\c1ccccc1)NCCN1CC[C@H](O)C1	ZINC000875278090	CD	On-Demand	Anodyne	OPRK1	21	42
O=C(NC/C=C/c1ccccc1)NCCN1CC[C@H](O)C1	ZINC000875278091	CD	On-Demand	Anodyne	SLC6A1	55	34
O=C(NC/C=C/c1ccccc1)NCCN1CC[C@H](O)C1	ZINC000875278091	CD	On-Demand	Anodyne	OPRK1	21	42
O=C(NCC1CCN(S(=O)(=O)C(F)F)CC1)N1CC(c2ccccc2)C1	ZINC000875278098	GE	On-Demand	Anodyne	EPHX2	24	40
O=C(NCC1CCN(S(=O)(=O)C(F)F)CC1)N1CC(c2ccccc2)C1	ZINC000875278098	GE	On-Demand	Anodyne	RBP4	58	37
COC(=O)N(C)NC(=O)NCCNC(=O)c1c(F)cccc1F	ZINC000875278110	EC	On-Demand	Reactive	DAC	21	40
Cc1ccccc1COC(=O)CCCOc1ccc(F)cc1	ZINC000875278133	DI	On-Demand	Anodyne	LTA4H	23	44
Cc1ccccc1COC(=O)CCCOc1ccc(F)cc1	ZINC000875278133	DI	On-Demand	Anodyne	PLA2G4B	42	30
Cc1ccccc1COC(=O)CCCOc1ccc(F)cc1	ZINC000875278133	DI	On-Demand	Anodyne	FFAR1	23	43
Cc1ccccc1COC(=O)CCCOc1ccc(F)cc1	ZINC000875278133	DI	On-Demand	Anodyne	FFAR4	35	40
COc1cccc(C[C@@H](C)NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)c1	ZINC000875278142	GH	On-Demand	Anodyne	OPRL1	16	40
COc1cccc(C[C@H](C)NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)c1	ZINC000875278143	GH	On-Demand	Anodyne	OPRL1	16	40
CS(=O)(=O)Nc1ccc(C(=O)COC(=O)CCCOc2ccc(F)cc2)cc1	ZINC000875278161	HF	On-Demand	Anodyne	GRIN1	20	44
Cc1nc2c(s1)[C@H](NC(=O)C(=O)NCc1cccc3ncccc13)CCC2	ZINC000875278198	GF	On-Demand	Anodyne	CDK5	23	40
Cc1nn(-c2ccccc2)c(C)c1NC(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875278203	IH	On-Demand	Anodyne	LTA4H	19	41
COC(=O)c1ccc(COC(=O)CCCOc2ccc(F)cc2)o1	ZINC000875278207	EG	On-Demand	Anodyne	LTA4H	18	46
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)NC1CCCCC1	ZINC000875278215	FG	On-Demand	Anodyne	FAAH	21	42
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)NC1CCCCC1	ZINC000875278215	FG	On-Demand	Anodyne	EPHX2	23	46
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000875278247	HG	On-Demand	Anodyne	HTR1D	15	40
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000875278247	HG	On-Demand	Anodyne	SSTR1	23	43
COC(=O)c1cccc(COC(=O)CCCOc2ccc(F)cc2)c1	ZINC000875278264	EH	On-Demand	Anodyne	MAOB	21	40
COC(=O)c1cccc(COC(=O)CCCOc2ccc(F)cc2)c1	ZINC000875278264	EH	On-Demand	Anodyne	LTA4H	26	43
COC(=O)c1cccc(COC(=O)CCCOc2ccc(F)cc2)c1	ZINC000875278264	EH	On-Demand	Anodyne	PLA2G4B	36	41
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000875278266	HI	On-Demand	Anodyne	EPHX2	92	58
O=C1CCN(C(=O)NCCNC(=O)c2c(F)cccc2F)CCCCCCN1	ZINC000875278273	GD	On-Demand	Anodyne	PLD2	51	32
CSCC[C@@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)N[C@H](C)c1ccc(Cl)c(Cl)c1	ZINC000875278291	JK	On-Demand	Anodyne	FPR1	37	42
CSCC[C@@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)N[C@@H](C)c1ccc(Cl)c(Cl)c1	ZINC000875278309	JK	On-Demand	Anodyne	FPR1	37	42
CSCC[C@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)N[C@@H](C)c1ccc(Cl)c(Cl)c1	ZINC000875278310	JK	On-Demand	Anodyne	FPR1	37	42
CSCC[C@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)N[C@H](C)c1ccc(Cl)c(Cl)c1	ZINC000875278311	JK	On-Demand	Anodyne	FPR1	37	42
COC(=O)C1CCN(C(=O)COC(=O)CCCOc2ccc(F)cc2)CC1	ZINC000875278329	GD	On-Demand	Anodyne	LTA4H	20	40
COC(=O)C1CCN(C(=O)COC(=O)CCCOc2ccc(F)cc2)CC1	ZINC000875278329	GD	On-Demand	Anodyne	HRH3	19	43
COC(=O)C1CCN(C(=O)COC(=O)CCCOc2ccc(F)cc2)CC1	ZINC000875278329	GD	On-Demand	Anodyne	CACNA1G	34	40
COC(=O)C1CCN(C(=O)COC(=O)CCCOc2ccc(F)cc2)CC1	ZINC000875278329	GD	On-Demand	Anodyne	PTR1	49	34
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)N1CCc2ccccc2C1	ZINC000875278331	GH	On-Demand	Anodyne	DPP8	29	42
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000875278334	JH	On-Demand	Anodyne	TGM2	57	39
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000875278334	JH	On-Demand	Anodyne	F13A1	74	41
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000875278334	JH	On-Demand	Anodyne	NAMPT	25	44
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(N)=O	ZINC000875278350	CD	On-Demand	Anodyne	LTA4H	17	47
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(N)=O	ZINC000875278350	CD	On-Demand	Anodyne	PLA2G4B	71	35
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(N)=O	ZINC000875278350	CD	On-Demand	Anodyne	FAAH	17	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCNC(=O)c1c(F)cccc1F	ZINC000875278389	GD	On-Demand	Anodyne	SLC6A3	49	38
COc1ccc([N+](=O)[O-])cc1COC(=O)CCCOc1ccc(F)cc1	ZINC000875278417	FH	On-Demand	Bother	ACR	18	41
CCC[C@H](CCO)NC(=O)NC1CCN(C(=O)OC(C)C)CC1	ZINC000875278449	ED	On-Demand	Anodyne	EPHX2	23	42
CCC[C@@H](CCO)NC(=O)NC1CCN(C(=O)OC(C)C)CC1	ZINC000875278451	ED	On-Demand	Anodyne	EPHX2	23	42
O=C(CCCOc1ccc(F)cc1)OCC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000875278456	IG	On-Demand	Anodyne	HRH3	18	41
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NCC1(C)COC1	ZINC000875278489	EF	On-Demand	Anodyne	FKBP1A	18	45
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NCC1(C)COC1	ZINC000875278489	EF	On-Demand	Anodyne	SIGMAR1	21	45
N#Cc1cccc(COC(=O)CCCOc2ccc(F)cc2)c1	ZINC000875278520	DH	On-Demand	Mild	MAOB	18	41
N#Cc1cccc(COC(=O)CCCOc2ccc(F)cc2)c1	ZINC000875278520	DH	On-Demand	Mild	LTA4H	19	40
N#Cc1cccc(COC(=O)CCCOc2ccc(F)cc2)c1	ZINC000875278520	DH	On-Demand	Mild	FFAR1	34	53
COCCN(CC1CCN(C)CC1)C(=O)NC/C=C/c1ccccc1	ZINC000875278540	EF	On-Demand	Anodyne	ACKR3	64	43
COCCN(CC1CCN(C)CC1)C(=O)NC/C=C\c1ccccc1	ZINC000875278541	EF	On-Demand	Anodyne	ACKR3	64	43
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1cccc(C#N)c1	ZINC000875278543	FG	On-Demand	Mild	CCR3	21	41
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccc(N2CCCCC2)cc1	ZINC000875278544	IJ	On-Demand	Anodyne	KCNQ2	16	42
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccc(N2CCCCC2)cc1	ZINC000875278544	IJ	On-Demand	Anodyne	HRH3	17	45
O=C(NCc1ccccc1CN1CCCCCC1)N1CCC(CO)(CO)CC1	ZINC000875278560	GE	On-Demand	Anodyne	NPFFR1	41	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC/C=C\c1ccccc1	ZINC000875278581	DE	On-Demand	Anodyne	SLC6A4	29	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC/C=C\c1ccccc1	ZINC000875278581	DE	On-Demand	Anodyne	SLC6A3	56	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC/C=C/c1ccccc1	ZINC000875278582	DE	On-Demand	Anodyne	SLC6A4	29	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC/C=C/c1ccccc1	ZINC000875278582	DE	On-Demand	Anodyne	SLC6A3	56	48
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000875278586	JE	On-Demand	Anodyne	MMP13	19	40
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000875278586	JE	On-Demand	Anodyne	MMP3	15	40
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000875278586	JE	On-Demand	Anodyne	TGM2	40	39
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000875278586	JE	On-Demand	Anodyne	MMP7	18	40
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000875278586	JE	On-Demand	Anodyne	F13A1	56	39
C[C@@H](NC(=O)COC(=O)CCCOc1ccc(F)cc1)c1ccc(Cl)cc1	ZINC000875278601	GI	On-Demand	Anodyne	ACACA	20	46
C[C@@H](NC(=O)COC(=O)CCCOc1ccc(F)cc1)c1ccc(Cl)cc1	ZINC000875278601	GI	On-Demand	Anodyne	ACACB	20	46
O=C(CCCOc1ccc(F)cc1)OCCN1C(=O)c2ccccc2S1(=O)=O	ZINC000875278604	HE	On-Demand	Anodyne	ELANE	16	47
COc1cccc(C[C@@H](C)NC(=O)NNc2cccc(C)n2)c1	ZINC000875278620	DF	On-Demand	Reactive	MTNR1A	34	40
COc1cccc(C[C@@H](C)NC(=O)NNc2cccc(C)n2)c1	ZINC000875278620	DF	On-Demand	Reactive	MTNR1B	35	40
COc1cccc(C[C@H](C)NC(=O)NNc2cccc(C)n2)c1	ZINC000875278624	DF	On-Demand	Reactive	MTNR1A	34	40
COc1cccc(C[C@H](C)NC(=O)NNc2cccc(C)n2)c1	ZINC000875278624	DF	On-Demand	Reactive	MTNR1B	35	40
COC(=O)N(C)NC(=O)N[C@@H](C)Cc1cccc(OC)c1	ZINC000875278627	CD	On-Demand	Reactive	MTNR1A	50	43
COC(=O)N(C)NC(=O)N[C@@H](C)Cc1cccc(OC)c1	ZINC000875278627	CD	On-Demand	Reactive	MTNR1B	51	42
COC(=O)N(C)NC(=O)N[C@@H](C)Cc1cccc(OC)c1	ZINC000875278627	CD	On-Demand	Reactive	ROCK2	41	38
COC(=O)N(C)NC(=O)N[C@@H](C)Cc1cccc(OC)c1	ZINC000875278627	CD	On-Demand	Reactive	HSD17B2	16	40
COC(=O)N(C)NC(=O)N[C@H](C)Cc1cccc(OC)c1	ZINC000875278628	CD	On-Demand	Reactive	MTNR1A	50	43
COC(=O)N(C)NC(=O)N[C@H](C)Cc1cccc(OC)c1	ZINC000875278628	CD	On-Demand	Reactive	MTNR1B	51	42
COC(=O)N(C)NC(=O)N[C@H](C)Cc1cccc(OC)c1	ZINC000875278628	CD	On-Demand	Reactive	ROCK2	41	38
COC(=O)N(C)NC(=O)N[C@H](C)Cc1cccc(OC)c1	ZINC000875278628	CD	On-Demand	Reactive	HSD17B2	16	40
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)c1ccc(F)cc1	ZINC000875278677	DI	On-Demand	Anodyne	PLA2G4B	50	33
C[C@H](CCc1cccn1C)NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875278708	GF	On-Demand	Anodyne	C3AR1	41	41
C[C@@H](CCc1cccn1C)NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875278709	GF	On-Demand	Anodyne	C3AR1	41	41
C[C@H](CCc1cccn1C)NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875278710	GF	On-Demand	Anodyne	C3AR1	41	41
C[C@@H](CCc1cccn1C)NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875278711	GF	On-Demand	Anodyne	C3AR1	41	41
O=C(NC/C=C/c1ccccc1)N1CCC[C@@H]1Cn1ccnc1	ZINC000875278744	DF	On-Demand	Anodyne	TBXAS1	29	43
O=C(NC/C=C/c1ccccc1)N1CCC[C@@H]1Cn1ccnc1	ZINC000875278744	DF	On-Demand	Anodyne	CYP27B1	53	37
O=C(NC/C=C\c1ccccc1)N1CCC[C@@H]1Cn1ccnc1	ZINC000875278745	DF	On-Demand	Anodyne	TBXAS1	29	43
O=C(NC/C=C\c1ccccc1)N1CCC[C@@H]1Cn1ccnc1	ZINC000875278745	DF	On-Demand	Anodyne	CYP27B1	53	37
C=CC[C@H]1CCN(C(=O)NC2CCN(C(=O)OC(C)C)CC2)C1	ZINC000875278795	DF	On-Demand	Mild	GPR119	23	42
C=CC[C@@H]1CCN(C(=O)NC2CCN(C(=O)OC(C)C)CC2)C1	ZINC000875278796	DF	On-Demand	Mild	GPR119	23	42
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3CC[C@H]4CCC[C@H]4C3)CC2)CC1	ZINC000875278826	GD	On-Demand	Anodyne	L3MBTL3	68	42
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3CC[C@H]4CCC[C@@H]4C3)CC2)CC1	ZINC000875278827	GD	On-Demand	Anodyne	L3MBTL3	68	42
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3CC[C@@H]4CCC[C@H]4C3)CC2)CC1	ZINC000875278828	GD	On-Demand	Anodyne	L3MBTL3	68	42
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3CC[C@@H]4CCC[C@@H]4C3)CC2)CC1	ZINC000875278829	GD	On-Demand	Anodyne	L3MBTL3	68	42
COc1ccc(N2CCN(C(=O)COC(=O)CCCOc3ccc(F)cc3)CC2)cc1	ZINC000875278848	IF	On-Demand	Clean	HTR1D	15	40
COc1ccc(N2CCN(C(=O)COC(=O)CCCOc3ccc(F)cc3)CC2)cc1	ZINC000875278848	IF	On-Demand	Clean	HTR7	18	43
COc1ccc(N2CCN(C(=O)COC(=O)CCCOc3ccc(F)cc3)CC2)cc1	ZINC000875278848	IF	On-Demand	Clean	SSTR1	27	42
CC(=O)N(C)c1ccc(CNC(=O)NC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000875278877	GE	On-Demand	Anodyne	EPHX2	34	41
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000875278880	IF	On-Demand	Bother	SSTR1	51	44
O=C(CCCOc1ccc(F)cc1)OCc1cnc(-c2ccccc2)s1	ZINC000875278910	FJ	On-Demand	Anodyne	PPARA	41	38
O=C(CCCOc1ccc(F)cc1)OCc1cnc(-c2ccccc2)s1	ZINC000875278910	FJ	On-Demand	Anodyne	LTA4H	27	40
O=C(CCCOc1ccc(F)cc1)OCc1cnc(-c2ccccc2)s1	ZINC000875278910	FJ	On-Demand	Anodyne	FAAH	24	41
Cc1ccc([C@H](C)NC(=O)COC(=O)CCCOc2ccc(F)cc2)cc1C	ZINC000875278931	GI	On-Demand	Anodyne	ACACA	15	42
Cc1ccc([C@H](C)NC(=O)COC(=O)CCCOc2ccc(F)cc2)cc1C	ZINC000875278931	GI	On-Demand	Anodyne	ACACB	17	42
O=C(CCCOc1ccc(F)cc1)OCc1nc(-c2cccs2)no1	ZINC000875278961	FH	On-Demand	Anodyne	TPSAB1	42	36
C[C@@H](CCc1cccn1C)NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875278967	GC	On-Demand	Anodyne	L3MBTL3	58	39
C[C@H](CCc1cccn1C)NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875278968	GC	On-Demand	Anodyne	L3MBTL3	58	39
O=C(COC(=O)CCCOc1ccc(F)cc1)NC(=O)NC1CC1	ZINC000875278992	ED	On-Demand	Anodyne	EPHX2	29	47
CN(Cc1ccc(F)cc1)C(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875279015	GG	On-Demand	Anodyne	LTA4H	27	41
CN(Cc1ccc(F)cc1)C(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875279015	GG	On-Demand	Anodyne	PLA2G4B	57	33
COc1ccccc1[C@H]1CCCN(C(=O)NCC2(C)COC2)CC1	ZINC000875279056	EG	On-Demand	Anodyne	RBP4	26	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCC2(C)COC2)CC1	ZINC000875279057	EG	On-Demand	Anodyne	RBP4	26	41
O=C(CCCOc1ccc(F)cc1)OCc1ncc(-c2ccccc2)o1	ZINC000875279064	FI	On-Demand	Anodyne	FAAH	52	47
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)c1ccc(F)cc1	ZINC000875279070	EH	On-Demand	Anodyne	PLA2G4B	70	35
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)c1ccc(F)cc1	ZINC000875279070	EH	On-Demand	Anodyne	LSS	18	42
CC(C)c1cc([C@@H]2CCCN(C(=O)C(=O)N[C@@H](C)CCc3cccn3C)C2)n[nH]1	ZINC000875279099	GF	On-Demand	Anodyne	CCR3	47	32
CC(C)c1cc([C@@H]2CCCN(C(=O)C(=O)N[C@H](C)CCc3cccn3C)C2)n[nH]1	ZINC000875279100	GF	On-Demand	Anodyne	CCR3	47	32
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)c1ccc(NS(C)(=O)=O)cc1	ZINC000875279143	HG	On-Demand	Anodyne	GRIN1	23	45
COc1ccc([C@H](NC(=O)NC2CCN(C(=O)OC(C)C)CC2)C2CC2)cn1	ZINC000875279149	GF	On-Demand	Anodyne	GPR119	34	42
COc1ccc([C@@H](NC(=O)NC2CCN(C(=O)OC(C)C)CC2)C2CC2)cn1	ZINC000875279150	GF	On-Demand	Anodyne	GPR119	34	42
COc1ccc2[nH]cc(CCNC(=O)N3CCC(N4CCN(C)CC4)CC3)c2c1	ZINC000875279165	GE	On-Demand	Anodyne	HTR1A	29	50
COc1ccc2[nH]cc(CCNC(=O)N3CCC(N4CCN(C)CC4)CC3)c2c1	ZINC000875279165	GE	On-Demand	Anodyne	HTR1D	121	48
COc1ccc2[nH]cc(CCNC(=O)N3CCC(N4CCN(C)CC4)CC3)c2c1	ZINC000875279165	GE	On-Demand	Anodyne	HTR1B	104	48
COc1ccc2[nH]cc(CCNC(=O)N3CCC(N4CCN(C)CC4)CC3)c2c1	ZINC000875279165	GE	On-Demand	Anodyne	SLC6A4	16	50
COc1ccc2[nH]cc(CCNC(=O)N3CCC(N4CCN(C)CC4)CC3)c2c1	ZINC000875279165	GE	On-Demand	Anodyne	HTR1F	59	37
COc1ccc2[nH]cc(CCNC(=O)N3CCC(N4CCN(C)CC4)CC3)c2c1	ZINC000875279165	GE	On-Demand	Anodyne	NQO2	42	59
COc1ccc2[nH]cc(CCNC(=O)N3CCC(N4CCN(C)CC4)CC3)c2c1	ZINC000875279165	GE	On-Demand	Anodyne	MPO	48	42
COc1ccc2[nH]cc(CCNC(=O)N3CCC(N4CCN(C)CC4)CC3)c2c1	ZINC000875279165	GE	On-Demand	Anodyne	HTR1E	27	40
COc1ccc2[nH]cc(CCNC(=O)N3CCC(N4CCN(C)CC4)CC3)c2c1	ZINC000875279165	GE	On-Demand	Anodyne	HTR5A	19	40
COc1ccc2[nH]cc(CCNC(=O)N3CCC(N4CCN(C)CC4)CC3)c2c1	ZINC000875279165	GE	On-Demand	Anodyne	MTNR1A	102	60
COc1ccc2[nH]cc(CCNC(=O)N3CCC(N4CCN(C)CC4)CC3)c2c1	ZINC000875279165	GE	On-Demand	Anodyne	MTNR1B	81	59
COc1ccc2[nH]cc(CCNC(=O)N3CCC(N4CCN(C)CC4)CC3)c2c1	ZINC000875279165	GE	On-Demand	Anodyne	ABCG2	26	43
COc1ccc2[nH]cc(CCNC(=O)N[C@H]3CCN(CC(C)(C)O)C3)c2c1	ZINC000875279174	FD	On-Demand	Anodyne	HTR1A	21	46
COc1ccc2[nH]cc(CCNC(=O)N[C@H]3CCN(CC(C)(C)O)C3)c2c1	ZINC000875279174	FD	On-Demand	Anodyne	HTR1D	98	44
COc1ccc2[nH]cc(CCNC(=O)N[C@H]3CCN(CC(C)(C)O)C3)c2c1	ZINC000875279174	FD	On-Demand	Anodyne	HTR1B	80	44
COc1ccc2[nH]cc(CCNC(=O)N[C@H]3CCN(CC(C)(C)O)C3)c2c1	ZINC000875279174	FD	On-Demand	Anodyne	NQO2	33	56
COc1ccc2[nH]cc(CCNC(=O)N[C@H]3CCN(CC(C)(C)O)C3)c2c1	ZINC000875279174	FD	On-Demand	Anodyne	MTNR1A	86	62
COc1ccc2[nH]cc(CCNC(=O)N[C@H]3CCN(CC(C)(C)O)C3)c2c1	ZINC000875279174	FD	On-Demand	Anodyne	MTNR1B	66	56
COc1ccc2[nH]cc(CCNC(=O)N[C@H]3CCN(CC(C)(C)O)C3)c2c1	ZINC000875279174	FD	On-Demand	Anodyne	ABCG2	26	42
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H]3c3cncc(C)c3)c2c1	ZINC000875279175	GH	On-Demand	Anodyne	HTR1A	19	45
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H]3c3cncc(C)c3)c2c1	ZINC000875279175	GH	On-Demand	Anodyne	HTR1D	73	44
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H]3c3cncc(C)c3)c2c1	ZINC000875279175	GH	On-Demand	Anodyne	HTR1B	60	44
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H]3c3cncc(C)c3)c2c1	ZINC000875279175	GH	On-Demand	Anodyne	NQO2	27	53
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H]3c3cncc(C)c3)c2c1	ZINC000875279175	GH	On-Demand	Anodyne	MPO	40	34
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H]3c3cncc(C)c3)c2c1	ZINC000875279175	GH	On-Demand	Anodyne	MTNR1A	73	54
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H]3c3cncc(C)c3)c2c1	ZINC000875279175	GH	On-Demand	Anodyne	MTNR1B	58	53
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H]3c3cncc(C)c3)c2c1	ZINC000875279175	GH	On-Demand	Anodyne	ABCG2	25	41
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H]3c3cncc(C)c3)c2c1	ZINC000875279176	GH	On-Demand	Anodyne	HTR1A	19	45
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H]3c3cncc(C)c3)c2c1	ZINC000875279176	GH	On-Demand	Anodyne	HTR1D	73	44
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H]3c3cncc(C)c3)c2c1	ZINC000875279176	GH	On-Demand	Anodyne	HTR1B	60	44
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H]3c3cncc(C)c3)c2c1	ZINC000875279176	GH	On-Demand	Anodyne	NQO2	27	53
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H]3c3cncc(C)c3)c2c1	ZINC000875279176	GH	On-Demand	Anodyne	MPO	40	34
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H]3c3cncc(C)c3)c2c1	ZINC000875279176	GH	On-Demand	Anodyne	MTNR1A	73	54
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H]3c3cncc(C)c3)c2c1	ZINC000875279176	GH	On-Demand	Anodyne	MTNR1B	58	53
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H]3c3cncc(C)c3)c2c1	ZINC000875279176	GH	On-Demand	Anodyne	ABCG2	25	41
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4CS(=O)(=O)C[C@@H]4C3)c2c1	ZINC000875279196	GD	On-Demand	Anodyne	HTR1A	21	49
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4CS(=O)(=O)C[C@@H]4C3)c2c1	ZINC000875279196	GD	On-Demand	Anodyne	HTR1D	94	49
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4CS(=O)(=O)C[C@@H]4C3)c2c1	ZINC000875279196	GD	On-Demand	Anodyne	HTR1B	76	49
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4CS(=O)(=O)C[C@@H]4C3)c2c1	ZINC000875279196	GD	On-Demand	Anodyne	NQO2	37	58
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4CS(=O)(=O)C[C@@H]4C3)c2c1	ZINC000875279196	GD	On-Demand	Anodyne	MPO	43	35
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4CS(=O)(=O)C[C@@H]4C3)c2c1	ZINC000875279196	GD	On-Demand	Anodyne	MTNR1A	90	59
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4CS(=O)(=O)C[C@@H]4C3)c2c1	ZINC000875279196	GD	On-Demand	Anodyne	MTNR1B	70	58
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4CS(=O)(=O)C[C@@H]4C3)c2c1	ZINC000875279196	GD	On-Demand	Anodyne	ABCG2	25	42
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4CS(=O)(=O)C[C@@H]4C3)c2c1	ZINC000875279197	GD	On-Demand	Anodyne	HTR1A	21	49
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4CS(=O)(=O)C[C@@H]4C3)c2c1	ZINC000875279197	GD	On-Demand	Anodyne	HTR1D	94	49
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4CS(=O)(=O)C[C@@H]4C3)c2c1	ZINC000875279197	GD	On-Demand	Anodyne	HTR1B	76	49
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4CS(=O)(=O)C[C@@H]4C3)c2c1	ZINC000875279197	GD	On-Demand	Anodyne	NQO2	37	58
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4CS(=O)(=O)C[C@@H]4C3)c2c1	ZINC000875279197	GD	On-Demand	Anodyne	MPO	43	35
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4CS(=O)(=O)C[C@@H]4C3)c2c1	ZINC000875279197	GD	On-Demand	Anodyne	MTNR1A	90	59
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4CS(=O)(=O)C[C@@H]4C3)c2c1	ZINC000875279197	GD	On-Demand	Anodyne	MTNR1B	70	58
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4CS(=O)(=O)C[C@@H]4C3)c2c1	ZINC000875279197	GD	On-Demand	Anodyne	ABCG2	25	42
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4CS(=O)(=O)C[C@H]4C3)c2c1	ZINC000875279198	GD	On-Demand	Anodyne	HTR1A	21	49
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4CS(=O)(=O)C[C@H]4C3)c2c1	ZINC000875279198	GD	On-Demand	Anodyne	HTR1D	94	49
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4CS(=O)(=O)C[C@H]4C3)c2c1	ZINC000875279198	GD	On-Demand	Anodyne	HTR1B	76	49
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4CS(=O)(=O)C[C@H]4C3)c2c1	ZINC000875279198	GD	On-Demand	Anodyne	NQO2	37	58
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4CS(=O)(=O)C[C@H]4C3)c2c1	ZINC000875279198	GD	On-Demand	Anodyne	MPO	43	35
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4CS(=O)(=O)C[C@H]4C3)c2c1	ZINC000875279198	GD	On-Demand	Anodyne	MTNR1A	90	59
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4CS(=O)(=O)C[C@H]4C3)c2c1	ZINC000875279198	GD	On-Demand	Anodyne	MTNR1B	70	58
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4CS(=O)(=O)C[C@H]4C3)c2c1	ZINC000875279198	GD	On-Demand	Anodyne	ABCG2	25	42
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4CS(=O)(=O)C[C@H]4C3)c2c1	ZINC000875279199	GD	On-Demand	Anodyne	HTR1A	21	49
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4CS(=O)(=O)C[C@H]4C3)c2c1	ZINC000875279199	GD	On-Demand	Anodyne	HTR1D	94	49
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4CS(=O)(=O)C[C@H]4C3)c2c1	ZINC000875279199	GD	On-Demand	Anodyne	HTR1B	76	49
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4CS(=O)(=O)C[C@H]4C3)c2c1	ZINC000875279199	GD	On-Demand	Anodyne	NQO2	37	58
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4CS(=O)(=O)C[C@H]4C3)c2c1	ZINC000875279199	GD	On-Demand	Anodyne	MPO	43	35
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4CS(=O)(=O)C[C@H]4C3)c2c1	ZINC000875279199	GD	On-Demand	Anodyne	MTNR1A	90	59
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4CS(=O)(=O)C[C@H]4C3)c2c1	ZINC000875279199	GD	On-Demand	Anodyne	MTNR1B	70	58
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4CS(=O)(=O)C[C@H]4C3)c2c1	ZINC000875279199	GD	On-Demand	Anodyne	ABCG2	25	42
COc1ccc2[nH]cc(CCNC(=O)N(C)CCc3cccc(C#N)c3)c2c1	ZINC000875279205	GG	On-Demand	Mild	HTR1A	17	48
COc1ccc2[nH]cc(CCNC(=O)N(C)CCc3cccc(C#N)c3)c2c1	ZINC000875279205	GG	On-Demand	Mild	HTR1D	42	48
COc1ccc2[nH]cc(CCNC(=O)N(C)CCc3cccc(C#N)c3)c2c1	ZINC000875279205	GG	On-Demand	Mild	HTR1B	32	43
COc1ccc2[nH]cc(CCNC(=O)N(C)CCc3cccc(C#N)c3)c2c1	ZINC000875279205	GG	On-Demand	Mild	SLC6A4	16	43
COc1ccc2[nH]cc(CCNC(=O)N(C)CCc3cccc(C#N)c3)c2c1	ZINC000875279205	GG	On-Demand	Mild	NQO2	30	56
COc1ccc2[nH]cc(CCNC(=O)N(C)CCc3cccc(C#N)c3)c2c1	ZINC000875279205	GG	On-Demand	Mild	MPO	48	34
COc1ccc2[nH]cc(CCNC(=O)N(C)CCc3cccc(C#N)c3)c2c1	ZINC000875279205	GG	On-Demand	Mild	HTR1E	15	43
COc1ccc2[nH]cc(CCNC(=O)N(C)CCc3cccc(C#N)c3)c2c1	ZINC000875279205	GG	On-Demand	Mild	MTNR1A	95	56
COc1ccc2[nH]cc(CCNC(=O)N(C)CCc3cccc(C#N)c3)c2c1	ZINC000875279205	GG	On-Demand	Mild	MTNR1B	73	56
COc1ccc2[nH]cc(CCNC(=O)N(C)CCc3cccc(C#N)c3)c2c1	ZINC000875279205	GG	On-Demand	Mild	ABCG2	27	45
COc1ccc2[nH]cc(CCNC(=O)N(C)CCc3cccc(C#N)c3)c2c1	ZINC000875279205	GG	On-Demand	Mild	MAPT	15	47
CC(=O)C1CCN(C(=O)NC[C@@H]2OCCc3ccccc32)CC1	ZINC000875279210	DE	On-Demand	Anodyne	SMO	21	43
CC(=O)C1CCN(C(=O)NC[C@H]2OCCc3ccccc32)CC1	ZINC000875279211	DE	On-Demand	Anodyne	SMO	21	43
COc1ccc2[nH]cc(CCNC(=O)NC[C@H]3C[C@H](O)C3)c2c1	ZINC000875279230	DD	On-Demand	Anodyne	HTR1A	20	51
COc1ccc2[nH]cc(CCNC(=O)NC[C@H]3C[C@H](O)C3)c2c1	ZINC000875279230	DD	On-Demand	Anodyne	HTR1D	63	51
COc1ccc2[nH]cc(CCNC(=O)NC[C@H]3C[C@H](O)C3)c2c1	ZINC000875279230	DD	On-Demand	Anodyne	HTR1B	52	51
COc1ccc2[nH]cc(CCNC(=O)NC[C@H]3C[C@H](O)C3)c2c1	ZINC000875279230	DD	On-Demand	Anodyne	NQO2	39	65
COc1ccc2[nH]cc(CCNC(=O)NC[C@H]3C[C@H](O)C3)c2c1	ZINC000875279230	DD	On-Demand	Anodyne	MPO	60	39
COc1ccc2[nH]cc(CCNC(=O)NC[C@H]3C[C@H](O)C3)c2c1	ZINC000875279230	DD	On-Demand	Anodyne	HTR1E	22	43
COc1ccc2[nH]cc(CCNC(=O)NC[C@H]3C[C@H](O)C3)c2c1	ZINC000875279230	DD	On-Demand	Anodyne	MTNR1A	119	76
COc1ccc2[nH]cc(CCNC(=O)NC[C@H]3C[C@H](O)C3)c2c1	ZINC000875279230	DD	On-Demand	Anodyne	MTNR1B	87	65
COc1ccc2[nH]cc(CCNC(=O)NC[C@H]3C[C@H](O)C3)c2c1	ZINC000875279230	DD	On-Demand	Anodyne	ABCG2	29	47
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](C(C)(C)O)C3)c2c1	ZINC000875279240	EF	On-Demand	Anodyne	HTR1A	28	47
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](C(C)(C)O)C3)c2c1	ZINC000875279240	EF	On-Demand	Anodyne	HTR1D	106	47
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](C(C)(C)O)C3)c2c1	ZINC000875279240	EF	On-Demand	Anodyne	HTR1B	86	47
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](C(C)(C)O)C3)c2c1	ZINC000875279240	EF	On-Demand	Anodyne	SLC6A4	17	49
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](C(C)(C)O)C3)c2c1	ZINC000875279240	EF	On-Demand	Anodyne	NQO2	45	61
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](C(C)(C)O)C3)c2c1	ZINC000875279240	EF	On-Demand	Anodyne	MPO	54	37
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](C(C)(C)O)C3)c2c1	ZINC000875279240	EF	On-Demand	Anodyne	HTR1E	27	41
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](C(C)(C)O)C3)c2c1	ZINC000875279240	EF	On-Demand	Anodyne	MTNR1A	112	63
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](C(C)(C)O)C3)c2c1	ZINC000875279240	EF	On-Demand	Anodyne	MTNR1B	88	61
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](C(C)(C)O)C3)c2c1	ZINC000875279240	EF	On-Demand	Anodyne	ABCG2	28	46
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](C(C)(C)O)C3)c2c1	ZINC000875279241	EF	On-Demand	Anodyne	HTR1A	28	47
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](C(C)(C)O)C3)c2c1	ZINC000875279241	EF	On-Demand	Anodyne	HTR1D	106	47
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](C(C)(C)O)C3)c2c1	ZINC000875279241	EF	On-Demand	Anodyne	HTR1B	86	47
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](C(C)(C)O)C3)c2c1	ZINC000875279241	EF	On-Demand	Anodyne	SLC6A4	17	49
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](C(C)(C)O)C3)c2c1	ZINC000875279241	EF	On-Demand	Anodyne	NQO2	45	61
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](C(C)(C)O)C3)c2c1	ZINC000875279241	EF	On-Demand	Anodyne	MPO	54	37
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](C(C)(C)O)C3)c2c1	ZINC000875279241	EF	On-Demand	Anodyne	HTR1E	27	41
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](C(C)(C)O)C3)c2c1	ZINC000875279241	EF	On-Demand	Anodyne	MTNR1A	112	63
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](C(C)(C)O)C3)c2c1	ZINC000875279241	EF	On-Demand	Anodyne	MTNR1B	88	61
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](C(C)(C)O)C3)c2c1	ZINC000875279241	EF	On-Demand	Anodyne	ABCG2	28	46
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccc(N2CCCC2)cc1	ZINC000875279272	HH	On-Demand	Anodyne	EPHX2	23	40
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccc(N2CCCC2)cc1	ZINC000875279272	HH	On-Demand	Anodyne	MCHR1	15	40
O=C(CCCOc1ccc(F)cc1)OCc1nc(-c2cccc(Cl)c2)no1	ZINC000875279310	GI	On-Demand	Anodyne	TPSAB1	68	40
O=C(CCCOc1ccc(F)cc1)OCc1nc(-c2cccc(Br)c2)no1	ZINC000875279317	IJ	On-Demand	Anodyne	TPSAB1	53	36
Cn1nnnc1C1CCN(C(=O)NC[C@@H]2OCCc3ccccc32)CC1	ZINC000875279319	FD	On-Demand	Anodyne	SMO	25	44
Cn1nnnc1C1CCN(C(=O)NC[C@H]2OCCc3ccccc32)CC1	ZINC000875279320	FD	On-Demand	Anodyne	SMO	25	44
COc1cc(CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)c2ccccc2n1	ZINC000875279336	FD	On-Demand	Anodyne	ALS	64	32
COc1cc(CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)c2ccccc2n1	ZINC000875279337	FD	On-Demand	Anodyne	ALS	64	32
COc1ccc2[nH]cc(CCNC(=O)N3CCC(C(C)=O)CC3)c2c1	ZINC000875279349	EF	On-Demand	Anodyne	HTR1A	26	49
COc1ccc2[nH]cc(CCNC(=O)N3CCC(C(C)=O)CC3)c2c1	ZINC000875279349	EF	On-Demand	Anodyne	HTR1D	109	48
COc1ccc2[nH]cc(CCNC(=O)N3CCC(C(C)=O)CC3)c2c1	ZINC000875279349	EF	On-Demand	Anodyne	HTR1B	89	48
COc1ccc2[nH]cc(CCNC(=O)N3CCC(C(C)=O)CC3)c2c1	ZINC000875279349	EF	On-Demand	Anodyne	NQO2	45	65
COc1ccc2[nH]cc(CCNC(=O)N3CCC(C(C)=O)CC3)c2c1	ZINC000875279349	EF	On-Demand	Anodyne	MPO	52	38
COc1ccc2[nH]cc(CCNC(=O)N3CCC(C(C)=O)CC3)c2c1	ZINC000875279349	EF	On-Demand	Anodyne	HTR1E	27	42
COc1ccc2[nH]cc(CCNC(=O)N3CCC(C(C)=O)CC3)c2c1	ZINC000875279349	EF	On-Demand	Anodyne	MTNR1A	127	65
COc1ccc2[nH]cc(CCNC(=O)N3CCC(C(C)=O)CC3)c2c1	ZINC000875279349	EF	On-Demand	Anodyne	MTNR1B	102	65
COc1ccc2[nH]cc(CCNC(=O)N3CCC(C(C)=O)CC3)c2c1	ZINC000875279349	EF	On-Demand	Anodyne	ABCG2	27	44
O=C(CCCOc1ccc(F)cc1)OCc1nc(-c2ccc(Cl)cc2)no1	ZINC000875279361	GI	On-Demand	Anodyne	TPSAB1	57	38
COc1ccc2[nH]cc(CCNC(=O)N3Cc4cccc(O)c4C3)c2c1	ZINC000875279367	FG	On-Demand	Clean	HTR1A	22	48
COc1ccc2[nH]cc(CCNC(=O)N3Cc4cccc(O)c4C3)c2c1	ZINC000875279367	FG	On-Demand	Clean	DRD4	40	31
COc1ccc2[nH]cc(CCNC(=O)N3Cc4cccc(O)c4C3)c2c1	ZINC000875279367	FG	On-Demand	Clean	ACHE	21	43
COc1ccc2[nH]cc(CCNC(=O)N3Cc4cccc(O)c4C3)c2c1	ZINC000875279367	FG	On-Demand	Clean	HTR1D	53	45
COc1ccc2[nH]cc(CCNC(=O)N3Cc4cccc(O)c4C3)c2c1	ZINC000875279367	FG	On-Demand	Clean	HTR1B	41	45
COc1ccc2[nH]cc(CCNC(=O)N3Cc4cccc(O)c4C3)c2c1	ZINC000875279367	FG	On-Demand	Clean	NQO2	41	59
COc1ccc2[nH]cc(CCNC(=O)N3Cc4cccc(O)c4C3)c2c1	ZINC000875279367	FG	On-Demand	Clean	MPO	41	36
COc1ccc2[nH]cc(CCNC(=O)N3Cc4cccc(O)c4C3)c2c1	ZINC000875279367	FG	On-Demand	Clean	HTR1E	15	40
COc1ccc2[nH]cc(CCNC(=O)N3Cc4cccc(O)c4C3)c2c1	ZINC000875279367	FG	On-Demand	Clean	MTNR1A	122	60
COc1ccc2[nH]cc(CCNC(=O)N3Cc4cccc(O)c4C3)c2c1	ZINC000875279367	FG	On-Demand	Clean	MTNR1B	98	59
COc1ccc2[nH]cc(CCNC(=O)N3Cc4cccc(O)c4C3)c2c1	ZINC000875279367	FG	On-Demand	Clean	ABCG2	27	44
Cc1cnc(CNC(=O)C(=O)N2CCN(c3ccc(F)cc3F)CC2)s1	ZINC000875279387	GD	On-Demand	Anodyne	NPY2R	75	37
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(S(=O)(=O)c2cccc(F)c2)CC1	ZINC000875279388	JE	On-Demand	Anodyne	PKM	27	41
COc1ccc2[nH]cc(CCNC(=O)N3CCCN(C=O)CC3)c2c1	ZINC000875279413	ED	On-Demand	Anodyne	HTR1A	23	51
COc1ccc2[nH]cc(CCNC(=O)N3CCCN(C=O)CC3)c2c1	ZINC000875279413	ED	On-Demand	Anodyne	ACHE	22	45
COc1ccc2[nH]cc(CCNC(=O)N3CCCN(C=O)CC3)c2c1	ZINC000875279413	ED	On-Demand	Anodyne	HTR1D	80	46
COc1ccc2[nH]cc(CCNC(=O)N3CCCN(C=O)CC3)c2c1	ZINC000875279413	ED	On-Demand	Anodyne	HTR1B	64	46
COc1ccc2[nH]cc(CCNC(=O)N3CCCN(C=O)CC3)c2c1	ZINC000875279413	ED	On-Demand	Anodyne	NQO2	35	60
COc1ccc2[nH]cc(CCNC(=O)N3CCCN(C=O)CC3)c2c1	ZINC000875279413	ED	On-Demand	Anodyne	MPO	49	38
COc1ccc2[nH]cc(CCNC(=O)N3CCCN(C=O)CC3)c2c1	ZINC000875279413	ED	On-Demand	Anodyne	HTR1E	15	42
COc1ccc2[nH]cc(CCNC(=O)N3CCCN(C=O)CC3)c2c1	ZINC000875279413	ED	On-Demand	Anodyne	MTNR1A	106	63
COc1ccc2[nH]cc(CCNC(=O)N3CCCN(C=O)CC3)c2c1	ZINC000875279413	ED	On-Demand	Anodyne	MTNR1B	84	60
COc1ccc2[nH]cc(CCNC(=O)N3CCCN(C=O)CC3)c2c1	ZINC000875279413	ED	On-Demand	Anodyne	ABCG2	26	43
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4[C@H](CCN4C)C3)c2c1	ZINC000875279414	FE	On-Demand	Anodyne	HTR1A	25	48
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4[C@H](CCN4C)C3)c2c1	ZINC000875279414	FE	On-Demand	Anodyne	HTR1D	110	48
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4[C@H](CCN4C)C3)c2c1	ZINC000875279414	FE	On-Demand	Anodyne	HTR1B	91	48
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4[C@H](CCN4C)C3)c2c1	ZINC000875279414	FE	On-Demand	Anodyne	NQO2	34	57
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4[C@H](CCN4C)C3)c2c1	ZINC000875279414	FE	On-Demand	Anodyne	MPO	42	36
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4[C@H](CCN4C)C3)c2c1	ZINC000875279414	FE	On-Demand	Anodyne	HTR6	16	42
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4[C@H](CCN4C)C3)c2c1	ZINC000875279414	FE	On-Demand	Anodyne	MTNR1A	87	58
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4[C@H](CCN4C)C3)c2c1	ZINC000875279414	FE	On-Demand	Anodyne	MTNR1B	69	57
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4[C@H](CCN4C)C3)c2c1	ZINC000875279414	FE	On-Demand	Anodyne	ABCG2	26	43
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4[C@H](CCN4C)C3)c2c1	ZINC000875279415	FE	On-Demand	Anodyne	HTR1A	25	48
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4[C@H](CCN4C)C3)c2c1	ZINC000875279415	FE	On-Demand	Anodyne	HTR1D	110	48
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4[C@H](CCN4C)C3)c2c1	ZINC000875279415	FE	On-Demand	Anodyne	HTR1B	91	48
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4[C@H](CCN4C)C3)c2c1	ZINC000875279415	FE	On-Demand	Anodyne	NQO2	34	57
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4[C@H](CCN4C)C3)c2c1	ZINC000875279415	FE	On-Demand	Anodyne	MPO	42	36
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4[C@H](CCN4C)C3)c2c1	ZINC000875279415	FE	On-Demand	Anodyne	HTR6	16	42
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4[C@H](CCN4C)C3)c2c1	ZINC000875279415	FE	On-Demand	Anodyne	MTNR1A	87	58
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4[C@H](CCN4C)C3)c2c1	ZINC000875279415	FE	On-Demand	Anodyne	MTNR1B	69	57
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4[C@H](CCN4C)C3)c2c1	ZINC000875279415	FE	On-Demand	Anodyne	ABCG2	26	43
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4[C@@H](CCN4C)C3)c2c1	ZINC000875279416	FE	On-Demand	Anodyne	HTR1A	25	48
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4[C@@H](CCN4C)C3)c2c1	ZINC000875279416	FE	On-Demand	Anodyne	HTR1D	110	48
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4[C@@H](CCN4C)C3)c2c1	ZINC000875279416	FE	On-Demand	Anodyne	HTR1B	91	48
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4[C@@H](CCN4C)C3)c2c1	ZINC000875279416	FE	On-Demand	Anodyne	NQO2	34	57
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4[C@@H](CCN4C)C3)c2c1	ZINC000875279416	FE	On-Demand	Anodyne	MPO	42	36
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4[C@@H](CCN4C)C3)c2c1	ZINC000875279416	FE	On-Demand	Anodyne	HTR6	16	42
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4[C@@H](CCN4C)C3)c2c1	ZINC000875279416	FE	On-Demand	Anodyne	MTNR1A	87	58
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4[C@@H](CCN4C)C3)c2c1	ZINC000875279416	FE	On-Demand	Anodyne	MTNR1B	69	57
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4[C@@H](CCN4C)C3)c2c1	ZINC000875279416	FE	On-Demand	Anodyne	ABCG2	26	43
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4[C@@H](CCN4C)C3)c2c1	ZINC000875279417	FE	On-Demand	Anodyne	HTR1A	25	48
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4[C@@H](CCN4C)C3)c2c1	ZINC000875279417	FE	On-Demand	Anodyne	HTR1D	110	48
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4[C@@H](CCN4C)C3)c2c1	ZINC000875279417	FE	On-Demand	Anodyne	HTR1B	91	48
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4[C@@H](CCN4C)C3)c2c1	ZINC000875279417	FE	On-Demand	Anodyne	NQO2	34	57
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4[C@@H](CCN4C)C3)c2c1	ZINC000875279417	FE	On-Demand	Anodyne	MPO	42	36
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4[C@@H](CCN4C)C3)c2c1	ZINC000875279417	FE	On-Demand	Anodyne	HTR6	16	42
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4[C@@H](CCN4C)C3)c2c1	ZINC000875279417	FE	On-Demand	Anodyne	MTNR1A	87	58
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4[C@@H](CCN4C)C3)c2c1	ZINC000875279417	FE	On-Demand	Anodyne	MTNR1B	69	57
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4[C@@H](CCN4C)C3)c2c1	ZINC000875279417	FE	On-Demand	Anodyne	ABCG2	26	43
COc1ccc2[nH]cc(CCNC(=O)N3CCC(CO)(CO)CC3)c2c1	ZINC000875279424	FD	On-Demand	Anodyne	HTR1A	21	49
COc1ccc2[nH]cc(CCNC(=O)N3CCC(CO)(CO)CC3)c2c1	ZINC000875279424	FD	On-Demand	Anodyne	HTR1D	91	47
COc1ccc2[nH]cc(CCNC(=O)N3CCC(CO)(CO)CC3)c2c1	ZINC000875279424	FD	On-Demand	Anodyne	HTR1B	74	47
COc1ccc2[nH]cc(CCNC(=O)N3CCC(CO)(CO)CC3)c2c1	ZINC000875279424	FD	On-Demand	Anodyne	NQO2	38	63
COc1ccc2[nH]cc(CCNC(=O)N3CCC(CO)(CO)CC3)c2c1	ZINC000875279424	FD	On-Demand	Anodyne	MPO	56	38
COc1ccc2[nH]cc(CCNC(=O)N3CCC(CO)(CO)CC3)c2c1	ZINC000875279424	FD	On-Demand	Anodyne	HTR1E	15	42
COc1ccc2[nH]cc(CCNC(=O)N3CCC(CO)(CO)CC3)c2c1	ZINC000875279424	FD	On-Demand	Anodyne	MTNR1A	109	64
COc1ccc2[nH]cc(CCNC(=O)N3CCC(CO)(CO)CC3)c2c1	ZINC000875279424	FD	On-Demand	Anodyne	MTNR1B	85	63
COc1ccc2[nH]cc(CCNC(=O)N3CCC(CO)(CO)CC3)c2c1	ZINC000875279424	FD	On-Demand	Anodyne	ABCG2	27	44
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875279427	FD	On-Demand	Anodyne	TRHR	53	32
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875279427	FD	On-Demand	Anodyne	CPT1A	106	42
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875279427	FD	On-Demand	Anodyne	CPT2	51	38
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875279428	FD	On-Demand	Anodyne	TRHR	53	32
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875279428	FD	On-Demand	Anodyne	CPT1A	106	42
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875279428	FD	On-Demand	Anodyne	CPT2	51	38
COc1ccc2[nH]cc(CCNC(=O)N3CCO[C@H](C(F)(F)F)CC3)c2c1	ZINC000875279433	GG	On-Demand	Anodyne	HTR1A	21	44
COc1ccc2[nH]cc(CCNC(=O)N3CCO[C@H](C(F)(F)F)CC3)c2c1	ZINC000875279433	GG	On-Demand	Anodyne	HTR1D	77	43
COc1ccc2[nH]cc(CCNC(=O)N3CCO[C@H](C(F)(F)F)CC3)c2c1	ZINC000875279433	GG	On-Demand	Anodyne	HTR1B	63	43
COc1ccc2[nH]cc(CCNC(=O)N3CCO[C@H](C(F)(F)F)CC3)c2c1	ZINC000875279433	GG	On-Demand	Anodyne	NQO2	38	56
COc1ccc2[nH]cc(CCNC(=O)N3CCO[C@H](C(F)(F)F)CC3)c2c1	ZINC000875279433	GG	On-Demand	Anodyne	MPO	45	36
COc1ccc2[nH]cc(CCNC(=O)N3CCO[C@H](C(F)(F)F)CC3)c2c1	ZINC000875279433	GG	On-Demand	Anodyne	MTNR1A	85	62
COc1ccc2[nH]cc(CCNC(=O)N3CCO[C@H](C(F)(F)F)CC3)c2c1	ZINC000875279433	GG	On-Demand	Anodyne	MTNR1B	65	56
COc1ccc2[nH]cc(CCNC(=O)N3CCO[C@H](C(F)(F)F)CC3)c2c1	ZINC000875279433	GG	On-Demand	Anodyne	ABCG2	26	42
COc1ccc2[nH]cc(CCNC(=O)N3CCO[C@@H](C(F)(F)F)CC3)c2c1	ZINC000875279434	GG	On-Demand	Anodyne	HTR1A	21	44
COc1ccc2[nH]cc(CCNC(=O)N3CCO[C@@H](C(F)(F)F)CC3)c2c1	ZINC000875279434	GG	On-Demand	Anodyne	HTR1D	77	43
COc1ccc2[nH]cc(CCNC(=O)N3CCO[C@@H](C(F)(F)F)CC3)c2c1	ZINC000875279434	GG	On-Demand	Anodyne	HTR1B	63	43
COc1ccc2[nH]cc(CCNC(=O)N3CCO[C@@H](C(F)(F)F)CC3)c2c1	ZINC000875279434	GG	On-Demand	Anodyne	NQO2	38	56
COc1ccc2[nH]cc(CCNC(=O)N3CCO[C@@H](C(F)(F)F)CC3)c2c1	ZINC000875279434	GG	On-Demand	Anodyne	MPO	45	36
COc1ccc2[nH]cc(CCNC(=O)N3CCO[C@@H](C(F)(F)F)CC3)c2c1	ZINC000875279434	GG	On-Demand	Anodyne	MTNR1A	85	62
COc1ccc2[nH]cc(CCNC(=O)N3CCO[C@@H](C(F)(F)F)CC3)c2c1	ZINC000875279434	GG	On-Demand	Anodyne	MTNR1B	65	56
COc1ccc2[nH]cc(CCNC(=O)N3CCO[C@@H](C(F)(F)F)CC3)c2c1	ZINC000875279434	GG	On-Demand	Anodyne	ABCG2	26	42
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](C(C)=O)C3)c2c1	ZINC000875279435	EF	On-Demand	Anodyne	HTR1A	24	49
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](C(C)=O)C3)c2c1	ZINC000875279435	EF	On-Demand	Anodyne	ACHE	17	43
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](C(C)=O)C3)c2c1	ZINC000875279435	EF	On-Demand	Anodyne	HTR1D	97	49
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](C(C)=O)C3)c2c1	ZINC000875279435	EF	On-Demand	Anodyne	HTR1B	81	49
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](C(C)=O)C3)c2c1	ZINC000875279435	EF	On-Demand	Anodyne	SSTR2	46	38
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](C(C)=O)C3)c2c1	ZINC000875279435	EF	On-Demand	Anodyne	NQO2	43	62
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](C(C)=O)C3)c2c1	ZINC000875279435	EF	On-Demand	Anodyne	MPO	42	36
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](C(C)=O)C3)c2c1	ZINC000875279435	EF	On-Demand	Anodyne	HTR1E	20	40
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](C(C)=O)C3)c2c1	ZINC000875279435	EF	On-Demand	Anodyne	HTR6	16	41
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](C(C)=O)C3)c2c1	ZINC000875279435	EF	On-Demand	Anodyne	MTNR1A	117	62
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](C(C)=O)C3)c2c1	ZINC000875279435	EF	On-Demand	Anodyne	MTNR1B	93	62
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](C(C)=O)C3)c2c1	ZINC000875279435	EF	On-Demand	Anodyne	ABCG2	26	43
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](C(C)=O)C3)c2c1	ZINC000875279436	EF	On-Demand	Anodyne	HTR1A	24	49
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](C(C)=O)C3)c2c1	ZINC000875279436	EF	On-Demand	Anodyne	ACHE	17	43
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](C(C)=O)C3)c2c1	ZINC000875279436	EF	On-Demand	Anodyne	HTR1D	97	49
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](C(C)=O)C3)c2c1	ZINC000875279436	EF	On-Demand	Anodyne	HTR1B	81	49
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](C(C)=O)C3)c2c1	ZINC000875279436	EF	On-Demand	Anodyne	SSTR2	46	38
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](C(C)=O)C3)c2c1	ZINC000875279436	EF	On-Demand	Anodyne	NQO2	43	62
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](C(C)=O)C3)c2c1	ZINC000875279436	EF	On-Demand	Anodyne	MPO	42	36
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](C(C)=O)C3)c2c1	ZINC000875279436	EF	On-Demand	Anodyne	HTR1E	20	40
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](C(C)=O)C3)c2c1	ZINC000875279436	EF	On-Demand	Anodyne	HTR6	16	41
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](C(C)=O)C3)c2c1	ZINC000875279436	EF	On-Demand	Anodyne	MTNR1A	117	62
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](C(C)=O)C3)c2c1	ZINC000875279436	EF	On-Demand	Anodyne	MTNR1B	93	62
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](C(C)=O)C3)c2c1	ZINC000875279436	EF	On-Demand	Anodyne	ABCG2	26	43
COc1ccc(NC(=O)[C@H](C)OC(=O)CCCOc2ccc(F)cc2)cc1	ZINC000875279443	GH	On-Demand	Anodyne	LTA4H	22	40
COc1ccc(NC(=O)[C@H](C)OC(=O)CCCOc2ccc(F)cc2)cc1	ZINC000875279443	GH	On-Demand	Anodyne	FAAH	21	43
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCC(c2nc3ccccc3s2)CC1	ZINC000875279445	JJ	On-Demand	Anodyne	LTA4H	33	42
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H]4C(=O)OC[C@H]4C3)c2c1	ZINC000875279454	ED	On-Demand	Anodyne	HTR1A	20	46
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H]4C(=O)OC[C@H]4C3)c2c1	ZINC000875279454	ED	On-Demand	Anodyne	HTR1D	41	43
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H]4C(=O)OC[C@H]4C3)c2c1	ZINC000875279454	ED	On-Demand	Anodyne	HTR1B	32	43
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H]4C(=O)OC[C@H]4C3)c2c1	ZINC000875279454	ED	On-Demand	Anodyne	NQO2	36	56
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H]4C(=O)OC[C@H]4C3)c2c1	ZINC000875279454	ED	On-Demand	Anodyne	MTNR1A	86	57
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H]4C(=O)OC[C@H]4C3)c2c1	ZINC000875279454	ED	On-Demand	Anodyne	MTNR1B	66	56
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H]4C(=O)OC[C@H]4C3)c2c1	ZINC000875279454	ED	On-Demand	Anodyne	ABCG2	27	45
COc1ccc2[nH]cc(CCNC(=O)N3CCN(C)c4ncccc4C3)c2c1	ZINC000875279502	GF	On-Demand	Anodyne	HTR1A	24	46
COc1ccc2[nH]cc(CCNC(=O)N3CCN(C)c4ncccc4C3)c2c1	ZINC000875279502	GF	On-Demand	Anodyne	HTR1D	92	46
COc1ccc2[nH]cc(CCNC(=O)N3CCN(C)c4ncccc4C3)c2c1	ZINC000875279502	GF	On-Demand	Anodyne	HTR1B	75	43
COc1ccc2[nH]cc(CCNC(=O)N3CCN(C)c4ncccc4C3)c2c1	ZINC000875279502	GF	On-Demand	Anodyne	NQO2	34	54
COc1ccc2[nH]cc(CCNC(=O)N3CCN(C)c4ncccc4C3)c2c1	ZINC000875279502	GF	On-Demand	Anodyne	MTNR1A	88	55
COc1ccc2[nH]cc(CCNC(=O)N3CCN(C)c4ncccc4C3)c2c1	ZINC000875279502	GF	On-Demand	Anodyne	MTNR1B	70	54
COc1ccc2[nH]cc(CCNC(=O)N3CCN(C)c4ncccc4C3)c2c1	ZINC000875279502	GF	On-Demand	Anodyne	ABCG2	26	43
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000875279512	HE	On-Demand	Anodyne	CA2	30	48
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000875279512	HE	On-Demand	Anodyne	CA1	25	42
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000875279512	HE	On-Demand	Anodyne	CA4	26	48
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000875279512	HE	On-Demand	Anodyne	CA12	24	41
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000875279512	HE	On-Demand	Anodyne	CA9	26	41
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000875279512	HE	On-Demand	Anodyne	MTCA1	25	41
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000875279512	HE	On-Demand	Anodyne	P96878_MYCTU	24	41
C[C@@H](NC(=O)CNS(=O)(=O)c1c(Cl)cccc1Cl)c1ccc(Cl)c(Cl)c1	ZINC000875279528	JI	On-Demand	Anodyne	F7	18	47
C[C@H](NC(=O)CNS(=O)(=O)c1c(Cl)cccc1Cl)c1ccc(Cl)c(Cl)c1	ZINC000875279529	JI	On-Demand	Anodyne	F7	18	47
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2c[nH]c3ccc(OC)cc23)C1	ZINC000875279547	FF	On-Demand	Anodyne	HTR1A	19	46
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2c[nH]c3ccc(OC)cc23)C1	ZINC000875279547	FF	On-Demand	Anodyne	HTR1D	61	46
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2c[nH]c3ccc(OC)cc23)C1	ZINC000875279547	FF	On-Demand	Anodyne	HTR1B	47	46
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2c[nH]c3ccc(OC)cc23)C1	ZINC000875279547	FF	On-Demand	Anodyne	NQO2	33	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2c[nH]c3ccc(OC)cc23)C1	ZINC000875279547	FF	On-Demand	Anodyne	MPO	45	35
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2c[nH]c3ccc(OC)cc23)C1	ZINC000875279547	FF	On-Demand	Anodyne	MTNR1A	105	60
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2c[nH]c3ccc(OC)cc23)C1	ZINC000875279547	FF	On-Demand	Anodyne	MTNR1B	81	57
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2c[nH]c3ccc(OC)cc23)C1	ZINC000875279547	FF	On-Demand	Anodyne	ABCG2	27	45
CCCCCCCNC(=O)C(=O)NCc1ncc(C)s1	ZINC000875279549	CE	On-Demand	Mild	ASAH1	85	36
O=C(NC[C@H]1OCCc2ccccc21)N1CCC[C@H](OC2CCC2)CC1	ZINC000875279552	FG	On-Demand	Anodyne	SMO	26	41
O=C(NC[C@@H]1OCCc2ccccc21)N1CCC[C@H](OC2CCC2)CC1	ZINC000875279553	FG	On-Demand	Anodyne	SMO	26	41
O=C(NC[C@@H]1OCCc2ccccc21)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875279554	FG	On-Demand	Anodyne	SMO	26	41
O=C(NC[C@H]1OCCc2ccccc21)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875279555	FG	On-Demand	Anodyne	SMO	26	41
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@](C)(C(F)(F)F)C3)c2c1	ZINC000875279556	FH	On-Demand	Anodyne	HTR1A	19	47
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@](C)(C(F)(F)F)C3)c2c1	ZINC000875279556	FH	On-Demand	Anodyne	HTR1D	69	44
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@](C)(C(F)(F)F)C3)c2c1	ZINC000875279556	FH	On-Demand	Anodyne	HTR1B	55	44
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@](C)(C(F)(F)F)C3)c2c1	ZINC000875279556	FH	On-Demand	Anodyne	NQO2	37	57
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@](C)(C(F)(F)F)C3)c2c1	ZINC000875279556	FH	On-Demand	Anodyne	MPO	51	37
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@](C)(C(F)(F)F)C3)c2c1	ZINC000875279556	FH	On-Demand	Anodyne	MTNR1A	88	61
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@](C)(C(F)(F)F)C3)c2c1	ZINC000875279556	FH	On-Demand	Anodyne	MTNR1B	69	57
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@](C)(C(F)(F)F)C3)c2c1	ZINC000875279556	FH	On-Demand	Anodyne	ABCG2	25	42
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@](C)(C(F)(F)F)C3)c2c1	ZINC000875279557	FH	On-Demand	Anodyne	HTR1A	19	47
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@](C)(C(F)(F)F)C3)c2c1	ZINC000875279557	FH	On-Demand	Anodyne	HTR1D	69	44
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@](C)(C(F)(F)F)C3)c2c1	ZINC000875279557	FH	On-Demand	Anodyne	HTR1B	55	44
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@](C)(C(F)(F)F)C3)c2c1	ZINC000875279557	FH	On-Demand	Anodyne	NQO2	37	57
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@](C)(C(F)(F)F)C3)c2c1	ZINC000875279557	FH	On-Demand	Anodyne	MPO	51	37
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@](C)(C(F)(F)F)C3)c2c1	ZINC000875279557	FH	On-Demand	Anodyne	MTNR1A	88	61
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@](C)(C(F)(F)F)C3)c2c1	ZINC000875279557	FH	On-Demand	Anodyne	MTNR1B	69	57
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@](C)(C(F)(F)F)C3)c2c1	ZINC000875279557	FH	On-Demand	Anodyne	ABCG2	25	42
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H]4C(=O)N(C)C(=O)[C@H]4C3)c2c1	ZINC000875279558	FC	On-Demand	Anodyne	HTR1A	25	52
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H]4C(=O)N(C)C(=O)[C@H]4C3)c2c1	ZINC000875279558	FC	On-Demand	Anodyne	HTR1D	92	47
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H]4C(=O)N(C)C(=O)[C@H]4C3)c2c1	ZINC000875279558	FC	On-Demand	Anodyne	HTR1B	76	47
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H]4C(=O)N(C)C(=O)[C@H]4C3)c2c1	ZINC000875279558	FC	On-Demand	Anodyne	NQO2	38	63
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H]4C(=O)N(C)C(=O)[C@H]4C3)c2c1	ZINC000875279558	FC	On-Demand	Anodyne	MPO	54	38
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H]4C(=O)N(C)C(=O)[C@H]4C3)c2c1	ZINC000875279558	FC	On-Demand	Anodyne	HTR1E	15	42
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H]4C(=O)N(C)C(=O)[C@H]4C3)c2c1	ZINC000875279558	FC	On-Demand	Anodyne	MTNR1A	112	64
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H]4C(=O)N(C)C(=O)[C@H]4C3)c2c1	ZINC000875279558	FC	On-Demand	Anodyne	MTNR1B	85	63
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H]4C(=O)N(C)C(=O)[C@H]4C3)c2c1	ZINC000875279558	FC	On-Demand	Anodyne	ABCG2	29	48
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000875279580	IG	On-Demand	Anodyne	HRH3	17	42
C=CCC[C@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccccc1	ZINC000875279586	GE	On-Demand	Mild	CCR5	29	40
C=CCC[C@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccccc1	ZINC000875279586	GE	On-Demand	Mild	L3MBTL3	47	37
C=CCC[C@@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccccc1	ZINC000875279587	GE	On-Demand	Mild	CCR5	29	40
C=CCC[C@@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccccc1	ZINC000875279587	GE	On-Demand	Mild	L3MBTL3	47	37
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1cccc(C(F)(F)F)c1	ZINC000875279594	IH	On-Demand	Anodyne	NOS1	37	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1cccc(C(F)(F)F)c1	ZINC000875279595	IH	On-Demand	Anodyne	NOS1	37	41
CC(C)c1ccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875279596	HI	On-Demand	Anodyne	FKBP1A	50	38
CC(C)c1ccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875279597	HI	On-Demand	Anodyne	FKBP1A	50	38
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCc2[nH]c3ccccc3c2C1	ZINC000875279598	HH	On-Demand	Anodyne	SSTR4	43	33
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCc2[nH]c3ccccc3c2C1	ZINC000875279598	HH	On-Demand	Anodyne	HTR5A	22	61
NC(=O)CCOC(=O)CCCOc1ccc(F)cc1	ZINC000875279605	CD	On-Demand	Anodyne	LTA4H	18	49
NC(=O)CCOC(=O)CCCOc1ccc(F)cc1	ZINC000875279605	CD	On-Demand	Anodyne	PLA2G4B	50	33
NC(=O)CCOC(=O)CCCOc1ccc(F)cc1	ZINC000875279605	CD	On-Demand	Anodyne	FAAH	17	42
CCOC(=O)[C@@H]1CCCN(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)C1	ZINC000875279606	IE	On-Demand	Anodyne	FKBP1A	54	38
CCOC(=O)[C@@H]1CCCN(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)C1	ZINC000875279606	IE	On-Demand	Anodyne	PREP	63	39
CCOC(=O)[C@@H]1CCCN(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)C1	ZINC000875279608	IE	On-Demand	Anodyne	FKBP1A	54	38
CCOC(=O)[C@@H]1CCCN(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)C1	ZINC000875279608	IE	On-Demand	Anodyne	PREP	63	39
C=CCC[C@H](NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1)c1ccccc1	ZINC000875279625	EF	On-Demand	Mild	SLC6A1	80	40
C=CCC[C@H](NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1)c1ccccc1	ZINC000875279625	EF	On-Demand	Mild	CCR5	28	43
C=CCC[C@@H](NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1)c1ccccc1	ZINC000875279626	EF	On-Demand	Mild	SLC6A1	80	40
C=CCC[C@@H](NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1)c1ccccc1	ZINC000875279626	EF	On-Demand	Mild	CCR5	28	43
C=CCC[C@H](NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1)c1ccccc1	ZINC000875279627	EF	On-Demand	Mild	SLC6A1	80	40
C=CCC[C@H](NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1)c1ccccc1	ZINC000875279627	EF	On-Demand	Mild	CCR5	28	43
C=CCC[C@@H](NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1)c1ccccc1	ZINC000875279628	EF	On-Demand	Mild	SLC6A1	80	40
C=CCC[C@@H](NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1)c1ccccc1	ZINC000875279628	EF	On-Demand	Mild	CCR5	28	43
O=C(CCCOc1ccc(F)cc1)OCCCN1C(=O)c2ccccc2C1=O	ZINC000875279665	GG	On-Demand	Anodyne	LTA4H	17	40
O=C(CCCOc1ccc(F)cc1)OCCCN1C(=O)c2ccccc2C1=O	ZINC000875279665	GG	On-Demand	Anodyne	HRH3	24	40
COc1ccc2[nH]cc(CCNC(=O)NC3(C)CC(F)(F)C3)c2c1	ZINC000875279670	EG	On-Demand	Anodyne	HTR1A	19	48
COc1ccc2[nH]cc(CCNC(=O)NC3(C)CC(F)(F)C3)c2c1	ZINC000875279670	EG	On-Demand	Anodyne	HTR1D	39	48
COc1ccc2[nH]cc(CCNC(=O)NC3(C)CC(F)(F)C3)c2c1	ZINC000875279670	EG	On-Demand	Anodyne	HTR1B	33	48
COc1ccc2[nH]cc(CCNC(=O)NC3(C)CC(F)(F)C3)c2c1	ZINC000875279670	EG	On-Demand	Anodyne	NQO2	38	64
COc1ccc2[nH]cc(CCNC(=O)NC3(C)CC(F)(F)C3)c2c1	ZINC000875279670	EG	On-Demand	Anodyne	MPO	71	41
COc1ccc2[nH]cc(CCNC(=O)NC3(C)CC(F)(F)C3)c2c1	ZINC000875279670	EG	On-Demand	Anodyne	HTR1E	16	47
COc1ccc2[nH]cc(CCNC(=O)NC3(C)CC(F)(F)C3)c2c1	ZINC000875279670	EG	On-Demand	Anodyne	MTNR1A	114	71
COc1ccc2[nH]cc(CCNC(=O)NC3(C)CC(F)(F)C3)c2c1	ZINC000875279670	EG	On-Demand	Anodyne	MTNR1B	84	64
COc1ccc2[nH]cc(CCNC(=O)NC3(C)CC(F)(F)C3)c2c1	ZINC000875279670	EG	On-Demand	Anodyne	ABCG2	28	47
COc1ccc2[nH]cc(CCNC(=O)N3CCC4(CCN(C)CC4)CC3)c2c1	ZINC000875279671	GG	On-Demand	Anodyne	HTR1A	27	51
COc1ccc2[nH]cc(CCNC(=O)N3CCC4(CCN(C)CC4)CC3)c2c1	ZINC000875279671	GG	On-Demand	Anodyne	HTR1D	104	47
COc1ccc2[nH]cc(CCNC(=O)N3CCC4(CCN(C)CC4)CC3)c2c1	ZINC000875279671	GG	On-Demand	Anodyne	HTR1B	88	48
COc1ccc2[nH]cc(CCNC(=O)N3CCC4(CCN(C)CC4)CC3)c2c1	ZINC000875279671	GG	On-Demand	Anodyne	NQO2	42	63
COc1ccc2[nH]cc(CCNC(=O)N3CCC4(CCN(C)CC4)CC3)c2c1	ZINC000875279671	GG	On-Demand	Anodyne	MPO	55	41
COc1ccc2[nH]cc(CCNC(=O)N3CCC4(CCN(C)CC4)CC3)c2c1	ZINC000875279671	GG	On-Demand	Anodyne	HTR1E	27	42
COc1ccc2[nH]cc(CCNC(=O)N3CCC4(CCN(C)CC4)CC3)c2c1	ZINC000875279671	GG	On-Demand	Anodyne	HTR5A	19	41
COc1ccc2[nH]cc(CCNC(=O)N3CCC4(CCN(C)CC4)CC3)c2c1	ZINC000875279671	GG	On-Demand	Anodyne	MTNR1A	114	64
COc1ccc2[nH]cc(CCNC(=O)N3CCC4(CCN(C)CC4)CC3)c2c1	ZINC000875279671	GG	On-Demand	Anodyne	MTNR1B	91	63
COc1ccc2[nH]cc(CCNC(=O)N3CCC4(CCN(C)CC4)CC3)c2c1	ZINC000875279671	GG	On-Demand	Anodyne	ABCG2	27	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875279680	FE	On-Demand	Anodyne	HTR1A	17	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875279680	FE	On-Demand	Anodyne	HTR1D	67	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875279680	FE	On-Demand	Anodyne	HTR1B	54	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875279680	FE	On-Demand	Anodyne	SLC6A4	19	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875279680	FE	On-Demand	Anodyne	NQO2	38	57
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875279680	FE	On-Demand	Anodyne	MTNR1A	98	58
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875279680	FE	On-Demand	Anodyne	MTNR1B	74	57
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875279680	FE	On-Demand	Anodyne	ABCG2	25	42
O=C(NC[C@@H]1OCCc2ccccc21)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875279681	GH	On-Demand	Anodyne	SMO	47	55
O=C(NC[C@@H]1OCCc2ccccc21)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875279681	GH	On-Demand	Anodyne	ETHR	63	45
O=C(NC[C@H]1OCCc2ccccc21)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875279682	GH	On-Demand	Anodyne	SMO	47	55
O=C(NC[C@H]1OCCc2ccccc21)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875279682	GH	On-Demand	Anodyne	ETHR	63	45
COCC(C)(C)CCNC(=O)C(=O)NCc1cc(OC)nc2ccccc12	ZINC000875279685	FE	On-Demand	Anodyne	METG	56	33
CONC(=O)C1CCN(C(=O)NCCc2c[nH]c3ccc(OC)cc23)CC1	ZINC000875279686	FD	On-Demand	Anodyne	HTR1A	23	47
CONC(=O)C1CCN(C(=O)NCCc2c[nH]c3ccc(OC)cc23)CC1	ZINC000875279686	FD	On-Demand	Anodyne	HTR1D	94	47
CONC(=O)C1CCN(C(=O)NCCc2c[nH]c3ccc(OC)cc23)CC1	ZINC000875279686	FD	On-Demand	Anodyne	HTR1B	77	47
CONC(=O)C1CCN(C(=O)NCCc2c[nH]c3ccc(OC)cc23)CC1	ZINC000875279686	FD	On-Demand	Anodyne	NQO2	37	59
CONC(=O)C1CCN(C(=O)NCCc2c[nH]c3ccc(OC)cc23)CC1	ZINC000875279686	FD	On-Demand	Anodyne	MPO	51	36
CONC(=O)C1CCN(C(=O)NCCc2c[nH]c3ccc(OC)cc23)CC1	ZINC000875279686	FD	On-Demand	Anodyne	HTR1E	21	42
CONC(=O)C1CCN(C(=O)NCCc2c[nH]c3ccc(OC)cc23)CC1	ZINC000875279686	FD	On-Demand	Anodyne	MTNR1A	101	60
CONC(=O)C1CCN(C(=O)NCCc2c[nH]c3ccc(OC)cc23)CC1	ZINC000875279686	FD	On-Demand	Anodyne	MTNR1B	80	59
CONC(=O)C1CCN(C(=O)NCCc2c[nH]c3ccc(OC)cc23)CC1	ZINC000875279686	FD	On-Demand	Anodyne	ABCG2	27	44
COc1ccc2[nH]cc(CCNC(=O)N[C@H](C)c3ccccc3O)c2c1	ZINC000875279693	FG	On-Demand	Clean	HTR1A	18	50
COc1ccc2[nH]cc(CCNC(=O)N[C@H](C)c3ccccc3O)c2c1	ZINC000875279693	FG	On-Demand	Clean	ACHE	21	41
COc1ccc2[nH]cc(CCNC(=O)N[C@H](C)c3ccccc3O)c2c1	ZINC000875279693	FG	On-Demand	Clean	HTR1D	49	47
COc1ccc2[nH]cc(CCNC(=O)N[C@H](C)c3ccccc3O)c2c1	ZINC000875279693	FG	On-Demand	Clean	HTR1B	40	47
COc1ccc2[nH]cc(CCNC(=O)N[C@H](C)c3ccccc3O)c2c1	ZINC000875279693	FG	On-Demand	Clean	TACR1	17	44
COc1ccc2[nH]cc(CCNC(=O)N[C@H](C)c3ccccc3O)c2c1	ZINC000875279693	FG	On-Demand	Clean	NQO2	39	63
COc1ccc2[nH]cc(CCNC(=O)N[C@H](C)c3ccccc3O)c2c1	ZINC000875279693	FG	On-Demand	Clean	CCKAR	23	42
COc1ccc2[nH]cc(CCNC(=O)N[C@H](C)c3ccccc3O)c2c1	ZINC000875279693	FG	On-Demand	Clean	MPO	49	38
COc1ccc2[nH]cc(CCNC(=O)N[C@H](C)c3ccccc3O)c2c1	ZINC000875279693	FG	On-Demand	Clean	HTR1E	16	44
COc1ccc2[nH]cc(CCNC(=O)N[C@H](C)c3ccccc3O)c2c1	ZINC000875279693	FG	On-Demand	Clean	BRS3	26	41
COc1ccc2[nH]cc(CCNC(=O)N[C@H](C)c3ccccc3O)c2c1	ZINC000875279693	FG	On-Demand	Clean	NMBR	37	43
COc1ccc2[nH]cc(CCNC(=O)N[C@H](C)c3ccccc3O)c2c1	ZINC000875279693	FG	On-Demand	Clean	MTNR1A	120	70
COc1ccc2[nH]cc(CCNC(=O)N[C@H](C)c3ccccc3O)c2c1	ZINC000875279693	FG	On-Demand	Clean	MTNR1B	94	63
COc1ccc2[nH]cc(CCNC(=O)N[C@H](C)c3ccccc3O)c2c1	ZINC000875279693	FG	On-Demand	Clean	CCKBR	16	42
COc1ccc2[nH]cc(CCNC(=O)N[C@H](C)c3ccccc3O)c2c1	ZINC000875279693	FG	On-Demand	Clean	GHSR	46	39
COc1ccc2[nH]cc(CCNC(=O)N[C@H](C)c3ccccc3O)c2c1	ZINC000875279693	FG	On-Demand	Clean	ABCG2	29	46
COc1ccc2[nH]cc(CCNC(=O)N[C@@H](C)c3ccccc3O)c2c1	ZINC000875279694	FG	On-Demand	Clean	HTR1A	18	50
COc1ccc2[nH]cc(CCNC(=O)N[C@@H](C)c3ccccc3O)c2c1	ZINC000875279694	FG	On-Demand	Clean	ACHE	21	41
COc1ccc2[nH]cc(CCNC(=O)N[C@@H](C)c3ccccc3O)c2c1	ZINC000875279694	FG	On-Demand	Clean	HTR1D	49	47
COc1ccc2[nH]cc(CCNC(=O)N[C@@H](C)c3ccccc3O)c2c1	ZINC000875279694	FG	On-Demand	Clean	HTR1B	40	47
COc1ccc2[nH]cc(CCNC(=O)N[C@@H](C)c3ccccc3O)c2c1	ZINC000875279694	FG	On-Demand	Clean	TACR1	17	44
COc1ccc2[nH]cc(CCNC(=O)N[C@@H](C)c3ccccc3O)c2c1	ZINC000875279694	FG	On-Demand	Clean	NQO2	39	63
COc1ccc2[nH]cc(CCNC(=O)N[C@@H](C)c3ccccc3O)c2c1	ZINC000875279694	FG	On-Demand	Clean	CCKAR	23	42
COc1ccc2[nH]cc(CCNC(=O)N[C@@H](C)c3ccccc3O)c2c1	ZINC000875279694	FG	On-Demand	Clean	MPO	49	38
COc1ccc2[nH]cc(CCNC(=O)N[C@@H](C)c3ccccc3O)c2c1	ZINC000875279694	FG	On-Demand	Clean	HTR1E	16	44
COc1ccc2[nH]cc(CCNC(=O)N[C@@H](C)c3ccccc3O)c2c1	ZINC000875279694	FG	On-Demand	Clean	BRS3	26	41
COc1ccc2[nH]cc(CCNC(=O)N[C@@H](C)c3ccccc3O)c2c1	ZINC000875279694	FG	On-Demand	Clean	NMBR	37	43
COc1ccc2[nH]cc(CCNC(=O)N[C@@H](C)c3ccccc3O)c2c1	ZINC000875279694	FG	On-Demand	Clean	MTNR1A	120	70
COc1ccc2[nH]cc(CCNC(=O)N[C@@H](C)c3ccccc3O)c2c1	ZINC000875279694	FG	On-Demand	Clean	MTNR1B	94	63
COc1ccc2[nH]cc(CCNC(=O)N[C@@H](C)c3ccccc3O)c2c1	ZINC000875279694	FG	On-Demand	Clean	CCKBR	16	42
COc1ccc2[nH]cc(CCNC(=O)N[C@@H](C)c3ccccc3O)c2c1	ZINC000875279694	FG	On-Demand	Clean	GHSR	46	39
COc1ccc2[nH]cc(CCNC(=O)N[C@@H](C)c3ccccc3O)c2c1	ZINC000875279694	FG	On-Demand	Clean	ABCG2	29	46
COc1cc(CNC(=O)C(=O)N[C@H](C)c2ccnn2C)c2ccccc2n1	ZINC000875279718	FD	On-Demand	Anodyne	ALS	41	31
COc1cc(CNC(=O)C(=O)N[C@H](C)c2ccnn2C)c2ccccc2n1	ZINC000875279718	FD	On-Demand	Anodyne	MT-CYB	41	31
COc1cc(CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)c2ccccc2n1	ZINC000875279719	FD	On-Demand	Anodyne	ALS	41	31
COc1cc(CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)c2ccccc2n1	ZINC000875279719	FD	On-Demand	Anodyne	MT-CYB	41	31
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H](N(C)C)[C@H](n4ccnn4)C3)c2c1	ZINC000875279728	GD	On-Demand	Anodyne	HTR1D	66	42
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H](N(C)C)[C@H](n4ccnn4)C3)c2c1	ZINC000875279728	GD	On-Demand	Anodyne	HTR1B	48	42
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H](N(C)C)[C@H](n4ccnn4)C3)c2c1	ZINC000875279728	GD	On-Demand	Anodyne	NQO2	26	51
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H](N(C)C)[C@H](n4ccnn4)C3)c2c1	ZINC000875279728	GD	On-Demand	Anodyne	MTNR1A	57	55
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H](N(C)C)[C@H](n4ccnn4)C3)c2c1	ZINC000875279728	GD	On-Demand	Anodyne	MTNR1B	42	51
COc1ccc2[nH]cc(CCNC(=O)N3CCC4(CCNC4=O)CC3)c2c1	ZINC000875279734	FE	On-Demand	Anodyne	HTR1A	19	48
COc1ccc2[nH]cc(CCNC(=O)N3CCC4(CCNC4=O)CC3)c2c1	ZINC000875279734	FE	On-Demand	Anodyne	HTR1D	59	45
COc1ccc2[nH]cc(CCNC(=O)N3CCC4(CCNC4=O)CC3)c2c1	ZINC000875279734	FE	On-Demand	Anodyne	HTR1B	47	45
COc1ccc2[nH]cc(CCNC(=O)N3CCC4(CCNC4=O)CC3)c2c1	ZINC000875279734	FE	On-Demand	Anodyne	NQO2	39	59
COc1ccc2[nH]cc(CCNC(=O)N3CCC4(CCNC4=O)CC3)c2c1	ZINC000875279734	FE	On-Demand	Anodyne	MPO	41	36
COc1ccc2[nH]cc(CCNC(=O)N3CCC4(CCNC4=O)CC3)c2c1	ZINC000875279734	FE	On-Demand	Anodyne	HTR1E	15	42
COc1ccc2[nH]cc(CCNC(=O)N3CCC4(CCNC4=O)CC3)c2c1	ZINC000875279734	FE	On-Demand	Anodyne	MTNR1A	96	60
COc1ccc2[nH]cc(CCNC(=O)N3CCC4(CCNC4=O)CC3)c2c1	ZINC000875279734	FE	On-Demand	Anodyne	MTNR1B	75	59
COc1ccc2[nH]cc(CCNC(=O)N3CCC4(CCNC4=O)CC3)c2c1	ZINC000875279734	FE	On-Demand	Anodyne	ABCG2	27	44
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](OC4CCC4)CC3)c2c1	ZINC000875279755	GH	On-Demand	Anodyne	HTR1A	23	49
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](OC4CCC4)CC3)c2c1	ZINC000875279755	GH	On-Demand	Anodyne	HTR1D	97	49
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](OC4CCC4)CC3)c2c1	ZINC000875279755	GH	On-Demand	Anodyne	HTR1B	80	49
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](OC4CCC4)CC3)c2c1	ZINC000875279755	GH	On-Demand	Anodyne	NQO2	37	59
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](OC4CCC4)CC3)c2c1	ZINC000875279755	GH	On-Demand	Anodyne	MPO	45	36
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](OC4CCC4)CC3)c2c1	ZINC000875279755	GH	On-Demand	Anodyne	HTR1E	20	40
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](OC4CCC4)CC3)c2c1	ZINC000875279755	GH	On-Demand	Anodyne	HTR6	16	43
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](OC4CCC4)CC3)c2c1	ZINC000875279755	GH	On-Demand	Anodyne	MTNR1A	102	60
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](OC4CCC4)CC3)c2c1	ZINC000875279755	GH	On-Demand	Anodyne	MTNR1B	81	59
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](OC4CCC4)CC3)c2c1	ZINC000875279755	GH	On-Demand	Anodyne	ABCG2	26	43
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](OC4CCC4)CC3)c2c1	ZINC000875279756	GH	On-Demand	Anodyne	HTR1A	23	49
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](OC4CCC4)CC3)c2c1	ZINC000875279756	GH	On-Demand	Anodyne	HTR1D	97	49
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](OC4CCC4)CC3)c2c1	ZINC000875279756	GH	On-Demand	Anodyne	HTR1B	80	49
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](OC4CCC4)CC3)c2c1	ZINC000875279756	GH	On-Demand	Anodyne	NQO2	37	59
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](OC4CCC4)CC3)c2c1	ZINC000875279756	GH	On-Demand	Anodyne	MPO	45	36
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](OC4CCC4)CC3)c2c1	ZINC000875279756	GH	On-Demand	Anodyne	HTR1E	20	40
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](OC4CCC4)CC3)c2c1	ZINC000875279756	GH	On-Demand	Anodyne	HTR6	16	43
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](OC4CCC4)CC3)c2c1	ZINC000875279756	GH	On-Demand	Anodyne	MTNR1A	102	60
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](OC4CCC4)CC3)c2c1	ZINC000875279756	GH	On-Demand	Anodyne	MTNR1B	81	59
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](OC4CCC4)CC3)c2c1	ZINC000875279756	GH	On-Demand	Anodyne	ABCG2	26	43
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccc(N2CCCCC2)nc1	ZINC000875279762	HH	On-Demand	Anodyne	MCHR1	16	42
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccc(N2CCCCC2)nc1	ZINC000875279762	HH	On-Demand	Anodyne	DGAT1	37	43
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1ccc(N2CCCCC2)nc1	ZINC000875279762	HH	On-Demand	Anodyne	SLC27A1	44	39
Cc1c(NC(=O)[C@H](C)OC(=O)CCCOc2ccc(F)cc2)cccc1[N+](=O)[O-]	ZINC000875279777	HH	On-Demand	Bother	COLA	43	40
Cc1c(NC(=O)[C@@H](C)OC(=O)CCCOc2ccc(F)cc2)cccc1[N+](=O)[O-]	ZINC000875279778	HH	On-Demand	Bother	COLA	43	40
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](Cc2ccccn2)c2ccccc2)CC1	ZINC000875279782	GE	On-Demand	Anodyne	CCR5	22	41
CC(=O)C1CCN(C(=O)C(=O)N[C@H](Cc2ccccn2)c2ccccc2)CC1	ZINC000875279783	GE	On-Demand	Anodyne	CCR5	22	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc(F)cc1	ZINC000875279790	GG	On-Demand	Anodyne	FKBP1A	47	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc(F)cc1	ZINC000875279791	GG	On-Demand	Anodyne	FKBP1A	47	38
O=C(CCCOC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875279803	GH	On-Demand	Anodyne	FKBP1A	86	48
O=C(CCCOC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875279803	GH	On-Demand	Anodyne	PREP	91	41
O=C(CCCOC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875279803	GH	On-Demand	Anodyne	CYP2J2	43	31
O=C(CCCOC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875279804	GH	On-Demand	Anodyne	FKBP1A	86	48
O=C(CCCOC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875279804	GH	On-Demand	Anodyne	PREP	91	41
O=C(CCCOC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875279804	GH	On-Demand	Anodyne	CYP2J2	43	31
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)NCCN1C(=O)CNC1=O	ZINC000875279819	GE	On-Demand	Anodyne	MDM2	109	34
C=CCC[C@H](NC(=O)C(=O)N(C)CCN1CC2(CCOCC2)C1)c1ccccc1	ZINC000875279826	GE	On-Demand	Mild	CASR	47	38
C=CCC[C@@H](NC(=O)C(=O)N(C)CCN1CC2(CCOCC2)C1)c1ccccc1	ZINC000875279827	GE	On-Demand	Mild	CASR	47	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(OCc2ccccc2)cc1	ZINC000875279851	JJ	On-Demand	Anodyne	FKBP1A	69	44
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(OCc2ccccc2)cc1	ZINC000875279851	JJ	On-Demand	Anodyne	LTA4H	51	47
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(OCc2ccccc2)cc1	ZINC000875279851	JJ	On-Demand	Anodyne	ADAM17	23	45
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(OCc2ccccc2)cc1	ZINC000875279851	JJ	On-Demand	Anodyne	CPT1A	70	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(OCc2ccccc2)cc1	ZINC000875279851	JJ	On-Demand	Anodyne	CPT2	44	33
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(OCc2ccccc2)cc1	ZINC000875279851	JJ	On-Demand	Anodyne	PREP	61	43
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(OCc2ccccc2)cc1	ZINC000875279851	JJ	On-Demand	Anodyne	NOS1	24	44
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(OCc2ccccc2)cc1	ZINC000875279851	JJ	On-Demand	Anodyne	KLK5	23	42
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(OCc2ccccc2)cc1	ZINC000875279852	JJ	On-Demand	Anodyne	FKBP1A	69	44
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(OCc2ccccc2)cc1	ZINC000875279852	JJ	On-Demand	Anodyne	LTA4H	51	47
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(OCc2ccccc2)cc1	ZINC000875279852	JJ	On-Demand	Anodyne	ADAM17	23	45
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(OCc2ccccc2)cc1	ZINC000875279852	JJ	On-Demand	Anodyne	CPT1A	70	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(OCc2ccccc2)cc1	ZINC000875279852	JJ	On-Demand	Anodyne	CPT2	44	33
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(OCc2ccccc2)cc1	ZINC000875279852	JJ	On-Demand	Anodyne	PREP	61	43
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(OCc2ccccc2)cc1	ZINC000875279852	JJ	On-Demand	Anodyne	NOS1	24	44
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(OCc2ccccc2)cc1	ZINC000875279852	JJ	On-Demand	Anodyne	KLK5	23	42
O=C(NC[C@@H]1OCCc2ccccc21)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875279863	FD	On-Demand	Anodyne	RBP4	49	38
O=C(NC[C@H]1OCCc2ccccc21)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875279864	FD	On-Demand	Anodyne	RBP4	49	38
CN1CCN(C2CCN(C(=O)NC[C@@H]3OCCc4ccccc43)CC2)CC1	ZINC000875279869	FD	On-Demand	Anodyne	SMO	26	45
CN1CCN(C2CCN(C(=O)NC[C@@H]3OCCc4ccccc43)CC2)CC1	ZINC000875279869	FD	On-Demand	Anodyne	L3MBTL3	60	39
CN1CCN(C2CCN(C(=O)NC[C@H]3OCCc4ccccc43)CC2)CC1	ZINC000875279870	FD	On-Demand	Anodyne	SMO	26	45
CN1CCN(C2CCN(C(=O)NC[C@H]3OCCc4ccccc43)CC2)CC1	ZINC000875279870	FD	On-Demand	Anodyne	L3MBTL3	60	39
O=C(OCc1c(F)cccc1Cl)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875279875	GI	On-Demand	Anodyne	FKBP1A	44	39
O=C(OCc1c(F)cccc1Cl)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875279875	GI	On-Demand	Anodyne	PREP	45	37
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1cccc(F)c1	ZINC000875279879	FH	On-Demand	Anodyne	EPHX2	17	41
O=C(OCc1c(F)cccc1Cl)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875279882	GI	On-Demand	Anodyne	FKBP1A	44	39
O=C(OCc1c(F)cccc1Cl)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875279882	GI	On-Demand	Anodyne	PREP	45	37
O=C(NCCCCC1CC1)C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000875279916	FE	On-Demand	Anodyne	CACNA1I	45	35
O=C(NCCCCC1CC1)C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000875279916	FE	On-Demand	Anodyne	SIRT3	41	34
O=C(NCCCCC1CC1)C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000875279916	FE	On-Demand	Anodyne	SIRT1	40	34
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](C(C)(C)O)C3)c2c1	ZINC000875279919	FF	On-Demand	Anodyne	HTR1A	26	49
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](C(C)(C)O)C3)c2c1	ZINC000875279919	FF	On-Demand	Anodyne	ACHE	17	43
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](C(C)(C)O)C3)c2c1	ZINC000875279919	FF	On-Demand	Anodyne	HTR1D	99	49
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](C(C)(C)O)C3)c2c1	ZINC000875279919	FF	On-Demand	Anodyne	HTR1B	81	49
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](C(C)(C)O)C3)c2c1	ZINC000875279919	FF	On-Demand	Anodyne	SSTR2	54	37
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](C(C)(C)O)C3)c2c1	ZINC000875279919	FF	On-Demand	Anodyne	SLC6A4	15	48
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](C(C)(C)O)C3)c2c1	ZINC000875279919	FF	On-Demand	Anodyne	NQO2	41	59
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](C(C)(C)O)C3)c2c1	ZINC000875279919	FF	On-Demand	Anodyne	MPO	49	36
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](C(C)(C)O)C3)c2c1	ZINC000875279919	FF	On-Demand	Anodyne	HTR1E	20	40
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](C(C)(C)O)C3)c2c1	ZINC000875279919	FF	On-Demand	Anodyne	HTR6	17	41
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](C(C)(C)O)C3)c2c1	ZINC000875279919	FF	On-Demand	Anodyne	MTNR1A	108	60
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](C(C)(C)O)C3)c2c1	ZINC000875279919	FF	On-Demand	Anodyne	MTNR1B	88	59
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@H](C(C)(C)O)C3)c2c1	ZINC000875279919	FF	On-Demand	Anodyne	ABCG2	27	44
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](C(C)(C)O)C3)c2c1	ZINC000875279920	FF	On-Demand	Anodyne	HTR1A	26	49
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](C(C)(C)O)C3)c2c1	ZINC000875279920	FF	On-Demand	Anodyne	ACHE	17	43
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](C(C)(C)O)C3)c2c1	ZINC000875279920	FF	On-Demand	Anodyne	HTR1D	99	49
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](C(C)(C)O)C3)c2c1	ZINC000875279920	FF	On-Demand	Anodyne	HTR1B	81	49
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](C(C)(C)O)C3)c2c1	ZINC000875279920	FF	On-Demand	Anodyne	SSTR2	54	37
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](C(C)(C)O)C3)c2c1	ZINC000875279920	FF	On-Demand	Anodyne	SLC6A4	15	48
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](C(C)(C)O)C3)c2c1	ZINC000875279920	FF	On-Demand	Anodyne	NQO2	41	59
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](C(C)(C)O)C3)c2c1	ZINC000875279920	FF	On-Demand	Anodyne	MPO	49	36
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](C(C)(C)O)C3)c2c1	ZINC000875279920	FF	On-Demand	Anodyne	HTR1E	20	40
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](C(C)(C)O)C3)c2c1	ZINC000875279920	FF	On-Demand	Anodyne	HTR6	17	41
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](C(C)(C)O)C3)c2c1	ZINC000875279920	FF	On-Demand	Anodyne	MTNR1A	108	60
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](C(C)(C)O)C3)c2c1	ZINC000875279920	FF	On-Demand	Anodyne	MTNR1B	88	59
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H](C(C)(C)O)C3)c2c1	ZINC000875279920	FF	On-Demand	Anodyne	ABCG2	27	44
O=C(OCc1ccccc1Cl)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875279939	FI	On-Demand	Anodyne	FKBP1A	68	44
O=C(OCc1ccccc1Cl)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875279939	FI	On-Demand	Anodyne	PREP	66	38
COc1ccc2[nH]cc(CCNC(=O)N(C)OCC(F)(F)F)c2c1	ZINC000875279940	EF	On-Demand	Anodyne	HTR1A	22	53
COc1ccc2[nH]cc(CCNC(=O)N(C)OCC(F)(F)F)c2c1	ZINC000875279940	EF	On-Demand	Anodyne	HTR1D	54	53
COc1ccc2[nH]cc(CCNC(=O)N(C)OCC(F)(F)F)c2c1	ZINC000875279940	EF	On-Demand	Anodyne	HTR1B	35	53
COc1ccc2[nH]cc(CCNC(=O)N(C)OCC(F)(F)F)c2c1	ZINC000875279940	EF	On-Demand	Anodyne	SLC6A4	15	45
COc1ccc2[nH]cc(CCNC(=O)N(C)OCC(F)(F)F)c2c1	ZINC000875279940	EF	On-Demand	Anodyne	NQO2	38	65
COc1ccc2[nH]cc(CCNC(=O)N(C)OCC(F)(F)F)c2c1	ZINC000875279940	EF	On-Demand	Anodyne	MPO	84	44
COc1ccc2[nH]cc(CCNC(=O)N(C)OCC(F)(F)F)c2c1	ZINC000875279940	EF	On-Demand	Anodyne	HTR1E	23	45
COc1ccc2[nH]cc(CCNC(=O)N(C)OCC(F)(F)F)c2c1	ZINC000875279940	EF	On-Demand	Anodyne	MTNR1A	105	69
COc1ccc2[nH]cc(CCNC(=O)N(C)OCC(F)(F)F)c2c1	ZINC000875279940	EF	On-Demand	Anodyne	MTNR1B	80	65
COc1ccc2[nH]cc(CCNC(=O)N(C)OCC(F)(F)F)c2c1	ZINC000875279940	EF	On-Demand	Anodyne	ABCG2	28	45
O=C(OCc1ccccc1Cl)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875279941	FI	On-Demand	Anodyne	FKBP1A	68	44
O=C(OCc1ccccc1Cl)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875279941	FI	On-Demand	Anodyne	PREP	66	38
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)c1nnc(-c2ccccc2)o1	ZINC000875279951	FI	On-Demand	Anodyne	PPARG	68	42
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)c1nnc(-c2ccccc2)o1	ZINC000875279951	FI	On-Demand	Anodyne	PPARA	75	45
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(F)c(Cl)c1	ZINC000875279962	HH	On-Demand	Anodyne	NOS1	43	37
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(F)c(Cl)c1	ZINC000875279962	HH	On-Demand	Anodyne	MCHR1	28	40
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4CSC[C@@H]4C3)c2c1	ZINC000875279965	FG	On-Demand	Anodyne	HTR1A	21	49
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4CSC[C@@H]4C3)c2c1	ZINC000875279965	FG	On-Demand	Anodyne	HTR1D	89	49
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4CSC[C@@H]4C3)c2c1	ZINC000875279965	FG	On-Demand	Anodyne	HTR1B	74	49
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4CSC[C@@H]4C3)c2c1	ZINC000875279965	FG	On-Demand	Anodyne	NQO2	37	58
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4CSC[C@@H]4C3)c2c1	ZINC000875279965	FG	On-Demand	Anodyne	MPO	43	35
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4CSC[C@@H]4C3)c2c1	ZINC000875279965	FG	On-Demand	Anodyne	MTNR1A	92	59
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4CSC[C@@H]4C3)c2c1	ZINC000875279965	FG	On-Demand	Anodyne	MTNR1B	70	58
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4CSC[C@@H]4C3)c2c1	ZINC000875279965	FG	On-Demand	Anodyne	ABCG2	25	42
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4CSC[C@@H]4C3)c2c1	ZINC000875279966	FG	On-Demand	Anodyne	HTR1A	21	49
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4CSC[C@@H]4C3)c2c1	ZINC000875279966	FG	On-Demand	Anodyne	HTR1D	89	49
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4CSC[C@@H]4C3)c2c1	ZINC000875279966	FG	On-Demand	Anodyne	HTR1B	74	49
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4CSC[C@@H]4C3)c2c1	ZINC000875279966	FG	On-Demand	Anodyne	NQO2	37	58
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4CSC[C@@H]4C3)c2c1	ZINC000875279966	FG	On-Demand	Anodyne	MPO	43	35
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4CSC[C@@H]4C3)c2c1	ZINC000875279966	FG	On-Demand	Anodyne	MTNR1A	92	59
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4CSC[C@@H]4C3)c2c1	ZINC000875279966	FG	On-Demand	Anodyne	MTNR1B	70	58
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4CSC[C@@H]4C3)c2c1	ZINC000875279966	FG	On-Demand	Anodyne	ABCG2	25	42
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4CSC[C@H]4C3)c2c1	ZINC000875279967	FG	On-Demand	Anodyne	HTR1A	21	49
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4CSC[C@H]4C3)c2c1	ZINC000875279967	FG	On-Demand	Anodyne	HTR1D	89	49
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4CSC[C@H]4C3)c2c1	ZINC000875279967	FG	On-Demand	Anodyne	HTR1B	74	49
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4CSC[C@H]4C3)c2c1	ZINC000875279967	FG	On-Demand	Anodyne	NQO2	37	58
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4CSC[C@H]4C3)c2c1	ZINC000875279967	FG	On-Demand	Anodyne	MPO	43	35
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4CSC[C@H]4C3)c2c1	ZINC000875279967	FG	On-Demand	Anodyne	MTNR1A	92	59
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4CSC[C@H]4C3)c2c1	ZINC000875279967	FG	On-Demand	Anodyne	MTNR1B	70	58
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H]4CSC[C@H]4C3)c2c1	ZINC000875279967	FG	On-Demand	Anodyne	ABCG2	25	42
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4CSC[C@H]4C3)c2c1	ZINC000875279968	FG	On-Demand	Anodyne	HTR1A	21	49
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4CSC[C@H]4C3)c2c1	ZINC000875279968	FG	On-Demand	Anodyne	HTR1D	89	49
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4CSC[C@H]4C3)c2c1	ZINC000875279968	FG	On-Demand	Anodyne	HTR1B	74	49
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4CSC[C@H]4C3)c2c1	ZINC000875279968	FG	On-Demand	Anodyne	NQO2	37	58
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4CSC[C@H]4C3)c2c1	ZINC000875279968	FG	On-Demand	Anodyne	MPO	43	35
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4CSC[C@H]4C3)c2c1	ZINC000875279968	FG	On-Demand	Anodyne	MTNR1A	92	59
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4CSC[C@H]4C3)c2c1	ZINC000875279968	FG	On-Demand	Anodyne	MTNR1B	70	58
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H]4CSC[C@H]4C3)c2c1	ZINC000875279968	FG	On-Demand	Anodyne	ABCG2	25	42
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(F)c(Cl)c1	ZINC000875279972	HH	On-Demand	Anodyne	NOS1	43	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(F)c(Cl)c1	ZINC000875279972	HH	On-Demand	Anodyne	MCHR1	28	40
O=C(OCc1ccc(Cl)cc1Cl)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875279974	GJ	On-Demand	Anodyne	FKBP1A	49	39
O=C(OCc1ccc(Cl)cc1Cl)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875279974	GJ	On-Demand	Anodyne	PREP	45	34
CONC(=O)C1CCN(C(=O)NC[C@@H]2OCCc3ccccc32)CC1	ZINC000875279977	ED	On-Demand	Anodyne	SMO	17	40
O=C(OCc1ccc(Cl)cc1Cl)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875279978	GJ	On-Demand	Anodyne	FKBP1A	49	39
O=C(OCc1ccc(Cl)cc1Cl)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875279978	GJ	On-Demand	Anodyne	PREP	45	34
CONC(=O)C1CCN(C(=O)NC[C@H]2OCCc3ccccc32)CC1	ZINC000875279979	ED	On-Demand	Anodyne	SMO	17	40
COCC(C)(C)CCNC(=O)C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000875279980	GD	On-Demand	Anodyne	CACNA1I	56	37
COc1ccc(-c2noc(COC(=O)CCCOc3ccc(F)cc3)n2)cc1	ZINC000875280011	GH	On-Demand	Anodyne	TPSAB1	43	36
COc1ccc(-c2noc(COC(=O)CCCOc3ccc(F)cc3)n2)cc1	ZINC000875280011	GH	On-Demand	Anodyne	LUCI_PHOPE	21	41
O=C(NCC1CCSCC1)NC1CC(Nc2ccccc2)C1	ZINC000875280021	DG	On-Demand	Anodyne	EPHX2	20	40
COc1ccc2[nH]cc(CCNC(=O)N3CC(CNC(=O)C(F)(F)F)C3)c2c1	ZINC000875280044	GE	On-Demand	Anodyne	HTR1A	20	47
COc1ccc2[nH]cc(CCNC(=O)N3CC(CNC(=O)C(F)(F)F)C3)c2c1	ZINC000875280044	GE	On-Demand	Anodyne	HTR1D	57	44
COc1ccc2[nH]cc(CCNC(=O)N3CC(CNC(=O)C(F)(F)F)C3)c2c1	ZINC000875280044	GE	On-Demand	Anodyne	HTR1B	45	44
COc1ccc2[nH]cc(CCNC(=O)N3CC(CNC(=O)C(F)(F)F)C3)c2c1	ZINC000875280044	GE	On-Demand	Anodyne	NQO2	35	57
COc1ccc2[nH]cc(CCNC(=O)N3CC(CNC(=O)C(F)(F)F)C3)c2c1	ZINC000875280044	GE	On-Demand	Anodyne	MPO	56	37
COc1ccc2[nH]cc(CCNC(=O)N3CC(CNC(=O)C(F)(F)F)C3)c2c1	ZINC000875280044	GE	On-Demand	Anodyne	MTNR1A	91	72
COc1ccc2[nH]cc(CCNC(=O)N3CC(CNC(=O)C(F)(F)F)C3)c2c1	ZINC000875280044	GE	On-Demand	Anodyne	MTNR1B	71	57
COc1ccc2[nH]cc(CCNC(=O)N3CC(CNC(=O)C(F)(F)F)C3)c2c1	ZINC000875280044	GE	On-Demand	Anodyne	ABCG2	26	43
O=C(OCc1ccc(Br)cc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280048	HI	On-Demand	Anodyne	FKBP1A	79	47
O=C(OCc1ccc(Br)cc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280048	HI	On-Demand	Anodyne	PREP	70	42
O=C(OCc1ccc(Br)cc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280048	HI	On-Demand	Anodyne	LGMN	68	42
O=C(OCc1ccc(Br)cc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280049	HI	On-Demand	Anodyne	FKBP1A	79	47
O=C(OCc1ccc(Br)cc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280049	HI	On-Demand	Anodyne	PREP	70	42
O=C(OCc1ccc(Br)cc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280049	HI	On-Demand	Anodyne	LGMN	68	42
N#Cc1ccc(N2CC[C@H](OC(=O)CCCOc3ccc(F)cc3)C2=O)cc1	ZINC000875280057	GG	On-Demand	Mild	MEN1	41	41
N#Cc1ccc(N2CC[C@@H](OC(=O)CCCOc3ccc(F)cc3)C2=O)cc1	ZINC000875280058	GG	On-Demand	Mild	MEN1	41	41
O=C(CCCOC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc(Br)cc1	ZINC000875280059	JJ	On-Demand	Anodyne	FKBP1A	69	43
O=C(CCCOC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc(Br)cc1	ZINC000875280059	JJ	On-Demand	Anodyne	PREP	41	34
O=C(CCCOC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc(Br)cc1	ZINC000875280060	JJ	On-Demand	Anodyne	FKBP1A	69	43
O=C(CCCOC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc(Br)cc1	ZINC000875280060	JJ	On-Demand	Anodyne	PREP	41	34
C=CCC[C@@H](NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1)c1ccccc1	ZINC000875280062	FG	On-Demand	Mild	UTS2	43	35
C=CCC[C@H](NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1)c1ccccc1	ZINC000875280063	FG	On-Demand	Mild	UTS2	43	35
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc(Cl)cc1	ZINC000875280064	GH	On-Demand	Anodyne	FKBP1A	46	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc(Cl)cc1	ZINC000875280065	GH	On-Demand	Anodyne	FKBP1A	46	38
CN(C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875280070	GF	On-Demand	Anodyne	FKBP1A	74	41
CN(C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875280070	GF	On-Demand	Anodyne	CPT1A	58	37
CN(C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875280070	GF	On-Demand	Anodyne	PREP	65	36
O=C(NCC[C@H]1CCSC1)C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000875280077	GD	On-Demand	Anodyne	SIRT3	43	36
O=C(NCC[C@H]1CCSC1)C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000875280077	GD	On-Demand	Anodyne	SIRT2	46	32
O=C(NCC[C@H]1CCSC1)C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000875280077	GD	On-Demand	Anodyne	SIRT1	42	36
O=C(NCC[C@@H]1CCSC1)C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000875280078	GD	On-Demand	Anodyne	SIRT3	43	36
O=C(NCC[C@@H]1CCSC1)C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000875280078	GD	On-Demand	Anodyne	SIRT2	46	32
O=C(NCC[C@@H]1CCSC1)C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000875280078	GD	On-Demand	Anodyne	SIRT1	42	36
Cc1cnc(CNC(=O)C(=O)NCCCCCCc2ccccc2)s1	ZINC000875280109	FF	On-Demand	Anodyne	FAAH	74	41
Cc1cnc(CNC(=O)C(=O)NCCCCCCc2ccccc2)s1	ZINC000875280109	FF	On-Demand	Anodyne	CES1	69	38
Cc1cnc(CNC(=O)C(=O)NCCCCCCc2ccccc2)s1	ZINC000875280109	FF	On-Demand	Anodyne	AMP1_PLAFQ	27	44
Cc1cnc(CNC(=O)C(=O)NCCCCCCc2ccccc2)s1	ZINC000875280109	FF	On-Demand	Anodyne	CES1D	55	34
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000875280119	HI	On-Demand	Anodyne	KCNQ2	17	43
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000875280119	HI	On-Demand	Anodyne	EPHX2	21	40
COc1ccc2[nH]cc(CCNC(=O)N3CCN(C)C(C)(C)CC3)c2c1	ZINC000875280134	FF	On-Demand	Anodyne	HTR1A	23	50
COc1ccc2[nH]cc(CCNC(=O)N3CCN(C)C(C)(C)CC3)c2c1	ZINC000875280134	FF	On-Demand	Anodyne	HTR1D	80	45
COc1ccc2[nH]cc(CCNC(=O)N3CCN(C)C(C)(C)CC3)c2c1	ZINC000875280134	FF	On-Demand	Anodyne	HTR1B	66	45
COc1ccc2[nH]cc(CCNC(=O)N3CCN(C)C(C)(C)CC3)c2c1	ZINC000875280134	FF	On-Demand	Anodyne	NQO2	35	59
COc1ccc2[nH]cc(CCNC(=O)N3CCN(C)C(C)(C)CC3)c2c1	ZINC000875280134	FF	On-Demand	Anodyne	MPO	44	37
COc1ccc2[nH]cc(CCNC(=O)N3CCN(C)C(C)(C)CC3)c2c1	ZINC000875280134	FF	On-Demand	Anodyne	HTR1E	21	42
COc1ccc2[nH]cc(CCNC(=O)N3CCN(C)C(C)(C)CC3)c2c1	ZINC000875280134	FF	On-Demand	Anodyne	HTR5A	19	40
COc1ccc2[nH]cc(CCNC(=O)N3CCN(C)C(C)(C)CC3)c2c1	ZINC000875280134	FF	On-Demand	Anodyne	MTNR1A	92	60
COc1ccc2[nH]cc(CCNC(=O)N3CCN(C)C(C)(C)CC3)c2c1	ZINC000875280134	FF	On-Demand	Anodyne	MTNR1B	73	59
COc1ccc2[nH]cc(CCNC(=O)N3CCN(C)C(C)(C)CC3)c2c1	ZINC000875280134	FF	On-Demand	Anodyne	ABCG2	26	43
C[C@@H](NC1(CNC(=O)N2CCCN(C=O)CC2)CCCC1)c1ccccc1	ZINC000875280160	FF	On-Demand	Anodyne	SMO	15	41
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H]4[C@H](O)C(C)(C)[C@@H]43)c2c1	ZINC000875280161	FF	On-Demand	Anodyne	HTR1A	21	47
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H]4[C@H](O)C(C)(C)[C@@H]43)c2c1	ZINC000875280161	FF	On-Demand	Anodyne	HTR1D	78	46
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H]4[C@H](O)C(C)(C)[C@@H]43)c2c1	ZINC000875280161	FF	On-Demand	Anodyne	HTR1B	65	46
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H]4[C@H](O)C(C)(C)[C@@H]43)c2c1	ZINC000875280161	FF	On-Demand	Anodyne	NQO2	32	56
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H]4[C@H](O)C(C)(C)[C@@H]43)c2c1	ZINC000875280161	FF	On-Demand	Anodyne	MPO	41	36
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H]4[C@H](O)C(C)(C)[C@@H]43)c2c1	ZINC000875280161	FF	On-Demand	Anodyne	MTNR1A	81	56
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H]4[C@H](O)C(C)(C)[C@@H]43)c2c1	ZINC000875280161	FF	On-Demand	Anodyne	MTNR1B	63	56
COc1ccc2[nH]cc(CCNC(=O)N3CCC[C@@H]4[C@H](O)C(C)(C)[C@@H]43)c2c1	ZINC000875280161	FF	On-Demand	Anodyne	ABCG2	26	42
C[C@H](NC1(CNC(=O)N2CCCN(C=O)CC2)CCCC1)c1ccccc1	ZINC000875280162	FF	On-Demand	Anodyne	SMO	15	41
COC(=O)[C@@]12C[C@@H](NC(=O)NCCc3c[nH]c4ccc(OC)cc34)C[C@@H]1C2	ZINC000875280166	FE	On-Demand	Anodyne	HTR1D	37	44
COC(=O)[C@@]12C[C@@H](NC(=O)NCCc3c[nH]c4ccc(OC)cc34)C[C@@H]1C2	ZINC000875280166	FE	On-Demand	Anodyne	HTR1B	31	43
COC(=O)[C@@]12C[C@@H](NC(=O)NCCc3c[nH]c4ccc(OC)cc34)C[C@@H]1C2	ZINC000875280166	FE	On-Demand	Anodyne	NQO2	31	41
COC(=O)[C@@]12C[C@@H](NC(=O)NCCc3c[nH]c4ccc(OC)cc34)C[C@@H]1C2	ZINC000875280166	FE	On-Demand	Anodyne	MTNR1A	82	64
COC(=O)[C@@]12C[C@@H](NC(=O)NCCc3c[nH]c4ccc(OC)cc34)C[C@@H]1C2	ZINC000875280166	FE	On-Demand	Anodyne	MTNR1B	62	57
COC(=O)[C@@]12C[C@@H](NC(=O)NCCc3c[nH]c4ccc(OC)cc34)C[C@@H]1C2	ZINC000875280166	FE	On-Demand	Anodyne	ABCG2	26	43
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](C(F)(F)F)O[C@H](C)C3)c2c1	ZINC000875280179	GG	On-Demand	Anodyne	HTR1A	19	43
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](C(F)(F)F)O[C@H](C)C3)c2c1	ZINC000875280179	GG	On-Demand	Anodyne	HTR1D	70	42
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](C(F)(F)F)O[C@H](C)C3)c2c1	ZINC000875280179	GG	On-Demand	Anodyne	HTR1B	57	42
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](C(F)(F)F)O[C@H](C)C3)c2c1	ZINC000875280179	GG	On-Demand	Anodyne	NQO2	33	54
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](C(F)(F)F)O[C@H](C)C3)c2c1	ZINC000875280179	GG	On-Demand	Anodyne	MPO	42	35
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](C(F)(F)F)O[C@H](C)C3)c2c1	ZINC000875280179	GG	On-Demand	Anodyne	MTNR1A	75	58
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](C(F)(F)F)O[C@H](C)C3)c2c1	ZINC000875280179	GG	On-Demand	Anodyne	MTNR1B	58	54
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](C(F)(F)F)O[C@H](C)C3)c2c1	ZINC000875280179	GG	On-Demand	Anodyne	ABCG2	25	41
O=C(NCC1CCSCC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875280180	EG	On-Demand	Anodyne	CCR3	26	45
O=C(NCC1CCSCC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875280180	EG	On-Demand	Anodyne	EPHX2	36	53
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](C(F)(F)F)O[C@@H](C)C3)c2c1	ZINC000875280182	GG	On-Demand	Anodyne	HTR1A	19	43
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](C(F)(F)F)O[C@@H](C)C3)c2c1	ZINC000875280182	GG	On-Demand	Anodyne	HTR1D	70	42
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](C(F)(F)F)O[C@@H](C)C3)c2c1	ZINC000875280182	GG	On-Demand	Anodyne	HTR1B	57	42
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](C(F)(F)F)O[C@@H](C)C3)c2c1	ZINC000875280182	GG	On-Demand	Anodyne	NQO2	33	54
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](C(F)(F)F)O[C@@H](C)C3)c2c1	ZINC000875280182	GG	On-Demand	Anodyne	MPO	42	35
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](C(F)(F)F)O[C@@H](C)C3)c2c1	ZINC000875280182	GG	On-Demand	Anodyne	MTNR1A	75	58
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](C(F)(F)F)O[C@@H](C)C3)c2c1	ZINC000875280182	GG	On-Demand	Anodyne	MTNR1B	58	54
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](C(F)(F)F)O[C@@H](C)C3)c2c1	ZINC000875280182	GG	On-Demand	Anodyne	ABCG2	25	41
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](C(F)(F)F)O[C@H](C)C3)c2c1	ZINC000875280183	GG	On-Demand	Anodyne	HTR1A	19	43
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](C(F)(F)F)O[C@H](C)C3)c2c1	ZINC000875280183	GG	On-Demand	Anodyne	HTR1D	70	42
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](C(F)(F)F)O[C@H](C)C3)c2c1	ZINC000875280183	GG	On-Demand	Anodyne	HTR1B	57	42
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](C(F)(F)F)O[C@H](C)C3)c2c1	ZINC000875280183	GG	On-Demand	Anodyne	NQO2	33	54
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](C(F)(F)F)O[C@H](C)C3)c2c1	ZINC000875280183	GG	On-Demand	Anodyne	MPO	42	35
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](C(F)(F)F)O[C@H](C)C3)c2c1	ZINC000875280183	GG	On-Demand	Anodyne	MTNR1A	75	58
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](C(F)(F)F)O[C@H](C)C3)c2c1	ZINC000875280183	GG	On-Demand	Anodyne	MTNR1B	58	54
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](C(F)(F)F)O[C@H](C)C3)c2c1	ZINC000875280183	GG	On-Demand	Anodyne	ABCG2	25	41
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](C(F)(F)F)O[C@@H](C)C3)c2c1	ZINC000875280185	GG	On-Demand	Anodyne	HTR1A	19	43
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](C(F)(F)F)O[C@@H](C)C3)c2c1	ZINC000875280185	GG	On-Demand	Anodyne	HTR1D	70	42
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](C(F)(F)F)O[C@@H](C)C3)c2c1	ZINC000875280185	GG	On-Demand	Anodyne	HTR1B	57	42
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](C(F)(F)F)O[C@@H](C)C3)c2c1	ZINC000875280185	GG	On-Demand	Anodyne	NQO2	33	54
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](C(F)(F)F)O[C@@H](C)C3)c2c1	ZINC000875280185	GG	On-Demand	Anodyne	MPO	42	35
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](C(F)(F)F)O[C@@H](C)C3)c2c1	ZINC000875280185	GG	On-Demand	Anodyne	MTNR1A	75	58
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](C(F)(F)F)O[C@@H](C)C3)c2c1	ZINC000875280185	GG	On-Demand	Anodyne	MTNR1B	58	54
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](C(F)(F)F)O[C@@H](C)C3)c2c1	ZINC000875280185	GG	On-Demand	Anodyne	ABCG2	25	41
Cc1cc(COC(=O)CCCOc2ccc(F)cc2)no1	ZINC000875280201	CG	On-Demand	Anodyne	PPARA	17	40
CC[C@H](C[C@H](C)O)NC(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875280219	EF	On-Demand	Anodyne	HTR1D	35	48
CC[C@H](C[C@H](C)O)NC(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875280219	EF	On-Demand	Anodyne	HTR1B	32	48
CC[C@H](C[C@H](C)O)NC(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875280219	EF	On-Demand	Anodyne	NQO2	36	64
CC[C@H](C[C@H](C)O)NC(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875280219	EF	On-Demand	Anodyne	MPO	52	38
CC[C@H](C[C@H](C)O)NC(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875280219	EF	On-Demand	Anodyne	HTR1E	22	44
CC[C@H](C[C@H](C)O)NC(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875280219	EF	On-Demand	Anodyne	MTNR1A	112	71
CC[C@H](C[C@H](C)O)NC(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875280219	EF	On-Demand	Anodyne	MTNR1B	84	64
CC[C@H](C[C@H](C)O)NC(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875280219	EF	On-Demand	Anodyne	GRPR	54	31
CC[C@H](C[C@H](C)O)NC(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875280219	EF	On-Demand	Anodyne	ABCG2	28	47
CN1CCN(C(=O)NC[C@@H]2OCCc3ccccc32)CCC1(C)C	ZINC000875280231	EE	On-Demand	Anodyne	SMO	18	41
CN1CCN(C(=O)NC[C@H]2OCCc3ccccc32)CCC1(C)C	ZINC000875280232	EE	On-Demand	Anodyne	SMO	18	41
COc1ccc2[nH]cc(CCNC(=O)NCc3ccc(N(C)C(C)=O)cc3)c2c1	ZINC000875280234	GG	On-Demand	Anodyne	HTR1D	52	54
COc1ccc2[nH]cc(CCNC(=O)NCc3ccc(N(C)C(C)=O)cc3)c2c1	ZINC000875280234	GG	On-Demand	Anodyne	HTR1B	35	54
COc1ccc2[nH]cc(CCNC(=O)NCc3ccc(N(C)C(C)=O)cc3)c2c1	ZINC000875280234	GG	On-Demand	Anodyne	NQO2	34	63
COc1ccc2[nH]cc(CCNC(=O)NCc3ccc(N(C)C(C)=O)cc3)c2c1	ZINC000875280234	GG	On-Demand	Anodyne	MPO	44	37
COc1ccc2[nH]cc(CCNC(=O)NCc3ccc(N(C)C(C)=O)cc3)c2c1	ZINC000875280234	GG	On-Demand	Anodyne	HTR1E	21	42
COc1ccc2[nH]cc(CCNC(=O)NCc3ccc(N(C)C(C)=O)cc3)c2c1	ZINC000875280234	GG	On-Demand	Anodyne	MTNR1A	104	70
COc1ccc2[nH]cc(CCNC(=O)NCc3ccc(N(C)C(C)=O)cc3)c2c1	ZINC000875280234	GG	On-Demand	Anodyne	MTNR1B	79	63
COc1ccc2[nH]cc(CCNC(=O)NCc3ccc(N(C)C(C)=O)cc3)c2c1	ZINC000875280234	GG	On-Demand	Anodyne	ABCG2	29	47
C[C@H](NC(C)(C)CNC(=O)N1CCC2(CCNC2=O)CC1)c1ccccc1	ZINC000875280273	FE	On-Demand	Anodyne	GHRHR	56	31
C[C@@H](NC(C)(C)CNC(=O)N1CCC2(CCNC2=O)CC1)c1ccccc1	ZINC000875280274	FE	On-Demand	Anodyne	GHRHR	56	31
C[C@@]1(CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CCOC1	ZINC000875280276	EE	On-Demand	Mild	ITK	17	49
C[C@@]1(CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CCOC1	ZINC000875280276	EE	On-Demand	Mild	PANC	49	36
COc1ccc(C)cc1NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280279	HG	On-Demand	Anodyne	FKBP1A	71	40
COc1ccc(C)cc1NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280280	HG	On-Demand	Anodyne	FKBP1A	71	40
O=C(OCc1ccc(Cl)cc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280281	FI	On-Demand	Anodyne	FKBP1A	70	47
O=C(OCc1ccc(Cl)cc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280281	FI	On-Demand	Anodyne	PREP	71	41
O=C(OCc1ccc(Cl)cc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280281	FI	On-Demand	Anodyne	LGMN	67	40
O=C(OCc1ccc(Cl)cc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280282	FI	On-Demand	Anodyne	FKBP1A	70	47
O=C(OCc1ccc(Cl)cc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280282	FI	On-Demand	Anodyne	PREP	71	41
O=C(OCc1ccc(Cl)cc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280282	FI	On-Demand	Anodyne	LGMN	67	40
COC(=O)c1ccc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875280297	GG	On-Demand	Anodyne	FKBP1A	89	48
COC(=O)c1ccc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875280297	GG	On-Demand	Anodyne	PREP	62	42
COC(=O)c1ccc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875280297	GG	On-Demand	Anodyne	LGMN	69	35
CC(C)c1noc(COC(=O)CCCOc2ccc(F)cc2)n1	ZINC000875280306	DG	On-Demand	Anodyne	TPSAB1	54	37
C[C@@H](NC1(CNC(=O)N2CCC(CO)(CO)CC2)CCCC1)c1ccccc1	ZINC000875280309	GE	On-Demand	Anodyne	SMO	17	42
C[C@H](NC1(CNC(=O)N2CCC(CO)(CO)CC2)CCCC1)c1ccccc1	ZINC000875280310	GE	On-Demand	Anodyne	SMO	17	42
O=C(NCC1CCSCC1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875280311	ED	On-Demand	Anodyne	CACNA1I	40	35
O=C(NCC1CCSCC1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875280312	ED	On-Demand	Anodyne	CACNA1I	40	35
O=C(NCC1CCSCC1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875280313	ED	On-Demand	Anodyne	CACNA1I	40	35
O=C(NCC1CCSCC1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875280314	ED	On-Demand	Anodyne	CACNA1I	40	35
CSc1ccc(NC(=O)[C@H](C)OC(=O)CCCOc2ccc(F)cc2)cc1	ZINC000875280338	GI	On-Demand	Anodyne	FAAH	17	41
CSc1ccc(NC(=O)[C@@H](C)OC(=O)CCCOc2ccc(F)cc2)cc1	ZINC000875280339	GI	On-Demand	Anodyne	FAAH	17	41
O=C(NCC1CCSCC1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875280340	EG	On-Demand	Anodyne	OXTR	47	38
O=C(NCC1CCSCC1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875280340	EG	On-Demand	Anodyne	SLC18A3	15	40
O=C(NCC1CCSCC1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875280341	EG	On-Demand	Anodyne	OXTR	47	38
O=C(NCC1CCSCC1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875280341	EG	On-Demand	Anodyne	SLC18A3	15	40
CC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280351	CD	On-Demand	Anodyne	FKBP1A	84	42
CC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280351	CD	On-Demand	Anodyne	CPT2	43	33
CC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280351	CD	On-Demand	Anodyne	PREP	76	39
CC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280352	CD	On-Demand	Anodyne	FKBP1A	84	42
CC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280352	CD	On-Demand	Anodyne	CPT2	43	33
CC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280352	CD	On-Demand	Anodyne	PREP	76	39
CCOC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280357	ED	On-Demand	Anodyne	FKBP1A	78	42
CCOC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280357	ED	On-Demand	Anodyne	CPT1A	43	36
CCOC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280357	ED	On-Demand	Anodyne	PREP	69	38
CCOC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280358	ED	On-Demand	Anodyne	FKBP1A	78	42
CCOC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280358	ED	On-Demand	Anodyne	CPT1A	43	36
CCOC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280358	ED	On-Demand	Anodyne	PREP	69	38
O=C(CCCOc1ccc(F)cc1)OCc1cc(-c2ccccc2)on1	ZINC000875280359	FI	On-Demand	Anodyne	PPARG	53	38
O=C(CCCOc1ccc(F)cc1)OCc1cc(-c2ccccc2)on1	ZINC000875280359	FI	On-Demand	Anodyne	PPARA	54	42
O=C(CCCOc1ccc(F)cc1)OCc1cc(-c2ccccc2)on1	ZINC000875280359	FI	On-Demand	Anodyne	PPARD	20	41
COc1ccc2[nH]cc(CCNC(=O)N3[C@H]4CC[C@H]3CC(CCO)C4)c2c1	ZINC000875280388	FG	On-Demand	Anodyne	HTR1A	18	45
COc1ccc2[nH]cc(CCNC(=O)N3[C@H]4CC[C@H]3CC(CCO)C4)c2c1	ZINC000875280388	FG	On-Demand	Anodyne	HTR1D	64	44
COc1ccc2[nH]cc(CCNC(=O)N3[C@H]4CC[C@H]3CC(CCO)C4)c2c1	ZINC000875280388	FG	On-Demand	Anodyne	HTR1B	53	44
COc1ccc2[nH]cc(CCNC(=O)N3[C@H]4CC[C@H]3CC(CCO)C4)c2c1	ZINC000875280388	FG	On-Demand	Anodyne	NQO2	39	58
COc1ccc2[nH]cc(CCNC(=O)N3[C@H]4CC[C@H]3CC(CCO)C4)c2c1	ZINC000875280388	FG	On-Demand	Anodyne	MTNR1A	94	59
COc1ccc2[nH]cc(CCNC(=O)N3[C@H]4CC[C@H]3CC(CCO)C4)c2c1	ZINC000875280388	FG	On-Demand	Anodyne	MTNR1B	71	58
COc1ccc2[nH]cc(CCNC(=O)N3[C@H]4CC[C@H]3CC(CCO)C4)c2c1	ZINC000875280388	FG	On-Demand	Anodyne	ABCG2	25	42
COc1ccc2[nH]cc(CCNC(=O)N3CCCCCCNC(=O)CC3)c2c1	ZINC000875280412	GF	On-Demand	Anodyne	HTR1A	18	47
COc1ccc2[nH]cc(CCNC(=O)N3CCCCCCNC(=O)CC3)c2c1	ZINC000875280412	GF	On-Demand	Anodyne	ACHE	17	42
COc1ccc2[nH]cc(CCNC(=O)N3CCCCCCNC(=O)CC3)c2c1	ZINC000875280412	GF	On-Demand	Anodyne	HTR1D	54	45
COc1ccc2[nH]cc(CCNC(=O)N3CCCCCCNC(=O)CC3)c2c1	ZINC000875280412	GF	On-Demand	Anodyne	HTR1B	42	45
COc1ccc2[nH]cc(CCNC(=O)N3CCCCCCNC(=O)CC3)c2c1	ZINC000875280412	GF	On-Demand	Anodyne	NQO2	36	57
COc1ccc2[nH]cc(CCNC(=O)N3CCCCCCNC(=O)CC3)c2c1	ZINC000875280412	GF	On-Demand	Anodyne	MTNR1A	91	58
COc1ccc2[nH]cc(CCNC(=O)N3CCCCCCNC(=O)CC3)c2c1	ZINC000875280412	GF	On-Demand	Anodyne	MTNR1B	75	57
COc1ccc2[nH]cc(CCNC(=O)N3CCCCCCNC(=O)CC3)c2c1	ZINC000875280412	GF	On-Demand	Anodyne	ABCG2	28	45
COc1cc2c(cc1OC)CN(C(=O)COC(=O)CCCOc1ccc(F)cc1)CC2	ZINC000875280430	IG	On-Demand	Anodyne	ABCB1	23	51
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(c2ccccc2F)CC1	ZINC000875280444	HG	On-Demand	Anodyne	HTR1A	28	44
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(c2ccccc2F)CC1	ZINC000875280444	HG	On-Demand	Anodyne	DRD2	30	44
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(c2ccccc2F)CC1	ZINC000875280444	HG	On-Demand	Anodyne	DRD4	17	41
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(c2ccccc2F)CC1	ZINC000875280444	HG	On-Demand	Anodyne	HTR1D	17	41
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(c2ccccc2F)CC1	ZINC000875280444	HG	On-Demand	Anodyne	HTR1B	19	41
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(c2ccccc2F)CC1	ZINC000875280444	HG	On-Demand	Anodyne	HTR2A	17	41
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(c2ccccc2F)CC1	ZINC000875280444	HG	On-Demand	Anodyne	DRD3	24	41
O=C(CCCOc1ccc(F)cc1)OCc1ccc(F)c(F)c1	ZINC000875280449	DI	On-Demand	Anodyne	LTA4H	19	46
O=C(CCCOc1ccc(F)cc1)OCc1ccc(F)c(F)c1	ZINC000875280449	DI	On-Demand	Anodyne	TPSAB1	41	36
Cc1cnc(CNC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)s1	ZINC000875280451	FE	On-Demand	Anodyne	OXTR	40	34
Cc1cnc(CNC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)s1	ZINC000875280452	FE	On-Demand	Anodyne	OXTR	40	34
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](c4nc(C)cs4)C3)c2c1	ZINC000875280455	GH	On-Demand	Anodyne	HTR1A	18	42
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](c4nc(C)cs4)C3)c2c1	ZINC000875280455	GH	On-Demand	Anodyne	HTR1D	80	42
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](c4nc(C)cs4)C3)c2c1	ZINC000875280455	GH	On-Demand	Anodyne	HTR1B	68	42
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](c4nc(C)cs4)C3)c2c1	ZINC000875280455	GH	On-Demand	Anodyne	HTR1F	43	35
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](c4nc(C)cs4)C3)c2c1	ZINC000875280455	GH	On-Demand	Anodyne	NQO2	27	52
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](c4nc(C)cs4)C3)c2c1	ZINC000875280455	GH	On-Demand	Anodyne	MTNR1A	75	53
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](c4nc(C)cs4)C3)c2c1	ZINC000875280455	GH	On-Demand	Anodyne	MTNR1B	58	52
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](c4nc(C)cs4)C3)c2c1	ZINC000875280455	GH	On-Demand	Anodyne	ABCG2	24	40
C[C@@H](NC(C)(C)CNC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1ccccc1	ZINC000875280456	GG	On-Demand	Anodyne	SMO	19	40
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](c4nc(C)cs4)C3)c2c1	ZINC000875280457	GH	On-Demand	Anodyne	HTR1A	18	42
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](c4nc(C)cs4)C3)c2c1	ZINC000875280457	GH	On-Demand	Anodyne	HTR1D	80	42
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](c4nc(C)cs4)C3)c2c1	ZINC000875280457	GH	On-Demand	Anodyne	HTR1B	68	42
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](c4nc(C)cs4)C3)c2c1	ZINC000875280457	GH	On-Demand	Anodyne	HTR1F	43	35
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](c4nc(C)cs4)C3)c2c1	ZINC000875280457	GH	On-Demand	Anodyne	NQO2	27	52
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](c4nc(C)cs4)C3)c2c1	ZINC000875280457	GH	On-Demand	Anodyne	MTNR1A	75	53
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](c4nc(C)cs4)C3)c2c1	ZINC000875280457	GH	On-Demand	Anodyne	MTNR1B	58	52
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](c4nc(C)cs4)C3)c2c1	ZINC000875280457	GH	On-Demand	Anodyne	ABCG2	24	40
C[C@H](NC(C)(C)CNC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1ccccc1	ZINC000875280458	GG	On-Demand	Anodyne	SMO	19	40
C[C@H](NC(C)(C)CNC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1ccccc1	ZINC000875280460	GG	On-Demand	Anodyne	SMO	19	40
C[C@@H](NC(C)(C)CNC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1ccccc1	ZINC000875280462	GG	On-Demand	Anodyne	SMO	19	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(Br)cc1	ZINC000875280487	JH	On-Demand	Anodyne	FKBP1A	43	39
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(Br)cc1	ZINC000875280488	JH	On-Demand	Anodyne	FKBP1A	43	39
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1Cl	ZINC000875280493	HH	On-Demand	Anodyne	FKBP1A	48	39
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1Cl	ZINC000875280493	HH	On-Demand	Anodyne	PREP	41	36
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1Cl	ZINC000875280494	HH	On-Demand	Anodyne	FKBP1A	48	39
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1Cl	ZINC000875280494	HH	On-Demand	Anodyne	PREP	41	36
C=CC(C)(C)CCCNC(=O)C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000875280498	FF	On-Demand	Mild	CACNA1I	47	35
Cn1ncc2c(N3CCN(C(=O)COC(=O)CCCOc4ccc(F)cc4)CC3)ncnc21	ZINC000875280500	JD	On-Demand	Anodyne	PDGFRB	47	38
Cc1ccccc1[C@H](C)NC(=O)[C@@H](C)OC(=O)CCCOc1ccc(F)cc1	ZINC000875280521	GI	On-Demand	Anodyne	CTSA	52	35
Cc1ccccc1[C@@H](C)NC(=O)[C@@H](C)OC(=O)CCCOc1ccc(F)cc1	ZINC000875280522	GI	On-Demand	Anodyne	CTSA	52	35
Cc1ccccc1[C@H](C)NC(=O)[C@H](C)OC(=O)CCCOc1ccc(F)cc1	ZINC000875280523	GI	On-Demand	Anodyne	CTSA	52	35
Cc1ccccc1[C@@H](C)NC(=O)[C@H](C)OC(=O)CCCOc1ccc(F)cc1	ZINC000875280524	GI	On-Demand	Anodyne	CTSA	52	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC12CC3CC(CC(C3)C1)C2	ZINC000875280535	IG	On-Demand	Anodyne	FKBP1A	43	51
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC12CC3CC(CC(C3)C1)C2	ZINC000875280535	IG	On-Demand	Anodyne	EPHX2	55	39
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC12CC3CC(CC(C3)C1)C2	ZINC000875280536	IG	On-Demand	Anodyne	FKBP1A	43	51
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC12CC3CC(CC(C3)C1)C2	ZINC000875280536	IG	On-Demand	Anodyne	EPHX2	55	39
O=C(NCc1ccc(O)c(Cl)c1)NCC1CCSCC1	ZINC000875280541	DF	On-Demand	Anodyne	NCE103	15	46
CCC(CC)(CNC(=O)C(=O)N1CCC(CO)(CO)CC1)c1ccccc1	ZINC000875280552	GD	On-Demand	Anodyne	CACNA1G	35	41
COc1ccc2[nH]cc(CCNC(=O)NC[C@H]3CC(C(F)(F)F)=NO3)c2c1	ZINC000875280603	GF	On-Demand	Anodyne	HTR1A	18	44
COc1ccc2[nH]cc(CCNC(=O)NC[C@H]3CC(C(F)(F)F)=NO3)c2c1	ZINC000875280603	GF	On-Demand	Anodyne	HTR1D	31	44
COc1ccc2[nH]cc(CCNC(=O)NC[C@H]3CC(C(F)(F)F)=NO3)c2c1	ZINC000875280603	GF	On-Demand	Anodyne	HTR1B	30	44
COc1ccc2[nH]cc(CCNC(=O)NC[C@H]3CC(C(F)(F)F)=NO3)c2c1	ZINC000875280603	GF	On-Demand	Anodyne	NQO2	33	56
COc1ccc2[nH]cc(CCNC(=O)NC[C@H]3CC(C(F)(F)F)=NO3)c2c1	ZINC000875280603	GF	On-Demand	Anodyne	MTNR1A	86	64
COc1ccc2[nH]cc(CCNC(=O)NC[C@H]3CC(C(F)(F)F)=NO3)c2c1	ZINC000875280603	GF	On-Demand	Anodyne	MTNR1B	65	56
COc1ccc2[nH]cc(CCNC(=O)NC[C@H]3CC(C(F)(F)F)=NO3)c2c1	ZINC000875280603	GF	On-Demand	Anodyne	ABCG2	27	44
COc1ccc2[nH]cc(CCNC(=O)NC[C@@H]3CC(C(F)(F)F)=NO3)c2c1	ZINC000875280604	GF	On-Demand	Anodyne	HTR1A	18	44
COc1ccc2[nH]cc(CCNC(=O)NC[C@@H]3CC(C(F)(F)F)=NO3)c2c1	ZINC000875280604	GF	On-Demand	Anodyne	HTR1D	31	44
COc1ccc2[nH]cc(CCNC(=O)NC[C@@H]3CC(C(F)(F)F)=NO3)c2c1	ZINC000875280604	GF	On-Demand	Anodyne	HTR1B	30	44
COc1ccc2[nH]cc(CCNC(=O)NC[C@@H]3CC(C(F)(F)F)=NO3)c2c1	ZINC000875280604	GF	On-Demand	Anodyne	NQO2	33	56
COc1ccc2[nH]cc(CCNC(=O)NC[C@@H]3CC(C(F)(F)F)=NO3)c2c1	ZINC000875280604	GF	On-Demand	Anodyne	MTNR1A	86	64
COc1ccc2[nH]cc(CCNC(=O)NC[C@@H]3CC(C(F)(F)F)=NO3)c2c1	ZINC000875280604	GF	On-Demand	Anodyne	MTNR1B	65	56
COc1ccc2[nH]cc(CCNC(=O)NC[C@@H]3CC(C(F)(F)F)=NO3)c2c1	ZINC000875280604	GF	On-Demand	Anodyne	ABCG2	27	44
O=C(NC[C@@H]1OCCc2ccccc21)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875280610	GE	On-Demand	Anodyne	SMO	39	49
O=C(NC[C@@H]1OCCc2ccccc21)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875280610	GE	On-Demand	Anodyne	ETHR	52	35
O=C(NC[C@H]1OCCc2ccccc21)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875280611	GE	On-Demand	Anodyne	SMO	39	49
O=C(NC[C@H]1OCCc2ccccc21)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875280611	GE	On-Demand	Anodyne	ETHR	52	35
O=C(NC[C@@H]1OCCc2ccccc21)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875280612	GE	On-Demand	Anodyne	SMO	39	49
O=C(NC[C@@H]1OCCc2ccccc21)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875280612	GE	On-Demand	Anodyne	ETHR	52	35
O=C(NC[C@H]1OCCc2ccccc21)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875280614	GE	On-Demand	Anodyne	SMO	39	49
O=C(NC[C@H]1OCCc2ccccc21)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875280614	GE	On-Demand	Anodyne	ETHR	52	35
O=C(OC/C=C\Cl)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280624	DG	On-Demand	Anodyne	FKBP1A	57	38
O=C(OC/C=C\Cl)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280624	DG	On-Demand	Anodyne	PREP	73	38
O=C(OC/C=C\Cl)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280628	DG	On-Demand	Anodyne	FKBP1A	57	38
O=C(OC/C=C\Cl)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280628	DG	On-Demand	Anodyne	PREP	73	38
O=C(OC/C=C/Cl)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280629	DG	On-Demand	Anodyne	FKBP1A	57	38
O=C(OC/C=C/Cl)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280629	DG	On-Demand	Anodyne	PREP	73	38
O=C(OC/C=C/Cl)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280631	DG	On-Demand	Anodyne	FKBP1A	57	38
O=C(OC/C=C/Cl)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280631	DG	On-Demand	Anodyne	PREP	73	38
O=C(OCC(=O)N1CCOCC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280648	FD	On-Demand	Anodyne	FKBP1A	46	38
O=C(OCC(=O)N1CCOCC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280648	FD	On-Demand	Anodyne	CPT1A	37	41
O=C(OCC(=O)N1CCOCC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280648	FD	On-Demand	Anodyne	CPT2	45	36
O=C(OCC(=O)N1CCOCC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280648	FD	On-Demand	Anodyne	PREP	65	36
O=C(OCC(=O)N1CCOCC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280650	FD	On-Demand	Anodyne	FKBP1A	46	38
O=C(OCC(=O)N1CCOCC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280650	FD	On-Demand	Anodyne	CPT1A	37	41
O=C(OCC(=O)N1CCOCC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280650	FD	On-Demand	Anodyne	CPT2	45	36
O=C(OCC(=O)N1CCOCC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280650	FD	On-Demand	Anodyne	PREP	65	36
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)NCc1ccc(Cl)cc1	ZINC000875280653	GH	On-Demand	Anodyne	PPARA	19	42
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)NCc1ccc(Cl)cc1	ZINC000875280653	GH	On-Demand	Anodyne	AMP1_PLAFQ	18	41
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)NCc1ccc(Cl)cc1	ZINC000875280653	GH	On-Demand	Anodyne	LEF	48	38
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)NCc1ccc(Cl)cc1	ZINC000875280653	GH	On-Demand	Anodyne	PDS	49	37
O=C(OCc1c(Cl)cccc1Cl)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280656	GJ	On-Demand	Anodyne	FKBP1A	61	43
O=C(OCc1c(Cl)cccc1Cl)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280656	GJ	On-Demand	Anodyne	PREP	67	40
O=C(OCc1c(Cl)cccc1Cl)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280657	GJ	On-Demand	Anodyne	FKBP1A	61	43
O=C(OCc1c(Cl)cccc1Cl)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280657	GJ	On-Demand	Anodyne	PREP	67	40
O=C(OCCN1C(=O)c2ccccc2C1=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280667	HF	On-Demand	Anodyne	FKBP1A	70	45
O=C(OCCN1C(=O)c2ccccc2C1=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280667	HF	On-Demand	Anodyne	PREP	53	36
O=C(OCCN1C(=O)c2ccccc2C1=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280669	HF	On-Demand	Anodyne	FKBP1A	70	45
O=C(OCCN1C(=O)c2ccccc2C1=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280669	HF	On-Demand	Anodyne	PREP	53	36
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)c1cccc([N+](=O)[O-])c1	ZINC000875280672	EI	On-Demand	Bother	CACNA1C	45	38
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)c1cccc([N+](=O)[O-])c1	ZINC000875280672	EI	On-Demand	Bother	CACNA1D	72	38
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)N1CCN(c2ncccn2)CC1	ZINC000875280675	HE	On-Demand	Anodyne	P2RX3	21	41
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)N1CCN(c2ncccn2)CC1	ZINC000875280675	HE	On-Demand	Anodyne	AKT1	18	40
COC(=O)N(C)NC(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875280680	DD	On-Demand	Reactive	HTR1A	22	57
COC(=O)N(C)NC(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875280680	DD	On-Demand	Reactive	HTR1D	63	57
COC(=O)N(C)NC(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875280680	DD	On-Demand	Reactive	HTR1B	41	57
COC(=O)N(C)NC(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875280680	DD	On-Demand	Reactive	NQO2	47	70
COC(=O)N(C)NC(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875280680	DD	On-Demand	Reactive	MPO	84	44
COC(=O)N(C)NC(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875280680	DD	On-Demand	Reactive	HTR1E	24	48
COC(=O)N(C)NC(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875280680	DD	On-Demand	Reactive	MTNR1A	134	79
COC(=O)N(C)NC(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875280680	DD	On-Demand	Reactive	MTNR1B	101	70
COC(=O)N(C)NC(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000875280680	DD	On-Demand	Reactive	ABCG2	29	48
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(OC(F)(F)F)cc1	ZINC000875280699	JH	On-Demand	Anodyne	P2RY1	40	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(OC(F)(F)F)cc1	ZINC000875280699	JH	On-Demand	Anodyne	EPHX2	52	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(OC(F)(F)F)cc1	ZINC000875280700	JH	On-Demand	Anodyne	P2RY1	40	36
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(OC(F)(F)F)cc1	ZINC000875280700	JH	On-Demand	Anodyne	EPHX2	52	41
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000875280702	JE	On-Demand	Anodyne	TGM2	54	43
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000875280702	JE	On-Demand	Anodyne	F13A1	55	43
Cc1oc(-c2ccccc2)nc1COC(=O)CCCOc1ccc(F)cc1	ZINC000875280723	FJ	On-Demand	Anodyne	PPARG	130	57
Cc1oc(-c2ccccc2)nc1COC(=O)CCCOc1ccc(F)cc1	ZINC000875280723	FJ	On-Demand	Anodyne	PPARA	140	59
Cc1oc(-c2ccccc2)nc1COC(=O)CCCOc1ccc(F)cc1	ZINC000875280723	FJ	On-Demand	Anodyne	LTA4H	15	40
Cc1oc(-c2ccccc2)nc1COC(=O)CCCOc1ccc(F)cc1	ZINC000875280723	FJ	On-Demand	Anodyne	PPARD	15	44
Cc1oc(-c2ccccc2)nc1COC(=O)CCCOc1ccc(F)cc1	ZINC000875280723	FJ	On-Demand	Anodyne	FAAH	19	44
Cc1oc(-c2ccccc2)nc1COC(=O)CCCOc1ccc(F)cc1	ZINC000875280723	FJ	On-Demand	Anodyne	PDE8B	58	34
C[C@@H]1C[C@@H](C)CN(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)C1	ZINC000875280734	GF	On-Demand	Anodyne	FKBP1A	68	40
C[C@@H]1C[C@@H](C)CN(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)C1	ZINC000875280734	GF	On-Demand	Anodyne	PREP	58	37
C[C@@H]1C[C@@H](C)CN(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)C1	ZINC000875280735	GF	On-Demand	Anodyne	FKBP1A	68	40
C[C@@H]1C[C@@H](C)CN(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)C1	ZINC000875280735	GF	On-Demand	Anodyne	PREP	58	37
C[C@H]1C[C@@H](C)CN(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)C1	ZINC000875280736	GF	On-Demand	Anodyne	FKBP1A	68	40
C[C@H]1C[C@@H](C)CN(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)C1	ZINC000875280736	GF	On-Demand	Anodyne	PREP	58	37
C[C@H]1C[C@@H](C)CN(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)C1	ZINC000875280737	GF	On-Demand	Anodyne	FKBP1A	68	40
C[C@H]1C[C@@H](C)CN(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)C1	ZINC000875280737	GF	On-Demand	Anodyne	PREP	58	37
COc1ccc2[nH]cc(CCNC(=O)N3C[C@@H](OC)CC[C@@H]3C)c2c1	ZINC000875280777	EF	On-Demand	Anodyne	HTR1A	25	49
COc1ccc2[nH]cc(CCNC(=O)N3C[C@@H](OC)CC[C@@H]3C)c2c1	ZINC000875280777	EF	On-Demand	Anodyne	HTR1D	76	46
COc1ccc2[nH]cc(CCNC(=O)N3C[C@@H](OC)CC[C@@H]3C)c2c1	ZINC000875280777	EF	On-Demand	Anodyne	HTR1B	61	46
COc1ccc2[nH]cc(CCNC(=O)N3C[C@@H](OC)CC[C@@H]3C)c2c1	ZINC000875280777	EF	On-Demand	Anodyne	NQO2	44	63
COc1ccc2[nH]cc(CCNC(=O)N3C[C@@H](OC)CC[C@@H]3C)c2c1	ZINC000875280777	EF	On-Demand	Anodyne	MPO	41	37
COc1ccc2[nH]cc(CCNC(=O)N3C[C@@H](OC)CC[C@@H]3C)c2c1	ZINC000875280777	EF	On-Demand	Anodyne	HTR1E	33	40
COc1ccc2[nH]cc(CCNC(=O)N3C[C@@H](OC)CC[C@@H]3C)c2c1	ZINC000875280777	EF	On-Demand	Anodyne	MTNR1A	114	63
COc1ccc2[nH]cc(CCNC(=O)N3C[C@@H](OC)CC[C@@H]3C)c2c1	ZINC000875280777	EF	On-Demand	Anodyne	MTNR1B	88	63
COc1ccc2[nH]cc(CCNC(=O)N3C[C@@H](OC)CC[C@@H]3C)c2c1	ZINC000875280777	EF	On-Demand	Anodyne	ABCG2	28	47
COc1ccc2[nH]cc(CCNC(=O)N3C[C@@H](OC)CC[C@H]3C)c2c1	ZINC000875280778	EF	On-Demand	Anodyne	HTR1A	25	49
COc1ccc2[nH]cc(CCNC(=O)N3C[C@@H](OC)CC[C@H]3C)c2c1	ZINC000875280778	EF	On-Demand	Anodyne	HTR1D	76	46
COc1ccc2[nH]cc(CCNC(=O)N3C[C@@H](OC)CC[C@H]3C)c2c1	ZINC000875280778	EF	On-Demand	Anodyne	HTR1B	61	46
COc1ccc2[nH]cc(CCNC(=O)N3C[C@@H](OC)CC[C@H]3C)c2c1	ZINC000875280778	EF	On-Demand	Anodyne	NQO2	44	63
COc1ccc2[nH]cc(CCNC(=O)N3C[C@@H](OC)CC[C@H]3C)c2c1	ZINC000875280778	EF	On-Demand	Anodyne	MPO	41	37
COc1ccc2[nH]cc(CCNC(=O)N3C[C@@H](OC)CC[C@H]3C)c2c1	ZINC000875280778	EF	On-Demand	Anodyne	HTR1E	33	40
COc1ccc2[nH]cc(CCNC(=O)N3C[C@@H](OC)CC[C@H]3C)c2c1	ZINC000875280778	EF	On-Demand	Anodyne	MTNR1A	114	63
COc1ccc2[nH]cc(CCNC(=O)N3C[C@@H](OC)CC[C@H]3C)c2c1	ZINC000875280778	EF	On-Demand	Anodyne	MTNR1B	88	63
COc1ccc2[nH]cc(CCNC(=O)N3C[C@@H](OC)CC[C@H]3C)c2c1	ZINC000875280778	EF	On-Demand	Anodyne	ABCG2	28	47
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H](OC)CC[C@H]3C)c2c1	ZINC000875280779	EF	On-Demand	Anodyne	HTR1A	25	49
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H](OC)CC[C@H]3C)c2c1	ZINC000875280779	EF	On-Demand	Anodyne	HTR1D	76	46
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H](OC)CC[C@H]3C)c2c1	ZINC000875280779	EF	On-Demand	Anodyne	HTR1B	61	46
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H](OC)CC[C@H]3C)c2c1	ZINC000875280779	EF	On-Demand	Anodyne	NQO2	44	63
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H](OC)CC[C@H]3C)c2c1	ZINC000875280779	EF	On-Demand	Anodyne	MPO	41	37
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H](OC)CC[C@H]3C)c2c1	ZINC000875280779	EF	On-Demand	Anodyne	HTR1E	33	40
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H](OC)CC[C@H]3C)c2c1	ZINC000875280779	EF	On-Demand	Anodyne	MTNR1A	114	63
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H](OC)CC[C@H]3C)c2c1	ZINC000875280779	EF	On-Demand	Anodyne	MTNR1B	88	63
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H](OC)CC[C@H]3C)c2c1	ZINC000875280779	EF	On-Demand	Anodyne	ABCG2	28	47
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H](OC)CC[C@@H]3C)c2c1	ZINC000875280780	EF	On-Demand	Anodyne	HTR1A	25	49
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H](OC)CC[C@@H]3C)c2c1	ZINC000875280780	EF	On-Demand	Anodyne	HTR1D	76	46
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H](OC)CC[C@@H]3C)c2c1	ZINC000875280780	EF	On-Demand	Anodyne	HTR1B	61	46
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H](OC)CC[C@@H]3C)c2c1	ZINC000875280780	EF	On-Demand	Anodyne	NQO2	44	63
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H](OC)CC[C@@H]3C)c2c1	ZINC000875280780	EF	On-Demand	Anodyne	MPO	41	37
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H](OC)CC[C@@H]3C)c2c1	ZINC000875280780	EF	On-Demand	Anodyne	HTR1E	33	40
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H](OC)CC[C@@H]3C)c2c1	ZINC000875280780	EF	On-Demand	Anodyne	MTNR1A	114	63
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H](OC)CC[C@@H]3C)c2c1	ZINC000875280780	EF	On-Demand	Anodyne	MTNR1B	88	63
COc1ccc2[nH]cc(CCNC(=O)N3C[C@H](OC)CC[C@@H]3C)c2c1	ZINC000875280780	EF	On-Demand	Anodyne	ABCG2	28	47
O=C(CCCOc1ccc(F)cc1)OCc1nc2ccccc2o1	ZINC000875280789	EH	On-Demand	Anodyne	PPARG	20	43
O=C(CCCOc1ccc(F)cc1)OCc1nc2ccccc2o1	ZINC000875280789	EH	On-Demand	Anodyne	PPARA	24	43
O=C(CCCOc1ccc(F)cc1)OCc1nc2ccccc2o1	ZINC000875280789	EH	On-Demand	Anodyne	LTA4H	18	40
Cc1cnc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)s1	ZINC000875280794	FD	On-Demand	Anodyne	SIRT3	59	38
Cc1cnc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)s1	ZINC000875280794	FD	On-Demand	Anodyne	SIRT2	58	37
Cc1cnc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)s1	ZINC000875280794	FD	On-Demand	Anodyne	SIRT1	56	37
C[C@]1(C(F)(F)F)CCN(C(=O)NC[C@@H]2OCCc3ccccc32)C1	ZINC000875280829	EG	On-Demand	Anodyne	TRPM8	43	33
C[C@]1(C(F)(F)F)CCN(C(=O)NC[C@H]2OCCc3ccccc32)C1	ZINC000875280830	EG	On-Demand	Anodyne	TRPM8	43	33
COc1ccccc1[C@H]1CCCN(C(=O)NCCN2C(=O)CNC2=O)CC1	ZINC000875280831	FD	On-Demand	Anodyne	DRD2	20	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCCN2C(=O)CNC2=O)CC1	ZINC000875280832	FD	On-Demand	Anodyne	DRD2	20	42
C=CCC[C@H](NC(=O)C(=O)N1CC[C@@H]2[C@H](CCN2C)C1)c1ccccc1	ZINC000875280835	FE	On-Demand	Mild	CCR5	25	40
C=CCC[C@H](NC(=O)C(=O)N1CC[C@H]2[C@@H](CCN2C)C1)c1ccccc1	ZINC000875280836	FE	On-Demand	Mild	CCR5	25	40
C=CCC[C@H](NC(=O)C(=O)N1CC[C@@H]2[C@@H](CCN2C)C1)c1ccccc1	ZINC000875280837	FE	On-Demand	Mild	CCR5	25	40
C=CCC[C@H](NC(=O)C(=O)N1CC[C@H]2[C@H](CCN2C)C1)c1ccccc1	ZINC000875280838	FE	On-Demand	Mild	CCR5	25	40
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)N1CCN(c2ccccc2O)CC1	ZINC000875280848	IF	On-Demand	Anodyne	HTR1A	27	44
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)N1CCN(c2ccccc2O)CC1	ZINC000875280848	IF	On-Demand	Anodyne	DRD2	34	44
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)N1CCN(c2ccccc2O)CC1	ZINC000875280848	IF	On-Demand	Anodyne	DRD3	26	40
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NCCN1C(=O)CNC1=O	ZINC000875280857	GD	On-Demand	Anodyne	SIGMAR1	15	48
CCCCCCCNC(=O)C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000875280862	FF	On-Demand	Mild	ASAH1	89	37
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)N[C@H](C)c1cc2ccccc2o1	ZINC000875280867	HJ	On-Demand	Anodyne	PPARA	28	41
C[C@H](NC(=O)[C@@H](C)OC(=O)CCCOc1ccc(F)cc1)c1cc2ccccc2o1	ZINC000875280868	HJ	On-Demand	Anodyne	PPARA	28	41
O=C(OCc1ccc(Cl)c(Cl)c1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280898	GJ	On-Demand	Anodyne	FKBP1A	71	42
O=C(OCc1ccc(Cl)c(Cl)c1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280898	GJ	On-Demand	Anodyne	OPRK1	25	43
O=C(OCc1ccc(Cl)c(Cl)c1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280898	GJ	On-Demand	Anodyne	PREP	64	39
O=C(OCc1ccc(Cl)c(Cl)c1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280898	GJ	On-Demand	Anodyne	LGMN	54	34
O=C(OCc1ccc(Cl)c(Cl)c1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280899	GJ	On-Demand	Anodyne	FKBP1A	71	42
O=C(OCc1ccc(Cl)c(Cl)c1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280899	GJ	On-Demand	Anodyne	OPRK1	25	43
O=C(OCc1ccc(Cl)c(Cl)c1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280899	GJ	On-Demand	Anodyne	PREP	64	39
O=C(OCc1ccc(Cl)c(Cl)c1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280899	GJ	On-Demand	Anodyne	LGMN	54	34
CC[C@@H]1CCCCN1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280902	GG	On-Demand	Anodyne	FKBP1A	63	40
CC[C@@H]1CCCCN1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280902	GG	On-Demand	Anodyne	CPT1A	49	36
CC[C@@H]1CCCCN1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280902	GG	On-Demand	Anodyne	CPT2	40	34
CC[C@@H]1CCCCN1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280902	GG	On-Demand	Anodyne	PREP	50	36
CC[C@H]1CCCCN1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280903	GG	On-Demand	Anodyne	FKBP1A	63	40
CC[C@H]1CCCCN1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280903	GG	On-Demand	Anodyne	CPT1A	49	36
CC[C@H]1CCCCN1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280903	GG	On-Demand	Anodyne	CPT2	40	34
CC[C@H]1CCCCN1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280903	GG	On-Demand	Anodyne	PREP	50	36
CC[C@@H]1CCCCN1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280904	GG	On-Demand	Anodyne	FKBP1A	63	40
CC[C@@H]1CCCCN1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280904	GG	On-Demand	Anodyne	CPT1A	49	36
CC[C@@H]1CCCCN1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280904	GG	On-Demand	Anodyne	CPT2	40	34
CC[C@@H]1CCCCN1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280904	GG	On-Demand	Anodyne	PREP	50	36
CC[C@H]1CCCCN1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280905	GG	On-Demand	Anodyne	FKBP1A	63	40
CC[C@H]1CCCCN1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280905	GG	On-Demand	Anodyne	CPT1A	49	36
CC[C@H]1CCCCN1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280905	GG	On-Demand	Anodyne	CPT2	40	34
CC[C@H]1CCCCN1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280905	GG	On-Demand	Anodyne	PREP	50	36
C[C@H](NC(C)(C)CNC(=O)N1CCC(c2nnnn2C)CC1)c1ccccc1	ZINC000875280936	GE	On-Demand	Anodyne	IL2RA	53	35
C[C@@H](NC(C)(C)CNC(=O)N1CCC(c2nnnn2C)CC1)c1ccccc1	ZINC000875280937	GE	On-Demand	Anodyne	IL2RA	53	35
O=C(OCc1cccc(Cl)c1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280938	FI	On-Demand	Anodyne	FKBP1A	78	46
O=C(OCc1cccc(Cl)c1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875280938	FI	On-Demand	Anodyne	PREP	74	39
O=C(OCc1cccc(Cl)c1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280939	FI	On-Demand	Anodyne	FKBP1A	78	46
O=C(OCc1cccc(Cl)c1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875280939	FI	On-Demand	Anodyne	PREP	74	39
C=CCC[C@@H](NC(=O)C(=O)N1CCC(C(C)=O)CC1)c1ccccc1	ZINC000875280949	EF	On-Demand	Mild	CCR5	30	41
C=CCC[C@H](NC(=O)C(=O)N1CCC(C(C)=O)CC1)c1ccccc1	ZINC000875280950	EF	On-Demand	Mild	CCR5	30	41
CC(=O)N1CCN(C(=O)[C@H](C)OC(=O)CCCOc2ccc(F)cc2)CC1	ZINC000875280957	GD	On-Demand	Anodyne	HRH3	24	44
CC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)CCCOc2ccc(F)cc2)CC1	ZINC000875280958	GD	On-Demand	Anodyne	HRH3	24	44
O=C(NCC1CCSCC1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875280959	EF	On-Demand	Anodyne	ADRB1	24	40
O=C(NCC1CCSCC1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875280959	EF	On-Demand	Anodyne	CACNA1I	46	38
O=C(NCC1CCSCC1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875280960	EF	On-Demand	Anodyne	ADRB1	24	40
O=C(NCC1CCSCC1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875280960	EF	On-Demand	Anodyne	CACNA1I	46	38
CC(=O)c1cccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875280981	HG	On-Demand	Anodyne	FKBP1A	47	37
CC(=O)c1cccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875280981	HG	On-Demand	Anodyne	CCR3	16	43
CC(=O)c1cccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875280981	HG	On-Demand	Anodyne	CPT1A	22	40
CC(=O)c1cccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875280981	HG	On-Demand	Anodyne	PREP	36	42
CC(=O)c1cccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875280981	HG	On-Demand	Anodyne	NOS1	47	42
CC(=O)c1cccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875280981	HG	On-Demand	Anodyne	ST14	20	44
CC(=O)c1cccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875280982	HG	On-Demand	Anodyne	FKBP1A	47	37
CC(=O)c1cccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875280982	HG	On-Demand	Anodyne	CCR3	16	43
CC(=O)c1cccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875280982	HG	On-Demand	Anodyne	CPT1A	22	40
CC(=O)c1cccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875280982	HG	On-Demand	Anodyne	PREP	36	42
CC(=O)c1cccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875280982	HG	On-Demand	Anodyne	NOS1	47	42
CC(=O)c1cccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875280982	HG	On-Demand	Anodyne	ST14	20	44
CCC(CC)(CNC(=O)C(=O)N1CCC(C(C)=O)CC1)c1ccccc1	ZINC000875280987	FF	On-Demand	Anodyne	CACNA1G	42	49
CC(=O)C1CCN(C(=O)NCC2(N[C@@H](C)c3ccccc3)CCCC2)CC1	ZINC000875280990	FH	On-Demand	Anodyne	SMO	21	47
CC(=O)C1CCN(C(=O)NCC2(N[C@@H](C)c3ccccc3)CCCC2)CC1	ZINC000875280990	FH	On-Demand	Anodyne	HCN1	53	36
CC(=O)C1CCN(C(=O)NCC2(N[C@@H](C)c3ccccc3)CCCC2)CC1	ZINC000875280990	FH	On-Demand	Anodyne	HCN4	42	36
CC(=O)C1CCN(C(=O)NCC2(N[C@H](C)c3ccccc3)CCCC2)CC1	ZINC000875280991	FH	On-Demand	Anodyne	SMO	21	47
CC(=O)C1CCN(C(=O)NCC2(N[C@H](C)c3ccccc3)CCCC2)CC1	ZINC000875280991	FH	On-Demand	Anodyne	HCN1	53	36
CC(=O)C1CCN(C(=O)NCC2(N[C@H](C)c3ccccc3)CCCC2)CC1	ZINC000875280991	FH	On-Demand	Anodyne	HCN4	42	36
O=C(NCc1ncc(Cl)s1)C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000875281015	GD	On-Demand	Anodyne	F10	15	48
O=C(NCc1ncc(Cl)s1)C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000875281015	GD	On-Demand	Anodyne	CACNA1I	41	33
CONC(=O)C1CCN(C(=O)NCC(C)(C)N[C@@H](C)c2ccccc2)CC1	ZINC000875281029	GE	On-Demand	Anodyne	AMY2	57	34
CONC(=O)C1CCN(C(=O)NCC(C)(C)N[C@H](C)c2ccccc2)CC1	ZINC000875281030	GE	On-Demand	Anodyne	AMY2	57	34
CC(C)(C)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875281049	EF	On-Demand	Anodyne	FKBP1A	85	45
CC(C)(C)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875281049	EF	On-Demand	Anodyne	PREP	58	38
CC(C)(C)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875281050	EF	On-Demand	Anodyne	FKBP1A	85	45
CC(C)(C)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875281050	EF	On-Demand	Anodyne	PREP	58	38
CC(C)(C)OC(=O)N1CCCC[C@@H](NC(=O)NCCN2CC[C@H](O)C2)C1	ZINC000875281057	FD	On-Demand	Anodyne	CACNA1H	15	40
CC(C)(C)OC(=O)N1CCCC[C@H](NC(=O)NCCN2CC[C@H](O)C2)C1	ZINC000875281058	FD	On-Demand	Anodyne	CACNA1H	15	40
CC(C)(C)OC(=O)N1CCCC[C@@H](NC(=O)NCCN2CC[C@@H](O)C2)C1	ZINC000875281059	FD	On-Demand	Anodyne	CACNA1H	15	40
CC(C)(C)OC(=O)N1CCCC[C@H](NC(=O)NCCN2CC[C@@H](O)C2)C1	ZINC000875281060	FD	On-Demand	Anodyne	CACNA1H	15	40
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000875281061	HH	On-Demand	Mild	VIPR1	30	49
N#CCOC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875281071	CD	On-Demand	Mild	FKBP1A	65	39
N#CCOC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875281071	CD	On-Demand	Mild	PREP	68	39
N#CCOC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875281071	CD	On-Demand	Mild	LGMN	66	34
N#CCOC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875281072	CD	On-Demand	Mild	FKBP1A	65	39
N#CCOC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875281072	CD	On-Demand	Mild	PREP	68	39
N#CCOC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875281072	CD	On-Demand	Mild	LGMN	66	34
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(Cl)cc1	ZINC000875281074	HG	On-Demand	Anodyne	FKBP1A	66	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(Cl)cc1	ZINC000875281074	HG	On-Demand	Anodyne	PREP	45	37
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(Cl)cc1	ZINC000875281074	HG	On-Demand	Anodyne	LGMN	64	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(Cl)cc1	ZINC000875281075	HG	On-Demand	Anodyne	FKBP1A	66	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(Cl)cc1	ZINC000875281075	HG	On-Demand	Anodyne	PREP	45	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(Cl)cc1	ZINC000875281075	HG	On-Demand	Anodyne	LGMN	64	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1ccco1	ZINC000875281084	GE	On-Demand	Anodyne	FKBP1A	45	37
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1ccco1	ZINC000875281084	GE	On-Demand	Anodyne	PREP	47	34
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1ccco1	ZINC000875281085	GE	On-Demand	Anodyne	FKBP1A	45	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1ccco1	ZINC000875281085	GE	On-Demand	Anodyne	PREP	47	34
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(Cl)c(Cl)c1	ZINC000875281091	II	On-Demand	Anodyne	NOS1	44	39
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(Cl)c(Cl)c1	ZINC000875281092	II	On-Demand	Anodyne	NOS1	44	39
Cc1ccc(NC(=O)c2nnc(COC(=O)CCCOc3ccc(F)cc3)s2)cc1	ZINC000875281099	II	On-Demand	Anodyne	FAAH	19	40
Cc1sc2nc(COC(=O)CCCOc3ccc(F)cc3)nc(N)c2c1C	ZINC000875281107	GH	On-Demand	Anodyne	DRTS_TOXGO	24	42
Cc1sc2nc(COC(=O)CCCOc3ccc(F)cc3)nc(N)c2c1C	ZINC000875281107	GH	On-Demand	Anodyne	DYR_PNECA	41	38
CC[C@@H](NC(=O)NCCC(=O)Nc1ccccc1)[C@H](O)c1ccccc1	ZINC000875281218	FF	On-Demand	Anodyne	SOAT1	15	40
CC[C@@H](NC(=O)NCCC(=O)Nc1ccccc1)[C@@H](O)c1ccccc1	ZINC000875281219	FF	On-Demand	Anodyne	SOAT1	15	40
NS(=O)(=O)c1ccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281226	JD	On-Demand	Anodyne	CA2	40	58
NS(=O)(=O)c1ccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281226	JD	On-Demand	Anodyne	FKBP1A	43	37
NS(=O)(=O)c1ccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281226	JD	On-Demand	Anodyne	CA1	40	47
NS(=O)(=O)c1ccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281226	JD	On-Demand	Anodyne	CA7	22	47
NS(=O)(=O)c1ccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281226	JD	On-Demand	Anodyne	CA5B	44	47
NS(=O)(=O)c1ccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281226	JD	On-Demand	Anodyne	CA4	35	45
NS(=O)(=O)c1ccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281226	JD	On-Demand	Anodyne	CA5A	46	47
NS(=O)(=O)c1ccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281226	JD	On-Demand	Anodyne	CA9	28	47
NS(=O)(=O)c1ccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281226	JD	On-Demand	Anodyne	F13A1	41	32
NS(=O)(=O)c1ccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281226	JD	On-Demand	Anodyne	MTCA1	41	40
NS(=O)(=O)c1ccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281226	JD	On-Demand	Anodyne	P96878_MYCTU	52	40
NS(=O)(=O)c1ccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281227	JD	On-Demand	Anodyne	CA2	40	58
NS(=O)(=O)c1ccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281227	JD	On-Demand	Anodyne	FKBP1A	43	37
NS(=O)(=O)c1ccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281227	JD	On-Demand	Anodyne	CA1	40	47
NS(=O)(=O)c1ccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281227	JD	On-Demand	Anodyne	CA7	22	47
NS(=O)(=O)c1ccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281227	JD	On-Demand	Anodyne	CA5B	44	47
NS(=O)(=O)c1ccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281227	JD	On-Demand	Anodyne	CA4	35	45
NS(=O)(=O)c1ccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281227	JD	On-Demand	Anodyne	CA5A	46	47
NS(=O)(=O)c1ccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281227	JD	On-Demand	Anodyne	CA9	28	47
NS(=O)(=O)c1ccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281227	JD	On-Demand	Anodyne	F13A1	41	32
NS(=O)(=O)c1ccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281227	JD	On-Demand	Anodyne	MTCA1	41	40
NS(=O)(=O)c1ccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281227	JD	On-Demand	Anodyne	P96878_MYCTU	52	40
COc1ccccc1NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875281236	HF	On-Demand	Anodyne	FKBP1A	85	39
COc1ccccc1NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875281238	HF	On-Demand	Anodyne	FKBP1A	85	39
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccccc1F	ZINC000875281266	GG	On-Demand	Anodyne	FKBP1A	53	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccccc1F	ZINC000875281266	GG	On-Demand	Anodyne	PREP	48	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccccc1F	ZINC000875281268	GG	On-Demand	Anodyne	FKBP1A	53	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccccc1F	ZINC000875281268	GG	On-Demand	Anodyne	PREP	48	35
O=C(CCNC(=O)NCC[C@H](O)C1CCCC1)Nc1ccccc1	ZINC000875281269	EE	On-Demand	Anodyne	LTA4H	20	41
O=C(CCNC(=O)NCC[C@H](O)C1CCCC1)Nc1ccccc1	ZINC000875281269	EE	On-Demand	Anodyne	HDAC10	28	40
O=C(CCNC(=O)NCC[C@H](O)C1CCCC1)Nc1ccccc1	ZINC000875281269	EE	On-Demand	Anodyne	HDAC2	19	40
O=C(CCNC(=O)NCC[C@H](O)C1CCCC1)Nc1ccccc1	ZINC000875281269	EE	On-Demand	Anodyne	HDAC3	19	40
O=C(CCNC(=O)NCC[C@H](O)C1CCCC1)Nc1ccccc1	ZINC000875281269	EE	On-Demand	Anodyne	HDAC6	21	40
O=C(CCNC(=O)NCC[C@H](O)C1CCCC1)Nc1ccccc1	ZINC000875281269	EE	On-Demand	Anodyne	HDAC11	32	40
O=C(CCNC(=O)NCC[C@@H](O)C1CCCC1)Nc1ccccc1	ZINC000875281271	EE	On-Demand	Anodyne	LTA4H	20	41
O=C(CCNC(=O)NCC[C@@H](O)C1CCCC1)Nc1ccccc1	ZINC000875281271	EE	On-Demand	Anodyne	HDAC10	28	40
O=C(CCNC(=O)NCC[C@@H](O)C1CCCC1)Nc1ccccc1	ZINC000875281271	EE	On-Demand	Anodyne	HDAC2	19	40
O=C(CCNC(=O)NCC[C@@H](O)C1CCCC1)Nc1ccccc1	ZINC000875281271	EE	On-Demand	Anodyne	HDAC3	19	40
O=C(CCNC(=O)NCC[C@@H](O)C1CCCC1)Nc1ccccc1	ZINC000875281271	EE	On-Demand	Anodyne	HDAC6	21	40
O=C(CCNC(=O)NCC[C@@H](O)C1CCCC1)Nc1ccccc1	ZINC000875281271	EE	On-Demand	Anodyne	HDAC11	32	40
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCCC(=O)Nc1ccccc1)CC2	ZINC000875281272	GF	On-Demand	Anodyne	PTPRF	40	31
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1Br	ZINC000875281274	JH	On-Demand	Anodyne	FKBP1A	47	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1Br	ZINC000875281276	JH	On-Demand	Anodyne	FKBP1A	47	38
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(-c4cccnc4)cc3)CC[C@@H]21	ZINC000875281310	GD	On-Demand	Anodyne	CHRNA7	44	40
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(-c4cccnc4)cc3)CC[C@@H]21	ZINC000875281310	GD	On-Demand	Anodyne	NAMPT	72	37
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(-c4cccnc4)cc3)CC[C@H]21	ZINC000875281313	GD	On-Demand	Anodyne	CHRNA7	44	40
CN1CC[C@H]2CN(C(=O)C(=O)NCc3ccc(-c4cccnc4)cc3)CC[C@H]21	ZINC000875281313	GD	On-Demand	Anodyne	NAMPT	72	37
O=C(CCNC(=O)N1CCC[C@@](O)(c2ccccc2)C1)Nc1ccccc1	ZINC000875281327	FF	On-Demand	Anodyne	EPHX2	18	49
O=C(CCNC(=O)N1CCC[C@](O)(c2ccccc2)C1)Nc1ccccc1	ZINC000875281328	FF	On-Demand	Anodyne	EPHX2	18	49
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc2nc(O)[nH]c2c1	ZINC000875281336	IF	On-Demand	Anodyne	NOS1	40	36
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc2nc(O)[nH]c2c1	ZINC000875281337	IF	On-Demand	Anodyne	NOS1	40	36
CC[C@@H]1COCCN1CCNC(=O)NCCC(=O)Nc1ccccc1	ZINC000875281344	ED	On-Demand	Anodyne	MTOR	42	38
CC[C@@H]1COCCN1CCNC(=O)NCCC(=O)Nc1ccccc1	ZINC000875281344	ED	On-Demand	Anodyne	EPHX2	15	44
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1Sc1ccccc1	ZINC000875281370	JK	On-Demand	Anodyne	FKBP1A	40	39
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(C(=O)Nc2ccccc2)CC1	ZINC000875281382	IF	On-Demand	Anodyne	PDGFRB	40	43
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(C(=O)Nc2ccccc2)CC1	ZINC000875281382	IF	On-Demand	Anodyne	LTA4H	38	40
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(C(=O)Nc2ccccc2)CC1	ZINC000875281382	IF	On-Demand	Anodyne	FAAH	27	44
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCN(C(=O)Nc2ccccc2)CC1	ZINC000875281382	IF	On-Demand	Anodyne	EPHX2	39	41
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)NCc1ccc(F)cc1	ZINC000875281389	GG	On-Demand	Anodyne	PPARA	18	41
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)NCc1ccc(F)cc1	ZINC000875281389	GG	On-Demand	Anodyne	LTA4H	19	45
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)NCc1ccc(F)cc1	ZINC000875281389	GG	On-Demand	Anodyne	LEF	42	36
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)NCc1ccc(F)cc1	ZINC000875281389	GG	On-Demand	Anodyne	PDS	44	34
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1Sc1ccccc1	ZINC000875281406	JK	On-Demand	Anodyne	FKBP1A	40	39
CC(=O)Nc1cccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875281408	IF	On-Demand	Anodyne	FKBP1A	54	38
CC(=O)Nc1cccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875281408	IF	On-Demand	Anodyne	CPT1A	25	43
CC(=O)Nc1cccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875281408	IF	On-Demand	Anodyne	NOS1	47	43
CC(=O)Nc1cccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875281409	IF	On-Demand	Anodyne	FKBP1A	54	38
CC(=O)Nc1cccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875281409	IF	On-Demand	Anodyne	CPT1A	25	43
CC(=O)Nc1cccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875281409	IF	On-Demand	Anodyne	NOS1	47	43
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1cccc(Cl)c1	ZINC000875281416	HG	On-Demand	Anodyne	FKBP1A	78	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1cccc(Cl)c1	ZINC000875281416	HG	On-Demand	Anodyne	PREP	61	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1cccc(Cl)c1	ZINC000875281417	HG	On-Demand	Anodyne	FKBP1A	78	40
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1cccc(Cl)c1	ZINC000875281417	HG	On-Demand	Anodyne	PREP	61	35
O=C(NCCCCC1CC1)C(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000875281418	FG	On-Demand	Anodyne	TBXAS1	16	40
O=C(NCCCCC1CC1)C(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000875281418	FG	On-Demand	Anodyne	BMP1	16	41
O=C(NCCCCC1CC1)C(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000875281418	FG	On-Demand	Anodyne	NAMPT	53	45
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc2c(c1)OCO2	ZINC000875281433	HF	On-Demand	Anodyne	CPT1A	20	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc2c(c1)OCO2	ZINC000875281433	HF	On-Demand	Anodyne	NOS1	45	39
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc2c(c1)OCO2	ZINC000875281433	HF	On-Demand	Anodyne	TRPC6	41	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc2c(c1)OCO2	ZINC000875281433	HF	On-Demand	Anodyne	TRPC3	44	40
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc2c(c1)OCO2	ZINC000875281456	HF	On-Demand	Anodyne	CPT1A	20	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc2c(c1)OCO2	ZINC000875281456	HF	On-Demand	Anodyne	NOS1	45	39
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc2c(c1)OCO2	ZINC000875281456	HF	On-Demand	Anodyne	TRPC6	41	40
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc2c(c1)OCO2	ZINC000875281456	HF	On-Demand	Anodyne	TRPC3	44	40
Cc1ccc(-c2csc(NC(=O)COC(=O)[C@H]3CCCCN3C(=O)c3cccs3)n2)cc1	ZINC000875281468	JI	On-Demand	Anodyne	CPT1A	26	43
Cc1ccc(-c2csc(NC(=O)COC(=O)[C@H]3CCCCN3C(=O)c3cccs3)n2)cc1	ZINC000875281468	JI	On-Demand	Anodyne	TRPC6	21	40
Cc1ccc(-c2csc(NC(=O)COC(=O)[C@H]3CCCCN3C(=O)c3cccs3)n2)cc1	ZINC000875281468	JI	On-Demand	Anodyne	TRPC3	23	40
Cc1ccc(-c2csc(NC(=O)COC(=O)[C@@H]3CCCCN3C(=O)c3cccs3)n2)cc1	ZINC000875281470	JI	On-Demand	Anodyne	CPT1A	26	43
Cc1ccc(-c2csc(NC(=O)COC(=O)[C@@H]3CCCCN3C(=O)c3cccs3)n2)cc1	ZINC000875281470	JI	On-Demand	Anodyne	TRPC6	21	40
Cc1ccc(-c2csc(NC(=O)COC(=O)[C@@H]3CCCCN3C(=O)c3cccs3)n2)cc1	ZINC000875281470	JI	On-Demand	Anodyne	TRPC3	23	40
O=C(CCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000875281492	FG	On-Demand	Anodyne	HDAC10	31	40
O=C(CCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000875281492	FG	On-Demand	Anodyne	HDAC2	17	40
O=C(CCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000875281492	FG	On-Demand	Anodyne	EPHX2	34	40
O=C(CCNC(=O)N1CCC[C@@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000875281492	FG	On-Demand	Anodyne	HDAC11	35	40
O=C(CCNC(=O)N1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000875281494	FG	On-Demand	Anodyne	HDAC10	31	40
O=C(CCNC(=O)N1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000875281494	FG	On-Demand	Anodyne	HDAC2	17	40
O=C(CCNC(=O)N1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000875281494	FG	On-Demand	Anodyne	EPHX2	34	40
O=C(CCNC(=O)N1CCC[C@H](OC2CCC2)CC1)Nc1ccccc1	ZINC000875281494	FG	On-Demand	Anodyne	HDAC11	35	40
O=C(OCc1csc(Nc2ccccc2)n1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875281502	IJ	On-Demand	Anodyne	FKBP1A	50	42
O=C(OCc1csc(Nc2ccccc2)n1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875281502	IJ	On-Demand	Anodyne	PREP	41	37
O=C(OCc1csc(Nc2ccccc2)n1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875281502	IJ	On-Demand	Anodyne	TRPC6	52	41
O=C(OCc1csc(Nc2ccccc2)n1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875281502	IJ	On-Demand	Anodyne	TRPC3	51	41
O=C(OCc1csc(Nc2ccccc2)n1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875281505	IJ	On-Demand	Anodyne	FKBP1A	50	42
O=C(OCc1csc(Nc2ccccc2)n1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875281505	IJ	On-Demand	Anodyne	PREP	41	37
O=C(OCc1csc(Nc2ccccc2)n1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875281505	IJ	On-Demand	Anodyne	TRPC6	52	41
O=C(OCc1csc(Nc2ccccc2)n1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875281505	IJ	On-Demand	Anodyne	TRPC3	51	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC1CCCCCCC1	ZINC000875281507	HH	On-Demand	Anodyne	FKBP1A	63	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC1CCCCCCC1	ZINC000875281507	HH	On-Demand	Anodyne	PREP	45	38
Cc1ccc(CNC(=O)COC(=O)CCCOc2ccc(F)cc2)cc1F	ZINC000875281537	GG	On-Demand	Anodyne	LTA4H	16	44
Cc1ccc(CNC(=O)COC(=O)CCCOc2ccc(F)cc2)cc1F	ZINC000875281537	GG	On-Demand	Anodyne	LEF	49	38
Cc1ccc(CNC(=O)COC(=O)CCCOc2ccc(F)cc2)cc1F	ZINC000875281537	GG	On-Demand	Anodyne	PPO2	17	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC1CCCCCCC1	ZINC000875281553	HH	On-Demand	Anodyne	FKBP1A	63	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC1CCCCCCC1	ZINC000875281553	HH	On-Demand	Anodyne	PREP	45	38
O=C(NCc1ccc(O)c(Cl)c1)NCc1cc2c(nc1O)CCC2	ZINC000875281556	EF	On-Demand	Anodyne	NCE103	15	44
C[C@@H]1[C@@H](NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)CCC[C@H]1C	ZINC000875281559	HG	On-Demand	Anodyne	FKBP1A	49	38
C[C@@H]1[C@@H](NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)CCC[C@H]1C	ZINC000875281561	HG	On-Demand	Anodyne	FKBP1A	49	38
N#Cc1ccc(Cn2cc(NC(=O)NCC3CCSCC3)cn2)cc1	ZINC000875281563	FG	On-Demand	Mild	CCR3	21	42
N#Cc1ccc(Cn2cc(NC(=O)NCC3CCSCC3)cn2)cc1	ZINC000875281563	FG	On-Demand	Mild	ITK	18	51
N#Cc1ccc(Cn2cc(NC(=O)NCC3CCSCC3)cn2)cc1	ZINC000875281563	FG	On-Demand	Mild	PANC	56	38
CONC(=O)C1CCN(C(=O)NCCC(=O)Nc2ccccc2)CC1	ZINC000875281578	ED	On-Demand	Anodyne	EPHX2	32	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCCc1ccc(Cl)cc1	ZINC000875281590	IG	On-Demand	Anodyne	FKBP1A	65	42
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCCc1ccc(Cl)cc1	ZINC000875281590	IG	On-Demand	Anodyne	PREP	54	36
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCCc1ccc(Cl)cc1	ZINC000875281591	IG	On-Demand	Anodyne	FKBP1A	65	42
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCCc1ccc(Cl)cc1	ZINC000875281591	IG	On-Demand	Anodyne	PREP	54	36
O=C(NCC1CCSCC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875281596	FE	On-Demand	Anodyne	SMO	32	44
O=C(NCC1CCSCC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875281596	FE	On-Demand	Anodyne	ETHR	58	36
O=C(NCC1CCSCC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875281597	FE	On-Demand	Anodyne	SMO	32	44
O=C(NCC1CCSCC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875281597	FE	On-Demand	Anodyne	ETHR	58	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(F)c(F)c1	ZINC000875281598	HG	On-Demand	Anodyne	NOS1	46	39
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(F)c(F)c1	ZINC000875281599	HG	On-Demand	Anodyne	NOS1	46	39
CC(=O)Nc1cccc2c1CN(C(=O)NCc1cc3c(nc1O)CCC3)CC2	ZINC000875281687	GF	On-Demand	Anodyne	P2RY14	42	31
CC(=O)Nc1ccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281707	IF	On-Demand	Anodyne	FKBP1A	51	39
CC(=O)Nc1ccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281707	IF	On-Demand	Anodyne	CPT1A	21	43
CC(=O)Nc1ccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281707	IF	On-Demand	Anodyne	NOS1	41	38
CC(=O)Nc1ccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281708	IF	On-Demand	Anodyne	FKBP1A	51	39
CC(=O)Nc1ccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281708	IF	On-Demand	Anodyne	CPT1A	21	43
CC(=O)Nc1ccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281708	IF	On-Demand	Anodyne	NOS1	41	38
CN(C)S(=O)(=O)c1cccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875281710	JE	On-Demand	Anodyne	NOS1	38	41
CN(C)S(=O)(=O)c1cccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875281710	JE	On-Demand	Anodyne	ST14	39	46
CN(C)S(=O)(=O)c1cccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875281711	JE	On-Demand	Anodyne	NOS1	38	41
CN(C)S(=O)(=O)c1cccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875281711	JE	On-Demand	Anodyne	ST14	39	46
COc1ccccc1[C@@H]1CN(C(=O)NCCC(=O)Nc2ccccc2)CCO1	ZINC000875281720	GF	On-Demand	Anodyne	DRD4	19	42
COc1ccccc1[C@H]1CN(C(=O)NCCC(=O)Nc2ccccc2)CCO1	ZINC000875281721	GF	On-Demand	Anodyne	DRD4	19	42
CN1CCC(CNC(=O)NCC2CCSCC2)(c2ccccc2)CC1	ZINC000875281726	FG	On-Demand	Anodyne	KCNA3	53	40
CN1CCC(CNC(=O)NCC2CCSCC2)(c2ccccc2)CC1	ZINC000875281726	FG	On-Demand	Anodyne	SOAT1	18	42
CN1CCC(CNC(=O)NCC2CCSCC2)(c2ccccc2)CC1	ZINC000875281726	FG	On-Demand	Anodyne	CACNA1I	27	44
CCOC(=O)C1CCN(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875281728	IE	On-Demand	Anodyne	FKBP1A	55	39
CCOC(=O)C1CCN(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875281728	IE	On-Demand	Anodyne	PREP	50	36
CCOC(=O)C1CCN(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875281729	IE	On-Demand	Anodyne	FKBP1A	55	39
CCOC(=O)C1CCN(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875281729	IE	On-Demand	Anodyne	PREP	50	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1cccc(Oc2ccccc2)c1	ZINC000875281743	JJ	On-Demand	Anodyne	FKBP1A	67	47
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1cccc(Oc2ccccc2)c1	ZINC000875281743	JJ	On-Demand	Anodyne	CPT1A	84	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1cccc(Oc2ccccc2)c1	ZINC000875281743	JJ	On-Demand	Anodyne	CPT2	45	35
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1cccc(Oc2ccccc2)c1	ZINC000875281743	JJ	On-Demand	Anodyne	PREP	48	35
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1cccc(Oc2ccccc2)c1	ZINC000875281743	JJ	On-Demand	Anodyne	NOS1	41	45
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1cccc(Oc2ccccc2)c1	ZINC000875281744	JJ	On-Demand	Anodyne	FKBP1A	67	47
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1cccc(Oc2ccccc2)c1	ZINC000875281744	JJ	On-Demand	Anodyne	CPT1A	84	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1cccc(Oc2ccccc2)c1	ZINC000875281744	JJ	On-Demand	Anodyne	CPT2	45	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1cccc(Oc2ccccc2)c1	ZINC000875281744	JJ	On-Demand	Anodyne	PREP	48	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1cccc(Oc2ccccc2)c1	ZINC000875281744	JJ	On-Demand	Anodyne	NOS1	41	45
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1[N+](=O)[O-]	ZINC000875281752	HF	On-Demand	Bother	FKBP1A	41	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1[N+](=O)[O-]	ZINC000875281753	HF	On-Demand	Bother	FKBP1A	41	37
O=C(NCC1CCSCC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875281757	FG	On-Demand	Anodyne	SMO	37	53
O=C(NCC1CCSCC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875281757	FG	On-Demand	Anodyne	ETHR	63	50
CN1CCN(C2CCN(C(=O)C(=O)NCC(C)(C)CN3CCCC3)CC2)CC1	ZINC000875281758	GC	On-Demand	Anodyne	L3MBTL3	53	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc2ccccc2c1	ZINC000875281761	HI	On-Demand	Anodyne	FKBP1A	47	37
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc2ccccc2c1	ZINC000875281761	HI	On-Demand	Anodyne	CPT1A	53	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc2ccccc2c1	ZINC000875281761	HI	On-Demand	Anodyne	NOS1	45	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc2ccccc2c1	ZINC000875281762	HI	On-Demand	Anodyne	FKBP1A	47	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc2ccccc2c1	ZINC000875281762	HI	On-Demand	Anodyne	CPT1A	53	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc2ccccc2c1	ZINC000875281762	HI	On-Demand	Anodyne	NOS1	45	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1cccc(Br)c1	ZINC000875281765	IH	On-Demand	Anodyne	FKBP1A	56	35
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1cccc(Br)c1	ZINC000875281765	IH	On-Demand	Anodyne	PREP	40	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1cccc(Br)c1	ZINC000875281766	IH	On-Demand	Anodyne	FKBP1A	56	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1cccc(Br)c1	ZINC000875281766	IH	On-Demand	Anodyne	PREP	40	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1cc([N+](=O)[O-])ccc1F	ZINC000875281774	IF	On-Demand	Bother	LGMN	51	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1cc([N+](=O)[O-])ccc1F	ZINC000875281775	IF	On-Demand	Bother	LGMN	51	35
O=CN1CCCN(C(=O)NCCC(=O)Nc2ccccc2)CC1	ZINC000875281785	DC	On-Demand	Anodyne	HDAC10	26	42
O=CN1CCCN(C(=O)NCCC(=O)Nc2ccccc2)CC1	ZINC000875281785	DC	On-Demand	Anodyne	HDAC2	17	42
O=CN1CCCN(C(=O)NCCC(=O)Nc2ccccc2)CC1	ZINC000875281785	DC	On-Demand	Anodyne	HDAC3	19	42
O=CN1CCCN(C(=O)NCCC(=O)Nc2ccccc2)CC1	ZINC000875281785	DC	On-Demand	Anodyne	HDAC6	20	42
O=CN1CCCN(C(=O)NCCC(=O)Nc2ccccc2)CC1	ZINC000875281785	DC	On-Demand	Anodyne	HDAC11	20	42
COc1ccc(-c2csc(NC(=O)COC(=O)[C@H]3CCCCN3C(=O)c3cccs3)n2)cc1	ZINC000875281798	JI	On-Demand	Anodyne	FKBP1A	44	39
COc1ccc(-c2csc(NC(=O)COC(=O)[C@H]3CCCCN3C(=O)c3cccs3)n2)cc1	ZINC000875281798	JI	On-Demand	Anodyne	CPT1A	36	43
COc1ccc(-c2csc(NC(=O)COC(=O)[C@H]3CCCCN3C(=O)c3cccs3)n2)cc1	ZINC000875281798	JI	On-Demand	Anodyne	ROCK1	21	42
COc1ccc(-c2csc(NC(=O)COC(=O)[C@H]3CCCCN3C(=O)c3cccs3)n2)cc1	ZINC000875281798	JI	On-Demand	Anodyne	ROCK2	15	42
COc1ccc(-c2csc(NC(=O)COC(=O)[C@@H]3CCCCN3C(=O)c3cccs3)n2)cc1	ZINC000875281800	JI	On-Demand	Anodyne	FKBP1A	44	39
COc1ccc(-c2csc(NC(=O)COC(=O)[C@@H]3CCCCN3C(=O)c3cccs3)n2)cc1	ZINC000875281800	JI	On-Demand	Anodyne	CPT1A	36	43
COc1ccc(-c2csc(NC(=O)COC(=O)[C@@H]3CCCCN3C(=O)c3cccs3)n2)cc1	ZINC000875281800	JI	On-Demand	Anodyne	ROCK1	21	42
COc1ccc(-c2csc(NC(=O)COC(=O)[C@@H]3CCCCN3C(=O)c3cccs3)n2)cc1	ZINC000875281800	JI	On-Demand	Anodyne	ROCK2	15	42
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1cccc(F)c1	ZINC000875281803	GG	On-Demand	Anodyne	NOS1	43	42
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1cccc(F)c1	ZINC000875281804	GG	On-Demand	Anodyne	NOS1	43	42
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000875281808	JG	On-Demand	Bother	LGMN	45	34
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000875281810	JG	On-Demand	Bother	LGMN	45	34
O=C(OCC(=O)N1CCCCC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875281820	FE	On-Demand	Anodyne	FKBP1A	58	41
O=C(OCC(=O)N1CCCCC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875281820	FE	On-Demand	Anodyne	CPT1A	42	36
O=C(OCC(=O)N1CCCCC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875281820	FE	On-Demand	Anodyne	CPT2	44	34
O=C(OCC(=O)N1CCCCC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875281820	FE	On-Demand	Anodyne	PREP	97	40
O=C(OCC(=O)N1CCCCC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875281821	FE	On-Demand	Anodyne	FKBP1A	58	41
O=C(OCC(=O)N1CCCCC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875281821	FE	On-Demand	Anodyne	CPT1A	42	36
O=C(OCC(=O)N1CCCCC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875281821	FE	On-Demand	Anodyne	CPT2	44	34
O=C(OCC(=O)N1CCCCC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875281821	FE	On-Demand	Anodyne	PREP	97	40
O=C(NCc1ccc(-c2cccnc2)cc1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875281822	GF	On-Demand	Anodyne	CHRNA7	40	39
O=C(NCc1ccc(-c2cccnc2)cc1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875281822	GF	On-Demand	Anodyne	NAMPT	60	38
NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875281868	ID	On-Demand	Anodyne	CA7	32	50
NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875281868	ID	On-Demand	Anodyne	CA12	15	50
NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)COC(=O)CCCOc1ccc(F)cc1	ZINC000875281868	ID	On-Demand	Anodyne	EIF2AK3	66	35
CC(=O)c1ccc(N2CCN(C(=O)COC(=O)CCCOc3ccc(F)cc3)CC2)c(F)c1	ZINC000875281874	JG	On-Demand	Anodyne	SLC6A9	24	45
CSc1ccc(NC(=O)COC(=O)CCCOc2ccc(F)cc2)cc1	ZINC000875281876	GH	On-Demand	Anodyne	LTA4H	31	43
CSc1ccc(NC(=O)COC(=O)CCCOc2ccc(F)cc2)cc1	ZINC000875281876	GH	On-Demand	Anodyne	FAAH	21	43
C[C@H](NC(=O)/C=C\c1cnc2ccccc2n1)c1ccc(Cl)c(Cl)c1	ZINC000875281879	FJ	On-Demand	Anodyne	KCNQ2	58	48
C[C@H](NC(=O)/C=C\c1cnc2ccccc2n1)c1ccc(Cl)c(Cl)c1	ZINC000875281879	FJ	On-Demand	Anodyne	UL26	75	38
C[C@H](NC(=O)/C=C\c1cnc2ccccc2n1)c1ccc(Cl)c(Cl)c1	ZINC000875281879	FJ	On-Demand	Anodyne	SCAF_EBVB9	60	38
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)NC(=O)Nc1ccc2c(c1)OCCO2	ZINC000875281905	IG	On-Demand	Anodyne	EPHX2	15	43
O=C(NCc1ccc(-c2cccnc2)cc1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875281906	GF	On-Demand	Anodyne	CHRNA7	40	39
O=C(NCc1ccc(-c2cccnc2)cc1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875281906	GF	On-Demand	Anodyne	NAMPT	60	38
O=C(NCc1ccc(-c2cccnc2)cc1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875281907	GF	On-Demand	Anodyne	CHRNA7	40	39
O=C(NCc1ccc(-c2cccnc2)cc1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875281907	GF	On-Demand	Anodyne	NAMPT	60	38
O=C(NCc1ccc(-c2cccnc2)cc1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875281908	GF	On-Demand	Anodyne	CHRNA7	40	39
O=C(NCc1ccc(-c2cccnc2)cc1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875281908	GF	On-Demand	Anodyne	NAMPT	60	38
CC(=O)C1CCN(C(=O)NCCC(=O)Nc2ccccc2)CC1	ZINC000875281909	DE	On-Demand	Anodyne	HDAC10	23	41
CC(=O)C1CCN(C(=O)NCCC(=O)Nc2ccccc2)CC1	ZINC000875281909	DE	On-Demand	Anodyne	HDAC3	16	41
CC(=O)C1CCN(C(=O)NCCC(=O)Nc2ccccc2)CC1	ZINC000875281909	DE	On-Demand	Anodyne	EPHX2	39	42
CC(=O)C1CCN(C(=O)NCCC(=O)Nc2ccccc2)CC1	ZINC000875281909	DE	On-Demand	Anodyne	HDAC11	23	41
O=C(CCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)Nc1ccccc1	ZINC000875281910	FF	On-Demand	Anodyne	ACE	26	47
O=C(CCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)Nc1ccccc1	ZINC000875281911	FF	On-Demand	Anodyne	ACE	26	47
O=C(CCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)Nc1ccccc1	ZINC000875281912	FF	On-Demand	Anodyne	ACE	26	47
O=C(CCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)Nc1ccccc1	ZINC000875281913	FF	On-Demand	Anodyne	ACE	26	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCC(=O)Nc1ccccc1	ZINC000875281914	ED	On-Demand	Anodyne	SLC6A4	29	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCC(=O)Nc1ccccc1	ZINC000875281914	ED	On-Demand	Anodyne	SLC6A3	60	47
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NN=C(c1ccccc1)c1ccccc1	ZINC000875281918	JH	On-Demand	Reactive	FKBP1A	52	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NN=C(c1ccccc1)c1ccccc1	ZINC000875281918	JH	On-Demand	Reactive	CPT1A	40	37
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NN=C(c1ccccc1)c1ccccc1	ZINC000875281918	JH	On-Demand	Reactive	PREP	57	36
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NN=C(c1ccccc1)c1ccccc1	ZINC000875281919	JH	On-Demand	Reactive	FKBP1A	52	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NN=C(c1ccccc1)c1ccccc1	ZINC000875281919	JH	On-Demand	Reactive	CPT1A	40	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NN=C(c1ccccc1)c1ccccc1	ZINC000875281919	JH	On-Demand	Reactive	PREP	57	36
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(-c3cccnc3)cc2)CC1	ZINC000875281930	FE	On-Demand	Anodyne	CHRNA7	33	40
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(-c3cccnc3)cc2)CC1	ZINC000875281930	FE	On-Demand	Anodyne	NAMPT	114	43
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1cccc(C(F)(F)F)c1	ZINC000875281934	II	On-Demand	Anodyne	FKBP1A	54	35
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1cccc(C(F)(F)F)c1	ZINC000875281934	II	On-Demand	Anodyne	CCR2	42	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1cccc(C(F)(F)F)c1	ZINC000875281935	II	On-Demand	Anodyne	FKBP1A	54	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1cccc(C(F)(F)F)c1	ZINC000875281935	II	On-Demand	Anodyne	CCR2	42	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC[C@@H]1CCCO1	ZINC000875281936	GD	On-Demand	Anodyne	FKBP1A	44	37
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC[C@H]1CCCO1	ZINC000875281937	GD	On-Demand	Anodyne	FKBP1A	44	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC[C@@H]1CCCO1	ZINC000875281938	GD	On-Demand	Anodyne	FKBP1A	44	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC[C@H]1CCCO1	ZINC000875281939	GD	On-Demand	Anodyne	FKBP1A	44	37
C[C@H](NC(=O)NCCC(=O)Nc1ccccc1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875281946	GF	On-Demand	Anodyne	LTA4H	19	42
C[C@H](NC(=O)NCCC(=O)Nc1ccccc1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875281946	GF	On-Demand	Anodyne	GPR119	16	40
C[C@@H](NC(=O)NCCC(=O)Nc1ccccc1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875281947	GF	On-Demand	Anodyne	LTA4H	19	42
C[C@@H](NC(=O)NCCC(=O)Nc1ccccc1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875281947	GF	On-Demand	Anodyne	GPR119	16	40
O=C(NCc1ccnc(OC2CCOCC2)c1)NNc1cccc(F)c1Cl	ZINC000875281948	GG	On-Demand	Reactive	MAPK1	49	32
CN1CCN(C2CCN(C(=O)NCCC(=O)Nc3ccccc3)CC2)CC1	ZINC000875281950	FD	On-Demand	Anodyne	EPHX2	25	40
CN1CCN(C2CCN(C(=O)NCCC(=O)Nc3ccccc3)CC2)CC1	ZINC000875281950	FD	On-Demand	Anodyne	L3MBTL3	78	42
Cc1ccc(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281964	FG	On-Demand	Anodyne	FKBP1A	62	38
Cc1ccc(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281964	FG	On-Demand	Anodyne	PREP	42	38
Cc1ccc(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281965	FG	On-Demand	Anodyne	FKBP1A	62	38
Cc1ccc(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281965	FG	On-Demand	Anodyne	PREP	42	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1c(Cl)cccc1Cl	ZINC000875281969	II	On-Demand	Anodyne	FKBP1A	43	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1c(Cl)cccc1Cl	ZINC000875281969	II	On-Demand	Anodyne	PREP	45	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1c(Cl)cccc1Cl	ZINC000875281970	II	On-Demand	Anodyne	FKBP1A	43	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1c(Cl)cccc1Cl	ZINC000875281970	II	On-Demand	Anodyne	PREP	45	38
CC[C@@H](C)c1ccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281981	II	On-Demand	Anodyne	FKBP1A	48	38
CC[C@@H](C)c1ccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875281984	II	On-Demand	Anodyne	FKBP1A	48	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1I	ZINC000875281985	JH	On-Demand	Anodyne	FKBP1A	47	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1I	ZINC000875281986	JH	On-Demand	Anodyne	FKBP1A	47	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1cccc([N+](=O)[O-])c1	ZINC000875281989	HF	On-Demand	Bother	NOS1	36	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1cccc([N+](=O)[O-])c1	ZINC000875281990	HF	On-Demand	Bother	NOS1	36	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC1CCCCCC1	ZINC000875281991	GG	On-Demand	Anodyne	FKBP1A	63	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC1CCCCCC1	ZINC000875281991	GG	On-Demand	Anodyne	PREP	45	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC1CCCCCC1	ZINC000875281992	GG	On-Demand	Anodyne	FKBP1A	63	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC1CCCCCC1	ZINC000875281992	GG	On-Demand	Anodyne	PREP	45	38
CC(C)c1ccccc1NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875281993	HI	On-Demand	Anodyne	FKBP1A	57	38
CC(C)c1ccccc1NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875281994	HI	On-Demand	Anodyne	FKBP1A	57	38
C[C@]1(C(F)(F)F)CCN(C(=O)NCCC(=O)Nc2ccccc2)C1	ZINC000875282003	EF	On-Demand	Anodyne	EPHX2	36	41
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)NCC(C1CC1)C1CC1	ZINC000875282006	FE	On-Demand	Anodyne	ROCK1	25	40
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)NCC(C1CC1)C1CC1	ZINC000875282006	FE	On-Demand	Anodyne	ROCK2	15	40
O=C(CCCOc1ccc(F)cc1)OCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000875282013	FG	On-Demand	Bother	CACNA1C	45	39
O=C(CCCOc1ccc(F)cc1)OCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000875282013	FG	On-Demand	Bother	CACNA1D	71	39
O=C(CCCOc1ccc(F)cc1)OCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000875282013	FG	On-Demand	Bother	ACR	18	46
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)N1CCN(c2ccccc2)CC1	ZINC000875282052	HG	On-Demand	Anodyne	HTR1A	18	53
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)N1CCN(c2ccccc2)CC1	ZINC000875282052	HG	On-Demand	Anodyne	HTR2A	16	53
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)N1CCN(c2ccccc2)CC1	ZINC000875282052	HG	On-Demand	Anodyne	P2RY12	59	35
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)N1CCN(c2ccccc2)CC1	ZINC000875282052	HG	On-Demand	Anodyne	HRH3	19	40
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)NC(=O)NCc1ccccc1	ZINC000875282065	HF	On-Demand	Anodyne	LTA4H	31	41
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)NC(=O)NCc1ccccc1	ZINC000875282065	HF	On-Demand	Anodyne	PDS	59	39
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000875282074	HI	On-Demand	Mild	TRPV4	40	31
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)c1nc(-c2ccccc2)no1	ZINC000875282100	FI	On-Demand	Anodyne	PPARG	50	42
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)c1nc(-c2ccccc2)no1	ZINC000875282100	FI	On-Demand	Anodyne	PPARA	56	42
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)NC(=O)Nc1ccccc1	ZINC000875282105	GG	On-Demand	Anodyne	LTA4H	35	41
C[C@@H](OC(=O)CCCOc1ccc(F)cc1)C(=O)NC(=O)Nc1ccccc1	ZINC000875282105	GG	On-Demand	Anodyne	EPHX2	18	43
O=C(NC1CCN(C(=O)NCC2CCSCC2)CC1)OCc1ccccc1	ZINC000875282107	GG	On-Demand	Anodyne	DRD4	15	42
O=C(NC1CCN(C(=O)NCC2CCSCC2)CC1)OCc1ccccc1	ZINC000875282107	GG	On-Demand	Anodyne	GRIN2B	38	44
O=C(NC1CCN(C(=O)NCC2CCSCC2)CC1)OCc1ccccc1	ZINC000875282107	GG	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NC1CCN(C(=O)NCC2CCSCC2)CC1)OCc1ccccc1	ZINC000875282107	GG	On-Demand	Anodyne	CTSB	22	53
O=C(NC1CCN(C(=O)NCC2CCSCC2)CC1)OCc1ccccc1	ZINC000875282107	GG	On-Demand	Anodyne	CTSK	25	53
O=C(NC1CCN(C(=O)NCC2CCSCC2)CC1)OCc1ccccc1	ZINC000875282107	GG	On-Demand	Anodyne	CTSL	30	53
O=C(NC1CCN(C(=O)NCC2CCSCC2)CC1)OCc1ccccc1	ZINC000875282107	GG	On-Demand	Anodyne	PREP	24	42
O=C(NC1CCN(C(=O)NCC2CCSCC2)CC1)OCc1ccccc1	ZINC000875282107	GG	On-Demand	Anodyne	CAPN2	47	37
O=C(NC1CCN(C(=O)NCC2CCSCC2)CC1)OCc1ccccc1	ZINC000875282107	GG	On-Demand	Anodyne	EPHX2	54	40
O=C(NC1CCN(C(=O)NCC2CCSCC2)CC1)OCc1ccccc1	ZINC000875282107	GG	On-Demand	Anodyne	TGM2	36	45
O=C(NC1CCN(C(=O)NCC2CCSCC2)CC1)OCc1ccccc1	ZINC000875282107	GG	On-Demand	Anodyne	DPP7	23	56
O=C(NC1CCN(C(=O)NCC2CCSCC2)CC1)OCc1ccccc1	ZINC000875282107	GG	On-Demand	Anodyne	F13A1	27	45
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(C(F)(F)F)cc1	ZINC000875282112	IH	On-Demand	Anodyne	FKBP1A	41	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(C(F)(F)F)cc1	ZINC000875282112	IH	On-Demand	Anodyne	TRPM8	41	36
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(C(F)(F)F)cc1	ZINC000875282113	IH	On-Demand	Anodyne	FKBP1A	41	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(C(F)(F)F)cc1	ZINC000875282113	IH	On-Demand	Anodyne	TRPM8	41	36
CCOC(=O)[C@H](C)C1CN(C(=O)NCCC(=O)Nc2ccccc2)C1	ZINC000875282124	ED	On-Demand	Anodyne	P2RY12	40	35
CCOC(=O)[C@H](C)C1CN(C(=O)NCCC(=O)Nc2ccccc2)C1	ZINC000875282124	ED	On-Demand	Anodyne	LTA4H	24	43
N#Cc1cccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875282126	GF	On-Demand	Mild	CPT1A	31	42
N#Cc1cccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875282126	GF	On-Demand	Mild	NOS1	37	41
N#Cc1cccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875282126	GF	On-Demand	Mild	LGMN	54	33
N#Cc1cccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875282127	GF	On-Demand	Mild	CPT1A	31	42
N#Cc1cccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875282127	GF	On-Demand	Mild	NOS1	37	41
N#Cc1cccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875282127	GF	On-Demand	Mild	LGMN	54	33
O=C(CCNC(=O)NC[C@H]1C[C@H](O)C1)Nc1ccccc1	ZINC000875282128	CD	On-Demand	Anodyne	HDAC10	18	42
O=C(CCNC(=O)NC[C@H]1C[C@H](O)C1)Nc1ccccc1	ZINC000875282128	CD	On-Demand	Anodyne	HDAC11	19	42
CN(C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)C1CCCCC1	ZINC000875282130	GG	On-Demand	Anodyne	FKBP1A	56	40
CN(C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)C1CCCCC1	ZINC000875282130	GG	On-Demand	Anodyne	PREP	47	35
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1cc([N+](=O)[O-])ccc1Cl	ZINC000875282141	JG	On-Demand	Bother	LGMN	45	34
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1cc([N+](=O)[O-])ccc1Cl	ZINC000875282142	JG	On-Demand	Bother	LGMN	45	34
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875282143	FG	On-Demand	Anodyne	FKBP1A	82	42
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875282143	FG	On-Demand	Anodyne	CPT1A	70	39
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875282143	FG	On-Demand	Anodyne	CPT2	44	34
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875282143	FG	On-Demand	Anodyne	PREP	87	40
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875282144	FG	On-Demand	Anodyne	FKBP1A	82	42
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875282144	FG	On-Demand	Anodyne	CPT1A	70	39
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875282144	FG	On-Demand	Anodyne	CPT2	44	34
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875282144	FG	On-Demand	Anodyne	PREP	87	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc2c(c1)OCCO2	ZINC000875282162	IF	On-Demand	Anodyne	NOS1	45	39
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc2c(c1)OCCO2	ZINC000875282163	IF	On-Demand	Anodyne	NOS1	45	39
O=C(NCc1ccc(-c2cccnc2)cc1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875282165	FF	On-Demand	Anodyne	NAMPT	67	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1Oc1ccccc1	ZINC000875282172	JJ	On-Demand	Anodyne	FKBP1A	61	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1Oc1ccccc1	ZINC000875282172	JJ	On-Demand	Anodyne	CPT1A	60	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1Oc1ccccc1	ZINC000875282172	JJ	On-Demand	Anodyne	CPT2	43	34
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1Oc1ccccc1	ZINC000875282173	JJ	On-Demand	Anodyne	FKBP1A	61	40
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1Oc1ccccc1	ZINC000875282173	JJ	On-Demand	Anodyne	CPT1A	60	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1Oc1ccccc1	ZINC000875282173	JJ	On-Demand	Anodyne	CPT2	43	34
O=C(NCC1CCSCC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875282177	EF	On-Demand	Anodyne	EPHX2	19	42
O=C(NCC1CCSCC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875282178	EF	On-Demand	Anodyne	EPHX2	19	42
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(F)cc1	ZINC000875282180	HF	On-Demand	Anodyne	FKBP1A	68	42
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(F)cc1	ZINC000875282180	HF	On-Demand	Anodyne	PREP	44	37
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(F)cc1	ZINC000875282180	HF	On-Demand	Anodyne	LGMN	63	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(F)cc1	ZINC000875282181	HF	On-Demand	Anodyne	FKBP1A	68	42
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(F)cc1	ZINC000875282181	HF	On-Demand	Anodyne	PREP	44	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(F)cc1	ZINC000875282181	HF	On-Demand	Anodyne	LGMN	63	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc(Cl)s1	ZINC000875282182	GH	On-Demand	Anodyne	FKBP1A	42	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc(Cl)s1	ZINC000875282183	GH	On-Demand	Anodyne	FKBP1A	42	36
CC[C@H](C[C@H](C)O)NC(=O)NCCC(=O)Nc1ccccc1	ZINC000875282186	DD	On-Demand	Anodyne	LTA4H	21	41
Cc1cc(C)cc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875282194	HH	On-Demand	Anodyne	FKBP1A	55	38
Cc1cc(C)cc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875282194	HH	On-Demand	Anodyne	PREP	40	38
Cc1cc(C)cc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875282194	HH	On-Demand	Anodyne	NOS1	40	38
Cc1cc(C)cc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875282195	HH	On-Demand	Anodyne	FKBP1A	55	38
Cc1cc(C)cc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875282195	HH	On-Demand	Anodyne	PREP	40	38
Cc1cc(C)cc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875282195	HH	On-Demand	Anodyne	NOS1	40	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(Oc2ccccc2)cc1	ZINC000875282198	JJ	On-Demand	Anodyne	FKBP1A	66	43
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(Oc2ccccc2)cc1	ZINC000875282198	JJ	On-Demand	Anodyne	LTA4H	51	42
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(Oc2ccccc2)cc1	ZINC000875282198	JJ	On-Demand	Anodyne	CPT1A	71	42
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(Oc2ccccc2)cc1	ZINC000875282198	JJ	On-Demand	Anodyne	CPT2	44	34
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(Oc2ccccc2)cc1	ZINC000875282198	JJ	On-Demand	Anodyne	PREP	43	36
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(Oc2ccccc2)cc1	ZINC000875282199	JJ	On-Demand	Anodyne	FKBP1A	66	43
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(Oc2ccccc2)cc1	ZINC000875282199	JJ	On-Demand	Anodyne	LTA4H	51	42
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(Oc2ccccc2)cc1	ZINC000875282199	JJ	On-Demand	Anodyne	CPT1A	71	42
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(Oc2ccccc2)cc1	ZINC000875282199	JJ	On-Demand	Anodyne	CPT2	44	34
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(Oc2ccccc2)cc1	ZINC000875282199	JJ	On-Demand	Anodyne	PREP	43	36
O=C(NCC1CCSCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875282203	EG	On-Demand	Anodyne	F2	30	43
O=C(NCC1CCSCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875282203	EG	On-Demand	Anodyne	PREP	49	37
O=C(NCC1CCSCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875282204	EG	On-Demand	Anodyne	F2	30	43
O=C(NCC1CCSCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875282204	EG	On-Demand	Anodyne	PREP	49	37
O=C(NCC1CCSCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875282205	EG	On-Demand	Anodyne	F2	30	43
O=C(NCC1CCSCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875282205	EG	On-Demand	Anodyne	PREP	49	37
Cn1nc(Cl)c(C(=O)NC2(c3ccccc3)CC2)c1Cl	ZINC000875282208	DG	On-Demand	Anodyne	TACR3	22	45
O=C(NCc1cc2c(nc1O)CCC2)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875282224	FF	On-Demand	Anodyne	EPHX2	20	53
C[C@H](NC(=O)C(=O)NCC(C1CC1)C1CC1)c1ccc(C(F)(F)F)nc1	ZINC000875282228	FF	On-Demand	Anodyne	TRPV1	51	33
O=C(CCCOc1ccc(F)cc1)OCc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875282235	HH	On-Demand	Anodyne	LTA4H	18	42
O=C(CCCOc1ccc(F)cc1)OCc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000875282235	HH	On-Demand	Anodyne	ADAMTS4	15	41
CC[C@H](C[C@H](C)O)NC(=O)NCCc1ccc(F)cc1Cl	ZINC000875282244	DF	On-Demand	Anodyne	P2RX7	44	40
Cc1ccnn1CC(=O)Nc1ccccc1S(=O)(=O)C(C)C	ZINC000875282249	DE	On-Demand	Anodyne	ALK	31	41
O=C(OCCOc1cccc(Cl)c1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282253	GI	On-Demand	Anodyne	FKBP1A	102	44
O=C(OCCOc1cccc(Cl)c1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282253	GI	On-Demand	Anodyne	CPT1A	49	42
O=C(OCCOc1cccc(Cl)c1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282253	GI	On-Demand	Anodyne	CPT2	45	42
O=C(OCCOc1cccc(Cl)c1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282254	GI	On-Demand	Anodyne	FKBP1A	102	44
O=C(OCCOc1cccc(Cl)c1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282254	GI	On-Demand	Anodyne	CPT1A	49	42
O=C(OCCOc1cccc(Cl)c1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282254	GI	On-Demand	Anodyne	CPT2	45	42
CC[C@H](C#N)Oc1cc(CNC(=O)N(C)CC(O)(CC)CC)ccc1OC	ZINC000875282258	GG	On-Demand	Mild	MT-ND1	19	40
COc1ccccc1[C@@H]1CSCCCN1C(=O)NC[C@]1(C)CCOC1	ZINC000875282261	FG	On-Demand	Anodyne	HCN1	57	36
COc1ccccc1[C@@H]1CSCCCN1C(=O)NC[C@]1(C)CCOC1	ZINC000875282261	FG	On-Demand	Anodyne	HCN4	48	34
COc1ccccc1[C@@H]1CSCCCN1C(=O)NC[C@@]1(C)CCOC1	ZINC000875282263	FG	On-Demand	Anodyne	HCN1	57	36
COc1ccccc1[C@@H]1CSCCCN1C(=O)NC[C@@]1(C)CCOC1	ZINC000875282263	FG	On-Demand	Anodyne	HCN4	48	34
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@]2(C)CCOC2)CC1	ZINC000875282267	EG	On-Demand	Anodyne	HCN1	58	37
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@]2(C)CCOC2)CC1	ZINC000875282267	EG	On-Demand	Anodyne	HCN4	49	34
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@@]2(C)CCOC2)CC1	ZINC000875282269	EG	On-Demand	Anodyne	HCN1	58	37
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@@]2(C)CCOC2)CC1	ZINC000875282269	EG	On-Demand	Anodyne	HCN4	49	34
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@@]2(C)CCOC2)CC1	ZINC000875282271	EG	On-Demand	Anodyne	HCN1	58	37
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@@]2(C)CCOC2)CC1	ZINC000875282271	EG	On-Demand	Anodyne	HCN4	49	34
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@]2(C)CCOC2)CC1	ZINC000875282273	EG	On-Demand	Anodyne	HCN1	58	37
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@]2(C)CCOC2)CC1	ZINC000875282273	EG	On-Demand	Anodyne	HCN4	49	34
CC[C@@H](C)c1ccc(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875282274	HJ	On-Demand	Anodyne	FKBP1A	62	39
O=C(NCC(C1CC1)C1CC1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875282287	GF	On-Demand	Anodyne	ETHR	57	50
CC[C@H](C)c1ccc(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875282295	HJ	On-Demand	Anodyne	FKBP1A	62	39
CC[C@H](C)c1ccc(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875282298	HJ	On-Demand	Anodyne	FKBP1A	62	39
CC[C@@H](C)c1ccc(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875282300	HJ	On-Demand	Anodyne	FKBP1A	62	39
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2ccc(F)cc2Cl)C1	ZINC000875282304	FF	On-Demand	Anodyne	P2RX7	69	41
CC(C)(C)NC(=O)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282312	GD	On-Demand	Anodyne	FKBP1A	66	43
CC(C)(C)NC(=O)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282314	GD	On-Demand	Anodyne	FKBP1A	66	43
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1cccs1	ZINC000875282315	GF	On-Demand	Anodyne	FKBP1A	67	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1cccs1	ZINC000875282315	GF	On-Demand	Anodyne	PREP	47	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1cccs1	ZINC000875282318	GF	On-Demand	Anodyne	FKBP1A	67	40
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1cccs1	ZINC000875282318	GF	On-Demand	Anodyne	PREP	47	35
N#Cc1ccsc1NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282333	HF	On-Demand	Mild	PREP	40	37
N#Cc1ccsc1NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282333	HF	On-Demand	Mild	LGMN	56	33
N#Cc1ccsc1NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282340	HF	On-Demand	Mild	PREP	40	37
N#Cc1ccsc1NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282340	HF	On-Demand	Mild	LGMN	56	33
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(C3CCCCC3)CC2)CC1	ZINC000875282342	FD	On-Demand	Anodyne	EPHX2	15	47
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(C3CCCCC3)CC2)CC1	ZINC000875282342	FD	On-Demand	Anodyne	L3MBTL3	53	35
COC(=O)C1(O)CN(C(=O)NCCc2ccc(F)cc2Cl)C1	ZINC000875282356	EC	On-Demand	Anodyne	P2RX7	68	41
C=CCNC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282357	ED	On-Demand	Mild	FKBP1A	59	39
C=CCNC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282357	ED	On-Demand	Mild	PREP	44	34
C=CCNC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282358	ED	On-Demand	Mild	FKBP1A	59	39
C=CCNC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282358	ED	On-Demand	Mild	PREP	44	34
O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282360	IG	On-Demand	Bother	LGMN	62	32
O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282361	IG	On-Demand	Bother	LGMN	62	32
Cc1ccc(CNC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875282364	HF	On-Demand	Anodyne	FKBP1A	91	41
Cc1ccc(CNC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875282364	HF	On-Demand	Anodyne	PREP	48	37
Cc1ccc(CNC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875282364	HF	On-Demand	Anodyne	LGMN	69	38
Cc1ccc(CNC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875282365	HF	On-Demand	Anodyne	FKBP1A	91	41
Cc1ccc(CNC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875282365	HF	On-Demand	Anodyne	PREP	48	37
Cc1ccc(CNC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875282365	HF	On-Demand	Anodyne	LGMN	69	38
CC[C@H](C#N)Oc1cc(CNC(=O)NCc2cccc3[nH]ccc23)ccc1OC	ZINC000875282376	GH	On-Demand	Mild	CTSL	17	40
C=C(C)CN(CC)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282382	GF	On-Demand	Mild	FKBP1A	56	38
C=C(C)CN(CC)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282383	GF	On-Demand	Mild	FKBP1A	56	38
O=C(NCC1CCSCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875282406	EG	On-Demand	Anodyne	F2	30	43
O=C(NCC1CCSCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875282406	EG	On-Demand	Anodyne	PREP	49	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(Cl)cn1	ZINC000875282407	HF	On-Demand	Anodyne	F10	40	30
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(Cl)cn1	ZINC000875282407	HF	On-Demand	Anodyne	CPT1A	51	36
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(Cl)cn1	ZINC000875282407	HF	On-Demand	Anodyne	PREP	45	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(Cl)cn1	ZINC000875282408	HF	On-Demand	Anodyne	F10	40	30
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(Cl)cn1	ZINC000875282408	HF	On-Demand	Anodyne	CPT1A	51	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(Cl)cn1	ZINC000875282408	HF	On-Demand	Anodyne	PREP	45	38
C[C@]1(C(F)(F)F)CN(C(=O)NCCC(=O)Nc2ccccc2)CCO1	ZINC000875282411	FE	On-Demand	Anodyne	EPHX2	34	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCCCc1ccccc1	ZINC000875282415	HG	On-Demand	Anodyne	FKBP1A	102	50
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCCCc1ccccc1	ZINC000875282415	HG	On-Demand	Anodyne	TRY1_BOVIN	54	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCCCc1ccccc1	ZINC000875282415	HG	On-Demand	Anodyne	PREP	98	43
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCCCc1ccccc1	ZINC000875282416	HG	On-Demand	Anodyne	FKBP1A	102	50
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCCCc1ccccc1	ZINC000875282416	HG	On-Demand	Anodyne	TRY1_BOVIN	54	37
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCCCc1ccccc1	ZINC000875282416	HG	On-Demand	Anodyne	PREP	98	43
O=C(OCC(=O)N1CCN(C(=O)c2ccco2)CC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282425	JD	On-Demand	Anodyne	FKBP1A	47	41
O=C(OCC(=O)N1CCN(C(=O)c2ccco2)CC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282425	JD	On-Demand	Anodyne	PREP	56	36
O=C(OCC(=O)N1CCN(C(=O)c2ccco2)CC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282426	JD	On-Demand	Anodyne	FKBP1A	47	41
O=C(OCC(=O)N1CCN(C(=O)c2ccco2)CC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282426	JD	On-Demand	Anodyne	PREP	56	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1cccc(I)c1	ZINC000875282432	JH	On-Demand	Anodyne	NOS1	43	42
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1cccc(I)c1	ZINC000875282433	JH	On-Demand	Anodyne	NOS1	43	42
CCN(Cc1ccccc1)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282434	HG	On-Demand	Anodyne	FKBP1A	100	44
CCN(Cc1ccccc1)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282434	HG	On-Demand	Anodyne	PREP	71	38
CCN(Cc1ccccc1)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282435	HG	On-Demand	Anodyne	FKBP1A	100	44
CCN(Cc1ccccc1)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282435	HG	On-Demand	Anodyne	PREP	71	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000875282441	JI	On-Demand	Anodyne	CPT1A	28	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000875282441	JI	On-Demand	Anodyne	ROCK1	19	40
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000875282442	JI	On-Demand	Anodyne	CPT1A	28	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000875282442	JI	On-Demand	Anodyne	ROCK1	19	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(-c2ccccc2)cc1	ZINC000875282443	IJ	On-Demand	Anodyne	FKBP1A	54	42
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(-c2ccccc2)cc1	ZINC000875282443	IJ	On-Demand	Anodyne	HCRTR1	15	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(-c2ccccc2)cc1	ZINC000875282443	IJ	On-Demand	Anodyne	CPT1A	54	42
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(-c2ccccc2)cc1	ZINC000875282443	IJ	On-Demand	Anodyne	PREP	49	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(-c2ccccc2)cc1	ZINC000875282443	IJ	On-Demand	Anodyne	NOS1	34	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(-c2ccccc2)cc1	ZINC000875282443	IJ	On-Demand	Anodyne	LGMN	56	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(-c2ccccc2)cc1	ZINC000875282444	IJ	On-Demand	Anodyne	FKBP1A	54	42
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(-c2ccccc2)cc1	ZINC000875282444	IJ	On-Demand	Anodyne	HCRTR1	15	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(-c2ccccc2)cc1	ZINC000875282444	IJ	On-Demand	Anodyne	CPT1A	54	42
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(-c2ccccc2)cc1	ZINC000875282444	IJ	On-Demand	Anodyne	PREP	49	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(-c2ccccc2)cc1	ZINC000875282444	IJ	On-Demand	Anodyne	NOS1	34	40
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(-c2ccccc2)cc1	ZINC000875282444	IJ	On-Demand	Anodyne	LGMN	56	37
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCCc1ccc(F)cc1	ZINC000875282450	HF	On-Demand	Anodyne	FKBP1A	66	43
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCCc1ccc(F)cc1	ZINC000875282450	HF	On-Demand	Anodyne	PREP	54	36
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCCc1ccc(F)cc1	ZINC000875282451	HF	On-Demand	Anodyne	FKBP1A	66	43
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCCc1ccc(F)cc1	ZINC000875282451	HF	On-Demand	Anodyne	PREP	54	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1-c1ccccc1	ZINC000875282452	IJ	On-Demand	Anodyne	FKBP1A	47	39
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1-c1ccccc1	ZINC000875282452	IJ	On-Demand	Anodyne	HCRTR1	19	43
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1-c1ccccc1	ZINC000875282452	IJ	On-Demand	Anodyne	PREP	44	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1-c1ccccc1	ZINC000875282453	IJ	On-Demand	Anodyne	FKBP1A	47	39
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1-c1ccccc1	ZINC000875282453	IJ	On-Demand	Anodyne	HCRTR1	19	43
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1-c1ccccc1	ZINC000875282453	IJ	On-Demand	Anodyne	PREP	44	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC1CC1	ZINC000875282455	ED	On-Demand	Anodyne	FKBP1A	65	39
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC1CC1	ZINC000875282455	ED	On-Demand	Anodyne	PREP	48	37
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC1CC1	ZINC000875282456	ED	On-Demand	Anodyne	FKBP1A	65	39
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC1CC1	ZINC000875282456	ED	On-Demand	Anodyne	PREP	48	37
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccc(-c3cccnc3)cc2)C1	ZINC000875282459	FE	On-Demand	Anodyne	CYP11B2	20	40
CC(C)(C)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282460	FE	On-Demand	Anodyne	FKBP1A	75	45
CC(C)(C)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282460	FE	On-Demand	Anodyne	PREP	50	38
CC(C)(C)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282462	FE	On-Demand	Anodyne	FKBP1A	75	45
CC(C)(C)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282462	FE	On-Demand	Anodyne	PREP	50	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(I)cc1	ZINC000875282465	JH	On-Demand	Anodyne	FKBP1A	40	39
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(I)cc1	ZINC000875282467	JH	On-Demand	Anodyne	FKBP1A	40	39
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC1C2CC3CC(C2)CC1C3	ZINC000875282475	IG	On-Demand	Anodyne	FKBP1A	35	44
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC1C2CC3CC(C2)CC1C3	ZINC000875282475	IG	On-Demand	Anodyne	HSD11B1	55	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC1C2CC3CC(C2)CC1C3	ZINC000875282476	IG	On-Demand	Anodyne	FKBP1A	35	44
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC1C2CC3CC(C2)CC1C3	ZINC000875282476	IG	On-Demand	Anodyne	HSD11B1	55	36
O=C(OCC(=O)N1c2ccccc2Sc2ccccc21)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282481	JK	On-Demand	Anodyne	FKBP1A	50	39
O=C(OCC(=O)N1c2ccccc2Sc2ccccc21)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282481	JK	On-Demand	Anodyne	PREP	64	34
O=C(OCC(=O)N1c2ccccc2Sc2ccccc21)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282482	JK	On-Demand	Anodyne	FKBP1A	50	39
O=C(OCC(=O)N1c2ccccc2Sc2ccccc21)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282482	JK	On-Demand	Anodyne	PREP	64	34
CCO[C@H]1COCC[C@H]1CC(=O)Nc1ccccc1S(=O)(=O)C(C)C	ZINC000875282489	FF	On-Demand	Anodyne	TIMP3	55	31
CCO[C@H]1COCC[C@@H]1CC(=O)Nc1ccccc1S(=O)(=O)C(C)C	ZINC000875282490	FF	On-Demand	Anodyne	TIMP3	55	31
CC(=O)c1ccccc1NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282491	HG	On-Demand	Anodyne	FKBP1A	53	41
CC(=O)c1ccccc1NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282491	HG	On-Demand	Anodyne	LGMN	40	33
CC(=O)c1ccccc1NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282492	HG	On-Demand	Anodyne	FKBP1A	53	41
CC(=O)c1ccccc1NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282492	HG	On-Demand	Anodyne	LGMN	40	33
NS(=O)(=O)c1cccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875282493	JD	On-Demand	Anodyne	CA2	15	48
NS(=O)(=O)c1cccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875282493	JD	On-Demand	Anodyne	NOS1	37	43
NS(=O)(=O)c1cccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875282493	JD	On-Demand	Anodyne	ST14	39	46
NS(=O)(=O)c1cccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875282493	JD	On-Demand	Anodyne	TTK	19	40
NS(=O)(=O)c1cccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875282495	JD	On-Demand	Anodyne	CA2	15	48
NS(=O)(=O)c1cccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875282495	JD	On-Demand	Anodyne	NOS1	37	43
NS(=O)(=O)c1cccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875282495	JD	On-Demand	Anodyne	ST14	39	46
NS(=O)(=O)c1cccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875282495	JD	On-Demand	Anodyne	TTK	19	40
CC(=O)[C@H]1CCCN(C(=O)NCCC(=O)Nc2ccccc2)C1	ZINC000875282498	DE	On-Demand	Anodyne	SLC6A1	68	33
CC(=O)[C@H]1CCCN(C(=O)NCCC(=O)Nc2ccccc2)C1	ZINC000875282498	DE	On-Demand	Anodyne	DPP7	36	40
CC(=O)[C@@H]1CCCN(C(=O)NCCC(=O)Nc2ccccc2)C1	ZINC000875282499	DE	On-Demand	Anodyne	SLC6A1	68	33
CC(=O)[C@@H]1CCCN(C(=O)NCCC(=O)Nc2ccccc2)C1	ZINC000875282499	DE	On-Demand	Anodyne	DPP7	36	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1c(F)cccc1F	ZINC000875282516	HG	On-Demand	Anodyne	FKBP1A	40	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1c(F)cccc1F	ZINC000875282517	HG	On-Demand	Anodyne	FKBP1A	40	37
Cc1nnc(NNC(=O)NCCc2ccc(F)cc2Cl)n1C	ZINC000875282522	ED	On-Demand	Reactive	P2RX7	64	43
CN1CC[C@H]2CN(C(=O)NCCC(=O)Nc3ccccc3)CC[C@H]21	ZINC000875282525	ED	On-Demand	Anodyne	CCR8	41	33
CN1CC[C@H]2CN(C(=O)NCCC(=O)Nc3ccccc3)CC[C@@H]21	ZINC000875282527	ED	On-Demand	Anodyne	CCR8	41	33
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NNC(=O)c1ccccc1	ZINC000875282538	HD	On-Demand	Reactive	FKBP1A	68	43
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NNC(=O)c1ccccc1	ZINC000875282538	HD	On-Demand	Reactive	CPT1A	48	37
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NNC(=O)c1ccccc1	ZINC000875282538	HD	On-Demand	Reactive	PREP	78	40
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NNC(=O)c1ccccc1	ZINC000875282540	HD	On-Demand	Reactive	FKBP1A	68	43
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NNC(=O)c1ccccc1	ZINC000875282540	HD	On-Demand	Reactive	CPT1A	48	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NNC(=O)c1ccccc1	ZINC000875282540	HD	On-Demand	Reactive	PREP	78	40
O=C(OCc1ccc(Br)cc1F)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282542	II	On-Demand	Anodyne	FKBP1A	45	38
O=C(OCc1ccc(Br)cc1F)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282542	II	On-Demand	Anodyne	PREP	50	36
O=C(OCc1ccc(Br)cc1F)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282546	II	On-Demand	Anodyne	FKBP1A	45	38
O=C(OCc1ccc(Br)cc1F)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282546	II	On-Demand	Anodyne	PREP	50	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1cccc2ccccc12	ZINC000875282554	HI	On-Demand	Anodyne	FKBP1A	52	37
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1cccc2ccccc12	ZINC000875282554	HI	On-Demand	Anodyne	HCRTR1	26	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1cccc2ccccc12	ZINC000875282554	HI	On-Demand	Anodyne	CPT1A	40	35
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1cccc2ccccc12	ZINC000875282554	HI	On-Demand	Anodyne	PREP	52	36
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1cccc2ccccc12	ZINC000875282567	HI	On-Demand	Anodyne	FKBP1A	52	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1cccc2ccccc12	ZINC000875282567	HI	On-Demand	Anodyne	HCRTR1	26	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1cccc2ccccc12	ZINC000875282567	HI	On-Demand	Anodyne	CPT1A	40	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1cccc2ccccc12	ZINC000875282567	HI	On-Demand	Anodyne	PREP	52	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NNC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000875282572	JD	On-Demand	Reactive	LGMN	56	32
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NNC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000875282574	JD	On-Demand	Reactive	LGMN	56	32
CC[C@H](C#N)Oc1cc(CNC(=O)NCC(C)(C)F)ccc1OC	ZINC000875282580	EF	On-Demand	Mild	MT-ND1	23	40
O=C(NCCc1ccc(F)cc1Cl)NC[C@H]1C[C@H](O)C1	ZINC000875282604	DE	On-Demand	Anodyne	P2RX7	60	41
O=C(NCc1ccnc(OC2CCOCC2)c1)NC1CC(Nc2ccccc2)C1	ZINC000875282623	GG	On-Demand	Anodyne	MAPK1	46	34
CN(C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)C(c1ccccc1)c1ccccc1	ZINC000875282627	JJ	On-Demand	Anodyne	FKBP1A	94	44
CN(C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)C(c1ccccc1)c1ccccc1	ZINC000875282627	JJ	On-Demand	Anodyne	OPRK1	28	44
CN(C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)C(c1ccccc1)c1ccccc1	ZINC000875282627	JJ	On-Demand	Anodyne	PREP	53	35
O=C(OCCCCN1C(=O)c2ccccc2C1=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282636	IG	On-Demand	Anodyne	FKBP1A	76	48
O=C(OCCCCN1C(=O)c2ccccc2C1=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282636	IG	On-Demand	Anodyne	PREP	74	36
O=C(OCCCCN1C(=O)c2ccccc2C1=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282637	IG	On-Demand	Anodyne	FKBP1A	76	48
O=C(OCCCCN1C(=O)c2ccccc2C1=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282637	IG	On-Demand	Anodyne	PREP	74	36
O=C(COC(=O)CCCOc1ccc(F)cc1)Nc1cc(F)cc(F)c1	ZINC000875282684	FG	On-Demand	Anodyne	LTA4H	22	43
C[C@@H]1CCCCN1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282719	GF	On-Demand	Anodyne	FKBP1A	69	42
C[C@@H]1CCCCN1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282719	GF	On-Demand	Anodyne	CPT1A	63	39
C[C@@H]1CCCCN1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282719	GF	On-Demand	Anodyne	CPT2	43	33
C[C@@H]1CCCCN1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282719	GF	On-Demand	Anodyne	PREP	66	37
C[C@H]1CCCCN1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282720	GF	On-Demand	Anodyne	FKBP1A	69	42
C[C@H]1CCCCN1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282720	GF	On-Demand	Anodyne	CPT1A	63	39
C[C@H]1CCCCN1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282720	GF	On-Demand	Anodyne	CPT2	43	33
C[C@H]1CCCCN1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282720	GF	On-Demand	Anodyne	PREP	66	37
C[C@@H]1CCCCN1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282721	GF	On-Demand	Anodyne	FKBP1A	69	42
C[C@@H]1CCCCN1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282721	GF	On-Demand	Anodyne	CPT1A	63	39
C[C@@H]1CCCCN1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282721	GF	On-Demand	Anodyne	CPT2	43	33
C[C@@H]1CCCCN1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282721	GF	On-Demand	Anodyne	PREP	66	37
C[C@H]1CCCCN1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282722	GF	On-Demand	Anodyne	FKBP1A	69	42
C[C@H]1CCCCN1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282722	GF	On-Demand	Anodyne	CPT1A	63	39
C[C@H]1CCCCN1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282722	GF	On-Demand	Anodyne	CPT2	43	33
C[C@H]1CCCCN1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282722	GF	On-Demand	Anodyne	PREP	66	37
CC[C@H](C#N)Oc1cc(CNC(=O)NCc2cccnc2C)ccc1OC	ZINC000875282730	FG	On-Demand	Mild	P2RX7	15	40
CCOc1ccccc1NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282746	HG	On-Demand	Anodyne	FKBP1A	68	38
CCOc1ccccc1NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282746	HG	On-Demand	Anodyne	HCN4	40	31
CCOc1ccccc1NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282747	HG	On-Demand	Anodyne	FKBP1A	68	38
CCOc1ccccc1NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282747	HG	On-Demand	Anodyne	HCN4	40	31
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000875282767	JJ	On-Demand	Anodyne	RAF1	22	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000875282767	JJ	On-Demand	Anodyne	NOS1	40	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000875282769	JJ	On-Demand	Anodyne	RAF1	22	40
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000875282769	JJ	On-Demand	Anodyne	NOS1	40	37
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1ccc2c(c1)OCO2	ZINC000875282770	IE	On-Demand	Anodyne	FKBP1A	54	45
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1ccc2c(c1)OCO2	ZINC000875282770	IE	On-Demand	Anodyne	NOS2	105	43
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1ccc2c(c1)OCO2	ZINC000875282771	IE	On-Demand	Anodyne	FKBP1A	54	45
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1ccc2c(c1)OCO2	ZINC000875282771	IE	On-Demand	Anodyne	NOS2	105	43
O=C(OCC(=O)N1CCC(Cc2ccccc2)CC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282772	JH	On-Demand	Anodyne	FKBP1A	76	43
O=C(OCC(=O)N1CCC(Cc2ccccc2)CC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282772	JH	On-Demand	Anodyne	GRIN2B	55	39
O=C(OCC(=O)N1CCC(Cc2ccccc2)CC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282772	JH	On-Demand	Anodyne	CPT1A	42	36
O=C(OCC(=O)N1CCC(Cc2ccccc2)CC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282772	JH	On-Demand	Anodyne	CPT2	44	33
O=C(OCC(=O)N1CCC(Cc2ccccc2)CC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282772	JH	On-Demand	Anodyne	PREP	98	41
O=C(OCC(=O)N1CCC(Cc2ccccc2)CC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282775	JH	On-Demand	Anodyne	FKBP1A	76	43
O=C(OCC(=O)N1CCC(Cc2ccccc2)CC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282775	JH	On-Demand	Anodyne	GRIN2B	55	39
O=C(OCC(=O)N1CCC(Cc2ccccc2)CC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282775	JH	On-Demand	Anodyne	CPT1A	42	36
O=C(OCC(=O)N1CCC(Cc2ccccc2)CC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282775	JH	On-Demand	Anodyne	CPT2	44	33
O=C(OCC(=O)N1CCC(Cc2ccccc2)CC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282775	JH	On-Demand	Anodyne	PREP	98	41
N#Cc1ccc(Cl)cc1NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282776	IG	On-Demand	Mild	LGMN	66	37
N#Cc1ccc(Cl)cc1NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282777	IG	On-Demand	Mild	LGMN	66	37
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000875282783	JH	On-Demand	Bother	LGMN	42	34
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000875282785	JH	On-Demand	Bother	LGMN	42	34
N#Cc1c(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)sc2c1CCCCC2	ZINC000875282805	JI	On-Demand	Mild	VIPR1	30	48
N#Cc1c(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)sc2c1CCCCC2	ZINC000875282809	JI	On-Demand	Mild	VIPR1	30	48
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1cccc(Cl)c1	ZINC000875282816	HH	On-Demand	Anodyne	NOS1	44	43
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1cccc(Cl)c1	ZINC000875282816	HH	On-Demand	Anodyne	GRM5	15	45
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1cccc(Cl)c1	ZINC000875282818	HH	On-Demand	Anodyne	NOS1	44	43
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1cccc(Cl)c1	ZINC000875282818	HH	On-Demand	Anodyne	GRM5	15	45
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NC1CCN(C2CCCCC2)CC1	ZINC000875282821	GE	On-Demand	Anodyne	SIGMAR1	19	44
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NC1CCN(C2CCCCC2)CC1	ZINC000875282823	GE	On-Demand	Anodyne	SIGMAR1	19	44
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1Cc1ccccc1	ZINC000875282826	JJ	On-Demand	Anodyne	FKBP1A	67	42
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1Cc1ccccc1	ZINC000875282826	JJ	On-Demand	Anodyne	PREP	58	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1Cc1ccccc1	ZINC000875282828	JJ	On-Demand	Anodyne	FKBP1A	67	42
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1Cc1ccccc1	ZINC000875282828	JJ	On-Demand	Anodyne	PREP	58	38
COc1ccc(N2CCN(C(=O)NCC3CCSCC3)CC2)c(OC)c1	ZINC000875282830	GF	On-Demand	Clean	HTR1A	42	43
COc1ccc(N2CCN(C(=O)NCC3CCSCC3)CC2)c(OC)c1	ZINC000875282830	GF	On-Demand	Clean	DRD2	38	41
COc1ccc(N2CCN(C(=O)NCC3CCSCC3)CC2)c(OC)c1	ZINC000875282830	GF	On-Demand	Clean	DRD4	42	33
COc1ccc(N2CCN(C(=O)NCC3CCSCC3)CC2)c(OC)c1	ZINC000875282830	GF	On-Demand	Clean	HTR1B	16	43
COc1ccc(N2CCN(C(=O)NCC3CCSCC3)CC2)c(OC)c1	ZINC000875282830	GF	On-Demand	Clean	DRD3	48	38
COc1ccc(N2CCN(C(=O)NCC3CCSCC3)CC2)c(OC)c1	ZINC000875282830	GF	On-Demand	Clean	PDGFRB	44	38
COc1ccc(N2CCN(C(=O)NCC3CCSCC3)CC2)c(OC)c1	ZINC000875282830	GF	On-Demand	Clean	MTNR1A	27	42
COc1ccc(N2CCN(C(=O)NCC3CCSCC3)CC2)c(OC)c1	ZINC000875282830	GF	On-Demand	Clean	MTNR1B	25	43
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1cccc2ccccc12	ZINC000875282834	HI	On-Demand	Anodyne	FKBP1A	43	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1cccc2ccccc12	ZINC000875282834	HI	On-Demand	Anodyne	PREP	50	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1cccc2ccccc12	ZINC000875282835	HI	On-Demand	Anodyne	FKBP1A	43	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1cccc2ccccc12	ZINC000875282835	HI	On-Demand	Anodyne	PREP	50	35
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875282850	JD	On-Demand	Anodyne	CA2	42	51
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875282850	JD	On-Demand	Anodyne	FKBP1A	62	38
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875282850	JD	On-Demand	Anodyne	CA1	41	51
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875282850	JD	On-Demand	Anodyne	CA7	27	51
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875282850	JD	On-Demand	Anodyne	PREP	41	35
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875282850	JD	On-Demand	Anodyne	CA5B	49	51
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875282850	JD	On-Demand	Anodyne	CA4	27	44
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875282850	JD	On-Demand	Anodyne	CA5A	49	44
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875282850	JD	On-Demand	Anodyne	CA12	31	41
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875282850	JD	On-Demand	Anodyne	CA9	31	43
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875282851	JD	On-Demand	Anodyne	CA2	42	51
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875282851	JD	On-Demand	Anodyne	FKBP1A	62	38
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875282851	JD	On-Demand	Anodyne	CA1	41	51
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875282851	JD	On-Demand	Anodyne	CA7	27	51
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875282851	JD	On-Demand	Anodyne	PREP	41	35
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875282851	JD	On-Demand	Anodyne	CA5B	49	51
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875282851	JD	On-Demand	Anodyne	CA4	27	44
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875282851	JD	On-Demand	Anodyne	CA5A	49	44
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875282851	JD	On-Demand	Anodyne	CA12	31	41
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875282851	JD	On-Demand	Anodyne	CA9	31	43
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccccc1Br	ZINC000875282854	IH	On-Demand	Anodyne	FKBP1A	52	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccccc1Br	ZINC000875282854	IH	On-Demand	Anodyne	PREP	48	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccccc1Br	ZINC000875282856	IH	On-Demand	Anodyne	FKBP1A	52	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccccc1Br	ZINC000875282856	IH	On-Demand	Anodyne	PREP	48	35
Cc1cncc([C@H]2CCCN2C(=O)NCCC(=O)Nc2ccccc2)c1	ZINC000875282863	FG	On-Demand	Anodyne	PREP	42	36
Cc1cncc([C@@H]2CCCN2C(=O)NCCC(=O)Nc2ccccc2)c1	ZINC000875282865	FG	On-Demand	Anodyne	PREP	42	36
O=C(OCC(=O)N1CCCc2ccccc21)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282867	HG	On-Demand	Anodyne	FKBP1A	56	39
O=C(OCC(=O)N1CCCc2ccccc21)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282867	HG	On-Demand	Anodyne	AVPR2	36	42
O=C(OCC(=O)N1CCCc2ccccc21)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282867	HG	On-Demand	Anodyne	PREP	62	34
O=C(OCC(=O)N1CCCc2ccccc21)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875282867	HG	On-Demand	Anodyne	NOS1	24	42
O=C(OCC(=O)N1CCCc2ccccc21)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282869	HG	On-Demand	Anodyne	FKBP1A	56	39
O=C(OCC(=O)N1CCCc2ccccc21)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282869	HG	On-Demand	Anodyne	AVPR2	36	42
O=C(OCC(=O)N1CCCc2ccccc21)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282869	HG	On-Demand	Anodyne	PREP	62	34
O=C(OCC(=O)N1CCCc2ccccc21)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875282869	HG	On-Demand	Anodyne	NOS1	24	42
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1cccc(Cl)c1	ZINC000875282871	GH	On-Demand	Anodyne	FKBP1A	51	35
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1cccc(Cl)c1	ZINC000875282871	GH	On-Demand	Anodyne	PREP	41	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1cccc(Cl)c1	ZINC000875282873	GH	On-Demand	Anodyne	FKBP1A	51	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1cccc(Cl)c1	ZINC000875282873	GH	On-Demand	Anodyne	PREP	41	41
CC[C@H](C#N)Oc1cc(CNC(=O)N2C[C@@H]3CCCC[C@@]32C)ccc1OC	ZINC000875282880	FH	On-Demand	Mild	LGMN	44	32
CN1CCN(C2CCN(C(=O)C(=O)NCC3(Cc4ccccc4)CC3)CC2)CC1	ZINC000875282888	GD	On-Demand	Anodyne	OPRL1	26	41
CN1CCN(C2CCN(C(=O)C(=O)NCC3(Cc4ccccc4)CC3)CC2)CC1	ZINC000875282888	GD	On-Demand	Anodyne	NPFFR2	16	40
CN1CCN(C2CCN(C(=O)C(=O)NCC3(Cc4ccccc4)CC3)CC2)CC1	ZINC000875282888	GD	On-Demand	Anodyne	NPFFR1	19	40
CN1CCN(C2CCN(C(=O)C(=O)NCC3(Cc4ccccc4)CC3)CC2)CC1	ZINC000875282888	GD	On-Demand	Anodyne	HCN1	40	38
CN1CCN(C2CCN(C(=O)C(=O)NCC3(Cc4ccccc4)CC3)CC2)CC1	ZINC000875282888	GD	On-Demand	Anodyne	L3MBTL3	65	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1cc2ccccc2o1	ZINC000875282899	GH	On-Demand	Anodyne	FKBP1A	64	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1cc2ccccc2o1	ZINC000875282899	GH	On-Demand	Anodyne	CPT1A	41	35
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1cc2ccccc2o1	ZINC000875282899	GH	On-Demand	Anodyne	PREP	59	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1cc2ccccc2o1	ZINC000875282901	GH	On-Demand	Anodyne	FKBP1A	64	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1cc2ccccc2o1	ZINC000875282901	GH	On-Demand	Anodyne	CPT1A	41	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1cc2ccccc2o1	ZINC000875282901	GH	On-Demand	Anodyne	PREP	59	35
CN1CCC(CNC(=O)NCc2cc3c(nc2O)CCC3)(c2ccccc2)CC1	ZINC000875282923	GF	On-Demand	Anodyne	SOAT1	15	40
O=C(NCc1nc(-c2ccncc2)cs1)NCc1cc2c(nc1O)CCC2	ZINC000875282937	GF	On-Demand	Anodyne	ROCK1	21	42
O=C(NCc1nc(-c2ccncc2)cs1)NCc1cc2c(nc1O)CCC2	ZINC000875282937	GF	On-Demand	Anodyne	ROCK2	15	42
CN1CCN(C2CCN(C(=O)C(=O)NCC(C3CC3)C3CC3)CC2)CC1	ZINC000875282940	FC	On-Demand	Anodyne	L3MBTL3	44	41
CCCCCCCNC(=O)C(=O)N[C@H]1CCCN(c2ccn(C)n2)C1=O	ZINC000875282953	FD	On-Demand	Mild	ASAH1	70	38
CCCCCCCNC(=O)C(=O)N[C@@H]1CCCN(c2ccn(C)n2)C1=O	ZINC000875282954	FD	On-Demand	Mild	ASAH1	70	38
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1	ZINC000875282957	IG	On-Demand	Anodyne	LTA4H	36	40
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1	ZINC000875282957	IG	On-Demand	Anodyne	EPHX2	35	40
O=C(CCCOc1ccc(F)cc1)OCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1	ZINC000875282957	IG	On-Demand	Anodyne	CACNA1G	35	43
C[C@@H](NC(=O)NCc1cc2c(nc1O)CCC2)c1ccc(C(F)(F)F)nc1	ZINC000875282998	GG	On-Demand	Anodyne	TRPV1	95	34
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NNC(=O)c1cccc(Cl)c1	ZINC000875283025	IE	On-Demand	Reactive	PREP	43	39
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NNC(=O)c1cccc(Cl)c1	ZINC000875283026	IE	On-Demand	Reactive	PREP	43	39
COCC(C)(C)CCNC(=O)C(=O)NCC1(Cc2ccccc2)CC1	ZINC000875283029	EE	On-Demand	Anodyne	NPFFR2	16	40
COCC(C)(C)CCNC(=O)C(=O)NCC1(Cc2ccccc2)CC1	ZINC000875283029	EE	On-Demand	Anodyne	NPFFR1	21	40
COC(=O)N(C)NC(=O)NCCc1ccc(F)cc1Cl	ZINC000875283034	DD	On-Demand	Reactive	P2RX7	52	40
COC(=O)N(C)NC(=O)NCCc1ccc(F)cc1Cl	ZINC000875283034	DD	On-Demand	Reactive	MTNR1A	43	39
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc2c(c1)CCC2	ZINC000875283050	HG	On-Demand	Anodyne	NOS1	49	44
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc2c(c1)CCC2	ZINC000875283051	HG	On-Demand	Anodyne	NOS1	49	44
CC(C)(C)N(Cc1ccccc1)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283060	II	On-Demand	Anodyne	FKBP1A	91	47
CC(C)(C)N(Cc1ccccc1)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283060	II	On-Demand	Anodyne	PREP	63	38
CC(C)(C)N(Cc1ccccc1)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283061	II	On-Demand	Anodyne	FKBP1A	91	47
CC(C)(C)N(Cc1ccccc1)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283061	II	On-Demand	Anodyne	PREP	63	38
CC(=O)c1ccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283065	HG	On-Demand	Anodyne	FKBP1A	44	38
CC(=O)c1ccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283066	HG	On-Demand	Anodyne	FKBP1A	44	38
COC(=O)N(C)NC(=O)NCCC(=O)Nc1ccccc1	ZINC000875283068	CC	On-Demand	Reactive	LTA4H	41	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(-c3cccnc3)cc2)C1	ZINC000875283069	FE	On-Demand	Anodyne	CHRNA7	21	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(-c3cccnc3)cc2)C1	ZINC000875283069	FE	On-Demand	Anodyne	NAMPT	65	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(-c3cccnc3)cc2)C1	ZINC000875283070	FE	On-Demand	Anodyne	CHRNA7	21	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(-c3cccnc3)cc2)C1	ZINC000875283070	FE	On-Demand	Anodyne	NAMPT	65	41
Cc1ccc(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1C	ZINC000875283075	GH	On-Demand	Anodyne	FKBP1A	70	38
Cc1ccc(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1C	ZINC000875283075	GH	On-Demand	Anodyne	PREP	42	38
O=C(OCc1ccc(F)cc1Cl)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283090	GI	On-Demand	Anodyne	FKBP1A	40	38
O=C(OCc1ccc(F)cc1Cl)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283090	GI	On-Demand	Anodyne	P2RX7	36	44
O=C(OCc1ccc(F)cc1Cl)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283091	GI	On-Demand	Anodyne	FKBP1A	40	38
O=C(OCc1ccc(F)cc1Cl)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283091	GI	On-Demand	Anodyne	P2RX7	36	44
CCOC(=O)N1CCN(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875283092	ID	On-Demand	Anodyne	FKBP1A	59	39
CCOC(=O)N1CCN(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875283092	ID	On-Demand	Anodyne	PREP	63	37
CCOC(=O)N1CCN(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875283093	ID	On-Demand	Anodyne	FKBP1A	59	39
CCOC(=O)N1CCN(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875283093	ID	On-Demand	Anodyne	PREP	63	37
O=C(NCC1(Cc2ccccc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875283098	EF	On-Demand	Anodyne	NPFFR2	15	41
O=C(NCC1(Cc2ccccc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875283098	EF	On-Demand	Anodyne	NPFFR1	19	41
Cc1ccc(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1C	ZINC000875283100	GH	On-Demand	Anodyne	FKBP1A	70	38
Cc1ccc(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1C	ZINC000875283100	GH	On-Demand	Anodyne	PREP	42	38
CC(=O)C1CCN(C(=O)C(=O)NCC2(Cc3ccccc3)CC2)CC1	ZINC000875283118	ED	On-Demand	Anodyne	NPFFR2	17	42
CC(=O)C1CCN(C(=O)C(=O)NCC2(Cc3ccccc3)CC2)CC1	ZINC000875283118	ED	On-Demand	Anodyne	NPFFR1	21	42
CC(=O)C1CCN(C(=O)C(=O)NCC2(Cc3ccccc3)CC2)CC1	ZINC000875283118	ED	On-Demand	Anodyne	SLC12A5	53	36
CC(=O)C1CCN(C(=O)C(=O)NCC2(Cc3ccccc3)CC2)CC1	ZINC000875283118	ED	On-Demand	Anodyne	HCN1	43	32
CC(=O)C1CCN(C(=O)C(=O)NCC2(Cc3ccccc3)CC2)CC1	ZINC000875283118	ED	On-Demand	Anodyne	HCN4	41	32
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc(Cl)c(Cl)c1	ZINC000875283124	II	On-Demand	Anodyne	FKBP1A	47	35
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc(Cl)c(Cl)c1	ZINC000875283124	II	On-Demand	Anodyne	CPT1A	41	37
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc(Cl)c(Cl)c1	ZINC000875283124	II	On-Demand	Anodyne	PREP	43	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc(Cl)c(Cl)c1	ZINC000875283125	II	On-Demand	Anodyne	FKBP1A	47	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc(Cl)c(Cl)c1	ZINC000875283125	II	On-Demand	Anodyne	CPT1A	41	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc(Cl)c(Cl)c1	ZINC000875283125	II	On-Demand	Anodyne	PREP	43	37
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCC1CCCCC1	ZINC000875283133	GF	On-Demand	Anodyne	FKBP1A	63	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCC1CCCCC1	ZINC000875283133	GF	On-Demand	Anodyne	PREP	53	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCC1CCCCC1	ZINC000875283134	GF	On-Demand	Anodyne	FKBP1A	63	40
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCC1CCCCC1	ZINC000875283134	GF	On-Demand	Anodyne	PREP	53	35
O=C(OCC(=O)C12CC3CC(CC(C3)C1)C2)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283137	HI	On-Demand	Anodyne	FKBP1A	48	43
O=C(NCc1cccc2ncccc12)C(=O)NC1CCN(C2CCCCC2)CC1	ZINC000875283140	GF	On-Demand	Anodyne	SIGMAR1	16	40
O=C(OCC(=O)C12CC3CC(CC(C3)C1)C2)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283142	HI	On-Demand	Anodyne	FKBP1A	48	43
O=C1CCN(C(=O)C(=O)NCC2(Cc3ccccc3)CC2)CCCCCCN1	ZINC000875283161	GE	On-Demand	Anodyne	NPFFR2	15	41
O=C1CCN(C(=O)C(=O)NCC2(Cc3ccccc3)CC2)CCCCCCN1	ZINC000875283161	GE	On-Demand	Anodyne	NPFFR1	19	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1C(=O)c1ccccc1	ZINC000875283166	JI	On-Demand	Anodyne	FKBP1A	40	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1C(=O)c1ccccc1	ZINC000875283166	JI	On-Demand	Anodyne	PREP	48	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1C(=O)c1ccccc1	ZINC000875283167	JI	On-Demand	Anodyne	FKBP1A	40	40
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1C(=O)c1ccccc1	ZINC000875283167	JI	On-Demand	Anodyne	PREP	48	37
O=C(OCC(=O)N1CCc2ccccc2C1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283176	HF	On-Demand	Anodyne	FKBP1A	45	39
O=C(OCC(=O)N1CCc2ccccc2C1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283176	HF	On-Demand	Anodyne	CPT1A	36	51
O=C(OCC(=O)N1CCc2ccccc2C1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283176	HF	On-Demand	Anodyne	CPT2	50	42
O=C(OCC(=O)N1CCc2ccccc2C1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283176	HF	On-Demand	Anodyne	PREP	97	43
O=C(OCC(=O)N1CCc2ccccc2C1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283177	HF	On-Demand	Anodyne	FKBP1A	45	39
O=C(OCC(=O)N1CCc2ccccc2C1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283177	HF	On-Demand	Anodyne	CPT1A	36	51
O=C(OCC(=O)N1CCc2ccccc2C1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283177	HF	On-Demand	Anodyne	CPT2	50	42
O=C(OCC(=O)N1CCc2ccccc2C1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283177	HF	On-Demand	Anodyne	PREP	97	43
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCC(=O)Nc2ccccc2)C1	ZINC000875283186	DE	On-Demand	Anodyne	TIMP3	40	31
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1F	ZINC000875283188	GG	On-Demand	Anodyne	FKBP1A	44	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1F	ZINC000875283189	GG	On-Demand	Anodyne	FKBP1A	44	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@@H]1CCCc2ccccc21	ZINC000875283208	IG	On-Demand	Anodyne	BDKRB1	40	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@@H]1CCCc2ccccc21	ZINC000875283208	IG	On-Demand	Anodyne	XIAP	21	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@@H]1CCCc2ccccc21	ZINC000875283208	IG	On-Demand	Anodyne	BIRC2	40	35
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@H]1CCCc2ccccc21	ZINC000875283209	IG	On-Demand	Anodyne	BDKRB1	40	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@H]1CCCc2ccccc21	ZINC000875283209	IG	On-Demand	Anodyne	XIAP	21	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@H]1CCCc2ccccc21	ZINC000875283209	IG	On-Demand	Anodyne	BIRC2	40	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@H]1CCCc2ccccc21	ZINC000875283210	IG	On-Demand	Anodyne	BDKRB1	40	36
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@H]1CCCc2ccccc21	ZINC000875283210	IG	On-Demand	Anodyne	XIAP	21	40
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@H]1CCCc2ccccc21	ZINC000875283210	IG	On-Demand	Anodyne	BIRC2	40	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@@H]1CCCc2ccccc21	ZINC000875283211	IG	On-Demand	Anodyne	BDKRB1	40	36
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@@H]1CCCc2ccccc21	ZINC000875283211	IG	On-Demand	Anodyne	XIAP	21	40
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@@H]1CCCc2ccccc21	ZINC000875283211	IG	On-Demand	Anodyne	BIRC2	40	35
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc(Br)cc1	ZINC000875283214	IH	On-Demand	Anodyne	FKBP1A	52	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc(Br)cc1	ZINC000875283215	IH	On-Demand	Anodyne	FKBP1A	52	37
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc(-c2ccccc2)cc1	ZINC000875283216	IJ	On-Demand	Anodyne	FKBP1A	64	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc(-c2ccccc2)cc1	ZINC000875283216	IJ	On-Demand	Anodyne	CPT1A	78	42
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc(-c2ccccc2)cc1	ZINC000875283216	IJ	On-Demand	Anodyne	PREP	68	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc(-c2ccccc2)cc1	ZINC000875283217	IJ	On-Demand	Anodyne	FKBP1A	64	40
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc(-c2ccccc2)cc1	ZINC000875283217	IJ	On-Demand	Anodyne	CPT1A	78	42
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc(-c2ccccc2)cc1	ZINC000875283217	IJ	On-Demand	Anodyne	PREP	68	37
O=C(OCc1cccc(C(F)(F)F)c1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283221	GJ	On-Demand	Anodyne	FKBP1A	84	46
O=C(OCc1cccc(C(F)(F)F)c1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283221	GJ	On-Demand	Anodyne	PREP	61	37
O=C(OCc1cccc(C(F)(F)F)c1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283221	GJ	On-Demand	Anodyne	LGMN	28	40
O=C(OCc1cccc(C(F)(F)F)c1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283222	GJ	On-Demand	Anodyne	FKBP1A	84	46
O=C(OCc1cccc(C(F)(F)F)c1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283222	GJ	On-Demand	Anodyne	PREP	61	37
O=C(OCc1cccc(C(F)(F)F)c1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283222	GJ	On-Demand	Anodyne	LGMN	28	40
C[C@@H]1Cc2ccccc2N1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283223	HG	On-Demand	Anodyne	FKBP1A	43	38
C[C@@H]1Cc2ccccc2N1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283223	HG	On-Demand	Anodyne	DRD4	22	40
C[C@@H]1Cc2ccccc2N1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283223	HG	On-Demand	Anodyne	PREP	53	38
C[C@@H]1Cc2ccccc2N1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283227	HG	On-Demand	Anodyne	FKBP1A	43	38
C[C@@H]1Cc2ccccc2N1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283227	HG	On-Demand	Anodyne	DRD4	22	40
C[C@@H]1Cc2ccccc2N1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283227	HG	On-Demand	Anodyne	PREP	53	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCCC(c1ccccc1)c1ccccc1	ZINC000875283231	JJ	On-Demand	Anodyne	F2	39	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCCC(c1ccccc1)c1ccccc1	ZINC000875283231	JJ	On-Demand	Anodyne	FKBP1A	94	46
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCCC(c1ccccc1)c1ccccc1	ZINC000875283231	JJ	On-Demand	Anodyne	TRY1_BOVIN	60	35
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCCC(c1ccccc1)c1ccccc1	ZINC000875283231	JJ	On-Demand	Anodyne	PREP	67	38
CCNC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283234	DD	On-Demand	Anodyne	FKBP1A	93	43
CCNC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283234	DD	On-Demand	Anodyne	PREP	67	38
CCNC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283235	DD	On-Demand	Anodyne	FKBP1A	93	43
CCNC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283235	DD	On-Demand	Anodyne	PREP	67	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCCC(c1ccccc1)c1ccccc1	ZINC000875283237	JJ	On-Demand	Anodyne	F2	39	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCCC(c1ccccc1)c1ccccc1	ZINC000875283237	JJ	On-Demand	Anodyne	FKBP1A	94	46
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCCC(c1ccccc1)c1ccccc1	ZINC000875283237	JJ	On-Demand	Anodyne	TRY1_BOVIN	60	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCCC(c1ccccc1)c1ccccc1	ZINC000875283237	JJ	On-Demand	Anodyne	PREP	67	38
CN(C)C[C@@H]1CN(C(=O)NCCC(=O)Nc2ccccc2)C[C@H]1CN(C)C	ZINC000875283239	GD	On-Demand	Anodyne	HDAC10	16	40
CN(C)C[C@@H]1CN(C(=O)NCCC(=O)Nc2ccccc2)C[C@H]1CN(C)C	ZINC000875283239	GD	On-Demand	Anodyne	HDAC11	20	40
C[C@@H](CN(C)C(=O)NCCC(=O)Nc1ccccc1)NC(=O)OC(C)(C)C	ZINC000875283241	GF	On-Demand	Anodyne	LTA4H	31	42
C[C@@H](CN(C)C(=O)NCCC(=O)Nc1ccccc1)NC(=O)OC(C)(C)C	ZINC000875283241	GF	On-Demand	Anodyne	FPR1	43	35
COc1ccc(OCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283242	GG	On-Demand	Anodyne	FKBP1A	107	52
COc1ccc(OCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283242	GG	On-Demand	Anodyne	MMP13	15	44
COc1ccc(OCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283242	GG	On-Demand	Anodyne	CPT1A	62	37
COc1ccc(OCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283242	GG	On-Demand	Anodyne	CPT2	40	35
COc1ccc(OCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283242	GG	On-Demand	Anodyne	PREP	48	35
COc1ccc(OCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283242	GG	On-Demand	Anodyne	MMP7	19	44
COc1ccc(OCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283244	GG	On-Demand	Anodyne	FKBP1A	107	52
COc1ccc(OCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283244	GG	On-Demand	Anodyne	MMP13	15	44
COc1ccc(OCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283244	GG	On-Demand	Anodyne	CPT1A	62	37
COc1ccc(OCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283244	GG	On-Demand	Anodyne	CPT2	40	35
COc1ccc(OCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283244	GG	On-Demand	Anodyne	PREP	48	35
COc1ccc(OCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283244	GG	On-Demand	Anodyne	MMP7	19	44
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1ccccc1	ZINC000875283245	GF	On-Demand	Anodyne	F2	45	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1ccccc1	ZINC000875283245	GF	On-Demand	Anodyne	FKBP1A	101	48
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1ccccc1	ZINC000875283245	GF	On-Demand	Anodyne	CELA1	23	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1ccccc1	ZINC000875283245	GF	On-Demand	Anodyne	TRY1_BOVIN	54	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1ccccc1	ZINC000875283245	GF	On-Demand	Anodyne	DPP4	15	44
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1ccccc1	ZINC000875283245	GF	On-Demand	Anodyne	PREP	92	45
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1ccccc1	ZINC000875283245	GF	On-Demand	Anodyne	LGMN	57	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1ccccc1	ZINC000875283245	GF	On-Demand	Anodyne	KLK5	23	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1ccccc1	ZINC000875283245	GF	On-Demand	Anodyne	TMPRSS11D	60	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1ccccc1	ZINC000875283247	GF	On-Demand	Anodyne	F2	45	40
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1ccccc1	ZINC000875283247	GF	On-Demand	Anodyne	FKBP1A	101	48
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1ccccc1	ZINC000875283247	GF	On-Demand	Anodyne	CELA1	23	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1ccccc1	ZINC000875283247	GF	On-Demand	Anodyne	TRY1_BOVIN	54	36
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1ccccc1	ZINC000875283247	GF	On-Demand	Anodyne	DPP4	15	44
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1ccccc1	ZINC000875283247	GF	On-Demand	Anodyne	PREP	92	45
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1ccccc1	ZINC000875283247	GF	On-Demand	Anodyne	LGMN	57	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1ccccc1	ZINC000875283247	GF	On-Demand	Anodyne	KLK5	23	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1ccccc1	ZINC000875283247	GF	On-Demand	Anodyne	TMPRSS11D	60	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC1CCCC1	ZINC000875283259	FE	On-Demand	Anodyne	FKBP1A	70	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC1CCCC1	ZINC000875283259	FE	On-Demand	Anodyne	PREP	49	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC1CCCC1	ZINC000875283261	FE	On-Demand	Anodyne	FKBP1A	70	40
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC1CCCC1	ZINC000875283261	FE	On-Demand	Anodyne	PREP	49	38
O=C(OCC(=O)N1CCN(Cc2ccccc2)CC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283265	JF	On-Demand	Anodyne	FKBP1A	69	43
O=C(OCC(=O)N1CCN(Cc2ccccc2)CC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283265	JF	On-Demand	Anodyne	SIGMAR1	30	40
O=C(OCC(=O)N1CCN(Cc2ccccc2)CC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283265	JF	On-Demand	Anodyne	CPT1A	54	37
O=C(OCC(=O)N1CCN(Cc2ccccc2)CC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283265	JF	On-Demand	Anodyne	CPT2	45	37
O=C(OCC(=O)N1CCN(Cc2ccccc2)CC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283265	JF	On-Demand	Anodyne	PREP	94	41
O=C(OCC(=O)N1CCN(Cc2ccccc2)CC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283267	JF	On-Demand	Anodyne	FKBP1A	69	43
O=C(OCC(=O)N1CCN(Cc2ccccc2)CC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283267	JF	On-Demand	Anodyne	SIGMAR1	30	40
O=C(OCC(=O)N1CCN(Cc2ccccc2)CC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283267	JF	On-Demand	Anodyne	CPT1A	54	37
O=C(OCC(=O)N1CCN(Cc2ccccc2)CC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283267	JF	On-Demand	Anodyne	CPT2	45	37
O=C(OCC(=O)N1CCN(Cc2ccccc2)CC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283267	JF	On-Demand	Anodyne	PREP	94	41
N#Cc1ccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283273	GF	On-Demand	Mild	CPT1A	18	40
N#Cc1ccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283273	GF	On-Demand	Mild	LGMN	54	33
N#Cc1ccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283275	GF	On-Demand	Mild	CPT1A	18	40
N#Cc1ccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283275	GF	On-Demand	Mild	LGMN	54	33
O=C(NCC1CCSCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875283277	EF	On-Demand	Anodyne	DRD4	20	40
O=C(NCC1CCSCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875283277	EF	On-Demand	Anodyne	ACHE	25	40
O=C(NCC1CCSCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875283277	EF	On-Demand	Anodyne	FAAH	15	40
Cc1noc(C)c1COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283281	EG	On-Demand	Anodyne	FKBP1A	46	40
Cc1noc(C)c1COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283288	EG	On-Demand	Anodyne	FKBP1A	46	40
C[C@H](NC(=O)C(=O)NCC1(Cc2ccccc2)CC1)c1ccnn1C	ZINC000875283290	ED	On-Demand	Anodyne	NPFFR2	16	40
C[C@H](NC(=O)C(=O)NCC1(Cc2ccccc2)CC1)c1ccnn1C	ZINC000875283290	ED	On-Demand	Anodyne	NPFFR1	19	40
C[C@H](NC(=O)C(=O)NCC1(Cc2ccccc2)CC1)c1ccnn1C	ZINC000875283290	ED	On-Demand	Anodyne	HCN1	65	33
C[C@H](NC(=O)C(=O)NCC1(Cc2ccccc2)CC1)c1ccnn1C	ZINC000875283290	ED	On-Demand	Anodyne	HCN4	48	33
O=C(NCC1CCSCC1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875283293	EG	On-Demand	Anodyne	F2	21	42
O=C(NCC1CCSCC1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875283293	EG	On-Demand	Anodyne	CPT1A	45	33
O=C(NCC1CCSCC1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875283295	EG	On-Demand	Anodyne	F2	21	42
O=C(NCC1CCSCC1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875283295	EG	On-Demand	Anodyne	CPT1A	45	33
O=C(NCC1CCSCC1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875283297	EG	On-Demand	Anodyne	F2	21	42
O=C(NCC1CCSCC1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875283297	EG	On-Demand	Anodyne	CPT1A	45	33
O=C(NCC1CCSCC1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875283299	EG	On-Demand	Anodyne	F2	21	42
O=C(NCC1CCSCC1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875283299	EG	On-Demand	Anodyne	CPT1A	45	33
COc1cccc([C@H](O)C2CCN(C(=O)NCC3CCSCC3)CC2)c1	ZINC000875283304	GG	On-Demand	Anodyne	DRD4	42	32
COCCn1c(C)cc(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1C	ZINC000875283305	IG	On-Demand	Anodyne	FKBP1A	54	36
COCCn1c(C)cc(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1C	ZINC000875283308	IG	On-Demand	Anodyne	FKBP1A	54	36
O=C(NCc1ccc(-c2cccnc2)cc1)C(=O)N[C@H]1CC12CCC2	ZINC000875283310	EE	On-Demand	Anodyne	NAMPT	41	40
O=C(NCc1ccc(-c2cccnc2)cc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875283312	EE	On-Demand	Anodyne	NAMPT	41	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1C(F)(F)F	ZINC000875283313	IH	On-Demand	Anodyne	FKBP1A	51	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1C(F)(F)F	ZINC000875283313	IH	On-Demand	Anodyne	SFRP1	43	33
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1C(F)(F)F	ZINC000875283313	IH	On-Demand	Anodyne	WNT3	50	33
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1C(F)(F)F	ZINC000875283316	IH	On-Demand	Anodyne	FKBP1A	51	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1C(F)(F)F	ZINC000875283316	IH	On-Demand	Anodyne	SFRP1	43	33
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1C(F)(F)F	ZINC000875283316	IH	On-Demand	Anodyne	WNT3	50	33
CCn1ncnc1-c1ccc(C(=O)Nc2ccccc2S(=O)(=O)C(C)C)cc1	ZINC000875283317	GG	On-Demand	Anodyne	PRNP	62	34
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000875283344	JG	On-Demand	Anodyne	FKBP1A	32	49
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000875283344	JG	On-Demand	Anodyne	EPHX2	79	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000875283345	JG	On-Demand	Anodyne	FKBP1A	32	49
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000875283345	JG	On-Demand	Anodyne	EPHX2	79	41
N#CCCN(CCC#N)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283346	HD	On-Demand	Mild	FKBP1A	42	37
N#CCCN(CCC#N)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283346	HD	On-Demand	Mild	PREP	46	34
N#CCCN(CCC#N)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283347	HD	On-Demand	Mild	FKBP1A	42	37
N#CCCN(CCC#N)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283347	HD	On-Demand	Mild	PREP	46	34
CN(C)C[C@@H]1CN(C(=O)NCCc2ccc(F)cc2Cl)C[C@H]1CN(C)C	ZINC000875283349	GE	On-Demand	Anodyne	P2RX7	80	44
O=C(NCCc1ccc(F)cc1Cl)N1CCC(CO)(CO)CC1	ZINC000875283355	ED	On-Demand	Anodyne	CACNA1H	42	32
O=C(NCCc1ccc(F)cc1Cl)N1CCC(CO)(CO)CC1	ZINC000875283355	ED	On-Demand	Anodyne	P2RX7	71	41
O=C(NCCc1ccc(F)cc1Cl)N1CCC(CO)(CO)CC1	ZINC000875283355	ED	On-Demand	Anodyne	EPHX2	15	47
O=C(NCCc1ccc(F)cc1Cl)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875283366	GE	On-Demand	Anodyne	P2RX7	66	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc2ccccc2c1	ZINC000875283367	HI	On-Demand	Anodyne	FKBP1A	68	37
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc2ccccc2c1	ZINC000875283367	HI	On-Demand	Anodyne	CPT1A	84	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc2ccccc2c1	ZINC000875283367	HI	On-Demand	Anodyne	CPT2	43	33
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc2ccccc2c1	ZINC000875283367	HI	On-Demand	Anodyne	PREP	52	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc2ccccc2c1	ZINC000875283368	HI	On-Demand	Anodyne	FKBP1A	68	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc2ccccc2c1	ZINC000875283368	HI	On-Demand	Anodyne	CPT1A	84	40
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc2ccccc2c1	ZINC000875283368	HI	On-Demand	Anodyne	CPT2	43	33
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc2ccccc2c1	ZINC000875283368	HI	On-Demand	Anodyne	PREP	52	37
O=C(OCCOc1ccc(Br)cc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283371	II	On-Demand	Anodyne	FKBP1A	77	43
O=C(OCCOc1ccc(Br)cc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283371	II	On-Demand	Anodyne	CPT1A	42	36
O=C(OCCOc1ccc(Br)cc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283372	II	On-Demand	Anodyne	FKBP1A	77	43
O=C(OCCOc1ccc(Br)cc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283372	II	On-Demand	Anodyne	CPT1A	42	36
CCC[C@@H](CC)C(=O)Nc1ccccc1S(=O)(=O)C(C)C	ZINC000875283373	DH	On-Demand	Anodyne	MME	23	43
CCC[C@H](CC)C(=O)Nc1ccccc1S(=O)(=O)C(C)C	ZINC000875283374	DH	On-Demand	Anodyne	MME	23	43
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC(=O)NCc1ccccc1	ZINC000875283391	IE	On-Demand	Anodyne	FKBP1A	78	45
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC(=O)NCc1ccccc1	ZINC000875283391	IE	On-Demand	Anodyne	TRY1_BOVIN	46	34
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC(=O)NCc1ccccc1	ZINC000875283391	IE	On-Demand	Anodyne	PREP	70	42
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC(=O)NCc1ccccc1	ZINC000875283391	IE	On-Demand	Anodyne	TMPRSS11D	53	36
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC(=O)NCc1ccccc1	ZINC000875283392	IE	On-Demand	Anodyne	FKBP1A	78	45
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC(=O)NCc1ccccc1	ZINC000875283392	IE	On-Demand	Anodyne	TRY1_BOVIN	46	34
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC(=O)NCc1ccccc1	ZINC000875283392	IE	On-Demand	Anodyne	PREP	70	42
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC(=O)NCc1ccccc1	ZINC000875283392	IE	On-Demand	Anodyne	TMPRSS11D	53	36
Cc1ccc(OCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283400	FH	On-Demand	Anodyne	FKBP1A	92	45
Cc1ccc(OCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283400	FH	On-Demand	Anodyne	CPT1A	50	36
Cc1ccc(OCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283400	FH	On-Demand	Anodyne	CPT2	41	36
Cc1ccc(OCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283400	FH	On-Demand	Anodyne	PREP	46	35
Cc1ccc(OCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283401	FH	On-Demand	Anodyne	FKBP1A	92	45
Cc1ccc(OCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283401	FH	On-Demand	Anodyne	CPT1A	50	36
Cc1ccc(OCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283401	FH	On-Demand	Anodyne	CPT2	41	36
Cc1ccc(OCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283401	FH	On-Demand	Anodyne	PREP	46	35
CC(=O)N1CCN(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875283406	HC	On-Demand	Anodyne	FKBP1A	67	41
CC(=O)N1CCN(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875283406	HC	On-Demand	Anodyne	CPT2	41	34
CC(=O)N1CCN(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875283406	HC	On-Demand	Anodyne	PREP	76	38
CC(=O)N1CCN(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875283407	HC	On-Demand	Anodyne	FKBP1A	67	41
CC(=O)N1CCN(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875283407	HC	On-Demand	Anodyne	CPT2	41	34
CC(=O)N1CCN(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875283407	HC	On-Demand	Anodyne	PREP	76	38
CCCc1ccc(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283420	GI	On-Demand	Anodyne	FKBP1A	97	42
CCCc1ccc(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283420	GI	On-Demand	Anodyne	PREP	59	33
CCCc1ccc(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283421	GI	On-Demand	Anodyne	FKBP1A	97	42
CCCc1ccc(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283421	GI	On-Demand	Anodyne	PREP	59	33
CCCCNC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283428	FE	On-Demand	Anodyne	FKBP1A	87	41
CCCCNC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283428	FE	On-Demand	Anodyne	PREP	58	36
CCCCNC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283428	FE	On-Demand	Anodyne	NOS1	17	43
CCCCNC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283429	FE	On-Demand	Anodyne	FKBP1A	87	41
CCCCNC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283429	FE	On-Demand	Anodyne	PREP	58	36
CCCCNC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283429	FE	On-Demand	Anodyne	NOS1	17	43
O=C(OCCOc1ccccc1Cl)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283436	GI	On-Demand	Anodyne	FKBP1A	84	44
O=C(OCCOc1ccccc1Cl)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283436	GI	On-Demand	Anodyne	PREP	63	36
O=C(OCCOc1ccccc1Cl)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283437	GI	On-Demand	Anodyne	FKBP1A	84	44
O=C(OCCOc1ccccc1Cl)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283437	GI	On-Demand	Anodyne	PREP	63	36
O=C(OCc1cc(=O)n2ccsc2n1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283449	HF	On-Demand	Anodyne	FKBP1A	62	39
O=C(OCc1cc(=O)n2ccsc2n1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283449	HF	On-Demand	Anodyne	PREP	50	35
O=C(OCc1cc(=O)n2ccsc2n1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283450	HF	On-Demand	Anodyne	FKBP1A	62	39
O=C(OCc1cc(=O)n2ccsc2n1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283450	HF	On-Demand	Anodyne	PREP	50	35
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCC2(Cc3ccccc3)CC2)C1	ZINC000875283465	EE	On-Demand	Anodyne	TIMP3	70	35
N#Cc1ccccc1COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283468	FG	On-Demand	Mild	FKBP1A	56	41
N#Cc1ccccc1COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283468	FG	On-Demand	Mild	DPP4	24	46
N#Cc1ccccc1COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283468	FG	On-Demand	Mild	PREP	71	39
N#Cc1ccccc1COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283468	FG	On-Demand	Mild	LGMN	54	36
N#Cc1ccccc1COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283469	FG	On-Demand	Mild	FKBP1A	56	41
N#Cc1ccccc1COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283469	FG	On-Demand	Mild	DPP4	24	46
N#Cc1ccccc1COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283469	FG	On-Demand	Mild	PREP	71	39
N#Cc1ccccc1COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283469	FG	On-Demand	Mild	LGMN	54	36
O=C1CC[C@H](C(=O)N2c3ccccc3CC[C@@H]2C(=O)Nc2ccccc2)O1	ZINC000875283487	FF	On-Demand	Anodyne	ACE	22	43
O=C1CC[C@H](C(=O)N2c3ccccc3CC[C@H]2C(=O)Nc2ccccc2)O1	ZINC000875283488	FF	On-Demand	Anodyne	ACE	22	43
C=CCN(CC=C)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283498	GE	On-Demand	Mild	FKBP1A	54	37
C=CCN(CC=C)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283498	GE	On-Demand	Mild	PREP	41	34
C=CCN(CC=C)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283499	GE	On-Demand	Mild	FKBP1A	54	37
C=CCN(CC=C)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283499	GE	On-Demand	Mild	PREP	41	34
CC[C@H](C)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283510	FE	On-Demand	Anodyne	FKBP1A	81	40
CC[C@H](C)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283510	FE	On-Demand	Anodyne	PREP	43	37
CC[C@H](C)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283510	FE	On-Demand	Anodyne	LGMN	59	33
CC[C@H](C)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283511	FE	On-Demand	Anodyne	FKBP1A	81	40
CC[C@H](C)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283511	FE	On-Demand	Anodyne	PREP	43	37
CC[C@H](C)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283511	FE	On-Demand	Anodyne	LGMN	59	33
O=C(OCCOc1ccc(F)cc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283518	GH	On-Demand	Anodyne	FKBP1A	70	43
O=C(OCCOc1ccc(F)cc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283518	GH	On-Demand	Anodyne	CPT1A	50	39
O=C(OCCOc1ccc(F)cc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283518	GH	On-Demand	Anodyne	CPT2	43	32
O=C(OCCOc1ccc(F)cc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283518	GH	On-Demand	Anodyne	PREP	41	35
O=C(OCCOc1ccc(F)cc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283519	GH	On-Demand	Anodyne	FKBP1A	70	43
O=C(OCCOc1ccc(F)cc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283519	GH	On-Demand	Anodyne	CPT1A	50	39
O=C(OCCOc1ccc(F)cc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283519	GH	On-Demand	Anodyne	CPT2	43	32
O=C(OCCOc1ccc(F)cc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283519	GH	On-Demand	Anodyne	PREP	41	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NNC(=O)c1cccs1	ZINC000875283523	HD	On-Demand	Reactive	FKBP1A	58	42
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NNC(=O)c1cccs1	ZINC000875283523	HD	On-Demand	Reactive	PREP	53	39
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NNC(=O)c1cccs1	ZINC000875283523	HD	On-Demand	Reactive	LGMN	47	33
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NNC(=O)c1cccs1	ZINC000875283524	HD	On-Demand	Reactive	FKBP1A	58	42
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NNC(=O)c1cccs1	ZINC000875283524	HD	On-Demand	Reactive	PREP	53	39
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NNC(=O)c1cccs1	ZINC000875283524	HD	On-Demand	Reactive	LGMN	47	33
CCOc1ccc(OCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283525	HH	On-Demand	Anodyne	FKBP1A	110	45
CCOc1ccc(OCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283525	HH	On-Demand	Anodyne	CPT1A	44	41
CCOc1ccc(OCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283525	HH	On-Demand	Anodyne	CPT2	41	41
CCOc1ccc(OCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283525	HH	On-Demand	Anodyne	PREP	45	35
CCOc1ccc(OCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283526	HH	On-Demand	Anodyne	FKBP1A	110	45
CCOc1ccc(OCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283526	HH	On-Demand	Anodyne	CPT1A	44	41
CCOc1ccc(OCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283526	HH	On-Demand	Anodyne	CPT2	41	41
CCOc1ccc(OCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283526	HH	On-Demand	Anodyne	PREP	45	35
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1c[nH]c2ccccc12	ZINC000875283529	GH	On-Demand	Anodyne	FKBP1A	38	43
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1c[nH]c2ccccc12	ZINC000875283530	GH	On-Demand	Anodyne	FKBP1A	38	43
COCCCNC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283540	FD	On-Demand	Anodyne	FKBP1A	82	42
COCCCNC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283540	FD	On-Demand	Anodyne	PREP	50	37
COCCCNC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283541	FD	On-Demand	Anodyne	FKBP1A	82	42
COCCCNC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283541	FD	On-Demand	Anodyne	PREP	50	37
CCOC1CC2(C1)C[C@H]2C(=O)Nc1ccccc1S(=O)(=O)C(C)C	ZINC000875283550	FG	On-Demand	Anodyne	TIMP3	69	33
COC(=O)C1=NO[C@@]2(CCN(C(=O)NCCc3ccc(F)cc3Cl)C2)C1	ZINC000875283561	GE	On-Demand	Anodyne	P2RX7	40	36
COC(=O)C1=NO[C@]2(CCN(C(=O)NCCc3ccc(F)cc3Cl)C2)C1	ZINC000875283562	GE	On-Demand	Anodyne	P2RX7	40	36
O=C(NCC1(Cc2ccccc2)CC1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875283584	FC	On-Demand	Anodyne	NPFFR2	23	49
O=C(NCC1(Cc2ccccc2)CC1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875283584	FC	On-Demand	Anodyne	NPFFR1	32	49
O=CN1CCCN(C(=O)NCCc2ccc(F)cc2Cl)CC1	ZINC000875283617	ED	On-Demand	Anodyne	P2RX7	68	40
CC(C)c1cccc(C(C)C)c1NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283633	JK	On-Demand	Anodyne	FKBP1A	56	37
CC(C)c1cccc(C(C)C)c1NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283634	JK	On-Demand	Anodyne	FKBP1A	56	37
CC(C)n1ncc(C(=O)Nc2ccccc2S(=O)(=O)C(C)C)c1Cl	ZINC000875283641	FH	On-Demand	Anodyne	EPHB3	48	40
CCN(CC)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283642	FE	On-Demand	Anodyne	FKBP1A	87	41
CCN(CC)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283642	FE	On-Demand	Anodyne	PREP	50	34
CCN(CC)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283643	FE	On-Demand	Anodyne	FKBP1A	87	41
CCN(CC)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283643	FE	On-Demand	Anodyne	PREP	50	34
NC(=O)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283656	EC	On-Demand	Anodyne	FKBP1A	65	42
NC(=O)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283656	EC	On-Demand	Anodyne	PREP	68	37
NC(=O)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283656	EC	On-Demand	Anodyne	LGMN	47	33
NC(=O)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283657	EC	On-Demand	Anodyne	FKBP1A	65	42
NC(=O)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283657	EC	On-Demand	Anodyne	PREP	68	37
NC(=O)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283657	EC	On-Demand	Anodyne	LGMN	47	33
O=C(OCCOc1ccc(Cl)cc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283664	GI	On-Demand	Anodyne	FKBP1A	69	43
O=C(OCCOc1ccc(Cl)cc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283664	GI	On-Demand	Anodyne	LTA4H	21	42
O=C(OCCOc1ccc(Cl)cc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283664	GI	On-Demand	Anodyne	CPT1A	49	39
O=C(OCCOc1ccc(Cl)cc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283664	GI	On-Demand	Anodyne	CPT2	44	38
O=C(OCCOc1ccc(Cl)cc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283664	GI	On-Demand	Anodyne	PREP	40	35
O=C(OCCOc1ccc(Cl)cc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283665	GI	On-Demand	Anodyne	FKBP1A	69	43
O=C(OCCOc1ccc(Cl)cc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283665	GI	On-Demand	Anodyne	LTA4H	21	42
O=C(OCCOc1ccc(Cl)cc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283665	GI	On-Demand	Anodyne	CPT1A	49	39
O=C(OCCOc1ccc(Cl)cc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283665	GI	On-Demand	Anodyne	CPT2	44	38
O=C(OCCOc1ccc(Cl)cc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283665	GI	On-Demand	Anodyne	PREP	40	35
O=C(OCc1ccccc1[N+](=O)[O-])[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283702	FG	On-Demand	Bother	FKBP1A	56	41
O=C(OCc1ccccc1[N+](=O)[O-])[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283702	FG	On-Demand	Bother	PREP	46	38
O=C(OCc1ccccc1[N+](=O)[O-])[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283703	FG	On-Demand	Bother	FKBP1A	56	41
O=C(OCc1ccccc1[N+](=O)[O-])[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283703	FG	On-Demand	Bother	PREP	46	38
COC(=O)c1sc(N)c(C(=O)OC)c1COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283717	JF	On-Demand	Anodyne	FKBP1A	48	40
COC(=O)c1sc(N)c(C(=O)OC)c1COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283718	JF	On-Demand	Anodyne	FKBP1A	48	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc(F)c(F)c1	ZINC000875283727	GG	On-Demand	Anodyne	FKBP1A	46	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc(F)c(F)c1	ZINC000875283727	GG	On-Demand	Anodyne	PREP	44	39
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc(F)c(F)c1	ZINC000875283728	GG	On-Demand	Anodyne	FKBP1A	46	36
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc(F)c(F)c1	ZINC000875283728	GG	On-Demand	Anodyne	PREP	44	39
O=C(OCc1cccc2ccccc12)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283734	GJ	On-Demand	Anodyne	FKBP1A	68	42
O=C(OCc1cccc2ccccc12)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283734	GJ	On-Demand	Anodyne	PREP	65	39
O=C(OCc1cccc2ccccc12)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283735	GJ	On-Demand	Anodyne	FKBP1A	68	42
O=C(OCc1cccc2ccccc12)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283735	GJ	On-Demand	Anodyne	PREP	65	39
O=C(NCCO)C1CCN(C(=O)NCCc2ccc(F)cc2Cl)CC1	ZINC000875283768	FD	On-Demand	Anodyne	P2RX7	79	45
O=C(NCCO)C1CCN(C(=O)NCCc2ccc(F)cc2Cl)CC1	ZINC000875283768	FD	On-Demand	Anodyne	EPHX2	25	52
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NCC2(Cc3ccccc3)CC2)CC1	ZINC000875283769	GC	On-Demand	Anodyne	NPFFR2	21	43
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NCC2(Cc3ccccc3)CC2)CC1	ZINC000875283769	GC	On-Demand	Anodyne	NPFFR1	28	43
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NCC2(Cc3ccccc3)CC2)CC1	ZINC000875283769	GC	On-Demand	Anodyne	SLC12A5	48	34
O=C(NCCc1ccc(F)cc1Cl)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875283775	FG	On-Demand	Anodyne	P2RX7	64	45
C[C@@H]1CCCC[C@H]1NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283780	GF	On-Demand	Anodyne	FKBP1A	54	39
C[C@@H]1CCCC[C@H]1NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283781	GF	On-Demand	Anodyne	FKBP1A	54	39
C[C@@H]1CCCC[C@@H]1NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283782	GF	On-Demand	Anodyne	FKBP1A	54	39
C[C@@H]1CCCC[C@@H]1NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283783	GF	On-Demand	Anodyne	FKBP1A	54	39
COC(=O)C1CCN(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875283790	HD	On-Demand	Anodyne	FKBP1A	73	43
COC(=O)C1CCN(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875283790	HD	On-Demand	Anodyne	PREP	78	43
COC(=O)C1CCN(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875283790	HD	On-Demand	Anodyne	PTR1	46	33
COC(=O)C1CCN(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875283791	HD	On-Demand	Anodyne	FKBP1A	73	43
COC(=O)C1CCN(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875283791	HD	On-Demand	Anodyne	PREP	78	43
COC(=O)C1CCN(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875283791	HD	On-Demand	Anodyne	PTR1	46	33
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCC(F)(F)F	ZINC000875283807	GD	On-Demand	Anodyne	FKBP1A	64	43
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCC(F)(F)F	ZINC000875283807	GD	On-Demand	Anodyne	PREP	57	34
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCC(F)(F)F	ZINC000875283808	GD	On-Demand	Anodyne	FKBP1A	64	43
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCC(F)(F)F	ZINC000875283808	GD	On-Demand	Anodyne	PREP	57	34
O=C(NCc1ccnc(OC2CCOCC2)c1)N1Cc2cccc(O)c2C1	ZINC000875283809	FF	On-Demand	Clean	NAMPT	22	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2(Cc3ccccc3)CC2)C1	ZINC000875283810	ED	On-Demand	Anodyne	SLC12A5	53	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2(Cc3ccccc3)CC2)C1	ZINC000875283810	ED	On-Demand	Anodyne	HCN1	54	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2(Cc3ccccc3)CC2)C1	ZINC000875283810	ED	On-Demand	Anodyne	HCN4	52	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2(Cc3ccccc3)CC2)C1	ZINC000875283811	ED	On-Demand	Anodyne	SLC12A5	53	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2(Cc3ccccc3)CC2)C1	ZINC000875283811	ED	On-Demand	Anodyne	HCN1	54	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2(Cc3ccccc3)CC2)C1	ZINC000875283811	ED	On-Demand	Anodyne	HCN4	52	34
O=C(OCCOc1cccc(Br)c1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283823	II	On-Demand	Anodyne	FKBP1A	92	44
O=C(OCCOc1cccc(Br)c1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283823	II	On-Demand	Anodyne	CPT1A	47	34
O=C(OCCOc1cccc(Br)c1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283823	II	On-Demand	Anodyne	CPT2	42	33
O=C(OCCOc1cccc(Br)c1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283824	II	On-Demand	Anodyne	FKBP1A	92	44
O=C(OCCOc1cccc(Br)c1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283824	II	On-Demand	Anodyne	CPT1A	47	34
O=C(OCCOc1cccc(Br)c1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283824	II	On-Demand	Anodyne	CPT2	42	33
O=C(Nc1ccc(Cl)nn1)c1ccnc(N2CCOCC2)n1	ZINC000875283846	DD	On-Demand	Anodyne	PIK3CA	22	42
O=C(Nc1ccc(Cl)nn1)c1ccnc(N2CCOCC2)n1	ZINC000875283846	DD	On-Demand	Anodyne	MTOR	24	42
O=C(Nc1ccc(Cl)nn1)c1ccnc(N2CCOCC2)n1	ZINC000875283846	DD	On-Demand	Anodyne	PIK3CG	21	42
CCc1ccc([C@H](C)NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283853	IH	On-Demand	Anodyne	FKBP1A	77	38
CCc1ccc([C@H](C)NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283853	IH	On-Demand	Anodyne	LGMN	65	38
CCc1ccc([C@H](C)NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283854	IH	On-Demand	Anodyne	FKBP1A	77	38
CCc1ccc([C@H](C)NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875283854	IH	On-Demand	Anodyne	LGMN	65	38
O=C(OCc1csc(-c2ccc(Br)cc2)n1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283879	JK	On-Demand	Anodyne	FKBP1A	49	38
O=C(OCc1csc(-c2ccc(Br)cc2)n1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283879	JK	On-Demand	Anodyne	CPT1A	27	40
O=C(OCc1csc(-c2ccc(Br)cc2)n1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283880	JK	On-Demand	Anodyne	FKBP1A	49	38
O=C(OCc1csc(-c2ccc(Br)cc2)n1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283880	JK	On-Demand	Anodyne	CPT1A	27	40
C[C@H](CS(C)(=O)=O)NC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875283890	FD	On-Demand	Mild	CTSF	70	38
C[C@H](CS(C)(=O)=O)NC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875283890	FD	On-Demand	Mild	CTSL	22	46
C[C@H](CS(C)(=O)=O)NC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875283899	FD	On-Demand	Mild	CTSF	70	38
C[C@H](CS(C)(=O)=O)NC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875283899	FD	On-Demand	Mild	CTSL	22	46
O=C(OCC(=O)N1CCCC1=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283901	FD	On-Demand	Anodyne	FKBP1A	65	42
O=C(OCC(=O)N1CCCC1=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283901	FD	On-Demand	Anodyne	PREP	53	33
O=C(OCC(=O)N1CCCC1=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283904	FD	On-Demand	Anodyne	FKBP1A	65	42
O=C(OCC(=O)N1CCCC1=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283904	FD	On-Demand	Anodyne	PREP	53	33
N#CCc1ccsc1C(=O)Nc1cc(F)ccc1N1CCCCC1	ZINC000875283906	EI	On-Demand	Mild	KCNQ2	69	43
N#CCc1ccsc1C(=O)Nc1cc(F)ccc1N1CCCCC1	ZINC000875283906	EI	On-Demand	Mild	CSF1R	20	48
O=C1CC[C@H](C(=O)Nc2c(N3CCCC3)cccc2N2CCCC2)O1	ZINC000875283919	EF	On-Demand	Anodyne	KCNQ2	73	41
CCS(=O)(=O)C[C@H](C)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875283929	FD	On-Demand	Anodyne	ACE	38	44
CCS(=O)(=O)C[C@H](C)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875283929	FD	On-Demand	Anodyne	XIAP	45	39
CCS(=O)(=O)C[C@H](C)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875283929	FD	On-Demand	Anodyne	WNT3	46	33
CCS(=O)(=O)C[C@H](C)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875283931	FD	On-Demand	Anodyne	ACE	38	44
CCS(=O)(=O)C[C@H](C)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875283931	FD	On-Demand	Anodyne	XIAP	45	39
CCS(=O)(=O)C[C@H](C)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875283931	FD	On-Demand	Anodyne	WNT3	46	33
CCS(=O)(=O)C[C@H](C)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875283933	FD	On-Demand	Anodyne	ACE	38	44
CCS(=O)(=O)C[C@H](C)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875283933	FD	On-Demand	Anodyne	XIAP	45	39
CCS(=O)(=O)C[C@H](C)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875283933	FD	On-Demand	Anodyne	WNT3	46	33
CCS(=O)(=O)C[C@H](C)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875283935	FD	On-Demand	Anodyne	ACE	38	44
CCS(=O)(=O)C[C@H](C)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875283935	FD	On-Demand	Anodyne	XIAP	45	39
CCS(=O)(=O)C[C@H](C)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875283935	FD	On-Demand	Anodyne	WNT3	46	33
O=C(OCC(=O)N1CCSc2ccccc21)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283944	IG	On-Demand	Anodyne	FKBP1A	48	37
O=C(OCC(=O)N1CCSc2ccccc21)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875283944	IG	On-Demand	Anodyne	PREP	43	34
O=C(OCC(=O)N1CCSc2ccccc21)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283954	IG	On-Demand	Anodyne	FKBP1A	48	37
O=C(OCC(=O)N1CCSc2ccccc21)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875283954	IG	On-Demand	Anodyne	PREP	43	34
C[C@](C#N)(NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)C1CC1	ZINC000875283999	GE	On-Demand	Mild	FKBP1A	58	40
C[C@](C#N)(NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)C1CC1	ZINC000875283999	GE	On-Demand	Mild	PREP	55	35
C[C@](C#N)(NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)C1CC1	ZINC000875283999	GE	On-Demand	Mild	LGMN	68	35
C[C@](C#N)(NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)C1CC1	ZINC000875284000	GE	On-Demand	Mild	FKBP1A	58	40
C[C@](C#N)(NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)C1CC1	ZINC000875284000	GE	On-Demand	Mild	PREP	55	35
C[C@](C#N)(NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)C1CC1	ZINC000875284000	GE	On-Demand	Mild	LGMN	68	35
Cc1ccc(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c(C)c1	ZINC000875284003	GH	On-Demand	Anodyne	FKBP1A	53	36
Cc1ccc(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c(C)c1	ZINC000875284004	GH	On-Demand	Anodyne	FKBP1A	53	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC(=O)NC1CCCCC1	ZINC000875284009	HE	On-Demand	Anodyne	FKBP1A	45	39
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC(=O)NC1CCCCC1	ZINC000875284009	HE	On-Demand	Anodyne	PREP	44	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC(=O)NC1CCCCC1	ZINC000875284010	HE	On-Demand	Anodyne	FKBP1A	45	39
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC(=O)NC1CCCCC1	ZINC000875284010	HE	On-Demand	Anodyne	PREP	44	38
Cc1ccnn1CC(=O)Nc1c(N2CCCC2)cccc1N1CCCC1	ZINC000875284040	FG	On-Demand	Anodyne	KCNQ2	76	40
O=C(OCc1csc(-c2ccc(F)cc2)n1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284041	IJ	On-Demand	Anodyne	FKBP1A	43	38
O=C(OCc1csc(-c2ccc(F)cc2)n1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284041	IJ	On-Demand	Anodyne	CPT1A	31	47
O=C(OCc1csc(-c2ccc(F)cc2)n1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284042	IJ	On-Demand	Anodyne	FKBP1A	43	38
O=C(OCc1csc(-c2ccc(F)cc2)n1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284042	IJ	On-Demand	Anodyne	CPT1A	31	47
CC(=O)Nc1nc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cs1	ZINC000875284048	GF	On-Demand	Anodyne	FKBP1A	48	41
CC(=O)Nc1nc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cs1	ZINC000875284049	GF	On-Demand	Anodyne	FKBP1A	48	41
O=C(Nc1ccc(Cl)nn1)[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000875284050	EE	On-Demand	Anodyne	EPHX2	18	51
O=C(Nc1ccc(Cl)nn1)[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000875284050	EE	On-Demand	Anodyne	SMO	40	39
O=C(Nc1ccc(Cl)nn1)[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000875284050	EE	On-Demand	Anodyne	L3MBTL3	67	36
O=C(Nc1ccc(Cl)nn1)[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000875284051	EE	On-Demand	Anodyne	EPHX2	18	51
O=C(Nc1ccc(Cl)nn1)[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000875284051	EE	On-Demand	Anodyne	SMO	40	39
O=C(Nc1ccc(Cl)nn1)[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000875284051	EE	On-Demand	Anodyne	L3MBTL3	67	36
CC(=O)[C@@H]1CCCN(C(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)C1	ZINC000875284052	GH	On-Demand	Anodyne	HRH2	37	41
CC(=O)[C@@H]1CCCN(C(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)C1	ZINC000875284052	GH	On-Demand	Anodyne	NPY1R	42	38
CC(=O)[C@@H]1CCCN(C(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)C1	ZINC000875284052	GH	On-Demand	Anodyne	CCKAR	28	41
CC(=O)[C@@H]1CCCN(C(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)C1	ZINC000875284052	GH	On-Demand	Anodyne	CCR3	78	43
CC(=O)[C@@H]1CCCN(C(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)C1	ZINC000875284052	GH	On-Demand	Anodyne	PREP	34	41
CC(=O)[C@@H]1CCCN(C(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)C1	ZINC000875284052	GH	On-Demand	Anodyne	CCKBR	48	41
CC(=O)[C@@H]1CCCN(C(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)C1	ZINC000875284052	GH	On-Demand	Anodyne	EPHX2	48	42
CC(=O)[C@@H]1CCCN(C(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)C1	ZINC000875284052	GH	On-Demand	Anodyne	DPP7	49	38
CC(=O)[C@@H]1CCCN(C(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)C1	ZINC000875284052	GH	On-Demand	Anodyne	P2RY14	43	34
CC(=O)[C@@H]1CCCN(C(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)C1	ZINC000875284052	GH	On-Demand	Anodyne	NAMPT	45	43
CC(=O)[C@H]1CCCN(C(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)C1	ZINC000875284053	GH	On-Demand	Anodyne	HRH2	37	41
CC(=O)[C@H]1CCCN(C(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)C1	ZINC000875284053	GH	On-Demand	Anodyne	NPY1R	42	38
CC(=O)[C@H]1CCCN(C(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)C1	ZINC000875284053	GH	On-Demand	Anodyne	CCKAR	28	41
CC(=O)[C@H]1CCCN(C(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)C1	ZINC000875284053	GH	On-Demand	Anodyne	CCR3	78	43
CC(=O)[C@H]1CCCN(C(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)C1	ZINC000875284053	GH	On-Demand	Anodyne	PREP	34	41
CC(=O)[C@H]1CCCN(C(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)C1	ZINC000875284053	GH	On-Demand	Anodyne	CCKBR	48	41
CC(=O)[C@H]1CCCN(C(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)C1	ZINC000875284053	GH	On-Demand	Anodyne	EPHX2	48	42
CC(=O)[C@H]1CCCN(C(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)C1	ZINC000875284053	GH	On-Demand	Anodyne	DPP7	49	38
CC(=O)[C@H]1CCCN(C(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)C1	ZINC000875284053	GH	On-Demand	Anodyne	P2RY14	43	34
CC(=O)[C@H]1CCCN(C(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)C1	ZINC000875284053	GH	On-Demand	Anodyne	NAMPT	45	43
C=C(Cl)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284071	DG	On-Demand	Mild	FKBP1A	67	41
C=C(Cl)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284071	DG	On-Demand	Mild	PREP	63	36
C=C(Cl)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284072	DG	On-Demand	Mild	FKBP1A	67	41
C=C(Cl)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284072	DG	On-Demand	Mild	PREP	63	36
Cc1csc2nc(COC(=O)[C@@H]3CCCCN3C(=O)c3cccs3)cc(=O)n12	ZINC000875284175	HF	On-Demand	Anodyne	FKBP1A	50	41
Cc1csc2nc(COC(=O)[C@H]3CCCCN3C(=O)c3cccs3)cc(=O)n12	ZINC000875284176	HF	On-Demand	Anodyne	FKBP1A	50	41
CO[C@H](CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)C(F)(F)F	ZINC000875284179	EE	On-Demand	Anodyne	WNT3	41	34
CO[C@H](CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)C(F)(F)F	ZINC000875284180	EE	On-Demand	Anodyne	WNT3	41	34
CO[C@H](CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)C(F)(F)F	ZINC000875284181	EE	On-Demand	Anodyne	WNT3	41	34
CO[C@H](CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)C(F)(F)F	ZINC000875284182	EE	On-Demand	Anodyne	WNT3	41	34
CCS(=O)(=O)C[C@@H](C)NC(=O)N(C)C[C@H]1CCCCN1Cc1ccccc1	ZINC000875284199	GF	On-Demand	Anodyne	SIGMAR1	18	46
CCS(=O)(=O)C[C@H](C)NC(=O)N(C)C[C@H]1CCCCN1Cc1ccccc1	ZINC000875284200	GF	On-Demand	Anodyne	SIGMAR1	18	46
CCOC(=O)CN(C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875284211	JF	On-Demand	Anodyne	FKBP1A	71	41
CCOC(=O)CN(C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875284211	JF	On-Demand	Anodyne	CPT1A	68	36
CCOC(=O)CN(C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875284211	JF	On-Demand	Anodyne	PREP	49	35
CCOC(=O)CN(C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875284212	JF	On-Demand	Anodyne	FKBP1A	71	41
CCOC(=O)CN(C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875284212	JF	On-Demand	Anodyne	CPT1A	68	36
CCOC(=O)CN(C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875284212	JF	On-Demand	Anodyne	PREP	49	35
CCC(=O)Nc1ccc(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875284213	IH	On-Demand	Anodyne	FKBP1A	42	36
CCC(=O)Nc1ccc(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875284214	IH	On-Demand	Anodyne	FKBP1A	42	36
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc[nH]1	ZINC000875284227	EE	On-Demand	Anodyne	FKBP1A	44	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc[nH]1	ZINC000875284228	EE	On-Demand	Anodyne	FKBP1A	44	36
O=C(OCc1c(F)c(F)c(F)c(F)c1F)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284233	HI	On-Demand	Anodyne	FKBP1A	54	42
O=C(OCc1c(F)c(F)c(F)c(F)c1F)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284233	HI	On-Demand	Anodyne	PREP	62	37
O=C(OCc1c(F)c(F)c(F)c(F)c1F)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284234	HI	On-Demand	Anodyne	FKBP1A	54	42
O=C(OCc1c(F)c(F)c(F)c(F)c1F)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284234	HI	On-Demand	Anodyne	PREP	62	37
COc1ccccc1-c1nc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cs1	ZINC000875284264	IJ	On-Demand	Anodyne	FKBP1A	80	41
COc1ccccc1-c1nc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cs1	ZINC000875284265	IJ	On-Demand	Anodyne	FKBP1A	80	41
O=C(Nc1ccc(Cl)nn1)[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875284268	EH	On-Demand	Anodyne	C3AR1	43	45
O=C(Nc1ccc(Cl)nn1)[C@H](Cc1cccnc1)C1CCCC1	ZINC000875284269	EH	On-Demand	Anodyne	C3AR1	43	45
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284283	IF	On-Demand	Anodyne	F2	53	42
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284283	IF	On-Demand	Anodyne	ACE	50	41
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284283	IF	On-Demand	Anodyne	FKBP1A	98	44
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284283	IF	On-Demand	Anodyne	OPRM1	53	43
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284283	IF	On-Demand	Anodyne	OPRD1	41	41
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284283	IF	On-Demand	Anodyne	CELA1	25	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284283	IF	On-Demand	Anodyne	MME	27	41
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284283	IF	On-Demand	Anodyne	TACR1	26	43
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284283	IF	On-Demand	Anodyne	CMA1	41	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284283	IF	On-Demand	Anodyne	CTRA_BOVIN	53	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284283	IF	On-Demand	Anodyne	TRY1_BOVIN	85	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284283	IF	On-Demand	Anodyne	CYSP_TRYCR	40	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284283	IF	On-Demand	Anodyne	CTSG	42	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284283	IF	On-Demand	Anodyne	NPFFR2	44	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284283	IF	On-Demand	Anodyne	PREP	79	43
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284283	IF	On-Demand	Anodyne	CAPNS1	65	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284283	IF	On-Demand	Anodyne	CELA2A	51	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284283	IF	On-Demand	Anodyne	LGMN	64	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284283	IF	On-Demand	Anodyne	CAPN1	47	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284283	IF	On-Demand	Anodyne	ACE2	43	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284283	IF	On-Demand	Anodyne	KLK5	22	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284283	IF	On-Demand	Anodyne	PLM2_PLAFA	40	31
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284283	IF	On-Demand	Anodyne	BRCA1	68	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284284	IF	On-Demand	Anodyne	F2	53	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284284	IF	On-Demand	Anodyne	ACE	50	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284284	IF	On-Demand	Anodyne	FKBP1A	98	44
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284284	IF	On-Demand	Anodyne	OPRM1	53	43
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284284	IF	On-Demand	Anodyne	OPRD1	41	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284284	IF	On-Demand	Anodyne	CELA1	25	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284284	IF	On-Demand	Anodyne	MME	27	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284284	IF	On-Demand	Anodyne	TACR1	26	43
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284284	IF	On-Demand	Anodyne	CMA1	41	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284284	IF	On-Demand	Anodyne	CTRA_BOVIN	53	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284284	IF	On-Demand	Anodyne	TRY1_BOVIN	85	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284284	IF	On-Demand	Anodyne	CYSP_TRYCR	40	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284284	IF	On-Demand	Anodyne	CTSG	42	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284284	IF	On-Demand	Anodyne	NPFFR2	44	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284284	IF	On-Demand	Anodyne	PREP	79	43
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284284	IF	On-Demand	Anodyne	CAPNS1	65	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284284	IF	On-Demand	Anodyne	CELA2A	51	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284284	IF	On-Demand	Anodyne	LGMN	64	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284284	IF	On-Demand	Anodyne	CAPN1	47	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284284	IF	On-Demand	Anodyne	ACE2	43	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284284	IF	On-Demand	Anodyne	KLK5	22	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284284	IF	On-Demand	Anodyne	PLM2_PLAFA	40	31
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284284	IF	On-Demand	Anodyne	BRCA1	68	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284285	IF	On-Demand	Anodyne	F2	53	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284285	IF	On-Demand	Anodyne	ACE	50	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284285	IF	On-Demand	Anodyne	FKBP1A	98	44
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284285	IF	On-Demand	Anodyne	OPRM1	53	43
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284285	IF	On-Demand	Anodyne	OPRD1	41	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284285	IF	On-Demand	Anodyne	CELA1	25	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284285	IF	On-Demand	Anodyne	MME	27	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284285	IF	On-Demand	Anodyne	TACR1	26	43
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284285	IF	On-Demand	Anodyne	CMA1	41	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284285	IF	On-Demand	Anodyne	CTRA_BOVIN	53	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284285	IF	On-Demand	Anodyne	TRY1_BOVIN	85	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284285	IF	On-Demand	Anodyne	CYSP_TRYCR	40	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284285	IF	On-Demand	Anodyne	CTSG	42	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284285	IF	On-Demand	Anodyne	NPFFR2	44	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284285	IF	On-Demand	Anodyne	PREP	79	43
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284285	IF	On-Demand	Anodyne	CAPNS1	65	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284285	IF	On-Demand	Anodyne	CELA2A	51	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284285	IF	On-Demand	Anodyne	LGMN	64	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284285	IF	On-Demand	Anodyne	CAPN1	47	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284285	IF	On-Demand	Anodyne	ACE2	43	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284285	IF	On-Demand	Anodyne	KLK5	22	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284285	IF	On-Demand	Anodyne	PLM2_PLAFA	40	31
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284285	IF	On-Demand	Anodyne	BRCA1	68	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284286	IF	On-Demand	Anodyne	F2	53	42
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284286	IF	On-Demand	Anodyne	ACE	50	41
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284286	IF	On-Demand	Anodyne	FKBP1A	98	44
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284286	IF	On-Demand	Anodyne	OPRM1	53	43
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284286	IF	On-Demand	Anodyne	OPRD1	41	41
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284286	IF	On-Demand	Anodyne	CELA1	25	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284286	IF	On-Demand	Anodyne	MME	27	41
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284286	IF	On-Demand	Anodyne	TACR1	26	43
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284286	IF	On-Demand	Anodyne	CMA1	41	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284286	IF	On-Demand	Anodyne	CTRA_BOVIN	53	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284286	IF	On-Demand	Anodyne	TRY1_BOVIN	85	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284286	IF	On-Demand	Anodyne	CYSP_TRYCR	40	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284286	IF	On-Demand	Anodyne	CTSG	42	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284286	IF	On-Demand	Anodyne	NPFFR2	44	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284286	IF	On-Demand	Anodyne	PREP	79	43
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284286	IF	On-Demand	Anodyne	CAPNS1	65	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284286	IF	On-Demand	Anodyne	CELA2A	51	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284286	IF	On-Demand	Anodyne	LGMN	64	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284286	IF	On-Demand	Anodyne	CAPN1	47	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284286	IF	On-Demand	Anodyne	ACE2	43	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284286	IF	On-Demand	Anodyne	KLK5	22	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284286	IF	On-Demand	Anodyne	PLM2_PLAFA	40	31
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284286	IF	On-Demand	Anodyne	BRCA1	68	36
O=C(Nc1ccc(Cl)nn1)[C@@H]1CC[C@H](Cc2ccccc2)O1	ZINC000875284291	DF	On-Demand	Anodyne	LUCI_PHOPY	57	34
C#CC[C@H](CCOC)NC(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000875284300	GH	On-Demand	Mild	ROCK2	32	40
C#CC[C@@H](CCOC)NC(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000875284301	GH	On-Demand	Mild	ROCK2	32	40
CN(Cc1ccc(F)cc1)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284302	HG	On-Demand	Anodyne	FKBP1A	54	38
CN(Cc1ccc(F)cc1)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284303	HG	On-Demand	Anodyne	FKBP1A	54	38
O=C(OCc1ccccc1C(F)(F)F)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284331	GJ	On-Demand	Anodyne	FKBP1A	66	45
O=C(OCc1ccccc1C(F)(F)F)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284331	GJ	On-Demand	Anodyne	PREP	54	38
O=C(OCc1ccccc1C(F)(F)F)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284331	GJ	On-Demand	Anodyne	SFRP1	40	34
O=C(OCc1ccccc1C(F)(F)F)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284331	GJ	On-Demand	Anodyne	WNT3	50	34
COC(=O)[C@H](NC(=O)c1cc(C)nn1C1CCOCC1)c1cc(F)ccc1F	ZINC000875284339	GE	On-Demand	Anodyne	MAPK1	42	32
COc1ccc(N2CCN(C(=O)COC(=O)[C@@H]3CCCCN3C(=O)c3cccs3)CC2)cc1	ZINC000875284350	JF	On-Demand	Clean	FKBP1A	53	41
COc1ccc(N2CCN(C(=O)COC(=O)[C@H]3CCCCN3C(=O)c3cccs3)CC2)cc1	ZINC000875284351	JF	On-Demand	Clean	FKBP1A	53	41
CCS(=O)(=O)C[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284369	GF	On-Demand	Reactive	ALOX5	18	45
CCS(=O)(=O)C[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284369	GF	On-Demand	Reactive	MAOB	20	45
CCS(=O)(=O)C[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284369	GF	On-Demand	Reactive	MME	17	45
CCS(=O)(=O)C[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284369	GF	On-Demand	Reactive	LTA4H	39	52
CCS(=O)(=O)C[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284369	GF	On-Demand	Reactive	CA1	28	50
CCS(=O)(=O)C[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284369	GF	On-Demand	Reactive	MMP13	19	47
CCS(=O)(=O)C[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284369	GF	On-Demand	Reactive	CTSB	26	40
CCS(=O)(=O)C[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284369	GF	On-Demand	Reactive	PAPA1_CARPA	44	34
CCS(=O)(=O)C[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284369	GF	On-Demand	Reactive	CTSK	21	44
CCS(=O)(=O)C[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284369	GF	On-Demand	Reactive	SCN2A	17	47
CCS(=O)(=O)C[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284369	GF	On-Demand	Reactive	ADAM17	16	42
CCS(=O)(=O)C[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284369	GF	On-Demand	Reactive	CAPNS1	42	30
CCS(=O)(=O)C[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284369	GF	On-Demand	Reactive	MMP2	18	44
CCS(=O)(=O)C[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284369	GF	On-Demand	Reactive	CAPN1	48	40
CCS(=O)(=O)C[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284369	GF	On-Demand	Reactive	MMP9	15	42
CCS(=O)(=O)C[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284369	GF	On-Demand	Reactive	CAPN2	66	40
CCS(=O)(=O)C[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284369	GF	On-Demand	Reactive	ACE2	42	45
CCS(=O)(=O)C[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284369	GF	On-Demand	Reactive	F7	15	46
CCS(=O)(=O)C[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284369	GF	On-Demand	Reactive	ADAMTS4	37	44
CCS(=O)(=O)C[C@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284369	GF	On-Demand	Reactive	FFAR1	47	42
CCS(=O)(=O)C[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284370	GF	On-Demand	Reactive	ALOX5	18	45
CCS(=O)(=O)C[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284370	GF	On-Demand	Reactive	MAOB	20	45
CCS(=O)(=O)C[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284370	GF	On-Demand	Reactive	MME	17	45
CCS(=O)(=O)C[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284370	GF	On-Demand	Reactive	LTA4H	39	52
CCS(=O)(=O)C[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284370	GF	On-Demand	Reactive	CA1	28	50
CCS(=O)(=O)C[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284370	GF	On-Demand	Reactive	MMP13	19	47
CCS(=O)(=O)C[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284370	GF	On-Demand	Reactive	CTSB	26	40
CCS(=O)(=O)C[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284370	GF	On-Demand	Reactive	PAPA1_CARPA	44	34
CCS(=O)(=O)C[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284370	GF	On-Demand	Reactive	CTSK	21	44
CCS(=O)(=O)C[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284370	GF	On-Demand	Reactive	SCN2A	17	47
CCS(=O)(=O)C[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284370	GF	On-Demand	Reactive	ADAM17	16	42
CCS(=O)(=O)C[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284370	GF	On-Demand	Reactive	CAPNS1	42	30
CCS(=O)(=O)C[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284370	GF	On-Demand	Reactive	MMP2	18	44
CCS(=O)(=O)C[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284370	GF	On-Demand	Reactive	CAPN1	48	40
CCS(=O)(=O)C[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284370	GF	On-Demand	Reactive	MMP9	15	42
CCS(=O)(=O)C[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284370	GF	On-Demand	Reactive	CAPN2	66	40
CCS(=O)(=O)C[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284370	GF	On-Demand	Reactive	ACE2	42	45
CCS(=O)(=O)C[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284370	GF	On-Demand	Reactive	F7	15	46
CCS(=O)(=O)C[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284370	GF	On-Demand	Reactive	ADAMTS4	37	44
CCS(=O)(=O)C[C@@H](C)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875284370	GF	On-Demand	Reactive	FFAR1	47	42
CC(C)(C)OC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284385	FF	On-Demand	Anodyne	FKBP1A	72	43
CC(C)(C)OC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284385	FF	On-Demand	Anodyne	PREP	47	36
CC(C)(C)OC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284386	FF	On-Demand	Anodyne	FKBP1A	72	43
CC(C)(C)OC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284386	FF	On-Demand	Anodyne	PREP	47	36
C[C@H](CS(C)(=O)=O)NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875284392	FC	On-Demand	Anodyne	SIGMAR1	19	40
COCCCn1c(C)cc(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1C	ZINC000875284407	IH	On-Demand	Anodyne	FKBP1A	56	36
COCCCn1c(C)cc(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1C	ZINC000875284408	IH	On-Demand	Anodyne	FKBP1A	56	36
Cn1nc(Cl)c(C(=O)Nc2cc(F)ccc2N2CCCCC2)c1Cl	ZINC000875284428	FI	On-Demand	Anodyne	CNR1	54	33
Cn1nc(Cl)c(C(=O)Nc2cc(F)ccc2N2CCCCC2)c1Cl	ZINC000875284428	FI	On-Demand	Anodyne	KCNQ2	65	38
Cn1nc(Cl)c(C(=O)Nc2cc(F)ccc2N2CCCCC2)c1Cl	ZINC000875284428	FI	On-Demand	Anodyne	CSF1R	16	43
Cn1nc(Cl)c(C(=O)Nc2cc(F)ccc2N2CCCCC2)c1Cl	ZINC000875284428	FI	On-Demand	Anodyne	WDR5	36	46
O=C(OCc1ccccc1C(F)(F)F)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284432	GJ	On-Demand	Anodyne	FKBP1A	66	45
O=C(OCc1ccccc1C(F)(F)F)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284432	GJ	On-Demand	Anodyne	PREP	54	38
O=C(OCc1ccccc1C(F)(F)F)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284432	GJ	On-Demand	Anodyne	SFRP1	40	34
O=C(OCc1ccccc1C(F)(F)F)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284432	GJ	On-Demand	Anodyne	WNT3	50	34
Cc1ccc([C@H](C)NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1C	ZINC000875284440	IH	On-Demand	Anodyne	FKBP1A	59	35
Cc1ccc([C@H](C)NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1C	ZINC000875284443	IH	On-Demand	Anodyne	FKBP1A	59	35
O=C(Nc1c(N2CCCC2)cccc1N1CCCC1)c1cccn(C2CC2)c1=O	ZINC000875284446	GH	On-Demand	Anodyne	KCNQ2	60	35
CCOc1ccccc1COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284462	FH	On-Demand	Anodyne	FKBP1A	90	43
CCOc1ccccc1COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284462	FH	On-Demand	Anodyne	PREP	45	37
CCOc1ccccc1COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284462	FH	On-Demand	Anodyne	HCN4	40	32
CCOc1ccccc1COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284463	FH	On-Demand	Anodyne	FKBP1A	90	43
CCOc1ccccc1COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284463	FH	On-Demand	Anodyne	PREP	45	37
CCOc1ccccc1COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284463	FH	On-Demand	Anodyne	HCN4	40	32
O=C(OCc1ccccc1Br)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284469	HI	On-Demand	Anodyne	FKBP1A	61	43
O=C(OCc1ccccc1Br)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284469	HI	On-Demand	Anodyne	PREP	61	38
O=C(OCc1ccccc1Br)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284470	HI	On-Demand	Anodyne	FKBP1A	61	43
O=C(OCc1ccccc1Br)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284470	HI	On-Demand	Anodyne	PREP	61	38
CC(=O)N(c1ccccc1)c1nc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cs1	ZINC000875284479	JJ	On-Demand	Anodyne	FKBP1A	52	42
CC(=O)N(c1ccccc1)c1nc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cs1	ZINC000875284480	JJ	On-Demand	Anodyne	FKBP1A	52	42
CCOc1ccc(-c2nc(COC(=O)[C@@H]3CCCCN3C(=O)c3cccs3)cs2)cc1	ZINC000875284487	JK	On-Demand	Anodyne	FKBP1A	78	38
CCOc1ccc(-c2nc(COC(=O)[C@@H]3CCCCN3C(=O)c3cccs3)cs2)cc1	ZINC000875284487	JK	On-Demand	Anodyne	CPT1A	70	44
CCOc1ccc(-c2nc(COC(=O)[C@H]3CCCCN3C(=O)c3cccs3)cs2)cc1	ZINC000875284488	JK	On-Demand	Anodyne	FKBP1A	78	38
CCOc1ccc(-c2nc(COC(=O)[C@H]3CCCCN3C(=O)c3cccs3)cs2)cc1	ZINC000875284488	JK	On-Demand	Anodyne	CPT1A	70	44
CSc1ccc(CCNC(=O)C(=O)N2CC[C@H](c3nc(C)cs3)C2)cc1	ZINC000875284505	GF	On-Demand	Anodyne	GPBAR1	16	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc2c(c1)OCCCO2	ZINC000875284509	IG	On-Demand	Anodyne	NOS1	44	39
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc2c(c1)OCCCO2	ZINC000875284510	IG	On-Demand	Anodyne	NOS1	44	39
CSc1ccc(CCNC(=O)C(=O)N2CC[C@@H](c3nc(C)cs3)C2)cc1	ZINC000875284518	GF	On-Demand	Anodyne	GPBAR1	16	40
O=C(OCCCO)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284529	CD	On-Demand	Anodyne	FKBP1A	86	49
O=C(OCCCO)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284529	CD	On-Demand	Anodyne	PREP	74	38
O=C(Nc1ccc(Cl)nn1)[C@@H]1C[C@H]1c1ccsc1	ZINC000875284530	CF	On-Demand	Anodyne	NPBWR1	71	34
O=C(OCCCO)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284531	CD	On-Demand	Anodyne	FKBP1A	86	49
O=C(OCCCO)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284531	CD	On-Demand	Anodyne	PREP	74	38
O=C(OCc1cnc(-c2ccccc2)s1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284560	HJ	On-Demand	Anodyne	FKBP1A	65	43
O=C(OCc1cnc(-c2ccccc2)s1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284560	HJ	On-Demand	Anodyne	CPT1A	80	40
O=C(OCc1cnc(-c2ccccc2)s1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284560	HJ	On-Demand	Anodyne	CPT2	42	31
O=C(OCc1cnc(-c2ccccc2)s1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284560	HJ	On-Demand	Anodyne	PREP	79	44
O=C(OCc1cnc(-c2ccccc2)s1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284562	HJ	On-Demand	Anodyne	FKBP1A	65	43
O=C(OCc1cnc(-c2ccccc2)s1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284562	HJ	On-Demand	Anodyne	CPT1A	80	40
O=C(OCc1cnc(-c2ccccc2)s1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284562	HJ	On-Demand	Anodyne	CPT2	42	31
O=C(OCc1cnc(-c2ccccc2)s1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284562	HJ	On-Demand	Anodyne	PREP	79	44
O=C(CCSc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284592	JG	On-Demand	Anodyne	FKBP1A	61	39
O=C(CCSc1ccccc1)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284592	JG	On-Demand	Anodyne	PREP	47	35
O=C(CCSc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284593	JG	On-Demand	Anodyne	FKBP1A	61	39
O=C(CCSc1ccccc1)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284593	JG	On-Demand	Anodyne	PREP	47	35
COc1ccccc1NC(=O)Cc1nc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cs1	ZINC000875284610	JI	On-Demand	Anodyne	FKBP1A	50	37
COc1ccccc1NC(=O)Cc1nc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cs1	ZINC000875284611	JI	On-Demand	Anodyne	FKBP1A	50	37
CCOc1ccc(-c2nc(COC(=O)[C@H]3CCCCN3C(=O)c3cccs3)cs2)cc1OC	ZINC000875284622	JK	On-Demand	Anodyne	FKBP1A	72	39
CCOc1ccc(-c2nc(COC(=O)[C@H]3CCCCN3C(=O)c3cccs3)cs2)cc1OC	ZINC000875284622	JK	On-Demand	Anodyne	PPARD	18	40
CCOc1ccc(-c2nc(COC(=O)[C@@H]3CCCCN3C(=O)c3cccs3)cs2)cc1OC	ZINC000875284623	JK	On-Demand	Anodyne	FKBP1A	72	39
CCOc1ccc(-c2nc(COC(=O)[C@@H]3CCCCN3C(=O)c3cccs3)cs2)cc1OC	ZINC000875284623	JK	On-Demand	Anodyne	PPARD	18	40
O=C(Nc1c(N2CCCC2)cccc1N1CCCC1)c1cnc2nccn2c1	ZINC000875284639	GG	On-Demand	Anodyne	KCNQ2	44	33
O=C(CCc1ccc(N2CCCS2(=O)=O)cc1)Nc1ccc(Cl)nn1	ZINC000875284650	GE	On-Demand	Anodyne	CDK1	18	46
O=C(Nc1ccc(Cl)nn1)[C@@H]1CC[C@@H](c2ccccc2)C1	ZINC000875284667	DH	On-Demand	Anodyne	TYK2	45	36
O=C(OC/C=C/c1ccccc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284737	FH	On-Demand	Anodyne	FKBP1A	65	42
O=C(OC/C=C/c1ccccc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284737	FH	On-Demand	Anodyne	CPT1A	43	36
O=C(OC/C=C/c1ccccc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284737	FH	On-Demand	Anodyne	CPT2	43	33
O=C(OC/C=C/c1ccccc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284737	FH	On-Demand	Anodyne	PREP	81	37
O=C(OC/C=C/c1ccccc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284746	FH	On-Demand	Anodyne	FKBP1A	65	42
O=C(OC/C=C/c1ccccc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284746	FH	On-Demand	Anodyne	CPT1A	43	36
O=C(OC/C=C/c1ccccc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284746	FH	On-Demand	Anodyne	CPT2	43	33
O=C(OC/C=C/c1ccccc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284746	FH	On-Demand	Anodyne	PREP	81	37
O=C(OC/C=C\c1ccccc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284748	FH	On-Demand	Anodyne	FKBP1A	65	42
O=C(OC/C=C\c1ccccc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284748	FH	On-Demand	Anodyne	CPT1A	43	36
O=C(OC/C=C\c1ccccc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284748	FH	On-Demand	Anodyne	CPT2	43	33
O=C(OC/C=C\c1ccccc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284748	FH	On-Demand	Anodyne	PREP	81	37
O=C(OC/C=C\c1ccccc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284750	FH	On-Demand	Anodyne	FKBP1A	65	42
O=C(OC/C=C\c1ccccc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284750	FH	On-Demand	Anodyne	CPT1A	43	36
O=C(OC/C=C\c1ccccc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284750	FH	On-Demand	Anodyne	CPT2	43	33
O=C(OC/C=C\c1ccccc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284750	FH	On-Demand	Anodyne	PREP	81	37
CO[C@H](CNC(=O)N1CCC[C@@](O)(c2ccccc2)C1)C(F)(F)F	ZINC000875284769	EE	On-Demand	Anodyne	EPHX2	18	46
CO[C@H](CNC(=O)N1CCC[C@](O)(c2ccccc2)C1)C(F)(F)F	ZINC000875284770	EE	On-Demand	Anodyne	EPHX2	18	46
COC(=O)[C@H](NC(=O)c1ccnc(OCCN(C)C)c1)c1cc(F)ccc1F	ZINC000875284811	GD	On-Demand	Anodyne	UTS2	43	32
CCS(=O)(=O)C[C@H](C)NC(=O)N1CCOC[C@H]1c1ccc(OC)cc1	ZINC000875284821	FD	On-Demand	Anodyne	MMP13	28	42
CCS(=O)(=O)C[C@H](C)NC(=O)N1CCOC[C@H]1c1ccc(OC)cc1	ZINC000875284821	FD	On-Demand	Anodyne	MMP3	27	42
CCS(=O)(=O)C[C@H](C)NC(=O)N1CCOC[C@H]1c1ccc(OC)cc1	ZINC000875284821	FD	On-Demand	Anodyne	MMP1	24	42
CCS(=O)(=O)C[C@@H](C)NC(=O)N1CCOC[C@H]1c1ccc(OC)cc1	ZINC000875284822	FD	On-Demand	Anodyne	MMP13	28	42
CCS(=O)(=O)C[C@@H](C)NC(=O)N1CCOC[C@H]1c1ccc(OC)cc1	ZINC000875284822	FD	On-Demand	Anodyne	MMP3	27	42
CCS(=O)(=O)C[C@@H](C)NC(=O)N1CCOC[C@H]1c1ccc(OC)cc1	ZINC000875284822	FD	On-Demand	Anodyne	MMP1	24	42
CCS(=O)(=O)C[C@@H](C)NC(=O)N1CCOC[C@@H]1c1ccc(OC)cc1	ZINC000875284823	FD	On-Demand	Anodyne	MMP13	28	42
CCS(=O)(=O)C[C@@H](C)NC(=O)N1CCOC[C@@H]1c1ccc(OC)cc1	ZINC000875284823	FD	On-Demand	Anodyne	MMP3	27	42
CCS(=O)(=O)C[C@@H](C)NC(=O)N1CCOC[C@@H]1c1ccc(OC)cc1	ZINC000875284823	FD	On-Demand	Anodyne	MMP1	24	42
CCS(=O)(=O)C[C@H](C)NC(=O)N1CCOC[C@@H]1c1ccc(OC)cc1	ZINC000875284824	FD	On-Demand	Anodyne	MMP13	28	42
CCS(=O)(=O)C[C@H](C)NC(=O)N1CCOC[C@@H]1c1ccc(OC)cc1	ZINC000875284824	FD	On-Demand	Anodyne	MMP3	27	42
CCS(=O)(=O)C[C@H](C)NC(=O)N1CCOC[C@@H]1c1ccc(OC)cc1	ZINC000875284824	FD	On-Demand	Anodyne	MMP1	24	42
CCC[C@@H](CNC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1)OCC	ZINC000875284839	EE	On-Demand	Clean	CTSK	21	43
CCC[C@H](CNC(=O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1)OCC	ZINC000875284840	EE	On-Demand	Clean	CTSK	21	43
CCC[C@H](CNC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)OCC	ZINC000875284841	EE	On-Demand	Clean	CTSK	21	43
CCC[C@@H](CNC(=O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)OCC	ZINC000875284842	EE	On-Demand	Clean	CTSK	21	43
COC[C@@H](C)NC(=O)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284844	HD	On-Demand	Anodyne	FKBP1A	60	38
COC[C@@H](C)NC(=O)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284845	HD	On-Demand	Anodyne	FKBP1A	60	38
COC[C@H](C)NC(=O)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284846	HD	On-Demand	Anodyne	FKBP1A	60	38
COC[C@H](C)NC(=O)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284847	HD	On-Demand	Anodyne	FKBP1A	60	38
CC(=O)C1CCN(C(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)CC1	ZINC000875284859	GH	On-Demand	Anodyne	HTR1D	21	41
CC(=O)C1CCN(C(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)CC1	ZINC000875284859	GH	On-Demand	Anodyne	HTR1B	20	41
CC(=O)C1CCN(C(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)CC1	ZINC000875284859	GH	On-Demand	Anodyne	NPY1R	44	39
CC(=O)C1CCN(C(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)CC1	ZINC000875284859	GH	On-Demand	Anodyne	CCKAR	33	45
CC(=O)C1CCN(C(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)CC1	ZINC000875284859	GH	On-Demand	Anodyne	CCR3	63	42
CC(=O)C1CCN(C(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)CC1	ZINC000875284859	GH	On-Demand	Anodyne	CCKBR	50	45
CC(=O)C1CCN(C(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)CC1	ZINC000875284859	GH	On-Demand	Anodyne	EPHX2	72	46
CC(=O)C1CCN(C(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)CC1	ZINC000875284859	GH	On-Demand	Anodyne	TPSAB1	29	42
CC(=O)C1CCN(C(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)CC1	ZINC000875284859	GH	On-Demand	Anodyne	P2RY14	42	33
CC(=O)C1CCN(C(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)CC1	ZINC000875284859	GH	On-Demand	Anodyne	NAMPT	51	40
O=C(COCc1ccnc(O)c1)Nc1c(N2CCCC2)cccc1N1CCCC1	ZINC000875284861	GG	On-Demand	Anodyne	KCNQ2	64	40
NC(=O)c1ccc(CC(=O)Nc2c(N3CCCC3)cccc2N2CCCC2)cn1	ZINC000875284862	GF	On-Demand	Anodyne	KCNQ2	75	46
O=C(OCCCOc1ccc(F)cc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284880	GH	On-Demand	Anodyne	FKBP1A	70	45
O=C(OCCCOc1ccc(F)cc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284880	GH	On-Demand	Anodyne	HRH3	15	43
O=C(OCCCOc1ccc(F)cc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875284880	GH	On-Demand	Anodyne	CPT1A	46	39
O=C(OCCCOc1ccc(F)cc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284881	GH	On-Demand	Anodyne	FKBP1A	70	45
O=C(OCCCOc1ccc(F)cc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284881	GH	On-Demand	Anodyne	HRH3	15	43
O=C(OCCCOc1ccc(F)cc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875284881	GH	On-Demand	Anodyne	CPT1A	46	39
COc1ccc(CN(C)C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1OC	ZINC000875284882	JF	On-Demand	Anodyne	FKBP1A	98	48
COc1ccc(CN(C)C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1OC	ZINC000875284883	JF	On-Demand	Anodyne	FKBP1A	98	48
CC(C)(C)OC(=O)N1CC[C@@H]([C@@H](F)C(=O)Nc2ccc(Cl)nn2)C1	ZINC000875284905	FF	On-Demand	Anodyne	GPR119	57	45
CC(C)(C)OC(=O)N1CC[C@H]([C@H](F)C(=O)Nc2ccc(Cl)nn2)C1	ZINC000875284906	FF	On-Demand	Anodyne	GPR119	57	45
CC(C)(C)OC(=O)N1CC[C@H]([C@@H](F)C(=O)Nc2ccc(Cl)nn2)C1	ZINC000875284907	FF	On-Demand	Anodyne	GPR119	57	45
CC(C)(C)OC(=O)N1CC[C@@H]([C@H](F)C(=O)Nc2ccc(Cl)nn2)C1	ZINC000875284908	FF	On-Demand	Anodyne	GPR119	57	45
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCCCN1CCCC1=O	ZINC000875284962	HD	On-Demand	Anodyne	FKBP1A	58	39
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCCCN1CCCC1=O	ZINC000875284963	HD	On-Demand	Anodyne	FKBP1A	58	39
C[C@H](CS(C)(=O)=O)NC(=O)N1CC2(CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000875284980	GD	On-Demand	Anodyne	GPR119	21	43
CCS(=O)(=O)C[C@H](C)NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875284998	FD	On-Demand	Anodyne	SIGMAR1	23	43
CCS(=O)(=O)C[C@@H](C)NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875284999	FD	On-Demand	Anodyne	SIGMAR1	23	43
Cc1cccc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875285039	EH	On-Demand	Anodyne	FKBP1A	95	48
Cc1cccc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875285039	EH	On-Demand	Anodyne	PREP	74	39
Cc1cccc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875285040	EH	On-Demand	Anodyne	FKBP1A	95	48
Cc1cccc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875285040	EH	On-Demand	Anodyne	PREP	74	39
COC(=O)c1cccc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875285047	GG	On-Demand	Anodyne	FKBP1A	94	47
COC(=O)c1cccc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875285047	GG	On-Demand	Anodyne	PREP	70	38
COC(=O)c1cccc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875285047	GG	On-Demand	Anodyne	ST14	15	42
COC(=O)c1cccc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875285048	GG	On-Demand	Anodyne	FKBP1A	94	47
COC(=O)c1cccc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875285048	GG	On-Demand	Anodyne	PREP	70	38
COC(=O)c1cccc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875285048	GG	On-Demand	Anodyne	ST14	15	42
CSc1ccc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875285049	GI	On-Demand	Anodyne	FKBP1A	78	47
CSc1ccc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875285049	GI	On-Demand	Anodyne	PREP	62	40
CSc1ccc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875285049	GI	On-Demand	Anodyne	LGMN	60	32
CSc1ccc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875285050	GI	On-Demand	Anodyne	FKBP1A	78	47
CSc1ccc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875285050	GI	On-Demand	Anodyne	PREP	62	40
CSc1ccc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875285050	GI	On-Demand	Anodyne	LGMN	60	32
CC(=O)c1c(C)cc(C)c(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1C	ZINC000875285059	HJ	On-Demand	Anodyne	FKBP1A	55	39
CC(=O)c1c(C)cc(C)c(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1C	ZINC000875285060	HJ	On-Demand	Anodyne	FKBP1A	55	39
Cc1ccccc1[C@H](NC(=O)C(=O)N[C@H](C)c1ccnn1C)C(C)(C)C	ZINC000875285068	FF	On-Demand	Anodyne	CTSA	47	31
Cc1ccccc1[C@@H](NC(=O)C(=O)N[C@H](C)c1ccnn1C)C(C)(C)C	ZINC000875285069	FF	On-Demand	Anodyne	CTSA	47	31
Cc1ccccc1[C@@H](NC(=O)C(=O)N[C@@H](C)c1ccnn1C)C(C)(C)C	ZINC000875285070	FF	On-Demand	Anodyne	CTSA	47	31
Cc1ccccc1[C@H](NC(=O)C(=O)N[C@@H](C)c1ccnn1C)C(C)(C)C	ZINC000875285071	FF	On-Demand	Anodyne	CTSA	47	31
O=C(NC1(C(=O)Nc2ccc(Cl)nn2)CC1)OCc1ccccc1	ZINC000875285095	EF	On-Demand	Anodyne	CAPN2	52	34
O=C(NC1(C(=O)Nc2ccc(Cl)nn2)CC1)OCc1ccccc1	ZINC000875285095	EF	On-Demand	Anodyne	SLC12A5	54	34
COc1ccc2c(COC(=O)[C@@H]3CCCCN3C(=O)c3cccs3)cc(=O)oc2c1	ZINC000875285139	IH	On-Demand	Anodyne	FKBP1A	58	45
COc1ccc2c(COC(=O)[C@@H]3CCCCN3C(=O)c3cccs3)cc(=O)oc2c1	ZINC000875285139	IH	On-Demand	Anodyne	MAOB	23	44
COc1ccc2c(COC(=O)[C@H]3CCCCN3C(=O)c3cccs3)cc(=O)oc2c1	ZINC000875285140	IH	On-Demand	Anodyne	FKBP1A	58	45
COc1ccc2c(COC(=O)[C@H]3CCCCN3C(=O)c3cccs3)cc(=O)oc2c1	ZINC000875285140	IH	On-Demand	Anodyne	MAOB	23	44
CCc1ccc(Cl)c(CC)c1NC(=O)CCCOC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285147	JK	On-Demand	Anodyne	FKBP1A	53	38
CCc1ccc(Cl)c(CC)c1NC(=O)CCCOC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285148	JK	On-Demand	Anodyne	FKBP1A	53	38
N#CC1(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)CCCCC1	ZINC000875285159	HF	On-Demand	Mild	FKBP1A	30	40
N#CC1(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)CCCCC1	ZINC000875285159	HF	On-Demand	Mild	LGMN	44	33
N#CC1(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)CCCCC1	ZINC000875285160	HF	On-Demand	Mild	FKBP1A	30	40
N#CC1(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)CCCCC1	ZINC000875285160	HF	On-Demand	Mild	LGMN	44	33
CCS(=O)(=O)C[C@@H](C)NC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875285161	FD	On-Demand	Anodyne	CTSV	29	40
CCS(=O)(=O)C[C@H](C)NC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875285162	FD	On-Demand	Anodyne	CTSV	29	40
CCS(=O)(=O)C[C@@H](C)NC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875285163	FD	On-Demand	Anodyne	CTSV	29	40
CCS(=O)(=O)C[C@H](C)NC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875285164	FD	On-Demand	Anodyne	CTSV	29	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC(=O)c1ccccc1	ZINC000875285165	HE	On-Demand	Anodyne	FKBP1A	71	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC(=O)c1ccccc1	ZINC000875285165	HE	On-Demand	Anodyne	CPT1A	56	37
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC(=O)c1ccccc1	ZINC000875285165	HE	On-Demand	Anodyne	PREP	78	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC(=O)c1ccccc1	ZINC000875285166	HE	On-Demand	Anodyne	FKBP1A	71	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC(=O)c1ccccc1	ZINC000875285166	HE	On-Demand	Anodyne	CPT1A	56	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC(=O)c1ccccc1	ZINC000875285166	HE	On-Demand	Anodyne	PREP	78	38
COC[C@@H](C)n1c(C)cc(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1C	ZINC000875285183	IH	On-Demand	Anodyne	FKBP1A	61	36
COC[C@@H](C)n1c(C)cc(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1C	ZINC000875285186	IH	On-Demand	Anodyne	FKBP1A	61	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1C(=O)Nc1ccccc1	ZINC000875285191	JI	On-Demand	Anodyne	FKBP1A	35	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1C(=O)Nc1ccccc1	ZINC000875285191	JI	On-Demand	Anodyne	HCRTR1	16	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1C(=O)Nc1ccccc1	ZINC000875285191	JI	On-Demand	Anodyne	NOS1	21	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1C(=O)Nc1ccccc1	ZINC000875285192	JI	On-Demand	Anodyne	FKBP1A	35	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1C(=O)Nc1ccccc1	ZINC000875285192	JI	On-Demand	Anodyne	HCRTR1	16	40
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1C(=O)Nc1ccccc1	ZINC000875285192	JI	On-Demand	Anodyne	NOS1	21	41
C[C@H](CS(C)(=O)=O)NC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875285197	EC	On-Demand	Anodyne	ADRB3	16	40
C[C@H](CS(C)(=O)=O)NC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875285197	EC	On-Demand	Anodyne	CTSV	28	40
C[C@H](CS(C)(=O)=O)NC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875285198	EC	On-Demand	Anodyne	ADRB3	16	40
C[C@H](CS(C)(=O)=O)NC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875285198	EC	On-Demand	Anodyne	CTSV	28	40
C[C@H](CS(C)(=O)=O)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875285203	ED	On-Demand	Anodyne	ACE	35	42
C[C@H](CS(C)(=O)=O)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875285204	ED	On-Demand	Anodyne	ACE	35	42
C[C@H](CS(C)(=O)=O)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875285205	ED	On-Demand	Anodyne	ACE	35	42
C[C@H](CS(C)(=O)=O)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875285206	ED	On-Demand	Anodyne	ACE	35	42
CCN(C(C)=O)c1nc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cs1	ZINC000875285239	HG	On-Demand	Anodyne	FKBP1A	42	37
CCN(C(C)=O)c1nc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cs1	ZINC000875285240	HG	On-Demand	Anodyne	FKBP1A	42	37
N#CCN(C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875285243	HF	On-Demand	Mild	FKBP1A	41	38
N#CCN(C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875285243	HF	On-Demand	Mild	PREP	50	36
N#CCN(C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875285244	HF	On-Demand	Mild	FKBP1A	41	38
N#CCN(C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875285244	HF	On-Demand	Mild	PREP	50	36
COc1ccc(C)cc1NC(=O)CNC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285256	JE	On-Demand	Anodyne	FKBP1A	76	40
COc1ccc(C)cc1NC(=O)CNC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285257	JE	On-Demand	Anodyne	FKBP1A	76	40
O=C(OCC(=O)N1CCC(c2ccccc2)=N1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285273	IF	On-Demand	Anodyne	FKBP1A	59	39
O=C(OCC(=O)N1CCC(c2ccccc2)=N1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285273	IF	On-Demand	Anodyne	CPT1A	79	40
O=C(OCC(=O)N1CCC(c2ccccc2)=N1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285273	IF	On-Demand	Anodyne	PREP	57	37
O=C(OCC(=O)N1CCC(c2ccccc2)=N1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285274	IF	On-Demand	Anodyne	FKBP1A	59	39
O=C(OCC(=O)N1CCC(c2ccccc2)=N1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285274	IF	On-Demand	Anodyne	CPT1A	79	40
O=C(OCC(=O)N1CCC(c2ccccc2)=N1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285274	IF	On-Demand	Anodyne	PREP	57	37
O=C(CN1CCCCC(=O)C1=O)Nc1c(N2CCCC2)cccc1N1CCCC1	ZINC000875285293	GE	On-Demand	Anodyne	KCNQ2	74	40
O=C(Nc1ccc(Cl)nn1)C1CCc2ccccc2CC1	ZINC000875285323	DG	On-Demand	Anodyne	TYK2	46	37
O=C(OCc1cccc(Br)c1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285326	HI	On-Demand	Anodyne	FKBP1A	78	46
O=C(OCc1cccc(Br)c1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285326	HI	On-Demand	Anodyne	PREP	72	39
O=C(OCc1cccc(Br)c1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285326	HI	On-Demand	Anodyne	LGMN	35	46
O=C(OCc1cccc(Br)c1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285327	HI	On-Demand	Anodyne	FKBP1A	78	46
O=C(OCc1cccc(Br)c1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285327	HI	On-Demand	Anodyne	PREP	72	39
O=C(OCc1cccc(Br)c1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285327	HI	On-Demand	Anodyne	LGMN	35	46
COc1ccc(Nc2nc(COC(=O)[C@H]3CCCCN3C(=O)c3cccs3)cs2)cc1	ZINC000875285331	JJ	On-Demand	Anodyne	FKBP1A	54	39
COc1ccc(Nc2nc(COC(=O)[C@H]3CCCCN3C(=O)c3cccs3)cs2)cc1	ZINC000875285331	JJ	On-Demand	Anodyne	TRPC6	56	45
COc1ccc(Nc2nc(COC(=O)[C@H]3CCCCN3C(=O)c3cccs3)cs2)cc1	ZINC000875285331	JJ	On-Demand	Anodyne	TRPC3	54	45
C[C@H](CS(C)(=O)=O)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875285363	GE	On-Demand	Reactive	MAOB	18	45
C[C@H](CS(C)(=O)=O)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875285363	GE	On-Demand	Reactive	LTA4H	36	51
C[C@H](CS(C)(=O)=O)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875285363	GE	On-Demand	Reactive	CA1	22	49
C[C@H](CS(C)(=O)=O)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875285363	GE	On-Demand	Reactive	MMP13	16	46
C[C@H](CS(C)(=O)=O)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875285363	GE	On-Demand	Reactive	CTSB	22	41
C[C@H](CS(C)(=O)=O)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875285363	GE	On-Demand	Reactive	PAPA1_CARPA	40	34
C[C@H](CS(C)(=O)=O)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875285363	GE	On-Demand	Reactive	CTSK	17	44
C[C@H](CS(C)(=O)=O)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875285363	GE	On-Demand	Reactive	MMP2	17	46
C[C@H](CS(C)(=O)=O)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875285363	GE	On-Demand	Reactive	CAPN1	42	41
C[C@H](CS(C)(=O)=O)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875285363	GE	On-Demand	Reactive	CAPN2	60	41
C[C@H](CS(C)(=O)=O)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875285363	GE	On-Demand	Reactive	ACE2	26	42
C[C@H](CS(C)(=O)=O)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875285363	GE	On-Demand	Reactive	F7	17	48
C[C@H](CS(C)(=O)=O)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875285363	GE	On-Demand	Reactive	ADAMTS4	35	44
C[C@H](CS(C)(=O)=O)NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875285363	GE	On-Demand	Reactive	FFAR1	45	41
O=C(OCCN1CCOCC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285366	FD	On-Demand	Anodyne	FKBP1A	66	41
O=C(OCCN1CCOCC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285366	FD	On-Demand	Anodyne	PREP	41	35
O=C(OCCN1CCOCC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285367	FD	On-Demand	Anodyne	FKBP1A	66	41
O=C(OCCN1CCOCC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285367	FD	On-Demand	Anodyne	PREP	41	35
CC(=O)c1ccccc1OCCOC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285370	HH	On-Demand	Anodyne	FKBP1A	85	43
CC(=O)c1ccccc1OCCOC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285370	HH	On-Demand	Anodyne	PREP	46	35
CC(=O)c1ccccc1OCCOC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285371	HH	On-Demand	Anodyne	FKBP1A	85	43
CC(=O)c1ccccc1OCCOC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285371	HH	On-Demand	Anodyne	PREP	46	35
CN(C)S(=O)(=O)c1cccc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875285398	IF	On-Demand	Anodyne	FKBP1A	80	44
CN(C)S(=O)(=O)c1cccc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875285398	IF	On-Demand	Anodyne	PREP	59	37
CN(C)S(=O)(=O)c1cccc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875285399	IF	On-Demand	Anodyne	FKBP1A	80	44
CN(C)S(=O)(=O)c1cccc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875285399	IF	On-Demand	Anodyne	PREP	59	37
CCS(=O)(=O)C[C@H](C)NC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875285410	GE	On-Demand	Mild	CTSF	71	37
CCS(=O)(=O)C[C@H](C)NC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875285410	GE	On-Demand	Mild	CTSL	23	41
CCS(=O)(=O)C[C@H](C)NC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875285411	GE	On-Demand	Mild	CTSF	71	37
CCS(=O)(=O)C[C@H](C)NC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875285411	GE	On-Demand	Mild	CTSL	23	41
CCS(=O)(=O)C[C@@H](C)NC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875285412	GE	On-Demand	Mild	CTSF	71	37
CCS(=O)(=O)C[C@@H](C)NC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875285412	GE	On-Demand	Mild	CTSL	23	41
CCS(=O)(=O)C[C@@H](C)NC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875285413	GE	On-Demand	Mild	CTSF	71	37
CCS(=O)(=O)C[C@@H](C)NC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875285413	GE	On-Demand	Mild	CTSL	23	41
CCOC(=O)C1=C(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)NC(=O)N[C@@H]1c1ccccc1	ZINC000875285414	JG	On-Demand	Anodyne	FKBP1A	54	42
CCOC(=O)C1=C(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)NC(=O)N[C@@H]1c1ccccc1	ZINC000875285414	JG	On-Demand	Anodyne	SLC27A4	66	33
CCOC(=O)C1=C(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)NC(=O)N[C@H]1c1ccccc1	ZINC000875285415	JG	On-Demand	Anodyne	FKBP1A	54	42
CCOC(=O)C1=C(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)NC(=O)N[C@H]1c1ccccc1	ZINC000875285415	JG	On-Demand	Anodyne	SLC27A4	66	33
CCOC(=O)C1=C(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)NC(=O)N[C@H]1c1ccccc1	ZINC000875285416	JG	On-Demand	Anodyne	FKBP1A	54	42
CCOC(=O)C1=C(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)NC(=O)N[C@H]1c1ccccc1	ZINC000875285416	JG	On-Demand	Anodyne	SLC27A4	66	33
CCOC(=O)C1=C(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)NC(=O)N[C@@H]1c1ccccc1	ZINC000875285417	JG	On-Demand	Anodyne	FKBP1A	54	42
CCOC(=O)C1=C(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)NC(=O)N[C@@H]1c1ccccc1	ZINC000875285417	JG	On-Demand	Anodyne	SLC27A4	66	33
O=C(OCCOC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875285418	GG	On-Demand	Anodyne	FKBP1A	97	48
O=C(OCCOC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875285418	GG	On-Demand	Anodyne	CPT1A	43	37
O=C(OCCOC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875285418	GG	On-Demand	Anodyne	PREP	93	39
O=C(OCCOC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875285419	GG	On-Demand	Anodyne	FKBP1A	97	48
O=C(OCCOC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875285419	GG	On-Demand	Anodyne	CPT1A	43	37
O=C(OCCOC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875285419	GG	On-Demand	Anodyne	PREP	93	39
O=C(OCc1csc(-c2ccc(Cl)cc2)n1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285428	IK	On-Demand	Anodyne	FKBP1A	42	38
O=C(OCc1csc(-c2ccc(Cl)cc2)n1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285428	IK	On-Demand	Anodyne	CPT1A	31	40
O=C(OCc1csc(-c2ccc(Cl)cc2)n1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285429	IK	On-Demand	Anodyne	FKBP1A	42	38
O=C(OCc1csc(-c2ccc(Cl)cc2)n1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285429	IK	On-Demand	Anodyne	CPT1A	31	40
COc1ccc(Nc2nc(COC(=O)[C@@H]3CCCCN3C(=O)c3cccs3)cs2)cc1	ZINC000875285432	JJ	On-Demand	Anodyne	FKBP1A	54	39
COc1ccc(Nc2nc(COC(=O)[C@@H]3CCCCN3C(=O)c3cccs3)cs2)cc1	ZINC000875285432	JJ	On-Demand	Anodyne	TRPC6	56	45
COc1ccc(Nc2nc(COC(=O)[C@@H]3CCCCN3C(=O)c3cccs3)cs2)cc1	ZINC000875285432	JJ	On-Demand	Anodyne	TRPC3	54	45
O=C(Nc1ccc(Cl)nn1)[C@H](c1cccnc1)C1CCCCC1	ZINC000875285439	EH	On-Demand	Anodyne	C3AR1	47	45
O=C(Nc1ccc(Cl)nn1)[C@@H](c1cccnc1)C1CCCCC1	ZINC000875285440	EH	On-Demand	Anodyne	C3AR1	47	45
Cc1ccccc1CN(C)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285452	HG	On-Demand	Anodyne	FKBP1A	45	37
Cc1ccccc1CN(C)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285453	HG	On-Demand	Anodyne	FKBP1A	45	37
C[C@@H]1CCCC[C@H]1NC(=O)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285501	IF	On-Demand	Anodyne	FKBP1A	46	37
C[C@@H]1CCCC[C@H]1NC(=O)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285502	IF	On-Demand	Anodyne	FKBP1A	46	37
C[C@@H]1CCCC[C@@H]1NC(=O)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285503	IF	On-Demand	Anodyne	FKBP1A	46	37
C[C@@H]1CCCC[C@@H]1NC(=O)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285504	IF	On-Demand	Anodyne	FKBP1A	46	37
O=C(OCCOc1c(Cl)cccc1Cl)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285560	IJ	On-Demand	Anodyne	FKBP1A	78	42
O=C(OCCOc1c(Cl)cccc1Cl)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285560	IJ	On-Demand	Anodyne	PREP	47	35
O=C(OCCOc1c(Cl)cccc1Cl)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285561	IJ	On-Demand	Anodyne	FKBP1A	78	42
O=C(OCCOc1c(Cl)cccc1Cl)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285561	IJ	On-Demand	Anodyne	PREP	47	35
O=C(OCc1ccc2c(c1)OCO2)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285566	FG	On-Demand	Anodyne	FKBP1A	60	48
O=C(OCc1ccc2c(c1)OCO2)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285566	FG	On-Demand	Anodyne	BMP1	28	40
O=C(OCc1ccc2c(c1)OCO2)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285566	FG	On-Demand	Anodyne	CPT1A	18	42
O=C(OCc1ccc2c(c1)OCO2)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285566	FG	On-Demand	Anodyne	PREP	51	36
O=C(OCc1ccc2c(c1)OCO2)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285566	FG	On-Demand	Anodyne	NOS2	61	35
O=C(OCc1ccc2c(c1)OCO2)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285572	FG	On-Demand	Anodyne	FKBP1A	60	48
O=C(OCc1ccc2c(c1)OCO2)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285572	FG	On-Demand	Anodyne	BMP1	28	40
O=C(OCc1ccc2c(c1)OCO2)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285572	FG	On-Demand	Anodyne	CPT1A	18	42
O=C(OCc1ccc2c(c1)OCO2)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285572	FG	On-Demand	Anodyne	PREP	51	36
O=C(OCc1ccc2c(c1)OCO2)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285572	FG	On-Demand	Anodyne	NOS2	61	35
N#CCSc1ccccc1NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285573	IH	On-Demand	Mild	LGMN	69	35
O=C1N[C@H](C(=O)Nc2c(N3CCCC3)cccc2N2CCCC2)CO1	ZINC000875285580	ED	On-Demand	Anodyne	KCNQ2	67	40
N#CCSc1ccccc1NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285584	IH	On-Demand	Mild	LGMN	69	35
O=C(Nc1ccc(Cl)nn1)c1ccc(C(=O)N2CCOCC2)cc1	ZINC000875285587	ED	On-Demand	Anodyne	F10	15	46
O=C(Nc1ccc(Cl)nn1)c1ccc(C(=O)N2CCOCC2)cc1	ZINC000875285587	ED	On-Demand	Anodyne	MTOR	19	40
O=C(Nc1ccc(Cl)nn1)c1ccc(C(=O)N2CCOCC2)cc1	ZINC000875285587	ED	On-Demand	Anodyne	LRRK2	19	43
COCC1CC(NC(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)C1	ZINC000875285618	GH	On-Demand	Anodyne	NPY1R	40	39
COCC1CC(NC(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)C1	ZINC000875285618	GH	On-Demand	Anodyne	CCR3	46	40
COCC1CC(NC(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)C1	ZINC000875285618	GH	On-Demand	Anodyne	ROCK2	28	44
COCC1CC(NC(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)C1	ZINC000875285618	GH	On-Demand	Anodyne	EPHX2	50	41
COCC1CC(NC(=O)NCc2cccc(NC(=O)Nc3ccccc3)c2)C1	ZINC000875285618	GH	On-Demand	Anodyne	NAMPT	30	40
O=C(OCCSc1ccc(F)cc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285628	GI	On-Demand	Anodyne	FKBP1A	60	43
Cc1ccn(C[C@H](C)C(=O)Nc2c(N3CCCC3)cccc2N2CCCC2)n1	ZINC000875285630	GH	On-Demand	Anodyne	KCNQ2	76	40
O=C(OCCSc1ccc(F)cc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285631	GI	On-Demand	Anodyne	FKBP1A	60	43
COc1ccc([N+](=O)[O-])cc1COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285632	HG	On-Demand	Bother	FKBP1A	74	44
CN(Cc1ccc(OC(F)F)cc1)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285634	JH	On-Demand	Anodyne	FKBP1A	51	35
CN(Cc1ccc(OC(F)F)cc1)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285635	JH	On-Demand	Anodyne	FKBP1A	51	35
COc1ccc([N+](=O)[O-])cc1COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285638	HG	On-Demand	Bother	FKBP1A	74	44
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC(=O)NC1CC1	ZINC000875285649	GD	On-Demand	Anodyne	FKBP1A	44	39
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC(=O)NC1CC1	ZINC000875285649	GD	On-Demand	Anodyne	PREP	43	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC(=O)NC1CC1	ZINC000875285650	GD	On-Demand	Anodyne	FKBP1A	44	39
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC(=O)NC1CC1	ZINC000875285650	GD	On-Demand	Anodyne	PREP	43	38
O=C(Nc1ccc(Cl)nn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875285651	DF	On-Demand	Anodyne	DRD2	18	46
O=C(Nc1ccc(Cl)nn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875285651	DF	On-Demand	Anodyne	DRD4	51	46
O=C(Nc1ccc(Cl)nn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875285651	DF	On-Demand	Anodyne	ACHE	47	57
O=C(Nc1ccc(Cl)nn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875285651	DF	On-Demand	Anodyne	SLC6A1	62	35
O=C(Nc1ccc(Cl)nn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875285651	DF	On-Demand	Anodyne	DRD3	16	46
O=C(Nc1ccc(Cl)nn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875285651	DF	On-Demand	Anodyne	LTA4H	19	46
O=C(Nc1ccc(Cl)nn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875285651	DF	On-Demand	Anodyne	SIGMAR1	51	59
O=C(Nc1ccc(Cl)nn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875285651	DF	On-Demand	Anodyne	CCR3	41	39
O=C(Nc1ccc(Cl)nn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875285651	DF	On-Demand	Anodyne	SLC18A3	18	41
O=C(Nc1ccc(Cl)nn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875285651	DF	On-Demand	Anodyne	S1PR5	22	41
O=C(Nc1ccc(Cl)nn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875285651	DF	On-Demand	Anodyne	CACNA1G	39	44
O=C(Nc1ccc(Cl)nn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875285652	DF	On-Demand	Anodyne	DRD2	18	46
O=C(Nc1ccc(Cl)nn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875285652	DF	On-Demand	Anodyne	DRD4	51	46
O=C(Nc1ccc(Cl)nn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875285652	DF	On-Demand	Anodyne	ACHE	47	57
O=C(Nc1ccc(Cl)nn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875285652	DF	On-Demand	Anodyne	SLC6A1	62	35
O=C(Nc1ccc(Cl)nn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875285652	DF	On-Demand	Anodyne	DRD3	16	46
O=C(Nc1ccc(Cl)nn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875285652	DF	On-Demand	Anodyne	LTA4H	19	46
O=C(Nc1ccc(Cl)nn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875285652	DF	On-Demand	Anodyne	SIGMAR1	51	59
O=C(Nc1ccc(Cl)nn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875285652	DF	On-Demand	Anodyne	CCR3	41	39
O=C(Nc1ccc(Cl)nn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875285652	DF	On-Demand	Anodyne	SLC18A3	18	41
O=C(Nc1ccc(Cl)nn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875285652	DF	On-Demand	Anodyne	S1PR5	22	41
O=C(Nc1ccc(Cl)nn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875285652	DF	On-Demand	Anodyne	CACNA1G	39	44
O=C(NCCN1C(=O)CCC1=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875285660	GE	On-Demand	Reactive	TSHR	42	33
O=C(NCCN1C(=O)CCC1=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875285660	GE	On-Demand	Reactive	LTA4H	32	45
O=C(NCCN1C(=O)CCC1=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875285660	GE	On-Demand	Reactive	SCN2A	15	40
O=C(NCCN1C(=O)CCC1=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875285660	GE	On-Demand	Reactive	FFAR1	18	40
C[C@H]1CN(c2ccc(C(=O)Nc3ccc(Cl)nn3)cc2)C[C@H](C)O1	ZINC000875285666	EF	On-Demand	Anodyne	PRNP	40	33
C[C@H]1CN(c2ccc(C(=O)Nc3ccc(Cl)nn3)cc2)C[C@@H](C)O1	ZINC000875285668	EF	On-Demand	Anodyne	PRNP	40	33
CCOc1ccc(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875285697	HH	On-Demand	Anodyne	FKBP1A	82	36
CCOc1ccc(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875285697	HH	On-Demand	Anodyne	CPT1A	70	41
CCOc1ccc(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875285697	HH	On-Demand	Anodyne	CPT2	44	41
CCOc1ccc(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875285698	HH	On-Demand	Anodyne	FKBP1A	82	36
CCOc1ccc(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875285698	HH	On-Demand	Anodyne	CPT1A	70	41
CCOc1ccc(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875285698	HH	On-Demand	Anodyne	CPT2	44	41
COc1ccc(CN(C)C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875285699	IF	On-Demand	Anodyne	FKBP1A	84	45
COc1ccc(CN(C)C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875285700	IF	On-Demand	Anodyne	FKBP1A	84	45
CCOc1ccc(C(C)=O)cc1COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285734	HI	On-Demand	Anodyne	FKBP1A	67	39
O=C(OCN1C(=O)c2ccccc2C1=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285740	GF	On-Demand	Anodyne	FKBP1A	69	41
O=C(OCN1C(=O)c2ccccc2C1=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285740	GF	On-Demand	Anodyne	PREP	57	36
O=C(OCN1C(=O)c2ccccc2C1=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285741	GF	On-Demand	Anodyne	FKBP1A	69	41
O=C(OCN1C(=O)c2ccccc2C1=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285741	GF	On-Demand	Anodyne	PREP	57	36
O=C(OC[C@H]1COc2ccccc2O1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285742	GG	On-Demand	Anodyne	FKBP1A	41	37
O=C(OC[C@@H]1COc2ccccc2O1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285743	GG	On-Demand	Anodyne	FKBP1A	41	37
O=C(OC[C@H]1COc2ccccc2O1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285744	GG	On-Demand	Anodyne	FKBP1A	41	37
O=C(OC[C@@H]1COc2ccccc2O1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285745	GG	On-Demand	Anodyne	FKBP1A	41	37
CCS(=O)(=O)C[C@@H](C)NC(=O)NNc1ccc(OC)cc1Br	ZINC000875285773	GD	On-Demand	Reactive	CA9	16	43
CCS(=O)(=O)C[C@H](C)NC(=O)NNc1ccc(OC)cc1Br	ZINC000875285774	GD	On-Demand	Reactive	CA9	16	43
CCS(=O)(=O)C[C@H](C)NC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875285775	FE	On-Demand	Anodyne	ACE	30	41
CCS(=O)(=O)C[C@H](C)NC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875285775	FE	On-Demand	Anodyne	WNT3	46	33
CCS(=O)(=O)C[C@H](C)NC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875285776	FE	On-Demand	Anodyne	ACE	30	41
CCS(=O)(=O)C[C@H](C)NC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875285776	FE	On-Demand	Anodyne	WNT3	46	33
CCS(=O)(=O)C[C@H](C)NC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875285777	FE	On-Demand	Anodyne	ACE	30	41
CCS(=O)(=O)C[C@H](C)NC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875285777	FE	On-Demand	Anodyne	WNT3	46	33
CCS(=O)(=O)C[C@H](C)NC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875285778	FE	On-Demand	Anodyne	ACE	30	41
CCS(=O)(=O)C[C@H](C)NC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875285778	FE	On-Demand	Anodyne	WNT3	46	33
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc(O)c(O)c1	ZINC000875285787	GF	On-Demand	Clean	FKBP1A	48	36
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc(O)c(O)c1	ZINC000875285787	GF	On-Demand	Clean	PREP	40	37
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc(O)c(O)c1	ZINC000875285788	GF	On-Demand	Clean	FKBP1A	48	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc(O)c(O)c1	ZINC000875285788	GF	On-Demand	Clean	PREP	40	37
CO[C@H](CNC(=O)N1CC(c2ccccc2)C1)C(F)(F)F	ZINC000875285793	DE	On-Demand	Anodyne	RBP4	67	42
C[C@H](CS(C)(=O)=O)NC(=O)N1CC[C@@H](c2cccc(Cl)c2)C1(C)C	ZINC000875285809	FG	On-Demand	Anodyne	MDM2	157	43
C[C@H](CS(C)(=O)=O)NC(=O)N1CC[C@H](c2cccc(Cl)c2)C1(C)C	ZINC000875285810	FG	On-Demand	Anodyne	MDM2	157	43
O=C(NCC[C@H]1CCSC1)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000875285829	FF	On-Demand	Anodyne	VCP	20	40
O=C(NCC[C@@H]1CCSC1)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000875285830	FF	On-Demand	Anodyne	VCP	20	40
O=C(NC1CCC(N2CCCCC2)CC1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875285831	GC	On-Demand	Anodyne	L3MBTL3	57	35
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCC1(N2CCOCC2)CCCCC1	ZINC000875285837	JE	On-Demand	Anodyne	FKBP1A	28	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCC1(N2CCOCC2)CCCCC1	ZINC000875285837	JE	On-Demand	Anodyne	HCN1	56	35
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCC1(N2CCOCC2)CCCCC1	ZINC000875285837	JE	On-Demand	Anodyne	HCN4	53	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCC1(N2CCOCC2)CCCCC1	ZINC000875285838	JE	On-Demand	Anodyne	FKBP1A	28	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCC1(N2CCOCC2)CCCCC1	ZINC000875285838	JE	On-Demand	Anodyne	HCN1	56	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCC1(N2CCOCC2)CCCCC1	ZINC000875285838	JE	On-Demand	Anodyne	HCN4	53	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCCCSc1ccccc1	ZINC000875285861	IH	On-Demand	Anodyne	FKBP1A	77	42
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCCCSc1ccccc1	ZINC000875285861	IH	On-Demand	Anodyne	PREP	57	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCCCSc1ccccc1	ZINC000875285862	IH	On-Demand	Anodyne	FKBP1A	77	42
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCCCSc1ccccc1	ZINC000875285862	IH	On-Demand	Anodyne	PREP	57	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1cccc(F)c1	ZINC000875285863	GG	On-Demand	Anodyne	FKBP1A	49	35
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1cccc(F)c1	ZINC000875285863	GG	On-Demand	Anodyne	PREP	41	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1cccc(F)c1	ZINC000875285864	GG	On-Demand	Anodyne	FKBP1A	49	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1cccc(F)c1	ZINC000875285864	GG	On-Demand	Anodyne	PREP	41	41
COc1ccc2cc(CN(C)C(=O)COC(=O)[C@H]3CCCCN3C(=O)c3cccs3)ccc2c1	ZINC000875285865	JI	On-Demand	Anodyne	FKBP1A	75	42
COc1ccc2cc(CN(C)C(=O)COC(=O)[C@@H]3CCCCN3C(=O)c3cccs3)ccc2c1	ZINC000875285866	JI	On-Demand	Anodyne	FKBP1A	75	42
CC(C)c1ccc(CCNC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875285867	IH	On-Demand	Anodyne	FKBP1A	89	40
CC(C)c1ccc(CCNC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875285867	IH	On-Demand	Anodyne	PREP	47	35
CC(C)c1ccc(CCNC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875285867	IH	On-Demand	Anodyne	LGMN	47	39
CC(C)c1ccc(CCNC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875285868	IH	On-Demand	Anodyne	FKBP1A	89	40
CC(C)c1ccc(CCNC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875285868	IH	On-Demand	Anodyne	PREP	47	35
CC(C)c1ccc(CCNC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875285868	IH	On-Demand	Anodyne	LGMN	47	39
O=C(OCc1ccc2ccccc2n1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285873	GI	On-Demand	Anodyne	ALOX5	28	46
O=C(OCc1ccc2ccccc2n1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285873	GI	On-Demand	Anodyne	FKBP1A	60	41
O=C(OCc1ccc2ccccc2n1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285873	GI	On-Demand	Anodyne	PREP	48	39
O=C(OCc1ccc2ccccc2n1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285874	GI	On-Demand	Anodyne	ALOX5	28	46
O=C(OCc1ccc2ccccc2n1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285874	GI	On-Demand	Anodyne	FKBP1A	60	41
O=C(OCc1ccc2ccccc2n1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285874	GI	On-Demand	Anodyne	PREP	48	39
O=C(OCC(=O)N1CCN(Cc2cccs2)CC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285875	JF	On-Demand	Anodyne	CPT2	41	32
O=C(OCC(=O)N1CCN(Cc2cccs2)CC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285875	JF	On-Demand	Anodyne	PREP	46	36
O=C(OCC(=O)N1CCN(Cc2cccs2)CC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285876	JF	On-Demand	Anodyne	CPT2	41	32
O=C(OCC(=O)N1CCN(Cc2cccs2)CC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285876	JF	On-Demand	Anodyne	PREP	46	36
CCCN(Cc1ccc(C)cc1)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285878	II	On-Demand	Anodyne	FKBP1A	62	37
CCCN(Cc1ccc(C)cc1)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285879	II	On-Demand	Anodyne	FKBP1A	62	37
CCC[C@H](CCO)NC(=O)NCc1cccc(O[C@H](C#N)CC)c1	ZINC000875285884	EF	On-Demand	Mild	PDS	44	39
CCC[C@@H](CCO)NC(=O)NCc1cccc(O[C@H](C#N)CC)c1	ZINC000875285885	EF	On-Demand	Mild	PDS	44	39
CCC[C@H](CCO)NC(=O)NCc1cccc(O[C@@H](C#N)CC)c1	ZINC000875285886	EF	On-Demand	Mild	PDS	44	39
CCC[C@@H](CCO)NC(=O)NCc1cccc(O[C@@H](C#N)CC)c1	ZINC000875285887	EF	On-Demand	Mild	PDS	44	39
O=C(OCc1nc(-c2cccc(Br)c2)no1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285900	JI	On-Demand	Anodyne	CPT1A	66	39
C[C@H](CS(C)(=O)=O)NC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875285901	FD	On-Demand	Anodyne	ACE	27	40
O=C(OCc1nc(-c2cccc(Br)c2)no1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285902	JI	On-Demand	Anodyne	CPT1A	66	39
C[C@H](CS(C)(=O)=O)NC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875285903	FD	On-Demand	Anodyne	ACE	27	40
C[C@H](CS(C)(=O)=O)NC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875285905	FD	On-Demand	Anodyne	ACE	27	40
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@](C)(CO)Cc2ccccc2F)c1	ZINC000875285906	GG	On-Demand	Mild	PDS	51	35
C[C@H](CS(C)(=O)=O)NC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875285907	FD	On-Demand	Anodyne	ACE	27	40
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@](C)(CO)Cc2ccccc2F)c1	ZINC000875285909	GG	On-Demand	Mild	PDS	51	35
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@@](C)(CO)Cc2ccccc2F)c1	ZINC000875285911	GG	On-Demand	Mild	PDS	51	35
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@](C)(CO)Cc2ccccc2F)c1	ZINC000875285913	GG	On-Demand	Mild	PDS	51	35
CCC1(N(C)C)CCN(C(=O)C(=O)NC2CCC(N3CCCCC3)CC2)CC1	ZINC000875285920	GE	On-Demand	Anodyne	L3MBTL3	46	34
O=C(NC1CCC(N2CCCCC2)CC1)C(=O)N[C@H](c1ccccn1)C1CCC1	ZINC000875285934	GF	On-Demand	Anodyne	TTK	30	42
O=C(NC1CCC(N2CCCCC2)CC1)C(=O)N[C@H](c1ccccn1)C1CCC1	ZINC000875285934	GF	On-Demand	Anodyne	L3MBTL3	51	35
O=C(NC1CCC(N2CCCCC2)CC1)C(=O)N[C@@H](c1ccccn1)C1CCC1	ZINC000875285935	GF	On-Demand	Anodyne	TTK	30	42
O=C(NC1CCC(N2CCCCC2)CC1)C(=O)N[C@@H](c1ccccn1)C1CCC1	ZINC000875285935	GF	On-Demand	Anodyne	L3MBTL3	51	35
O=C(OCCSc1ccc(Cl)cc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285936	HJ	On-Demand	Anodyne	FKBP1A	59	40
O=C(OCCSc1ccc(Cl)cc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285937	HJ	On-Demand	Anodyne	FKBP1A	59	40
O=C(OCC1CCCCC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285938	EH	On-Demand	Anodyne	FKBP1A	70	42
O=C(OCC1CCCCC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285938	EH	On-Demand	Anodyne	PREP	74	38
O=C(OCC1CCCCC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285939	EH	On-Demand	Anodyne	FKBP1A	70	42
O=C(OCC1CCCCC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285939	EH	On-Demand	Anodyne	PREP	74	38
COC(=O)c1cc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc(C(=O)OC)c1	ZINC000875285950	JE	On-Demand	Anodyne	FKBP1A	52	36
COC(=O)c1cc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc(C(=O)OC)c1	ZINC000875285950	JE	On-Demand	Anodyne	PREP	34	42
COC(=O)c1cc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc(C(=O)OC)c1	ZINC000875285951	JE	On-Demand	Anodyne	FKBP1A	52	36
COC(=O)c1cc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc(C(=O)OC)c1	ZINC000875285951	JE	On-Demand	Anodyne	PREP	34	42
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc2c(c1)OCO2	ZINC000875285964	HF	On-Demand	Anodyne	FKBP1A	33	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc2c(c1)OCO2	ZINC000875285964	HF	On-Demand	Anodyne	CPT1A	29	42
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc2c(c1)OCO2	ZINC000875285965	HF	On-Demand	Anodyne	FKBP1A	33	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc2c(c1)OCO2	ZINC000875285965	HF	On-Demand	Anodyne	CPT1A	29	42
CCS(=O)(=O)C[C@@H](C)NC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875285970	GF	On-Demand	Anodyne	RBP4	35	40
CCS(=O)(=O)C[C@H](C)NC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875285971	GF	On-Demand	Anodyne	RBP4	35	40
CCS(=O)(=O)C[C@@H](C)NC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875285972	GF	On-Demand	Anodyne	RBP4	35	40
CCS(=O)(=O)C[C@H](C)NC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875285973	GF	On-Demand	Anodyne	RBP4	35	40
CCCOc1ccc(OCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875285982	HI	On-Demand	Anodyne	FKBP1A	100	45
CCCOc1ccc(OCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875285982	HI	On-Demand	Anodyne	CPT1A	44	36
CCCOc1ccc(OCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875285982	HI	On-Demand	Anodyne	CPT2	40	36
CCCOc1ccc(OCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875285982	HI	On-Demand	Anodyne	PREP	45	35
CCCOc1ccc(OCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875285983	HI	On-Demand	Anodyne	FKBP1A	100	45
CCCOc1ccc(OCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875285983	HI	On-Demand	Anodyne	CPT1A	44	36
CCCOc1ccc(OCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875285983	HI	On-Demand	Anodyne	CPT2	40	36
CCCOc1ccc(OCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875285983	HI	On-Demand	Anodyne	PREP	45	35
CSc1ccc(CCNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)cc1	ZINC000875285986	GF	On-Demand	Anodyne	SIRT3	54	34
CSc1ccc(CCNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)cc1	ZINC000875285986	GF	On-Demand	Anodyne	SIRT2	55	34
CSc1ccc(CCNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)cc1	ZINC000875285986	GF	On-Demand	Anodyne	SIRT1	54	34
O=C(OCCCn1c(O)nc2ccccc21)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285987	HG	On-Demand	Anodyne	FKBP1A	66	42
O=C(OCCCn1c(O)nc2ccccc21)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285987	HG	On-Demand	Anodyne	PDE6D	53	39
O=C(OCCCn1c(O)nc2ccccc21)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875285987	HG	On-Demand	Anodyne	PREP	43	35
O=C(OCCCn1c(O)nc2ccccc21)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285988	HG	On-Demand	Anodyne	FKBP1A	66	42
O=C(OCCCn1c(O)nc2ccccc21)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285988	HG	On-Demand	Anodyne	PDE6D	53	39
O=C(OCCCn1c(O)nc2ccccc21)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875285988	HG	On-Demand	Anodyne	PREP	43	35
CSc1ccc(CCNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875285989	ED	On-Demand	Anodyne	GPBAR1	20	41
CSc1ccc(CCNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875285990	ED	On-Demand	Anodyne	GPBAR1	20	41
CCOC(=O)C1=C(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)NC(=O)N[C@H]1C	ZINC000875285995	ID	On-Demand	Anodyne	FKBP1A	44	41
CCOC(=O)C1=C(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)NC(=O)N[C@H]1C	ZINC000875285996	ID	On-Demand	Anodyne	FKBP1A	44	41
CCOC(=O)C1=C(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)NC(=O)N[C@@H]1C	ZINC000875285997	ID	On-Demand	Anodyne	FKBP1A	44	41
CCOC(=O)C1=C(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)NC(=O)N[C@@H]1C	ZINC000875285998	ID	On-Demand	Anodyne	FKBP1A	44	41
Cc1nn(-c2ccccc2)c(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1C#N	ZINC000875286021	IH	On-Demand	Mild	PREP	44	38
Cc1nn(-c2ccccc2)c(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1C#N	ZINC000875286022	IH	On-Demand	Mild	PREP	44	38
O=C(OCCCc1nc(-c2ccccc2)no1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286025	IH	On-Demand	Anodyne	FKBP1A	77	46
O=C(OCCCc1nc(-c2ccccc2)no1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286025	IH	On-Demand	Anodyne	CPT1A	91	39
O=C(OCCCc1nc(-c2ccccc2)no1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286025	IH	On-Demand	Anodyne	PREP	51	40
O=C(OCCCc1nc(-c2ccccc2)no1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286026	IH	On-Demand	Anodyne	FKBP1A	77	46
O=C(OCCCc1nc(-c2ccccc2)no1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286026	IH	On-Demand	Anodyne	CPT1A	91	39
O=C(OCCCc1nc(-c2ccccc2)no1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286026	IH	On-Demand	Anodyne	PREP	51	40
O=C(NCc1cccc(-c2cccnc2)c1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875286042	FF	On-Demand	Anodyne	NAMPT	41	35
O=C(NCc1cccc(-c2cccnc2)c1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875286051	GF	On-Demand	Anodyne	CHRNA7	47	38
O=C(NCc1cccc(-c2cccnc2)c1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875286051	GF	On-Demand	Anodyne	NAMPT	47	36
O=C(NCc1cccc(-c2cccnc2)c1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875286052	GF	On-Demand	Anodyne	CHRNA7	47	38
O=C(NCc1cccc(-c2cccnc2)c1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875286052	GF	On-Demand	Anodyne	NAMPT	47	36
O=C(NCc1cccc(-c2cccnc2)c1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875286053	GF	On-Demand	Anodyne	CHRNA7	47	38
O=C(NCc1cccc(-c2cccnc2)c1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875286053	GF	On-Demand	Anodyne	NAMPT	47	36
O=C(NCc1cccc(-c2cccnc2)c1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875286054	GF	On-Demand	Anodyne	CHRNA7	47	38
O=C(NCc1cccc(-c2cccnc2)c1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875286054	GF	On-Demand	Anodyne	NAMPT	47	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1cnc(N2CCCCC2)s1	ZINC000875286057	IH	On-Demand	Anodyne	FKBP1A	44	35
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1cnc(N2CCCCC2)s1	ZINC000875286057	IH	On-Demand	Anodyne	PREP	48	36
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1cnc(N2CCCCC2)s1	ZINC000875286058	IH	On-Demand	Anodyne	FKBP1A	44	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1cnc(N2CCCCC2)s1	ZINC000875286058	IH	On-Demand	Anodyne	PREP	48	36
O=C(OCC(=O)N1CCN(C(=O)Nc2ccccc2)CC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286061	JF	On-Demand	Anodyne	FKBP1A	49	47
O=C(OCC(=O)N1CCN(C(=O)Nc2ccccc2)CC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286061	JF	On-Demand	Anodyne	CPT1A	47	38
O=C(OCC(=O)N1CCN(C(=O)Nc2ccccc2)CC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286061	JF	On-Demand	Anodyne	CPT2	43	35
O=C(OCC(=O)N1CCN(C(=O)Nc2ccccc2)CC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286061	JF	On-Demand	Anodyne	PREP	63	36
O=C(OCC(=O)N1CCN(C(=O)Nc2ccccc2)CC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286062	JF	On-Demand	Anodyne	FKBP1A	49	47
O=C(OCC(=O)N1CCN(C(=O)Nc2ccccc2)CC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286062	JF	On-Demand	Anodyne	CPT1A	47	38
O=C(OCC(=O)N1CCN(C(=O)Nc2ccccc2)CC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286062	JF	On-Demand	Anodyne	CPT2	43	35
O=C(OCC(=O)N1CCN(C(=O)Nc2ccccc2)CC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286062	JF	On-Demand	Anodyne	PREP	63	36
O=C(NC1CCC(N2CCCCC2)CC1)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875286073	GE	On-Demand	Anodyne	L3MBTL3	56	35
O=C(NC1CCC(N2CCCCC2)CC1)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875286074	GE	On-Demand	Anodyne	L3MBTL3	56	35
O=C(NC1CCC(N2CCCCC2)CC1)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875286075	GE	On-Demand	Anodyne	L3MBTL3	56	35
O=C(NC1CCC(N2CCCCC2)CC1)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875286076	GE	On-Demand	Anodyne	L3MBTL3	56	35
O=C(NCc1cccc2[nH]ccc12)C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000875286082	GF	On-Demand	Anodyne	L3MBTL3	45	33
CC[C@@H](C#N)Oc1cccc(CNC(=O)NCCN2CC[C@@H](O)C2)c1	ZINC000875286083	ED	On-Demand	Mild	DRD4	43	34
CC[C@@H](C#N)Oc1cccc(CNC(=O)NCCN2CC[C@@H](O)C2)c1	ZINC000875286083	ED	On-Demand	Mild	HRH2	36	41
CC[C@@H](C#N)Oc1cccc(CNC(=O)NCCN2CC[C@@H](O)C2)c1	ZINC000875286083	ED	On-Demand	Mild	MCHR1	16	40
CC[C@@H](C#N)Oc1cccc(CNC(=O)NCCN2CC[C@H](O)C2)c1	ZINC000875286084	ED	On-Demand	Mild	DRD4	43	34
CC[C@@H](C#N)Oc1cccc(CNC(=O)NCCN2CC[C@H](O)C2)c1	ZINC000875286084	ED	On-Demand	Mild	HRH2	36	41
CC[C@@H](C#N)Oc1cccc(CNC(=O)NCCN2CC[C@H](O)C2)c1	ZINC000875286084	ED	On-Demand	Mild	MCHR1	16	40
CC[C@H](C#N)Oc1cccc(CNC(=O)NCCN2CC[C@@H](O)C2)c1	ZINC000875286085	ED	On-Demand	Mild	DRD4	43	34
CC[C@H](C#N)Oc1cccc(CNC(=O)NCCN2CC[C@@H](O)C2)c1	ZINC000875286085	ED	On-Demand	Mild	HRH2	36	41
CC[C@H](C#N)Oc1cccc(CNC(=O)NCCN2CC[C@@H](O)C2)c1	ZINC000875286085	ED	On-Demand	Mild	MCHR1	16	40
CC[C@H](C#N)Oc1cccc(CNC(=O)NCCN2CC[C@H](O)C2)c1	ZINC000875286086	ED	On-Demand	Mild	DRD4	43	34
CC[C@H](C#N)Oc1cccc(CNC(=O)NCCN2CC[C@H](O)C2)c1	ZINC000875286086	ED	On-Demand	Mild	HRH2	36	41
CC[C@H](C#N)Oc1cccc(CNC(=O)NCCN2CC[C@H](O)C2)c1	ZINC000875286086	ED	On-Demand	Mild	MCHR1	16	40
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CC(c3ccccc3)C2)c1	ZINC000875286087	EH	On-Demand	Mild	PDS	68	41
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CC(c3ccccc3)C2)c1	ZINC000875286088	EH	On-Demand	Mild	PDS	68	41
COc1cc(CNC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc(OC)c1OC	ZINC000875286091	JF	On-Demand	Anodyne	FKBP1A	110	51
COc1cc(CNC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc(OC)c1OC	ZINC000875286092	JF	On-Demand	Anodyne	FKBP1A	110	51
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC(=O)Nc1ccc2c(c1)OCCO2	ZINC000875286111	JE	On-Demand	Anodyne	NOS1	43	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC(=O)Nc1ccc2c(c1)OCCO2	ZINC000875286113	JE	On-Demand	Anodyne	NOS1	43	37
COC(=O)c1c(C)[nH]c(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1C	ZINC000875286123	IF	On-Demand	Anodyne	FKBP1A	40	35
COC(=O)c1c(C)[nH]c(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1C	ZINC000875286124	IF	On-Demand	Anodyne	FKBP1A	40	35
CO[C@H](CNC(=O)N(Cc1cccc(O)c1)[C@@H]1CC[C@@H](O)CC1)C(F)(F)F	ZINC000875286126	GF	On-Demand	Anodyne	HSD17B2	21	44
CC(=O)Nc1ccc2c(COC(=O)[C@H]3CCCCN3C(=O)c3cccs3)cc(=O)oc2c1	ZINC000875286139	JH	On-Demand	Anodyne	FKBP1A	32	40
CC(=O)Nc1ccc2c(COC(=O)[C@@H]3CCCCN3C(=O)c3cccs3)cc(=O)oc2c1	ZINC000875286140	JH	On-Demand	Anodyne	FKBP1A	32	40
CCOC(=O)N1CCC(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875286151	JE	On-Demand	Anodyne	FKBP1A	58	39
CCOC(=O)N1CCC(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875286151	JE	On-Demand	Anodyne	CCR8	23	42
CCOC(=O)N1CCC(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875286151	JE	On-Demand	Anodyne	WNT3	41	32
CCOC(=O)N1CCC(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875286152	JE	On-Demand	Anodyne	FKBP1A	58	39
CCOC(=O)N1CCC(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875286152	JE	On-Demand	Anodyne	CCR8	23	42
CCOC(=O)N1CCC(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875286152	JE	On-Demand	Anodyne	WNT3	41	32
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000875286196	JF	On-Demand	Anodyne	FKBP1A	46	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000875286197	JF	On-Demand	Anodyne	FKBP1A	46	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC(=O)NC1CCCC1	ZINC000875286215	HE	On-Demand	Anodyne	FKBP1A	48	39
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC(=O)NC1CCCC1	ZINC000875286215	HE	On-Demand	Anodyne	PREP	46	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC(=O)NC1CCCC1	ZINC000875286216	HE	On-Demand	Anodyne	FKBP1A	48	39
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC(=O)NC1CCCC1	ZINC000875286216	HE	On-Demand	Anodyne	PREP	46	38
CC[C@@H](C#N)Oc1cccc(CNC(=O)NCCN(C)CC(F)F)c1	ZINC000875286233	FE	On-Demand	Mild	PDS	48	35
CC[C@H](C#N)Oc1cccc(CNC(=O)NCCN(C)CC(F)F)c1	ZINC000875286234	FE	On-Demand	Mild	PDS	48	35
O=C(NCc1cccc2ncccc12)C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000875286235	GF	On-Demand	Anodyne	L3MBTL3	43	34
O=C(NCC1CC=CC1)C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000875286236	ED	On-Demand	Anodyne	L3MBTL3	57	35
Nc1nc(N)nc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)n1	ZINC000875286255	FC	On-Demand	Anodyne	FKBP1A	56	42
Nc1nc(N)nc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)n1	ZINC000875286255	FC	On-Demand	Anodyne	PREP	56	40
Nc1nc(N)nc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)n1	ZINC000875286256	FC	On-Demand	Anodyne	FKBP1A	56	42
Nc1nc(N)nc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)n1	ZINC000875286256	FC	On-Demand	Anodyne	PREP	56	40
O=C(NC1CCC(N2CCCCC2)CC1)C(=O)N1CCCC2(CC1)CC2	ZINC000875286261	FF	On-Demand	Anodyne	L3MBTL3	47	36
CC(=O)C1CCN(C(=O)C(=O)NC2CCC(N3CCCCC3)CC2)CC1	ZINC000875286262	FD	On-Demand	Anodyne	L3MBTL3	75	39
O=C(OCC(=O)N1CCN(c2cccc(Cl)c2)CC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286264	JG	On-Demand	Anodyne	CPT1A	22	54
O=C(OCC(=O)N1CCN(c2cccc(Cl)c2)CC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286264	JG	On-Demand	Anodyne	CPT2	29	54
O=C(OCC(=O)N1CCN(c2cccc(Cl)c2)CC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286265	JG	On-Demand	Anodyne	CPT1A	22	54
O=C(OCC(=O)N1CCN(c2cccc(Cl)c2)CC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286265	JG	On-Demand	Anodyne	CPT2	29	54
O=C(NC1CCC(N2CCCCC2)CC1)C(=O)N[C@H]1CCCn2nccc21	ZINC000875286267	FD	On-Demand	Anodyne	L3MBTL3	74	37
O=C(NC1CCC(N2CCCCC2)CC1)C(=O)N[C@@H]1CCCn2nccc21	ZINC000875286268	FD	On-Demand	Anodyne	L3MBTL3	74	37
COCC(C)(C)CCNC(=O)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000875286269	FF	On-Demand	Anodyne	PTAFR	17	40
COC(=O)N(C)NC(=O)NCCOc1cccc(C(C)(C)C)c1	ZINC000875286288	DE	On-Demand	Reactive	MTNR1A	34	47
COC(=O)N(C)NC(=O)NCCOc1cccc(C(C)(C)C)c1	ZINC000875286288	DE	On-Demand	Reactive	MTNR1B	23	47
COC(=O)N(C)NC(=O)NCCOc1cccc(C(C)(C)C)c1	ZINC000875286288	DE	On-Demand	Reactive	PDS	46	37
CCCCC[C@@H](C)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286289	GG	On-Demand	Anodyne	FKBP1A	75	39
CCCCC[C@@H](C)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286291	GG	On-Demand	Anodyne	FKBP1A	75	39
CN(C)S(=O)(=O)c1ccc(OCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286294	JF	On-Demand	Anodyne	FKBP1A	71	46
CN(C)S(=O)(=O)c1ccc(OCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286294	JF	On-Demand	Anodyne	ADAM17	19	42
CN(C)S(=O)(=O)c1ccc(OCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286294	JF	On-Demand	Anodyne	MMP3	21	40
CN(C)S(=O)(=O)c1ccc(OCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286294	JF	On-Demand	Anodyne	MMP7	26	40
CN(C)S(=O)(=O)c1ccc(OCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286294	JF	On-Demand	Anodyne	MMP1	23	42
CN(C)S(=O)(=O)c1ccc(OCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286295	JF	On-Demand	Anodyne	FKBP1A	71	46
CN(C)S(=O)(=O)c1ccc(OCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286295	JF	On-Demand	Anodyne	ADAM17	19	42
CN(C)S(=O)(=O)c1ccc(OCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286295	JF	On-Demand	Anodyne	MMP3	21	40
CN(C)S(=O)(=O)c1ccc(OCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286295	JF	On-Demand	Anodyne	MMP7	26	40
CN(C)S(=O)(=O)c1ccc(OCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286295	JF	On-Demand	Anodyne	MMP1	23	42
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@](O)(c3ccccc3)C2)c1	ZINC000875286311	GH	On-Demand	Mild	PDS	44	38
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@](O)(c3ccccc3)C2)c1	ZINC000875286312	GH	On-Demand	Mild	PDS	44	38
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)c1	ZINC000875286313	GH	On-Demand	Mild	PDS	44	38
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)c1	ZINC000875286314	GH	On-Demand	Mild	PDS	44	38
Cc1cc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)on1	ZINC000875286322	EF	On-Demand	Anodyne	FKBP1A	60	41
Cc1cc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)on1	ZINC000875286322	EF	On-Demand	Anodyne	CPT1A	47	38
Cc1cc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)on1	ZINC000875286322	EF	On-Demand	Anodyne	PREP	47	40
COc1ccc(OC)c([C@H](C)NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875286324	JG	On-Demand	Anodyne	FKBP1A	81	43
COc1ccc(OC)c([C@H](C)NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875286326	JG	On-Demand	Anodyne	FKBP1A	81	43
O=C(OCc1cccc(F)c1F)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286333	FH	On-Demand	Anodyne	FKBP1A	46	40
O=C(OCc1cccc(F)c1F)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286333	FH	On-Demand	Anodyne	PREP	43	35
O=C(OCc1cccc(F)c1F)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286334	FH	On-Demand	Anodyne	FKBP1A	46	40
O=C(OCc1cccc(F)c1F)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286334	FH	On-Demand	Anodyne	PREP	43	35
CC[C@@H](C#N)Oc1cccc(CNC(=O)NCC2CC(O)C2)c1	ZINC000875286336	DD	On-Demand	Mild	PDS	57	39
CC[C@H](C#N)Oc1cccc(CNC(=O)NC[C@@H]2C[C@H](O)C2)c1	ZINC000875286337	DD	On-Demand	Mild	PDS	57	39
CC[C@H](C#N)Oc1cccc(CNC(=O)NCC2CC(O)C2)c1	ZINC000875286338	DD	On-Demand	Mild	PDS	57	39
CC[C@@H](C#N)Oc1cccc(CNC(=O)NC[C@@H]2C[C@H](O)C2)c1	ZINC000875286339	DD	On-Demand	Mild	PDS	57	39
CC[C@@H](C#N)Oc1cccc(CNC(=O)NC(C)(C)C(C)(C)O)c1	ZINC000875286354	EF	On-Demand	Mild	PDS	63	38
CC[C@H](C#N)Oc1cccc(CNC(=O)NC(C)(C)C(C)(C)O)c1	ZINC000875286355	EF	On-Demand	Mild	PDS	63	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC(=O)NCC(F)(F)F	ZINC000875286360	HD	On-Demand	Anodyne	FKBP1A	41	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC(=O)NCC(F)(F)F	ZINC000875286361	HD	On-Demand	Anodyne	FKBP1A	41	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)C1CCCC1	ZINC000875286364	CE	On-Demand	Anodyne	RIR1_HHV11	40	33
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)C1CCCC1	ZINC000875286365	CE	On-Demand	Anodyne	RIR1_HHV11	40	33
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CC[C@H](c3ccc(O)cc3)C2)c1	ZINC000875286369	GH	On-Demand	Mild	CCR1	27	40
N#CCCCCOC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286378	DF	On-Demand	Mild	FKBP1A	74	45
N#CCCCCOC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286378	DF	On-Demand	Mild	PREP	57	36
N#CCCCCOC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286378	DF	On-Demand	Mild	LGMN	63	34
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CC[C@H](c3ccc(O)cc3)C2)c1	ZINC000875286379	GH	On-Demand	Mild	CCR1	27	40
N#CCCCCOC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286380	DF	On-Demand	Mild	FKBP1A	74	45
N#CCCCCOC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286380	DF	On-Demand	Mild	PREP	57	36
N#CCCCCOC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286380	DF	On-Demand	Mild	LGMN	63	34
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CC[C@@H](c3ccc(O)cc3)C2)c1	ZINC000875286381	GH	On-Demand	Mild	CCR1	27	40
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CC[C@@H](c3ccc(O)cc3)C2)c1	ZINC000875286383	GH	On-Demand	Mild	CCR1	27	40
O=C(NCc1cccc(F)c1F)C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000875286385	GE	On-Demand	Anodyne	P2RX7	22	43
O=C(NCc1cccc(F)c1F)C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000875286385	GE	On-Demand	Anodyne	L3MBTL3	76	35
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@H]2CCC[C@@H]2O)c1	ZINC000875286387	DE	On-Demand	Mild	PDS	43	36
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H]2CCC[C@@H]2O)c1	ZINC000875286388	DE	On-Demand	Mild	PDS	43	36
O=C(NCCCCC1CC1)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000875286389	FG	On-Demand	Anodyne	PTAFR	19	43
O=C(NCCCCC1CC1)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000875286389	FG	On-Demand	Anodyne	VCP	20	40
O=C(NCCCCC1CC1)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000875286389	FG	On-Demand	Anodyne	NAMPT	40	44
O=C(OCc1cscn1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286401	EF	On-Demand	Anodyne	FKBP1A	53	40
O=C(OCc1cscn1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286401	EF	On-Demand	Anodyne	PREP	50	39
O=C(OCc1cscn1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286402	EF	On-Demand	Anodyne	FKBP1A	53	40
O=C(OCc1cscn1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286402	EF	On-Demand	Anodyne	PREP	50	39
Cc1ccccc1CNC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286404	HF	On-Demand	Anodyne	FKBP1A	79	41
Cc1ccccc1CNC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286404	HF	On-Demand	Anodyne	AVPR2	15	40
Cc1ccccc1CNC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286404	HF	On-Demand	Anodyne	P2RX7	18	40
Cc1ccccc1CNC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286404	HF	On-Demand	Anodyne	PREP	43	37
Cc1ccccc1CNC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286406	HF	On-Demand	Anodyne	FKBP1A	79	41
Cc1ccccc1CNC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286406	HF	On-Demand	Anodyne	AVPR2	15	40
Cc1ccccc1CNC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286406	HF	On-Demand	Anodyne	P2RX7	18	40
Cc1ccccc1CNC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286406	HF	On-Demand	Anodyne	PREP	43	37
CS(=O)(=O)NCCc1ccc(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286414	JE	On-Demand	Anodyne	FKBP1A	74	38
CS(=O)(=O)NCCc1ccc(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286416	JE	On-Demand	Anodyne	FKBP1A	74	38
C[C@H](NC(=O)C(=O)NC1CCC(N2CCCCC2)CC1)c1ccnn1C	ZINC000875286418	FD	On-Demand	Anodyne	L3MBTL3	50	35
O=C(OCc1csc(-c2ccsc2)n1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286422	HJ	On-Demand	Anodyne	FKBP1A	47	39
O=C(OCc1csc(-c2ccsc2)n1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286424	HJ	On-Demand	Anodyne	FKBP1A	47	39
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H](C)Oc2ccccc2)C1	ZINC000875286427	EE	On-Demand	Anodyne	CAPN2	68	35
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H](C)Oc2ccccc2)C1	ZINC000875286428	EE	On-Demand	Anodyne	CAPN2	68	35
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CC[C@@H]3CC[C@@H](O)[C@@H]32)c1	ZINC000875286450	EE	On-Demand	Mild	PDS	40	35
C[C@@H]1CCN(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c2ccccc2S1	ZINC000875286451	JI	On-Demand	Anodyne	FKBP1A	57	38
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CC[C@@H]3CC[C@@H](O)[C@@H]32)c1	ZINC000875286452	EE	On-Demand	Mild	PDS	40	35
CCCCNC(=O)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286453	GD	On-Demand	Anodyne	FKBP1A	59	38
CCCCNC(=O)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286454	GD	On-Demand	Anodyne	FKBP1A	59	38
C[C@H]1CCN(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c2ccccc2S1	ZINC000875286455	JI	On-Demand	Anodyne	FKBP1A	57	38
C[C@@H]1CCN(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c2ccccc2S1	ZINC000875286457	JI	On-Demand	Anodyne	FKBP1A	57	38
C[C@H]1CCN(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c2ccccc2S1	ZINC000875286458	JI	On-Demand	Anodyne	FKBP1A	57	38
C[C@@H](CNC(=O)N1CCC[C@H](OC2CCC2)CC1)Oc1ccccc1	ZINC000875286460	EH	On-Demand	Anodyne	EPHX2	26	44
C[C@@H](CNC(=O)N1CCC[C@@H](OC2CCC2)CC1)Oc1ccccc1	ZINC000875286461	EH	On-Demand	Anodyne	EPHX2	26	44
Cc1cc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)no1	ZINC000875286481	EF	On-Demand	Anodyne	FKBP1A	69	41
Cc1cc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)no1	ZINC000875286481	EF	On-Demand	Anodyne	CPT1A	46	39
Cc1cc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)no1	ZINC000875286481	EF	On-Demand	Anodyne	PREP	48	40
CC[C@@H](C#N)Oc1cccc(CNC(=O)NCC[C@@H](O)C(F)F)c1	ZINC000875286486	EE	On-Demand	Mild	PDS	55	37
CC[C@@H](C#N)Oc1cccc(CNC(=O)NCC[C@H](O)C(F)F)c1	ZINC000875286488	EE	On-Demand	Mild	PDS	55	37
N#CCc1ccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286494	HF	On-Demand	Mild	LGMN	69	34
N#CCc1ccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286495	HF	On-Demand	Mild	LGMN	69	34
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC(=O)c1cccs1	ZINC000875286496	HE	On-Demand	Anodyne	FKBP1A	59	40
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC(=O)c1cccs1	ZINC000875286496	HE	On-Demand	Anodyne	PREP	58	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC(=O)c1cccs1	ZINC000875286497	HE	On-Demand	Anodyne	FKBP1A	59	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC(=O)c1cccs1	ZINC000875286497	HE	On-Demand	Anodyne	PREP	58	38
COc1ccccc1[C@H]1CCCN(C(=O)N[C@H](C)c2c(C)noc2C)CC1	ZINC000875286502	FI	On-Demand	Anodyne	SMO	27	40
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H](C)c2c(C)noc2C)CC1	ZINC000875286503	FI	On-Demand	Anodyne	SMO	27	40
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H](C)c2c(C)noc2C)CC1	ZINC000875286504	FI	On-Demand	Anodyne	SMO	27	40
COc1ccccc1[C@H]1CCCN(C(=O)N[C@@H](C)c2c(C)noc2C)CC1	ZINC000875286505	FI	On-Demand	Anodyne	SMO	27	40
C[C@@H](NC(=O)NC1(C)CC(F)(F)C1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000875286514	GH	On-Demand	Anodyne	PRNP	40	35
C[C@H](NC(=O)NC1(C)CC(F)(F)C1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000875286515	GH	On-Demand	Anodyne	PRNP	40	35
CC[C@H](C#N)Oc1cccc(CNC(=O)NCC[C@H](O)C(F)F)c1	ZINC000875286531	EE	On-Demand	Mild	PDS	55	37
CC[C@H](C#N)Oc1cccc(CNC(=O)NCC[C@@H](O)C(F)F)c1	ZINC000875286532	EE	On-Demand	Mild	PDS	55	37
CC[C@H](C#N)Oc1cccc(CNC(=O)N2C[C@@H]3CCCC[C@@]32C)c1	ZINC000875286533	EH	On-Demand	Mild	FKBP1A	15	41
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2C[C@@H]3CCCC[C@@]32C)c1	ZINC000875286534	EH	On-Demand	Mild	FKBP1A	15	41
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NC2CCC(N3CCCCC3)CC2)CC1	ZINC000875286536	GC	On-Demand	Anodyne	L3MBTL3	45	33
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCC(=O)Nc1ccc(F)c(F)c1	ZINC000875286539	JE	On-Demand	Anodyne	NOS1	41	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCC(=O)Nc1ccc(F)c(F)c1	ZINC000875286540	JE	On-Demand	Anodyne	NOS1	41	37
Cc1cccc(NC(=O)NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1C	ZINC000875286541	IG	On-Demand	Anodyne	FKBP1A	42	35
Cc1cccc(NC(=O)NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1C	ZINC000875286542	IG	On-Demand	Anodyne	FKBP1A	42	35
Cc1ccccc1CCNC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286544	HF	On-Demand	Anodyne	FKBP1A	74	40
Cc1ccccc1CCNC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286544	HF	On-Demand	Anodyne	PREP	44	35
Cc1ccccc1CCNC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286545	HF	On-Demand	Anodyne	FKBP1A	74	40
Cc1ccccc1CCNC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286545	HF	On-Demand	Anodyne	PREP	44	35
COc1ccc(OC)c([C@H]2CCCN2C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875286547	JH	On-Demand	Anodyne	FKBP1A	91	45
COc1ccc(OC)c([C@H]2CCCN2C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875286547	JH	On-Demand	Anodyne	CPT1A	102	44
COc1ccc(OC)c([C@H]2CCCN2C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875286547	JH	On-Demand	Anodyne	CPT2	40	35
COc1ccc(OC)c([C@H]2CCCN2C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875286549	JH	On-Demand	Anodyne	FKBP1A	91	45
COc1ccc(OC)c([C@H]2CCCN2C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875286549	JH	On-Demand	Anodyne	CPT1A	102	44
COc1ccc(OC)c([C@H]2CCCN2C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875286549	JH	On-Demand	Anodyne	CPT2	40	35
NS(=O)(=O)c1ccc(OCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286552	IE	On-Demand	Anodyne	FKBP1A	69	46
NS(=O)(=O)c1ccc(OCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286552	IE	On-Demand	Anodyne	CPT1A	31	45
NS(=O)(=O)c1ccc(OCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286552	IE	On-Demand	Anodyne	MMP7	22	40
NS(=O)(=O)c1ccc(OCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286552	IE	On-Demand	Anodyne	MMP1	15	42
NS(=O)(=O)c1ccc(OCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286553	IE	On-Demand	Anodyne	FKBP1A	69	46
NS(=O)(=O)c1ccc(OCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286553	IE	On-Demand	Anodyne	CPT1A	31	45
NS(=O)(=O)c1ccc(OCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286553	IE	On-Demand	Anodyne	MMP7	22	40
NS(=O)(=O)c1ccc(OCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286553	IE	On-Demand	Anodyne	MMP1	15	42
CC[C@H](C#N)Oc1cccc(CNC(=O)N(C)OCC(F)(F)F)c1	ZINC000875286556	EG	On-Demand	Mild	PDS	66	38
CC[C@@H](C#N)Oc1cccc(CNC(=O)N(C)OCC(F)(F)F)c1	ZINC000875286557	EG	On-Demand	Mild	PDS	66	38
COc1ccc(OCCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286558	HH	On-Demand	Anodyne	FKBP1A	104	53
COc1ccc(OCCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286558	HH	On-Demand	Anodyne	HRH3	18	43
COc1ccc(OCCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286558	HH	On-Demand	Anodyne	MMP13	15	43
COc1ccc(OCCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286558	HH	On-Demand	Anodyne	CPT1A	56	37
COc1ccc(OCCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286558	HH	On-Demand	Anodyne	PREP	43	34
COc1ccc(OCCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286558	HH	On-Demand	Anodyne	MMP7	20	43
COc1ccc(OCCCOC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286558	HH	On-Demand	Anodyne	MMP1	15	43
COc1ccc(OCCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286559	HH	On-Demand	Anodyne	FKBP1A	104	53
COc1ccc(OCCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286559	HH	On-Demand	Anodyne	HRH3	18	43
COc1ccc(OCCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286559	HH	On-Demand	Anodyne	MMP13	15	43
COc1ccc(OCCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286559	HH	On-Demand	Anodyne	CPT1A	56	37
COc1ccc(OCCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286559	HH	On-Demand	Anodyne	PREP	43	34
COc1ccc(OCCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286559	HH	On-Demand	Anodyne	MMP7	20	43
COc1ccc(OCCCOC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286559	HH	On-Demand	Anodyne	MMP1	15	43
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)C1CCCC1	ZINC000875286566	EH	On-Demand	Anodyne	OPRL1	18	48
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)C1CCCC1	ZINC000875286567	EH	On-Demand	Anodyne	OPRL1	18	48
O=C(NC[C@@H]1CC[C@H]2C[C@H]2C1)C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000875286578	FE	On-Demand	Anodyne	L3MBTL3	43	35
O=C(NC[C@@H]1CC[C@@H]2C[C@@H]2C1)C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000875286579	FE	On-Demand	Anodyne	L3MBTL3	43	35
O=C(NC[C@@H]1CC[C@@H]2C[C@H]2C1)C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000875286580	FE	On-Demand	Anodyne	L3MBTL3	43	35
O=C(NC[C@@H]1CC[C@H]2C[C@@H]2C1)C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000875286581	FE	On-Demand	Anodyne	L3MBTL3	43	35
CC[C@@H](C#N)Oc1cccc(CNC(=O)NC[C@H]2c3ccccc3C(=O)N2C)c1	ZINC000875286582	GF	On-Demand	Mild	PDS	40	36
CC[C@@H](C#N)Oc1cccc(CNC(=O)NC[C@@H]2c3ccccc3C(=O)N2C)c1	ZINC000875286583	GF	On-Demand	Mild	PDS	40	36
CC[C@H](C#N)Oc1cccc(CNC(=O)NC[C@@H]2c3ccccc3C(=O)N2C)c1	ZINC000875286584	GF	On-Demand	Mild	PDS	40	36
CC[C@H](C#N)Oc1cccc(CNC(=O)NC[C@H]2c3ccccc3C(=O)N2C)c1	ZINC000875286585	GF	On-Demand	Mild	PDS	40	36
O=C(OCc1cc(-c2ccccc2)on1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286599	GI	On-Demand	Anodyne	FKBP1A	66	42
O=C(OCc1cc(-c2ccccc2)on1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286599	GI	On-Demand	Anodyne	CPT1A	100	39
O=C(OCc1cc(-c2ccccc2)on1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286599	GI	On-Demand	Anodyne	PREP	69	51
O=C(OCc1cc(-c2ccccc2)on1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286600	GI	On-Demand	Anodyne	FKBP1A	66	42
O=C(OCc1cc(-c2ccccc2)on1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286600	GI	On-Demand	Anodyne	CPT1A	100	39
O=C(OCc1cc(-c2ccccc2)on1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286600	GI	On-Demand	Anodyne	PREP	69	51
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875286603	GH	On-Demand	Mild	F2	28	41
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875286603	GH	On-Demand	Mild	LGMN	43	35
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875286603	GH	On-Demand	Mild	TMPRSS11D	61	34
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875286603	GH	On-Demand	Mild	PDS	47	38
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875286604	GH	On-Demand	Mild	F2	28	41
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875286604	GH	On-Demand	Mild	LGMN	43	35
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875286604	GH	On-Demand	Mild	TMPRSS11D	61	34
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875286604	GH	On-Demand	Mild	PDS	47	38
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875286605	GH	On-Demand	Mild	F2	28	41
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875286605	GH	On-Demand	Mild	LGMN	43	35
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875286605	GH	On-Demand	Mild	TMPRSS11D	61	34
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875286605	GH	On-Demand	Mild	PDS	47	38
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875286606	GH	On-Demand	Mild	F2	28	41
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875286606	GH	On-Demand	Mild	LGMN	43	35
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875286606	GH	On-Demand	Mild	TMPRSS11D	61	34
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875286606	GH	On-Demand	Mild	PDS	47	38
CC[C@@H](C#N)Oc1cccc(CNC(=O)NC[C@H]2CC(C(F)(F)F)=NO2)c1	ZINC000875286607	GF	On-Demand	Mild	PDS	45	34
CC[C@@H](C#N)Oc1cccc(CNC(=O)NC[C@@H]2CC(C(F)(F)F)=NO2)c1	ZINC000875286608	GF	On-Demand	Mild	PDS	45	34
CC[C@H](C#N)Oc1cccc(CNC(=O)NC[C@@H]2CC(C(F)(F)F)=NO2)c1	ZINC000875286609	GF	On-Demand	Mild	PDS	45	34
CC[C@H](C#N)Oc1cccc(CNC(=O)NC[C@H]2CC(C(F)(F)F)=NO2)c1	ZINC000875286610	GF	On-Demand	Mild	PDS	45	34
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(-c3cccnc3)c2)CC1	ZINC000875286613	FE	On-Demand	Anodyne	CHRNA7	43	34
CC(=O)C1CCN(C(=O)C(=O)NCc2cccc(-c3cccnc3)c2)CC1	ZINC000875286613	FE	On-Demand	Anodyne	NAMPT	92	40
O=C(OCC(=O)N1CCN(c2ccccc2F)CC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286626	JF	On-Demand	Anodyne	PREP	46	34
O=C(OCC(=O)N1CCN(c2ccccc2F)CC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286627	JF	On-Demand	Anodyne	PREP	46	34
Cc1ccc(CNC(=O)C(=O)NC2CCC(N3CCCCC3)CC2)o1	ZINC000875286630	EE	On-Demand	Anodyne	L3MBTL3	70	36
O=C(Cn1ncc2cccnc21)Nc1c(N2CCCC2)cccc1N1CCCC1	ZINC000875286632	GG	On-Demand	Anodyne	KCNQ2	70	39
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)c2ccc(NC(=O)c3ccncc3)cc2)C1	ZINC000875286635	GG	On-Demand	Anodyne	PRNP	58	38
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)c2ccc(NC(=O)c3ccncc3)cc2)C1	ZINC000875286636	GG	On-Demand	Anodyne	PRNP	58	38
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)c2ccc(NC(=O)c3ccncc3)cc2)C1	ZINC000875286637	GG	On-Demand	Anodyne	PRNP	58	38
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)c2ccc(NC(=O)c3ccncc3)cc2)C1	ZINC000875286638	GG	On-Demand	Anodyne	PRNP	58	38
O=C(OCC(=O)N(c1ccccc1)C1CCCCC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286643	JJ	On-Demand	Anodyne	FKBP1A	52	40
O=C(OCC(=O)N(c1ccccc1)C1CCCCC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286643	JJ	On-Demand	Anodyne	CPT1A	69	38
O=C(OCC(=O)N(c1ccccc1)C1CCCCC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286643	JJ	On-Demand	Anodyne	CPT2	43	33
O=C(OCC(=O)N(c1ccccc1)C1CCCCC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286643	JJ	On-Demand	Anodyne	PREP	49	35
O=C(OCC(=O)N(c1ccccc1)C1CCCCC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286644	JJ	On-Demand	Anodyne	FKBP1A	52	40
O=C(OCC(=O)N(c1ccccc1)C1CCCCC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286644	JJ	On-Demand	Anodyne	CPT1A	69	38
O=C(OCC(=O)N(c1ccccc1)C1CCCCC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286644	JJ	On-Demand	Anodyne	CPT2	43	33
O=C(OCC(=O)N(c1ccccc1)C1CCCCC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286644	JJ	On-Demand	Anodyne	PREP	49	35
CC(=O)NCCCc1ccc(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286663	JG	On-Demand	Anodyne	FKBP1A	83	42
CC(=O)NCCCc1ccc(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286663	JG	On-Demand	Anodyne	PREP	48	34
CC(=O)NCCCc1ccc(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286664	JG	On-Demand	Anodyne	FKBP1A	83	42
CC(=O)NCCCc1ccc(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286664	JG	On-Demand	Anodyne	PREP	48	34
CC(=O)C1CCN(C(=O)N[C@@H](C)c2ccc(NC(=O)c3ccncc3)cc2)CC1	ZINC000875286684	GG	On-Demand	Anodyne	PRNP	66	40
CC(=O)C1CCN(C(=O)N[C@H](C)c2ccc(NC(=O)c3ccncc3)cc2)CC1	ZINC000875286685	GG	On-Demand	Anodyne	PRNP	66	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc2c(c1)CCCC2	ZINC000875286686	HI	On-Demand	Anodyne	FKBP1A	49	35
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc2c(c1)CCCC2	ZINC000875286686	HI	On-Demand	Anodyne	PREP	40	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc2c(c1)CCCC2	ZINC000875286687	HI	On-Demand	Anodyne	FKBP1A	49	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc2c(c1)CCCC2	ZINC000875286687	HI	On-Demand	Anodyne	PREP	40	37
O=C(Nc1c(N2CCCC2)cccc1N1CCCC1)c1sccc1C(F)F	ZINC000875286690	GK	On-Demand	Anodyne	KCNQ2	73	41
O=C(OCC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCCO2)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286708	JH	On-Demand	Anodyne	CPT1A	80	43
O=C(OCC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286709	JH	On-Demand	Anodyne	CPT1A	80	43
O=C(OCC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCCO2)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286710	JH	On-Demand	Anodyne	CPT1A	80	43
O=C(OCC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286711	JH	On-Demand	Anodyne	CPT1A	80	43
CN1CCN(C2CCN(C(=O)C(=O)N[C@H]3CN(C)Cc4ccccc43)CC2)CC1	ZINC000875286719	GC	On-Demand	Anodyne	L3MBTL3	83	44
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3CN(C)Cc4ccccc43)CC2)CC1	ZINC000875286720	GC	On-Demand	Anodyne	L3MBTL3	83	44
CC(C)(C)C(=O)Nc1ccc(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286723	JI	On-Demand	Anodyne	FKBP1A	51	40
CC(C)(C)C(=O)Nc1ccc(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875286724	JI	On-Demand	Anodyne	FKBP1A	51	40
O=C(OCc1nc2ccccc2o1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286725	FH	On-Demand	Anodyne	FKBP1A	43	41
O=C(OCc1nc2ccccc2o1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286725	FH	On-Demand	Anodyne	ELANE	19	40
O=C(OCc1nc2ccccc2o1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286725	FH	On-Demand	Anodyne	PREP	44	42
O=C(OCc1nc2ccccc2o1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286726	FH	On-Demand	Anodyne	FKBP1A	43	41
O=C(OCc1nc2ccccc2o1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286726	FH	On-Demand	Anodyne	ELANE	19	40
O=C(OCc1nc2ccccc2o1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286726	FH	On-Demand	Anodyne	PREP	44	42
O=C(OCCO)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286727	CD	On-Demand	Anodyne	FKBP1A	78	45
O=C(OCCO)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286727	CD	On-Demand	Anodyne	PREP	71	38
O=C(OCCO)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286728	CD	On-Demand	Anodyne	FKBP1A	78	45
O=C(OCCO)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286728	CD	On-Demand	Anodyne	PREP	71	38
O=C1CCC(=O)N1CCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875286729	FD	On-Demand	Anodyne	FKBP1A	19	40
O=C1CCC(=O)N1CCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875286730	FD	On-Demand	Anodyne	FKBP1A	19	40
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCCC[C@@H]2CNC(C)=O)c1	ZINC000875286741	FF	On-Demand	Mild	FKBP1A	18	41
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCCC[C@@H]2CNC(C)=O)c1	ZINC000875286741	FF	On-Demand	Mild	LGMN	46	34
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCCC[C@@H]2CNC(C)=O)c1	ZINC000875286742	FF	On-Demand	Mild	FKBP1A	18	41
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCCC[C@@H]2CNC(C)=O)c1	ZINC000875286742	FF	On-Demand	Mild	LGMN	46	34
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCCC[C@H]2CNC(C)=O)c1	ZINC000875286743	FF	On-Demand	Mild	FKBP1A	18	41
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCCC[C@H]2CNC(C)=O)c1	ZINC000875286743	FF	On-Demand	Mild	LGMN	46	34
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCCC[C@H]2CNC(C)=O)c1	ZINC000875286744	FF	On-Demand	Mild	FKBP1A	18	41
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCCC[C@H]2CNC(C)=O)c1	ZINC000875286744	FF	On-Demand	Mild	LGMN	46	34
CS(=O)(=O)c1cccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875286749	JE	On-Demand	Anodyne	FKBP1A	55	35
CS(=O)(=O)c1cccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875286749	JE	On-Demand	Anodyne	NOS1	41	42
CS(=O)(=O)c1cccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875286749	JE	On-Demand	Anodyne	ST14	39	47
CS(=O)(=O)c1cccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875286750	JE	On-Demand	Anodyne	FKBP1A	55	35
CS(=O)(=O)c1cccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875286750	JE	On-Demand	Anodyne	NOS1	41	42
CS(=O)(=O)c1cccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875286750	JE	On-Demand	Anodyne	ST14	39	47
O=C(NC1CCC(N2CCCCC2)CC1)C(=O)N1CCC(CCF)CC1	ZINC000875286751	FE	On-Demand	Anodyne	L3MBTL3	65	38
O=C(NC[C@@H]1Cc2ccccc2CO1)C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000875286754	GE	On-Demand	Anodyne	L3MBTL3	50	34
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC(=O)Nc1ccc2c(c1)OCCCO2	ZINC000875286757	JF	On-Demand	Anodyne	NOS1	42	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC(=O)Nc1ccc2c(c1)OCCCO2	ZINC000875286758	JF	On-Demand	Anodyne	NOS1	42	37
O=C(OCC(=O)N1CCC(c2nc3ccccc3s2)CC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286763	JI	On-Demand	Anodyne	PREP	29	42
O=C(OCC(=O)N1CCC(c2nc3ccccc3s2)CC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286764	JI	On-Demand	Anodyne	PREP	29	42
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(c3ccc(C(F)(F)F)cc3)C2=O)CC1	ZINC000875286785	GF	On-Demand	Anodyne	EPHX2	18	42
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2Cn2ccnc2)c1	ZINC000875286786	FF	On-Demand	Mild	NOS2	46	41
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2Cn2ccnc2)c1	ZINC000875286787	FF	On-Demand	Mild	NOS2	46	41
C[C@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)C1CCCC1	ZINC000875286799	EH	On-Demand	Mild	ITK	23	51
C[C@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)C1CCCC1	ZINC000875286799	EH	On-Demand	Mild	PANC	58	39
CN1CC[C@H]2CN(C(=O)C(=O)NCc3cccc(-c4cccnc4)c3)CC[C@@H]21	ZINC000875286809	GD	On-Demand	Anodyne	CHRNA7	48	38
CN1CC[C@H]2CN(C(=O)C(=O)NCc3cccc(-c4cccnc4)c3)CC[C@@H]21	ZINC000875286809	GD	On-Demand	Anodyne	NAMPT	52	37
CN1CC[C@H]2CN(C(=O)C(=O)NCc3cccc(-c4cccnc4)c3)CC[C@H]21	ZINC000875286811	GD	On-Demand	Anodyne	CHRNA7	48	38
CN1CC[C@H]2CN(C(=O)C(=O)NCc3cccc(-c4cccnc4)c3)CC[C@H]21	ZINC000875286811	GD	On-Demand	Anodyne	NAMPT	52	37
CC[C@H](C#N)Oc1cccc(CNC(=O)N(C)C[C@@H]2C[C@H](O)C2)c1	ZINC000875286820	EE	On-Demand	Mild	PDS	48	38
CC[C@@H](C#N)Oc1cccc(CNC(=O)N(C)C[C@@H]2C[C@H](O)C2)c1	ZINC000875286821	EE	On-Demand	Mild	PDS	48	38
O=C1CCC(=O)N1CCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875286831	FD	On-Demand	Anodyne	FKBP1A	19	40
O=C1CCC(=O)N1CCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875286832	FD	On-Demand	Anodyne	FKBP1A	19	40
COCC(C)(C)CCNC(=O)N[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000875286836	GH	On-Demand	Anodyne	F7	23	41
COCC(C)(C)CCNC(=O)N[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000875286837	GH	On-Demand	Anodyne	F7	23	41
CCOC1CC2(C1)C[C@H]2C(=O)Nc1c(N2CCCC2)cccc1N1CCCC1	ZINC000875286839	GI	On-Demand	Anodyne	KCNQ2	73	35
O=C(Cc1ccc(Cl)cn1)Nc1c(N2CCCC2)cccc1N1CCCC1	ZINC000875286855	GI	On-Demand	Anodyne	F10	15	41
O=C(Cc1ccc(Cl)cn1)Nc1c(N2CCCC2)cccc1N1CCCC1	ZINC000875286855	GI	On-Demand	Anodyne	KCNQ2	79	52
O=C(Cc1ccc(Cl)cn1)Nc1c(N2CCCC2)cccc1N1CCCC1	ZINC000875286855	GI	On-Demand	Anodyne	SCN2A	18	40
O=C(Cc1ccc(Cl)cn1)Nc1c(N2CCCC2)cccc1N1CCCC1	ZINC000875286855	GI	On-Demand	Anodyne	SCN10A	18	40
C[C@@H](CNC(=O)N[C@H]1CCN(CC(C)(C)O)C1)Oc1ccccc1	ZINC000875286857	ED	On-Demand	Anodyne	LTA4H	21	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc2c(c1)CCC2	ZINC000875286860	GH	On-Demand	Anodyne	FKBP1A	43	35
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc2c(c1)CCC2	ZINC000875286861	GH	On-Demand	Anodyne	FKBP1A	43	35
CCOC(=O)CCCOC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286868	FF	On-Demand	Anodyne	FKBP1A	83	46
CCOC(=O)CCCOC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286868	FF	On-Demand	Anodyne	PREP	66	38
CCOC(=O)CCCOC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286869	FF	On-Demand	Anodyne	FKBP1A	83	46
CCOC(=O)CCCOC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286869	FF	On-Demand	Anodyne	PREP	66	38
C[C@@H](NC(=O)N1C[C@H]2CC=CC[C@H]2C1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000875286874	GI	On-Demand	Anodyne	PRNP	51	36
C[C@H](NC(=O)N1C[C@H]2CC=CC[C@H]2C1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000875286875	GI	On-Demand	Anodyne	PRNP	51	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NOCc1ccccc1	ZINC000875286896	HF	On-Demand	Anodyne	FKBP1A	83	49
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NOCc1ccccc1	ZINC000875286896	HF	On-Demand	Anodyne	CELA1	24	45
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NOCc1ccccc1	ZINC000875286896	HF	On-Demand	Anodyne	CTRA_BOVIN	50	32
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NOCc1ccccc1	ZINC000875286896	HF	On-Demand	Anodyne	CTSG	40	32
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NOCc1ccccc1	ZINC000875286896	HF	On-Demand	Anodyne	PREP	79	45
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NOCc1ccccc1	ZINC000875286896	HF	On-Demand	Anodyne	CELA2A	40	32
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NOCc1ccccc1	ZINC000875286896	HF	On-Demand	Anodyne	LGMN	67	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NOCc1ccccc1	ZINC000875286896	HF	On-Demand	Anodyne	KLK5	23	42
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NOCc1ccccc1	ZINC000875286897	HF	On-Demand	Anodyne	FKBP1A	83	49
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NOCc1ccccc1	ZINC000875286897	HF	On-Demand	Anodyne	CELA1	24	45
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NOCc1ccccc1	ZINC000875286897	HF	On-Demand	Anodyne	CTRA_BOVIN	50	32
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NOCc1ccccc1	ZINC000875286897	HF	On-Demand	Anodyne	CTSG	40	32
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NOCc1ccccc1	ZINC000875286897	HF	On-Demand	Anodyne	PREP	79	45
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NOCc1ccccc1	ZINC000875286897	HF	On-Demand	Anodyne	CELA2A	40	32
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NOCc1ccccc1	ZINC000875286897	HF	On-Demand	Anodyne	LGMN	67	40
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NOCc1ccccc1	ZINC000875286897	HF	On-Demand	Anodyne	KLK5	23	42
Cn1cnc2c1c(=O)n(CCCOC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c(=O)n2C	ZINC000875286898	JD	On-Demand	Anodyne	FKBP1A	59	40
Cn1cnc2c1c(=O)n(CCCOC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c(=O)n2C	ZINC000875286899	JD	On-Demand	Anodyne	FKBP1A	59	40
O=C(OCc1cc2ccccc2nc1Cl)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286907	HJ	On-Demand	Anodyne	FKBP1A	40	38
O=C(OCc1cc2ccccc2nc1Cl)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286907	HJ	On-Demand	Anodyne	PREP	42	38
O=C(OCc1cc2ccccc2nc1Cl)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286908	HJ	On-Demand	Anodyne	FKBP1A	40	38
O=C(OCc1cc2ccccc2nc1Cl)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286908	HJ	On-Demand	Anodyne	PREP	42	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc(I)cc1	ZINC000875286919	JH	On-Demand	Anodyne	FKBP1A	49	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc(I)cc1	ZINC000875286919	JH	On-Demand	Anodyne	PREP	41	36
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc(I)cc1	ZINC000875286920	JH	On-Demand	Anodyne	FKBP1A	49	36
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc(I)cc1	ZINC000875286920	JH	On-Demand	Anodyne	PREP	41	36
CN1C(=O)Cc2cc(C(=O)COC(=O)[C@@H]3CCCCN3C(=O)c3cccs3)ccc21	ZINC000875286934	IF	On-Demand	Anodyne	FKBP1A	41	35
CN1C(=O)Cc2cc(C(=O)COC(=O)[C@H]3CCCCN3C(=O)c3cccs3)ccc21	ZINC000875286935	IF	On-Demand	Anodyne	FKBP1A	41	35
Cc1scc(CNC(=O)C(=O)NC2CCC(N3CCCCC3)CC2)c1C	ZINC000875286936	GF	On-Demand	Anodyne	L3MBTL3	40	33
O=C(OCc1noc(-c2cccs2)n1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286939	HH	On-Demand	Anodyne	CPT1A	44	37
O=C(OCc1noc(-c2cccs2)n1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286940	HH	On-Demand	Anodyne	CPT1A	44	37
COC[C@H](NC(=O)c1c(Cl)nn(C)c1Cl)c1ccccc1	ZINC000875286941	EF	On-Demand	Anodyne	TACR3	54	43
COC[C@@H](NC(=O)c1c(Cl)nn(C)c1Cl)c1ccccc1	ZINC000875286942	EF	On-Demand	Anodyne	TACR3	54	43
COC(=O)[C@@H](CC(C)C)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286943	HD	On-Demand	Anodyne	FKBP1A	72	39
COC(=O)[C@@H](CC(C)C)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286943	HD	On-Demand	Anodyne	NTSR1	72	33
COC(=O)[C@@H](CC(C)C)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286943	HD	On-Demand	Anodyne	NTSR2	40	31
COC(=O)[C@@H](CC(C)C)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286943	HD	On-Demand	Anodyne	HLA-A	52	32
COC(=O)[C@@H](CC(C)C)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286943	HD	On-Demand	Anodyne	LGMN	52	32
COC(=O)[C@@H](CC(C)C)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286945	HD	On-Demand	Anodyne	FKBP1A	72	39
COC(=O)[C@@H](CC(C)C)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286945	HD	On-Demand	Anodyne	NTSR1	72	33
COC(=O)[C@@H](CC(C)C)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286945	HD	On-Demand	Anodyne	NTSR2	40	31
COC(=O)[C@@H](CC(C)C)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286945	HD	On-Demand	Anodyne	HLA-A	52	32
COC(=O)[C@@H](CC(C)C)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286945	HD	On-Demand	Anodyne	LGMN	52	32
CN(CCOc1ccc(Cl)cc1)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286958	JG	On-Demand	Anodyne	FKBP1A	40	35
CN(CCOc1ccc(Cl)cc1)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286959	JG	On-Demand	Anodyne	FKBP1A	40	35
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1ccccc1F	ZINC000875286960	HF	On-Demand	Anodyne	FKBP1A	68	39
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1ccccc1F	ZINC000875286960	HF	On-Demand	Anodyne	DPP4	18	43
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1ccccc1F	ZINC000875286961	HF	On-Demand	Anodyne	FKBP1A	68	39
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1ccccc1F	ZINC000875286961	HF	On-Demand	Anodyne	DPP4	18	43
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCCC[C@@H]2[C@@H]2CCCC[C@H]2O)c1	ZINC000875286962	GH	On-Demand	Mild	FKBP1A	30	41
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCCC[C@@H]2[C@@H]2CCCC[C@H]2O)c1	ZINC000875286962	GH	On-Demand	Mild	LGMN	56	36
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCCC[C@@H]2[C@H]2CCCC[C@@H]2O)c1	ZINC000875286963	GH	On-Demand	Mild	FKBP1A	30	41
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCCC[C@@H]2[C@H]2CCCC[C@@H]2O)c1	ZINC000875286963	GH	On-Demand	Mild	LGMN	56	36
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCCC[C@@H]2[C@@H]2CCCC[C@@H]2O)c1	ZINC000875286964	GH	On-Demand	Mild	FKBP1A	30	41
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCCC[C@@H]2[C@@H]2CCCC[C@@H]2O)c1	ZINC000875286964	GH	On-Demand	Mild	LGMN	56	36
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCCC[C@@H]2[C@H]2CCCC[C@H]2O)c1	ZINC000875286965	GH	On-Demand	Mild	FKBP1A	30	41
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCCC[C@@H]2[C@H]2CCCC[C@H]2O)c1	ZINC000875286965	GH	On-Demand	Mild	LGMN	56	36
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCC(N4CCCCC4)CC3)CC[C@H]21	ZINC000875286967	GD	On-Demand	Anodyne	L3MBTL3	70	37
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCC(N4CCCCC4)CC3)CC[C@@H]21	ZINC000875286968	GD	On-Demand	Anodyne	L3MBTL3	70	37
O=C(OCCCc1nc(-c2cccs2)no1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286978	II	On-Demand	Anodyne	FKBP1A	66	42
O=C(OCCCc1nc(-c2cccs2)no1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286978	II	On-Demand	Anodyne	ETHR	36	42
O=C(OCCCc1nc(-c2cccs2)no1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286979	II	On-Demand	Anodyne	FKBP1A	66	42
O=C(OCCCc1nc(-c2cccs2)no1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286979	II	On-Demand	Anodyne	ETHR	36	42
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCCOc1ccc(Cl)cc1	ZINC000875286984	JG	On-Demand	Anodyne	FKBP1A	48	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCCOc1ccc(Cl)cc1	ZINC000875286985	JG	On-Demand	Anodyne	FKBP1A	48	37
CN(C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)C(C)(C)C#N	ZINC000875286988	GE	On-Demand	Mild	FKBP1A	51	39
CN(C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)C(C)(C)C#N	ZINC000875286988	GE	On-Demand	Mild	LGMN	40	32
CCCCCNC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286991	FF	On-Demand	Anodyne	FKBP1A	80	41
CCCCCNC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286991	FF	On-Demand	Anodyne	PREP	53	36
CCCCCNC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286992	FF	On-Demand	Anodyne	FKBP1A	80	41
CCCCCNC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286992	FF	On-Demand	Anodyne	PREP	53	36
O=C(OCc1cc(-c2cccs2)on1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286994	HI	On-Demand	Anodyne	FKBP1A	51	39
O=C(OCc1cc(-c2cccs2)on1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286994	HI	On-Demand	Anodyne	CPT1A	42	36
O=C(OCc1cc(-c2cccs2)on1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875286994	HI	On-Demand	Anodyne	PREP	49	42
O=C(OCc1cc(-c2cccs2)on1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286995	HI	On-Demand	Anodyne	FKBP1A	51	39
O=C(OCc1cc(-c2cccs2)on1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286995	HI	On-Demand	Anodyne	CPT1A	42	36
O=C(OCc1cc(-c2cccs2)on1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875286995	HI	On-Demand	Anodyne	PREP	49	42
COC[C@H](NC(=O)c1sccc1CC#N)c1ccccc1	ZINC000875287000	DF	On-Demand	Mild	TACR3	23	44
COC[C@@H](NC(=O)c1sccc1CC#N)c1ccccc1	ZINC000875287001	DF	On-Demand	Mild	TACR3	23	44
C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287007	JI	On-Demand	Anodyne	FKBP1A	75	44
C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287007	JI	On-Demand	Anodyne	PREP	53	36
C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287007	JI	On-Demand	Anodyne	BRCA1	50	31
C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287009	JI	On-Demand	Anodyne	FKBP1A	75	44
C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287009	JI	On-Demand	Anodyne	PREP	53	36
C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287009	JI	On-Demand	Anodyne	BRCA1	50	31
CS(=O)(=O)NCCc1ccc(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)s1	ZINC000875287011	JE	On-Demand	Anodyne	FKBP1A	50	35
CS(=O)(=O)NCCc1ccc(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)s1	ZINC000875287012	JE	On-Demand	Anodyne	FKBP1A	50	35
O=C(OCC(=O)N(Cc1ccco1)c1ccccc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287018	JI	On-Demand	Anodyne	PREP	45	34
O=C(OCC(=O)N(Cc1ccco1)c1ccccc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287020	JI	On-Demand	Anodyne	PREP	45	34
O=C(OCc1csc(COc2ccc(F)cc2)n1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287034	JJ	On-Demand	Anodyne	CPT1A	41	40
O=C(OCc1csc(COc2ccc(F)cc2)n1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287036	JJ	On-Demand	Anodyne	CPT1A	41	40
O=C(OCc1cc(-c2ccco2)on1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287038	GH	On-Demand	Anodyne	FKBP1A	40	36
O=C(OCc1cc(-c2ccco2)on1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287038	GH	On-Demand	Anodyne	PREP	32	40
O=C(OCc1cc(-c2ccco2)on1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287040	GH	On-Demand	Anodyne	FKBP1A	40	36
O=C(OCc1cc(-c2ccco2)on1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287040	GH	On-Demand	Anodyne	PREP	32	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(C(=O)N2CCOCC2)cc1	ZINC000875287044	JE	On-Demand	Anodyne	FKBP1A	43	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(C(=O)N2CCOCC2)cc1	ZINC000875287044	JE	On-Demand	Anodyne	TMPRSS11D	51	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(C(=O)N2CCOCC2)cc1	ZINC000875287046	JE	On-Demand	Anodyne	FKBP1A	43	36
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(C(=O)N2CCOCC2)cc1	ZINC000875287046	JE	On-Demand	Anodyne	TMPRSS11D	51	37
O=C(OCC(=O)N1CCN(c2cnccn2)CC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287049	ID	On-Demand	Anodyne	CPT1A	49	47
O=C(OCC(=O)N1CCN(c2cnccn2)CC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287049	ID	On-Demand	Anodyne	CPT2	45	44
O=C(OCC(=O)N1CCN(c2cnccn2)CC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287049	ID	On-Demand	Anodyne	PREP	45	36
O=C(OCC(=O)N1CCN(c2cnccn2)CC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287050	ID	On-Demand	Anodyne	CPT1A	49	47
O=C(OCC(=O)N1CCN(c2cnccn2)CC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287050	ID	On-Demand	Anodyne	CPT2	45	44
O=C(OCC(=O)N1CCN(c2cnccn2)CC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287050	ID	On-Demand	Anodyne	PREP	45	36
CCOc1cc(CNC(=O)N2CCC3(CCN(C)CC3)CC2)ccc1OC	ZINC000875287051	GG	On-Demand	Anodyne	SSTR5	54	38
CCOc1cc(CNC(=O)N2CCC3(CCN(C)CC3)CC2)ccc1OC	ZINC000875287051	GG	On-Demand	Anodyne	HCN1	54	37
CCOc1cc(CNC(=O)N2CCCC[C@H]2CNC(=O)NC)ccc1OC	ZINC000875287052	GE	On-Demand	Anodyne	FKBP1A	56	44
CCOc1cc(CNC(=O)N2CCCC[C@H]2CNC(=O)NC)ccc1OC	ZINC000875287052	GE	On-Demand	Anodyne	SSTR5	64	40
CCOc1cc(CNC(=O)N2CCCC[C@@H]2CNC(=O)NC)ccc1OC	ZINC000875287053	GE	On-Demand	Anodyne	FKBP1A	56	44
CCOc1cc(CNC(=O)N2CCCC[C@@H]2CNC(=O)NC)ccc1OC	ZINC000875287053	GE	On-Demand	Anodyne	SSTR5	64	40
CC[C@@H](C#N)Oc1cccc(CNC(=O)NC(C)(C)C(O)(CC)CC)c1	ZINC000875287054	FG	On-Demand	Mild	PDS	60	38
CC[C@H](C#N)Oc1cccc(CNC(=O)NC(C)(C)C(O)(CC)CC)c1	ZINC000875287055	FG	On-Demand	Mild	PDS	60	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCCc1cccc2cccnc12	ZINC000875287059	JG	On-Demand	Anodyne	FKBP1A	43	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCCc1cccc2cccnc12	ZINC000875287059	JG	On-Demand	Anodyne	HCRTR1	15	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCCc1cccc2cccnc12	ZINC000875287062	JG	On-Demand	Anodyne	FKBP1A	43	36
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCCc1cccc2cccnc12	ZINC000875287062	JG	On-Demand	Anodyne	HCRTR1	15	41
O=C(OCc1ccc(F)cc1Br)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287063	II	On-Demand	Anodyne	FKBP1A	40	38
O=C(OCc1ccc(F)cc1Br)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287064	II	On-Demand	Anodyne	FKBP1A	40	38
N#Cc1cccc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875287072	FG	On-Demand	Mild	FKBP1A	74	44
N#Cc1cccc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875287072	FG	On-Demand	Mild	CPT1A	20	42
N#Cc1cccc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875287072	FG	On-Demand	Mild	PREP	77	39
N#Cc1cccc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875287072	FG	On-Demand	Mild	LGMN	70	38
O=C(OCc1nc2ccccc2n1C(F)F)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287073	HI	On-Demand	Anodyne	PDE6D	53	35
N#Cc1cccc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875287074	FG	On-Demand	Mild	FKBP1A	74	44
N#Cc1cccc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875287074	FG	On-Demand	Mild	CPT1A	20	42
N#Cc1cccc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875287074	FG	On-Demand	Mild	PREP	77	39
N#Cc1cccc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875287074	FG	On-Demand	Mild	LGMN	70	38
O=C(OCc1nc2ccccc2n1C(F)F)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287077	HI	On-Demand	Anodyne	PDE6D	53	35
CCOc1cc(CNC(=O)N2Cc3cccnc3N3CCC[C@H]3C2)ccc1OC	ZINC000875287083	GG	On-Demand	Anodyne	SSTR5	64	39
CCOc1cc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)ccc1OC	ZINC000875287086	FF	On-Demand	Anodyne	SSTR5	78	42
CCOc1cc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)ccc1OC	ZINC000875287086	FF	On-Demand	Anodyne	PDE6A	40	31
CCOc1cc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)ccc1OC	ZINC000875287086	FF	On-Demand	Anodyne	MT-ND1	23	40
CCOc1cc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)ccc1OC	ZINC000875287087	FF	On-Demand	Anodyne	SSTR5	78	42
CCOc1cc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)ccc1OC	ZINC000875287087	FF	On-Demand	Anodyne	PDE6A	40	31
CCOc1cc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)ccc1OC	ZINC000875287087	FF	On-Demand	Anodyne	MT-ND1	23	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCC(=O)N1CCCC1	ZINC000875287126	HD	On-Demand	Anodyne	FKBP1A	66	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCC(=O)N1CCCC1	ZINC000875287126	HD	On-Demand	Anodyne	CPT2	40	33
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCC(=O)N1CCCC1	ZINC000875287126	HD	On-Demand	Anodyne	PREP	96	39
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCC(=O)N1CCCC1	ZINC000875287128	HD	On-Demand	Anodyne	FKBP1A	66	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCC(=O)N1CCCC1	ZINC000875287128	HD	On-Demand	Anodyne	CPT2	40	33
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCC(=O)N1CCCC1	ZINC000875287128	HD	On-Demand	Anodyne	PREP	96	39
CC[C@H](C#N)Oc1cccc(CNC(=O)N(Cc2ccccc2)[C@H](CC)CO)c1	ZINC000875287134	GH	On-Demand	Mild	PDS	77	40
CC[C@@H](C#N)Oc1cccc(CNC(=O)N(Cc2ccccc2)[C@H](CC)CO)c1	ZINC000875287135	GH	On-Demand	Mild	PDS	77	40
NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287141	JD	On-Demand	Anodyne	CA7	15	42
NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287141	JD	On-Demand	Anodyne	NOS1	18	44
O=C(Nc1ccccc1)c1ccc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875287144	IJ	On-Demand	Anodyne	FKBP1A	71	48
O=C(Nc1ccccc1)c1ccc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875287144	IJ	On-Demand	Anodyne	PREP	72	41
O=C(Nc1ccccc1)c1ccc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875287144	IJ	On-Demand	Anodyne	NOS1	17	43
O=C(Nc1ccccc1)c1ccc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875287144	IJ	On-Demand	Anodyne	LGMN	57	35
O=C(Nc1ccccc1)c1ccc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875287144	IJ	On-Demand	Anodyne	NOD2	42	36
O=C(Nc1ccccc1)c1ccc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875287144	IJ	On-Demand	Anodyne	KCNK3	23	43
NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287145	JD	On-Demand	Anodyne	CA7	15	42
NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287145	JD	On-Demand	Anodyne	NOS1	18	44
O=C(Nc1ccccc1)c1ccc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875287147	IJ	On-Demand	Anodyne	FKBP1A	71	48
O=C(Nc1ccccc1)c1ccc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875287147	IJ	On-Demand	Anodyne	PREP	72	41
O=C(Nc1ccccc1)c1ccc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875287147	IJ	On-Demand	Anodyne	NOS1	17	43
O=C(Nc1ccccc1)c1ccc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875287147	IJ	On-Demand	Anodyne	LGMN	57	35
O=C(Nc1ccccc1)c1ccc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875287147	IJ	On-Demand	Anodyne	NOD2	42	36
O=C(Nc1ccccc1)c1ccc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875287147	IJ	On-Demand	Anodyne	KCNK3	23	43
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NCCN1C(=O)CCC1=O	ZINC000875287149	GD	On-Demand	Anodyne	SIGMAR1	29	45
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccc(O[C@H](C#N)CC)c2)C1	ZINC000875287171	FF	On-Demand	Mild	PDS	40	36
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccc(O[C@@H](C#N)CC)c2)C1	ZINC000875287172	FF	On-Demand	Mild	PDS	40	36
COC(=O)c1ccoc1COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287189	GF	On-Demand	Anodyne	FKBP1A	46	41
COC(=O)c1ccoc1COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287192	GF	On-Demand	Anodyne	FKBP1A	46	41
CCOc1cc(CNC(=O)NC[C@H]2CC(C(F)(F)F)=NO2)ccc1OC	ZINC000875287194	GF	On-Demand	Anodyne	SSTR5	52	37
CCOc1cc(CNC(=O)NC[C@@H]2CC(C(F)(F)F)=NO2)ccc1OC	ZINC000875287196	GF	On-Demand	Anodyne	SSTR5	52	37
O=C(OCCN1C(=O)c2ccccc2S1(=O)=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287214	IE	On-Demand	Anodyne	FKBP1A	62	43
O=C(OCCN1C(=O)c2ccccc2S1(=O)=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287215	IE	On-Demand	Anodyne	FKBP1A	62	43
N#CCCNC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287218	ED	On-Demand	Mild	FKBP1A	51	38
N#CCCNC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287218	ED	On-Demand	Mild	PREP	64	35
N#CCCNC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287218	ED	On-Demand	Mild	LGMN	66	34
N#CCCNC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287219	ED	On-Demand	Mild	FKBP1A	51	38
N#CCCNC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287219	ED	On-Demand	Mild	PREP	64	35
N#CCCNC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287219	ED	On-Demand	Mild	LGMN	66	34
N#Cc1cc(C(=O)Nc2c(N3CCCC3)cccc2N2CCCC2)co1	ZINC000875287220	FH	On-Demand	Mild	KCNQ2	67	37
N#Cc1cc(C(=O)Nc2c(N3CCCC3)cccc2N2CCCC2)co1	ZINC000875287220	FH	On-Demand	Mild	CSF1R	26	50
O=C(NC1CCC(N2CCCCC2)CC1)C(=O)N[C@@H](CF)c1ccc(F)cc1	ZINC000875287235	GF	On-Demand	Anodyne	L3MBTL3	60	35
O=C(NC1CCC(N2CCCCC2)CC1)C(=O)N[C@H](CF)c1ccc(F)cc1	ZINC000875287236	GF	On-Demand	Anodyne	L3MBTL3	60	35
C[C@H](NC(=O)C(=O)NCC(C)(C)C1CCCCC1)c1ccnn1C	ZINC000875287240	EE	On-Demand	Anodyne	AMY2	42	29
CC[C@@H](C#N)Oc1cccc(CNC(=O)NNc2cccc(C)n2)c1	ZINC000875287255	EF	On-Demand	Reactive	PDS	49	36
CC[C@H](C#N)Oc1cccc(CNC(=O)NNc2cccc(C)n2)c1	ZINC000875287256	EF	On-Demand	Reactive	PDS	49	36
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875287257	GG	On-Demand	Mild	PDS	43	36
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875287258	GG	On-Demand	Mild	PDS	43	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCCc1ccc(OC(F)F)cc1	ZINC000875287269	JG	On-Demand	Anodyne	FKBP1A	67	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCCc1ccc(OC(F)F)cc1	ZINC000875287269	JG	On-Demand	Anodyne	PREP	41	34
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCCc1ccc(OC(F)F)cc1	ZINC000875287270	JG	On-Demand	Anodyne	FKBP1A	67	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCCc1ccc(OC(F)F)cc1	ZINC000875287270	JG	On-Demand	Anodyne	PREP	41	34
N#Cc1ccc(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875287288	GG	On-Demand	Mild	CPT1A	25	44
N#Cc1ccc(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875287288	GG	On-Demand	Mild	PREP	47	37
N#Cc1ccc(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875287289	GG	On-Demand	Mild	CPT1A	25	44
N#Cc1ccc(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875287289	GG	On-Demand	Mild	PREP	47	37
CCN(Cc1cccc(F)c1)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287297	IG	On-Demand	Anodyne	FKBP1A	82	38
CCN(Cc1cccc(F)c1)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287297	IG	On-Demand	Anodyne	PREP	47	32
CCN(Cc1cccc(F)c1)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287298	IG	On-Demand	Anodyne	FKBP1A	82	38
CCN(Cc1cccc(F)c1)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287298	IG	On-Demand	Anodyne	PREP	47	32
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](CO)CCC(C)C)c1	ZINC000875287305	EF	On-Demand	Mild	ANPEP	15	46
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](CO)CCC(C)C)c1	ZINC000875287305	EF	On-Demand	Mild	PDS	50	39
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](CO)CCC(C)C)c1	ZINC000875287306	EF	On-Demand	Mild	ANPEP	15	46
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](CO)CCC(C)C)c1	ZINC000875287306	EF	On-Demand	Mild	PDS	50	39
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@H](CO)CCC(C)C)c1	ZINC000875287307	EF	On-Demand	Mild	ANPEP	15	46
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@H](CO)CCC(C)C)c1	ZINC000875287307	EF	On-Demand	Mild	PDS	50	39
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@@H](CO)CCC(C)C)c1	ZINC000875287308	EF	On-Demand	Mild	ANPEP	15	46
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@@H](CO)CCC(C)C)c1	ZINC000875287308	EF	On-Demand	Mild	PDS	50	39
O=C(OCC(=O)N1CCN(Cc2cccc(Cl)c2)CC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287310	JG	On-Demand	Anodyne	FKBP1A	41	36
O=C(OCC(=O)N1CCN(Cc2cccc(Cl)c2)CC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287310	JG	On-Demand	Anodyne	CPT2	21	40
O=C(OCC(=O)N1CCN(Cc2cccc(Cl)c2)CC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287310	JG	On-Demand	Anodyne	PREP	44	36
O=C(OCC(=O)N1CCN(Cc2cccc(Cl)c2)CC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287311	JG	On-Demand	Anodyne	FKBP1A	41	36
O=C(OCC(=O)N1CCN(Cc2cccc(Cl)c2)CC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287311	JG	On-Demand	Anodyne	CPT2	21	40
O=C(OCC(=O)N1CCN(Cc2cccc(Cl)c2)CC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287311	JG	On-Demand	Anodyne	PREP	44	36
O=C(NCc1ccc2cccnc2c1)C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000875287326	GF	On-Demand	Anodyne	HRH3	18	41
O=C(NCc1ccc2cccnc2c1)C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000875287326	GF	On-Demand	Anodyne	CCR3	22	41
O=C(NCc1ccc2cccnc2c1)C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000875287326	GF	On-Demand	Anodyne	L3MBTL3	51	34
O=C(NCc1ccc2cccnc2c1)C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000875287326	GF	On-Demand	Anodyne	NAMPT	23	40
CCCN(CCC)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287329	GF	On-Demand	Anodyne	FKBP1A	76	39
CCCN(CCC)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287329	GF	On-Demand	Anodyne	PREP	43	33
CCCN(CCC)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287330	GF	On-Demand	Anodyne	FKBP1A	76	39
CCCN(CCC)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287330	GF	On-Demand	Anodyne	PREP	43	33
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875287335	EF	On-Demand	Mild	PDS	43	35
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875287336	EF	On-Demand	Mild	PDS	43	35
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875287337	EF	On-Demand	Mild	PDS	43	35
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875287338	EF	On-Demand	Mild	PDS	43	35
CCOc1cc(CNC(=O)NC2CC(C(=O)OC)C2)ccc1OC	ZINC000875287351	ED	On-Demand	Anodyne	SSTR5	62	41
C[C@@H](c1ccc(F)cc1)N(C)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287354	IH	On-Demand	Anodyne	FKBP1A	60	38
C[C@@H](c1ccc(F)cc1)N(C)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287356	IH	On-Demand	Anodyne	FKBP1A	60	38
CCOc1cc(CNC(=O)N(C)OCC(F)(F)F)ccc1OC	ZINC000875287366	EF	On-Demand	Anodyne	MT-ND1	25	43
COc1cc(F)c([C@@H](C)NC(=O)N2CCC(CO)(CO)CC2)cc1OC	ZINC000875287373	FD	On-Demand	Anodyne	CACNA1H	41	36
COc1cc(F)c([C@H](C)NC(=O)N2CCC(CO)(CO)CC2)cc1OC	ZINC000875287374	FD	On-Demand	Anodyne	CACNA1H	41	36
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000875287375	GG	On-Demand	Mild	PDS	41	33
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000875287376	GG	On-Demand	Mild	PDS	41	33
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000875287377	GG	On-Demand	Mild	PDS	41	33
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000875287378	GG	On-Demand	Mild	PDS	41	33
CCOc1cc(CNC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)ccc1OC	ZINC000875287389	GD	On-Demand	Anodyne	SSTR5	49	39
CCOc1cc(CNC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)ccc1OC	ZINC000875287389	GD	On-Demand	Anodyne	PDE6A	40	31
COc1ccc(-c2nnc(COC(=O)[C@@H]3CCCCN3C(=O)c3cccs3)o2)cc1	ZINC000875287394	IH	On-Demand	Anodyne	FKBP1A	46	39
COc1ccc(-c2nnc(COC(=O)[C@H]3CCCCN3C(=O)c3cccs3)o2)cc1	ZINC000875287395	IH	On-Demand	Anodyne	FKBP1A	46	39
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1cnn(-c2ccccc2)c1	ZINC000875287398	JF	On-Demand	Anodyne	FKBP1A	59	39
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1cnn(-c2ccccc2)c1	ZINC000875287398	JF	On-Demand	Anodyne	PREP	72	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1cnn(-c2ccccc2)c1	ZINC000875287399	JF	On-Demand	Anodyne	FKBP1A	59	39
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1cnn(-c2ccccc2)c1	ZINC000875287399	JF	On-Demand	Anodyne	PREP	72	38
CCn1c(=O)c2ccccc2n2c(COC(=O)[C@@H]3CCCCN3C(=O)c3cccs3)nnc12	ZINC000875287401	JF	On-Demand	Anodyne	FKBP1A	48	38
CCn1c(=O)c2ccccc2n2c(COC(=O)[C@H]3CCCCN3C(=O)c3cccs3)nnc12	ZINC000875287403	JF	On-Demand	Anodyne	FKBP1A	48	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)Oc1ccccc1	ZINC000875287436	EE	On-Demand	Anodyne	SLC6A4	28	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)Oc1ccccc1	ZINC000875287436	EE	On-Demand	Anodyne	SLC6A3	60	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)Oc1ccccc1	ZINC000875287437	EE	On-Demand	Anodyne	SLC6A4	28	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)Oc1ccccc1	ZINC000875287437	EE	On-Demand	Anodyne	SLC6A3	60	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)Oc1ccccc1	ZINC000875287438	EE	On-Demand	Anodyne	SLC6A4	28	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)Oc1ccccc1	ZINC000875287438	EE	On-Demand	Anodyne	SLC6A3	60	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)Oc1ccccc1	ZINC000875287439	EE	On-Demand	Anodyne	SLC6A4	28	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)Oc1ccccc1	ZINC000875287439	EE	On-Demand	Anodyne	SLC6A3	60	48
CCOc1cc(CNC(=O)N2CCN(C)C(C)(C)CC2)ccc1OC	ZINC000875287462	EF	On-Demand	Anodyne	SSTR5	50	38
O=C(OCCN1CCCCC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287464	FF	On-Demand	Anodyne	FKBP1A	73	46
O=C(OCCN1CCCCC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287464	FF	On-Demand	Anodyne	SLC6A1	53	41
O=C(OCCN1CCCCC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287464	FF	On-Demand	Anodyne	HRH3	17	48
O=C(OCCN1CCCCC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287464	FF	On-Demand	Anodyne	PREP	58	37
O=C(OCCN1CCCCC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287465	FF	On-Demand	Anodyne	FKBP1A	73	46
O=C(OCCN1CCCCC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287465	FF	On-Demand	Anodyne	SLC6A1	53	41
O=C(OCCN1CCCCC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287465	FF	On-Demand	Anodyne	HRH3	17	48
O=C(OCCN1CCCCC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287465	FF	On-Demand	Anodyne	PREP	58	37
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)c1	ZINC000875287473	GI	On-Demand	Mild	PDS	53	35
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)c1	ZINC000875287480	GI	On-Demand	Mild	PDS	53	35
COc1ccccc1N(C(C)=O)c1nc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cs1	ZINC000875287493	JJ	On-Demand	Anodyne	FKBP1A	48	38
COc1ccccc1N(C(C)=O)c1nc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cs1	ZINC000875287496	JJ	On-Demand	Anodyne	FKBP1A	48	38
N#CCc1ccsc1C(=O)Nc1c(N2CCCC2)cccc1N1CCCC1	ZINC000875287508	GI	On-Demand	Mild	KCNQ2	71	40
N#CCc1ccsc1C(=O)Nc1c(N2CCCC2)cccc1N1CCCC1	ZINC000875287508	GI	On-Demand	Mild	CSF1R	16	42
CC(=O)C1CCN(C(=O)NCc2ccnc(OC3CCC(C)CC3)c2)CC1	ZINC000875287514	FH	On-Demand	Anodyne	EPHX2	17	41
COCCN(CC1CCN(C)CC1)C(=O)NC[C@H](C)Oc1ccccc1	ZINC000875287521	FE	On-Demand	Anodyne	ACKR3	43	32
COCCN(CC1CCN(C)CC1)C(=O)NC[C@@H](C)Oc1ccccc1	ZINC000875287522	FE	On-Demand	Anodyne	ACKR3	43	32
COc1ccccc1N(CCC(N)=O)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287535	JE	On-Demand	Anodyne	FKBP1A	62	36
COc1ccccc1N(CCC(N)=O)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287536	JE	On-Demand	Anodyne	FKBP1A	62	36
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@@H]2CC(C)(C)CC[C@H]2O)c1	ZINC000875287539	FG	On-Demand	Mild	PDS	42	34
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H]2CC(C)(C)CC[C@H]2O)c1	ZINC000875287540	FG	On-Demand	Mild	PDS	42	34
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCc3nc(C4CC4)ncc3C2)c1	ZINC000875287565	GG	On-Demand	Mild	MAPK1	36	44
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCc3nc(C4CC4)ncc3C2)c1	ZINC000875287565	GG	On-Demand	Mild	P2RY14	40	34
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCc3nc(C4CC4)ncc3C2)c1	ZINC000875287566	GG	On-Demand	Mild	MAPK1	36	44
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCc3nc(C4CC4)ncc3C2)c1	ZINC000875287566	GG	On-Demand	Mild	P2RY14	40	34
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287569	HD	On-Demand	Anodyne	FKBP1A	57	42
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287569	HD	On-Demand	Anodyne	CPT1A	62	39
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287569	HD	On-Demand	Anodyne	CPT2	46	35
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287569	HD	On-Demand	Anodyne	PREP	75	36
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287570	HD	On-Demand	Anodyne	FKBP1A	57	42
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287570	HD	On-Demand	Anodyne	CPT1A	62	39
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287570	HD	On-Demand	Anodyne	CPT2	46	35
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287570	HD	On-Demand	Anodyne	PREP	75	36
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287571	HD	On-Demand	Anodyne	FKBP1A	57	42
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287571	HD	On-Demand	Anodyne	CPT1A	62	39
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287571	HD	On-Demand	Anodyne	CPT2	46	35
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287571	HD	On-Demand	Anodyne	PREP	75	36
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287572	HD	On-Demand	Anodyne	FKBP1A	57	42
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287572	HD	On-Demand	Anodyne	CPT1A	62	39
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287572	HD	On-Demand	Anodyne	CPT2	46	35
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287572	HD	On-Demand	Anodyne	PREP	75	36
O=C(OCc1ccc(C(F)(F)F)cc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287589	GJ	On-Demand	Anodyne	FKBP1A	78	48
O=C(OCc1ccc(C(F)(F)F)cc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287589	GJ	On-Demand	Anodyne	PREP	61	39
O=C(OCc1ccc(C(F)(F)F)cc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287589	GJ	On-Demand	Anodyne	LGMN	66	43
O=C(OCc1ccc(C(F)(F)F)cc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287590	GJ	On-Demand	Anodyne	FKBP1A	78	48
O=C(OCc1ccc(C(F)(F)F)cc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287590	GJ	On-Demand	Anodyne	PREP	61	39
O=C(OCc1ccc(C(F)(F)F)cc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287590	GJ	On-Demand	Anodyne	LGMN	66	43
CN(Cc1ccc(Cl)c(Cl)c1)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287597	JI	On-Demand	Anodyne	FKBP1A	58	36
CN(Cc1ccc(Cl)c(Cl)c1)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287597	JI	On-Demand	Anodyne	OPRK1	26	42
CN(Cc1ccc(Cl)c(Cl)c1)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287598	JI	On-Demand	Anodyne	FKBP1A	58	36
CN(Cc1ccc(Cl)c(Cl)c1)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287598	JI	On-Demand	Anodyne	OPRK1	26	42
O=C(NCc1cccc2c1CCOC2)C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000875287607	GE	On-Demand	Anodyne	L3MBTL3	49	34
O=C(OCCN1c2cccc3cccc(c23)S1(=O)=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287627	JH	On-Demand	Anodyne	FKBP1A	45	37
O=C(OCCN1c2cccc3cccc(c23)S1(=O)=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287628	JH	On-Demand	Anodyne	FKBP1A	45	37
O=C(OCc1nc(-c2cccc(C(F)(F)F)c2)no1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287652	JJ	On-Demand	Anodyne	CPT1A	51	38
O=C(OCc1nc(-c2cccc(C(F)(F)F)c2)no1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287654	JJ	On-Demand	Anodyne	CPT1A	51	38
Nc1nc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)nc(Nc2ccccc2)n1	ZINC000875287667	IF	On-Demand	Anodyne	FKBP1A	41	41
Nc1nc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)nc(Nc2ccccc2)n1	ZINC000875287667	IF	On-Demand	Anodyne	CPT1A	51	35
Nc1nc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)nc(Nc2ccccc2)n1	ZINC000875287668	IF	On-Demand	Anodyne	FKBP1A	41	41
Nc1nc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)nc(Nc2ccccc2)n1	ZINC000875287668	IF	On-Demand	Anodyne	CPT1A	51	35
O=C(OCc1nnc(-c2cc3c(s2)CCCC3)o1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287669	JI	On-Demand	Anodyne	PREP	40	35
O=C(OCc1nnc(-c2cc3c(s2)CCCC3)o1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287670	JI	On-Demand	Anodyne	PREP	40	35
COC(=O)N(C)NC(=O)NC[C@H](C)Oc1ccccc1	ZINC000875287705	CD	On-Demand	Reactive	MTNR1A	18	48
COC(=O)N(C)NC(=O)NC[C@H](C)Oc1ccccc1	ZINC000875287705	CD	On-Demand	Reactive	MTNR1B	15	48
COC(=O)N(C)NC(=O)NC[C@@H](C)Oc1ccccc1	ZINC000875287706	CD	On-Demand	Reactive	MTNR1A	18	48
COC(=O)N(C)NC(=O)NC[C@@H](C)Oc1ccccc1	ZINC000875287706	CD	On-Demand	Reactive	MTNR1B	15	48
CSc1ccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875287715	HH	On-Demand	Anodyne	FKBP1A	44	37
CSc1ccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875287717	HH	On-Demand	Anodyne	FKBP1A	44	37
O=C(NCCc1ccc2c(c1)CCO2)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875287721	FD	On-Demand	Anodyne	MTNR1A	25	40
O=C(NCCc1ccc2c(c1)CCO2)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875287721	FD	On-Demand	Anodyne	MTNR1B	31	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1S(=O)(=O)C(F)F	ZINC000875287722	JF	On-Demand	Anodyne	FKBP1A	40	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1S(=O)(=O)C(F)F	ZINC000875287722	JF	On-Demand	Anodyne	LGMN	53	33
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1S(=O)(=O)C(F)F	ZINC000875287724	JF	On-Demand	Anodyne	FKBP1A	40	36
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1S(=O)(=O)C(F)F	ZINC000875287724	JF	On-Demand	Anodyne	LGMN	53	33
CC(C)c1cccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875287730	HI	On-Demand	Anodyne	FKBP1A	59	38
CC(C)c1cccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875287730	HI	On-Demand	Anodyne	NOS1	44	41
CC(C)c1cccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875287731	HI	On-Demand	Anodyne	FKBP1A	59	38
CC(C)c1cccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875287731	HI	On-Demand	Anodyne	NOS1	44	41
O=C(OCc1nc(-c2cccs2)no1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287734	HH	On-Demand	Anodyne	CPT1A	48	40
O=C(OCc1nc(-c2cccs2)no1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287734	HH	On-Demand	Anodyne	ETHR	38	44
O=C(OCc1nc(-c2cccs2)no1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287735	HH	On-Demand	Anodyne	CPT1A	48	40
O=C(OCc1nc(-c2cccs2)no1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287735	HH	On-Demand	Anodyne	ETHR	38	44
CC[C@H]1c2ccsc2CCN1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287740	IH	On-Demand	Anodyne	FKBP1A	61	38
CC[C@@H]1c2ccsc2CCN1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287742	IH	On-Demand	Anodyne	FKBP1A	61	38
CC[C@H]1c2ccsc2CCN1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287743	IH	On-Demand	Anodyne	FKBP1A	61	38
CC[C@@H]1c2ccsc2CCN1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287744	IH	On-Demand	Anodyne	FKBP1A	61	38
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000875287749	GE	On-Demand	Anodyne	DRD4	40	30
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000875287749	GE	On-Demand	Anodyne	NQO2	31	47
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000875287749	GE	On-Demand	Anodyne	HTR6	42	39
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000875287749	GE	On-Demand	Anodyne	MTNR1A	33	48
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000875287749	GE	On-Demand	Anodyne	EBP	16	45
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000875287751	GE	On-Demand	Anodyne	DRD4	40	30
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000875287751	GE	On-Demand	Anodyne	NQO2	31	47
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000875287751	GE	On-Demand	Anodyne	HTR6	42	39
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000875287751	GE	On-Demand	Anodyne	MTNR1A	33	48
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000875287751	GE	On-Demand	Anodyne	EBP	16	45
C[C@H](C#N)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287752	DE	On-Demand	Mild	FKBP1A	66	39
C[C@H](C#N)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287752	DE	On-Demand	Mild	PREP	56	37
C[C@H](C#N)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287752	DE	On-Demand	Mild	LGMN	70	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCC1(c2ccccc2)CCCC1	ZINC000875287754	JH	On-Demand	Anodyne	FKBP1A	59	46
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCC1(c2ccccc2)CCCC1	ZINC000875287754	JH	On-Demand	Anodyne	KCNA3	40	35
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCC1(c2ccccc2)CCCC1	ZINC000875287754	JH	On-Demand	Anodyne	PREP	47	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCC1(c2ccccc2)CCCC1	ZINC000875287756	JH	On-Demand	Anodyne	FKBP1A	59	46
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCC1(c2ccccc2)CCCC1	ZINC000875287756	JH	On-Demand	Anodyne	KCNA3	40	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCC1(c2ccccc2)CCCC1	ZINC000875287756	JH	On-Demand	Anodyne	PREP	47	35
C[C@H](C#N)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287759	DE	On-Demand	Mild	FKBP1A	66	39
C[C@H](C#N)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287759	DE	On-Demand	Mild	PREP	56	37
C[C@H](C#N)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287759	DE	On-Demand	Mild	LGMN	70	36
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NCCN1C(=O)CCC1=O	ZINC000875287760	FD	On-Demand	Anodyne	PTGES2	40	31
O=C(OCC(=O)N1CCNC1=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287764	FC	On-Demand	Anodyne	FKBP1A	62	39
O=C(OCC(=O)N1CCNC1=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287764	FC	On-Demand	Anodyne	PREP	47	34
O=C(OCC(=O)N1CCNC1=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287766	FC	On-Demand	Anodyne	FKBP1A	62	39
O=C(OCC(=O)N1CCNC1=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287766	FC	On-Demand	Anodyne	PREP	47	34
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](CC)[C@H](O)c2ccccc2)c1	ZINC000875287776	GH	On-Demand	Mild	PDS	73	42
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](CC)[C@@H](O)c2ccccc2)c1	ZINC000875287777	GH	On-Demand	Mild	PDS	73	42
O=C(OCc1cccc2cccnc12)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287783	GI	On-Demand	Anodyne	FKBP1A	51	38
O=C(OCc1cccc2cccnc12)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287783	GI	On-Demand	Anodyne	PREP	46	39
O=C(OCc1cccc2cccnc12)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287784	GI	On-Demand	Anodyne	FKBP1A	51	38
O=C(OCc1cccc2cccnc12)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287784	GI	On-Demand	Anodyne	PREP	46	39
CCOc1cc(CNC(=O)N2CCC[C@@H](CCC(=O)OC)C2)ccc1OC	ZINC000875287790	GF	On-Demand	Anodyne	SSTR5	64	38
CCOc1cc(CNC(=O)N2CCC[C@@H](CCC(=O)OC)C2)ccc1OC	ZINC000875287790	GF	On-Demand	Anodyne	CCR3	16	41
CCOc1cc(CNC(=O)N2CCC[C@H](CCC(=O)OC)C2)ccc1OC	ZINC000875287791	GF	On-Demand	Anodyne	SSTR5	64	38
CCOc1cc(CNC(=O)N2CCC[C@H](CCC(=O)OC)C2)ccc1OC	ZINC000875287791	GF	On-Demand	Anodyne	CCR3	16	41
O=C(OCc1nc(-c2ccc(Cl)cc2)no1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287802	II	On-Demand	Anodyne	CPT1A	61	45
O=C(OCc1nc(-c2ccc(Cl)cc2)no1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287803	II	On-Demand	Anodyne	CPT1A	61	45
CC[C@@H](C#N)Oc1cccc(CNC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875287811	DD	On-Demand	Mild	PDS	57	39
CC[C@H](C#N)Oc1cccc(CNC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875287812	DD	On-Demand	Mild	PDS	57	39
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2C[C@@H]3C[C@H]2CN3c2ccccc2)c1	ZINC000875287819	GH	On-Demand	Mild	PDS	60	39
CC[C@H](C#N)Oc1cccc(CNC(=O)N2C[C@@H]3C[C@H]2CN3c2ccccc2)c1	ZINC000875287821	GH	On-Demand	Mild	PDS	60	39
CC[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1ccc(Cl)s1	ZINC000875287823	FG	On-Demand	Anodyne	CACNA1H	36	41
O=C(OCc1nc(-c2ccsc2)no1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287831	HH	On-Demand	Anodyne	CPT1A	56	36
O=C(OCc1nc(-c2ccsc2)no1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287832	HH	On-Demand	Anodyne	CPT1A	56	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC(=O)Nc1ccccc1	ZINC000875287835	HF	On-Demand	Anodyne	FKBP1A	59	44
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC(=O)Nc1ccccc1	ZINC000875287835	HF	On-Demand	Anodyne	PREP	51	37
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC(=O)Nc1ccccc1	ZINC000875287835	HF	On-Demand	Anodyne	NOS1	30	42
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC(=O)Nc1ccccc1	ZINC000875287836	HF	On-Demand	Anodyne	FKBP1A	59	44
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC(=O)Nc1ccccc1	ZINC000875287836	HF	On-Demand	Anodyne	PREP	51	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC(=O)Nc1ccccc1	ZINC000875287836	HF	On-Demand	Anodyne	NOS1	30	42
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CC=CC2)c1	ZINC000875287837	CE	On-Demand	Mild	PDS	58	39
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CC=CC2)c1	ZINC000875287838	CE	On-Demand	Mild	PDS	58	39
CC[C@H](C#N)Oc1cccc(CNC(=O)NC2(C)COC2)c1	ZINC000875287850	DD	On-Demand	Mild	PDS	47	37
CC[C@@H](C#N)Oc1cccc(CNC(=O)NC2(C)COC2)c1	ZINC000875287851	DD	On-Demand	Mild	PDS	47	37
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC(=O)Nc1ccc2c(c1)OCO2	ZINC000875287856	JE	On-Demand	Anodyne	NOS1	43	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC(=O)Nc1ccc2c(c1)OCO2	ZINC000875287857	JE	On-Demand	Anodyne	NOS1	43	37
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCCc1nc2ccccc2s1	ZINC000875287858	JG	On-Demand	Anodyne	FKBP1A	40	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCCc1nc2ccccc2s1	ZINC000875287858	JG	On-Demand	Anodyne	TRY1_BOVIN	48	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCCc1nc2ccccc2s1	ZINC000875287858	JG	On-Demand	Anodyne	PREP	40	45
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCCc1nc2ccccc2s1	ZINC000875287859	JG	On-Demand	Anodyne	FKBP1A	40	36
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCCc1nc2ccccc2s1	ZINC000875287859	JG	On-Demand	Anodyne	TRY1_BOVIN	48	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCCc1nc2ccccc2s1	ZINC000875287859	JG	On-Demand	Anodyne	PREP	40	45
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H]2C[C@H](CO)C2)c1	ZINC000875287860	DD	On-Demand	Mild	PDS	43	36
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@@H]2C[C@H](CO)C2)c1	ZINC000875287861	DD	On-Demand	Mild	PDS	43	36
COc1ccc(CN(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)C2CC2)cc1	ZINC000875287862	JG	On-Demand	Anodyne	FKBP1A	83	45
COc1ccc(CN(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)C2CC2)cc1	ZINC000875287863	JG	On-Demand	Anodyne	FKBP1A	83	45
CCN(Cc1ccc(OC)c(OC)c1)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287864	JG	On-Demand	Anodyne	FKBP1A	107	48
CCN(Cc1ccc(OC)c(OC)c1)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287865	JG	On-Demand	Anodyne	FKBP1A	107	48
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@H]1CCOc2ccccc21	ZINC000875287866	IF	On-Demand	Anodyne	TRAR	51	32
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@@H]1CCOc2ccccc21	ZINC000875287867	IF	On-Demand	Anodyne	TRAR	51	32
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@H]1CCOc2ccccc21	ZINC000875287868	IF	On-Demand	Anodyne	TRAR	51	32
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@@H]1CCOc2ccccc21	ZINC000875287869	IF	On-Demand	Anodyne	TRAR	51	32
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@@H](c1ccccc1)c1cccs1	ZINC000875287873	JI	On-Demand	Anodyne	FKBP1A	70	42
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@@H](c1ccccc1)c1cccs1	ZINC000875287873	JI	On-Demand	Anodyne	TRY1_BOVIN	41	34
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@@H](c1ccccc1)c1cccs1	ZINC000875287873	JI	On-Demand	Anodyne	PREP	58	36
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@@H](c1ccccc1)c1cccs1	ZINC000875287874	JI	On-Demand	Anodyne	FKBP1A	70	42
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@@H](c1ccccc1)c1cccs1	ZINC000875287874	JI	On-Demand	Anodyne	TRY1_BOVIN	41	34
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@@H](c1ccccc1)c1cccs1	ZINC000875287874	JI	On-Demand	Anodyne	PREP	58	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@H](c1ccccc1)c1cccs1	ZINC000875287875	JI	On-Demand	Anodyne	FKBP1A	70	42
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@H](c1ccccc1)c1cccs1	ZINC000875287875	JI	On-Demand	Anodyne	TRY1_BOVIN	41	34
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@H](c1ccccc1)c1cccs1	ZINC000875287875	JI	On-Demand	Anodyne	PREP	58	36
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@H](c1ccccc1)c1cccs1	ZINC000875287876	JI	On-Demand	Anodyne	FKBP1A	70	42
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@H](c1ccccc1)c1cccs1	ZINC000875287876	JI	On-Demand	Anodyne	TRY1_BOVIN	41	34
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@H](c1ccccc1)c1cccs1	ZINC000875287876	JI	On-Demand	Anodyne	PREP	58	36
CC[C@@H](C#N)Oc1cccc(CNC(=O)N(C)CC(O)(CC)CC)c1	ZINC000875287881	EG	On-Demand	Mild	PDS	56	37
CC[C@H](C#N)Oc1cccc(CNC(=O)N(C)CC(O)(CC)CC)c1	ZINC000875287882	EG	On-Demand	Mild	PDS	56	37
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@@H](C(C)C)[C@H](O)C(F)(F)F)c1	ZINC000875287883	GG	On-Demand	Mild	PDS	59	38
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](C(C)C)[C@H](O)C(F)(F)F)c1	ZINC000875287884	GG	On-Demand	Mild	PDS	59	38
O=C(OCC(=O)N1CCC[C@@H]2CCCC[C@@H]21)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287891	HG	On-Demand	Anodyne	FKBP1A	55	39
O=C(OCC(=O)N1CCC[C@@H]2CCCC[C@@H]21)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287891	HG	On-Demand	Anodyne	CPT1A	54	36
O=C(OCC(=O)N1CCC[C@@H]2CCCC[C@@H]21)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287891	HG	On-Demand	Anodyne	CPT2	43	34
O=C(OCC(=O)N1CCC[C@@H]2CCCC[C@@H]21)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287891	HG	On-Demand	Anodyne	PREP	81	37
O=C(OCC(=O)N1CCC[C@@H]2CCCC[C@H]21)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287892	HG	On-Demand	Anodyne	FKBP1A	55	39
O=C(OCC(=O)N1CCC[C@@H]2CCCC[C@H]21)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287892	HG	On-Demand	Anodyne	CPT1A	54	36
O=C(OCC(=O)N1CCC[C@@H]2CCCC[C@H]21)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287892	HG	On-Demand	Anodyne	CPT2	43	34
O=C(OCC(=O)N1CCC[C@@H]2CCCC[C@H]21)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287892	HG	On-Demand	Anodyne	PREP	81	37
O=C(OCC(=O)N1CCC[C@@H]2CCCC[C@@H]21)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287893	HG	On-Demand	Anodyne	FKBP1A	55	39
O=C(OCC(=O)N1CCC[C@@H]2CCCC[C@@H]21)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287893	HG	On-Demand	Anodyne	CPT1A	54	36
O=C(OCC(=O)N1CCC[C@@H]2CCCC[C@@H]21)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287893	HG	On-Demand	Anodyne	CPT2	43	34
O=C(OCC(=O)N1CCC[C@@H]2CCCC[C@@H]21)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287893	HG	On-Demand	Anodyne	PREP	81	37
O=C(OCC(=O)N1CCC[C@@H]2CCCC[C@H]21)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287894	HG	On-Demand	Anodyne	FKBP1A	55	39
O=C(OCC(=O)N1CCC[C@@H]2CCCC[C@H]21)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287894	HG	On-Demand	Anodyne	CPT1A	54	36
O=C(OCC(=O)N1CCC[C@@H]2CCCC[C@H]21)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287894	HG	On-Demand	Anodyne	CPT2	43	34
O=C(OCC(=O)N1CCC[C@@H]2CCCC[C@H]21)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287894	HG	On-Demand	Anodyne	PREP	81	37
CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287897	IG	On-Demand	Clean	FKBP1A	64	38
CN(Cc1ccc(N(C)C)cc1)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287898	IG	On-Demand	Clean	FKBP1A	64	38
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2cccc(-c3cccnc3)c2)C1	ZINC000875287912	FE	On-Demand	Anodyne	CYP11B2	30	41
O=C(NC1CCC(N2CCCCC2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875287915	FE	On-Demand	Anodyne	L3MBTL3	69	38
CCN(Cc1ccc2c(c1)OCCO2)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287919	JG	On-Demand	Anodyne	FKBP1A	62	42
CCN(Cc1ccc2c(c1)OCCO2)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287920	JG	On-Demand	Anodyne	FKBP1A	62	42
CC(C)c1noc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)n1	ZINC000875287925	FF	On-Demand	Anodyne	FKBP1A	42	40
CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287931	IE	On-Demand	Anodyne	FKBP1A	73	42
CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287931	IE	On-Demand	Anodyne	CPT1A	64	39
CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287931	IE	On-Demand	Anodyne	CPT2	46	39
CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287931	IE	On-Demand	Anodyne	PREP	80	38
CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287933	IE	On-Demand	Anodyne	FKBP1A	73	42
CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287933	IE	On-Demand	Anodyne	CPT1A	64	39
CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287933	IE	On-Demand	Anodyne	CPT2	46	39
CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287933	IE	On-Demand	Anodyne	PREP	80	38
O=C(OCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875287948	JF	On-Demand	Bother	SSTR1	46	43
O=C(OCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875287949	JF	On-Demand	Bother	SSTR1	46	43
CC(C)c1noc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)n1	ZINC000875287960	FF	On-Demand	Anodyne	FKBP1A	42	40
CCOc1cc(CNC(=O)NNc2cccc(C)n2)ccc1OC	ZINC000875287978	EF	On-Demand	Reactive	SSTR5	42	36
CCOc1cc(CNC(=O)NNc2cccc(C)n2)ccc1OC	ZINC000875287978	EF	On-Demand	Reactive	ROCK2	19	40
CCOc1cc(CNC(=O)NNc2cccc(C)n2)ccc1OC	ZINC000875287978	EF	On-Demand	Reactive	GRM5	15	45
CCOc1cc(CNC(=O)NNc2cccc(C)n2)ccc1OC	ZINC000875287978	EF	On-Demand	Reactive	DRTS_TRYCR	48	36
O=C(NCCO)C1CCN(C(=O)NCCc2ccc3c(c2)CCO3)CC1	ZINC000875287984	FC	On-Demand	Anodyne	MTNR1B	32	42
O=C(Cc1csc(C2CC2)n1)Nc1c(N2CCCC2)cccc1N1CCCC1	ZINC000875287998	GI	On-Demand	Anodyne	KCNQ2	66	41
CC(=O)Nc1ccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c(C(F)(F)F)c1	ZINC000875288023	JH	On-Demand	Anodyne	NOS1	40	37
CC(=O)Nc1ccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c(C(F)(F)F)c1	ZINC000875288023	JH	On-Demand	Anodyne	WNT3	41	32
CC(=O)Nc1ccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c(C(F)(F)F)c1	ZINC000875288024	JH	On-Demand	Anodyne	NOS1	40	37
CC(=O)Nc1ccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c(C(F)(F)F)c1	ZINC000875288024	JH	On-Demand	Anodyne	WNT3	41	32
CCOc1cc(CNC(=O)N2CCCCCCNC(=O)CC2)ccc1OC	ZINC000875288025	GF	On-Demand	Anodyne	SSTR5	53	37
CCOc1cc(CNC(=O)N2CCO[C@H](C(F)(F)F)CC2)ccc1OC	ZINC000875288046	GF	On-Demand	Anodyne	SSTR5	74	39
CCOc1cc(CNC(=O)N2CCO[C@@H](C(F)(F)F)CC2)ccc1OC	ZINC000875288048	GF	On-Demand	Anodyne	SSTR5	74	39
O=C(OCc1csc(-c2ccc(C(F)(F)F)cc2)n1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288058	JK	On-Demand	Anodyne	FKBP1A	47	39
O=C(OCc1csc(-c2ccc(C(F)(F)F)cc2)n1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288058	JK	On-Demand	Anodyne	CPT1A	22	41
O=C(OCc1csc(-c2ccc(C(F)(F)F)cc2)n1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288064	JK	On-Demand	Anodyne	FKBP1A	47	39
O=C(OCc1csc(-c2ccc(C(F)(F)F)cc2)n1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288064	JK	On-Demand	Anodyne	CPT1A	22	41
CCOc1cc(CNC(=O)N[C@@H]2C[C@H]3C[C@@]3(C(=O)OC)C2)ccc1OC	ZINC000875288066	FE	On-Demand	Anodyne	SSTR5	59	38
O=C(Nc1ccccc1)C1CCN(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875288076	JG	On-Demand	Anodyne	FKBP1A	46	42
O=C(Nc1ccccc1)C1CCN(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875288076	JG	On-Demand	Anodyne	CPT1A	44	37
O=C(Nc1ccccc1)C1CCN(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875288076	JG	On-Demand	Anodyne	CPT2	43	33
O=C(Nc1ccccc1)C1CCN(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875288076	JG	On-Demand	Anodyne	PREP	57	36
O=C(Nc1ccccc1)C1CCN(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875288076	JG	On-Demand	Anodyne	NOS1	24	40
O=C(Nc1ccccc1)C1CCN(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875288078	JG	On-Demand	Anodyne	FKBP1A	46	42
O=C(Nc1ccccc1)C1CCN(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875288078	JG	On-Demand	Anodyne	CPT1A	44	37
O=C(Nc1ccccc1)C1CCN(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875288078	JG	On-Demand	Anodyne	CPT2	43	33
O=C(Nc1ccccc1)C1CCN(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875288078	JG	On-Demand	Anodyne	PREP	57	36
O=C(Nc1ccccc1)C1CCN(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875288078	JG	On-Demand	Anodyne	NOS1	24	40
O=C(OCc1nc(COc2ccc(F)cc2)no1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288085	IH	On-Demand	Anodyne	CPT1A	78	39
O=C(OCc1nc(COc2ccc(F)cc2)no1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288086	IH	On-Demand	Anodyne	CPT1A	78	39
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc(C(F)(F)F)cc1	ZINC000875288101	II	On-Demand	Anodyne	FKBP1A	49	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc(C(F)(F)F)cc1	ZINC000875288103	II	On-Demand	Anodyne	FKBP1A	49	37
CCOc1cc(CNC(=O)N2CCCN(C=O)CC2)ccc1OC	ZINC000875288109	ED	On-Demand	Anodyne	PDGFRB	27	40
CCOc1cc(CNC(=O)N2CCCN(C=O)CC2)ccc1OC	ZINC000875288109	ED	On-Demand	Anodyne	SSTR5	56	39
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000875288110	JG	On-Demand	Mild	FKBP1A	73	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000875288111	JG	On-Demand	Mild	FKBP1A	73	38
O=C(OCC(=O)N1CCc2sccc2C1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288116	HF	On-Demand	Anodyne	CPT1A	27	41
O=C(OCC(=O)N1CCc2sccc2C1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288116	HF	On-Demand	Anodyne	CPT2	46	38
O=C(OCC(=O)N1CCc2sccc2C1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288116	HF	On-Demand	Anodyne	PREP	70	36
O=C(OCC(=O)N1CCc2sccc2C1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288118	HF	On-Demand	Anodyne	CPT1A	27	41
O=C(OCC(=O)N1CCc2sccc2C1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288118	HF	On-Demand	Anodyne	CPT2	46	38
O=C(OCC(=O)N1CCc2sccc2C1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288118	HF	On-Demand	Anodyne	PREP	70	36
CCOc1cc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)ccc1OC	ZINC000875288127	FD	On-Demand	Anodyne	DRD4	27	40
CCOc1cc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)ccc1OC	ZINC000875288127	FD	On-Demand	Anodyne	SIGMAR1	15	40
CCOc1cc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)ccc1OC	ZINC000875288127	FD	On-Demand	Anodyne	SSTR5	87	43
CCOc1cc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)ccc1OC	ZINC000875288127	FD	On-Demand	Anodyne	CCR3	25	42
CCOc1cc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)ccc1OC	ZINC000875288127	FD	On-Demand	Anodyne	MCHR1	22	48
CCOc1cc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)ccc1OC	ZINC000875288127	FD	On-Demand	Anodyne	HCN1	43	31
CCOc1cc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)ccc1OC	ZINC000875288127	FD	On-Demand	Anodyne	HCN4	41	31
C[C@H]1CCc2ccccc2N1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288150	IH	On-Demand	Anodyne	FKBP1A	43	38
C[C@H]1CCc2ccccc2N1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288150	IH	On-Demand	Anodyne	PREP	51	34
CC[C@@H](C#N)Oc1cccc(CNC(=O)N(C2CC2)C2CC2)c1	ZINC000875288151	DG	On-Demand	Mild	PDS	65	38
C[C@H]1CCc2ccccc2N1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288152	IH	On-Demand	Anodyne	FKBP1A	43	38
C[C@H]1CCc2ccccc2N1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288152	IH	On-Demand	Anodyne	PREP	51	34
CC[C@H](C#N)Oc1cccc(CNC(=O)N(C2CC2)C2CC2)c1	ZINC000875288153	DG	On-Demand	Mild	PDS	65	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2cccc(-c3cccnc3)c2)C1	ZINC000875288154	FE	On-Demand	Anodyne	NAMPT	56	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2cccc(-c3cccnc3)c2)C1	ZINC000875288155	FE	On-Demand	Anodyne	NAMPT	56	41
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2C[C@H]3C[C@H](O)C[C@H]2C3)c1	ZINC000875288158	EE	On-Demand	Mild	PDS	48	38
CC[C@H](C#N)Oc1cccc(CNC(=O)N2C[C@H]3C[C@@H](O)C[C@H]2C3)c1	ZINC000875288159	EE	On-Demand	Mild	PDS	48	38
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2C[C@H]3C[C@@H](O)C[C@H]2C3)c1	ZINC000875288160	EE	On-Demand	Mild	PDS	48	38
CC[C@H](C#N)Oc1cccc(CNC(=O)N2C[C@H]3C[C@H](O)C[C@H]2C3)c1	ZINC000875288161	EE	On-Demand	Mild	PDS	48	38
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@](C)(CO)Cc2ccc(F)cc2)c1	ZINC000875288165	GG	On-Demand	Mild	PDS	40	35
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@](C)(CO)Cc2ccc(F)cc2)c1	ZINC000875288166	GG	On-Demand	Mild	PDS	40	35
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@@](C)(CO)Cc2ccc(F)cc2)c1	ZINC000875288167	GG	On-Demand	Mild	PDS	40	35
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@](C)(CO)Cc2ccc(F)cc2)c1	ZINC000875288168	GG	On-Demand	Mild	PDS	40	35
O=C(OCc1nnsc1Cl)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288171	FF	On-Demand	Anodyne	FKBP1A	55	39
O=C(OCc1nnsc1Cl)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288171	FF	On-Demand	Anodyne	PREP	45	36
O=C(OCc1nnsc1Cl)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288172	FF	On-Demand	Anodyne	FKBP1A	55	39
O=C(OCc1nnsc1Cl)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288172	FF	On-Demand	Anodyne	PREP	45	36
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000875288173	GE	On-Demand	Anodyne	L3MBTL3	64	34
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000875288174	GE	On-Demand	Anodyne	L3MBTL3	64	34
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](C)[C@@H](O)C(F)(F)F)c1	ZINC000875288179	FE	On-Demand	Mild	CTSF	40	31
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](C)[C@@H](O)C(F)(F)F)c1	ZINC000875288179	FE	On-Demand	Mild	PDS	63	38
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](C)[C@H](O)C(F)(F)F)c1	ZINC000875288180	FE	On-Demand	Mild	CTSF	40	31
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](C)[C@H](O)C(F)(F)F)c1	ZINC000875288180	FE	On-Demand	Mild	PDS	63	38
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](C)[C@H](O)C(F)(F)F)c1	ZINC000875288181	FE	On-Demand	Mild	CTSF	40	31
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](C)[C@H](O)C(F)(F)F)c1	ZINC000875288181	FE	On-Demand	Mild	PDS	63	38
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](C)[C@@H](O)C(F)(F)F)c1	ZINC000875288182	FE	On-Demand	Mild	CTSF	40	31
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](C)[C@@H](O)C(F)(F)F)c1	ZINC000875288182	FE	On-Demand	Mild	PDS	63	38
C#CCNC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288185	ED	On-Demand	Mild	FKBP1A	77	42
C#CCNC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288185	ED	On-Demand	Mild	PREP	57	38
C#CCNC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288185	ED	On-Demand	Mild	LGMN	49	32
C#CCNC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288186	ED	On-Demand	Mild	FKBP1A	77	42
C#CCNC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288186	ED	On-Demand	Mild	PREP	57	38
C#CCNC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288186	ED	On-Demand	Mild	LGMN	49	32
O=C(NC1CCC(N2CCCCC2)CC1)C(=O)N[C@@H]1CCO[C@H]1c1ccccc1	ZINC000875288187	GF	On-Demand	Anodyne	L3MBTL3	79	38
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCCC(F)(F)CC2)c1	ZINC000875288188	FH	On-Demand	Mild	PDS	43	35
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCCC(F)(F)CC2)c1	ZINC000875288189	FH	On-Demand	Mild	PDS	43	35
CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2cnn(C3CCN(C)CC3)c2)c1	ZINC000875288190	GG	On-Demand	Mild	NAMPT	44	38
CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2cnn(C3CCN(C)CC3)c2)c1	ZINC000875288191	GG	On-Demand	Mild	NAMPT	44	38
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCC(N3CCCCC3)CC2)C1	ZINC000875288206	FD	On-Demand	Anodyne	L3MBTL3	49	36
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCC(N3CCCCC3)CC2)C1	ZINC000875288207	FD	On-Demand	Anodyne	L3MBTL3	49	36
COc1cc2c(cc1OC)CN(C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)CC2	ZINC000875288208	JF	On-Demand	Anodyne	FKBP1A	69	39
COc1cc2c(cc1OC)CN(C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)CC2	ZINC000875288208	JF	On-Demand	Anodyne	CPT1A	19	43
COc1cc2c(cc1OC)CN(C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)CC2	ZINC000875288208	JF	On-Demand	Anodyne	CPT2	44	43
COc1cc2c(cc1OC)CN(C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)CC2	ZINC000875288209	JF	On-Demand	Anodyne	FKBP1A	69	39
COc1cc2c(cc1OC)CN(C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)CC2	ZINC000875288209	JF	On-Demand	Anodyne	CPT1A	19	43
COc1cc2c(cc1OC)CN(C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)CC2	ZINC000875288209	JF	On-Demand	Anodyne	CPT2	44	43
Cc1nn(-c2ccccc2)c(Cl)c1COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288218	IJ	On-Demand	Anodyne	FKBP1A	47	41
Cc1nn(-c2ccccc2)c(Cl)c1COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288218	IJ	On-Demand	Anodyne	PREP	42	38
Cc1nn(-c2ccccc2)c(Cl)c1COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288219	IJ	On-Demand	Anodyne	FKBP1A	47	41
Cc1nn(-c2ccccc2)c(Cl)c1COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288219	IJ	On-Demand	Anodyne	PREP	42	38
COC[C@@H](NC(=O)c1c(C(F)(F)F)coc1C)c1ccccc1	ZINC000875288220	EH	On-Demand	Anodyne	TACR3	48	39
COC[C@H](NC(=O)c1c(C(F)(F)F)coc1C)c1ccccc1	ZINC000875288221	EH	On-Demand	Anodyne	TACR3	48	39
COc1ccc(-c2noc(COC(=O)[C@@H]3CCCCN3C(=O)c3cccs3)n2)c(OC)c1	ZINC000875288229	JH	On-Demand	Anodyne	FKBP1A	55	43
COc1ccc(-c2noc(COC(=O)[C@@H]3CCCCN3C(=O)c3cccs3)n2)c(OC)c1	ZINC000875288229	JH	On-Demand	Anodyne	CPT1A	42	37
COc1ccc(-c2noc(COC(=O)[C@H]3CCCCN3C(=O)c3cccs3)n2)c(OC)c1	ZINC000875288230	JH	On-Demand	Anodyne	FKBP1A	55	43
COc1ccc(-c2noc(COC(=O)[C@H]3CCCCN3C(=O)c3cccs3)n2)c(OC)c1	ZINC000875288230	JH	On-Demand	Anodyne	CPT1A	42	37
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](C)Oc1ccccc1	ZINC000875288238	CE	On-Demand	Anodyne	CAPN2	81	37
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](C)Oc1ccccc1	ZINC000875288238	CE	On-Demand	Anodyne	ACE2	44	37
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](C)Oc1ccccc1	ZINC000875288238	CE	On-Demand	Anodyne	PDS	57	36
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](C)Oc1ccccc1	ZINC000875288240	CE	On-Demand	Anodyne	CAPN2	81	37
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](C)Oc1ccccc1	ZINC000875288240	CE	On-Demand	Anodyne	ACE2	44	37
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](C)Oc1ccccc1	ZINC000875288240	CE	On-Demand	Anodyne	PDS	57	36
COc1ccc(-c2noc(COC(=O)[C@@H]3CCCCN3C(=O)c3cccs3)n2)cc1	ZINC000875288245	IH	On-Demand	Anodyne	FKBP1A	48	39
COc1ccc(-c2noc(COC(=O)[C@@H]3CCCCN3C(=O)c3cccs3)n2)cc1	ZINC000875288245	IH	On-Demand	Anodyne	CPT1A	73	46
COc1ccc(-c2noc(COC(=O)[C@H]3CCCCN3C(=O)c3cccs3)n2)cc1	ZINC000875288246	IH	On-Demand	Anodyne	FKBP1A	48	39
COc1ccc(-c2noc(COC(=O)[C@H]3CCCCN3C(=O)c3cccs3)n2)cc1	ZINC000875288246	IH	On-Demand	Anodyne	CPT1A	73	46
O=C(OCC(=O)N1CCN(C(=O)c2cccs2)CC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288249	JE	On-Demand	Anodyne	FKBP1A	54	40
O=C(OCC(=O)N1CCN(C(=O)c2cccs2)CC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288249	JE	On-Demand	Anodyne	CPT2	44	35
O=C(OCC(=O)N1CCN(C(=O)c2cccs2)CC1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288249	JE	On-Demand	Anodyne	PREP	81	38
O=C(OCC(=O)N1CCN(C(=O)c2cccs2)CC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288250	JE	On-Demand	Anodyne	FKBP1A	54	40
O=C(OCC(=O)N1CCN(C(=O)c2cccs2)CC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288250	JE	On-Demand	Anodyne	CPT2	44	35
O=C(OCC(=O)N1CCN(C(=O)c2cccs2)CC1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288250	JE	On-Demand	Anodyne	PREP	81	38
O=C(NCCN1C(=O)CCC1=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875288253	FC	On-Demand	Anodyne	PTGER4	23	44
O=C(NCCN1C(=O)CCC1=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875288254	FC	On-Demand	Anodyne	PTGER4	23	44
NC(=O)CSc1ccccc1NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288277	JF	On-Demand	Anodyne	LGMN	61	35
NC(=O)CSc1ccccc1NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288278	JF	On-Demand	Anodyne	LGMN	61	35
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000875288279	JI	On-Demand	Anodyne	FKBP1A	46	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000875288279	JI	On-Demand	Anodyne	AVPR2	40	39
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000875288279	JI	On-Demand	Anodyne	PRNP	50	34
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000875288279	JI	On-Demand	Anodyne	PREP	50	37
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000875288279	JI	On-Demand	Anodyne	KCNK3	16	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000875288282	JI	On-Demand	Anodyne	FKBP1A	46	40
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000875288282	JI	On-Demand	Anodyne	AVPR2	40	39
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000875288282	JI	On-Demand	Anodyne	PRNP	50	34
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000875288282	JI	On-Demand	Anodyne	PREP	50	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000875288282	JI	On-Demand	Anodyne	KCNK3	16	41
COC(=O)[C@@H]1CCCN(C(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)C1	ZINC000875288283	GG	On-Demand	Anodyne	PREP	24	45
COC(=O)[C@@H]1CCCN(C(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)C1	ZINC000875288283	GG	On-Demand	Anodyne	SFRP1	41	34
C[C@@H](CNC(=O)N1CCC(C(=O)NCCO)CC1)Oc1ccccc1	ZINC000875288289	EC	On-Demand	Anodyne	MTNR1A	19	52
C[C@@H](CNC(=O)N1CCC(C(=O)NCCO)CC1)Oc1ccccc1	ZINC000875288289	EC	On-Demand	Anodyne	MTNR1B	18	52
C[C@@H](CNC(=O)N1CCC(C(=O)NCCO)CC1)Oc1ccccc1	ZINC000875288289	EC	On-Demand	Anodyne	EPHX2	25	41
C[C@H](CNC(=O)N1CCC(C(=O)NCCO)CC1)Oc1ccccc1	ZINC000875288290	EC	On-Demand	Anodyne	MTNR1A	19	52
C[C@H](CNC(=O)N1CCC(C(=O)NCCO)CC1)Oc1ccccc1	ZINC000875288290	EC	On-Demand	Anodyne	MTNR1B	18	52
C[C@H](CNC(=O)N1CCC(C(=O)NCCO)CC1)Oc1ccccc1	ZINC000875288290	EC	On-Demand	Anodyne	EPHX2	25	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC1CCN(C2CC2)CC1	ZINC000875288295	HE	On-Demand	Anodyne	FKBP1A	45	36
O=C(NCCN1C(=O)CCC1=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875288297	FC	On-Demand	Anodyne	SIGMAR1	36	42
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC1CCN(C2CC2)CC1	ZINC000875288305	HE	On-Demand	Anodyne	FKBP1A	45	36
COc1ccccc1[C@H](C)NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288311	IG	On-Demand	Anodyne	FKBP1A	91	38
COc1ccccc1[C@H](C)NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288315	IG	On-Demand	Anodyne	FKBP1A	91	38
CCOc1cc(CNC(=O)N(CCOC)CC2CCN(C)CC2)ccc1OC	ZINC000875288333	GF	On-Demand	Anodyne	ACHE	17	41
CCOc1cc(CNC(=O)N(CCOC)CC2CCN(C)CC2)ccc1OC	ZINC000875288333	GF	On-Demand	Anodyne	SSTR5	72	39
CCOc1cc(CNC(=O)N(CCOC)CC2CCN(C)CC2)ccc1OC	ZINC000875288333	GF	On-Demand	Anodyne	ACKR3	66	35
C[C@H]1CC(=O)N[C@@H](C(=O)Nc2c(N3CCCC3)cccc2N2CCCC2)C1	ZINC000875288364	FF	On-Demand	Anodyne	KCNQ2	70	37
CSc1ccc(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875288369	HH	On-Demand	Anodyne	FKBP1A	55	37
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875288371	GI	On-Demand	Mild	EPHX2	17	43
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875288372	GI	On-Demand	Mild	EPHX2	17	43
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875288373	GI	On-Demand	Mild	EPHX2	17	43
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875288374	GI	On-Demand	Mild	EPHX2	17	43
O=C(OCc1nnnn1Cc1ccccc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288375	HF	On-Demand	Anodyne	FKBP1A	66	44
O=C(OCc1nnnn1Cc1ccccc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288375	HF	On-Demand	Anodyne	PREP	64	40
O=C(OCc1nnnn1Cc1ccccc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288376	HF	On-Demand	Anodyne	FKBP1A	66	44
O=C(OCc1nnnn1Cc1ccccc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288376	HF	On-Demand	Anodyne	PREP	64	40
CCOc1cc(CNC(=O)NN(C)C(=O)OC)ccc1OC	ZINC000875288394	DD	On-Demand	Reactive	PDE6A	41	35
CCOc1cc(CNC(=O)NN(C)C(=O)OC)ccc1OC	ZINC000875288394	DD	On-Demand	Reactive	MT-ND1	25	43
CC[C@H](C[C@H](C)O)NC(=O)NCCc1ccc2c(c1)CCO2	ZINC000875288397	DE	On-Demand	Anodyne	MTNR1B	35	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(O)cc1	ZINC000875288399	GF	On-Demand	Anodyne	FKBP1A	43	39
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccc(O)cc1	ZINC000875288400	GF	On-Demand	Anodyne	FKBP1A	43	39
CC[C@@H](NC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)c1ccc(Cl)s1	ZINC000875288402	GH	On-Demand	Anodyne	ETHR	46	34
CC[C@@H](NC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)c1ccc(Cl)s1	ZINC000875288405	GH	On-Demand	Anodyne	ETHR	46	34
O=C(OCc1nc(-c2ccc(C(F)(F)F)cc2)no1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288411	JJ	On-Demand	Anodyne	CPT1A	50	37
O=C(OCc1nc(-c2ccc(C(F)(F)F)cc2)no1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288412	JJ	On-Demand	Anodyne	CPT1A	50	37
CCOc1cc(CNC(=O)N2CC(O)(C(=O)OC)C2)ccc1OC	ZINC000875288419	EC	On-Demand	Anodyne	SSTR5	43	36
O=C(OCC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288420	IF	On-Demand	Bother	NOS1	18	44
O=C(OCC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288421	IF	On-Demand	Bother	NOS1	18	44
O=C(OCc1cc(-c2ccc(Cl)cc2)no1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288423	IJ	On-Demand	Anodyne	CPT1A	66	39
O=C(OCc1cc(-c2ccc(Cl)cc2)no1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288424	IJ	On-Demand	Anodyne	CPT1A	66	39
O=C(OCCCc1nc(-c2ccncc2)no1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288426	IG	On-Demand	Anodyne	FKBP1A	67	45
O=C(OCCCc1nc(-c2ccncc2)no1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288426	IG	On-Demand	Anodyne	CPT1A	48	39
O=C(OCCCc1nc(-c2ccncc2)no1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288427	IG	On-Demand	Anodyne	FKBP1A	67	45
O=C(OCCCc1nc(-c2ccncc2)no1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288427	IG	On-Demand	Anodyne	CPT1A	48	39
CCOc1cc(CNC(=O)N2CC(CNC(=O)C(F)(F)F)C2)ccc1OC	ZINC000875288431	GD	On-Demand	Anodyne	SSTR5	43	37
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(OC(F)F)cc1	ZINC000875288432	JG	On-Demand	Anodyne	FKBP1A	71	37
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(OC(F)F)cc1	ZINC000875288432	JG	On-Demand	Anodyne	LGMN	63	32
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(OC(F)F)cc1	ZINC000875288432	JG	On-Demand	Anodyne	TMPRSS11D	46	34
CSc1ccc(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875288433	HH	On-Demand	Anodyne	FKBP1A	55	37
COc1cc(Br)c(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1OC	ZINC000875288459	JI	On-Demand	Anodyne	FKBP1A	86	43
COc1cc(Br)c(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1OC	ZINC000875288460	JI	On-Demand	Anodyne	FKBP1A	86	43
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(OC(F)F)cc1	ZINC000875288462	JG	On-Demand	Anodyne	FKBP1A	71	37
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(OC(F)F)cc1	ZINC000875288462	JG	On-Demand	Anodyne	LGMN	63	32
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(OC(F)F)cc1	ZINC000875288462	JG	On-Demand	Anodyne	TMPRSS11D	46	34
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000875288469	GE	On-Demand	Anodyne	PRNP	63	37
O=C(OCc1ccno1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288480	DE	On-Demand	Anodyne	FKBP1A	54	40
O=C(OCc1ccno1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288480	DE	On-Demand	Anodyne	PREP	55	39
O=C(OCc1ccno1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288482	DE	On-Demand	Anodyne	FKBP1A	54	40
O=C(OCc1ccno1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288482	DE	On-Demand	Anodyne	PREP	55	39
O=C(OCC(=O)N(Cc1ccccc1)CC(F)(F)F)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288495	JH	On-Demand	Anodyne	FKBP1A	72	42
O=C(OCC(=O)N(Cc1ccccc1)CC(F)(F)F)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288495	JH	On-Demand	Anodyne	PREP	65	36
O=C(OCC(=O)N(Cc1ccccc1)CC(F)(F)F)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288496	JH	On-Demand	Anodyne	FKBP1A	72	42
O=C(OCC(=O)N(Cc1ccccc1)CC(F)(F)F)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288496	JH	On-Demand	Anodyne	PREP	65	36
Cc1ccc(CNC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1F	ZINC000875288518	HG	On-Demand	Anodyne	FKBP1A	76	40
Cc1ccc(CNC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1F	ZINC000875288518	HG	On-Demand	Anodyne	LGMN	63	33
Cc1ccc(CNC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1F	ZINC000875288520	HG	On-Demand	Anodyne	FKBP1A	76	40
Cc1ccc(CNC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1F	ZINC000875288520	HG	On-Demand	Anodyne	LGMN	63	33
O=C(OCCCN1C(=O)c2ccccc2C1=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288525	IF	On-Demand	Anodyne	FKBP1A	77	48
O=C(OCCCN1C(=O)c2ccccc2C1=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288525	IF	On-Demand	Anodyne	PREP	76	36
O=C(OCCCN1C(=O)c2ccccc2C1=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288526	IF	On-Demand	Anodyne	FKBP1A	77	48
O=C(OCCCN1C(=O)c2ccccc2C1=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288526	IF	On-Demand	Anodyne	PREP	76	36
O=C(OCC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCO2)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288528	JG	On-Demand	Anodyne	CPT1A	84	43
O=C(OCC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCO2)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288529	JG	On-Demand	Anodyne	CPT1A	84	43
O=C(OCC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCO2)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288531	JG	On-Demand	Anodyne	CPT1A	84	43
O=C(OCC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCO2)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288532	JG	On-Demand	Anodyne	CPT1A	84	43
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC(C1CC1)C1CC1	ZINC000875288553	GF	On-Demand	Anodyne	FKBP1A	55	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC(C1CC1)C1CC1	ZINC000875288553	GF	On-Demand	Anodyne	PREP	42	35
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NC(C1CC1)C1CC1	ZINC000875288553	GF	On-Demand	Anodyne	LGMN	58	33
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC(C1CC1)C1CC1	ZINC000875288555	GF	On-Demand	Anodyne	FKBP1A	55	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC(C1CC1)C1CC1	ZINC000875288555	GF	On-Demand	Anodyne	PREP	42	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NC(C1CC1)C1CC1	ZINC000875288555	GF	On-Demand	Anodyne	LGMN	58	33
CN(C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)[C@H]1CCCc2ccccc21	ZINC000875288558	IH	On-Demand	Anodyne	FKBP1A	48	37
CN(C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)[C@@H]1CCCc2ccccc21	ZINC000875288559	IH	On-Demand	Anodyne	FKBP1A	48	37
O=C(OCCCOc1ccc(Cl)cc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288570	HI	On-Demand	Anodyne	FKBP1A	69	44
O=C(OCCCOc1ccc(Cl)cc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288570	HI	On-Demand	Anodyne	LTA4H	19	41
O=C(OCCCOc1ccc(Cl)cc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288570	HI	On-Demand	Anodyne	HRH3	16	43
O=C(OCCCOc1ccc(Cl)cc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288570	HI	On-Demand	Anodyne	CPT1A	43	38
O=C(OCCCOc1ccc(Cl)cc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288570	HI	On-Demand	Anodyne	CPT2	41	38
O=C(OCCCOc1ccc(Cl)cc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288571	HI	On-Demand	Anodyne	FKBP1A	69	44
O=C(OCCCOc1ccc(Cl)cc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288571	HI	On-Demand	Anodyne	LTA4H	19	41
O=C(OCCCOc1ccc(Cl)cc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288571	HI	On-Demand	Anodyne	HRH3	16	43
O=C(OCCCOc1ccc(Cl)cc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288571	HI	On-Demand	Anodyne	CPT1A	43	38
O=C(OCCCOc1ccc(Cl)cc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288571	HI	On-Demand	Anodyne	CPT2	41	38
COc1ccc([C@H](NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)C2CC2)cc1	ZINC000875288582	JH	On-Demand	Anodyne	FKBP1A	69	39
COc1ccc([C@@H](NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)C2CC2)cc1	ZINC000875288583	JH	On-Demand	Anodyne	FKBP1A	69	39
COc1ccc([C@H](NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)C2CC2)cc1	ZINC000875288584	JH	On-Demand	Anodyne	FKBP1A	69	39
COc1ccc([C@@H](NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)C2CC2)cc1	ZINC000875288585	JH	On-Demand	Anodyne	FKBP1A	69	39
CC[C@H](C#N)Oc1cccc(CNC(=O)NC2(C)CC(F)(F)C2)c1	ZINC000875288586	EG	On-Demand	Mild	PDS	51	37
CC[C@@H](C#N)Oc1cccc(CNC(=O)NC2(C)CC(F)(F)C2)c1	ZINC000875288587	EG	On-Demand	Mild	PDS	51	37
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@H](CC)C[C@@H](C)O)c1	ZINC000875288595	EF	On-Demand	Mild	ANPEP	16	47
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@H](CC)C[C@@H](C)O)c1	ZINC000875288595	EF	On-Demand	Mild	PDS	64	41
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@H](CC)C[C@H](C)O)c1	ZINC000875288597	EF	On-Demand	Mild	ANPEP	16	47
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@H](CC)C[C@H](C)O)c1	ZINC000875288597	EF	On-Demand	Mild	PDS	64	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(O[C@@H](C#N)CC)c1	ZINC000875288598	EF	On-Demand	Mild	ANPEP	16	47
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(O[C@@H](C#N)CC)c1	ZINC000875288598	EF	On-Demand	Mild	PDS	64	41
CCc1nnc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)o1	ZINC000875288603	EE	On-Demand	Anodyne	FKBP1A	61	41
CCc1nnc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)o1	ZINC000875288604	EE	On-Demand	Anodyne	FKBP1A	61	41
O=C(OCc1ccc(S(=O)(=O)C(F)F)cc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288609	IG	On-Demand	Anodyne	FKBP1A	64	42
O=C(OCc1ccc(S(=O)(=O)C(F)F)cc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288609	IG	On-Demand	Anodyne	PREP	40	37
O=C(OCc1ccc(S(=O)(=O)C(F)F)cc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288609	IG	On-Demand	Anodyne	LGMN	66	34
O=C(OCc1ccc(S(=O)(=O)C(F)F)cc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288610	IG	On-Demand	Anodyne	FKBP1A	64	42
O=C(OCc1ccc(S(=O)(=O)C(F)F)cc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288610	IG	On-Demand	Anodyne	PREP	40	37
O=C(OCc1ccc(S(=O)(=O)C(F)F)cc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288610	IG	On-Demand	Anodyne	LGMN	66	34
CC[C@@H](NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc(Cl)cc1	ZINC000875288611	II	On-Demand	Anodyne	FKBP1A	45	37
CC[C@@H](NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc(Cl)cc1	ZINC000875288612	II	On-Demand	Anodyne	FKBP1A	45	37
CC[C@H](NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccc(Cl)cc1	ZINC000875288613	II	On-Demand	Anodyne	FKBP1A	45	37
CC[C@H](NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccc(Cl)cc1	ZINC000875288614	II	On-Demand	Anodyne	FKBP1A	45	37
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(OC(F)(F)F)cc1	ZINC000875288615	JH	On-Demand	Anodyne	FKBP1A	66	39
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(OC(F)(F)F)cc1	ZINC000875288615	JH	On-Demand	Anodyne	LGMN	44	33
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(OC(F)(F)F)cc1	ZINC000875288616	JH	On-Demand	Anodyne	FKBP1A	66	39
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(OC(F)(F)F)cc1	ZINC000875288616	JH	On-Demand	Anodyne	LGMN	44	33
COc1ccc([C@H](NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)C(C)C)cc1	ZINC000875288617	JH	On-Demand	Anodyne	FKBP1A	68	39
COc1ccc([C@@H](NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)C(C)C)cc1	ZINC000875288618	JH	On-Demand	Anodyne	FKBP1A	68	39
COc1ccc([C@H](NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)C(C)C)cc1	ZINC000875288619	JH	On-Demand	Anodyne	FKBP1A	68	39
COc1ccc([C@@H](NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)C(C)C)cc1	ZINC000875288620	JH	On-Demand	Anodyne	FKBP1A	68	39
CN1CCCC[C@@H]1CCOC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288634	FG	On-Demand	Anodyne	FKBP1A	71	42
CN1CCCC[C@@H]1CCOC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288634	FG	On-Demand	Anodyne	PREP	63	35
CN1CCCC[C@@H]1CCOC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288634	FG	On-Demand	Anodyne	CHRNA10	49	34
CN1CCCC[C@@H]1CCOC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288634	FG	On-Demand	Anodyne	ACKR3	51	32
CN1CCCC[C@H]1CCOC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288635	FG	On-Demand	Anodyne	FKBP1A	71	42
CN1CCCC[C@H]1CCOC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288635	FG	On-Demand	Anodyne	PREP	63	35
CN1CCCC[C@H]1CCOC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288635	FG	On-Demand	Anodyne	CHRNA10	49	34
CN1CCCC[C@H]1CCOC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288635	FG	On-Demand	Anodyne	ACKR3	51	32
CN1CCCC[C@@H]1CCOC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288636	FG	On-Demand	Anodyne	FKBP1A	71	42
CN1CCCC[C@@H]1CCOC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288636	FG	On-Demand	Anodyne	PREP	63	35
CN1CCCC[C@@H]1CCOC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288636	FG	On-Demand	Anodyne	CHRNA10	49	34
CN1CCCC[C@@H]1CCOC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288636	FG	On-Demand	Anodyne	ACKR3	51	32
CN1CCCC[C@H]1CCOC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288637	FG	On-Demand	Anodyne	FKBP1A	71	42
CN1CCCC[C@H]1CCOC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288637	FG	On-Demand	Anodyne	PREP	63	35
CN1CCCC[C@H]1CCOC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288637	FG	On-Demand	Anodyne	CHRNA10	49	34
CN1CCCC[C@H]1CCOC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288637	FG	On-Demand	Anodyne	ACKR3	51	32
O=C(OCc1ccc(F)c(F)c1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288640	FH	On-Demand	Anodyne	FKBP1A	73	43
O=C(OCc1ccc(F)c(F)c1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288640	FH	On-Demand	Anodyne	PREP	68	40
O=C(OCc1ccc(F)c(F)c1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288640	FH	On-Demand	Anodyne	LGMN	63	38
O=C(OCc1ccc(F)c(F)c1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288641	FH	On-Demand	Anodyne	FKBP1A	73	43
O=C(OCc1ccc(F)c(F)c1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288641	FH	On-Demand	Anodyne	PREP	68	40
O=C(OCc1ccc(F)c(F)c1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288641	FH	On-Demand	Anodyne	LGMN	63	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@@H](c1ccccc1)c1ccc(Cl)cc1	ZINC000875288643	JJ	On-Demand	Anodyne	FKBP1A	54	39
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@@H](c1ccccc1)c1ccc(Cl)cc1	ZINC000875288643	JJ	On-Demand	Anodyne	PRCP	19	42
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@@H](c1ccccc1)c1ccc(Cl)cc1	ZINC000875288651	JJ	On-Demand	Anodyne	FKBP1A	54	39
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@@H](c1ccccc1)c1ccc(Cl)cc1	ZINC000875288651	JJ	On-Demand	Anodyne	PRCP	19	42
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@H](c1ccccc1)c1ccc(Cl)cc1	ZINC000875288652	JJ	On-Demand	Anodyne	FKBP1A	54	39
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@H](c1ccccc1)c1ccc(Cl)cc1	ZINC000875288652	JJ	On-Demand	Anodyne	PRCP	19	42
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@H](c1ccccc1)c1ccc(Cl)cc1	ZINC000875288653	JJ	On-Demand	Anodyne	FKBP1A	54	39
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@H](c1ccccc1)c1ccc(Cl)cc1	ZINC000875288653	JJ	On-Demand	Anodyne	PRCP	19	42
COc1ccccc1[C@H]1CCCN(C(=O)NCCN2C(=O)CCC2=O)CC1	ZINC000875288656	FE	On-Demand	Anodyne	HTR1A	38	43
COc1ccccc1[C@H]1CCCN(C(=O)NCCN2C(=O)CCC2=O)CC1	ZINC000875288656	FE	On-Demand	Anodyne	DRD2	32	45
COc1ccccc1[C@H]1CCCN(C(=O)NCCN2C(=O)CCC2=O)CC1	ZINC000875288656	FE	On-Demand	Anodyne	DRD4	18	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCCN2C(=O)CCC2=O)CC1	ZINC000875288657	FE	On-Demand	Anodyne	HTR1A	38	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCCN2C(=O)CCC2=O)CC1	ZINC000875288657	FE	On-Demand	Anodyne	DRD2	32	45
COc1ccccc1[C@@H]1CCCN(C(=O)NCCN2C(=O)CCC2=O)CC1	ZINC000875288657	FE	On-Demand	Anodyne	DRD4	18	43
COc1ccc(C)cc1COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288677	FH	On-Demand	Anodyne	FKBP1A	88	45
COc1ccc(C)cc1COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288677	FH	On-Demand	Anodyne	QRFPR	27	40
COc1ccc(C)cc1COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288680	FH	On-Demand	Anodyne	FKBP1A	88	45
COc1ccc(C)cc1COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288680	FH	On-Demand	Anodyne	QRFPR	27	40
Cc1noc(C)c1[C@H](C)NC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875288687	FH	On-Demand	Anodyne	CPT1A	43	33
Cc1noc(C)c1[C@H](C)NC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875288689	FH	On-Demand	Anodyne	CPT1A	43	33
Cc1noc(C)c1[C@H](C)NC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875288690	FH	On-Demand	Anodyne	CPT1A	43	33
Cc1noc(C)c1[C@H](C)NC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875288691	FH	On-Demand	Anodyne	CPT1A	43	33
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCCOc1ccccc1	ZINC000875288702	HE	On-Demand	Anodyne	FKBP1A	92	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCCOc1ccccc1	ZINC000875288702	HE	On-Demand	Anodyne	CPT1A	109	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCCOc1ccccc1	ZINC000875288702	HE	On-Demand	Anodyne	CPT2	48	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCCOc1ccccc1	ZINC000875288702	HE	On-Demand	Anodyne	PREP	63	39
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCCOc1ccccc1	ZINC000875288704	HE	On-Demand	Anodyne	FKBP1A	92	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCCOc1ccccc1	ZINC000875288704	HE	On-Demand	Anodyne	CPT1A	109	40
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCCOc1ccccc1	ZINC000875288704	HE	On-Demand	Anodyne	CPT2	48	36
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCCOc1ccccc1	ZINC000875288704	HE	On-Demand	Anodyne	PREP	63	39
CCc1ccc(N(C(C)=O)c2nc(COC(=O)[C@@H]3CCCCN3C(=O)c3cccs3)cs2)cc1	ZINC000875288706	JK	On-Demand	Anodyne	FKBP1A	40	38
CCc1ccc(N(C(C)=O)c2nc(COC(=O)[C@H]3CCCCN3C(=O)c3cccs3)cs2)cc1	ZINC000875288708	JK	On-Demand	Anodyne	FKBP1A	40	38
O=C(OCc1ccc(Cl)s1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288715	FI	On-Demand	Anodyne	FKBP1A	46	40
O=C(OCc1ccc(Cl)s1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288715	FI	On-Demand	Anodyne	PREP	53	37
CN(C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)[C@H](c1ccccc1)c1ccc(F)cc1	ZINC000875288716	JJ	On-Demand	Anodyne	FKBP1A	79	41
CN(C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)[C@H](c1ccccc1)c1ccc(F)cc1	ZINC000875288716	JJ	On-Demand	Anodyne	OPRK1	21	41
CN(C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)[C@@H](c1ccccc1)c1ccc(F)cc1	ZINC000875288717	JJ	On-Demand	Anodyne	FKBP1A	79	41
CN(C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)[C@@H](c1ccccc1)c1ccc(F)cc1	ZINC000875288717	JJ	On-Demand	Anodyne	OPRK1	21	41
O=C(OCc1ccc(Cl)s1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288718	FI	On-Demand	Anodyne	FKBP1A	46	40
O=C(OCc1ccc(Cl)s1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288718	FI	On-Demand	Anodyne	PREP	53	37
Cc1ccc(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)s1	ZINC000875288719	GH	On-Demand	Anodyne	FKBP1A	54	40
Cc1ccc(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)s1	ZINC000875288719	GH	On-Demand	Anodyne	PREP	40	35
Cc1ccc(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)s1	ZINC000875288721	GH	On-Demand	Anodyne	FKBP1A	54	40
Cc1ccc(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)s1	ZINC000875288721	GH	On-Demand	Anodyne	PREP	40	35
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)C1CCCCC1	ZINC000875288722	FG	On-Demand	Anodyne	FKBP1A	61	44
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)C1CCCCC1	ZINC000875288722	FG	On-Demand	Anodyne	PREP	61	39
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)C1CCCCC1	ZINC000875288724	FG	On-Demand	Anodyne	FKBP1A	61	44
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)C1CCCCC1	ZINC000875288724	FG	On-Demand	Anodyne	PREP	61	39
CCOc1cc(CNC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)ccc1OC	ZINC000875288730	FF	On-Demand	Anodyne	SSTR5	49	38
COC(=O)c1cccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875288745	IF	On-Demand	Anodyne	FKBP1A	51	36
COC(=O)c1cccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875288745	IF	On-Demand	Anodyne	PREP	34	43
COC(=O)c1cccc(NC(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875288745	IF	On-Demand	Anodyne	NOS1	43	41
COC(=O)c1cccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875288746	IF	On-Demand	Anodyne	FKBP1A	51	36
COC(=O)c1cccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875288746	IF	On-Demand	Anodyne	PREP	34	43
COC(=O)c1cccc(NC(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875288746	IF	On-Demand	Anodyne	NOS1	43	41
N#Cc1ccc(F)c(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875288749	FG	On-Demand	Mild	PREP	42	36
N#Cc1ccc(F)c(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875288749	FG	On-Demand	Mild	LGMN	41	34
N#Cc1ccc(F)c(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875288752	FG	On-Demand	Mild	PREP	42	36
N#Cc1ccc(F)c(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c1	ZINC000875288752	FG	On-Demand	Mild	LGMN	41	34
O=C(OCc1ccccc1OC(F)F)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288753	GI	On-Demand	Anodyne	FKBP1A	60	40
O=C(OCc1ccccc1OC(F)F)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288754	GI	On-Demand	Anodyne	FKBP1A	60	40
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCC1(c2ccccc2)CC1	ZINC000875288761	IG	On-Demand	Anodyne	FKBP1A	58	44
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCC1(c2ccccc2)CC1	ZINC000875288761	IG	On-Demand	Anodyne	KCNA3	40	34
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCC1(c2ccccc2)CC1	ZINC000875288761	IG	On-Demand	Anodyne	PREP	50	35
O=C(OCc1cc(=O)c(O)co1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288766	FE	On-Demand	Anodyne	FKBP1A	48	40
O=C(OCc1cc(=O)c(O)co1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288767	FE	On-Demand	Anodyne	FKBP1A	48	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCC1(c2ccccc2)CC1	ZINC000875288769	IG	On-Demand	Anodyne	FKBP1A	58	44
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCC1(c2ccccc2)CC1	ZINC000875288769	IG	On-Demand	Anodyne	KCNA3	40	34
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCC1(c2ccccc2)CC1	ZINC000875288769	IG	On-Demand	Anodyne	PREP	50	35
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CC(OCC(F)F)C2)c1	ZINC000875288789	FF	On-Demand	Mild	PDS	53	37
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CC(OCC(F)F)C2)c1	ZINC000875288790	FF	On-Demand	Mild	PDS	53	37
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000875288791	FD	On-Demand	Mild	NQO2	21	41
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000875288791	FD	On-Demand	Mild	MTNR1A	17	42
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000875288791	FD	On-Demand	Mild	EBP	15	43
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000875288792	FD	On-Demand	Mild	NQO2	21	41
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000875288792	FD	On-Demand	Mild	MTNR1A	17	42
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000875288792	FD	On-Demand	Mild	EBP	15	43
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000875288794	FD	On-Demand	Mild	NQO2	21	41
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000875288794	FD	On-Demand	Mild	MTNR1A	17	42
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000875288794	FD	On-Demand	Mild	EBP	15	43
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000875288795	FD	On-Demand	Mild	NQO2	21	41
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000875288795	FD	On-Demand	Mild	MTNR1A	17	42
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000875288795	FD	On-Demand	Mild	EBP	15	43
CCOc1cc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)ccc1OC	ZINC000875288802	GH	On-Demand	Anodyne	PDE4A	22	41
CCOc1cc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)ccc1OC	ZINC000875288802	GH	On-Demand	Anodyne	SSTR5	76	42
CCOc1cc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)ccc1OC	ZINC000875288803	GH	On-Demand	Anodyne	PDE4A	22	41
CCOc1cc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)ccc1OC	ZINC000875288803	GH	On-Demand	Anodyne	SSTR5	76	42
N#Cc1ccc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)c(F)c1	ZINC000875288810	FG	On-Demand	Mild	PREP	55	35
N#Cc1ccc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)c(F)c1	ZINC000875288811	FG	On-Demand	Mild	PREP	55	35
CN(C)CCn1cc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)cn1	ZINC000875288815	GG	On-Demand	Anodyne	MAPK10	17	56
CN(C)CCn1cc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)cn1	ZINC000875288815	GG	On-Demand	Anodyne	PANC	57	37
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1cccc([N+](=O)[O-])c1	ZINC000875288817	HG	On-Demand	Bother	CPT1A	15	40
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1cccc([N+](=O)[O-])c1	ZINC000875288818	HG	On-Demand	Bother	CPT1A	15	40
CS(=O)(=O)Nc1ccc(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875288829	JF	On-Demand	Anodyne	FKBP1A	50	36
CS(=O)(=O)Nc1ccc(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875288830	JF	On-Demand	Anodyne	FKBP1A	50	36
CC(C)(C)NC(=O)CN1CCN(C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875288831	JD	On-Demand	Anodyne	FKBP1A	44	41
CC(C)(C)NC(=O)CN1CCN(C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)CC1	ZINC000875288832	JD	On-Demand	Anodyne	FKBP1A	44	41
CC[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccc(Cl)s1	ZINC000875288836	GG	On-Demand	Anodyne	L3MBTL3	47	39
CCOc1cc(CNC(=O)N2Cc3cccc(O)c3C2)ccc1OC	ZINC000875288837	EG	On-Demand	Clean	SSTR5	42	36
CCOc1cc(CNC(=O)N2Cc3cccc(O)c3C2)ccc1OC	ZINC000875288837	EG	On-Demand	Clean	MT-ND1	18	40
CCOc1cc(CNC(=O)N2Cc3cccc(O)c3C2)ccc1OC	ZINC000875288837	EG	On-Demand	Clean	NAMPT	21	40
O=C(OCc1cnn(-c2ccccc2)c1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288840	GH	On-Demand	Anodyne	FKBP1A	67	43
O=C(OCc1cnn(-c2ccccc2)c1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288840	GH	On-Demand	Anodyne	PREP	84	42
O=C(OCc1cnn(-c2ccccc2)c1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288841	GH	On-Demand	Anodyne	FKBP1A	67	43
O=C(OCc1cnn(-c2ccccc2)c1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288841	GH	On-Demand	Anodyne	PREP	84	42
O=C(OCc1csc(COc2ccc(Cl)cc2)n1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288844	JK	On-Demand	Anodyne	CPT1A	39	43
O=C(OCc1csc(COc2ccc(Cl)cc2)n1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288845	JK	On-Demand	Anodyne	CPT1A	39	43
O=C(OCc1cc(Cl)c2c(c1)OCCO2)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288867	HH	On-Demand	Anodyne	FKBP1A	40	38
O=C(OCc1cc(Cl)c2c(c1)OCCO2)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288871	HH	On-Demand	Anodyne	FKBP1A	40	38
NC(=O)CCN(Cc1ccccc1)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288872	JE	On-Demand	Anodyne	FKBP1A	66	41
NC(=O)CCN(Cc1ccccc1)C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288872	JE	On-Demand	Anodyne	PREP	67	36
O=C(OCc1nc2ccccc2c2ccccc12)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288873	IK	On-Demand	Bother	FKBP1A	58	42
O=C(OCc1nc2ccccc2c2ccccc12)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288873	IK	On-Demand	Bother	PREP	58	40
NC(=O)CCN(Cc1ccccc1)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288874	JE	On-Demand	Anodyne	FKBP1A	66	41
NC(=O)CCN(Cc1ccccc1)C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288874	JE	On-Demand	Anodyne	PREP	67	36
O=C(OCc1nc2ccccc2c2ccccc12)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288888	IK	On-Demand	Bother	FKBP1A	58	42
O=C(OCc1nc2ccccc2c2ccccc12)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288888	IK	On-Demand	Bother	PREP	58	40
C[C@@H](OC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)C(=O)Nc1ncccn1	ZINC000875288891	GE	On-Demand	Anodyne	FKBP1A	56	37
CCOc1cc(CNC(=O)N2CC[C@H](C(F)(F)F)O[C@@H](C)C2)ccc1OC	ZINC000875288897	GG	On-Demand	Anodyne	SSTR5	69	39
CCOc1cc(CNC(=O)N2CC[C@@H](C(F)(F)F)O[C@@H](C)C2)ccc1OC	ZINC000875288899	GG	On-Demand	Anodyne	SSTR5	69	39
CCOc1cc(CNC(=O)N2CC[C@H](C(F)(F)F)O[C@H](C)C2)ccc1OC	ZINC000875288901	GG	On-Demand	Anodyne	SSTR5	69	39
CCOc1cc(CNC(=O)N2CC[C@@H](C(F)(F)F)O[C@H](C)C2)ccc1OC	ZINC000875288903	GG	On-Demand	Anodyne	SSTR5	69	39
CCC[C@@H](NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875288906	IH	On-Demand	Anodyne	FKBP1A	90	45
CCC[C@@H](NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875288906	IH	On-Demand	Anodyne	TRY1_BOVIN	63	33
CCC[C@@H](NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875288906	IH	On-Demand	Anodyne	PREP	45	37
CCC[C@H](NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875288908	IH	On-Demand	Anodyne	FKBP1A	90	45
CCC[C@H](NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875288908	IH	On-Demand	Anodyne	TRY1_BOVIN	63	33
CCC[C@H](NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875288908	IH	On-Demand	Anodyne	PREP	45	37
O=C(OCc1csc(-c2ccccn2)n1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288909	HI	On-Demand	Anodyne	FKBP1A	41	39
O=C(OCc1csc(-c2ccccn2)n1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288909	HI	On-Demand	Anodyne	CPT1A	62	50
O=C(OCc1csc(-c2ccccn2)n1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288909	HI	On-Demand	Anodyne	PREP	49	38
CCC[C@H](NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875288910	IH	On-Demand	Anodyne	FKBP1A	90	45
CCC[C@H](NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875288910	IH	On-Demand	Anodyne	TRY1_BOVIN	63	33
CCC[C@H](NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875288910	IH	On-Demand	Anodyne	PREP	45	37
O=C(OCc1csc(-c2ccccn2)n1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288911	HI	On-Demand	Anodyne	FKBP1A	41	39
O=C(OCc1csc(-c2ccccn2)n1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288911	HI	On-Demand	Anodyne	CPT1A	62	50
O=C(OCc1csc(-c2ccccn2)n1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288911	HI	On-Demand	Anodyne	PREP	49	38
CCC[C@@H](NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875288912	IH	On-Demand	Anodyne	FKBP1A	90	45
CCC[C@@H](NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875288912	IH	On-Demand	Anodyne	TRY1_BOVIN	63	33
CCC[C@@H](NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1ccccc1	ZINC000875288912	IH	On-Demand	Anodyne	PREP	45	37
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@H](c1ccccc1)C1CC1	ZINC000875288913	IH	On-Demand	Anodyne	FKBP1A	66	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@H](c1ccccc1)C1CC1	ZINC000875288913	IH	On-Demand	Anodyne	TRY1_BOVIN	41	33
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@H](c1ccccc1)C1CC1	ZINC000875288913	IH	On-Demand	Anodyne	PREP	47	36
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@@H](c1ccccc1)C1CC1	ZINC000875288916	IH	On-Demand	Anodyne	FKBP1A	66	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@@H](c1ccccc1)C1CC1	ZINC000875288916	IH	On-Demand	Anodyne	TRY1_BOVIN	41	33
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@@H](c1ccccc1)C1CC1	ZINC000875288916	IH	On-Demand	Anodyne	PREP	47	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@@H](c1ccccc1)C1CC1	ZINC000875288918	IH	On-Demand	Anodyne	FKBP1A	66	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@@H](c1ccccc1)C1CC1	ZINC000875288918	IH	On-Demand	Anodyne	TRY1_BOVIN	41	33
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@@H](c1ccccc1)C1CC1	ZINC000875288918	IH	On-Demand	Anodyne	PREP	47	36
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@H](c1ccccc1)C1CC1	ZINC000875288920	IH	On-Demand	Anodyne	FKBP1A	66	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@H](c1ccccc1)C1CC1	ZINC000875288920	IH	On-Demand	Anodyne	TRY1_BOVIN	41	33
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@H](c1ccccc1)C1CC1	ZINC000875288920	IH	On-Demand	Anodyne	PREP	47	36
COc1cc(F)c([C@H](C)NC(=O)N2CCC3(CCN(C)CC3)CC2)cc1OC	ZINC000875288922	GG	On-Demand	Anodyne	CACNA1H	43	33
O=C(NCCCO[C@H]1CCCc2ccccc21)N1CCC2(CCNC2=O)CC1	ZINC000875288925	GF	On-Demand	Anodyne	GHRHR	41	31
COc1cc(F)c([C@@H](C)NC(=O)N2CCC3(CCN(C)CC3)CC2)cc1OC	ZINC000875288926	GG	On-Demand	Anodyne	CACNA1H	43	33
O=C(NCCCO[C@@H]1CCCc2ccccc21)N1CCC2(CCNC2=O)CC1	ZINC000875288927	GF	On-Demand	Anodyne	GHRHR	41	31
Nc1nc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)nc2ccccc12	ZINC000875288928	GG	On-Demand	Anodyne	FKBP1A	51	41
Nc1nc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)nc2ccccc12	ZINC000875288928	GG	On-Demand	Anodyne	PREP	60	39
C[C@@H](CNC(=O)N1CCC[C@H](C(C)(C)O)C1)Oc1ccccc1	ZINC000875288930	DF	On-Demand	Anodyne	AMY2	46	31
Nc1nc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)nc2ccccc12	ZINC000875288931	GG	On-Demand	Anodyne	FKBP1A	51	41
Nc1nc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)nc2ccccc12	ZINC000875288931	GG	On-Demand	Anodyne	PREP	60	39
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCCc1cnn(-c2ccccc2)c1	ZINC000875288933	JF	On-Demand	Anodyne	FKBP1A	53	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCCc1cnn(-c2ccccc2)c1	ZINC000875288933	JF	On-Demand	Anodyne	PREP	70	39
C[C@@H](CNC(=O)N1CCC[C@@H](C(C)(C)O)C1)Oc1ccccc1	ZINC000875288934	DF	On-Demand	Anodyne	AMY2	46	31
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCCc1cnn(-c2ccccc2)c1	ZINC000875288935	JF	On-Demand	Anodyne	FKBP1A	53	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCCc1cnn(-c2ccccc2)c1	ZINC000875288935	JF	On-Demand	Anodyne	PREP	70	39
CCOc1cc(CNC(=O)N(CC)OCC)ccc1OC	ZINC000875288955	CF	On-Demand	Anodyne	PDE6A	40	31
CCOc1cc(CNC(=O)N(CC)OCC)ccc1OC	ZINC000875288955	CF	On-Demand	Anodyne	MT-ND1	26	45
CCOc1cc(CNC(=O)N(CC)OCC)ccc1OC	ZINC000875288955	CF	On-Demand	Anodyne	DRTS_TRYCR	50	36
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCCN(C=O)CC2)c1	ZINC000875288956	ED	On-Demand	Mild	PDS	48	38
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCCN(C=O)CC2)c1	ZINC000875288957	ED	On-Demand	Mild	PDS	48	38
O=C(OCc1csc(-c2cccs2)n1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288969	HJ	On-Demand	Anodyne	FKBP1A	52	41
O=C(OCc1csc(-c2cccs2)n1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288970	HJ	On-Demand	Anodyne	FKBP1A	52	41
O=C(OCCCOc1ccccc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288975	FH	On-Demand	Anodyne	CHRM2	16	41
O=C(OCCCOc1ccccc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288975	FH	On-Demand	Anodyne	CHRM1	23	41
O=C(OCCCOc1ccccc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288975	FH	On-Demand	Anodyne	FKBP1A	109	50
O=C(OCCCOc1ccccc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288975	FH	On-Demand	Anodyne	CHRM3	23	41
O=C(OCCCOc1ccccc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288975	FH	On-Demand	Anodyne	CPT1A	117	42
O=C(OCCCOc1ccccc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288975	FH	On-Demand	Anodyne	CPT2	50	38
O=C(OCCCOc1ccccc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288975	FH	On-Demand	Anodyne	PREP	83	39
O=C(OCCCOc1ccccc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288976	FH	On-Demand	Anodyne	CHRM2	16	41
O=C(OCCCOc1ccccc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288976	FH	On-Demand	Anodyne	CHRM1	23	41
O=C(OCCCOc1ccccc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288976	FH	On-Demand	Anodyne	FKBP1A	109	50
O=C(OCCCOc1ccccc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288976	FH	On-Demand	Anodyne	CHRM3	23	41
O=C(OCCCOc1ccccc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288976	FH	On-Demand	Anodyne	CPT1A	117	42
O=C(OCCCOc1ccccc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288976	FH	On-Demand	Anodyne	CPT2	50	38
O=C(OCCCOc1ccccc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288976	FH	On-Demand	Anodyne	PREP	83	39
COC(=O)c1sccc1NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288988	IF	On-Demand	Anodyne	FKBP1A	50	37
COC(=O)c1sccc1NC(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288988	IF	On-Demand	Anodyne	FAS	39	45
O=C(OCc1nc(-c2ccc(F)cc2)no1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288991	HH	On-Demand	Anodyne	CPT1A	64	38
O=C(OCc1nc(-c2ccc(F)cc2)no1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875288992	HH	On-Demand	Anodyne	CPT1A	64	38
COc1ccc(CN(C)C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1F	ZINC000875288993	IG	On-Demand	Anodyne	FKBP1A	82	41
COC(=O)c1sccc1NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288994	IF	On-Demand	Anodyne	FKBP1A	50	37
COC(=O)c1sccc1NC(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875288994	IF	On-Demand	Anodyne	FAS	39	45
CCOc1cc(CNC(=O)N(CCOC)C2CCOCC2)ccc1OC	ZINC000875288995	FE	On-Demand	Anodyne	SSTR5	47	37
CCOc1cc(CNC(=O)N(CCOC)C2CCOCC2)ccc1OC	ZINC000875288995	FE	On-Demand	Anodyne	REN	27	40
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000875289000	JF	On-Demand	Anodyne	NOS1	36	40
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000875289000	JF	On-Demand	Anodyne	ST14	22	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000875289001	JF	On-Demand	Anodyne	NOS1	36	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000875289001	JF	On-Demand	Anodyne	ST14	22	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875289002	JF	On-Demand	Anodyne	FKBP1A	62	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875289002	JF	On-Demand	Anodyne	PREP	56	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875289002	JF	On-Demand	Anodyne	LGMN	44	35
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875289002	JF	On-Demand	Anodyne	TMPRSS11D	58	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875289003	JF	On-Demand	Anodyne	FKBP1A	62	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875289003	JF	On-Demand	Anodyne	PREP	56	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875289003	JF	On-Demand	Anodyne	LGMN	44	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000875289003	JF	On-Demand	Anodyne	TMPRSS11D	58	35
COc1ccc(CN(C)C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1F	ZINC000875289007	IG	On-Demand	Anodyne	FKBP1A	82	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000875289010	JI	On-Demand	Anodyne	F2	41	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000875289010	JI	On-Demand	Anodyne	ACE	33	40
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000875289010	JI	On-Demand	Anodyne	FKBP1A	91	42
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000875289010	JI	On-Demand	Anodyne	MME	18	40
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000875289010	JI	On-Demand	Anodyne	CTRA_BOVIN	40	32
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000875289010	JI	On-Demand	Anodyne	TRY1_BOVIN	75	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000875289010	JI	On-Demand	Anodyne	PREP	72	42
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000875289010	JI	On-Demand	Anodyne	LGMN	48	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000875289010	JI	On-Demand	Anodyne	BRCA1	44	31
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000875289011	JI	On-Demand	Anodyne	F2	41	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000875289011	JI	On-Demand	Anodyne	ACE	33	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000875289011	JI	On-Demand	Anodyne	FKBP1A	91	42
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000875289011	JI	On-Demand	Anodyne	MME	18	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000875289011	JI	On-Demand	Anodyne	CTRA_BOVIN	40	32
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000875289011	JI	On-Demand	Anodyne	TRY1_BOVIN	75	35
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000875289011	JI	On-Demand	Anodyne	PREP	72	42
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000875289011	JI	On-Demand	Anodyne	LGMN	48	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000875289011	JI	On-Demand	Anodyne	BRCA1	44	31
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000875289012	JI	On-Demand	Anodyne	F2	41	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000875289012	JI	On-Demand	Anodyne	ACE	33	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000875289012	JI	On-Demand	Anodyne	FKBP1A	91	42
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000875289012	JI	On-Demand	Anodyne	MME	18	40
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000875289012	JI	On-Demand	Anodyne	CTRA_BOVIN	40	32
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000875289012	JI	On-Demand	Anodyne	TRY1_BOVIN	75	35
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000875289012	JI	On-Demand	Anodyne	PREP	72	42
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000875289012	JI	On-Demand	Anodyne	LGMN	48	38
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000875289012	JI	On-Demand	Anodyne	BRCA1	44	31
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000875289013	JI	On-Demand	Anodyne	F2	41	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000875289013	JI	On-Demand	Anodyne	ACE	33	40
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000875289013	JI	On-Demand	Anodyne	FKBP1A	91	42
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000875289013	JI	On-Demand	Anodyne	MME	18	40
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000875289013	JI	On-Demand	Anodyne	CTRA_BOVIN	40	32
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000875289013	JI	On-Demand	Anodyne	TRY1_BOVIN	75	35
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000875289013	JI	On-Demand	Anodyne	PREP	72	42
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000875289013	JI	On-Demand	Anodyne	LGMN	48	38
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000875289013	JI	On-Demand	Anodyne	BRCA1	44	31
O=C(OCCCCCCN1C(=O)c2ccccc2C1=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875289018	JI	On-Demand	Anodyne	FKBP1A	73	48
O=C(OCCCCCCN1C(=O)c2ccccc2C1=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875289018	JI	On-Demand	Anodyne	PREP	66	36
O=C(OCCCCCCN1C(=O)c2ccccc2C1=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875289020	JI	On-Demand	Anodyne	FKBP1A	73	48
O=C(OCCCCCCN1C(=O)c2ccccc2C1=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875289020	JI	On-Demand	Anodyne	PREP	66	36
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000875289023	GG	On-Demand	Anodyne	TRPV1	19	41
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000875289023	GG	On-Demand	Anodyne	PRNP	51	37
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000875289025	GG	On-Demand	Anodyne	TRPV1	19	41
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000875289025	GG	On-Demand	Anodyne	PRNP	51	37
Cc1ccc(OCc2nc(COC(=O)[C@@H]3CCCCN3C(=O)c3cccs3)cs2)cc1	ZINC000875289038	JJ	On-Demand	Anodyne	FKBP1A	41	36
Cc1ccc(OCc2nc(COC(=O)[C@@H]3CCCCN3C(=O)c3cccs3)cs2)cc1	ZINC000875289038	JJ	On-Demand	Anodyne	CPT1A	42	37
Cc1ccc(OCc2nc(COC(=O)[C@H]3CCCCN3C(=O)c3cccs3)cs2)cc1	ZINC000875289039	JJ	On-Demand	Anodyne	FKBP1A	41	36
Cc1ccc(OCc2nc(COC(=O)[C@H]3CCCCN3C(=O)c3cccs3)cs2)cc1	ZINC000875289039	JJ	On-Demand	Anodyne	CPT1A	42	37
N#Cc1c(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cn2ccccc12	ZINC000875289045	GH	On-Demand	Mild	PREP	45	35
N#Cc1c(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cn2ccccc12	ZINC000875289046	GH	On-Demand	Mild	PREP	45	35
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000875289049	FD	On-Demand	Mild	NQO2	22	42
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000875289049	FD	On-Demand	Mild	HTR6	26	42
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000875289049	FD	On-Demand	Mild	MTNR1A	20	43
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000875289049	FD	On-Demand	Mild	EBP	15	43
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000875289050	FD	On-Demand	Mild	NQO2	22	42
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000875289050	FD	On-Demand	Mild	HTR6	26	42
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000875289050	FD	On-Demand	Mild	MTNR1A	20	43
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000875289050	FD	On-Demand	Mild	EBP	15	43
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000875289051	FD	On-Demand	Mild	NQO2	22	42
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000875289051	FD	On-Demand	Mild	HTR6	26	42
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000875289051	FD	On-Demand	Mild	MTNR1A	20	43
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000875289051	FD	On-Demand	Mild	EBP	15	43
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000875289052	FD	On-Demand	Mild	NQO2	22	42
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000875289052	FD	On-Demand	Mild	HTR6	26	42
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000875289052	FD	On-Demand	Mild	MTNR1A	20	43
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000875289052	FD	On-Demand	Mild	EBP	15	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cc(OC)c(OC)cc1F	ZINC000875289055	GF	On-Demand	Anodyne	SLC6A4	21	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cc(OC)c(OC)cc1F	ZINC000875289055	GF	On-Demand	Anodyne	SLC6A3	40	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cc(OC)c(OC)cc1F	ZINC000875289056	GF	On-Demand	Anodyne	SLC6A4	21	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cc(OC)c(OC)cc1F	ZINC000875289056	GF	On-Demand	Anodyne	SLC6A3	40	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cc(OC)c(OC)cc1F	ZINC000875289057	GF	On-Demand	Anodyne	SLC6A4	21	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cc(OC)c(OC)cc1F	ZINC000875289057	GF	On-Demand	Anodyne	SLC6A3	40	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cc(OC)c(OC)cc1F	ZINC000875289058	GF	On-Demand	Anodyne	SLC6A4	21	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cc(OC)c(OC)cc1F	ZINC000875289058	GF	On-Demand	Anodyne	SLC6A3	40	45
COc1cc(C)ccc1C(=O)COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875289059	HG	On-Demand	Anodyne	FKBP1A	88	41
COc1cc(C)ccc1C(=O)COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875289060	HG	On-Demand	Anodyne	FKBP1A	88	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCc1ccccc1Cn1cccn1	ZINC000875289070	JF	On-Demand	Anodyne	FKBP1A	47	36
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCc1ccccc1Cn1cccn1	ZINC000875289071	JF	On-Demand	Anodyne	FKBP1A	47	36
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCC1CC1	ZINC000875289080	FD	On-Demand	Anodyne	FKBP1A	66	41
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)NCC1CC1	ZINC000875289080	FD	On-Demand	Anodyne	PREP	63	36
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCC1CC1	ZINC000875289081	FD	On-Demand	Anodyne	FKBP1A	66	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)NCC1CC1	ZINC000875289081	FD	On-Demand	Anodyne	PREP	63	36
O=C(COC(=O)[C@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1N1CCCC1=O	ZINC000875289084	JG	On-Demand	Anodyne	FKBP1A	38	41
O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)Nc1ccccc1N1CCCC1=O	ZINC000875289085	JG	On-Demand	Anodyne	FKBP1A	38	41
N#Cc1ccccc1-c1ccc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875289095	IK	On-Demand	Mild	FKBP1A	56	42
N#Cc1ccccc1-c1ccc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875289095	IK	On-Demand	Mild	PREP	69	38
N#Cc1ccccc1-c1ccc(COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875289095	IK	On-Demand	Mild	LGMN	76	39
N#Cc1ccccc1-c1ccc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875289096	IK	On-Demand	Mild	FKBP1A	56	42
N#Cc1ccccc1-c1ccc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875289096	IK	On-Demand	Mild	PREP	69	38
N#Cc1ccccc1-c1ccc(COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1	ZINC000875289096	IK	On-Demand	Mild	LGMN	76	39
NC(=O)CCOC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875289107	DD	On-Demand	Anodyne	FKBP1A	71	44
NC(=O)CCOC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875289107	DD	On-Demand	Anodyne	PREP	70	37
NC(=O)CCOC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875289108	DD	On-Demand	Anodyne	FKBP1A	71	44
NC(=O)CCOC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875289108	DD	On-Demand	Anodyne	PREP	70	37
Cc1oc(-c2ccccc2)nc1COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875289109	HI	On-Demand	Anodyne	FKBP1A	50	41
Cc1oc(-c2ccccc2)nc1COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875289109	HI	On-Demand	Anodyne	PPARG	79	44
Cc1oc(-c2ccccc2)nc1COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875289109	HI	On-Demand	Anodyne	PPARA	85	39
Cc1oc(-c2ccccc2)nc1COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875289109	HI	On-Demand	Anodyne	CPT1A	65	38
Cc1oc(-c2ccccc2)nc1COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875289109	HI	On-Demand	Anodyne	PREP	43	39
Cc1oc(-c2ccccc2)nc1COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875289109	HI	On-Demand	Anodyne	PDE8B	66	39
Cc1oc(-c2ccccc2)nc1COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875289110	HI	On-Demand	Anodyne	FKBP1A	50	41
Cc1oc(-c2ccccc2)nc1COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875289110	HI	On-Demand	Anodyne	PPARG	79	44
Cc1oc(-c2ccccc2)nc1COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875289110	HI	On-Demand	Anodyne	PPARA	85	39
Cc1oc(-c2ccccc2)nc1COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875289110	HI	On-Demand	Anodyne	CPT1A	65	38
Cc1oc(-c2ccccc2)nc1COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875289110	HI	On-Demand	Anodyne	PREP	43	39
Cc1oc(-c2ccccc2)nc1COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875289110	HI	On-Demand	Anodyne	PDE8B	66	39
O=C(OCc1cc(-c2ccccc2)no1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875289120	GI	On-Demand	Anodyne	FKBP1A	54	41
O=C(OCc1cc(-c2ccccc2)no1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875289120	GI	On-Demand	Anodyne	CPT1A	107	42
O=C(OCc1cc(-c2ccccc2)no1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875289120	GI	On-Demand	Anodyne	PREP	66	46
O=C(OCc1cc(-c2ccccc2)no1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875289121	GI	On-Demand	Anodyne	FKBP1A	54	41
O=C(OCc1cc(-c2ccccc2)no1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875289121	GI	On-Demand	Anodyne	CPT1A	107	42
O=C(OCc1cc(-c2ccccc2)no1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875289121	GI	On-Demand	Anodyne	PREP	66	46
O=C(OCC(=O)N(Cc1ccccc1)c1ccccc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875289122	JJ	On-Demand	Anodyne	FKBP1A	70	41
O=C(OCC(=O)N(Cc1ccccc1)c1ccccc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875289122	JJ	On-Demand	Anodyne	CPT1A	41	35
O=C(OCC(=O)N(Cc1ccccc1)c1ccccc1)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875289122	JJ	On-Demand	Anodyne	PREP	72	38
O=C(OCC(=O)N(Cc1ccccc1)c1ccccc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875289123	JJ	On-Demand	Anodyne	FKBP1A	70	41
O=C(OCC(=O)N(Cc1ccccc1)c1ccccc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875289123	JJ	On-Demand	Anodyne	CPT1A	41	35
O=C(OCC(=O)N(Cc1ccccc1)c1ccccc1)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875289123	JJ	On-Demand	Anodyne	PREP	72	38
CC[C@H](C#N)Oc1cccc(CNC(=O)N2OC3CCC2CC3)c1	ZINC000875289132	EG	On-Demand	Mild	PDS	44	37
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2OC3CCC2CC3)c1	ZINC000875289133	EG	On-Demand	Mild	PDS	44	37
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CC(CNC(=O)C(F)(F)F)C2)c1	ZINC000875289134	GE	On-Demand	Mild	PDS	53	34
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CC(CNC(=O)C(F)(F)F)C2)c1	ZINC000875289135	GE	On-Demand	Mild	PDS	53	34
COc1ccc([C@@H]2CCCN2C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1OC	ZINC000875289145	JH	On-Demand	Anodyne	FKBP1A	81	42
COc1ccc([C@@H]2CCCN2C(=O)COC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)cc1OC	ZINC000875289145	JH	On-Demand	Anodyne	CPT1A	90	41
COc1ccc([C@@H]2CCCN2C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1OC	ZINC000875289146	JH	On-Demand	Anodyne	FKBP1A	81	42
COc1ccc([C@@H]2CCCN2C(=O)COC(=O)[C@H]2CCCCN2C(=O)c2cccs2)cc1OC	ZINC000875289146	JH	On-Demand	Anodyne	CPT1A	90	41
COC(=O)c1occc1COC(=O)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875289149	GF	On-Demand	Anodyne	FKBP1A	51	41
COC(=O)c1occc1COC(=O)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875289150	GF	On-Demand	Anodyne	FKBP1A	51	41
CCOc1cc(CNC(=O)NC[C@@H]2CCO[C@@H]2C(=O)OC)ccc1OC	ZINC000875289168	FD	On-Demand	Anodyne	SSTR5	44	39
CC[C@H](C#N)Oc1cccc(CNC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)c1	ZINC000875289180	FF	On-Demand	Mild	SLC6A3	44	39
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)c1	ZINC000875289181	FF	On-Demand	Mild	SLC6A3	44	39
CC[C@H](C#N)Oc1cccc(CNC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)c1	ZINC000875289182	FF	On-Demand	Mild	SLC6A3	44	39
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)c1	ZINC000875289183	FF	On-Demand	Mild	SLC6A3	44	39
O=C(OCc1nccn1C(F)F)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000875289186	FG	On-Demand	Anodyne	FKBP1A	43	37
O=C(OCc1nccn1C(F)F)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000875289187	FG	On-Demand	Anodyne	FKBP1A	43	37
CC[C@H](C#N)Oc1cccc(CNC(=O)N(CC)[C@H](C)[C@@H](O)c2ccccc2)c1	ZINC000875289192	GI	On-Demand	Mild	PDS	72	40
CC[C@H](C#N)Oc1cccc(CNC(=O)N(CC)[C@@H](C)[C@@H](O)c2ccccc2)c1	ZINC000875289193	GI	On-Demand	Mild	PDS	72	40
CC[C@H](C#N)Oc1cccc(CNC(=O)N(CC)[C@@H](C)[C@H](O)c2ccccc2)c1	ZINC000875289194	GI	On-Demand	Mild	PDS	72	40
CC[C@H](C#N)Oc1cccc(CNC(=O)N(CC)[C@H](C)[C@H](O)c2ccccc2)c1	ZINC000875289195	GI	On-Demand	Mild	PDS	72	40
COc1cccc([C@H](CNC(=O)NCc2cc(OC)ccc2O)OC)c1	ZINC000875289199	FF	On-Demand	Clean	MTNR1A	56	43
COc1cccc([C@H](CNC(=O)NCc2cc(OC)ccc2O)OC)c1	ZINC000875289199	FF	On-Demand	Clean	MTNR1B	54	43
C[C@@H](NC(=O)NCCOc1cccnc1)[C@@H](O)C(F)(F)F	ZINC000875289201	DD	On-Demand	Anodyne	PTAFR	15	40
C[C@@H](NC(=O)NCCOc1cccnc1)[C@H](O)C(F)(F)F	ZINC000875289202	DD	On-Demand	Anodyne	PTAFR	15	40
C[C@@]1(Br)C[C@@H]1C(=O)Nc1nc(O)c2ccccc2n1	ZINC000875289205	DE	On-Demand	Anodyne	TNKS	45	31
C[C@@]1(Br)C[C@H]1C(=O)Nc1nc(O)c2ccccc2n1	ZINC000875289206	DE	On-Demand	Anodyne	TNKS	45	31
COc1ccc(O)c(CNC(=O)NCC[C@@H]2CCSC2)c1	ZINC000875289218	DE	On-Demand	Clean	MTNR1A	38	43
COc1ccc(O)c(CNC(=O)NCC[C@@H]2CCSC2)c1	ZINC000875289218	DE	On-Demand	Clean	MTNR1B	25	43
COc1ccc(O)c(CNC(=O)NCC[C@H]2CCSC2)c1	ZINC000875289219	DE	On-Demand	Clean	MTNR1A	38	43
COc1ccc(O)c(CNC(=O)NCC[C@H]2CCSC2)c1	ZINC000875289219	DE	On-Demand	Clean	MTNR1B	25	43
COc1ccc(O)c(CNC(=O)N[C@H](C)[C@@]23CCCC[C@@H]2C3)c1	ZINC000875289220	DG	On-Demand	Clean	MTNR1A	35	40
COc1ccc(O)c(CNC(=O)N[C@H](C)[C@@]23CCCC[C@@H]2C3)c1	ZINC000875289220	DG	On-Demand	Clean	MTNR1B	27	40
COc1ccc(O)c(CNC(=O)N[C@H](C)[C@@]23CCCC[C@H]2C3)c1	ZINC000875289221	DG	On-Demand	Clean	MTNR1A	35	40
COc1ccc(O)c(CNC(=O)N[C@H](C)[C@@]23CCCC[C@H]2C3)c1	ZINC000875289221	DG	On-Demand	Clean	MTNR1B	27	40
COc1ccc(O)c(CNC(=O)N[C@H](C)[C@]23CCCC[C@@H]2C3)c1	ZINC000875289222	DG	On-Demand	Clean	MTNR1A	35	40
COc1ccc(O)c(CNC(=O)N[C@H](C)[C@]23CCCC[C@@H]2C3)c1	ZINC000875289222	DG	On-Demand	Clean	MTNR1B	27	40
COc1ccc(O)c(CNC(=O)N[C@H](C)[C@]23CCCC[C@H]2C3)c1	ZINC000875289223	DG	On-Demand	Clean	MTNR1A	35	40
COc1ccc(O)c(CNC(=O)N[C@H](C)[C@]23CCCC[C@H]2C3)c1	ZINC000875289223	DG	On-Demand	Clean	MTNR1B	27	40
O=C(Nc1nc(O)c2ccccc2n1)[C@]12CCCC[C@@H]1C2	ZINC000875289226	CF	On-Demand	Anodyne	TNKS	45	31
O=C(Nc1nc(O)c2ccccc2n1)[C@@]12CCCC[C@H]1C2	ZINC000875289227	CF	On-Demand	Anodyne	TNKS	45	31
O=C(Nc1nc(O)c2ccccc2n1)[C@]12CCCC[C@H]1C2	ZINC000875289228	CF	On-Demand	Anodyne	TNKS	45	31
O=C(Nc1nc(O)c2ccccc2n1)[C@@]12CCCC[C@@H]1C2	ZINC000875289229	CF	On-Demand	Anodyne	TNKS	45	31
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(OC)c(OCC)c2)C1	ZINC000875289235	FE	On-Demand	Anodyne	SSTR5	45	36
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289237	GD	On-Demand	Anodyne	HTR1A	76	45
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289237	GD	On-Demand	Anodyne	DRD2	72	47
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289237	GD	On-Demand	Anodyne	DRD4	46	42
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289237	GD	On-Demand	Anodyne	ADRA1D	72	40
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289237	GD	On-Demand	Anodyne	ADRA1A	65	40
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289237	GD	On-Demand	Anodyne	ADRA1B	53	38
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289237	GD	On-Demand	Anodyne	DRD3	79	43
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289237	GD	On-Demand	Anodyne	HTR7	51	38
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289238	GD	On-Demand	Anodyne	HTR1A	76	45
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289238	GD	On-Demand	Anodyne	DRD2	72	47
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289238	GD	On-Demand	Anodyne	DRD4	46	42
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289238	GD	On-Demand	Anodyne	ADRA1D	72	40
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289238	GD	On-Demand	Anodyne	ADRA1A	65	40
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289238	GD	On-Demand	Anodyne	ADRA1B	53	38
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289238	GD	On-Demand	Anodyne	DRD3	79	43
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289238	GD	On-Demand	Anodyne	HTR7	51	38
O=C(CCCOC1CCOCC1)Nc1nc(O)c2ccccc2n1	ZINC000875289245	EE	On-Demand	Anodyne	TNKS	66	38
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)C1	ZINC000875289251	FD	On-Demand	Anodyne	HTR1A	51	45
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)C1	ZINC000875289251	FD	On-Demand	Anodyne	DRD2	44	45
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)C1	ZINC000875289251	FD	On-Demand	Anodyne	ADRA1D	49	42
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)C1	ZINC000875289251	FD	On-Demand	Anodyne	ADRA1A	41	42
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)C1	ZINC000875289251	FD	On-Demand	Anodyne	ADRA1B	38	42
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)C1	ZINC000875289251	FD	On-Demand	Anodyne	DRD3	50	38
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)C1	ZINC000875289252	FD	On-Demand	Anodyne	HTR1A	51	45
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)C1	ZINC000875289252	FD	On-Demand	Anodyne	DRD2	44	45
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)C1	ZINC000875289252	FD	On-Demand	Anodyne	ADRA1D	49	42
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)C1	ZINC000875289252	FD	On-Demand	Anodyne	ADRA1A	41	42
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)C1	ZINC000875289252	FD	On-Demand	Anodyne	ADRA1B	38	42
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)C1	ZINC000875289252	FD	On-Demand	Anodyne	DRD3	50	38
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)C1	ZINC000875289253	FD	On-Demand	Anodyne	HTR1A	51	45
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)C1	ZINC000875289253	FD	On-Demand	Anodyne	DRD2	44	45
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)C1	ZINC000875289253	FD	On-Demand	Anodyne	ADRA1D	49	42
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)C1	ZINC000875289253	FD	On-Demand	Anodyne	ADRA1A	41	42
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)C1	ZINC000875289253	FD	On-Demand	Anodyne	ADRA1B	38	42
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)C1	ZINC000875289253	FD	On-Demand	Anodyne	DRD3	50	38
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)C1	ZINC000875289254	FD	On-Demand	Anodyne	HTR1A	51	45
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)C1	ZINC000875289254	FD	On-Demand	Anodyne	DRD2	44	45
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)C1	ZINC000875289254	FD	On-Demand	Anodyne	ADRA1D	49	42
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)C1	ZINC000875289254	FD	On-Demand	Anodyne	ADRA1A	41	42
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)C1	ZINC000875289254	FD	On-Demand	Anodyne	ADRA1B	38	42
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)C1	ZINC000875289254	FD	On-Demand	Anodyne	DRD3	50	38
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCC23CCOCC3)c1	ZINC000875289255	EE	On-Demand	Clean	MTNR1A	34	41
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCC23CCOCC3)c1	ZINC000875289255	EE	On-Demand	Clean	MTNR1B	25	41
COc1ccc(O)c(CNC(=O)NC[C@H]2CCC23CCOCC3)c1	ZINC000875289256	EE	On-Demand	Clean	MTNR1A	34	41
COc1ccc(O)c(CNC(=O)NC[C@H]2CCC23CCOCC3)c1	ZINC000875289256	EE	On-Demand	Clean	MTNR1B	25	41
COc1cc(C)ccc1CNC(=O)C(=O)N[C@H](C)c1ccc(C(F)(F)F)nc1	ZINC000875289261	GF	On-Demand	Anodyne	TRPV1	90	35
COc1cc(C)ccc1CNC(=O)C(=O)N[C@@H](C)c1ccc(C(F)(F)F)nc1	ZINC000875289262	GF	On-Demand	Anodyne	TRPV1	90	35
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@H]3[C@H](CCN3C)C2)C1	ZINC000875289263	GC	On-Demand	Anodyne	HTR1A	57	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@H]3[C@H](CCN3C)C2)C1	ZINC000875289263	GC	On-Demand	Anodyne	DRD2	48	43
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@H]3[C@H](CCN3C)C2)C1	ZINC000875289263	GC	On-Demand	Anodyne	DRD4	26	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@H]3[C@H](CCN3C)C2)C1	ZINC000875289263	GC	On-Demand	Anodyne	ADRA1D	46	36
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@H]3[C@H](CCN3C)C2)C1	ZINC000875289263	GC	On-Demand	Anodyne	DRD3	57	43
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@@H]3[C@H](CCN3C)C2)C1	ZINC000875289264	GC	On-Demand	Anodyne	HTR1A	57	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@@H]3[C@H](CCN3C)C2)C1	ZINC000875289264	GC	On-Demand	Anodyne	DRD2	48	43
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@@H]3[C@H](CCN3C)C2)C1	ZINC000875289264	GC	On-Demand	Anodyne	DRD4	26	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@@H]3[C@H](CCN3C)C2)C1	ZINC000875289264	GC	On-Demand	Anodyne	ADRA1D	46	36
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@@H]3[C@H](CCN3C)C2)C1	ZINC000875289264	GC	On-Demand	Anodyne	DRD3	57	43
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@H]3[C@@H](CCN3C)C2)C1	ZINC000875289265	GC	On-Demand	Anodyne	HTR1A	57	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@H]3[C@@H](CCN3C)C2)C1	ZINC000875289265	GC	On-Demand	Anodyne	DRD2	48	43
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@H]3[C@@H](CCN3C)C2)C1	ZINC000875289265	GC	On-Demand	Anodyne	DRD4	26	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@H]3[C@@H](CCN3C)C2)C1	ZINC000875289265	GC	On-Demand	Anodyne	ADRA1D	46	36
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@H]3[C@@H](CCN3C)C2)C1	ZINC000875289265	GC	On-Demand	Anodyne	DRD3	57	43
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@@H]3[C@@H](CCN3C)C2)C1	ZINC000875289266	GC	On-Demand	Anodyne	HTR1A	57	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@@H]3[C@@H](CCN3C)C2)C1	ZINC000875289266	GC	On-Demand	Anodyne	DRD2	48	43
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@@H]3[C@@H](CCN3C)C2)C1	ZINC000875289266	GC	On-Demand	Anodyne	DRD4	26	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@@H]3[C@@H](CCN3C)C2)C1	ZINC000875289266	GC	On-Demand	Anodyne	ADRA1D	46	36
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@@H]3[C@@H](CCN3C)C2)C1	ZINC000875289266	GC	On-Demand	Anodyne	DRD3	57	43
Cn1nc(Cl)c(C(=O)Nc2c(F)cccc2N2CCCC2)c1Cl	ZINC000875289269	FH	On-Demand	Anodyne	CNR1	40	30
Cn1nc(Cl)c(C(=O)Nc2c(F)cccc2N2CCCC2)c1Cl	ZINC000875289269	FH	On-Demand	Anodyne	KCNQ2	68	37
COc1ccc(O)c(CNC(=O)NCc2ccc(C3(C)OCCO3)cc2)c1	ZINC000875289271	FF	On-Demand	Clean	MTNR1A	41	45
COc1ccc(O)c(CNC(=O)NCc2ccc(C3(C)OCCO3)cc2)c1	ZINC000875289271	FF	On-Demand	Clean	MTNR1B	29	45
CC(=O)NC[C@@H]1CCCCN1C(=O)NCCOc1cccnc1	ZINC000875289273	DD	On-Demand	Anodyne	FKBP1A	27	42
CC(=O)NC[C@@H]1CCCCN1C(=O)NCCOc1cccnc1	ZINC000875289273	DD	On-Demand	Anodyne	CHRNA7	26	41
CC(=O)NC[C@@H]1CCCCN1C(=O)NCCOc1cccnc1	ZINC000875289273	DD	On-Demand	Anodyne	CPT1A	64	37
COc1ccc(O)c(CNC(=O)NC[C@@H]2CC[C@H]3C[C@@H]3C2)c1	ZINC000875289275	DF	On-Demand	Clean	MTNR1A	36	42
COc1ccc(O)c(CNC(=O)NC[C@@H]2CC[C@H]3C[C@@H]3C2)c1	ZINC000875289275	DF	On-Demand	Clean	MTNR1B	26	42
COc1ccc(O)c(CNC(=O)NC[C@@H]2CC[C@H]3C[C@H]3C2)c1	ZINC000875289276	DF	On-Demand	Clean	MTNR1A	36	42
COc1ccc(O)c(CNC(=O)NC[C@@H]2CC[C@H]3C[C@H]3C2)c1	ZINC000875289276	DF	On-Demand	Clean	MTNR1B	26	42
COc1ccc(O)c(CNC(=O)NC[C@@H]2CC[C@@H]3C[C@H]3C2)c1	ZINC000875289277	DF	On-Demand	Clean	MTNR1A	36	42
COc1ccc(O)c(CNC(=O)NC[C@@H]2CC[C@@H]3C[C@H]3C2)c1	ZINC000875289277	DF	On-Demand	Clean	MTNR1B	26	42
COc1ccc(O)c(CNC(=O)NC[C@@H]2CC[C@@H]3C[C@@H]3C2)c1	ZINC000875289278	DF	On-Demand	Clean	MTNR1A	36	42
COc1ccc(O)c(CNC(=O)NC[C@@H]2CC[C@@H]3C[C@@H]3C2)c1	ZINC000875289278	DF	On-Demand	Clean	MTNR1B	26	42
CCC[C@H](CC)C(=O)Nc1nc(O)c2ccccc2n1	ZINC000875289283	CG	On-Demand	Anodyne	TACR3	47	38
CCC[C@@H](CC)C(=O)Nc1nc(O)c2ccccc2n1	ZINC000875289284	CG	On-Demand	Anodyne	TACR3	47	38
CCOc1cc(CNC(=O)NCCN2CCOC[C@@H]2CC)ccc1OC	ZINC000875289287	FE	On-Demand	Anodyne	SSTR5	57	37
CCOc1cc(CNC(=O)NCCN2CCOC[C@H]2CC)ccc1OC	ZINC000875289288	FE	On-Demand	Anodyne	SSTR5	57	37
COc1ccc(O)c(CNC(=O)NC[C@H]2CCCC23CC3)c1	ZINC000875289289	DF	On-Demand	Clean	MTNR1A	44	44
COc1ccc(O)c(CNC(=O)NC[C@H]2CCCC23CC3)c1	ZINC000875289289	DF	On-Demand	Clean	MTNR1B	31	44
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCCC23CC3)c1	ZINC000875289290	DF	On-Demand	Clean	MTNR1A	44	44
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCCC23CC3)c1	ZINC000875289290	DF	On-Demand	Clean	MTNR1B	31	44
CCOc1cc(CNC(=O)N2CC[C@]3(C(=O)OC)CCC[C@H]23)ccc1OC	ZINC000875289297	GF	On-Demand	Anodyne	SSTR5	58	37
CCOc1cc(CNC(=O)N2CC[C@]3(C(=O)OC)CCC[C@H]23)ccc1OC	ZINC000875289297	GF	On-Demand	Anodyne	HCN4	40	31
COc1ccc(O)c(CNC(=O)NC2CN(c3ccncn3)C2)c1	ZINC000875289300	EC	On-Demand	Clean	MTNR1A	17	40
COc1ccc(O)c(CNC(=O)NC2CN(c3ccncn3)C2)c1	ZINC000875289300	EC	On-Demand	Clean	MTNR1B	17	40
COc1ccc(O)c(CNC(=O)NCc2ccsc2C(F)(F)F)c1	ZINC000875289305	FG	On-Demand	Clean	MTNR1A	34	44
COc1ccc(O)c(CNC(=O)NCc2ccsc2C(F)(F)F)c1	ZINC000875289305	FG	On-Demand	Clean	MTNR1B	22	44
O=C(Cc1csc(C2CC2)n1)Nc1nc(O)c2ccccc2n1	ZINC000875289309	EF	On-Demand	Anodyne	TNKS	60	35
COc1ccc(O)c(CNC(=O)N[C@H](C)c2ccns2)c1	ZINC000875289314	DE	On-Demand	Clean	MTNR1A	29	42
COc1ccc(O)c(CNC(=O)N[C@H](C)c2ccns2)c1	ZINC000875289314	DE	On-Demand	Clean	MTNR1B	26	42
COc1ccc(O)c(CNC(=O)N[C@@H](C)c2ccns2)c1	ZINC000875289315	DE	On-Demand	Clean	MTNR1A	29	42
COc1ccc(O)c(CNC(=O)N[C@@H](C)c2ccns2)c1	ZINC000875289315	DE	On-Demand	Clean	MTNR1B	26	42
O=C(NCCOc1cccnc1)N[C@@H]1C[C@H](CO)C1	ZINC000875289316	CC	On-Demand	Anodyne	HRH2	15	40
COc1ccc(O)c(CNC(=O)N[C@@H]2[C@H](C)O[C@H](C)[C@@H]2C)c1	ZINC000875289328	DE	On-Demand	Clean	MTNR1A	36	44
COc1ccc(O)c(CNC(=O)N[C@@H]2[C@H](C)O[C@H](C)[C@@H]2C)c1	ZINC000875289328	DE	On-Demand	Clean	MTNR1B	23	44
COc1ccc(O)c(CNC(=O)N[C@@H]2[C@H](C)O[C@@H](C)[C@H]2C)c1	ZINC000875289329	DE	On-Demand	Clean	MTNR1A	36	44
COc1ccc(O)c(CNC(=O)N[C@@H]2[C@H](C)O[C@@H](C)[C@H]2C)c1	ZINC000875289329	DE	On-Demand	Clean	MTNR1B	23	44
COc1ccc(O)c(CNC(=O)N[C@@H]2[C@H](C)O[C@H](C)[C@H]2C)c1	ZINC000875289330	DE	On-Demand	Clean	MTNR1A	36	44
COc1ccc(O)c(CNC(=O)N[C@@H]2[C@H](C)O[C@H](C)[C@H]2C)c1	ZINC000875289330	DE	On-Demand	Clean	MTNR1B	23	44
COc1ccc(O)c(CNC(=O)N[C@@H]2[C@H](C)O[C@@H](C)[C@@H]2C)c1	ZINC000875289331	DE	On-Demand	Clean	MTNR1A	36	44
COc1ccc(O)c(CNC(=O)N[C@@H]2[C@H](C)O[C@@H](C)[C@@H]2C)c1	ZINC000875289331	DE	On-Demand	Clean	MTNR1B	23	44
COc1ccc(O)c(CNC(=O)NCC(C)(C)C(=O)N2CCCC2)c1	ZINC000875289339	ED	On-Demand	Clean	MTNR1A	39	42
COc1ccc(O)c(CNC(=O)NCC(C)(C)C(=O)N2CCCC2)c1	ZINC000875289339	ED	On-Demand	Clean	MTNR1B	33	42
COc1ccc(O)c(CNC(=O)NCCn2ccc(C(F)(F)F)n2)c1	ZINC000875289345	FE	On-Demand	Clean	MTNR1A	20	41
COc1ccc(O)c(CNC(=O)NCCn2ccc(C(F)(F)F)n2)c1	ZINC000875289345	FE	On-Demand	Clean	MTNR1B	15	41
COc1ccc(O)c(CNC(=O)NCCC[C@@H]2C=CCC2)c1	ZINC000875289346	DF	On-Demand	Clean	MTNR1A	39	47
COc1ccc(O)c(CNC(=O)NCCC[C@@H]2C=CCC2)c1	ZINC000875289346	DF	On-Demand	Clean	MTNR1B	28	47
COc1ccc(O)c(CNC(=O)NCCC[C@H]2C=CCC2)c1	ZINC000875289347	DF	On-Demand	Clean	MTNR1A	39	47
COc1ccc(O)c(CNC(=O)NCCC[C@H]2C=CCC2)c1	ZINC000875289347	DF	On-Demand	Clean	MTNR1B	28	47
COc1ccc(O)c(CNC(=O)N[C@H]2CO[C@H](C3CC3)C2)c1	ZINC000875289357	DD	On-Demand	Clean	MTNR1A	31	40
COc1ccc(O)c(CNC(=O)N[C@H]2CO[C@H](C3CC3)C2)c1	ZINC000875289357	DD	On-Demand	Clean	MTNR1B	21	40
COc1ccc(O)c(CNC(=O)N[C@H]2CO[C@@H](C3CC3)C2)c1	ZINC000875289358	DD	On-Demand	Clean	MTNR1A	31	40
COc1ccc(O)c(CNC(=O)N[C@H]2CO[C@@H](C3CC3)C2)c1	ZINC000875289358	DD	On-Demand	Clean	MTNR1B	21	40
COc1ccc(O)c(CNC(=O)N[C@@H]2CO[C@@H](C3CC3)C2)c1	ZINC000875289359	DD	On-Demand	Clean	MTNR1A	31	40
COc1ccc(O)c(CNC(=O)N[C@@H]2CO[C@@H](C3CC3)C2)c1	ZINC000875289359	DD	On-Demand	Clean	MTNR1B	21	40
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@@H](OC)C2)c1	ZINC000875289364	CD	On-Demand	Clean	MTNR1A	69	48
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@@H](OC)C2)c1	ZINC000875289364	CD	On-Demand	Clean	MTNR1B	57	48
COc1ccc(O)c(CNC(=O)NC[C@@H]2Cc3ccccc3CO2)c1	ZINC000875289365	EE	On-Demand	Clean	MTNR1A	45	41
COc1ccc(O)c(CNC(=O)NC[C@@H]2Cc3ccccc3CO2)c1	ZINC000875289365	EE	On-Demand	Clean	MTNR1B	34	41
COc1ccc(O)c(CNC(=O)NCc2c(Br)cnn2C)c1	ZINC000875289372	FD	On-Demand	Clean	HTR2A	18	42
COc1ccc(O)c(CNC(=O)NCc2c(Br)cnn2C)c1	ZINC000875289372	FD	On-Demand	Clean	MTNR1A	31	42
COc1ccc(O)c(CNC(=O)NCc2c(Br)cnn2C)c1	ZINC000875289372	FD	On-Demand	Clean	MTNR1B	27	42
COc1ccc(O)c(CNC(=O)NCc2ccc(N(C)C(C)=O)cc2)c1	ZINC000875289376	FE	On-Demand	Clean	MTNR1A	47	46
COc1ccc(O)c(CNC(=O)NCc2ccc(N(C)C(C)=O)cc2)c1	ZINC000875289376	FE	On-Demand	Clean	MTNR1B	36	46
COc1ccc(O)c(CNC(=O)NCc2ccc(N(C)C(C)=O)cc2)c1	ZINC000875289376	FE	On-Demand	Clean	CA9	15	40
O=C(NCCOc1cccnc1)N1CC(c2ccccc2)C1	ZINC000875289377	CE	On-Demand	Anodyne	PTAFR	29	41
O=C(NCCOc1cccnc1)N1CC(c2ccccc2)C1	ZINC000875289377	CE	On-Demand	Anodyne	CHRNA7	22	43
O=C(NCCOc1cccnc1)N1CC(c2ccccc2)C1	ZINC000875289377	CE	On-Demand	Anodyne	NAMPT	35	40
O=C(NCCOc1cccnc1)NC1CN(c2ccncn2)C1	ZINC000875289381	DC	On-Demand	Anodyne	HRH2	21	41
COc1ccc(O)c(CNC(=O)NC[C@@H]2CN(Cc3ccncc3)CCO2)c1	ZINC000875289387	GD	On-Demand	Clean	DRD4	19	42
COc1ccc(O)c(CNC(=O)NC[C@@H]2CN(Cc3ccncc3)CCO2)c1	ZINC000875289387	GD	On-Demand	Clean	PDK1	41	40
COc1ccc(O)c(CNC(=O)NC[C@H]2CN(Cc3ccncc3)CCO2)c1	ZINC000875289388	GD	On-Demand	Clean	DRD4	19	42
COc1ccc(O)c(CNC(=O)NC[C@H]2CN(Cc3ccncc3)CCO2)c1	ZINC000875289388	GD	On-Demand	Clean	PDK1	41	40
COc1ccc(O)c(CNC(=O)NCc2csc(C)c2C)c1	ZINC000875289405	DG	On-Demand	Clean	MTNR1A	45	46
COc1ccc(O)c(CNC(=O)NCc2csc(C)c2C)c1	ZINC000875289405	DG	On-Demand	Clean	MTNR1B	31	46
COc1ccc(O)c(CNC(=O)N[C@H]2CCCC23CC3)c1	ZINC000875289406	CF	On-Demand	Clean	MTNR1A	45	44
COc1ccc(O)c(CNC(=O)N[C@H]2CCCC23CC3)c1	ZINC000875289406	CF	On-Demand	Clean	MTNR1B	32	44
COc1ccc(O)c(CNC(=O)N[C@@H]2CCCC23CC3)c1	ZINC000875289407	CF	On-Demand	Clean	MTNR1A	45	44
COc1ccc(O)c(CNC(=O)N[C@@H]2CCCC23CC3)c1	ZINC000875289407	CF	On-Demand	Clean	MTNR1B	32	44
C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCCN2C(=O)NCCOc2cccnc2)C1	ZINC000875289408	FF	On-Demand	Anodyne	FKBP1A	24	41
C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCCN2C(=O)NCCOc2cccnc2)C1	ZINC000875289409	FF	On-Demand	Anodyne	FKBP1A	24	41
C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCCN2C(=O)NCCOc2cccnc2)C1	ZINC000875289410	FF	On-Demand	Anodyne	FKBP1A	24	41
C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCCN2C(=O)NCCOc2cccnc2)C1	ZINC000875289411	FF	On-Demand	Anodyne	FKBP1A	24	41
COc1ccc(O)c(CNC(=O)NC2CCC(C)(N(C)C)CC2)c1	ZINC000875289412	EE	On-Demand	Clean	MTNR1A	40	42
COc1ccc(O)c(CNC(=O)NC2CCC(C)(N(C)C)CC2)c1	ZINC000875289412	EE	On-Demand	Clean	MTNR1B	32	42
COc1ccc(O)c(CNC(=O)N[C@H](C)c2cnc(C)s2)c1	ZINC000875289414	DF	On-Demand	Clean	MTNR1A	24	40
COc1ccc(O)c(CNC(=O)N[C@H](C)c2cnc(C)s2)c1	ZINC000875289414	DF	On-Demand	Clean	MTNR1B	23	40
COc1ccc(O)c(CNC(=O)N[C@@H](C)c2cnc(C)s2)c1	ZINC000875289415	DF	On-Demand	Clean	MTNR1A	24	40
COc1ccc(O)c(CNC(=O)N[C@@H](C)c2cnc(C)s2)c1	ZINC000875289415	DF	On-Demand	Clean	MTNR1B	23	40
COc1ccc(O)c(CNC(=O)NCc2ccc(C(C)(C)C)o2)c1	ZINC000875289420	EG	On-Demand	Clean	MTNR1A	37	44
COc1ccc(O)c(CNC(=O)NCc2ccc(C(C)(C)C)o2)c1	ZINC000875289420	EG	On-Demand	Clean	MTNR1B	26	44
COc1ccc(O)c(CNC(=O)NC2CCN(c3ccccc3C#N)CC2)c1	ZINC000875289421	GF	On-Demand	Mild	DRD2	28	43
COc1ccc(O)c(CNC(=O)NC2CCN(c3ccccc3C#N)CC2)c1	ZINC000875289421	GF	On-Demand	Mild	DRD4	45	37
COc1ccc(O)c(CNC(=O)NC2CCN(c3ccccc3C#N)CC2)c1	ZINC000875289421	GF	On-Demand	Mild	ADRA1D	23	43
COc1ccc(O)c(CNC(=O)NC2CCN(c3ccccc3C#N)CC2)c1	ZINC000875289421	GF	On-Demand	Mild	ADRA1A	19	43
COc1ccc(O)c(CNC(=O)NC2CCN(c3ccccc3C#N)CC2)c1	ZINC000875289421	GF	On-Demand	Mild	ADRA1B	16	43
COc1ccc(O)c(CNC(=O)NC2CCN(c3ccccc3C#N)CC2)c1	ZINC000875289421	GF	On-Demand	Mild	NPY1R	19	41
C[C@H]1CCc2ccccc2[C@@H]1NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875289423	GD	On-Demand	Anodyne	L3MBTL3	65	40
C[C@H]1CCc2ccccc2[C@H]1NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875289425	GD	On-Demand	Anodyne	L3MBTL3	65	40
COC(=O)N(C)NC(=O)NCCOc1cccnc1	ZINC000875289430	CC	On-Demand	Reactive	MTNR1A	15	40
COc1ccc(O)c(CNC(=O)NCc2nn(C)cc2C(F)F)c1	ZINC000875289431	EE	On-Demand	Clean	MTNR1A	24	41
COc1ccc(O)c(CNC(=O)NCc2nn(C)cc2C(F)F)c1	ZINC000875289431	EE	On-Demand	Clean	MTNR1B	20	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC[C@@H]2CCSC2)C1	ZINC000875289434	GD	On-Demand	Anodyne	HTR1A	71	43
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC[C@@H]2CCSC2)C1	ZINC000875289434	GD	On-Demand	Anodyne	DRD2	62	46
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC[C@@H]2CCSC2)C1	ZINC000875289434	GD	On-Demand	Anodyne	DRD4	36	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC[C@@H]2CCSC2)C1	ZINC000875289434	GD	On-Demand	Anodyne	ADRA1D	68	38
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC[C@@H]2CCSC2)C1	ZINC000875289434	GD	On-Demand	Anodyne	ADRA1A	60	38
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC[C@@H]2CCSC2)C1	ZINC000875289434	GD	On-Demand	Anodyne	ADRA1B	53	38
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC[C@@H]2CCSC2)C1	ZINC000875289434	GD	On-Demand	Anodyne	DRD3	71	46
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC[C@@H]2CCSC2)C1	ZINC000875289434	GD	On-Demand	Anodyne	HTR7	47	37
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC[C@H]2CCSC2)C1	ZINC000875289435	GD	On-Demand	Anodyne	HTR1A	71	43
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC[C@H]2CCSC2)C1	ZINC000875289435	GD	On-Demand	Anodyne	DRD2	62	46
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC[C@H]2CCSC2)C1	ZINC000875289435	GD	On-Demand	Anodyne	DRD4	36	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC[C@H]2CCSC2)C1	ZINC000875289435	GD	On-Demand	Anodyne	ADRA1D	68	38
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC[C@H]2CCSC2)C1	ZINC000875289435	GD	On-Demand	Anodyne	ADRA1A	60	38
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC[C@H]2CCSC2)C1	ZINC000875289435	GD	On-Demand	Anodyne	ADRA1B	53	38
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC[C@H]2CCSC2)C1	ZINC000875289435	GD	On-Demand	Anodyne	DRD3	71	46
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC[C@H]2CCSC2)C1	ZINC000875289435	GD	On-Demand	Anodyne	HTR7	47	37
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC[C@@H]2CCSC2)C1	ZINC000875289436	GD	On-Demand	Anodyne	HTR1A	71	43
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC[C@@H]2CCSC2)C1	ZINC000875289436	GD	On-Demand	Anodyne	DRD2	62	46
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC[C@@H]2CCSC2)C1	ZINC000875289436	GD	On-Demand	Anodyne	DRD4	36	41
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC[C@@H]2CCSC2)C1	ZINC000875289436	GD	On-Demand	Anodyne	ADRA1D	68	38
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC[C@@H]2CCSC2)C1	ZINC000875289436	GD	On-Demand	Anodyne	ADRA1A	60	38
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC[C@@H]2CCSC2)C1	ZINC000875289436	GD	On-Demand	Anodyne	ADRA1B	53	38
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC[C@@H]2CCSC2)C1	ZINC000875289436	GD	On-Demand	Anodyne	DRD3	71	46
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC[C@@H]2CCSC2)C1	ZINC000875289436	GD	On-Demand	Anodyne	HTR7	47	37
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC[C@H]2CCSC2)C1	ZINC000875289437	GD	On-Demand	Anodyne	HTR1A	71	43
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC[C@H]2CCSC2)C1	ZINC000875289437	GD	On-Demand	Anodyne	DRD2	62	46
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC[C@H]2CCSC2)C1	ZINC000875289437	GD	On-Demand	Anodyne	DRD4	36	41
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC[C@H]2CCSC2)C1	ZINC000875289437	GD	On-Demand	Anodyne	ADRA1D	68	38
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC[C@H]2CCSC2)C1	ZINC000875289437	GD	On-Demand	Anodyne	ADRA1A	60	38
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC[C@H]2CCSC2)C1	ZINC000875289437	GD	On-Demand	Anodyne	ADRA1B	53	38
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC[C@H]2CCSC2)C1	ZINC000875289437	GD	On-Demand	Anodyne	DRD3	71	46
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC[C@H]2CCSC2)C1	ZINC000875289437	GD	On-Demand	Anodyne	HTR7	47	37
COc1ccc(O)c(CNC(=O)NCc2csc(C(F)(F)F)c2)c1	ZINC000875289438	FG	On-Demand	Clean	MTNR1A	39	43
COc1ccc(O)c(CNC(=O)NCc2csc(C(F)(F)F)c2)c1	ZINC000875289438	FG	On-Demand	Clean	MTNR1B	29	43
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3cc(OC)ccc3O)C[C@@H]1C2	ZINC000875289439	ED	On-Demand	Clean	MTNR1A	28	41
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3cc(OC)ccc3O)C[C@@H]1C2	ZINC000875289439	ED	On-Demand	Clean	MTNR1B	19	41
O=C(NCCOc1cccnc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875289447	EE	On-Demand	Anodyne	ADRB2	15	40
O=C(NCCOc1cccnc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875289447	EE	On-Demand	Anodyne	ADRB1	40	40
O=C(NCCOc1cccnc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875289447	EE	On-Demand	Anodyne	HRH2	26	44
O=C(NCCOc1cccnc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875289447	EE	On-Demand	Anodyne	ADRB3	33	40
O=C(NCCOc1cccnc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875289447	EE	On-Demand	Anodyne	PDS	51	37
O=C(NCCOc1cccnc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875289448	EE	On-Demand	Anodyne	ADRB2	15	40
O=C(NCCOc1cccnc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875289448	EE	On-Demand	Anodyne	ADRB1	40	40
O=C(NCCOc1cccnc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875289448	EE	On-Demand	Anodyne	HRH2	26	44
O=C(NCCOc1cccnc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875289448	EE	On-Demand	Anodyne	ADRB3	33	40
O=C(NCCOc1cccnc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875289448	EE	On-Demand	Anodyne	PDS	51	37
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@H]2c2ccsc2)c1	ZINC000875289458	DF	On-Demand	Clean	MTNR1A	27	40
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@H]2c2ccsc2)c1	ZINC000875289458	DF	On-Demand	Clean	MTNR1B	18	40
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@H]2c2ccsc2)c1	ZINC000875289458	DF	On-Demand	Clean	NPBWR1	81	34
CC[C@@H](NC(=O)NCc1cc(OC)ccc1O)c1cccc(OC)c1OC	ZINC000875289465	FG	On-Demand	Clean	MTNR1A	55	39
CC[C@@H](NC(=O)NCc1cc(OC)ccc1O)c1cccc(OC)c1OC	ZINC000875289465	FG	On-Demand	Clean	MTNR1B	50	37
CCOC1CC2(C1)C[C@H]2NC(=O)NCc1cc(OC)ccc1O	ZINC000875289475	DE	On-Demand	Clean	MTNR1A	37	41
CCOC1CC2(C1)C[C@H]2NC(=O)NCc1cc(OC)ccc1O	ZINC000875289475	DE	On-Demand	Clean	MTNR1B	27	41
CCOC1CC2(C1)C[C@@H]2NC(=O)NCc1cc(OC)ccc1O	ZINC000875289476	DE	On-Demand	Clean	MTNR1A	37	41
CCOC1CC2(C1)C[C@@H]2NC(=O)NCc1cc(OC)ccc1O	ZINC000875289476	DE	On-Demand	Clean	MTNR1B	27	41
C=CC(C)(C)CCNC(=O)NCc1cc(OC)ccc1O	ZINC000875289478	CF	On-Demand	Mild	MTNR1A	47	46
C=CC(C)(C)CCNC(=O)NCc1cc(OC)ccc1O	ZINC000875289478	CF	On-Demand	Mild	MTNR1B	37	46
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@H]2c2ccc(F)cc2F)c1	ZINC000875289483	EG	On-Demand	Clean	MTNR1A	27	44
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@H]2c2ccc(F)cc2F)c1	ZINC000875289483	EG	On-Demand	Clean	MTNR1B	21	44
COc1ccc(O)c(CNC(=O)NCc2cc(Br)cnc2OC)c1	ZINC000875289488	GF	On-Demand	Clean	MTNR1A	39	44
COc1ccc(O)c(CNC(=O)NCc2cc(Br)cnc2OC)c1	ZINC000875289488	GF	On-Demand	Clean	MTNR1B	33	44
CO[C@H]1CCN([C@@H]2CCC[C@@H]2NC(=O)NCCOc2cccnc2)C1	ZINC000875289497	ED	On-Demand	Anodyne	CHRNA7	40	36
COC(=O)N(C)NC(=O)N[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1	ZINC000875289499	GE	On-Demand	Reactive	EPHX2	28	41
COC(=O)N(C)NC(=O)N[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1	ZINC000875289500	GE	On-Demand	Reactive	EPHX2	28	41
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289501	FC	On-Demand	Mild	HTR1A	74	41
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289501	FC	On-Demand	Mild	DRD2	65	42
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289501	FC	On-Demand	Mild	DRD4	33	42
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289501	FC	On-Demand	Mild	ADRA1D	62	39
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289501	FC	On-Demand	Mild	ADRA1A	57	39
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289501	FC	On-Demand	Mild	ADRA1B	49	39
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289501	FC	On-Demand	Mild	DRD3	62	39
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289501	FC	On-Demand	Mild	HTR7	49	37
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289502	FC	On-Demand	Mild	HTR1A	74	41
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289502	FC	On-Demand	Mild	DRD2	65	42
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289502	FC	On-Demand	Mild	DRD4	33	42
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289502	FC	On-Demand	Mild	ADRA1D	62	39
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289502	FC	On-Demand	Mild	ADRA1A	57	39
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289502	FC	On-Demand	Mild	ADRA1B	49	39
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289502	FC	On-Demand	Mild	DRD3	62	39
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289502	FC	On-Demand	Mild	HTR7	49	37
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289503	FC	On-Demand	Mild	HTR1A	74	41
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289503	FC	On-Demand	Mild	DRD2	65	42
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289503	FC	On-Demand	Mild	DRD4	33	42
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289503	FC	On-Demand	Mild	ADRA1D	62	39
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289503	FC	On-Demand	Mild	ADRA1A	57	39
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289503	FC	On-Demand	Mild	ADRA1B	49	39
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289503	FC	On-Demand	Mild	DRD3	62	39
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289503	FC	On-Demand	Mild	HTR7	49	37
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289504	FC	On-Demand	Mild	HTR1A	74	41
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289504	FC	On-Demand	Mild	DRD2	65	42
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289504	FC	On-Demand	Mild	DRD4	33	42
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289504	FC	On-Demand	Mild	ADRA1D	62	39
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289504	FC	On-Demand	Mild	ADRA1A	57	39
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289504	FC	On-Demand	Mild	ADRA1B	49	39
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289504	FC	On-Demand	Mild	DRD3	62	39
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289504	FC	On-Demand	Mild	HTR7	49	37
COc1ccc(O)c(CNC(=O)NCC[C@H]2CCCOC2)c1	ZINC000875289521	DE	On-Demand	Clean	MTNR1A	50	42
COc1ccc(O)c(CNC(=O)NCC[C@H]2CCCOC2)c1	ZINC000875289521	DE	On-Demand	Clean	MTNR1B	35	42
COc1ccc(O)c(CNC(=O)NCC[C@@H]2CCCOC2)c1	ZINC000875289522	DE	On-Demand	Clean	MTNR1A	50	42
COc1ccc(O)c(CNC(=O)NCC[C@@H]2CCCOC2)c1	ZINC000875289522	DE	On-Demand	Clean	MTNR1B	35	42
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC2(OC(C)C)CCC2)C1	ZINC000875289524	GD	On-Demand	Anodyne	HTR1A	77	43
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC2(OC(C)C)CCC2)C1	ZINC000875289524	GD	On-Demand	Anodyne	DRD2	63	42
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC2(OC(C)C)CCC2)C1	ZINC000875289524	GD	On-Demand	Anodyne	DRD4	30	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC2(OC(C)C)CCC2)C1	ZINC000875289524	GD	On-Demand	Anodyne	ADRA1D	83	42
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC2(OC(C)C)CCC2)C1	ZINC000875289524	GD	On-Demand	Anodyne	ADRA1A	74	42
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC2(OC(C)C)CCC2)C1	ZINC000875289524	GD	On-Demand	Anodyne	ADRA1B	63	42
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC2(OC(C)C)CCC2)C1	ZINC000875289524	GD	On-Demand	Anodyne	DRD3	58	40
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC2(OC(C)C)CCC2)C1	ZINC000875289524	GD	On-Demand	Anodyne	HTR7	47	40
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC2(OC(C)C)CCC2)C1	ZINC000875289524	GD	On-Demand	Anodyne	HCN1	52	36
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC2(OC(C)C)CCC2)C1	ZINC000875289524	GD	On-Demand	Anodyne	HCN4	50	36
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC2(OC(C)C)CCC2)C1	ZINC000875289525	GD	On-Demand	Anodyne	HTR1A	77	43
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC2(OC(C)C)CCC2)C1	ZINC000875289525	GD	On-Demand	Anodyne	DRD2	63	42
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC2(OC(C)C)CCC2)C1	ZINC000875289525	GD	On-Demand	Anodyne	DRD4	30	41
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC2(OC(C)C)CCC2)C1	ZINC000875289525	GD	On-Demand	Anodyne	ADRA1D	83	42
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC2(OC(C)C)CCC2)C1	ZINC000875289525	GD	On-Demand	Anodyne	ADRA1A	74	42
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC2(OC(C)C)CCC2)C1	ZINC000875289525	GD	On-Demand	Anodyne	ADRA1B	63	42
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC2(OC(C)C)CCC2)C1	ZINC000875289525	GD	On-Demand	Anodyne	DRD3	58	40
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC2(OC(C)C)CCC2)C1	ZINC000875289525	GD	On-Demand	Anodyne	HTR7	47	40
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC2(OC(C)C)CCC2)C1	ZINC000875289525	GD	On-Demand	Anodyne	HCN1	52	36
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC2(OC(C)C)CCC2)C1	ZINC000875289525	GD	On-Demand	Anodyne	HCN4	50	36
COc1ccc(O)c(CNC(=O)N[C@@H](c2ccccn2)C2CCC2)c1	ZINC000875289530	EG	On-Demand	Clean	TTK	21	42
COc1ccc(O)c(CNC(=O)N[C@H](c2ccccn2)C2CCC2)c1	ZINC000875289536	EG	On-Demand	Clean	TTK	21	42
COc1ccc(O)c(CNC(=O)NCc2cccnc2C)c1	ZINC000875289538	DE	On-Demand	Clean	NQO2	21	41
COc1ccc(O)c(CNC(=O)NCc2cccnc2C)c1	ZINC000875289538	DE	On-Demand	Clean	MTNR1A	68	45
COc1ccc(O)c(CNC(=O)NCc2cccnc2C)c1	ZINC000875289538	DE	On-Demand	Clean	MTNR1B	53	45
CCOc1cc(CNC(=O)NC2(C)CC(F)(F)C2)ccc1OC	ZINC000875289540	EG	On-Demand	Anodyne	MT-ND1	22	41
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCN2C2CCCC2)c1	ZINC000875289551	EE	On-Demand	Clean	MTNR1A	35	41
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCN2C2CCCC2)c1	ZINC000875289551	EE	On-Demand	Clean	MTNR1B	29	41
COc1ccc(O)c(CNC(=O)NC[C@H]2CCN2C2CCCC2)c1	ZINC000875289553	EE	On-Demand	Clean	MTNR1A	35	41
COc1ccc(O)c(CNC(=O)NC[C@H]2CCN2C2CCCC2)c1	ZINC000875289553	EE	On-Demand	Clean	MTNR1B	29	41
C[C@H]1CC[C@@H](NC(=O)C(=O)N2CCC(N3CCN(C)CC3)CC2)c2ccccc21	ZINC000875289554	GD	On-Demand	Anodyne	L3MBTL3	73	41
COc1ccc(O)c(CNC(=O)NCc2conc2C)c1	ZINC000875289555	CD	On-Demand	Clean	MTNR1A	39	45
COc1ccc(O)c(CNC(=O)NCc2conc2C)c1	ZINC000875289555	CD	On-Demand	Clean	MTNR1B	26	45
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289557	FC	On-Demand	Mild	HTR1A	75	41
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289557	FC	On-Demand	Mild	DRD2	71	42
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289557	FC	On-Demand	Mild	DRD4	42	42
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289557	FC	On-Demand	Mild	ADRA1D	63	39
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289557	FC	On-Demand	Mild	ADRA1A	59	39
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289557	FC	On-Demand	Mild	ADRA1B	50	39
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289557	FC	On-Demand	Mild	DRD3	69	40
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289557	FC	On-Demand	Mild	HTR7	50	37
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289558	FC	On-Demand	Mild	HTR1A	75	41
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289558	FC	On-Demand	Mild	DRD2	71	42
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289558	FC	On-Demand	Mild	DRD4	42	42
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289558	FC	On-Demand	Mild	ADRA1D	63	39
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289558	FC	On-Demand	Mild	ADRA1A	59	39
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289558	FC	On-Demand	Mild	ADRA1B	50	39
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289558	FC	On-Demand	Mild	DRD3	69	40
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875289558	FC	On-Demand	Mild	HTR7	50	37
C[C@H]1CC[C@H](NC(=O)C(=O)N2CCC(N3CCN(C)CC3)CC2)c2ccccc21	ZINC000875289559	GD	On-Demand	Anodyne	L3MBTL3	73	41
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289560	FC	On-Demand	Mild	HTR1A	75	41
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289560	FC	On-Demand	Mild	DRD2	71	42
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289560	FC	On-Demand	Mild	DRD4	42	42
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289560	FC	On-Demand	Mild	ADRA1D	63	39
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289560	FC	On-Demand	Mild	ADRA1A	59	39
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289560	FC	On-Demand	Mild	ADRA1B	50	39
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289560	FC	On-Demand	Mild	DRD3	69	40
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289560	FC	On-Demand	Mild	HTR7	50	37
O=C(NCc1coc2ccccc12)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875289561	FE	On-Demand	Anodyne	INHA	53	34
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289562	FC	On-Demand	Mild	HTR1A	75	41
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289562	FC	On-Demand	Mild	DRD2	71	42
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289562	FC	On-Demand	Mild	DRD4	42	42
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289562	FC	On-Demand	Mild	ADRA1D	63	39
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289562	FC	On-Demand	Mild	ADRA1A	59	39
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289562	FC	On-Demand	Mild	ADRA1B	50	39
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289562	FC	On-Demand	Mild	DRD3	69	40
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875289562	FC	On-Demand	Mild	HTR7	50	37
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CCC(C(C)=O)CC2)C1	ZINC000875289568	FD	On-Demand	Anodyne	HTR1A	58	44
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CCC(C(C)=O)CC2)C1	ZINC000875289568	FD	On-Demand	Anodyne	DRD2	49	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CCC(C(C)=O)CC2)C1	ZINC000875289568	FD	On-Demand	Anodyne	ADRA1D	55	38
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CCC(C(C)=O)CC2)C1	ZINC000875289568	FD	On-Demand	Anodyne	ADRA1A	47	38
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CCC(C(C)=O)CC2)C1	ZINC000875289568	FD	On-Demand	Anodyne	ADRA1B	44	38
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CCC(C(C)=O)CC2)C1	ZINC000875289568	FD	On-Demand	Anodyne	DRD3	55	40
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CCC(C(C)=O)CC2)C1	ZINC000875289570	FD	On-Demand	Anodyne	HTR1A	58	44
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CCC(C(C)=O)CC2)C1	ZINC000875289570	FD	On-Demand	Anodyne	DRD2	49	41
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CCC(C(C)=O)CC2)C1	ZINC000875289570	FD	On-Demand	Anodyne	ADRA1D	55	38
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CCC(C(C)=O)CC2)C1	ZINC000875289570	FD	On-Demand	Anodyne	ADRA1A	47	38
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CCC(C(C)=O)CC2)C1	ZINC000875289570	FD	On-Demand	Anodyne	ADRA1B	44	38
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CCC(C(C)=O)CC2)C1	ZINC000875289570	FD	On-Demand	Anodyne	DRD3	55	40
COc1ccc(O)c(CNC(=O)N[C@@H]2COc3cccc(C)c3C2)c1	ZINC000875289576	EF	On-Demand	Clean	MTNR1A	29	49
COc1ccc(O)c(CNC(=O)N[C@H]2COc3cccc(C)c3C2)c1	ZINC000875289578	EF	On-Demand	Clean	MTNR1A	29	49
O=C(NCc1coc2ccccc12)NC[C@H]1C[C@H](O)C1	ZINC000875289614	CE	On-Demand	Anodyne	INHA	44	31
C#CC[C@H](COC)NC(=O)NCc1cc(OC)ccc1O	ZINC000875289617	CD	On-Demand	Mild	MTNR1A	30	42
C#CC[C@H](COC)NC(=O)NCc1cc(OC)ccc1O	ZINC000875289617	CD	On-Demand	Mild	MTNR1B	24	42
C#CC[C@@H](COC)NC(=O)NCc1cc(OC)ccc1O	ZINC000875289618	CD	On-Demand	Mild	MTNR1A	30	42
C#CC[C@@H](COC)NC(=O)NCc1cc(OC)ccc1O	ZINC000875289618	CD	On-Demand	Mild	MTNR1B	24	42
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@H]2C2CCOCC2)c1	ZINC000875289620	DE	On-Demand	Clean	MTNR1A	32	42
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@H]2C2CCOCC2)c1	ZINC000875289620	DE	On-Demand	Clean	MTNR1B	23	42
O=C(NCCOc1cccnc1)N[C@H]1CCC[C@@H]1O	ZINC000875289622	CC	On-Demand	Anodyne	HRH2	21	40
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2C[C@H](OC)CC[C@@H]2C)C1	ZINC000875289652	GD	On-Demand	Anodyne	HTR1A	47	40
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2C[C@H](OC)CC[C@@H]2C)C1	ZINC000875289652	GD	On-Demand	Anodyne	DRD2	40	44
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2C[C@H](OC)CC[C@@H]2C)C1	ZINC000875289652	GD	On-Demand	Anodyne	DRD4	23	44
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2C[C@H](OC)CC[C@@H]2C)C1	ZINC000875289652	GD	On-Demand	Anodyne	ADRA1D	40	37
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2C[C@H](OC)CC[C@@H]2C)C1	ZINC000875289652	GD	On-Demand	Anodyne	DRD3	49	36
CO[C@@H]1C[C@@H]2CN(C(=O)NCc3cc(C(C)C)no3)Cc3cccnc3N2C1	ZINC000875289653	GF	On-Demand	Anodyne	SLC5A7	26	46
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2C[C@@H](OC)CC[C@@H]2C)C1	ZINC000875289654	GD	On-Demand	Anodyne	HTR1A	47	40
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2C[C@@H](OC)CC[C@@H]2C)C1	ZINC000875289654	GD	On-Demand	Anodyne	DRD2	40	44
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2C[C@@H](OC)CC[C@@H]2C)C1	ZINC000875289654	GD	On-Demand	Anodyne	DRD4	23	44
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2C[C@@H](OC)CC[C@@H]2C)C1	ZINC000875289654	GD	On-Demand	Anodyne	ADRA1D	40	37
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2C[C@@H](OC)CC[C@@H]2C)C1	ZINC000875289654	GD	On-Demand	Anodyne	DRD3	49	36
CO[C@H]1C[C@H]2CN(C(=O)NCc3cc(C(C)C)no3)Cc3cccnc3N2C1	ZINC000875289655	GF	On-Demand	Anodyne	SLC5A7	26	46
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2C[C@H](OC)CC[C@H]2C)C1	ZINC000875289656	GD	On-Demand	Anodyne	HTR1A	47	40
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2C[C@H](OC)CC[C@H]2C)C1	ZINC000875289656	GD	On-Demand	Anodyne	DRD2	40	44
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2C[C@H](OC)CC[C@H]2C)C1	ZINC000875289656	GD	On-Demand	Anodyne	DRD4	23	44
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2C[C@H](OC)CC[C@H]2C)C1	ZINC000875289656	GD	On-Demand	Anodyne	ADRA1D	40	37
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2C[C@H](OC)CC[C@H]2C)C1	ZINC000875289656	GD	On-Demand	Anodyne	DRD3	49	36
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2C[C@@H](OC)CC[C@H]2C)C1	ZINC000875289657	GD	On-Demand	Anodyne	HTR1A	47	40
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2C[C@@H](OC)CC[C@H]2C)C1	ZINC000875289657	GD	On-Demand	Anodyne	DRD2	40	44
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2C[C@@H](OC)CC[C@H]2C)C1	ZINC000875289657	GD	On-Demand	Anodyne	DRD4	23	44
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2C[C@@H](OC)CC[C@H]2C)C1	ZINC000875289657	GD	On-Demand	Anodyne	ADRA1D	40	37
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2C[C@@H](OC)CC[C@H]2C)C1	ZINC000875289657	GD	On-Demand	Anodyne	DRD3	49	36
O=C(NCCOc1cccnc1)N1CCC[C@@H]1Cn1ccnc1	ZINC000875289667	DD	On-Demand	Anodyne	CHRNA7	18	40
COCCOc1ccc(F)cc1NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875289668	FG	On-Demand	Anodyne	SLC9A1	46	33
COc1ccc(O)c(CNC(=O)NCCOC(F)(F)C(F)(F)F)c1	ZINC000875289681	FE	On-Demand	Clean	MTNR1A	44	46
COc1ccc(O)c(CNC(=O)NCCOC(F)(F)C(F)(F)F)c1	ZINC000875289681	FE	On-Demand	Clean	MTNR1B	33	46
COc1ccc(O)c(CNC(=O)NCCc2cn(C)c3ncccc23)c1	ZINC000875289699	FE	On-Demand	Clean	NQO2	27	47
COc1ccc(O)c(CNC(=O)NCCc2cn(C)c3ncccc23)c1	ZINC000875289699	FE	On-Demand	Clean	MTNR1A	87	50
COc1ccc(O)c(CNC(=O)NCCc2cn(C)c3ncccc23)c1	ZINC000875289699	FE	On-Demand	Clean	MTNR1B	66	47
COc1ccc(O)c(CNC(=O)NC2CCC(OC(C)(C)C)CC2)c1	ZINC000875289719	FG	On-Demand	Clean	MTNR1A	36	41
COc1ccc(O)c(CNC(=O)NC2CCC(OC(C)(C)C)CC2)c1	ZINC000875289719	FG	On-Demand	Clean	MTNR1B	26	41
COc1ccc(O)c(CNC(=O)NC2CCC(OC(C)(C)C)CC2)c1	ZINC000875289719	FG	On-Demand	Clean	EPHX2	35	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CCN(C)C(C)(C)CC2)C1	ZINC000875289722	GD	On-Demand	Anodyne	HTR1A	55	39
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CCN(C)C(C)(C)CC2)C1	ZINC000875289722	GD	On-Demand	Anodyne	DRD2	40	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CCN(C)C(C)(C)CC2)C1	ZINC000875289722	GD	On-Demand	Anodyne	DRD4	24	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CCN(C)C(C)(C)CC2)C1	ZINC000875289722	GD	On-Demand	Anodyne	ADRA1D	45	37
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CCN(C)C(C)(C)CC2)C1	ZINC000875289722	GD	On-Demand	Anodyne	DRD3	49	37
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CCN(C)C(C)(C)CC2)C1	ZINC000875289724	GD	On-Demand	Anodyne	HTR1A	55	39
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CCN(C)C(C)(C)CC2)C1	ZINC000875289724	GD	On-Demand	Anodyne	DRD2	40	41
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CCN(C)C(C)(C)CC2)C1	ZINC000875289724	GD	On-Demand	Anodyne	DRD4	24	41
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CCN(C)C(C)(C)CC2)C1	ZINC000875289724	GD	On-Demand	Anodyne	ADRA1D	45	37
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CCN(C)C(C)(C)CC2)C1	ZINC000875289724	GD	On-Demand	Anodyne	DRD3	49	37
COCC(C)(C)CCNC(=O)NCc1cc(OC)ccc1O	ZINC000875289726	DE	On-Demand	Clean	MTNR1A	49	47
COCC(C)(C)CCNC(=O)NCc1cc(OC)ccc1O	ZINC000875289726	DE	On-Demand	Clean	MTNR1B	36	47
CN1CCN(C2CCN(C(=O)N[C@H]3CCCN(c4ccccc4)C3=O)CC2)CC1	ZINC000875289727	GD	On-Demand	Anodyne	EPHX2	15	45
CN1CCN(C2CCN(C(=O)N[C@H]3CCCN(c4ccccc4)C3=O)CC2)CC1	ZINC000875289727	GD	On-Demand	Anodyne	CALCRL	52	36
CN1CCN(C2CCN(C(=O)N[C@H]3CCCN(c4ccccc4)C3=O)CC2)CC1	ZINC000875289727	GD	On-Demand	Anodyne	L3MBTL3	79	42
CN1CCN(C2CCN(C(=O)N[C@@H]3CCCN(c4ccccc4)C3=O)CC2)CC1	ZINC000875289728	GD	On-Demand	Anodyne	EPHX2	15	45
CN1CCN(C2CCN(C(=O)N[C@@H]3CCCN(c4ccccc4)C3=O)CC2)CC1	ZINC000875289728	GD	On-Demand	Anodyne	CALCRL	52	36
CN1CCN(C2CCN(C(=O)N[C@@H]3CCCN(c4ccccc4)C3=O)CC2)CC1	ZINC000875289728	GD	On-Demand	Anodyne	L3MBTL3	79	42
COc1ccc(O)c(CNC(=O)NCC2(c3ccccc3)CCN(C)CC2)c1	ZINC000875289733	GF	On-Demand	Clean	DRD4	40	31
COc1ccc(O)c(CNC(=O)NCC2(c3ccccc3)CCN(C)CC2)c1	ZINC000875289733	GF	On-Demand	Clean	KCNA3	50	40
COc1ccc(O)c(CNC(=O)NCC2(c3ccccc3)CCN(C)CC2)c1	ZINC000875289733	GF	On-Demand	Clean	NMBR	41	34
COc1ccc(O)c(CNC(=O)NCC2(c3ccccc3)CCN(C)CC2)c1	ZINC000875289733	GF	On-Demand	Clean	MTNR1A	48	40
COc1ccc(O)c(CNC(=O)NCC2(c3ccccc3)CCN(C)CC2)c1	ZINC000875289733	GF	On-Demand	Clean	MTNR1B	42	40
COc1ccc(O)c(CNC(=O)NCC2(c3ccccc3)CCN(C)CC2)c1	ZINC000875289733	GF	On-Demand	Clean	SOAT1	21	49
COc1ccc(O)c(CNC(=O)NCC2CC=CC2)c1	ZINC000875289745	CE	On-Demand	Clean	MTNR1A	62	46
COc1ccc(O)c(CNC(=O)NCC2CC=CC2)c1	ZINC000875289745	CE	On-Demand	Clean	MTNR1B	48	46
COc1ccc(O)c(CNC(=O)NCc2ccc(C(F)(F)F)s2)c1	ZINC000875289747	FG	On-Demand	Clean	CSNK1D	18	40
COc1ccc(O)c(CNC(=O)NCc2ccc(C(F)(F)F)s2)c1	ZINC000875289747	FG	On-Demand	Clean	MTNR1A	39	44
COc1ccc(O)c(CNC(=O)NCc2ccc(C(F)(F)F)s2)c1	ZINC000875289747	FG	On-Demand	Clean	MTNR1B	27	44
O=C(Nc1nc(O)c2ccccc2n1)[C@@H]1CC[C@H](Cc2ccccc2)O1	ZINC000875289752	EG	On-Demand	Anodyne	TNKS	60	34
COc1ccc(O)c(CNC(=O)NC[C@@H]2CC(=O)c3ccccc3O2)c1	ZINC000875289756	FE	On-Demand	Clean	MTNR1A	46	40
COc1ccc(O)c(CNC(=O)NC[C@@H]2CC(=O)c3ccccc3O2)c1	ZINC000875289756	FE	On-Demand	Clean	MTNR1B	34	40
COc1ccc(O)c(CNC(=O)NC[C@H]2CC(=O)c3ccccc3O2)c1	ZINC000875289758	FE	On-Demand	Clean	MTNR1A	46	40
COc1ccc(O)c(CNC(=O)NC[C@H]2CC(=O)c3ccccc3O2)c1	ZINC000875289758	FE	On-Demand	Clean	MTNR1B	34	40
Cc1ccc(NC(=O)c2cccc(OC(=O)[C@]3(C#N)CCCOC3)c2)cc1	ZINC000875289759	FG	On-Demand	Mild	KCNK3	64	40
Cc1ccc(NC(=O)c2cccc(OC(=O)[C@]3(C#N)CCCOC3)c2)cc1	ZINC000875289759	FG	On-Demand	Mild	KCNK9	42	36
Cc1ccc(NC(=O)c2cccc(OC(=O)[C@@]3(C#N)CCCOC3)c2)cc1	ZINC000875289761	FG	On-Demand	Mild	KCNK3	64	40
Cc1ccc(NC(=O)c2cccc(OC(=O)[C@@]3(C#N)CCCOC3)c2)cc1	ZINC000875289761	FG	On-Demand	Mild	KCNK9	42	36
O=C(NCCOc1cccnc1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875289777	FF	On-Demand	Anodyne	CHRNA7	17	40
CCO[C@@H](C(=O)Nc1nc(O)c2ccccc2n1)C1CCOCC1	ZINC000875289804	EE	On-Demand	Anodyne	TNKS	62	37
COc1ccc(O)c(CNC(=O)NC[C@@H]2CC=CC[C@H]2C(F)(F)F)c1	ZINC000875289806	FG	On-Demand	Clean	MTNR1A	31	41
COc1ccc(O)c(CNC(=O)NC[C@@H]2CC=CC[C@H]2C(F)(F)F)c1	ZINC000875289806	FG	On-Demand	Clean	MTNR1B	21	41
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@@H](C(=O)OC(C)(C)C)C2)c1	ZINC000875289820	FE	On-Demand	Clean	MTNR1A	43	44
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@@H](C(=O)OC(C)(C)C)C2)c1	ZINC000875289820	FE	On-Demand	Clean	MTNR1B	34	44
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@H](C(=O)OC(C)(C)C)C2)c1	ZINC000875289822	FE	On-Demand	Clean	MTNR1A	43	44
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@H](C(=O)OC(C)(C)C)C2)c1	ZINC000875289822	FE	On-Demand	Clean	MTNR1B	34	44
COc1ccc(O)c(CNC(=O)NC2CC(C(=O)OC(C)(C)C)C2)c1	ZINC000875289824	FE	On-Demand	Clean	MTNR1A	43	44
COc1ccc(O)c(CNC(=O)NC2CC(C(=O)OC(C)(C)C)C2)c1	ZINC000875289824	FE	On-Demand	Clean	MTNR1B	34	44
COc1ccc(O)c(CNC(=O)NCCC(C)(C)OC)c1	ZINC000875289830	CE	On-Demand	Clean	MTNR1A	62	49
COc1ccc(O)c(CNC(=O)NCCC(C)(C)OC)c1	ZINC000875289830	CE	On-Demand	Clean	MTNR1B	47	49
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1	ZINC000875289831	FE	On-Demand	Anodyne	EPHX2	29	40
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1	ZINC000875289833	FE	On-Demand	Anodyne	EPHX2	29	40
CC(=O)C1CCN(C(=O)N[C@H]2CCCN(c3ccccc3)C2=O)CC1	ZINC000875289851	EE	On-Demand	Anodyne	EPHX2	21	42
CC(=O)C1CCN(C(=O)N[C@@H]2CCCN(c3ccccc3)C2=O)CC1	ZINC000875289853	EE	On-Demand	Anodyne	EPHX2	21	42
CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H]1CCCN2C(=O)NCCOc1cccnc1	ZINC000875289869	GF	On-Demand	Anodyne	FKBP1A	20	42
CC(C)(C)OC(=O)N1CC[C@@H]2[C@H]1CCCN2C(=O)NCCOc1cccnc1	ZINC000875289871	GF	On-Demand	Anodyne	FKBP1A	20	42
CC(C)(C)OC(=O)N1CC[C@H]2[C@@H]1CCCN2C(=O)NCCOc1cccnc1	ZINC000875289873	GF	On-Demand	Anodyne	FKBP1A	20	42
CC(C)(C)OC(=O)N1CC[C@H]2[C@H]1CCCN2C(=O)NCCOc1cccnc1	ZINC000875289875	GF	On-Demand	Anodyne	FKBP1A	20	42
Cc1nnc(NNC(=O)N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)n1C	ZINC000875289890	GE	On-Demand	Reactive	DRD4	20	51
Cc1nnc(NNC(=O)N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)n1C	ZINC000875289890	GE	On-Demand	Reactive	SIGMAR1	17	48
Cc1nnc(NNC(=O)N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)n1C	ZINC000875289890	GE	On-Demand	Reactive	CCR3	25	41
Cc1nnc(NNC(=O)N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)n1C	ZINC000875289890	GE	On-Demand	Reactive	MLNR	21	41
Cc1nnc(NNC(=O)N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)n1C	ZINC000875289890	GE	On-Demand	Reactive	CCR2	29	47
Cc1nnc(NNC(=O)N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)n1C	ZINC000875289890	GE	On-Demand	Reactive	SLC6A5	39	45
Cc1nnc(NNC(=O)N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)n1C	ZINC000875289890	GE	On-Demand	Reactive	MCHR1	39	43
Cc1nnc(NNC(=O)N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)n1C	ZINC000875289890	GE	On-Demand	Reactive	BIRC2	18	41
Cc1nnc(NNC(=O)N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)n1C	ZINC000875289891	GE	On-Demand	Reactive	DRD4	20	51
Cc1nnc(NNC(=O)N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)n1C	ZINC000875289891	GE	On-Demand	Reactive	SIGMAR1	17	48
Cc1nnc(NNC(=O)N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)n1C	ZINC000875289891	GE	On-Demand	Reactive	CCR3	25	41
Cc1nnc(NNC(=O)N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)n1C	ZINC000875289891	GE	On-Demand	Reactive	MLNR	21	41
Cc1nnc(NNC(=O)N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)n1C	ZINC000875289891	GE	On-Demand	Reactive	CCR2	29	47
Cc1nnc(NNC(=O)N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)n1C	ZINC000875289891	GE	On-Demand	Reactive	SLC6A5	39	45
Cc1nnc(NNC(=O)N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)n1C	ZINC000875289891	GE	On-Demand	Reactive	MCHR1	39	43
Cc1nnc(NNC(=O)N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)n1C	ZINC000875289891	GE	On-Demand	Reactive	BIRC2	18	41
CCO[C@@H](C(=O)Nc1nc(O)c2ccccc2n1)[C@H]1CCOC1	ZINC000875289898	DD	On-Demand	Anodyne	TNKS	58	34
CCO[C@@H](C(=O)Nc1nc(O)c2ccccc2n1)[C@@H]1CCOC1	ZINC000875289900	DD	On-Demand	Anodyne	TNKS	58	34
COc1ccc(O)c(CNC(=O)NCCSCCC(F)(F)F)c1	ZINC000875289903	FF	On-Demand	Clean	MTNR1A	33	45
COc1ccc(O)c(CNC(=O)NCCSCCC(F)(F)F)c1	ZINC000875289903	FF	On-Demand	Clean	MTNR1B	23	45
CCOc1cc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)ccc1OC	ZINC000875289904	EE	On-Demand	Anodyne	SSTR5	78	43
CCOc1cc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)ccc1OC	ZINC000875289904	EE	On-Demand	Anodyne	PDE6A	41	31
CCOc1cc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)ccc1OC	ZINC000875289904	EE	On-Demand	Anodyne	MT-ND1	23	41
CCOc1cc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)ccc1OC	ZINC000875289905	EE	On-Demand	Anodyne	SSTR5	78	43
CCOc1cc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)ccc1OC	ZINC000875289905	EE	On-Demand	Anodyne	PDE6A	41	31
CCOc1cc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)ccc1OC	ZINC000875289905	EE	On-Demand	Anodyne	MT-ND1	23	41
O=C(NCCOc1cccnc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875289909	EE	On-Demand	Anodyne	F2	18	43
O=C(NCCOc1cccnc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875289909	EE	On-Demand	Anodyne	ADRB1	16	40
O=C(NCCOc1cccnc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875289909	EE	On-Demand	Anodyne	ADRB3	23	40
O=C(NCCOc1cccnc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875289909	EE	On-Demand	Anodyne	CHRNA7	23	40
O=C(NCCOc1cccnc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875289909	EE	On-Demand	Anodyne	CPT1A	80	39
O=C(NCCOc1cccnc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875289909	EE	On-Demand	Anodyne	PREP	41	37
O=C(NCCOc1cccnc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875289910	EE	On-Demand	Anodyne	F2	18	43
O=C(NCCOc1cccnc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875289910	EE	On-Demand	Anodyne	ADRB1	16	40
O=C(NCCOc1cccnc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875289910	EE	On-Demand	Anodyne	ADRB3	23	40
O=C(NCCOc1cccnc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875289910	EE	On-Demand	Anodyne	CHRNA7	23	40
O=C(NCCOc1cccnc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875289910	EE	On-Demand	Anodyne	CPT1A	80	39
O=C(NCCOc1cccnc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875289910	EE	On-Demand	Anodyne	PREP	41	37
O=C(NCCOc1cccnc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875289911	EE	On-Demand	Anodyne	F2	18	43
O=C(NCCOc1cccnc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875289911	EE	On-Demand	Anodyne	ADRB1	16	40
O=C(NCCOc1cccnc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875289911	EE	On-Demand	Anodyne	ADRB3	23	40
O=C(NCCOc1cccnc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875289911	EE	On-Demand	Anodyne	CHRNA7	23	40
O=C(NCCOc1cccnc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875289911	EE	On-Demand	Anodyne	CPT1A	80	39
O=C(NCCOc1cccnc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875289911	EE	On-Demand	Anodyne	PREP	41	37
O=C(NCCOc1cccnc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875289912	EE	On-Demand	Anodyne	F2	18	43
O=C(NCCOc1cccnc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875289912	EE	On-Demand	Anodyne	ADRB1	16	40
O=C(NCCOc1cccnc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875289912	EE	On-Demand	Anodyne	ADRB3	23	40
O=C(NCCOc1cccnc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875289912	EE	On-Demand	Anodyne	CHRNA7	23	40
O=C(NCCOc1cccnc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875289912	EE	On-Demand	Anodyne	CPT1A	80	39
O=C(NCCOc1cccnc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875289912	EE	On-Demand	Anodyne	PREP	41	37
CCC(CC)(CNC(=O)NCc1cc(OC)ccc1O)C(F)(F)F	ZINC000875289917	EH	On-Demand	Clean	MTNR1A	46	45
CCC(CC)(CNC(=O)NCc1cc(OC)ccc1O)C(F)(F)F	ZINC000875289917	EH	On-Demand	Clean	MTNR1B	36	45
COc1ccc(O)c(CNC(=O)N[C@H]2CCc3ccc(Cl)cc32)c1	ZINC000875289918	EH	On-Demand	Clean	NQO2	28	42
COc1ccc(O)c(CNC(=O)N[C@H]2CCc3ccc(Cl)cc32)c1	ZINC000875289918	EH	On-Demand	Clean	MTNR1A	25	44
COc1ccc(O)c(CNC(=O)N[C@H]2CCc3ccc(Cl)cc32)c1	ZINC000875289918	EH	On-Demand	Clean	MTNR1B	22	41
COc1ccc(O)c(CNC(=O)N[C@@H]2CCc3ccc(Cl)cc32)c1	ZINC000875289919	EH	On-Demand	Clean	NQO2	28	42
COc1ccc(O)c(CNC(=O)N[C@@H]2CCc3ccc(Cl)cc32)c1	ZINC000875289919	EH	On-Demand	Clean	MTNR1A	25	44
COc1ccc(O)c(CNC(=O)N[C@@H]2CCc3ccc(Cl)cc32)c1	ZINC000875289919	EH	On-Demand	Clean	MTNR1B	22	41
COc1ccc(O)c(CNC(=O)N[C@@H](C)c2ccc(OC)cc2OC)c1	ZINC000875289920	FF	On-Demand	Clean	MTNR1A	48	44
COc1ccc(O)c(CNC(=O)N[C@@H](C)c2ccc(OC)cc2OC)c1	ZINC000875289920	FF	On-Demand	Clean	MTNR1B	41	44
O=C(NCCOc1cccnc1)N1CC=CC1	ZINC000875289923	BD	On-Demand	Anodyne	CHRNA7	18	42
O=C(NCCOc1cccnc1)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875289924	CD	On-Demand	Anodyne	CHRNA7	52	42
O=C(NCCCCC1CC1)C(=O)N[C@H]1CCN(c2ccccn2)C1	ZINC000875289933	ED	On-Demand	Anodyne	HTR1A	17	45
O=C(NCCCCC1CC1)C(=O)N[C@H]1CCN(c2ccccn2)C1	ZINC000875289933	ED	On-Demand	Anodyne	DRD2	21	52
O=C(NCCCCC1CC1)C(=O)N[C@H]1CCN(c2ccccn2)C1	ZINC000875289933	ED	On-Demand	Anodyne	DRD4	21	40
O=C(NCCCCC1CC1)C(=O)N[C@H]1CCN(c2ccccn2)C1	ZINC000875289933	ED	On-Demand	Anodyne	DRD3	23	49
O=C(NCCCCC1CC1)C(=O)N[C@H]1CCN(c2ccccn2)C1	ZINC000875289933	ED	On-Demand	Anodyne	SIRT3	50	31
O=C(NCCCCC1CC1)C(=O)N[C@H]1CCN(c2ccccn2)C1	ZINC000875289933	ED	On-Demand	Anodyne	SIRT2	50	31
O=C(NCCCCC1CC1)C(=O)N[C@H]1CCN(c2ccccn2)C1	ZINC000875289933	ED	On-Demand	Anodyne	SIRT1	50	31
O=C(NCCCCC1CC1)C(=O)N[C@@H]1CCN(c2ccccn2)C1	ZINC000875289934	ED	On-Demand	Anodyne	HTR1A	17	45
O=C(NCCCCC1CC1)C(=O)N[C@@H]1CCN(c2ccccn2)C1	ZINC000875289934	ED	On-Demand	Anodyne	DRD2	21	52
O=C(NCCCCC1CC1)C(=O)N[C@@H]1CCN(c2ccccn2)C1	ZINC000875289934	ED	On-Demand	Anodyne	DRD4	21	40
O=C(NCCCCC1CC1)C(=O)N[C@@H]1CCN(c2ccccn2)C1	ZINC000875289934	ED	On-Demand	Anodyne	DRD3	23	49
O=C(NCCCCC1CC1)C(=O)N[C@@H]1CCN(c2ccccn2)C1	ZINC000875289934	ED	On-Demand	Anodyne	SIRT3	50	31
O=C(NCCCCC1CC1)C(=O)N[C@@H]1CCN(c2ccccn2)C1	ZINC000875289934	ED	On-Demand	Anodyne	SIRT2	50	31
O=C(NCCCCC1CC1)C(=O)N[C@@H]1CCN(c2ccccn2)C1	ZINC000875289934	ED	On-Demand	Anodyne	SIRT1	50	31
COC(=O)N(C)NC(=O)NCc1cc(C(C)C)no1	ZINC000875289941	CD	On-Demand	Reactive	SLC5A7	25	42
COc1ccc(O)c(CNC(=O)N[C@H](C)c2nccnc2C)c1	ZINC000875289944	DE	On-Demand	Clean	MTNR1A	38	42
COc1ccc(O)c(CNC(=O)N[C@H](C)c2nccnc2C)c1	ZINC000875289944	DE	On-Demand	Clean	MTNR1B	32	42
COc1ccc(O)c(CNC(=O)N[C@@H](C)c2nccnc2C)c1	ZINC000875289946	DE	On-Demand	Clean	MTNR1A	38	42
COc1ccc(O)c(CNC(=O)N[C@@H](C)c2nccnc2C)c1	ZINC000875289946	DE	On-Demand	Clean	MTNR1B	32	42
COc1ccc(O)c(CNC(=O)NCC[C@H]2CCCS2)c1	ZINC000875289948	DE	On-Demand	Clean	MTNR1A	44	44
COc1ccc(O)c(CNC(=O)NCC[C@H]2CCCS2)c1	ZINC000875289948	DE	On-Demand	Clean	MTNR1B	32	44
COc1ccc(O)c(CNC(=O)NCC[C@@H]2CCCS2)c1	ZINC000875289950	DE	On-Demand	Clean	MTNR1A	44	44
COc1ccc(O)c(CNC(=O)NCC[C@@H]2CCCS2)c1	ZINC000875289950	DE	On-Demand	Clean	MTNR1B	32	44
CCO[C@H]1COCC[C@H]1CC(=O)Nc1nc(O)c2ccccc2n1	ZINC000875289954	EE	On-Demand	Anodyne	TNKS	60	34
CCO[C@H]1COCC[C@@H]1CC(=O)Nc1nc(O)c2ccccc2n1	ZINC000875289956	EE	On-Demand	Anodyne	TNKS	60	34
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(C(C)C)no1	ZINC000875289969	DE	On-Demand	Anodyne	SLC6A3	40	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(C(C)C)no1	ZINC000875289969	DE	On-Demand	Anodyne	SLC5A7	26	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(C(C)C)no1	ZINC000875289971	DE	On-Demand	Anodyne	SLC6A3	40	36
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(C(C)C)no1	ZINC000875289971	DE	On-Demand	Anodyne	SLC5A7	26	45
O=C(NCCOc1cccnc1)N(C1CC1)C1CC1	ZINC000875289978	CD	On-Demand	Anodyne	CHRNA7	22	41
CCOc1cc(CNC(=O)N2CCC(CO)(CO)CC2)ccc1OC	ZINC000875290005	FD	On-Demand	Anodyne	SSTR5	51	38
CCOc1cc(CNC(=O)N2CCC(CO)(CO)CC2)ccc1OC	ZINC000875290005	FD	On-Demand	Anodyne	PDE6A	41	31
CCOc1cc(CNC(=O)N2CCC(CO)(CO)CC2)ccc1OC	ZINC000875290005	FD	On-Demand	Anodyne	HCN1	47	33
C[C@@]1(CO)CN(C(=O)NCCOc2cccnc2)C[C@]1(C)CO	ZINC000875290007	DC	On-Demand	Anodyne	PTAFR	15	47
C[C@@]1(CO)CN(C(=O)NCCOc2cccnc2)C[C@]1(C)CO	ZINC000875290007	DC	On-Demand	Anodyne	CHRNA7	17	42
COc1ccc(O)c(CNC(=O)NC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)c1	ZINC000875290023	DE	On-Demand	Clean	MTNR1A	30	41
COc1ccc(O)c(CNC(=O)NC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)c1	ZINC000875290023	DE	On-Demand	Clean	MTNR1B	20	41
COc1ccc(O)c(CNC(=O)NC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)c1	ZINC000875290025	DE	On-Demand	Clean	MTNR1A	30	41
COc1ccc(O)c(CNC(=O)NC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)c1	ZINC000875290025	DE	On-Demand	Clean	MTNR1B	20	41
COc1ccc(O)c(CNC(=O)NC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)c1	ZINC000875290027	DE	On-Demand	Clean	MTNR1A	30	41
COc1ccc(O)c(CNC(=O)NC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)c1	ZINC000875290027	DE	On-Demand	Clean	MTNR1B	20	41
COc1ccc(O)c(CNC(=O)NC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)c1	ZINC000875290030	DE	On-Demand	Clean	MTNR1A	30	41
COc1ccc(O)c(CNC(=O)NC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)c1	ZINC000875290030	DE	On-Demand	Clean	MTNR1B	20	41
O=C1OC[C@H]2CN(C(=O)N[C@@H]3CCN(Cc4ccc(C(F)(F)F)cc4)C3)C[C@@H]12	ZINC000875290040	GE	On-Demand	Anodyne	DRD4	20	52
O=C1OC[C@H]2CN(C(=O)N[C@@H]3CCN(Cc4ccc(C(F)(F)F)cc4)C3)C[C@@H]12	ZINC000875290040	GE	On-Demand	Anodyne	SIGMAR1	16	49
O=C1OC[C@H]2CN(C(=O)N[C@@H]3CCN(Cc4ccc(C(F)(F)F)cc4)C3)C[C@@H]12	ZINC000875290040	GE	On-Demand	Anodyne	CCR3	25	41
O=C1OC[C@H]2CN(C(=O)N[C@@H]3CCN(Cc4ccc(C(F)(F)F)cc4)C3)C[C@@H]12	ZINC000875290040	GE	On-Demand	Anodyne	MLNR	23	42
O=C1OC[C@H]2CN(C(=O)N[C@@H]3CCN(Cc4ccc(C(F)(F)F)cc4)C3)C[C@@H]12	ZINC000875290040	GE	On-Demand	Anodyne	CCR2	24	45
O=C1OC[C@H]2CN(C(=O)N[C@@H]3CCN(Cc4ccc(C(F)(F)F)cc4)C3)C[C@@H]12	ZINC000875290040	GE	On-Demand	Anodyne	SLC6A5	31	42
O=C1OC[C@H]2CN(C(=O)N[C@@H]3CCN(Cc4ccc(C(F)(F)F)cc4)C3)C[C@@H]12	ZINC000875290040	GE	On-Demand	Anodyne	MCHR1	43	49
O=C1OC[C@H]2CN(C(=O)N[C@@H]3CCN(Cc4ccc(C(F)(F)F)cc4)C3)C[C@@H]12	ZINC000875290040	GE	On-Demand	Anodyne	LUXR	15	41
O=C1OC[C@H]2CN(C(=O)N[C@H]3CCN(Cc4ccc(C(F)(F)F)cc4)C3)C[C@@H]12	ZINC000875290042	GE	On-Demand	Anodyne	DRD4	20	52
O=C1OC[C@H]2CN(C(=O)N[C@H]3CCN(Cc4ccc(C(F)(F)F)cc4)C3)C[C@@H]12	ZINC000875290042	GE	On-Demand	Anodyne	SIGMAR1	16	49
O=C1OC[C@H]2CN(C(=O)N[C@H]3CCN(Cc4ccc(C(F)(F)F)cc4)C3)C[C@@H]12	ZINC000875290042	GE	On-Demand	Anodyne	CCR3	25	41
O=C1OC[C@H]2CN(C(=O)N[C@H]3CCN(Cc4ccc(C(F)(F)F)cc4)C3)C[C@@H]12	ZINC000875290042	GE	On-Demand	Anodyne	MLNR	23	42
O=C1OC[C@H]2CN(C(=O)N[C@H]3CCN(Cc4ccc(C(F)(F)F)cc4)C3)C[C@@H]12	ZINC000875290042	GE	On-Demand	Anodyne	CCR2	24	45
O=C1OC[C@H]2CN(C(=O)N[C@H]3CCN(Cc4ccc(C(F)(F)F)cc4)C3)C[C@@H]12	ZINC000875290042	GE	On-Demand	Anodyne	SLC6A5	31	42
O=C1OC[C@H]2CN(C(=O)N[C@H]3CCN(Cc4ccc(C(F)(F)F)cc4)C3)C[C@@H]12	ZINC000875290042	GE	On-Demand	Anodyne	MCHR1	43	49
O=C1OC[C@H]2CN(C(=O)N[C@H]3CCN(Cc4ccc(C(F)(F)F)cc4)C3)C[C@@H]12	ZINC000875290042	GE	On-Demand	Anodyne	LUXR	15	41
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875290044	FE	On-Demand	Anodyne	DRD4	24	56
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875290044	FE	On-Demand	Anodyne	SIGMAR1	23	53
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875290044	FE	On-Demand	Anodyne	CCR3	34	45
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875290044	FE	On-Demand	Anodyne	MLNR	22	42
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875290044	FE	On-Demand	Anodyne	CCR2	39	50
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875290044	FE	On-Demand	Anodyne	SLC6A5	37	47
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875290044	FE	On-Demand	Anodyne	EPHX2	23	40
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875290044	FE	On-Demand	Anodyne	CXCR3	21	41
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875290044	FE	On-Demand	Anodyne	MCHR1	49	52
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875290044	FE	On-Demand	Anodyne	CACNA1I	45	41
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875290046	FE	On-Demand	Anodyne	DRD4	24	56
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875290046	FE	On-Demand	Anodyne	SIGMAR1	23	53
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875290046	FE	On-Demand	Anodyne	CCR3	34	45
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875290046	FE	On-Demand	Anodyne	MLNR	22	42
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875290046	FE	On-Demand	Anodyne	CCR2	39	50
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875290046	FE	On-Demand	Anodyne	SLC6A5	37	47
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875290046	FE	On-Demand	Anodyne	EPHX2	23	40
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875290046	FE	On-Demand	Anodyne	CXCR3	21	41
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875290046	FE	On-Demand	Anodyne	MCHR1	49	52
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875290046	FE	On-Demand	Anodyne	CACNA1I	45	41
COc1ccc(O)c(CNC(=O)NCCC[C@@H]2CCOC2=O)c1	ZINC000875290047	DD	On-Demand	Clean	NQO2	27	41
COc1ccc(O)c(CNC(=O)NCCC[C@@H]2CCOC2=O)c1	ZINC000875290047	DD	On-Demand	Clean	MTNR1A	46	47
COc1ccc(O)c(CNC(=O)NCCC[C@@H]2CCOC2=O)c1	ZINC000875290047	DD	On-Demand	Clean	MTNR1B	31	47
COc1ccc(O)c(CNC(=O)NCCC[C@H]2CCOC2=O)c1	ZINC000875290049	DD	On-Demand	Clean	NQO2	27	41
COc1ccc(O)c(CNC(=O)NCCC[C@H]2CCOC2=O)c1	ZINC000875290049	DD	On-Demand	Clean	MTNR1A	46	47
COc1ccc(O)c(CNC(=O)NCCC[C@H]2CCOC2=O)c1	ZINC000875290049	DD	On-Demand	Clean	MTNR1B	31	47
C[C@@H](CCNC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)N1CCCCC1	ZINC000875290069	GC	On-Demand	Anodyne	L3MBTL3	52	42
CCOC1CC2(C1)C[C@H]2C(=O)Nc1nc(O)c2ccccc2n1	ZINC000875290120	DE	On-Demand	Anodyne	TIMP3	60	32
CCOC1CC2(C1)C[C@H]2C(=O)Nc1nc(O)c2ccccc2n1	ZINC000875290120	DE	On-Demand	Anodyne	TNKS	60	34
O=C(NCc1coc2ccccc12)N1CCC(CO)(CO)CC1	ZINC000875290124	DD	On-Demand	Anodyne	EPHX2	15	40
COc1ccc(O)c(CNC(=O)N[C@@H]2CC23CCC3)c1	ZINC000875290125	CE	On-Demand	Clean	MTNR1A	45	44
COc1ccc(O)c(CNC(=O)N[C@@H]2CC23CCC3)c1	ZINC000875290125	CE	On-Demand	Clean	MTNR1B	33	44
COc1ccc(O)c(CNC(=O)N[C@H]2CC23CCC3)c1	ZINC000875290127	CE	On-Demand	Clean	MTNR1A	45	44
COc1ccc(O)c(CNC(=O)N[C@H]2CC23CCC3)c1	ZINC000875290127	CE	On-Demand	Clean	MTNR1B	33	44
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCN2C2CCCCC2)c1	ZINC000875290128	EF	On-Demand	Clean	MTNR1A	33	40
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCN2C2CCCCC2)c1	ZINC000875290128	EF	On-Demand	Clean	MTNR1B	27	40
COc1ccc(O)c(CNC(=O)NC[C@H]2CCN2C2CCCCC2)c1	ZINC000875290130	EF	On-Demand	Clean	MTNR1A	33	40
COc1ccc(O)c(CNC(=O)NC[C@H]2CCN2C2CCCCC2)c1	ZINC000875290130	EF	On-Demand	Clean	MTNR1B	27	40
O=C1CCN(C(=O)NCCOc2cccnc2)CCCCCCN1	ZINC000875290132	ED	On-Demand	Anodyne	CHRNA7	18	40
COc1ccc(O)c(CNC(=O)NCC2(OC(C)C)CCC2)c1	ZINC000875290134	DF	On-Demand	Clean	MTNR1A	44	44
COc1ccc(O)c(CNC(=O)NCC2(OC(C)C)CCC2)c1	ZINC000875290134	DF	On-Demand	Clean	MTNR1B	33	44
O=C(NCCOc1cccnc1)NC1CC(Nc2ccccc2)C1	ZINC000875290173	EE	On-Demand	Anodyne	CHRNA7	21	40
CC(=O)C1CCN(C(=O)C(=O)NCC2CCC(C(C)(C)C)CC2)CC1	ZINC000875290181	FF	On-Demand	Anodyne	CACNA1I	41	32
COc1ccc(O)c(CNC(=O)NCC(C)(C)c2ccc(C)cn2)c1	ZINC000875290183	EF	On-Demand	Clean	MTNR1A	15	40
COc1cc(C)ccc1CNC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875290206	ED	On-Demand	Anodyne	EPHX2	26	41
O=C(NCCOc1cccnc1)N1CCC(CO)(CO)CC1	ZINC000875290210	DC	On-Demand	Anodyne	CHRNA7	17	41
C/C=C\CNC(=O)NCc1cc(OC)ccc1O	ZINC000875290212	CD	On-Demand	Clean	MTNR1A	63	51
C/C=C\CNC(=O)NCc1cc(OC)ccc1O	ZINC000875290212	CD	On-Demand	Clean	MTNR1B	53	51
C/C=C/CNC(=O)NCc1cc(OC)ccc1O	ZINC000875290214	CD	On-Demand	Clean	MTNR1A	63	51
C/C=C/CNC(=O)NCc1cc(OC)ccc1O	ZINC000875290214	CD	On-Demand	Clean	MTNR1B	53	51
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(c2ccccn2)C1	ZINC000875290215	EC	On-Demand	Anodyne	DRD4	28	41
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(c2ccccn2)C1	ZINC000875290218	EC	On-Demand	Anodyne	DRD4	28	41
C[C@@H](CCNC(=O)C(=O)NC[C@H]1c2ccccc2CN1C)N1CCCCC1	ZINC000875290220	FD	On-Demand	Anodyne	CCR5	22	40
COc1cc(C)ccc1CNC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875290221	GC	On-Demand	Anodyne	L3MBTL3	55	38
C[C@@H](CCNC(=O)C(=O)NC[C@@H]1c2ccccc2CN1C)N1CCCCC1	ZINC000875290222	FD	On-Demand	Anodyne	CCR5	22	40
COc1ccc(O)c(CNC(=O)NCc2noc3c2CC(C)(C)CC3)c1	ZINC000875290224	FF	On-Demand	Clean	MTNR1A	25	41
COc1ccc(O)c(CNC(=O)NCc2noc3c2CC(C)(C)CC3)c1	ZINC000875290224	FF	On-Demand	Clean	MTNR1B	16	41
CC(C)(C)OC(=O)N1CCC2(CC1)CN(C(=O)NCCOc1cccnc1)C2	ZINC000875290226	GF	On-Demand	Anodyne	GPR119	37	43
C#CC[C@@H](COC)NC(=O)C(=O)NCc1cccc(-c2ccccn2)c1	ZINC000875290233	FD	On-Demand	Mild	PDS	48	33
C#CC[C@H](COC)NC(=O)C(=O)NCc1cccc(-c2ccccn2)c1	ZINC000875290235	FD	On-Demand	Mild	PDS	48	33
O=C(NCCOc1cccnc1)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875290236	EE	On-Demand	Anodyne	CHRNA7	27	40
O=C(NCCOc1cccnc1)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875290238	EE	On-Demand	Anodyne	CHRNA7	27	40
COc1ccc(O)c(CNC(=O)NCCCCC2CC2)c1	ZINC000875290240	CF	On-Demand	Clean	NQO2	34	41
COc1ccc(O)c(CNC(=O)NCCCCC2CC2)c1	ZINC000875290240	CF	On-Demand	Clean	MTNR1A	67	52
COc1ccc(O)c(CNC(=O)NCCCCC2CC2)c1	ZINC000875290240	CF	On-Demand	Clean	MTNR1B	55	52
COc1ccc(O)c(CNC(=O)NCc2cc(C(F)(F)F)cc(Cl)n2)c1	ZINC000875290252	GG	On-Demand	Clean	CSNK1D	21	41
COc1ccc(O)c(CNC(=O)NCc2cc(C(F)(F)F)cc(Cl)n2)c1	ZINC000875290252	GG	On-Demand	Clean	MTNR1A	19	42
COc1ccc(O)c(CNC(=O)NCc2cc(C(F)(F)F)cc(Cl)n2)c1	ZINC000875290252	GG	On-Demand	Clean	MTNR1B	15	42
O=C(NCC[C@H]1CCSC1)C(=O)N[C@H]1CCN(c2ccccn2)C1	ZINC000875290265	ED	On-Demand	Anodyne	SIRT3	52	33
O=C(NCC[C@H]1CCSC1)C(=O)N[C@H]1CCN(c2ccccn2)C1	ZINC000875290265	ED	On-Demand	Anodyne	SIRT2	53	33
O=C(NCC[C@H]1CCSC1)C(=O)N[C@H]1CCN(c2ccccn2)C1	ZINC000875290265	ED	On-Demand	Anodyne	SIRT1	52	33
O=C(NCC[C@@H]1CCSC1)C(=O)N[C@H]1CCN(c2ccccn2)C1	ZINC000875290267	ED	On-Demand	Anodyne	SIRT3	52	33
O=C(NCC[C@@H]1CCSC1)C(=O)N[C@H]1CCN(c2ccccn2)C1	ZINC000875290267	ED	On-Demand	Anodyne	SIRT2	53	33
O=C(NCC[C@@H]1CCSC1)C(=O)N[C@H]1CCN(c2ccccn2)C1	ZINC000875290267	ED	On-Demand	Anodyne	SIRT1	52	33
O=C(NCC[C@H]1CCSC1)C(=O)N[C@@H]1CCN(c2ccccn2)C1	ZINC000875290269	ED	On-Demand	Anodyne	SIRT3	52	33
O=C(NCC[C@H]1CCSC1)C(=O)N[C@@H]1CCN(c2ccccn2)C1	ZINC000875290269	ED	On-Demand	Anodyne	SIRT2	53	33
O=C(NCC[C@H]1CCSC1)C(=O)N[C@@H]1CCN(c2ccccn2)C1	ZINC000875290269	ED	On-Demand	Anodyne	SIRT1	52	33
O=C(NCC[C@@H]1CCSC1)C(=O)N[C@@H]1CCN(c2ccccn2)C1	ZINC000875290271	ED	On-Demand	Anodyne	SIRT3	52	33
O=C(NCC[C@@H]1CCSC1)C(=O)N[C@@H]1CCN(c2ccccn2)C1	ZINC000875290271	ED	On-Demand	Anodyne	SIRT2	53	33
O=C(NCC[C@@H]1CCSC1)C(=O)N[C@@H]1CCN(c2ccccn2)C1	ZINC000875290271	ED	On-Demand	Anodyne	SIRT1	52	33
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875290298	FD	On-Demand	Anodyne	HTR1A	77	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875290298	FD	On-Demand	Anodyne	DRD2	58	39
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875290298	FD	On-Demand	Anodyne	ADRA1D	70	39
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875290298	FD	On-Demand	Anodyne	HTR2A	17	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875290298	FD	On-Demand	Anodyne	ADRA1A	63	39
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875290298	FD	On-Demand	Anodyne	ADRA1B	54	38
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875290298	FD	On-Demand	Anodyne	DRD3	62	39
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875290298	FD	On-Demand	Anodyne	HTR7	47	37
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875290299	FD	On-Demand	Anodyne	HTR1A	77	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875290299	FD	On-Demand	Anodyne	DRD2	58	39
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875290299	FD	On-Demand	Anodyne	ADRA1D	70	39
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875290299	FD	On-Demand	Anodyne	HTR2A	17	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875290299	FD	On-Demand	Anodyne	ADRA1A	63	39
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875290299	FD	On-Demand	Anodyne	ADRA1B	54	38
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875290299	FD	On-Demand	Anodyne	DRD3	62	39
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875290299	FD	On-Demand	Anodyne	HTR7	47	37
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875290300	FD	On-Demand	Anodyne	HTR1A	77	41
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875290300	FD	On-Demand	Anodyne	DRD2	58	39
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875290300	FD	On-Demand	Anodyne	ADRA1D	70	39
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875290300	FD	On-Demand	Anodyne	HTR2A	17	41
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875290300	FD	On-Demand	Anodyne	ADRA1A	63	39
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875290300	FD	On-Demand	Anodyne	ADRA1B	54	38
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875290300	FD	On-Demand	Anodyne	DRD3	62	39
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@@H](C)c2ccnn2C)C1	ZINC000875290300	FD	On-Demand	Anodyne	HTR7	47	37
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875290301	FD	On-Demand	Anodyne	HTR1A	77	41
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875290301	FD	On-Demand	Anodyne	DRD2	58	39
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875290301	FD	On-Demand	Anodyne	ADRA1D	70	39
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875290301	FD	On-Demand	Anodyne	HTR2A	17	41
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875290301	FD	On-Demand	Anodyne	ADRA1A	63	39
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875290301	FD	On-Demand	Anodyne	ADRA1B	54	38
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875290301	FD	On-Demand	Anodyne	DRD3	62	39
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@H](C)c2ccnn2C)C1	ZINC000875290301	FD	On-Demand	Anodyne	HTR7	47	37
COc1ccc(O)c(CNC(=O)NCc2ccc(C)o2)c1	ZINC000875290304	CE	On-Demand	Clean	MTNR1A	58	47
COc1ccc(O)c(CNC(=O)NCc2ccc(C)o2)c1	ZINC000875290304	CE	On-Demand	Clean	MTNR1B	42	47
CCC[C@@H](CNC(=O)NCc1cc(OC)ccc1O)OCC	ZINC000875290308	DE	On-Demand	Clean	MTNR1A	41	45
CCC[C@@H](CNC(=O)NCc1cc(OC)ccc1O)OCC	ZINC000875290308	DE	On-Demand	Clean	MTNR1B	33	45
CCC[C@H](CNC(=O)NCc1cc(OC)ccc1O)OCC	ZINC000875290309	DE	On-Demand	Clean	MTNR1A	41	45
CCC[C@H](CNC(=O)NCc1cc(OC)ccc1O)OCC	ZINC000875290309	DE	On-Demand	Clean	MTNR1B	33	45
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875290318	ED	On-Demand	Anodyne	HTR1A	73	43
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875290318	ED	On-Demand	Anodyne	DRD2	58	43
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875290318	ED	On-Demand	Anodyne	DRD4	31	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875290318	ED	On-Demand	Anodyne	ADRA1D	63	38
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875290318	ED	On-Demand	Anodyne	HTR2A	16	40
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875290318	ED	On-Demand	Anodyne	ADRA1A	56	38
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875290318	ED	On-Demand	Anodyne	ADRA1B	51	38
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875290318	ED	On-Demand	Anodyne	DRD3	60	39
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875290318	ED	On-Demand	Anodyne	HTR7	47	39
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875290319	ED	On-Demand	Anodyne	HTR1A	73	43
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875290319	ED	On-Demand	Anodyne	DRD2	58	43
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875290319	ED	On-Demand	Anodyne	DRD4	31	41
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875290319	ED	On-Demand	Anodyne	ADRA1D	63	38
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875290319	ED	On-Demand	Anodyne	HTR2A	16	40
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875290319	ED	On-Demand	Anodyne	ADRA1A	56	38
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875290319	ED	On-Demand	Anodyne	ADRA1B	51	38
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875290319	ED	On-Demand	Anodyne	DRD3	60	39
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@H]2CC23CCC3)C1	ZINC000875290319	ED	On-Demand	Anodyne	HTR7	47	39
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875290320	ED	On-Demand	Anodyne	HTR1A	73	43
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875290320	ED	On-Demand	Anodyne	DRD2	58	43
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875290320	ED	On-Demand	Anodyne	DRD4	31	41
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875290320	ED	On-Demand	Anodyne	ADRA1D	63	38
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875290320	ED	On-Demand	Anodyne	HTR2A	16	40
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875290320	ED	On-Demand	Anodyne	ADRA1A	56	38
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875290320	ED	On-Demand	Anodyne	ADRA1B	51	38
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875290320	ED	On-Demand	Anodyne	DRD3	60	39
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875290320	ED	On-Demand	Anodyne	HTR7	47	39
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875290321	ED	On-Demand	Anodyne	HTR1A	73	43
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875290321	ED	On-Demand	Anodyne	DRD2	58	43
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875290321	ED	On-Demand	Anodyne	DRD4	31	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875290321	ED	On-Demand	Anodyne	ADRA1D	63	38
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875290321	ED	On-Demand	Anodyne	HTR2A	16	40
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875290321	ED	On-Demand	Anodyne	ADRA1A	56	38
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875290321	ED	On-Demand	Anodyne	ADRA1B	51	38
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875290321	ED	On-Demand	Anodyne	DRD3	60	39
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@@H]2CC23CCC3)C1	ZINC000875290321	ED	On-Demand	Anodyne	HTR7	47	39
O=C(NCCOc1cccnc1)N1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O	ZINC000875290322	EF	On-Demand	Anodyne	FKBP1A	25	41
O=C(NCCOc1cccnc1)N1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O	ZINC000875290322	EF	On-Demand	Anodyne	CPT1A	72	38
O=C(NCCOc1cccnc1)N1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O	ZINC000875290323	EF	On-Demand	Anodyne	FKBP1A	25	41
O=C(NCCOc1cccnc1)N1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O	ZINC000875290323	EF	On-Demand	Anodyne	CPT1A	72	38
O=C(NCCOc1cccnc1)N1CCCC[C@@H]1[C@H]1CCCC[C@H]1O	ZINC000875290324	EF	On-Demand	Anodyne	FKBP1A	25	41
O=C(NCCOc1cccnc1)N1CCCC[C@@H]1[C@H]1CCCC[C@H]1O	ZINC000875290324	EF	On-Demand	Anodyne	CPT1A	72	38
O=C(NCCOc1cccnc1)N1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O	ZINC000875290325	EF	On-Demand	Anodyne	FKBP1A	25	41
O=C(NCCOc1cccnc1)N1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O	ZINC000875290325	EF	On-Demand	Anodyne	CPT1A	72	38
CCC(F)(F)C(C)(C)CNC(=O)NCc1cc(OC)ccc1O	ZINC000875290326	EG	On-Demand	Clean	MTNR1A	35	44
CCC(F)(F)C(C)(C)CNC(=O)NCc1cc(OC)ccc1O	ZINC000875290326	EG	On-Demand	Clean	MTNR1B	25	44
COc1ccc(O)c(CNC(=O)NCC(C)(C)F)c1	ZINC000875290327	CD	On-Demand	Clean	MTNR1A	63	48
COc1ccc(O)c(CNC(=O)NCC(C)(C)F)c1	ZINC000875290327	CD	On-Demand	Clean	MTNR1B	50	48
CC[C@@H]1COCCN1CCNC(=O)NCCOc1cccnc1	ZINC000875290348	DC	On-Demand	Anodyne	CHRNA7	16	40
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@H]3CSC[C@@H]3C2)C1	ZINC000875290349	GD	On-Demand	Anodyne	HTR1A	43	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@H]3CSC[C@@H]3C2)C1	ZINC000875290349	GD	On-Demand	Anodyne	DRD2	36	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@H]3CSC[C@@H]3C2)C1	ZINC000875290349	GD	On-Demand	Anodyne	DRD3	45	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@@H]3CSC[C@H]3C2)C1	ZINC000875290350	GD	On-Demand	Anodyne	HTR1A	43	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@@H]3CSC[C@H]3C2)C1	ZINC000875290350	GD	On-Demand	Anodyne	DRD2	36	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@@H]3CSC[C@H]3C2)C1	ZINC000875290350	GD	On-Demand	Anodyne	DRD3	45	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@@H]3CSC[C@@H]3C2)C1	ZINC000875290352	GD	On-Demand	Anodyne	HTR1A	43	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@@H]3CSC[C@@H]3C2)C1	ZINC000875290352	GD	On-Demand	Anodyne	DRD2	36	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@@H]3CSC[C@@H]3C2)C1	ZINC000875290352	GD	On-Demand	Anodyne	DRD3	45	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@H]3CSC[C@H]3C2)C1	ZINC000875290354	GD	On-Demand	Anodyne	HTR1A	43	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@H]3CSC[C@H]3C2)C1	ZINC000875290354	GD	On-Demand	Anodyne	DRD2	36	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@H]3CSC[C@H]3C2)C1	ZINC000875290354	GD	On-Demand	Anodyne	DRD3	45	41
COc1ccc(O)c(CNC(=O)NCCC2CCN(C(C)C)CC2)c1	ZINC000875290356	EF	On-Demand	Clean	MTNR1A	41	42
COc1ccc(O)c(CNC(=O)NCCC2CCN(C(C)C)CC2)c1	ZINC000875290356	EF	On-Demand	Clean	MTNR1B	32	42
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3coc4ccccc34)C[C@@H]1C2	ZINC000875290362	EF	On-Demand	Anodyne	INHA	48	33
N#CCc1ccsc1C(=O)Nc1c(F)cccc1N1CCCC1	ZINC000875290374	EH	On-Demand	Mild	KCNQ2	69	39
Cc1cnc(COC(=O)C2CCN(C(C)C)CC2)cn1	ZINC000875290380	CD	On-Demand	Anodyne	PTR1	44	32
O=C(NCc1coc2ccccc12)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875290385	EI	On-Demand	Anodyne	INHA	46	33
O=C(NCCOc1cccnc1)NCCN1CC[C@@H](O)C1	ZINC000875290391	CB	On-Demand	Anodyne	HRH2	40	40
O=C(NCCOc1cccnc1)NCCN1CC[C@@H](O)C1	ZINC000875290391	CB	On-Demand	Anodyne	LTA4H	15	44
O=C(NCCOc1cccnc1)NCCN1CC[C@@H](O)C1	ZINC000875290391	CB	On-Demand	Anodyne	CHRNA7	44	38
O=C(NCCOc1cccnc1)NCCN1CC[C@H](O)C1	ZINC000875290393	CB	On-Demand	Anodyne	HRH2	40	40
O=C(NCCOc1cccnc1)NCCN1CC[C@H](O)C1	ZINC000875290393	CB	On-Demand	Anodyne	LTA4H	15	44
O=C(NCCOc1cccnc1)NCCN1CC[C@H](O)C1	ZINC000875290393	CB	On-Demand	Anodyne	CHRNA7	44	38
C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C(=O)Nc1nc(O)c2ccccc2n1	ZINC000875290397	CF	On-Demand	Anodyne	TNKS	45	30
C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C(=O)Nc1nc(O)c2ccccc2n1	ZINC000875290399	CF	On-Demand	Anodyne	TNKS	45	30
C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C(=O)Nc1nc(O)c2ccccc2n1	ZINC000875290400	CF	On-Demand	Anodyne	TNKS	45	30
COc1ccc(O)c(CNC(=O)NCC(C)(C)C(C)(F)F)c1	ZINC000875290404	DF	On-Demand	Clean	MTNR1A	49	46
COc1ccc(O)c(CNC(=O)NCC(C)(C)C(C)(F)F)c1	ZINC000875290404	DF	On-Demand	Clean	MTNR1B	37	46
COc1ccc(O)c(CNC(=O)NCC[C@@H]2CC=CCC2)c1	ZINC000875290406	DF	On-Demand	Clean	MTNR1A	40	43
COc1ccc(O)c(CNC(=O)NCC[C@@H]2CC=CCC2)c1	ZINC000875290406	DF	On-Demand	Clean	MTNR1B	26	43
COc1ccc(O)c(CNC(=O)NCC[C@H]2CC=CCC2)c1	ZINC000875290408	DF	On-Demand	Clean	MTNR1A	40	43
COc1ccc(O)c(CNC(=O)NCC[C@H]2CC=CCC2)c1	ZINC000875290408	DF	On-Demand	Clean	MTNR1B	26	43
COc1ccccc1[C@@H]1CSCCCN1C(=O)NCc1cc(C(C)C)no1	ZINC000875290430	GI	On-Demand	Anodyne	SLC5A7	27	46
COc1ccc(O)c(CNC(=O)NC[C@H]2c3ccccc3C(=O)N2C)c1	ZINC000875290437	FE	On-Demand	Clean	MTNR1A	40	39
COc1ccc(O)c(CNC(=O)NC[C@@H]2c3ccccc3C(=O)N2C)c1	ZINC000875290440	FE	On-Demand	Clean	MTNR1A	40	39
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@@H](C)O[C@H]2C)c1	ZINC000875290442	CD	On-Demand	Clean	MTNR1A	42	45
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@@H](C)O[C@H]2C)c1	ZINC000875290442	CD	On-Demand	Clean	MTNR1B	30	45
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@@H](C)O[C@@H]2C)c1	ZINC000875290444	CD	On-Demand	Clean	MTNR1A	42	45
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@@H](C)O[C@@H]2C)c1	ZINC000875290444	CD	On-Demand	Clean	MTNR1B	30	45
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@H](C)O[C@@H]2C)c1	ZINC000875290446	CD	On-Demand	Clean	MTNR1A	42	45
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@H](C)O[C@@H]2C)c1	ZINC000875290446	CD	On-Demand	Clean	MTNR1B	30	45
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@H](C)O[C@H]2C)c1	ZINC000875290448	CD	On-Demand	Clean	MTNR1A	42	45
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@H](C)O[C@H]2C)c1	ZINC000875290448	CD	On-Demand	Clean	MTNR1B	30	45
O=C(N[C@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCc2coc3ccccc23)C1	ZINC000875290483	GF	On-Demand	Anodyne	INHA	71	38
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCc2coc3ccccc23)C1	ZINC000875290484	GF	On-Demand	Anodyne	INHA	71	38
O=C(N[C@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCc2coc3ccccc23)C1	ZINC000875290485	GF	On-Demand	Anodyne	INHA	71	38
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCc2coc3ccccc23)C1	ZINC000875290486	GF	On-Demand	Anodyne	INHA	71	38
COc1ccc(O)c(CNC(=O)NC[C@H]2CC(C)(C)CO2)c1	ZINC000875290494	DE	On-Demand	Clean	MTNR1A	34	42
COc1ccc(O)c(CNC(=O)NC[C@H]2CC(C)(C)CO2)c1	ZINC000875290494	DE	On-Demand	Clean	MTNR1B	23	42
COc1ccc(O)c(CNC(=O)NC[C@@H]2CC(C)(C)CO2)c1	ZINC000875290495	DE	On-Demand	Clean	MTNR1A	34	42
COc1ccc(O)c(CNC(=O)NC[C@@H]2CC(C)(C)CO2)c1	ZINC000875290495	DE	On-Demand	Clean	MTNR1B	23	42
COC(=O)c1ccc(OC)c2c1CCN(C(=O)NCc1cc(C(C)C)no1)C2	ZINC000875290509	GF	On-Demand	Anodyne	SLC5A7	32	52
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)N[C@H]2CCN(c3ccccn3)C2)C1	ZINC000875290540	EC	On-Demand	Anodyne	HCRTR1	25	42
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)N[C@H]2CCN(c3ccccn3)C2)C1	ZINC000875290540	EC	On-Demand	Anodyne	HCRTR2	40	42
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)N[C@@H]2CCN(c3ccccn3)C2)C1	ZINC000875290542	EC	On-Demand	Anodyne	HCRTR1	25	42
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)N[C@@H]2CCN(c3ccccn3)C2)C1	ZINC000875290542	EC	On-Demand	Anodyne	HCRTR2	40	42
C#C[C@@H]1CC[C@@H](NC(=O)NCc2cc(OC)ccc2O)CC1	ZINC000875290553	DE	On-Demand	Mild	MTNR1A	41	42
C#C[C@@H]1CC[C@@H](NC(=O)NCc2cc(OC)ccc2O)CC1	ZINC000875290553	DE	On-Demand	Mild	MTNR1B	32	42
COc1ccc(O)c(CNC(=O)N[C@@H]2CCCC[C@@H]2F)c1	ZINC000875290555	CE	On-Demand	Clean	MTNR1A	52	44
COc1ccc(O)c(CNC(=O)N[C@@H]2CCCC[C@@H]2F)c1	ZINC000875290555	CE	On-Demand	Clean	MTNR1B	39	44
C#CC[C@H](CCOC)NC(=O)NCc1cc(OC)ccc1O	ZINC000875290556	DD	On-Demand	Mild	MTNR1A	31	41
C#CC[C@H](CCOC)NC(=O)NCc1cc(OC)ccc1O	ZINC000875290556	DD	On-Demand	Mild	MTNR1B	24	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1coc2ccccc12	ZINC000875290557	EF	On-Demand	Anodyne	INHA	66	35
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1coc2ccccc12	ZINC000875290557	EF	On-Demand	Anodyne	SLC6A3	48	38
C#CC[C@@H](CCOC)NC(=O)NCc1cc(OC)ccc1O	ZINC000875290558	DD	On-Demand	Mild	MTNR1A	31	41
C#CC[C@@H](CCOC)NC(=O)NCc1cc(OC)ccc1O	ZINC000875290558	DD	On-Demand	Mild	MTNR1B	24	41
COc1ccc(O)c(CNC(=O)N[C@@H](C)c2ccc(C(F)(F)F)nc2)c1	ZINC000875290560	FG	On-Demand	Clean	TRPV1	77	39
COc1ccc(O)c(CNC(=O)N[C@H](C)c2ccc(C(F)(F)F)nc2)c1	ZINC000875290561	FG	On-Demand	Clean	TRPV1	77	39
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCc2ncc(Cl)s2)C1	ZINC000875290566	GD	On-Demand	Anodyne	HTR1A	79	41
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCc2ncc(Cl)s2)C1	ZINC000875290566	GD	On-Demand	Anodyne	DRD2	68	41
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCc2ncc(Cl)s2)C1	ZINC000875290566	GD	On-Demand	Anodyne	DRD4	46	41
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCc2ncc(Cl)s2)C1	ZINC000875290566	GD	On-Demand	Anodyne	ADRA1D	67	39
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCc2ncc(Cl)s2)C1	ZINC000875290566	GD	On-Demand	Anodyne	ADRA1A	61	39
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCc2ncc(Cl)s2)C1	ZINC000875290566	GD	On-Demand	Anodyne	ADRA1B	50	39
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCc2ncc(Cl)s2)C1	ZINC000875290566	GD	On-Demand	Anodyne	DRD3	75	41
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCc2ncc(Cl)s2)C1	ZINC000875290566	GD	On-Demand	Anodyne	HTR7	55	38
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCc2ncc(Cl)s2)C1	ZINC000875290567	GD	On-Demand	Anodyne	HTR1A	79	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCc2ncc(Cl)s2)C1	ZINC000875290567	GD	On-Demand	Anodyne	DRD2	68	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCc2ncc(Cl)s2)C1	ZINC000875290567	GD	On-Demand	Anodyne	DRD4	46	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCc2ncc(Cl)s2)C1	ZINC000875290567	GD	On-Demand	Anodyne	ADRA1D	67	39
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCc2ncc(Cl)s2)C1	ZINC000875290567	GD	On-Demand	Anodyne	ADRA1A	61	39
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCc2ncc(Cl)s2)C1	ZINC000875290567	GD	On-Demand	Anodyne	ADRA1B	50	39
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCc2ncc(Cl)s2)C1	ZINC000875290567	GD	On-Demand	Anodyne	DRD3	75	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCc2ncc(Cl)s2)C1	ZINC000875290567	GD	On-Demand	Anodyne	HTR7	55	38
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875290569	GD	On-Demand	Anodyne	HTR1A	50	40
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875290569	GD	On-Demand	Anodyne	DRD2	43	42
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875290569	GD	On-Demand	Anodyne	DRD4	24	40
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875290569	GD	On-Demand	Anodyne	ADRA1D	49	37
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875290569	GD	On-Demand	Anodyne	ADRA1A	40	37
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875290569	GD	On-Demand	Anodyne	DRD3	51	39
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875290570	GD	On-Demand	Anodyne	HTR1A	50	40
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875290570	GD	On-Demand	Anodyne	DRD2	43	42
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875290570	GD	On-Demand	Anodyne	DRD4	24	40
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875290570	GD	On-Demand	Anodyne	ADRA1D	49	37
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875290570	GD	On-Demand	Anodyne	ADRA1A	40	37
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875290570	GD	On-Demand	Anodyne	DRD3	51	39
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875290571	GD	On-Demand	Anodyne	HTR1A	50	40
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875290571	GD	On-Demand	Anodyne	DRD2	43	42
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875290571	GD	On-Demand	Anodyne	DRD4	24	40
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875290571	GD	On-Demand	Anodyne	ADRA1D	49	37
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875290571	GD	On-Demand	Anodyne	ADRA1A	40	37
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875290571	GD	On-Demand	Anodyne	DRD3	51	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1coc2ccccc12	ZINC000875290572	EF	On-Demand	Anodyne	INHA	66	35
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1coc2ccccc12	ZINC000875290572	EF	On-Demand	Anodyne	SLC6A3	48	38
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875290573	GD	On-Demand	Anodyne	HTR1A	50	40
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875290573	GD	On-Demand	Anodyne	DRD2	43	42
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875290573	GD	On-Demand	Anodyne	DRD4	24	40
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875290573	GD	On-Demand	Anodyne	ADRA1D	49	37
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875290573	GD	On-Demand	Anodyne	ADRA1A	40	37
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875290573	GD	On-Demand	Anodyne	DRD3	51	39
O=C(NCC[C@H](O)C1CCCC1)NCc1coc2ccccc12	ZINC000875290580	DG	On-Demand	Anodyne	INHA	67	35
O=C(NCC[C@@H](O)C1CCCC1)NCc1coc2ccccc12	ZINC000875290582	DG	On-Demand	Anodyne	INHA	67	35
COc1ccc(O)c(CNC(=O)NC[C@H]2c3ccccc3CN2C)c1	ZINC000875290587	EE	On-Demand	Clean	MTNR1A	44	39
COc1ccc(O)c(CNC(=O)NC[C@H]2c3ccccc3CN2C)c1	ZINC000875290587	EE	On-Demand	Clean	MTNR1B	40	39
COc1ccc(O)c(CNC(=O)NC[C@@H]2c3ccccc3CN2C)c1	ZINC000875290589	EE	On-Demand	Clean	MTNR1A	44	39
COc1ccc(O)c(CNC(=O)NC[C@@H]2c3ccccc3CN2C)c1	ZINC000875290589	EE	On-Demand	Clean	MTNR1B	40	39
COc1ccc(O)c(CNC(=O)N[C@@H](C)c2ccnn2C)c1	ZINC000875290590	DD	On-Demand	Clean	MTNR1A	31	41
COc1ccc(O)c(CNC(=O)N[C@@H](C)c2ccnn2C)c1	ZINC000875290590	DD	On-Demand	Clean	MTNR1B	28	41
COc1ccc(O)c(CNC(=O)N[C@H](C)c2ccnn2C)c1	ZINC000875290591	DD	On-Demand	Clean	MTNR1A	31	41
COc1ccc(O)c(CNC(=O)N[C@H](C)c2ccnn2C)c1	ZINC000875290591	DD	On-Demand	Clean	MTNR1B	28	41
CCOc1cc(CNC(=O)NC[C@H]2C[C@H](O)C2)ccc1OC	ZINC000875290592	DD	On-Demand	Anodyne	SSTR5	46	41
COc1ccc(O)c(CNC(=O)NC[C@@]2(C)C[C@@H]3C[C@@H]3C2)c1	ZINC000875290597	DF	On-Demand	Clean	MTNR1A	45	44
COc1ccc(O)c(CNC(=O)NC[C@@]2(C)C[C@@H]3C[C@@H]3C2)c1	ZINC000875290597	DF	On-Demand	Clean	MTNR1B	33	44
COc1ccc(O)c(CNC(=O)NCC2(C)C[C@@H]3C[C@H]3C2)c1	ZINC000875290599	DF	On-Demand	Clean	MTNR1A	45	44
COc1ccc(O)c(CNC(=O)NCC2(C)C[C@@H]3C[C@H]3C2)c1	ZINC000875290599	DF	On-Demand	Clean	MTNR1B	33	44
COc1ccc(O)c(CNC(=O)NCC2(C)C[C@H]3C[C@@H]3C2)c1	ZINC000875290601	DF	On-Demand	Clean	MTNR1A	45	44
COc1ccc(O)c(CNC(=O)NCC2(C)C[C@H]3C[C@@H]3C2)c1	ZINC000875290601	DF	On-Demand	Clean	MTNR1B	33	44
O=C(CC(F)(F)C(F)(F)F)Nc1nc(O)c2ccccc2n1	ZINC000875290620	DF	On-Demand	Anodyne	KCNJ11	95	35
O=C(CC(F)(F)C(F)(F)F)Nc1nc(O)c2ccccc2n1	ZINC000875290620	DF	On-Demand	Anodyne	TNKS	47	33
CCOC(=O)[C@@H]1CN(C(=O)NCc2cc(C(C)C)no2)CCC1(F)F	ZINC000875290623	FF	On-Demand	Anodyne	SLC5A7	24	42
CCO[C@@H](C(=O)Nc1nc(O)c2ccccc2n1)C1CCCC1	ZINC000875290645	DF	On-Demand	Anodyne	TNKS	67	40
CCO[C@@H](C(=O)Nc1nc(O)c2ccccc2n1)C1CCCC1	ZINC000875290645	DF	On-Demand	Anodyne	TNKS2	16	40
CCCCCCCNC(=O)C(=O)N[C@H]1CCN(c2ccccn2)C1	ZINC000875290646	ED	On-Demand	Mild	HTR1A	21	43
CCCCCCCNC(=O)C(=O)N[C@H]1CCN(c2ccccn2)C1	ZINC000875290646	ED	On-Demand	Mild	DRD2	21	43
CCCCCCCNC(=O)C(=O)N[C@H]1CCN(c2ccccn2)C1	ZINC000875290646	ED	On-Demand	Mild	DRD4	30	40
CCCCCCCNC(=O)C(=O)N[C@H]1CCN(c2ccccn2)C1	ZINC000875290646	ED	On-Demand	Mild	DRD3	21	43
CCCCCCCNC(=O)C(=O)N[C@H]1CCN(c2ccccn2)C1	ZINC000875290646	ED	On-Demand	Mild	ASAH1	61	32
CCCCCCCNC(=O)C(=O)N[C@@H]1CCN(c2ccccn2)C1	ZINC000875290648	ED	On-Demand	Mild	HTR1A	21	43
CCCCCCCNC(=O)C(=O)N[C@@H]1CCN(c2ccccn2)C1	ZINC000875290648	ED	On-Demand	Mild	DRD2	21	43
CCCCCCCNC(=O)C(=O)N[C@@H]1CCN(c2ccccn2)C1	ZINC000875290648	ED	On-Demand	Mild	DRD4	30	40
CCCCCCCNC(=O)C(=O)N[C@@H]1CCN(c2ccccn2)C1	ZINC000875290648	ED	On-Demand	Mild	DRD3	21	43
CCCCCCCNC(=O)C(=O)N[C@@H]1CCN(c2ccccn2)C1	ZINC000875290648	ED	On-Demand	Mild	ASAH1	61	32
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875290673	FD	On-Demand	Anodyne	HTR1A	56	40
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875290673	FD	On-Demand	Anodyne	DRD2	48	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875290673	FD	On-Demand	Anodyne	DRD4	27	41
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875290673	FD	On-Demand	Anodyne	ADRA1D	55	38
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875290673	FD	On-Demand	Anodyne	ADRA1A	48	38
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875290673	FD	On-Demand	Anodyne	ADRA1B	44	38
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875290673	FD	On-Demand	Anodyne	DRD3	54	41
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875290674	FD	On-Demand	Anodyne	HTR1A	56	40
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875290674	FD	On-Demand	Anodyne	DRD2	48	41
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875290674	FD	On-Demand	Anodyne	DRD4	27	41
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875290674	FD	On-Demand	Anodyne	ADRA1D	55	38
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875290674	FD	On-Demand	Anodyne	ADRA1A	48	38
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875290674	FD	On-Demand	Anodyne	ADRA1B	44	38
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875290674	FD	On-Demand	Anodyne	DRD3	54	41
O=C(NCCOc1cccnc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875290675	EF	On-Demand	Anodyne	EPHX2	22	46
O=C(NCCOc1cccnc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875290676	EF	On-Demand	Anodyne	EPHX2	22	46
COCC1CC(NC(=O)NCc2cc(OC)ccc2O)C1	ZINC000875290677	CD	On-Demand	Clean	MTNR1A	59	47
COCC1CC(NC(=O)NCc2cc(OC)ccc2O)C1	ZINC000875290677	CD	On-Demand	Clean	MTNR1B	47	47
COc1ccc(O)c(CNC(=O)NC[C@@H]2C[C@H](OC)C2)c1	ZINC000875290678	CD	On-Demand	Clean	MTNR1A	58	45
COc1ccc(O)c(CNC(=O)NC[C@@H]2C[C@H](OC)C2)c1	ZINC000875290678	CD	On-Demand	Clean	MTNR1B	45	45
COc1ccc(O)c(CNC(=O)NCC2(C(F)(F)F)CCCC2)c1	ZINC000875290688	EG	On-Demand	Clean	MTNR1A	44	44
COc1ccc(O)c(CNC(=O)NCC2(C(F)(F)F)CCCC2)c1	ZINC000875290688	EG	On-Demand	Clean	MTNR1B	32	44
COc1ccc(O)c(CNC(=O)NCC2([C@@H]3CCCCO3)CCC2)c1	ZINC000875290689	EF	On-Demand	Clean	MTNR1A	30	40
COc1ccc(O)c(CNC(=O)NCC2([C@@H]3CCCCO3)CCC2)c1	ZINC000875290689	EF	On-Demand	Clean	MTNR1B	20	40
COc1ccc(O)c(CNC(=O)NCC2([C@H]3CCCCO3)CCC2)c1	ZINC000875290690	EF	On-Demand	Clean	MTNR1A	30	40
COc1ccc(O)c(CNC(=O)NCC2([C@H]3CCCCO3)CCC2)c1	ZINC000875290690	EF	On-Demand	Clean	MTNR1B	20	40
CCOc1cc(CNC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)ccc1OC	ZINC000875290693	FE	On-Demand	Anodyne	SLC6A4	27	45
CCOc1cc(CNC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)ccc1OC	ZINC000875290693	FE	On-Demand	Anodyne	SLC6A3	53	42
CCOc1cc(CNC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)ccc1OC	ZINC000875290693	FE	On-Demand	Anodyne	SSTR5	64	39
CCOc1cc(CNC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)ccc1OC	ZINC000875290694	FE	On-Demand	Anodyne	SLC6A4	27	45
CCOc1cc(CNC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)ccc1OC	ZINC000875290694	FE	On-Demand	Anodyne	SLC6A3	53	42
CCOc1cc(CNC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)ccc1OC	ZINC000875290694	FE	On-Demand	Anodyne	SSTR5	64	39
COc1ccc(O)c(CNC(=O)NCc2ccccc2CC(F)(F)F)c1	ZINC000875290695	FH	On-Demand	Clean	MTNR1A	59	45
COc1ccc(O)c(CNC(=O)NCc2ccccc2CC(F)(F)F)c1	ZINC000875290695	FH	On-Demand	Clean	MTNR1B	50	45
COc1ccc(O)c(CNC(=O)NCc2c(C(F)(F)F)cnn2C)c1	ZINC000875290698	FE	On-Demand	Clean	MTNR1A	20	40
COc1ccc(O)c(CNC(=O)NCc2c(C(F)(F)F)cnn2C)c1	ZINC000875290698	FE	On-Demand	Clean	MTNR1B	16	40
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@@H](SC)C2)c1	ZINC000875290702	CE	On-Demand	Clean	MTNR1A	52	46
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@@H](SC)C2)c1	ZINC000875290702	CE	On-Demand	Clean	MTNR1B	40	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCOc1cccnc1	ZINC000875290703	DD	On-Demand	Anodyne	SLC6A4	20	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCOc1cccnc1	ZINC000875290703	DD	On-Demand	Anodyne	SLC6A3	37	42
COc1ccc(O)c(CNC(=O)NCc2cccc3c2CCOC3)c1	ZINC000875290724	EE	On-Demand	Clean	DRD4	40	31
COc1ccc(O)c(CNC(=O)NCc2cccc3c2CCOC3)c1	ZINC000875290724	EE	On-Demand	Clean	MTNR1A	63	41
COc1ccc(O)c(CNC(=O)NCc2cccc3c2CCOC3)c1	ZINC000875290724	EE	On-Demand	Clean	MTNR1B	52	41
O=C(Cc1csc(C2CCCC2)n1)Nc1nc(O)c2ccccc2n1	ZINC000875290727	FH	On-Demand	Anodyne	TNKS	58	33
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)c1	ZINC000875290736	DE	On-Demand	Clean	MTNR1A	32	42
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)c1	ZINC000875290736	DE	On-Demand	Clean	MTNR1B	22	42
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)c1	ZINC000875290737	DE	On-Demand	Clean	MTNR1A	32	42
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)c1	ZINC000875290737	DE	On-Demand	Clean	MTNR1B	22	42
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)c1	ZINC000875290738	DE	On-Demand	Clean	MTNR1A	32	42
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)c1	ZINC000875290738	DE	On-Demand	Clean	MTNR1B	22	42
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)c1	ZINC000875290739	DE	On-Demand	Clean	MTNR1A	32	42
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)c1	ZINC000875290739	DE	On-Demand	Clean	MTNR1B	22	42
O=C(NCCOc1cccnc1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875290740	EE	On-Demand	Anodyne	EPHX2	16	54
O=C(NCCOc1cccnc1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875290741	EE	On-Demand	Anodyne	EPHX2	16	54
C[C@@H](CCNC(=O)C(=O)NCc1cccc2ncccc12)N1CCCCC1	ZINC000875290760	FE	On-Demand	Anodyne	HNMT	46	35
CC[C@H](C[C@H](C)O)NC(=O)NCc1coc2ccccc12	ZINC000875290774	CF	On-Demand	Anodyne	ANPEP	17	45
CCCCCCCNC(=O)C(=O)NCc1ccc(S(C)(=O)=O)s1	ZINC000875290800	FD	On-Demand	Mild	ASAH1	88	35
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2coc3ccccc23)C1	ZINC000875290808	EF	On-Demand	Anodyne	INHA	51	33
CC[C@@H]1COCCN1CCNC(=O)NCc1cc(C(C)C)no1	ZINC000875290823	DD	On-Demand	Anodyne	SLC5A7	24	42
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3cc(C(C)C)no3)C[C@@H]1C2	ZINC000875290860	DD	On-Demand	Anodyne	SLC5A7	25	43
O=C(N[C@H]1CCc2ccccc2OC1)C(=O)N[C@@H](c1ccccn1)C1CCC1	ZINC000875290869	GF	On-Demand	Anodyne	TTK	20	40
O=C(N[C@H]1CCc2ccccc2OC1)C(=O)N[C@H](c1ccccn1)C1CCC1	ZINC000875290870	GF	On-Demand	Anodyne	TTK	20	40
O=C(N[C@H](c1ccccn1)C1CCC1)C(=O)N[C@@H]1CCc2ccccc2OC1	ZINC000875290871	GF	On-Demand	Anodyne	TTK	20	40
O=C(N[C@@H]1CCc2ccccc2OC1)C(=O)N[C@@H](c1ccccn1)C1CCC1	ZINC000875290872	GF	On-Demand	Anodyne	TTK	20	40
O=C(NCc1coc2ccccc12)N1CCC[C@H](OC2CCC2)CC1	ZINC000875290891	EI	On-Demand	Anodyne	EPHX2	25	45
O=C(NCc1coc2ccccc12)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875290892	EI	On-Demand	Anodyne	EPHX2	25	45
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCCN(c2ccccc2)C1=O	ZINC000875290895	EE	On-Demand	Anodyne	RIR1_HHV11	20	42
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCCN(c2ccccc2)C1=O	ZINC000875290895	EE	On-Demand	Anodyne	XIAP	64	39
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCCN(c2ccccc2)C1=O	ZINC000875290895	EE	On-Demand	Anodyne	BIRC3	41	39
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCCN(c2ccccc2)C1=O	ZINC000875290895	EE	On-Demand	Anodyne	BIRC2	55	39
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCCN(c2ccccc2)C1=O	ZINC000875290896	EE	On-Demand	Anodyne	RIR1_HHV11	20	42
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCCN(c2ccccc2)C1=O	ZINC000875290896	EE	On-Demand	Anodyne	XIAP	64	39
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCCN(c2ccccc2)C1=O	ZINC000875290896	EE	On-Demand	Anodyne	BIRC3	41	39
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCCN(c2ccccc2)C1=O	ZINC000875290896	EE	On-Demand	Anodyne	BIRC2	55	39
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCC[C@H](C)N2CCCCC2)c1	ZINC000875290901	FE	On-Demand	Anodyne	CCR5	23	41
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCC[C@@H](C)N2CCCCC2)c1	ZINC000875290902	FE	On-Demand	Anodyne	CCR5	23	41
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCC[C@@H](C)N2CCCCC2)c1	ZINC000875290903	FE	On-Demand	Anodyne	CCR5	23	41
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCC[C@H](C)N2CCCCC2)c1	ZINC000875290904	FE	On-Demand	Anodyne	CCR5	23	41
O=C(NCc1coc2ccccc12)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875290915	EG	On-Demand	Anodyne	INHA	44	33
CCC1(CC)CCCN1C(=O)NCc1cc(C(C)C)no1	ZINC000875290916	CH	On-Demand	Anodyne	SLC5A7	24	41
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2CCCN(c3ccccc3)C2=O)CC1	ZINC000875290945	GD	On-Demand	Anodyne	EPHX2	19	43
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2CCCN(c3ccccc3)C2=O)CC1	ZINC000875290945	GD	On-Demand	Anodyne	WNT3	40	31
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2CCCN(c3ccccc3)C2=O)CC1	ZINC000875290946	GD	On-Demand	Anodyne	EPHX2	19	43
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2CCCN(c3ccccc3)C2=O)CC1	ZINC000875290946	GD	On-Demand	Anodyne	WNT3	40	31
COc1cc(C)ccc1CNC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875290977	GF	On-Demand	Anodyne	PDE4A	19	41
COc1cc(C)ccc1CNC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875290978	GF	On-Demand	Anodyne	PDE4A	19	41
O=CN1CCCN(C(=O)N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875290979	GE	On-Demand	Anodyne	DRD4	24	57
O=CN1CCCN(C(=O)N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875290979	GE	On-Demand	Anodyne	SIGMAR1	23	54
O=CN1CCCN(C(=O)N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875290979	GE	On-Demand	Anodyne	CCR3	32	51
O=CN1CCCN(C(=O)N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875290979	GE	On-Demand	Anodyne	MLNR	41	48
O=CN1CCCN(C(=O)N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875290979	GE	On-Demand	Anodyne	CCR2	38	47
O=CN1CCCN(C(=O)N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875290979	GE	On-Demand	Anodyne	SLC6A5	33	46
O=CN1CCCN(C(=O)N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875290979	GE	On-Demand	Anodyne	MCHR1	44	51
O=CN1CCCN(C(=O)N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875290979	GE	On-Demand	Anodyne	BIRC2	18	40
O=CN1CCCN(C(=O)N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875290980	GE	On-Demand	Anodyne	DRD4	24	57
O=CN1CCCN(C(=O)N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875290980	GE	On-Demand	Anodyne	SIGMAR1	23	54
O=CN1CCCN(C(=O)N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875290980	GE	On-Demand	Anodyne	CCR3	32	51
O=CN1CCCN(C(=O)N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875290980	GE	On-Demand	Anodyne	MLNR	41	48
O=CN1CCCN(C(=O)N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875290980	GE	On-Demand	Anodyne	CCR2	38	47
O=CN1CCCN(C(=O)N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875290980	GE	On-Demand	Anodyne	SLC6A5	33	46
O=CN1CCCN(C(=O)N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875290980	GE	On-Demand	Anodyne	MCHR1	44	51
O=CN1CCCN(C(=O)N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875290980	GE	On-Demand	Anodyne	BIRC2	18	40
COCCN(CC1CCN(C)CC1)C(=O)NCc1cc(C(C)C)no1	ZINC000875290987	FE	On-Demand	Anodyne	SLC5A7	29	53
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875291051	GG	On-Demand	Anodyne	DRD4	27	58
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875291051	GG	On-Demand	Anodyne	SIGMAR1	24	54
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875291051	GG	On-Demand	Anodyne	CCR3	35	45
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875291051	GG	On-Demand	Anodyne	UTS2R	21	42
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875291051	GG	On-Demand	Anodyne	MLNR	57	52
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875291051	GG	On-Demand	Anodyne	CCR2	41	51
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875291051	GG	On-Demand	Anodyne	SLC6A5	38	46
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875291051	GG	On-Demand	Anodyne	EPHX2	30	47
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875291051	GG	On-Demand	Anodyne	CXCR3	16	40
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875291051	GG	On-Demand	Anodyne	MCHR1	59	59
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875291051	GG	On-Demand	Anodyne	CACNA1G	42	44
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875291051	GG	On-Demand	Anodyne	BIRC2	21	42
CC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875291052	GG	On-Demand	Anodyne	DRD4	27	58
CC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875291052	GG	On-Demand	Anodyne	SIGMAR1	24	54
CC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875291052	GG	On-Demand	Anodyne	CCR3	35	45
CC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875291052	GG	On-Demand	Anodyne	UTS2R	21	42
CC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875291052	GG	On-Demand	Anodyne	MLNR	57	52
CC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875291052	GG	On-Demand	Anodyne	CCR2	41	51
CC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875291052	GG	On-Demand	Anodyne	SLC6A5	38	46
CC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875291052	GG	On-Demand	Anodyne	EPHX2	30	47
CC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875291052	GG	On-Demand	Anodyne	CXCR3	16	40
CC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875291052	GG	On-Demand	Anodyne	MCHR1	59	59
CC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875291052	GG	On-Demand	Anodyne	CACNA1G	42	44
CC(=O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000875291052	GG	On-Demand	Anodyne	BIRC2	21	42
CC[C@@H]1COCCN1CCNC(=O)NCc1coc2ccccc12	ZINC000875291066	EE	On-Demand	Anodyne	INHA	62	33
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(c3ccccc3)C2=O)C1	ZINC000875291074	FE	On-Demand	Anodyne	ACE	61	44
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(c3ccccc3)C2=O)C1	ZINC000875291074	FE	On-Demand	Anodyne	P2RY12	48	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(c3ccccc3)C2=O)C1	ZINC000875291074	FE	On-Demand	Anodyne	XIAP	53	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(c3ccccc3)C2=O)C1	ZINC000875291074	FE	On-Demand	Anodyne	BIRC2	67	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(c3ccccc3)C2=O)C1	ZINC000875291075	FE	On-Demand	Anodyne	ACE	61	44
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(c3ccccc3)C2=O)C1	ZINC000875291075	FE	On-Demand	Anodyne	P2RY12	48	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(c3ccccc3)C2=O)C1	ZINC000875291075	FE	On-Demand	Anodyne	XIAP	53	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(c3ccccc3)C2=O)C1	ZINC000875291075	FE	On-Demand	Anodyne	BIRC2	67	37
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cc(C(C)C)no2)C1	ZINC000875291082	DE	On-Demand	Anodyne	SLC5A7	25	44
CC(=O)N(C)c1ccc(CNC(=O)N[C@H]2CCCN(c3ccccc3)C2=O)cc1	ZINC000875291093	GF	On-Demand	Anodyne	PLG	55	32
CC(=O)N(C)c1ccc(CNC(=O)N[C@H]2CCCN(c3ccccc3)C2=O)cc1	ZINC000875291093	GF	On-Demand	Anodyne	TRYP_PIG	48	32
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H]2CCCN(c3ccccc3)C2=O)cc1	ZINC000875291094	GF	On-Demand	Anodyne	PLG	55	32
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H]2CCCN(c3ccccc3)C2=O)cc1	ZINC000875291094	GF	On-Demand	Anodyne	TRYP_PIG	48	32
O=C(NCCO)C1CCN(C(=O)NCc2coc3ccccc23)CC1	ZINC000875291112	ED	On-Demand	Anodyne	INHA	57	39
O=C(NCCO)C1CCN(C(=O)NCc2coc3ccccc23)CC1	ZINC000875291112	ED	On-Demand	Anodyne	MTNR1A	19	44
O=C(NCCO)C1CCN(C(=O)NCc2coc3ccccc23)CC1	ZINC000875291112	ED	On-Demand	Anodyne	EPHX2	26	47
COc1cc(C)ccc1CNC(=O)C(=O)NC[C@@H]1c2ccccc2CN1C	ZINC000875291152	FD	On-Demand	Anodyne	DRD3	16	40
COc1cc(C)ccc1CNC(=O)C(=O)NC[C@H]1c2ccccc2CN1C	ZINC000875291153	FD	On-Demand	Anodyne	DRD3	16	40
O=C1CCN(C(=O)C(=O)N[C@H]2CCc3ccccc3OC2)CCCCCCN1	ZINC000875291166	GD	On-Demand	Anodyne	GHRL	40	35
O=C1CCN(C(=O)C(=O)N[C@@H]2CCc3ccccc3OC2)CCCCCCN1	ZINC000875291167	GD	On-Demand	Anodyne	GHRL	40	35
C[C@@H](CCNC(=O)C(=O)NCc1ccc(Br)cn1)N1CCCCC1	ZINC000875291196	GD	On-Demand	Anodyne	CCR5	18	41
COc1cc(C)ccc1CNC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875291235	GE	On-Demand	Anodyne	SIRT3	40	30
COc1cc(C)ccc1CNC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875291235	GE	On-Demand	Anodyne	SIRT2	45	32
COc1cc(C)ccc1CNC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875291235	GE	On-Demand	Anodyne	SIRT1	41	32
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875291251	FE	On-Demand	Reactive	DRD4	30	57
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875291251	FE	On-Demand	Reactive	CHRM3	18	41
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875291251	FE	On-Demand	Reactive	LTA4H	22	42
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875291251	FE	On-Demand	Reactive	SIGMAR1	29	54
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875291251	FE	On-Demand	Reactive	SSTR5	37	40
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875291251	FE	On-Demand	Reactive	CCR3	35	44
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875291251	FE	On-Demand	Reactive	CCR5	21	42
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875291251	FE	On-Demand	Reactive	UTS2R	22	44
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875291251	FE	On-Demand	Reactive	MLNR	42	44
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875291251	FE	On-Demand	Reactive	CCR2	36	51
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875291251	FE	On-Demand	Reactive	SLC6A5	41	51
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875291251	FE	On-Demand	Reactive	EPHX2	27	42
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875291251	FE	On-Demand	Reactive	MCHR1	70	46
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875291251	FE	On-Demand	Reactive	CACNA1G	43	38
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875291251	FE	On-Demand	Reactive	BIRC2	23	40
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875291252	FE	On-Demand	Reactive	DRD4	30	57
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875291252	FE	On-Demand	Reactive	CHRM3	18	41
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875291252	FE	On-Demand	Reactive	LTA4H	22	42
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875291252	FE	On-Demand	Reactive	SIGMAR1	29	54
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875291252	FE	On-Demand	Reactive	SSTR5	37	40
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875291252	FE	On-Demand	Reactive	CCR3	35	44
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875291252	FE	On-Demand	Reactive	CCR5	21	42
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875291252	FE	On-Demand	Reactive	UTS2R	22	44
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875291252	FE	On-Demand	Reactive	MLNR	42	44
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875291252	FE	On-Demand	Reactive	CCR2	36	51
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875291252	FE	On-Demand	Reactive	SLC6A5	41	51
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875291252	FE	On-Demand	Reactive	EPHX2	27	42
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875291252	FE	On-Demand	Reactive	MCHR1	70	46
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875291252	FE	On-Demand	Reactive	CACNA1G	43	38
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000875291252	FE	On-Demand	Reactive	BIRC2	23	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC(C)(C)c1cccs1	ZINC000875291261	EF	On-Demand	Anodyne	SLC6A3	39	42
Cc1ccc(C(=O)N2CCSCC2)cc1NC(=O)[C@]12CCCC[C@H]1C2	ZINC000875291264	FH	On-Demand	Anodyne	MAPK11	20	40
Cc1ccc(C(=O)N2CCSCC2)cc1NC(=O)[C@@]12CCCC[C@H]1C2	ZINC000875291265	FH	On-Demand	Anodyne	MAPK11	20	40
Cc1ccc(C(=O)N2CCSCC2)cc1NC(=O)[C@@]12CCCC[C@@H]1C2	ZINC000875291266	FH	On-Demand	Anodyne	MAPK11	20	40
Cc1ccc(C(=O)N2CCSCC2)cc1NC(=O)[C@]12CCCC[C@@H]1C2	ZINC000875291267	FH	On-Demand	Anodyne	MAPK11	20	40
CN(C)C[C@@H]1CN(C(=O)NCc2coc3ccccc23)C[C@H]1CN(C)C	ZINC000875291270	FE	On-Demand	Anodyne	INHA	45	31
O=C(N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875291271	GD	On-Demand	Anodyne	DRD4	25	56
O=C(N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875291271	GD	On-Demand	Anodyne	SIGMAR1	21	53
O=C(N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875291271	GD	On-Demand	Anodyne	CCR3	23	45
O=C(N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875291271	GD	On-Demand	Anodyne	MLNR	21	41
O=C(N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875291271	GD	On-Demand	Anodyne	CCR2	59	47
O=C(N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875291271	GD	On-Demand	Anodyne	SLC6A5	34	48
O=C(N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875291271	GD	On-Demand	Anodyne	MCHR1	46	48
CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)NCCN2CC[C@H](O)C2)C1	ZINC000875291293	FC	On-Demand	Anodyne	CACNA1H	15	43
CC(C)(C)OC(=O)N1CCC[C@@H](NC(=O)NCCN2CC[C@H](O)C2)C1	ZINC000875291294	FC	On-Demand	Anodyne	CACNA1H	15	43
CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)NCCN2CC[C@@H](O)C2)C1	ZINC000875291295	FC	On-Demand	Anodyne	CACNA1H	15	43
CC(C)(C)OC(=O)N1CCC[C@@H](NC(=O)NCCN2CC[C@@H](O)C2)C1	ZINC000875291296	FC	On-Demand	Anodyne	CACNA1H	15	43
CC[C@@H](NC(=O)NCCc1ccc(O)c(OC)c1)[C@@H](O)c1ccccc1	ZINC000875291378	FF	On-Demand	Anodyne	MTNR1A	19	50
CC[C@@H](NC(=O)NCCc1ccc(O)c(OC)c1)[C@@H](O)c1ccccc1	ZINC000875291378	FF	On-Demand	Anodyne	MTNR1B	19	50
CC[C@@H](NC(=O)NCCc1ccc(O)c(OC)c1)[C@@H](O)c1ccccc1	ZINC000875291378	FF	On-Demand	Anodyne	NCE103	16	43
CC[C@@H](NC(=O)NCCc1ccc(O)c(OC)c1)[C@H](O)c1ccccc1	ZINC000875291381	FF	On-Demand	Anodyne	MTNR1A	19	50
CC[C@@H](NC(=O)NCCc1ccc(O)c(OC)c1)[C@H](O)c1ccccc1	ZINC000875291381	FF	On-Demand	Anodyne	MTNR1B	19	50
CC[C@@H](NC(=O)NCCc1ccc(O)c(OC)c1)[C@H](O)c1ccccc1	ZINC000875291381	FF	On-Demand	Anodyne	NCE103	16	43
C#CCOc1ccccc1CNC(=O)N1CCC[C@](O)(CC)C1	ZINC000875291382	DE	On-Demand	Mild	HCN1	42	32
C#CCOc1ccccc1CNC(=O)N1CCC[C@@](O)(CC)C1	ZINC000875291383	DE	On-Demand	Mild	HCN1	42	32
O=C(NC[C@H]1CCCN1Cc1ccccc1)N[C@@H]1CCOC[C@H]1O	ZINC000875291388	ED	On-Demand	Anodyne	DRD2	34	47
O=C(NC[C@H]1CCCN1Cc1ccccc1)N[C@@H]1CCOC[C@H]1O	ZINC000875291388	ED	On-Demand	Anodyne	SIGMAR1	19	48
C#CCOc1ccccc1CNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875291394	ED	On-Demand	Mild	HCN1	46	31
C#CCOc1ccccc1CNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875291394	ED	On-Demand	Mild	HCN4	40	31
Cc1nnc(NNC(=O)NC[C@@H]2CCCN2Cc2ccccc2)n1C	ZINC000875291418	ED	On-Demand	Reactive	DRD2	37	47
Cc1nnc(NNC(=O)NC[C@@H]2CCCN2Cc2ccccc2)n1C	ZINC000875291418	ED	On-Demand	Reactive	SIGMAR1	16	46
Cc1nnc(NNC(=O)NC[C@@H]2CCCN2Cc2ccccc2)n1C	ZINC000875291418	ED	On-Demand	Reactive	ACKR3	51	33
Cc1nnc(NNC(=O)NC[C@H]2CCCN2Cc2ccccc2)n1C	ZINC000875291419	ED	On-Demand	Reactive	DRD2	37	47
Cc1nnc(NNC(=O)NC[C@H]2CCCN2Cc2ccccc2)n1C	ZINC000875291419	ED	On-Demand	Reactive	SIGMAR1	16	46
Cc1nnc(NNC(=O)NC[C@H]2CCCN2Cc2ccccc2)n1C	ZINC000875291419	ED	On-Demand	Reactive	ACKR3	51	33
COC(=O)CCCOc1ccc(CNC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875291420	GF	On-Demand	Clean	LTA4H	19	42
COC(=O)CCCOc1ccc(CNC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875291420	GF	On-Demand	Clean	NAMPT	23	43
COCC(C)(C)CCNC(=O)NCCc1ccc(O)c(OC)c1	ZINC000875291421	DE	On-Demand	Anodyne	TRPV1	24	48
COCC(C)(C)CCNC(=O)NCCc1ccc(O)c(OC)c1	ZINC000875291421	DE	On-Demand	Anodyne	NCE103	19	50
O=CN1CCCN(C(=O)NCCc2nc(-c3cccc(Cl)c3)no2)CC1	ZINC000875291433	GD	On-Demand	Anodyne	GRM5	17	48
COCC1CC(NC(=O)NCCc2ccc(O)c(OC)c2)C1	ZINC000875291460	DD	On-Demand	Anodyne	MTNR1A	17	54
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)C1	ZINC000875291471	FE	On-Demand	Anodyne	ACE	45	42
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)C1	ZINC000875291471	FE	On-Demand	Anodyne	DRD2	41	47
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)C1	ZINC000875291471	FE	On-Demand	Anodyne	SIGMAR1	20	48
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCCN2Cc2ccccc2)C1	ZINC000875291474	FE	On-Demand	Anodyne	ACE	45	42
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCCN2Cc2ccccc2)C1	ZINC000875291474	FE	On-Demand	Anodyne	DRD2	41	47
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCCN2Cc2ccccc2)C1	ZINC000875291474	FE	On-Demand	Anodyne	SIGMAR1	20	48
C#CCOc1ccccc1CNC(=O)N[C@H](CC)C[C@H](C)O	ZINC000875291479	DE	On-Demand	Mild	ANPEP	17	46
C#CCOc1ccccc1CNC(=O)N[C@@H](CC)C[C@@H](C)O	ZINC000875291480	DE	On-Demand	Mild	ANPEP	17	46
C#CCOc1ccccc1CNC(=O)N[C@H](CC)C[C@@H](C)O	ZINC000875291481	DE	On-Demand	Mild	ANPEP	17	46
C#CCOc1ccccc1CNC(=O)N[C@@H](CC)C[C@H](C)O	ZINC000875291482	DE	On-Demand	Mild	ANPEP	17	46
Cn1nc(Cl)c(C(=O)NC(C)(C)c2cccc(C(F)(F)F)c2)c1Cl	ZINC000875291491	GI	On-Demand	Anodyne	IMDH_CRYPV	45	38
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000875291493	EE	On-Demand	Anodyne	RIR1_HHV11	45	33
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000875291496	EE	On-Demand	Anodyne	RIR1_HHV11	45	33
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1CCCN1Cc1ccccc1	ZINC000875291516	DD	On-Demand	Anodyne	DRD2	38	50
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1CCCN1Cc1ccccc1	ZINC000875291516	DD	On-Demand	Anodyne	ACHE	20	40
O=C(NC[C@H]1C[C@H](O)C1)NC[C@H]1CCCN1Cc1ccccc1	ZINC000875291516	DD	On-Demand	Anodyne	SIGMAR1	34	51
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000875291517	DD	On-Demand	Anodyne	DRD2	38	50
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000875291517	DD	On-Demand	Anodyne	ACHE	20	40
O=C(NC[C@H]1C[C@H](O)C1)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000875291517	DD	On-Demand	Anodyne	SIGMAR1	34	51
C#CCOc1ccccc1CNC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875291537	EE	On-Demand	Mild	EPHX2	18	49
C#CCOc1ccccc1CNC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875291538	EE	On-Demand	Mild	EPHX2	18	49
O=C(NCCO)C1CCN(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)CC1	ZINC000875291551	GD	On-Demand	Anodyne	DRD2	29	45
O=C(NCCO)C1CCN(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)CC1	ZINC000875291551	GD	On-Demand	Anodyne	SIGMAR1	17	46
O=C(NCCO)C1CCN(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)CC1	ZINC000875291551	GD	On-Demand	Anodyne	CACNA1G	25	40
O=C(NCCO)C1CCN(C(=O)NC[C@H]2CCCN2Cc2ccccc2)CC1	ZINC000875291552	GD	On-Demand	Anodyne	DRD2	29	45
O=C(NCCO)C1CCN(C(=O)NC[C@H]2CCCN2Cc2ccccc2)CC1	ZINC000875291552	GD	On-Demand	Anodyne	SIGMAR1	17	46
O=C(NCCO)C1CCN(C(=O)NC[C@H]2CCCN2Cc2ccccc2)CC1	ZINC000875291552	GD	On-Demand	Anodyne	CACNA1G	25	40
COCCN(CC1CCN(C)CC1)C(=O)NCCc1ccc(O)c(OC)c1	ZINC000875291597	GD	On-Demand	Anodyne	ACKR3	63	33
COc1ccc([C@@H]2CN(C(=O)NCCc3ccc(O)c(OC)c3)CCO2)cc1	ZINC000875291646	GF	On-Demand	Anodyne	MTNR1B	15	44
Cc1nnc(NNC(=O)N[C@@H](CN2CCCCC2)c2ccccc2)n1C	ZINC000875291678	FD	On-Demand	Reactive	CCR5	25	43
Cc1nnc(NNC(=O)N[C@H](CN2CCCCC2)c2ccccc2)n1C	ZINC000875291679	FD	On-Demand	Reactive	CCR5	25	43
CC(=O)Nc1ccc2c(COC(=O)CCCOc3ccccc3C)cc(=O)oc2c1	ZINC000875291680	HH	On-Demand	Anodyne	MAOB	27	41
O=C(N[C@@H](CN1CCCCC1)c1ccccc1)N1CCC2(CCNC2=O)CC1	ZINC000875291700	GF	On-Demand	Anodyne	CACNA1H	29	41
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)C1	ZINC000875291703	EC	On-Demand	Anodyne	DRD2	45	52
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)C1	ZINC000875291703	EC	On-Demand	Anodyne	LTA4H	20	41
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)C1	ZINC000875291703	EC	On-Demand	Anodyne	SIGMAR1	33	55
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)C1	ZINC000875291703	EC	On-Demand	Anodyne	SLC12A5	43	35
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCCN2Cc2ccccc2)C1	ZINC000875291704	EC	On-Demand	Anodyne	DRD2	45	52
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCCN2Cc2ccccc2)C1	ZINC000875291704	EC	On-Demand	Anodyne	LTA4H	20	41
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCCN2Cc2ccccc2)C1	ZINC000875291704	EC	On-Demand	Anodyne	SIGMAR1	33	55
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCCN2Cc2ccccc2)C1	ZINC000875291704	EC	On-Demand	Anodyne	SLC12A5	43	35
O=C(N[C@H](CN1CCCCC1)c1ccccc1)N1CCC2(CCNC2=O)CC1	ZINC000875291707	GF	On-Demand	Anodyne	CACNA1H	29	41
CONC(=O)C1CCN(C(=O)N[C@@H](CN2CCCCC2)c2ccccc2)CC1	ZINC000875291709	GE	On-Demand	Anodyne	CCR5	32	42
CONC(=O)C1CCN(C(=O)N[C@@H](CN2CCCCC2)c2ccccc2)CC1	ZINC000875291709	GE	On-Demand	Anodyne	AMY2	47	33
CONC(=O)C1CCN(C(=O)N[C@H](CN2CCCCC2)c2ccccc2)CC1	ZINC000875291712	GE	On-Demand	Anodyne	CCR5	32	42
CONC(=O)C1CCN(C(=O)N[C@H](CN2CCCCC2)c2ccccc2)CC1	ZINC000875291712	GE	On-Demand	Anodyne	AMY2	47	33
O=CN1CCCN(C(=O)NC[C@H]2CCCN2Cc2ccccc2)CC1	ZINC000875291733	ED	On-Demand	Anodyne	DRD2	36	47
O=CN1CCCN(C(=O)NC[C@H]2CCCN2Cc2ccccc2)CC1	ZINC000875291733	ED	On-Demand	Anodyne	SIGMAR1	25	48
O=CN1CCCN(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)CC1	ZINC000875291735	ED	On-Demand	Anodyne	DRD2	36	47
O=CN1CCCN(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)CC1	ZINC000875291735	ED	On-Demand	Anodyne	SIGMAR1	25	48
O=C(NNc1cccc(F)c1Cl)NC1CCN(C[C@H]2CCCO2)CC1	ZINC000875291759	FF	On-Demand	Reactive	SIGMAR1	15	40
O=C(NNc1cccc(F)c1Cl)NC1CCN(C[C@@H]2CCCO2)CC1	ZINC000875291762	FF	On-Demand	Reactive	SIGMAR1	15	40
C#CCOc1ccccc1CNC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875291763	FG	On-Demand	Mild	EPHX2	27	54
C#CCOc1ccccc1CNC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875291764	FG	On-Demand	Mild	EPHX2	27	54
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875291765	GE	On-Demand	Anodyne	SIGMAR1	19	44
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875291765	GE	On-Demand	Anodyne	EPHX2	25	40
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875291767	GE	On-Demand	Anodyne	SIGMAR1	19	44
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875291767	GE	On-Demand	Anodyne	EPHX2	25	40
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875291769	GE	On-Demand	Anodyne	SIGMAR1	19	44
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875291769	GE	On-Demand	Anodyne	EPHX2	25	40
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875291771	GE	On-Demand	Anodyne	SIGMAR1	19	44
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875291771	GE	On-Demand	Anodyne	EPHX2	25	40
O=C(NC[C@H]1CCCN1Cc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875291781	FD	On-Demand	Anodyne	DRD2	36	48
O=C(NC[C@H]1CCCN1Cc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875291781	FD	On-Demand	Anodyne	SIGMAR1	32	48
C#CC[C@H](COC)NC(=O)NCCc1ccc(O)c(OC)c1	ZINC000875291825	DD	On-Demand	Mild	TRPV1	15	44
C#CC[C@@H](COC)NC(=O)NCCc1ccc(O)c(OC)c1	ZINC000875291826	DD	On-Demand	Mild	TRPV1	15	44
COc1ccccc1[C@H]1CCCN(C(=O)NCCn2cccn2)CC1	ZINC000875291846	EF	On-Demand	Anodyne	DRD2	26	46
COc1ccccc1[C@H]1CCCN(C(=O)NCCn2cccn2)CC1	ZINC000875291846	EF	On-Demand	Anodyne	DRD4	15	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCCn2cccn2)CC1	ZINC000875291847	EF	On-Demand	Anodyne	DRD2	26	46
COc1ccccc1[C@@H]1CCCN(C(=O)NCCn2cccn2)CC1	ZINC000875291847	EF	On-Demand	Anodyne	DRD4	15	42
CC[C@H](NC(=O)c1c(Cl)nn(C)c1Cl)c1nc2ccccc2[nH]1	ZINC000875291848	FG	On-Demand	Anodyne	TACR3	52	42
C#CCOc1ccccc1CNC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875291853	FC	On-Demand	Mild	EPHX2	24	47
COC(=O)CCCOc1ccc(CNC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875291858	GD	On-Demand	Anodyne	LTA4H	24	41
CC[C@H](C[C@H](C)O)NC(=O)NCCc1ccc(O)c(OC)c1	ZINC000875291896	DD	On-Demand	Anodyne	TRPV1	18	48
CC[C@@H](NC(=O)NCCc1ccc(O)c(OC)c1)c1cccc(OC)c1OC	ZINC000875291899	GG	On-Demand	Anodyne	MTNR1A	21	47
COC(=O)CCCOc1ccc(CNC(=O)NC2(C)CC(F)(F)C2)cc1	ZINC000875291931	FG	On-Demand	Anodyne	LTA4H	16	41
CC(=O)C1CCN(C(=O)N[C@@H](CN2CCCCC2)c2ccccc2)CC1	ZINC000875292009	FG	On-Demand	Anodyne	SLC6A1	38	40
CC(=O)C1CCN(C(=O)N[C@@H](CN2CCCCC2)c2ccccc2)CC1	ZINC000875292009	FG	On-Demand	Anodyne	OPRK1	28	40
CC(=O)C1CCN(C(=O)N[C@@H](CN2CCCCC2)c2ccccc2)CC1	ZINC000875292009	FG	On-Demand	Anodyne	CCR5	39	44
CC(=O)C1CCN(C(=O)N[C@@H](CN2CCCCC2)c2ccccc2)CC1	ZINC000875292009	FG	On-Demand	Anodyne	BIRC2	24	40
CC(=O)C1CCN(C(=O)N[C@H](CN2CCCCC2)c2ccccc2)CC1	ZINC000875292010	FG	On-Demand	Anodyne	SLC6A1	38	40
CC(=O)C1CCN(C(=O)N[C@H](CN2CCCCC2)c2ccccc2)CC1	ZINC000875292010	FG	On-Demand	Anodyne	OPRK1	28	40
CC(=O)C1CCN(C(=O)N[C@H](CN2CCCCC2)c2ccccc2)CC1	ZINC000875292010	FG	On-Demand	Anodyne	CCR5	39	44
CC(=O)C1CCN(C(=O)N[C@H](CN2CCCCC2)c2ccccc2)CC1	ZINC000875292010	FG	On-Demand	Anodyne	BIRC2	24	40
COC(=O)C1(O)CN(C(=O)N[C@@H](CN2CCCCC2)c2ccccc2)C1	ZINC000875292043	FD	On-Demand	Anodyne	OPRK1	17	41
COC(=O)C1(O)CN(C(=O)N[C@H](CN2CCCCC2)c2ccccc2)C1	ZINC000875292044	FD	On-Demand	Anodyne	OPRK1	17	41
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CCN(c2cccc(F)c2)CC1	ZINC000875292056	GE	On-Demand	Anodyne	CCR3	37	45
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CCN(c2cccc(F)c2)CC1	ZINC000875292057	GE	On-Demand	Anodyne	CCR3	37	45
COC(=O)CCCOc1ccc(CNC(=O)NC[C@H]2C[C@H](O)C2)cc1	ZINC000875292072	FD	On-Demand	Anodyne	LTA4H	18	41
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000875292085	EE	On-Demand	Anodyne	DRD2	37	46
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000875292085	EE	On-Demand	Anodyne	SIGMAR1	20	47
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000875292086	EE	On-Demand	Anodyne	DRD2	37	46
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000875292086	EE	On-Demand	Anodyne	SIGMAR1	20	47
C#CCOc1ccccc1CNC(=O)N(CCOC)CC1CCN(C)CC1	ZINC000875292139	FE	On-Demand	Mild	ACKR3	62	32
C#CCOc1ccccc1CNC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875292148	FF	On-Demand	Mild	EPHX2	20	51
C#CCOc1ccccc1CNC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875292149	FF	On-Demand	Mild	EPHX2	20	51
C#CCOc1ccccc1CNC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875292159	DE	On-Demand	Mild	EPHX2	18	51
C#CCOc1ccccc1CNC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875292160	DE	On-Demand	Mild	EPHX2	18	51
COC(=O)N(C)NC(=O)N[C@@H](CN1CCCCC1)c1ccccc1	ZINC000875292197	EE	On-Demand	Reactive	OPRK1	29	44
COC(=O)N(C)NC(=O)N[C@H](CN1CCCCC1)c1ccccc1	ZINC000875292198	EE	On-Demand	Reactive	OPRK1	29	44
CNC(=O)C[C@H](NC(=O)C(=O)N1CCC(C(C)=O)CC1)c1ccccc1	ZINC000875292199	FC	On-Demand	Anodyne	CCR5	26	41
CNC(=O)C[C@@H](NC(=O)C(=O)N1CCC(C(C)=O)CC1)c1ccccc1	ZINC000875292200	FC	On-Demand	Anodyne	CCR5	26	41
O=C(NCCn1cccn1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875292207	ED	On-Demand	Anodyne	FAAH	21	44
Cc1cccc(NC(=O)[C@H](C)OC(=O)CCCOc2ccccc2C)c1	ZINC000875292229	FI	On-Demand	Anodyne	KCNK3	79	40
Cc1cccc(NC(=O)[C@H](C)OC(=O)CCCOc2ccccc2C)c1	ZINC000875292229	FI	On-Demand	Anodyne	KCNK9	76	39
Cc1cccc(NC(=O)[C@@H](C)OC(=O)CCCOc2ccccc2C)c1	ZINC000875292230	FI	On-Demand	Anodyne	KCNK3	79	40
Cc1cccc(NC(=O)[C@@H](C)OC(=O)CCCOc2ccccc2C)c1	ZINC000875292230	FI	On-Demand	Anodyne	KCNK9	76	39
CNC(=O)C[C@H](NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1)c1ccccc1	ZINC000875292237	FC	On-Demand	Anodyne	CCR5	32	42
CNC(=O)C[C@H](NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1)c1ccccc1	ZINC000875292238	FC	On-Demand	Anodyne	CCR5	32	42
CNC(=O)C[C@@H](NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1)c1ccccc1	ZINC000875292239	FC	On-Demand	Anodyne	CCR5	32	42
CNC(=O)C[C@@H](NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1)c1ccccc1	ZINC000875292240	FC	On-Demand	Anodyne	CCR5	32	42
CC(C)(C)OC(=O)N1CCC[C@@H](NC(=O)NC2CN(c3ccncn3)C2)C1	ZINC000875292315	GD	On-Demand	Anodyne	GPR119	39	60
CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)NC2CN(c3ccncn3)C2)C1	ZINC000875292316	GD	On-Demand	Anodyne	GPR119	39	60
COC(=O)CCCOc1ccc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875292319	GF	On-Demand	Anodyne	HRH3	25	42
COC(=O)CCCOc1ccc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875292320	GF	On-Demand	Anodyne	HRH3	25	42
COC(=O)N(C)NC(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000875292346	DD	On-Demand	Reactive	DRD2	46	53
COC(=O)N(C)NC(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000875292346	DD	On-Demand	Reactive	LTA4H	22	47
COC(=O)N(C)NC(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000875292346	DD	On-Demand	Reactive	SIGMAR1	33	54
COC(=O)N(C)NC(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000875292346	DD	On-Demand	Reactive	PREP	40	36
COC(=O)N(C)NC(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000875292346	DD	On-Demand	Reactive	ACKR3	42	32
COC(=O)N(C)NC(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000875292347	DD	On-Demand	Reactive	DRD2	46	53
COC(=O)N(C)NC(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000875292347	DD	On-Demand	Reactive	LTA4H	22	47
COC(=O)N(C)NC(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000875292347	DD	On-Demand	Reactive	SIGMAR1	33	54
COC(=O)N(C)NC(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000875292347	DD	On-Demand	Reactive	PREP	40	36
COC(=O)N(C)NC(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000875292347	DD	On-Demand	Reactive	ACKR3	42	32
CC[C@H](NC(=O)c1c(C(F)(F)F)coc1C)c1nc2ccccc2[nH]1	ZINC000875292355	FI	On-Demand	Anodyne	TACR3	51	40
O=C(NC[C@H]1C[C@H](O)C1)N[C@H](CN1CCCCC1)c1ccccc1	ZINC000875292383	EE	On-Demand	Anodyne	OPRK1	29	40
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H](CN1CCCCC1)c1ccccc1	ZINC000875292384	EE	On-Demand	Anodyne	OPRK1	29	40
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875292420	GG	On-Demand	Anodyne	CCR5	38	40
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875292421	GG	On-Demand	Anodyne	CCR5	38	40
CNC(=O)C[C@H](NC(=O)C(=O)N1CCN(C)c2ncccc2C1)c1ccccc1	ZINC000875292430	GC	On-Demand	Anodyne	PTAFR	30	41
CNC(=O)C[C@@H](NC(=O)C(=O)N1CCN(C)c2ncccc2C1)c1ccccc1	ZINC000875292431	GC	On-Demand	Anodyne	PTAFR	30	41
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CC(c2ccccc2)C1	ZINC000875292444	EE	On-Demand	Anodyne	DRD4	22	40
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CC(c2ccccc2)C1	ZINC000875292444	EE	On-Demand	Anodyne	SIGMAR1	24	42
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CC(c2ccccc2)C1	ZINC000875292444	EE	On-Demand	Anodyne	CCR5	44	45
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CC(c2ccccc2)C1	ZINC000875292444	EE	On-Demand	Anodyne	SLC18A3	27	42
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CC(c2ccccc2)C1	ZINC000875292444	EE	On-Demand	Anodyne	EPHX2	28	40
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CC(c2ccccc2)C1	ZINC000875292444	EE	On-Demand	Anodyne	SMO	26	41
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CC(c2ccccc2)C1	ZINC000875292445	EE	On-Demand	Anodyne	DRD4	22	40
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CC(c2ccccc2)C1	ZINC000875292445	EE	On-Demand	Anodyne	SIGMAR1	24	42
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CC(c2ccccc2)C1	ZINC000875292445	EE	On-Demand	Anodyne	CCR5	44	45
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CC(c2ccccc2)C1	ZINC000875292445	EE	On-Demand	Anodyne	SLC18A3	27	42
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CC(c2ccccc2)C1	ZINC000875292445	EE	On-Demand	Anodyne	EPHX2	28	40
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CC(c2ccccc2)C1	ZINC000875292445	EE	On-Demand	Anodyne	SMO	26	41
O=C(NC[C@H]1CCCN1Cc1ccccc1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875292533	GD	On-Demand	Anodyne	DRD2	30	44
O=C(NC[C@H]1CCCN1Cc1ccccc1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875292533	GD	On-Demand	Anodyne	SIGMAR1	17	45
C#CCOc1ccccc1CNC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875292552	ED	On-Demand	Mild	SLC6A3	40	37
C#CCOc1ccccc1CNC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875292553	ED	On-Demand	Mild	SLC6A3	40	37
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CCC[C@](F)(c2ccccc2)C1	ZINC000875292592	GG	On-Demand	Anodyne	SIGMAR1	16	43
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CCC[C@@](F)(c2ccccc2)C1	ZINC000875292593	GG	On-Demand	Anodyne	SIGMAR1	16	43
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CCC[C@](F)(c2ccccc2)C1	ZINC000875292594	GG	On-Demand	Anodyne	SIGMAR1	16	43
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CCC[C@@](F)(c2ccccc2)C1	ZINC000875292595	GG	On-Demand	Anodyne	SIGMAR1	16	43
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CCOc2cc(F)ccc2C1	ZINC000875292617	GE	On-Demand	Anodyne	CCR3	28	42
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CCOc2cc(F)ccc2C1	ZINC000875292618	GE	On-Demand	Anodyne	CCR3	28	42
CC(=O)Nc1cccc(NC(=O)COC(=O)CCCOc2ccccc2C)c1	ZINC000875292677	GG	On-Demand	Anodyne	KCNK3	64	40
CC(=O)Nc1cccc(NC(=O)COC(=O)CCCOc2ccccc2C)c1	ZINC000875292677	GG	On-Demand	Anodyne	KCNK9	62	37
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1nc2ccccc2s1	ZINC000875292689	EG	On-Demand	Anodyne	TMPRSS6	45	32
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1nc2ccccc2s1	ZINC000875292692	EG	On-Demand	Anodyne	TMPRSS6	45	32
O=C(NCc1ccc2ccccc2n1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875292715	GH	On-Demand	Anodyne	ALOX5AP	56	39
O=C(NCc1ccc2ccccc2n1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875292715	GH	On-Demand	Anodyne	SMO	37	41
C[C@H](NC(=O)N1C[C@@H](O)C[C@H]1C1CC1)c1nc2ccccc2s1	ZINC000875292724	EF	On-Demand	Anodyne	TPSAB1	15	43
C[C@H](NC(=O)N1C[C@H](O)C[C@H]1C1CC1)c1nc2ccccc2s1	ZINC000875292725	EF	On-Demand	Anodyne	TPSAB1	15	43
C[C@H](NC(=O)N1C[C@@H](O)C[C@@H]1C1CC1)c1nc2ccccc2s1	ZINC000875292726	EF	On-Demand	Anodyne	TPSAB1	15	43
C[C@H](NC(=O)N1C[C@H](O)C[C@@H]1C1CC1)c1nc2ccccc2s1	ZINC000875292727	EF	On-Demand	Anodyne	TPSAB1	15	43
Cn1nc(Cl)c(C(=O)N2C[C@H](C(N)=O)Cc3ccccc32)c1Cl	ZINC000875292730	FE	On-Demand	Anodyne	TPP2	49	32
Cn1nc(Cl)c(C(=O)N2C[C@@H](C(N)=O)Cc3ccccc32)c1Cl	ZINC000875292731	FE	On-Demand	Anodyne	TPP2	49	32
CCOC(=O)N1CCN(C(=O)COC(=O)CCCOc2ccccc2C)CC1	ZINC000875292744	GD	On-Demand	Anodyne	P2RY12	104	39
C[C@@H](NC(=O)N1C[C@@H]2CCC[C@]2(CO)C1)c1nc2ccccc2s1	ZINC000875292751	EG	On-Demand	Anodyne	TRY1_BOVIN	44	36
C[C@H](NC(=O)N1C[C@@H]2CCC[C@]2(CO)C1)c1nc2ccccc2s1	ZINC000875292752	EG	On-Demand	Anodyne	TRY1_BOVIN	44	36
COc1ccc2c(COC(=O)CCCOc3ccccc3C)cc(=O)oc2c1	ZINC000875292789	GI	On-Demand	Anodyne	CYP19A1	15	44
COc1ccc2c(COC(=O)CCCOc3ccccc3C)cc(=O)oc2c1	ZINC000875292789	GI	On-Demand	Anodyne	CYP11B1	17	43
COc1ccc2c(COC(=O)CCCOc3ccccc3C)cc(=O)oc2c1	ZINC000875292789	GI	On-Demand	Anodyne	MAOA	53	44
COc1ccc2c(COC(=O)CCCOc3ccccc3C)cc(=O)oc2c1	ZINC000875292789	GI	On-Demand	Anodyne	MAOB	55	48
Cn1nnnc1C1CCN(C(=O)N[C@@H](CN2CCCCC2)c2ccccc2)CC1	ZINC000875292791	GE	On-Demand	Anodyne	CCR5	26	41
Cn1nnnc1C1CCN(C(=O)N[C@H](CN2CCCCC2)c2ccccc2)CC1	ZINC000875292792	GE	On-Demand	Anodyne	CCR5	26	41
Cc1cncc([C@@H]2CCCN2C(=O)NC2CCN(C[C@@H]3CCCO3)CC2)c1	ZINC000875292805	FF	On-Demand	Anodyne	SSTR5	31	43
Cc1cncc([C@@H]2CCCN2C(=O)NC2CCN(C[C@H]3CCCO3)CC2)c1	ZINC000875292806	FF	On-Demand	Anodyne	SSTR5	31	43
Cc1cncc([C@H]2CCCN2C(=O)NC2CCN(C[C@@H]3CCCO3)CC2)c1	ZINC000875292807	FF	On-Demand	Anodyne	SSTR5	31	43
Cc1cncc([C@H]2CCCN2C(=O)NC2CCN(C[C@H]3CCCO3)CC2)c1	ZINC000875292808	FF	On-Demand	Anodyne	SSTR5	31	43
C[C@@H](NC(=O)N1CC[C@H](c2ccc(O)cc2)C1)c1nc2ccccc2s1	ZINC000875292864	FI	On-Demand	Anodyne	CCR1	31	50
C[C@@H](NC(=O)N1CC[C@H](c2ccc(O)cc2)C1)c1nc2ccccc2s1	ZINC000875292864	FI	On-Demand	Anodyne	TMPRSS6	44	31
C[C@@H](NC(=O)N1CC[C@@H](c2ccc(O)cc2)C1)c1nc2ccccc2s1	ZINC000875292866	FI	On-Demand	Anodyne	CCR1	31	50
C[C@@H](NC(=O)N1CC[C@@H](c2ccc(O)cc2)C1)c1nc2ccccc2s1	ZINC000875292866	FI	On-Demand	Anodyne	TMPRSS6	44	31
CCC[C@@H](CCO)NC(=O)N[C@H](C)c1nc2ccccc2s1	ZINC000875292879	DG	On-Demand	Anodyne	TMPRSS6	46	35
CCC[C@H](CCO)NC(=O)N[C@@H](C)c1nc2ccccc2s1	ZINC000875292880	DG	On-Demand	Anodyne	TMPRSS6	46	35
CCC[C@@H](CCO)NC(=O)N[C@@H](C)c1nc2ccccc2s1	ZINC000875292882	DG	On-Demand	Anodyne	TMPRSS6	46	35
CCC[C@H](CCO)NC(=O)N[C@H](C)c1nc2ccccc2s1	ZINC000875292883	DG	On-Demand	Anodyne	TMPRSS6	46	35
COc1ccc([N+](=O)[O-])cc1COC(=O)CCCOc1ccccc1C	ZINC000875292980	FH	On-Demand	Bother	CACNA1C	43	36
COc1ccc([N+](=O)[O-])cc1COC(=O)CCCOc1ccccc1C	ZINC000875292980	FH	On-Demand	Bother	CACNA1D	71	36
O=C(NCCn1cccn1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875293001	EE	On-Demand	Anodyne	FKBP1A	19	43
O=C(NCCn1cccn1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875293002	EE	On-Demand	Anodyne	FKBP1A	19	43
O=C(NCCn1cccn1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875293003	EE	On-Demand	Anodyne	FKBP1A	19	43
O=C(NCCn1cccn1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875293004	EE	On-Demand	Anodyne	FKBP1A	19	43
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875293083	FF	On-Demand	Anodyne	SMO	23	40
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875293085	FF	On-Demand	Anodyne	SMO	23	40
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875293087	FF	On-Demand	Anodyne	SMO	23	40
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875293089	FF	On-Demand	Anodyne	SMO	23	40
Cc1nccnc1[C@H](C)NC(=O)N[C@@H](CN1CCCCC1)c1ccccc1	ZINC000875293091	FG	On-Demand	Anodyne	PTAFR	25	43
Cc1nccnc1[C@@H](C)NC(=O)N[C@H](CN1CCCCC1)c1ccccc1	ZINC000875293092	FG	On-Demand	Anodyne	PTAFR	25	43
Cc1nccnc1[C@@H](C)NC(=O)N[C@@H](CN1CCCCC1)c1ccccc1	ZINC000875293094	FG	On-Demand	Anodyne	PTAFR	25	43
Cc1nccnc1[C@H](C)NC(=O)N[C@H](CN1CCCCC1)c1ccccc1	ZINC000875293095	FG	On-Demand	Anodyne	PTAFR	25	43
C[C@@H](NC(=O)N(C)[C@H]1C[C@@H](C(N)=O)C1)c1nc2ccccc2s1	ZINC000875293133	EE	On-Demand	Anodyne	TMPRSS6	54	33
O=C(NCc1ccc2ccccc2n1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875293154	FH	On-Demand	Anodyne	ALOX5	30	45
O=C(NCc1ccc2ccccc2n1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875293154	FH	On-Demand	Anodyne	TRY1_BOVIN	51	35
O=C(NCc1ccc2ccccc2n1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875293154	FH	On-Demand	Anodyne	SMO	36	40
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N[C@@H]1CCO[C@H]1c1ccccc1	ZINC000875293184	FE	On-Demand	Anodyne	DRD4	16	44
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N[C@@H]1CCO[C@H]1c1ccccc1	ZINC000875293184	FE	On-Demand	Anodyne	SIGMAR1	24	41
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N[C@@H]1CCO[C@H]1c1ccccc1	ZINC000875293184	FE	On-Demand	Anodyne	EPHX2	26	44
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N[C@@H]1CCO[C@H]1c1ccccc1	ZINC000875293185	FE	On-Demand	Anodyne	DRD4	16	44
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N[C@@H]1CCO[C@H]1c1ccccc1	ZINC000875293185	FE	On-Demand	Anodyne	SIGMAR1	24	41
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N[C@@H]1CCO[C@H]1c1ccccc1	ZINC000875293185	FE	On-Demand	Anodyne	EPHX2	26	44
O=C(NCc1ccc2ccccc2n1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875293232	FH	On-Demand	Anodyne	ALOX5	30	45
O=C(NCc1ccc2ccccc2n1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875293232	FH	On-Demand	Anodyne	TRY1_BOVIN	51	35
O=C(NCc1ccc2ccccc2n1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875293232	FH	On-Demand	Anodyne	SMO	36	40
O=C(NCc1ccc2ccccc2n1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875293234	FH	On-Demand	Anodyne	ALOX5	30	45
O=C(NCc1ccc2ccccc2n1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875293234	FH	On-Demand	Anodyne	TRY1_BOVIN	51	35
O=C(NCc1ccc2ccccc2n1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875293234	FH	On-Demand	Anodyne	SMO	36	40
O=C(NCc1ccc2ccccc2n1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875293236	FH	On-Demand	Anodyne	ALOX5	30	45
O=C(NCc1ccc2ccccc2n1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875293236	FH	On-Demand	Anodyne	TRY1_BOVIN	51	35
O=C(NCc1ccc2ccccc2n1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875293236	FH	On-Demand	Anodyne	SMO	36	40
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875293289	GF	On-Demand	Anodyne	CCR3	48	42
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875293289	GF	On-Demand	Anodyne	MLNR	23	41
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875293289	GF	On-Demand	Anodyne	EPHX2	36	42
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875293290	GF	On-Demand	Anodyne	CCR3	48	42
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875293290	GF	On-Demand	Anodyne	MLNR	23	41
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875293290	GF	On-Demand	Anodyne	EPHX2	36	42
CN1CCN(C2CCN(C(=O)N[C@@H]3CCC[C@H](C(=O)N(C)C)C3)CC2)CC1	ZINC000875293323	GD	On-Demand	Anodyne	L3MBTL3	49	41
CN1CCN(C2CCN(C(=O)N[C@@H]3CCC[C@@H](C(=O)N(C)C)C3)CC2)CC1	ZINC000875293324	GD	On-Demand	Anodyne	L3MBTL3	49	41
CN1CCN(C2CCN(C(=O)N[C@H]3CCC[C@H](C(=O)N(C)C)C3)CC2)CC1	ZINC000875293325	GD	On-Demand	Anodyne	L3MBTL3	49	41
CN1CCN(C2CCN(C(=O)N[C@H]3CCC[C@@H](C(=O)N(C)C)C3)CC2)CC1	ZINC000875293326	GD	On-Demand	Anodyne	L3MBTL3	49	41
CC(=O)c1cccc(NC(=O)COC(=O)CCCOc2ccccc2C)c1	ZINC000875293327	FH	On-Demand	Anodyne	KCNK3	76	37
CC(=O)c1cccc(NC(=O)COC(=O)CCCOc2ccccc2C)c1	ZINC000875293327	FH	On-Demand	Anodyne	KCNK9	64	37
C[C@@](CO)(Cc1ccc(F)cc1)NC(=O)NC1CCN(C[C@H]2CCCO2)CC1	ZINC000875293362	GE	On-Demand	Anodyne	CCR3	50	39
C[C@@](CO)(Cc1ccc(F)cc1)NC(=O)NC1CCN(C[C@@H]2CCCO2)CC1	ZINC000875293363	GE	On-Demand	Anodyne	CCR3	50	39
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000875293454	FG	On-Demand	Anodyne	DRD4	21	45
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000875293454	FG	On-Demand	Anodyne	SIGMAR1	24	42
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000875293454	FG	On-Demand	Anodyne	CCR5	43	39
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000875293454	FG	On-Demand	Anodyne	EPHX2	27	47
C[C@@H](NC(=O)N(C)CCN1CC2(CCOCC2)C1)c1nc2ccccc2s1	ZINC000875293466	GG	On-Demand	Anodyne	CASR	40	43
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(C[C@@H]2CCCO2)CC1	ZINC000875293467	GE	On-Demand	Anodyne	DRD4	15	43
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(C[C@@H]2CCCO2)CC1	ZINC000875293467	GE	On-Demand	Anodyne	SIGMAR1	15	45
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(C[C@@H]2CCCO2)CC1	ZINC000875293467	GE	On-Demand	Anodyne	EPHX2	15	41
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(C[C@@H]2CCCO2)CC1	ZINC000875293467	GE	On-Demand	Anodyne	MCHR1	17	41
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(C[C@@H]2CCCO2)CC1	ZINC000875293468	GE	On-Demand	Anodyne	DRD4	15	43
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(C[C@@H]2CCCO2)CC1	ZINC000875293468	GE	On-Demand	Anodyne	SIGMAR1	15	45
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(C[C@@H]2CCCO2)CC1	ZINC000875293468	GE	On-Demand	Anodyne	EPHX2	15	41
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(C[C@@H]2CCCO2)CC1	ZINC000875293468	GE	On-Demand	Anodyne	MCHR1	17	41
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(C[C@H]2CCCO2)CC1	ZINC000875293469	GE	On-Demand	Anodyne	DRD4	15	43
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(C[C@H]2CCCO2)CC1	ZINC000875293469	GE	On-Demand	Anodyne	SIGMAR1	15	45
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(C[C@H]2CCCO2)CC1	ZINC000875293469	GE	On-Demand	Anodyne	EPHX2	15	41
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(C[C@H]2CCCO2)CC1	ZINC000875293469	GE	On-Demand	Anodyne	MCHR1	17	41
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(C[C@H]2CCCO2)CC1	ZINC000875293470	GE	On-Demand	Anodyne	DRD4	15	43
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(C[C@H]2CCCO2)CC1	ZINC000875293470	GE	On-Demand	Anodyne	SIGMAR1	15	45
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(C[C@H]2CCCO2)CC1	ZINC000875293470	GE	On-Demand	Anodyne	EPHX2	15	41
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(C[C@H]2CCCO2)CC1	ZINC000875293470	GE	On-Demand	Anodyne	MCHR1	17	41
C[C@@H](NC(=O)NCC[C@@H](O)C(F)F)c1nc2ccccc2s1	ZINC000875293491	EF	On-Demand	Anodyne	ST14	41	36
C[C@@H](NC(=O)NCC[C@@H](O)C(F)F)c1nc2ccccc2s1	ZINC000875293491	EF	On-Demand	Anodyne	TMPRSS6	58	36
C[C@@H](NC(=O)NCC[C@H](O)C(F)F)c1nc2ccccc2s1	ZINC000875293492	EF	On-Demand	Anodyne	ST14	41	36
C[C@@H](NC(=O)NCC[C@H](O)C(F)F)c1nc2ccccc2s1	ZINC000875293492	EF	On-Demand	Anodyne	TMPRSS6	58	36
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000875293555	FG	On-Demand	Anodyne	DRD4	21	45
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000875293555	FG	On-Demand	Anodyne	SIGMAR1	24	42
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000875293555	FG	On-Demand	Anodyne	CCR5	43	39
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000875293555	FG	On-Demand	Anodyne	EPHX2	27	47
O=CN1CCCN(C(=O)N[C@@H](CN2CCCCC2)c2ccccc2)CC1	ZINC000875293581	FE	On-Demand	Anodyne	DPP7	43	37
O=CN1CCCN(C(=O)N[C@H](CN2CCCCC2)c2ccccc2)CC1	ZINC000875293582	FE	On-Demand	Anodyne	DPP7	43	37
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875293620	GE	On-Demand	Anodyne	CHRM2	15	42
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875293620	GE	On-Demand	Anodyne	DRD4	32	48
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875293620	GE	On-Demand	Anodyne	ACHE	25	46
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875293620	GE	On-Demand	Anodyne	CHRM3	17	42
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875293620	GE	On-Demand	Anodyne	SIGMAR1	38	47
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875293620	GE	On-Demand	Anodyne	CCR3	23	47
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875293620	GE	On-Demand	Anodyne	EPHX2	15	42
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875293620	GE	On-Demand	Anodyne	MCHR1	25	42
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875293621	GE	On-Demand	Anodyne	CHRM2	15	42
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875293621	GE	On-Demand	Anodyne	DRD4	32	48
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875293621	GE	On-Demand	Anodyne	ACHE	25	46
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875293621	GE	On-Demand	Anodyne	CHRM3	17	42
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875293621	GE	On-Demand	Anodyne	SIGMAR1	38	47
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875293621	GE	On-Demand	Anodyne	CCR3	23	47
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875293621	GE	On-Demand	Anodyne	EPHX2	15	42
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875293621	GE	On-Demand	Anodyne	MCHR1	25	42
C[C@@H](NC(=O)N1CCc2nc(C3CC3)ncc2C1)c1nc2ccccc2s1	ZINC000875293622	GH	On-Demand	Anodyne	MAPK1	46	35
COC(=O)C1CCN(C(=O)COC(=O)CCCOc2ccccc2C)CC1	ZINC000875293623	GE	On-Demand	Anodyne	PTR1	49	35
CCn1ncc(CNC(=O)N[C@H](CN2CCCCC2)c2ccccc2)n1	ZINC000875293665	FE	On-Demand	Anodyne	TACR3	44	44
CCn1ncc(CNC(=O)N[C@@H](CN2CCCCC2)c2ccccc2)n1	ZINC000875293666	FE	On-Demand	Anodyne	TACR3	44	44
C[C@@H](NC(=O)N1CC[C@@H]2CC[C@@H](O)[C@@H]21)c1nc2ccccc2s1	ZINC000875293679	EF	On-Demand	Anodyne	UL80	21	41
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1nc2ccccc2s1	ZINC000875293727	EH	On-Demand	Anodyne	F2	18	40
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1nc2ccccc2s1	ZINC000875293727	EH	On-Demand	Anodyne	TRY1_BOVIN	50	41
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1nc2ccccc2s1	ZINC000875293727	EH	On-Demand	Anodyne	TPSAB1	17	41
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1nc2ccccc2s1	ZINC000875293727	EH	On-Demand	Anodyne	ST14	43	34
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1nc2ccccc2s1	ZINC000875293727	EH	On-Demand	Anodyne	TMPRSS6	59	34
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1nc2ccccc2s1	ZINC000875293728	EH	On-Demand	Anodyne	F2	18	40
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1nc2ccccc2s1	ZINC000875293728	EH	On-Demand	Anodyne	TRY1_BOVIN	50	41
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1nc2ccccc2s1	ZINC000875293728	EH	On-Demand	Anodyne	TPSAB1	17	41
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1nc2ccccc2s1	ZINC000875293728	EH	On-Demand	Anodyne	ST14	43	34
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1nc2ccccc2s1	ZINC000875293728	EH	On-Demand	Anodyne	TMPRSS6	59	34
CCN(CCNC(=O)OC(C)(C)C)C(=O)NCc1ccc2ccccc2n1	ZINC000875293732	FG	On-Demand	Anodyne	CYSLTR1	43	38
C[C@H](NC(=O)NCCN(C)CC(F)F)c1nc2ccccc2s1	ZINC000875293813	EF	On-Demand	Anodyne	TMPRSS6	45	33
C[C@@H](NC(=O)NCCN(C)CC(F)F)c1nc2ccccc2s1	ZINC000875293814	EF	On-Demand	Anodyne	TMPRSS6	45	33
C[C@@H](NC(=O)NCC[C@H](O)C1CCCC1)c1nc2ccccc2s1	ZINC000875293851	EH	On-Demand	Anodyne	TPSAB1	15	41
C[C@@H](NC(=O)NCC[C@H](O)C1CCCC1)c1nc2ccccc2s1	ZINC000875293851	EH	On-Demand	Anodyne	ST14	49	36
C[C@@H](NC(=O)NCC[C@H](O)C1CCCC1)c1nc2ccccc2s1	ZINC000875293851	EH	On-Demand	Anodyne	TMPRSS6	68	36
C[C@@H](NC(=O)NCC[C@@H](O)C1CCCC1)c1nc2ccccc2s1	ZINC000875293852	EH	On-Demand	Anodyne	TPSAB1	15	41
C[C@@H](NC(=O)NCC[C@@H](O)C1CCCC1)c1nc2ccccc2s1	ZINC000875293852	EH	On-Demand	Anodyne	ST14	49	36
C[C@@H](NC(=O)NCC[C@@H](O)C1CCCC1)c1nc2ccccc2s1	ZINC000875293852	EH	On-Demand	Anodyne	TMPRSS6	68	36
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1nc2ccccc2s1	ZINC000875293861	DE	On-Demand	Anodyne	TPSAB1	15	40
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1nc2ccccc2s1	ZINC000875293861	DE	On-Demand	Anodyne	TMPRSS6	40	32
C[C@H](NC(=O)NC[C@@H]1C[C@H](O)C1)c1nc2ccccc2s1	ZINC000875293862	DE	On-Demand	Anodyne	TPSAB1	15	40
C[C@H](NC(=O)NC[C@@H]1C[C@H](O)C1)c1nc2ccccc2s1	ZINC000875293862	DE	On-Demand	Anodyne	TMPRSS6	40	32
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1nc2ccccc2s1	ZINC000875293863	DE	On-Demand	Anodyne	TPSAB1	15	40
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1nc2ccccc2s1	ZINC000875293863	DE	On-Demand	Anodyne	TMPRSS6	40	32
C[C@@H](NC(=O)NCC1CC(O)C1)c1nc2ccccc2s1	ZINC000875293864	DE	On-Demand	Anodyne	TPSAB1	15	40
C[C@@H](NC(=O)NCC1CC(O)C1)c1nc2ccccc2s1	ZINC000875293864	DE	On-Demand	Anodyne	TMPRSS6	40	32
C[C@@H](NC(=O)NC[C@@H]1C[C@H](O)C1)c1nc2ccccc2s1	ZINC000875293865	DE	On-Demand	Anodyne	TPSAB1	15	40
C[C@@H](NC(=O)NC[C@@H]1C[C@H](O)C1)c1nc2ccccc2s1	ZINC000875293865	DE	On-Demand	Anodyne	TMPRSS6	40	32
C[C@H](NC(=O)NCC1CC(O)C1)c1nc2ccccc2s1	ZINC000875293866	DE	On-Demand	Anodyne	TPSAB1	15	40
C[C@H](NC(=O)NCC1CC(O)C1)c1nc2ccccc2s1	ZINC000875293866	DE	On-Demand	Anodyne	TMPRSS6	40	32
CC(=O)NC[C@@H]1CCCCN1C(=O)N[C@@H](C)c1nc2ccccc2s1	ZINC000875293902	FG	On-Demand	Anodyne	TRY1_BOVIN	42	40
CC(=O)NC[C@@H]1CCCCN1C(=O)N[C@@H](C)c1nc2ccccc2s1	ZINC000875293902	FG	On-Demand	Anodyne	TPSAB1	16	40
CC(=O)NC[C@@H]1CCCCN1C(=O)N[C@@H](C)c1nc2ccccc2s1	ZINC000875293902	FG	On-Demand	Anodyne	TMPRSS6	45	34
CC(=O)NC[C@@H]1CCCCN1C(=O)N[C@H](C)c1nc2ccccc2s1	ZINC000875293903	FG	On-Demand	Anodyne	TRY1_BOVIN	42	40
CC(=O)NC[C@@H]1CCCCN1C(=O)N[C@H](C)c1nc2ccccc2s1	ZINC000875293903	FG	On-Demand	Anodyne	TPSAB1	16	40
CC(=O)NC[C@@H]1CCCCN1C(=O)N[C@H](C)c1nc2ccccc2s1	ZINC000875293903	FG	On-Demand	Anodyne	TMPRSS6	45	34
C[C@@H](NC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1nc2ccccc2s1	ZINC000875293938	FH	On-Demand	Anodyne	RBP4	45	33
C[C@@H](NC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1nc2ccccc2s1	ZINC000875293939	FH	On-Demand	Anodyne	RBP4	45	33
C[C@@H](NC(=O)N1CC(NS(C)(=O)=O)C1)c1nc2ccccc2s1	ZINC000875293949	FD	On-Demand	Anodyne	TMPRSS6	40	32
C[C@@H](NC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1nc2ccccc2s1	ZINC000875293951	FI	On-Demand	Anodyne	TRY1_BOVIN	42	38
C[C@@H](NC(=O)N1CCC[C@H](OC2CCC2)CC1)c1nc2ccccc2s1	ZINC000875293954	FI	On-Demand	Anodyne	TRY1_BOVIN	42	38
C[C@@H](NC(=O)NCCN1CC[C@H](O)C1)c1nc2ccccc2s1	ZINC000875293969	ED	On-Demand	Anodyne	ST14	46	33
C[C@@H](NC(=O)NCCN1CC[C@H](O)C1)c1nc2ccccc2s1	ZINC000875293969	ED	On-Demand	Anodyne	TMPRSS6	64	33
C[C@H](NC(=O)NCCN1CC[C@@H](O)C1)c1nc2ccccc2s1	ZINC000875293970	ED	On-Demand	Anodyne	ST14	46	33
C[C@H](NC(=O)NCCN1CC[C@@H](O)C1)c1nc2ccccc2s1	ZINC000875293970	ED	On-Demand	Anodyne	TMPRSS6	64	33
C[C@H](NC(=O)NCCN1CC[C@H](O)C1)c1nc2ccccc2s1	ZINC000875293971	ED	On-Demand	Anodyne	ST14	46	33
C[C@H](NC(=O)NCCN1CC[C@H](O)C1)c1nc2ccccc2s1	ZINC000875293971	ED	On-Demand	Anodyne	TMPRSS6	64	33
C[C@@H](NC(=O)NCCN1CC[C@@H](O)C1)c1nc2ccccc2s1	ZINC000875293972	ED	On-Demand	Anodyne	ST14	46	33
C[C@@H](NC(=O)NCCN1CC[C@@H](O)C1)c1nc2ccccc2s1	ZINC000875293972	ED	On-Demand	Anodyne	TMPRSS6	64	33
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H]2CCC[C@H](C(=O)N(C)C)C2)cc1	ZINC000875294044	FE	On-Demand	Anodyne	FASN	35	42
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H]2CCC[C@@H](C(=O)N(C)C)C2)cc1	ZINC000875294045	FE	On-Demand	Anodyne	FASN	35	42
CC(=O)N(C)c1ccc(CNC(=O)N[C@H]2CCC[C@H](C(=O)N(C)C)C2)cc1	ZINC000875294046	FE	On-Demand	Anodyne	FASN	35	42
CC(=O)N(C)c1ccc(CNC(=O)N[C@H]2CCC[C@@H](C(=O)N(C)C)C2)cc1	ZINC000875294047	FE	On-Demand	Anodyne	FASN	35	42
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875294050	GF	On-Demand	Anodyne	SIGMAR1	18	65
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875294051	GF	On-Demand	Anodyne	SIGMAR1	18	65
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875294052	GF	On-Demand	Anodyne	SIGMAR1	18	65
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875294053	GF	On-Demand	Anodyne	SIGMAR1	18	65
COCC(C)(C)CCNC(=O)C(=O)N[C@@H](C)c1ccc(-n2cccn2)cc1	ZINC000875294070	FE	On-Demand	Anodyne	AMP1_PLAFQ	67	49
COCC(C)(C)CCNC(=O)C(=O)N[C@H](C)c1ccc(-n2cccn2)cc1	ZINC000875294072	FE	On-Demand	Anodyne	AMP1_PLAFQ	67	49
COCC(C)(C)CCNC(=O)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000875294076	GD	On-Demand	Anodyne	CACNA1I	69	38
CN1CCC(N2CC[C@@H](NC(=O)N[C@H]3CCN(CC(C)(C)O)C3)C2)CC1	ZINC000875294088	FC	On-Demand	Anodyne	SLC6A5	21	48
C[C@H](NC(=O)C(=O)NCC1CCN(CC(F)(F)F)CC1)c1ccnn1C	ZINC000875294142	GC	On-Demand	Anodyne	HTR4	46	36
C[C@H](NC(=O)C(=O)NCC1CCN(CC(F)(F)F)CC1)c1ccnn1C	ZINC000875294142	GC	On-Demand	Anodyne	CACNA1I	67	36
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000875294178	GC	On-Demand	Mild	CACNA1I	49	33
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000875294179	GC	On-Demand	Mild	CACNA1I	49	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2CCN(CC(F)(F)F)CC2)C1	ZINC000875294232	GD	On-Demand	Anodyne	CACNA1I	47	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2CCN(CC(F)(F)F)CC2)C1	ZINC000875294234	GD	On-Demand	Anodyne	CACNA1I	47	35
O=C(NCCCCC1CC1)C(=O)N[C@H]1CCN(c2ncccc2Cl)C1	ZINC000875294256	FE	On-Demand	Anodyne	SIRT3	43	34
O=C(NCCCCC1CC1)C(=O)N[C@H]1CCN(c2ncccc2Cl)C1	ZINC000875294256	FE	On-Demand	Anodyne	SIRT2	43	30
O=C(NCCCCC1CC1)C(=O)N[C@H]1CCN(c2ncccc2Cl)C1	ZINC000875294256	FE	On-Demand	Anodyne	SIRT1	44	34
O=C(NCCCCC1CC1)C(=O)N[C@@H]1CCN(c2ncccc2Cl)C1	ZINC000875294258	FE	On-Demand	Anodyne	SIRT3	43	34
O=C(NCCCCC1CC1)C(=O)N[C@@H]1CCN(c2ncccc2Cl)C1	ZINC000875294258	FE	On-Demand	Anodyne	SIRT2	43	30
O=C(NCCCCC1CC1)C(=O)N[C@@H]1CCN(c2ncccc2Cl)C1	ZINC000875294258	FE	On-Demand	Anodyne	SIRT1	44	34
CC[C@H]1CCCCN1C(=O)COC(=O)CCCOc1ccccc1C	ZINC000875294284	EG	On-Demand	Anodyne	CPT1A	87	37
CC[C@@H]1CCCCN1C(=O)COC(=O)CCCOc1ccccc1C	ZINC000875294287	EG	On-Demand	Anodyne	CPT1A	87	37
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1nc2ccccc2s1	ZINC000875294289	GD	On-Demand	Anodyne	TMPRSS6	41	32
CN1CCC(N2CC[C@@H](NC(=O)N3CC[C@@H](C(C)(C)O)C3)C2)CC1	ZINC000875294290	EC	On-Demand	Anodyne	SLC6A5	20	46
CN1CCC(N2CC[C@@H](NC(=O)N3CC[C@H](C(C)(C)O)C3)C2)CC1	ZINC000875294291	EC	On-Demand	Anodyne	SLC6A5	20	46
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2nc3ccccc3s2)C1	ZINC000875294298	FG	On-Demand	Anodyne	TMPRSS6	49	32
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2nc3ccccc3s2)C1	ZINC000875294306	FG	On-Demand	Anodyne	TMPRSS6	49	32
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)C1	ZINC000875294327	FD	On-Demand	Anodyne	ADAM17	16	50
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)C1	ZINC000875294327	FD	On-Demand	Anodyne	AMP1_PLAFQ	60	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)C1	ZINC000875294329	FD	On-Demand	Anodyne	ADAM17	16	50
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)C1	ZINC000875294329	FD	On-Demand	Anodyne	AMP1_PLAFQ	60	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)c2ccc(-n3cccn3)cc2)C1	ZINC000875294331	FD	On-Demand	Anodyne	ADAM17	16	50
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)c2ccc(-n3cccn3)cc2)C1	ZINC000875294331	FD	On-Demand	Anodyne	AMP1_PLAFQ	60	44
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)c2ccc(-n3cccn3)cc2)C1	ZINC000875294333	FD	On-Demand	Anodyne	ADAM17	16	50
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)c2ccc(-n3cccn3)cc2)C1	ZINC000875294333	FD	On-Demand	Anodyne	AMP1_PLAFQ	60	44
C[C@H](NC(=O)C(=O)NCC[C@H]1CCSC1)c1ccc(-n2cccn2)cc1	ZINC000875294356	FE	On-Demand	Anodyne	ADAM17	15	44
C[C@H](NC(=O)C(=O)NCC[C@H]1CCSC1)c1ccc(-n2cccn2)cc1	ZINC000875294356	FE	On-Demand	Anodyne	AMP1_PLAFQ	59	43
C[C@H](NC(=O)C(=O)NCC[C@@H]1CCSC1)c1ccc(-n2cccn2)cc1	ZINC000875294360	FE	On-Demand	Anodyne	ADAM17	15	44
C[C@H](NC(=O)C(=O)NCC[C@@H]1CCSC1)c1ccc(-n2cccn2)cc1	ZINC000875294360	FE	On-Demand	Anodyne	AMP1_PLAFQ	59	43
CN1CCC(N2CC[C@@H](NC(=O)N3CCC[C@H](OC4CCC4)CC3)C2)CC1	ZINC000875294363	GE	On-Demand	Anodyne	SLC6A5	17	41
CN1CCC(N2CC[C@@H](NC(=O)N3CCC[C@@H](OC4CCC4)CC3)C2)CC1	ZINC000875294364	GE	On-Demand	Anodyne	SLC6A5	17	41
CN1CCC(N2CC[C@@H](NC(=O)N3CC(CNC(=O)C(F)(F)F)C3)C2)CC1	ZINC000875294371	GC	On-Demand	Anodyne	SLC6A5	19	43
O=C(NC[C@H](O)Cc1cccc(Cl)c1)N[C@@H]1CCN(C2CC2)C1	ZINC000875294411	ED	On-Demand	Anodyne	SLC6A5	16	49
O=C(NC[C@H](O)Cc1cccc(Cl)c1)N[C@@H]1CCN(C2CC2)C1	ZINC000875294411	ED	On-Demand	Anodyne	EPHX2	15	41
O=C(NC[C@H](O)Cc1cccc(Cl)c1)N[C@H]1CCN(C2CC2)C1	ZINC000875294412	ED	On-Demand	Anodyne	SLC6A5	16	49
O=C(NC[C@H](O)Cc1cccc(Cl)c1)N[C@H]1CCN(C2CC2)C1	ZINC000875294412	ED	On-Demand	Anodyne	EPHX2	15	41
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)N[C@H]1CCN(C2CC2)C1	ZINC000875294413	ED	On-Demand	Anodyne	SLC6A5	16	49
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)N[C@H]1CCN(C2CC2)C1	ZINC000875294413	ED	On-Demand	Anodyne	EPHX2	15	41
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)N[C@@H]1CCN(C2CC2)C1	ZINC000875294414	ED	On-Demand	Anodyne	SLC6A5	16	49
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)N[C@@H]1CCN(C2CC2)C1	ZINC000875294414	ED	On-Demand	Anodyne	EPHX2	15	41
O=C(NNc1cccc(F)c1Cl)N[C@@H]1CCN(C2CC2)C1	ZINC000875294420	DE	On-Demand	Reactive	SLC6A5	17	41
O=C(NNc1cccc(F)c1Cl)N[C@H]1CCN(C2CC2)C1	ZINC000875294421	DE	On-Demand	Reactive	SLC6A5	17	41
COCCCn1cc(C(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)cn1	ZINC000875294424	EF	On-Demand	Bother	TAAR1	25	42
COCCCn1cc(C(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)cn1	ZINC000875294424	EF	On-Demand	Bother	USP47	45	36
CN1CCC(N2CC[C@@H](NC(=O)N3Cc4cccnc4N4CCC[C@H]4C3)C2)CC1	ZINC000875294496	GD	On-Demand	Anodyne	SLC6A5	18	42
CN1CCC(N2CC[C@@H](NC(=O)N3CC4(CN(Cc5ccccc5)C4)C3)C2)CC1	ZINC000875294517	GD	On-Demand	Anodyne	CHRM1	19	40
CN1CCC(N2CC[C@@H](NC(=O)N3CC4(CN(Cc5ccccc5)C4)C3)C2)CC1	ZINC000875294517	GD	On-Demand	Anodyne	DRD4	39	44
CN1CCC(N2CC[C@@H](NC(=O)N3CC4(CN(Cc5ccccc5)C4)C3)C2)CC1	ZINC000875294517	GD	On-Demand	Anodyne	SIGMAR1	35	43
CN1CCC(N2CC[C@@H](NC(=O)N3CC4(CN(Cc5ccccc5)C4)C3)C2)CC1	ZINC000875294517	GD	On-Demand	Anodyne	CCR3	34	40
CN1CCC(N2CC[C@@H](NC(=O)N3CC4(CN(Cc5ccccc5)C4)C3)C2)CC1	ZINC000875294517	GD	On-Demand	Anodyne	SLC6A5	24	51
CC(=O)c1cccc(NC(=O)[C@H](C)OC(=O)CCCOc2ccccc2C)c1	ZINC000875294518	GH	On-Demand	Anodyne	KCNK3	67	36
CC(=O)c1cccc(NC(=O)[C@H](C)OC(=O)CCCOc2ccccc2C)c1	ZINC000875294518	GH	On-Demand	Anodyne	KCNK9	63	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1csc(-c2ccccc2)n1	ZINC000875294519	FG	On-Demand	Anodyne	SLC6A4	27	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1csc(-c2ccccc2)n1	ZINC000875294519	FG	On-Demand	Anodyne	SLC6A3	53	41
CC(=O)c1cccc(NC(=O)[C@@H](C)OC(=O)CCCOc2ccccc2C)c1	ZINC000875294520	GH	On-Demand	Anodyne	KCNK3	67	36
CC(=O)c1cccc(NC(=O)[C@@H](C)OC(=O)CCCOc2ccccc2C)c1	ZINC000875294520	GH	On-Demand	Anodyne	KCNK9	63	36
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1csc(-c2ccccc2)n1	ZINC000875294522	FG	On-Demand	Anodyne	SLC6A4	27	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1csc(-c2ccccc2)n1	ZINC000875294522	FG	On-Demand	Anodyne	SLC6A3	53	41
CC(=O)C1CCN(C(=O)C(=O)NCC2CCN(CC(F)(F)F)CC2)CC1	ZINC000875294540	GD	On-Demand	Anodyne	CACNA1I	59	37
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN(C[C@@H]2CCCO2)CC1	ZINC000875294550	FE	On-Demand	Anodyne	SIGMAR1	15	50
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN(C[C@@H]2CCCO2)CC1	ZINC000875294550	FE	On-Demand	Anodyne	CCR3	16	41
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN(C[C@@H]2CCCO2)CC1	ZINC000875294550	FE	On-Demand	Anodyne	PDK1	42	36
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN(C[C@@H]2CCCO2)CC1	ZINC000875294550	FE	On-Demand	Anodyne	MCHR1	17	43
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN(C[C@H]2CCCO2)CC1	ZINC000875294552	FE	On-Demand	Anodyne	SIGMAR1	15	50
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN(C[C@H]2CCCO2)CC1	ZINC000875294552	FE	On-Demand	Anodyne	CCR3	16	41
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN(C[C@H]2CCCO2)CC1	ZINC000875294552	FE	On-Demand	Anodyne	PDK1	42	36
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN(C[C@H]2CCCO2)CC1	ZINC000875294552	FE	On-Demand	Anodyne	MCHR1	17	43
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875294592	FF	On-Demand	Anodyne	DRD4	16	48
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875294592	FF	On-Demand	Anodyne	LTA4H	18	41
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875294592	FF	On-Demand	Anodyne	SIGMAR1	19	41
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875294592	FF	On-Demand	Anodyne	EPHX2	27	41
O=C(NC1CCN(C[C@H]2CCCO2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875294594	FF	On-Demand	Anodyne	DRD4	16	48
O=C(NC1CCN(C[C@H]2CCCO2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875294594	FF	On-Demand	Anodyne	LTA4H	18	41
O=C(NC1CCN(C[C@H]2CCCO2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875294594	FF	On-Demand	Anodyne	SIGMAR1	19	41
O=C(NC1CCN(C[C@H]2CCCO2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875294594	FF	On-Demand	Anodyne	EPHX2	27	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1oc2ccccc2c1C	ZINC000875294605	EF	On-Demand	Anodyne	SLC6A3	44	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1oc2ccccc2c1C	ZINC000875294606	EF	On-Demand	Anodyne	SLC6A3	44	37
O=C(NCC1CCN(CC(F)(F)F)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875294607	FD	On-Demand	Anodyne	CACNA1I	55	37
CCC1(CC)CCCN1C(=O)N[C@H]1CCN(C2CCN(C)CC2)C1	ZINC000875294609	EF	On-Demand	Anodyne	SLC6A5	18	42
CCC1(CC)CCCN1C(=O)N[C@@H]1CCN(C2CCN(C)CC2)C1	ZINC000875294611	EF	On-Demand	Anodyne	SLC6A5	18	42
C[C@H](NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21)c1ccc(-n2cccn2)cc1	ZINC000875294623	GE	On-Demand	Anodyne	ADAM17	17	53
C[C@H](NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21)c1ccc(-n2cccn2)cc1	ZINC000875294623	GE	On-Demand	Anodyne	AMP1_PLAFQ	61	44
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(C3CCN(C)CC3)C2)C1	ZINC000875294625	EB	On-Demand	Anodyne	SLC6A5	18	44
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(C3CCN(C)CC3)C2)C1	ZINC000875294629	EB	On-Demand	Anodyne	SLC6A5	18	44
O=C(NCCO)C1CCN(C(=O)NCc2csc(-c3ccccc3)n2)CC1	ZINC000875294631	GD	On-Demand	Anodyne	EPHX2	24	41
CN1CCC(N2CC[C@@H](NC(=O)N3CCO[C@H](C(F)(F)F)CC3)C2)CC1	ZINC000875294647	GD	On-Demand	Anodyne	SLC6A5	19	43
CN1CCC(N2CC[C@@H](NC(=O)N3CCO[C@@H](C(F)(F)F)CC3)C2)CC1	ZINC000875294649	GD	On-Demand	Anodyne	SLC6A5	19	43
C[C@@H](NC(=O)NCC[C@@H](O)COCc1ccccc1)c1nc2ccccc2s1	ZINC000875294673	GH	On-Demand	Anodyne	ST14	40	35
C[C@@H](NC(=O)NCC[C@@H](O)COCc1ccccc1)c1nc2ccccc2s1	ZINC000875294673	GH	On-Demand	Anodyne	TMPRSS6	57	35
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(C(F)(F)F)cc2C)CC1	ZINC000875294678	FE	On-Demand	Anodyne	CCR2	75	43
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(C(F)(F)F)cc2C)CC1	ZINC000875294678	FE	On-Demand	Anodyne	EPHX2	33	46
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(C(F)(F)F)cc2C)CC1	ZINC000875294678	FE	On-Demand	Anodyne	LIPG	47	37
C[C@H](NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(-n2cccn2)cc1	ZINC000875294683	FD	On-Demand	Anodyne	ADAM17	15	45
C[C@H](NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(-n2cccn2)cc1	ZINC000875294683	FD	On-Demand	Anodyne	AMP1_PLAFQ	63	45
C[C@H](NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(-n2cccn2)cc1	ZINC000875294684	FD	On-Demand	Anodyne	ADAM17	15	45
C[C@H](NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(-n2cccn2)cc1	ZINC000875294684	FD	On-Demand	Anodyne	AMP1_PLAFQ	63	45
C[C@H](NC(=O)C(=O)NCCCCC1CC1)c1ccc(-n2cccn2)cc1	ZINC000875294773	FF	On-Demand	Anodyne	ADAM17	16	45
C[C@H](NC(=O)C(=O)NCCCCC1CC1)c1ccc(-n2cccn2)cc1	ZINC000875294773	FF	On-Demand	Anodyne	AMP1_PLAFQ	64	46
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(C4CCN(C)CC4)C3)C[C@@H]1C2	ZINC000875294786	FC	On-Demand	Anodyne	SLC6A5	20	45
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(C4CCN(C)CC4)C3)C[C@@H]1C2	ZINC000875294787	FC	On-Demand	Anodyne	SLC6A5	20	45
O=C(NCc1csc(-c2ccccc2)n1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875294793	GH	On-Demand	Anodyne	ETHR	53	38
O=C(NCc1csc(-c2ccccc2)n1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875294794	GH	On-Demand	Anodyne	ETHR	53	38
CN1CCC(N2CC[C@@H](NC(=O)N3Cc4cccc(O)c4C3)C2)CC1	ZINC000875294796	ED	On-Demand	Clean	SLC6A5	21	48
CN1CCC(N2CC[C@@H](NC(=O)N[C@@H]3CCOC[C@H]3O)C2)CC1	ZINC000875294812	EB	On-Demand	Anodyne	SLC6A5	18	43
O=C(N[C@H]1CCN(C2CC2)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875294849	ED	On-Demand	Anodyne	DRD4	39	48
O=C(N[C@H]1CCN(C2CC2)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875294849	ED	On-Demand	Anodyne	SIGMAR1	44	47
O=C(N[C@H]1CCN(C2CC2)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875294849	ED	On-Demand	Anodyne	CCR3	37	43
O=C(N[C@H]1CCN(C2CC2)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875294849	ED	On-Demand	Anodyne	SLC6A5	19	46
O=C(N[C@H]1CCN(C2CC2)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875294849	ED	On-Demand	Anodyne	MCHR1	15	46
O=C(N[C@@H]1CCN(C2CC2)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875294850	ED	On-Demand	Anodyne	DRD4	39	48
O=C(N[C@@H]1CCN(C2CC2)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875294850	ED	On-Demand	Anodyne	SIGMAR1	44	47
O=C(N[C@@H]1CCN(C2CC2)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875294850	ED	On-Demand	Anodyne	CCR3	37	43
O=C(N[C@@H]1CCN(C2CC2)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875294850	ED	On-Demand	Anodyne	SLC6A5	19	46
O=C(N[C@@H]1CCN(C2CC2)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875294850	ED	On-Demand	Anodyne	MCHR1	15	46
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)C1	ZINC000875294886	FE	On-Demand	Anodyne	ADAM17	15	45
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)C1	ZINC000875294886	FE	On-Demand	Anodyne	AMP1_PLAFQ	61	44
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)N[C@@H](C)c2ccc(-n3cccn3)cc2)C1	ZINC000875294888	FE	On-Demand	Anodyne	ADAM17	15	45
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)N[C@@H](C)c2ccc(-n3cccn3)cc2)C1	ZINC000875294888	FE	On-Demand	Anodyne	AMP1_PLAFQ	61	44
CN1CCC(N2CC[C@@H](NC(=O)NC[C@H](O)Cc3cccc(Cl)c3)C2)CC1	ZINC000875294914	GD	On-Demand	Anodyne	SLC6A5	23	59
CN1CCC(N2CC[C@@H](NC(=O)NC[C@@H](O)Cc3cccc(Cl)c3)C2)CC1	ZINC000875294915	GD	On-Demand	Anodyne	SLC6A5	23	59
COc1cc2c(cc1OC)CN(C(=O)COC(=O)CCCOc1ccccc1C)CC2	ZINC000875294923	IG	On-Demand	Anodyne	ABCB1B	54	33
COc1cc2c(cc1OC)CN(C(=O)COC(=O)CCCOc1ccccc1C)CC2	ZINC000875294923	IG	On-Demand	Anodyne	ABCB1	26	46
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCCN(c3ccccc3)C2)C1	ZINC000875294962	FD	On-Demand	Anodyne	SLC6A1	64	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H]2CCCN(c3ccccc3)C2)C1	ZINC000875294962	FD	On-Demand	Anodyne	ADAM10	32	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCCN(c3ccccc3)C2)C1	ZINC000875294963	FD	On-Demand	Anodyne	SLC6A1	64	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H]2CCCN(c3ccccc3)C2)C1	ZINC000875294963	FD	On-Demand	Anodyne	ADAM10	32	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCCN(c3ccccc3)C2)C1	ZINC000875294964	FD	On-Demand	Anodyne	SLC6A1	64	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCCN(c3ccccc3)C2)C1	ZINC000875294964	FD	On-Demand	Anodyne	ADAM10	32	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCCN(c3ccccc3)C2)C1	ZINC000875294965	FD	On-Demand	Anodyne	SLC6A1	64	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H]2CCCN(c3ccccc3)C2)C1	ZINC000875294965	FD	On-Demand	Anodyne	ADAM10	32	41
CN1CCC(N2CC[C@@H](NC(=O)N3CCCN(C=O)CC3)C2)CC1	ZINC000875295001	EC	On-Demand	Anodyne	SLC6A5	17	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2csc(-c3ccccc3)n2)C1	ZINC000875295010	FG	On-Demand	Anodyne	P2RY12	66	35
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2csc(-c3ccccc3)n2)C1	ZINC000875295010	FG	On-Demand	Anodyne	PDE8B	45	34
CN1CCC(N2CC[C@@H](NC(=O)N3CCC[C@@H](C(C)(C)O)C3)C2)CC1	ZINC000875295028	FD	On-Demand	Anodyne	SLC6A5	18	45
CN1CCC(N2CC[C@@H](NC(=O)N3CCC[C@H](C(C)(C)O)C3)C2)CC1	ZINC000875295031	FD	On-Demand	Anodyne	SLC6A5	18	45
C=CC(C)(C)CCCNC(=O)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000875295034	GE	On-Demand	Mild	CACNA1I	50	37
CN1CCC(N2CC[C@@H](NC(=O)N3C[C@@H]4C[C@H]3CN4c3ccccc3)C2)CC1	ZINC000875295075	GD	On-Demand	Anodyne	SLC6A5	21	51
C[C@H](NC(=O)C(=O)N1CC[C@H]2CSC[C@H]2C1)c1ccc(-n2cccn2)cc1	ZINC000875295088	GE	On-Demand	Anodyne	ADAM17	15	45
C[C@H](NC(=O)C(=O)N1CC[C@H]2CSC[C@H]2C1)c1ccc(-n2cccn2)cc1	ZINC000875295088	GE	On-Demand	Anodyne	AMP1_PLAFQ	60	44
C[C@H](NC(=O)C(=O)N1CC[C@@H]2CSC[C@@H]2C1)c1ccc(-n2cccn2)cc1	ZINC000875295089	GE	On-Demand	Anodyne	ADAM17	15	45
C[C@H](NC(=O)C(=O)N1CC[C@@H]2CSC[C@@H]2C1)c1ccc(-n2cccn2)cc1	ZINC000875295089	GE	On-Demand	Anodyne	AMP1_PLAFQ	60	44
C[C@H](NC(=O)C(=O)N1CC[C@@H]2CSC[C@H]2C1)c1ccc(-n2cccn2)cc1	ZINC000875295091	GE	On-Demand	Anodyne	ADAM17	15	45
C[C@H](NC(=O)C(=O)N1CC[C@@H]2CSC[C@H]2C1)c1ccc(-n2cccn2)cc1	ZINC000875295091	GE	On-Demand	Anodyne	AMP1_PLAFQ	60	44
C[C@H](NC(=O)C(=O)N1CC[C@H]2CSC[C@@H]2C1)c1ccc(-n2cccn2)cc1	ZINC000875295092	GE	On-Demand	Anodyne	ADAM17	15	45
C[C@H](NC(=O)C(=O)N1CC[C@H]2CSC[C@@H]2C1)c1ccc(-n2cccn2)cc1	ZINC000875295092	GE	On-Demand	Anodyne	AMP1_PLAFQ	60	44
C[C@H](NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1)c1ccc(-n2cccn2)cc1	ZINC000875295102	GE	On-Demand	Anodyne	ADAM17	16	47
C[C@H](NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1)c1ccc(-n2cccn2)cc1	ZINC000875295102	GE	On-Demand	Anodyne	AMP1_PLAFQ	61	45
Cc1ccn(C[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)n1	ZINC000875295135	DG	On-Demand	Bother	COLA	18	41
C[C@@H]1CN(C(=O)N[C@@H]2CCN(C3CCN(C)CC3)C2)CC[C@@H](C(F)(F)F)O1	ZINC000875295181	GD	On-Demand	Anodyne	SLC6A5	19	42
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)CC1	ZINC000875295189	FD	On-Demand	Anodyne	SIGMAR1	25	40
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)CC1	ZINC000875295190	FD	On-Demand	Anodyne	SIGMAR1	25	40
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)CC1	ZINC000875295191	FD	On-Demand	Anodyne	SIGMAR1	25	40
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)CC1	ZINC000875295192	FD	On-Demand	Anodyne	SIGMAR1	25	40
C[C@@H]1CN(C(=O)N[C@@H]2CCN(C3CCN(C)CC3)C2)CC[C@H](C(F)(F)F)O1	ZINC000875295197	GD	On-Demand	Anodyne	SLC6A5	19	42
C[C@@H]1CN(C(=O)N[C@H]2CCN(C3CCN(C)CC3)C2)CC[C@H](C(F)(F)F)O1	ZINC000875295199	GD	On-Demand	Anodyne	SLC6A5	19	42
C[C@@H]1CN(C(=O)N[C@H]2CCN(C3CCN(C)CC3)C2)CC[C@@H](C(F)(F)F)O1	ZINC000875295201	GD	On-Demand	Anodyne	SLC6A5	19	42
C[C@@H](CNC(=O)N1CCc2nc(C3CC3)ncc2C1)C(C)(C)C	ZINC000875295234	DG	On-Demand	Anodyne	MAPK1	45	38
CN1CCC(N2CC[C@@H](NC(=O)N[C@@H]3CC(C)(C)CC[C@H]3O)C2)CC1	ZINC000875295249	FD	On-Demand	Anodyne	SLC6A5	19	43
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1CCN(C2CCN(C)CC2)C1	ZINC000875295275	GD	On-Demand	Anodyne	SLC6A5	18	43
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1CCN(C2CCN(C)CC2)C1	ZINC000875295276	GD	On-Demand	Anodyne	SLC6A5	18	43
Cc1cc(C(F)(F)F)ccc1CNC(=O)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875295293	GF	On-Demand	Anodyne	CCR2	60	42
Cc1cc(C(F)(F)F)ccc1CNC(=O)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875295294	GF	On-Demand	Anodyne	CCR2	60	42
Cc1cc(C(F)(F)F)ccc1CNC(=O)C(=O)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875295295	GF	On-Demand	Anodyne	CCR2	60	42
Cc1cc(C(F)(F)F)ccc1CNC(=O)C(=O)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875295296	GF	On-Demand	Anodyne	CCR2	60	42
CN1CCC(N2CC[C@@H](NC(=O)N3CCC(CO)(CO)CC3)C2)CC1	ZINC000875295299	FB	On-Demand	Anodyne	SLC6A5	18	44
C[C@H](NC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1)c1ccc(-n2cccn2)cc1	ZINC000875295302	FE	On-Demand	Anodyne	ADAM17	15	45
C[C@H](NC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1)c1ccc(-n2cccn2)cc1	ZINC000875295302	FE	On-Demand	Anodyne	AMP1_PLAFQ	65	46
Cc1cc(C(F)(F)F)ccc1CNC(=O)C(=O)NC1CCC(C)(N(C)C)CC1	ZINC000875295303	GG	On-Demand	Anodyne	CCR2	75	41
Cc1cc(C(F)(F)F)ccc1CNC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875295304	FE	On-Demand	Anodyne	CCR2	87	43
Cc1cc(C(F)(F)F)ccc1CNC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875295304	FE	On-Demand	Anodyne	EPHX2	22	40
Cc1cc(C(F)(F)F)ccc1CNC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875295304	FE	On-Demand	Anodyne	LIPG	49	40
Cc1cc(C(F)(F)F)ccc1CNC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875295305	FE	On-Demand	Anodyne	CCR2	87	43
Cc1cc(C(F)(F)F)ccc1CNC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875295305	FE	On-Demand	Anodyne	EPHX2	22	40
Cc1cc(C(F)(F)F)ccc1CNC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875295305	FE	On-Demand	Anodyne	LIPG	49	40
O=C(NCc1ncc(Cl)s1)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000875295308	GD	On-Demand	Anodyne	CACNA1I	66	37
O=C(NCCC[C@H]1C=CCC1)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000875295318	GE	On-Demand	Anodyne	CACNA1I	40	32
O=C(NCCC[C@@H]1C=CCC1)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000875295319	GE	On-Demand	Anodyne	CACNA1I	40	32
CN1CCC(N2CC[C@@H](NC(=O)NC[C@H]3C[C@H](O)C3)C2)CC1	ZINC000875295320	DC	On-Demand	Anodyne	SLC6A5	19	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)C1	ZINC000875295347	FD	On-Demand	Anodyne	SIGMAR1	22	40
CN1CCC(N2CC[C@@H](NC(=O)NC[C@H]3CC(C(F)(F)F)=NO3)C2)CC1	ZINC000875295355	GD	On-Demand	Anodyne	SLC6A5	20	45
CN1CCC(N2CC[C@@H](NC(=O)NC[C@@H]3CC(C(F)(F)F)=NO3)C2)CC1	ZINC000875295357	GD	On-Demand	Anodyne	SLC6A5	20	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(C2CCN(C)CC2)C1	ZINC000875295362	FC	On-Demand	Anodyne	SLC6A5	17	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(C2CCN(C)CC2)C1	ZINC000875295363	FC	On-Demand	Anodyne	SLC6A5	17	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(C2CCN(C)CC2)C1	ZINC000875295364	FC	On-Demand	Anodyne	SLC6A5	17	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(C2CCN(C)CC2)C1	ZINC000875295365	FC	On-Demand	Anodyne	SLC6A5	17	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)C1	ZINC000875295366	FD	On-Demand	Anodyne	SIGMAR1	22	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)C1	ZINC000875295367	FD	On-Demand	Anodyne	SIGMAR1	22	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)C1	ZINC000875295369	FD	On-Demand	Anodyne	SIGMAR1	22	40
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)c2ccc(-n3cccn3)cc2)CC1	ZINC000875295393	FD	On-Demand	Anodyne	ADAM17	16	49
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)c2ccc(-n3cccn3)cc2)CC1	ZINC000875295393	FD	On-Demand	Anodyne	AMP1_PLAFQ	64	47
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)CC1	ZINC000875295394	FD	On-Demand	Anodyne	ADAM17	16	49
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)CC1	ZINC000875295394	FD	On-Demand	Anodyne	AMP1_PLAFQ	64	47
CN1CC[C@H]2CN(C(=O)C(=O)NCC3CCN(CC(F)(F)F)CC3)CC[C@@H]21	ZINC000875295512	GC	On-Demand	Anodyne	CACNA1I	62	38
CN1CC[C@H]2CN(C(=O)C(=O)NCC3CCN(CC(F)(F)F)CC3)CC[C@H]21	ZINC000875295514	GC	On-Demand	Anodyne	CACNA1I	62	38
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](C)c1ccc(-n2cccn2)cc1	ZINC000875295530	FD	On-Demand	Mild	AMP1_PLAFQ	62	42
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](C)c1ccc(-n2cccn2)cc1	ZINC000875295531	FD	On-Demand	Mild	AMP1_PLAFQ	62	42
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H](C)c1ccc(-n2cccn2)cc1	ZINC000875295532	FD	On-Demand	Mild	AMP1_PLAFQ	62	42
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H](C)c1ccc(-n2cccn2)cc1	ZINC000875295533	FD	On-Demand	Mild	AMP1_PLAFQ	62	42
CN1CCC(N2CC[C@@H](NC(=O)NC3([C@@H]4CCCCO4)CCC3)C2)CC1	ZINC000875295540	FD	On-Demand	Anodyne	SLC6A5	18	42
CN1CCC(N2CC[C@@H](NC(=O)NC3([C@H]4CCCCO4)CCC3)C2)CC1	ZINC000875295542	FD	On-Demand	Anodyne	SLC6A5	18	42
Cc1cc(C(F)(F)F)ccc1CNC(=O)C(=O)N1CC[C@@H]2[C@H](CCN2C)C1	ZINC000875295559	GE	On-Demand	Anodyne	CCR2	76	42
Cc1cc(C(F)(F)F)ccc1CNC(=O)C(=O)N1CC[C@@H]2[C@H](CCN2C)C1	ZINC000875295559	GE	On-Demand	Anodyne	EPHX2	19	40
Cc1cc(C(F)(F)F)ccc1CNC(=O)C(=O)N1CC[C@@H]2[C@H](CCN2C)C1	ZINC000875295559	GE	On-Demand	Anodyne	LIPG	49	35
Cc1cc(C(F)(F)F)ccc1CNC(=O)C(=O)N1CC[C@@H]2[C@@H](CCN2C)C1	ZINC000875295560	GE	On-Demand	Anodyne	CCR2	76	42
Cc1cc(C(F)(F)F)ccc1CNC(=O)C(=O)N1CC[C@@H]2[C@@H](CCN2C)C1	ZINC000875295560	GE	On-Demand	Anodyne	EPHX2	19	40
Cc1cc(C(F)(F)F)ccc1CNC(=O)C(=O)N1CC[C@@H]2[C@@H](CCN2C)C1	ZINC000875295560	GE	On-Demand	Anodyne	LIPG	49	35
Cc1cc(C(F)(F)F)ccc1CNC(=O)C(=O)N1CC[C@H]2[C@@H](CCN2C)C1	ZINC000875295561	GE	On-Demand	Anodyne	CCR2	76	42
Cc1cc(C(F)(F)F)ccc1CNC(=O)C(=O)N1CC[C@H]2[C@@H](CCN2C)C1	ZINC000875295561	GE	On-Demand	Anodyne	EPHX2	19	40
Cc1cc(C(F)(F)F)ccc1CNC(=O)C(=O)N1CC[C@H]2[C@@H](CCN2C)C1	ZINC000875295561	GE	On-Demand	Anodyne	LIPG	49	35
Cc1cc(C(F)(F)F)ccc1CNC(=O)C(=O)N1CC[C@H]2[C@H](CCN2C)C1	ZINC000875295562	GE	On-Demand	Anodyne	CCR2	76	42
Cc1cc(C(F)(F)F)ccc1CNC(=O)C(=O)N1CC[C@H]2[C@H](CCN2C)C1	ZINC000875295562	GE	On-Demand	Anodyne	EPHX2	19	40
Cc1cc(C(F)(F)F)ccc1CNC(=O)C(=O)N1CC[C@H]2[C@H](CCN2C)C1	ZINC000875295562	GE	On-Demand	Anodyne	LIPG	49	35
CC[C@H](C[C@H](C)O)NC(=O)NCc1csc(-c2ccccc2)n1	ZINC000875295569	EG	On-Demand	Anodyne	ANPEP	24	40
COC(=O)N(C)NC(=O)N[C@@H]1CCN(C2CCN(C)CC2)C1	ZINC000875295575	DC	On-Demand	Reactive	SLC6A5	21	48
COC(=O)N(C)NC(=O)N[C@H]1CCN(C2CCN(C)CC2)C1	ZINC000875295578	DC	On-Demand	Reactive	SLC6A5	21	48
CN1CCC(N2CC[C@@H](NC(=O)N[C@@H]3CC=CC[C@H]3C(F)(F)F)C2)CC1	ZINC000875295582	FE	On-Demand	Anodyne	SLC6A5	21	47
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)c1ccc(-n2cccn2)cc1	ZINC000875295599	FD	On-Demand	Mild	AMP1_PLAFQ	63	44
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)c1ccc(-n2cccn2)cc1	ZINC000875295601	FD	On-Demand	Mild	AMP1_PLAFQ	63	44
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](C)c1ccc(-n2cccn2)cc1	ZINC000875295603	FD	On-Demand	Mild	AMP1_PLAFQ	63	44
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](C)c1ccc(-n2cccn2)cc1	ZINC000875295605	FD	On-Demand	Mild	AMP1_PLAFQ	63	44
COc1ccc(NC(=O)c2c(Cl)nn(C)c2Cl)c(OC)c1OC	ZINC000875295613	FG	On-Demand	Anodyne	SLC9A1	44	32
CN1CCC(N2CC[C@@H](NC(=O)NC3(C)CC(F)(F)C3)C2)CC1	ZINC000875295616	ED	On-Demand	Anodyne	SLC6A5	18	42
CN1CCC(N2CC[C@@H](NC(=O)N3CCC4(CCN(C)CC4)CC3)C2)CC1	ZINC000875295629	GD	On-Demand	Anodyne	SLC6A5	18	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(C3CCN(C)CC3)C2)C1	ZINC000875295636	FC	On-Demand	Anodyne	SLC6A5	17	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(C3CCN(C)CC3)C2)C1	ZINC000875295642	FC	On-Demand	Anodyne	SLC6A5	17	41
C[C@H](NC(=O)C(=O)N1CCN(C)C(C)(C)CC1)c1ccc(-n2cccn2)cc1	ZINC000875295665	GD	On-Demand	Anodyne	AMP1_PLAFQ	61	43
CN1CCC(N2CC[C@@H](NC(=O)NNc3cccc(F)c3Cl)C2)CC1	ZINC000875295669	FE	On-Demand	Reactive	SLC6A5	23	50
O=C(N[C@@H]1CCN(C2CC2)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875295689	ED	On-Demand	Anodyne	EPHX2	18	44
O=C(N[C@H]1CCN(C2CC2)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875295690	ED	On-Demand	Anodyne	EPHX2	18	44
O=C(N[C@H]1CCN(C2CC2)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875295691	ED	On-Demand	Anodyne	EPHX2	18	44
O=C(N[C@@H]1CCN(C2CC2)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875295692	ED	On-Demand	Anodyne	EPHX2	18	44
CN1CCC(N2CC[C@@H](NC(=O)N3[C@H]4CC[C@H]3CC(CCO)C4)C2)CC1	ZINC000875295732	FD	On-Demand	Anodyne	SLC6A5	17	41
Cc1nnc(NNC(=O)N[C@@H]2CCN(C3CCN(C)CC3)C2)n1C	ZINC000875295744	EB	On-Demand	Reactive	SLC6A5	20	44
Cc1nnc(NNC(=O)N[C@H]2CCN(C3CCN(C)CC3)C2)n1C	ZINC000875295745	EB	On-Demand	Reactive	SLC6A5	20	44
COc1ccc(NC(=O)[C@H](C)OC(=O)CCCOc2ccccc2C)cc1	ZINC000875295757	FH	On-Demand	Anodyne	MTNR1B	37	41
CN1CCC(N2CC[C@@H](NC(=O)N(C)OCC(F)(F)F)C2)CC1	ZINC000875295760	ED	On-Demand	Anodyne	SLC6A5	24	48
CN1CCC(N2CC[C@@H](NC(=O)NC(C)(C)[C@H]3CCCCO3)C2)CC1	ZINC000875295814	FD	On-Demand	Anodyne	SLC6A5	21	46
CN1CCC(N2CC[C@@H](NC(=O)NC(C)(C)[C@@H]3CCCCO3)C2)CC1	ZINC000875295818	FD	On-Demand	Anodyne	SLC6A5	21	46
CN1CCC(N2CC[C@@H](NC(=O)N3CCC[C@](O)(c4ccccc4)C3)C2)CC1	ZINC000875295828	GD	On-Demand	Anodyne	SLC6A5	18	46
CN1CCC(N2CC[C@@H](NC(=O)N3CCC[C@](O)(c4ccccc4)C3)C2)CC1	ZINC000875295828	GD	On-Demand	Anodyne	EPHX2	15	42
CN1CCC(N2CC[C@@H](NC(=O)N3CCC[C@@](O)(c4ccccc4)C3)C2)CC1	ZINC000875295830	GD	On-Demand	Anodyne	SLC6A5	18	46
CN1CCC(N2CC[C@@H](NC(=O)N3CCC[C@@](O)(c4ccccc4)C3)C2)CC1	ZINC000875295830	GD	On-Demand	Anodyne	EPHX2	15	42
C[C@H](NC(=O)C(=O)N1CC[C@H]2[C@@H](CCN2C)C1)c1ccc(-n2cccn2)cc1	ZINC000875295848	GD	On-Demand	Anodyne	ADAM17	15	44
C[C@H](NC(=O)C(=O)N1CC[C@H]2[C@@H](CCN2C)C1)c1ccc(-n2cccn2)cc1	ZINC000875295848	GD	On-Demand	Anodyne	AMP1_PLAFQ	60	43
C[C@H](NC(=O)C(=O)N1CC[C@@H]2[C@H](CCN2C)C1)c1ccc(-n2cccn2)cc1	ZINC000875295850	GD	On-Demand	Anodyne	ADAM17	15	44
C[C@H](NC(=O)C(=O)N1CC[C@@H]2[C@H](CCN2C)C1)c1ccc(-n2cccn2)cc1	ZINC000875295850	GD	On-Demand	Anodyne	AMP1_PLAFQ	60	43
C[C@H](NC(=O)C(=O)N1CC[C@@H]2[C@@H](CCN2C)C1)c1ccc(-n2cccn2)cc1	ZINC000875295852	GD	On-Demand	Anodyne	ADAM17	15	44
C[C@H](NC(=O)C(=O)N1CC[C@@H]2[C@@H](CCN2C)C1)c1ccc(-n2cccn2)cc1	ZINC000875295852	GD	On-Demand	Anodyne	AMP1_PLAFQ	60	43
C[C@H](NC(=O)C(=O)N1CC[C@H]2[C@H](CCN2C)C1)c1ccc(-n2cccn2)cc1	ZINC000875295855	GD	On-Demand	Anodyne	ADAM17	15	44
C[C@H](NC(=O)C(=O)N1CC[C@H]2[C@H](CCN2C)C1)c1ccc(-n2cccn2)cc1	ZINC000875295855	GD	On-Demand	Anodyne	AMP1_PLAFQ	60	43
C[C@@H](CNC(=O)N1CC[C@@H](c2ccc(O)cc2)C1)C(C)(C)C	ZINC000875295862	DH	On-Demand	Anodyne	CCR1	32	40
C[C@@H](CNC(=O)N1CC[C@H](c2ccc(O)cc2)C1)C(C)(C)C	ZINC000875295867	DH	On-Demand	Anodyne	CCR1	32	40
CN1CCC(N2CC[C@@H](NC(=O)NC3CC(Nc4ccccc4)C3)C2)CC1	ZINC000875295868	FE	On-Demand	Anodyne	SLC6A5	22	54
CN1CCC(N2CC[C@@H](NC(=O)NC3CC(Nc4ccccc4)C3)C2)CC1	ZINC000875295868	FE	On-Demand	Anodyne	EPHX2	20	40
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCN(C4CC4)C3)cn2)cc1	ZINC000875295907	FE	On-Demand	Mild	ITK	15	48
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCN(C4CC4)C3)cn2)cc1	ZINC000875295907	FE	On-Demand	Mild	PANC	54	38
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCN(C4CC4)C3)cn2)cc1	ZINC000875295908	FE	On-Demand	Mild	ITK	15	48
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCN(C4CC4)C3)cn2)cc1	ZINC000875295908	FE	On-Demand	Mild	PANC	54	38
CN1CCC(N2CC[C@@H](NC(=O)NCC[C@H](O)C3CCCC3)C2)CC1	ZINC000875295931	FD	On-Demand	Anodyne	SLC6A5	21	45
CN1CCC(N2CC[C@@H](NC(=O)NCC[C@@H](O)C3CCCC3)C2)CC1	ZINC000875295933	FD	On-Demand	Anodyne	SLC6A5	21	45
C[C@@H]1CN(C(=O)NCc2csc(-c3ccccc3)n2)CC[C@@H](C(F)(F)F)O1	ZINC000875295937	GI	On-Demand	Anodyne	ETHR	41	35
C[C@@H]1CN(C(=O)NCc2csc(-c3ccccc3)n2)CC[C@H](C(F)(F)F)O1	ZINC000875295938	GI	On-Demand	Anodyne	ETHR	41	35
O=C(NCc1csc(-c2ccccc2)n1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875295953	GI	On-Demand	Anodyne	EPHX2	28	42
O=C(NCc1csc(-c2ccccc2)n1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875295954	GI	On-Demand	Anodyne	EPHX2	28	42
Cc1cc(C(F)(F)F)ccc1CNC(=O)C(=O)NCc1ncc(Cl)s1	ZINC000875295961	GG	On-Demand	Anodyne	PPARD	31	40
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2CCN(C3CCN(C)CC3)C2)C[C@H]1CN(C)C	ZINC000875295967	GC	On-Demand	Anodyne	SLC6A5	18	42
CN(C)C[C@@H]1CN(C(=O)N[C@H]2CCN(C3CCN(C)CC3)C2)C[C@H]1CN(C)C	ZINC000875295968	GC	On-Demand	Anodyne	SLC6A5	18	42
O=C(NCC[C@@H]1CCSC1)C(=O)N[C@@H]1CCN(c2ncccc2Cl)C1	ZINC000875295972	GD	On-Demand	Anodyne	SIRT3	41	32
O=C(NCC[C@@H]1CCSC1)C(=O)N[C@@H]1CCN(c2ncccc2Cl)C1	ZINC000875295972	GD	On-Demand	Anodyne	SIRT2	46	32
O=C(NCC[C@@H]1CCSC1)C(=O)N[C@@H]1CCN(c2ncccc2Cl)C1	ZINC000875295972	GD	On-Demand	Anodyne	SIRT1	41	32
O=C(NCC[C@@H]1CCSC1)C(=O)N[C@H]1CCN(c2ncccc2Cl)C1	ZINC000875295973	GD	On-Demand	Anodyne	SIRT3	41	32
O=C(NCC[C@@H]1CCSC1)C(=O)N[C@H]1CCN(c2ncccc2Cl)C1	ZINC000875295973	GD	On-Demand	Anodyne	SIRT2	46	32
O=C(NCC[C@@H]1CCSC1)C(=O)N[C@H]1CCN(c2ncccc2Cl)C1	ZINC000875295973	GD	On-Demand	Anodyne	SIRT1	41	32
O=C(NCC[C@H]1CCSC1)C(=O)N[C@@H]1CCN(c2ncccc2Cl)C1	ZINC000875295974	GD	On-Demand	Anodyne	SIRT3	41	32
O=C(NCC[C@H]1CCSC1)C(=O)N[C@@H]1CCN(c2ncccc2Cl)C1	ZINC000875295974	GD	On-Demand	Anodyne	SIRT2	46	32
O=C(NCC[C@H]1CCSC1)C(=O)N[C@@H]1CCN(c2ncccc2Cl)C1	ZINC000875295974	GD	On-Demand	Anodyne	SIRT1	41	32
O=C(NCC[C@H]1CCSC1)C(=O)N[C@H]1CCN(c2ncccc2Cl)C1	ZINC000875295975	GD	On-Demand	Anodyne	SIRT3	41	32
O=C(NCC[C@H]1CCSC1)C(=O)N[C@H]1CCN(c2ncccc2Cl)C1	ZINC000875295975	GD	On-Demand	Anodyne	SIRT2	46	32
O=C(NCC[C@H]1CCSC1)C(=O)N[C@H]1CCN(c2ncccc2Cl)C1	ZINC000875295975	GD	On-Demand	Anodyne	SIRT1	41	32
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCCN(c2ccccc2)C1	ZINC000875295982	GE	On-Demand	Anodyne	CACNA1I	45	33
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCCN(c2ccccc2)C1	ZINC000875295983	GE	On-Demand	Anodyne	CACNA1I	45	33
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(C2CCN(C)CC2)C1	ZINC000875295986	ED	On-Demand	Anodyne	SLC6A5	18	42
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(C2CCN(C)CC2)C1	ZINC000875295987	ED	On-Demand	Anodyne	SLC6A5	18	42
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCC2CCN(CC(F)(F)F)CC2)C1	ZINC000875295991	GD	On-Demand	Anodyne	CACNA1I	43	34
O=C(NCCCCC1CC1)C(=O)NCC1CCN(CC(F)(F)F)CC1	ZINC000875295992	FE	On-Demand	Anodyne	CACNA1I	54	38
Cc1cc(C(F)(F)F)ccc1CNC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875295993	GD	On-Demand	Anodyne	CCR2	53	39
C[C@@H](CNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)C(C)(C)C	ZINC000875295995	EH	On-Demand	Anodyne	OPRL1	16	46
Cc1cc(C(F)(F)F)ccc1CNC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875296000	EF	On-Demand	Anodyne	CCR2	52	40
Cc1cc(C(F)(F)F)ccc1CNC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875296001	EF	On-Demand	Anodyne	CCR2	52	40
O=C(NCCCCC1CC1)C(=O)NC1CCN(c2cccnn2)CC1	ZINC000875296048	ED	On-Demand	Anodyne	DRD3	15	43
O=C(NCCCCC1CC1)C(=O)NC1CCN(c2cccnn2)CC1	ZINC000875296048	ED	On-Demand	Anodyne	SIRT1	40	33
O=C(NCCCCC1CC1)C(=O)NC1CCN(c2cccnn2)CC1	ZINC000875296048	ED	On-Demand	Anodyne	SCD1	19	42
COc1ccc(N2CCN(C(=O)COC(=O)CCCOc3ccccc3C)CC2)cc1	ZINC000875296107	IG	On-Demand	Clean	HTR1A	24	41
COc1ccc(N2CCN(C(=O)COC(=O)CCCOc3ccccc3C)CC2)cc1	ZINC000875296107	IG	On-Demand	Clean	HTR1D	15	41
C[C@@](CO)(Cc1ccc(Br)cc1)NC(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000875296177	GE	On-Demand	Anodyne	SLC6A5	19	43
C[C@@](CO)(Cc1ccc(Br)cc1)NC(=O)N[C@H]1CCN(C2CC2)C1	ZINC000875296178	GE	On-Demand	Anodyne	SLC6A5	19	43
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1CCN(C2CC2)C1	ZINC000875296190	ED	On-Demand	Anodyne	SLC6A5	17	41
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000875296191	ED	On-Demand	Anodyne	SLC6A5	17	41
O=C(COc1ccccc1Br)NNC(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000875296220	GD	On-Demand	Reactive	SLC6A5	20	45
O=C(COc1ccccc1Br)NNC(=O)N[C@H]1CCN(C2CC2)C1	ZINC000875296221	GD	On-Demand	Reactive	SLC6A5	20	45
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000875296254	DE	On-Demand	Bother	F2	21	40
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000875296254	DE	On-Demand	Bother	LGMN	63	32
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000875296254	DE	On-Demand	Bother	XIAP	23	41
CCCCCCCNC(=O)C(=O)NC1CCN(c2cccnn2)CC1	ZINC000875296257	ED	On-Demand	Mild	EPHX2	18	46
CCCCCCCNC(=O)C(=O)NC1CCN(c2cccnn2)CC1	ZINC000875296257	ED	On-Demand	Mild	ASAH1	61	32
O=C(NC1CC(Nc2ccccc2)C1)N[C@H]1CCN(C2CC2)C1	ZINC000875296338	DE	On-Demand	Anodyne	LTA4H	19	44
O=C(NC1CC(Nc2ccccc2)C1)N[C@H]1CCN(C2CC2)C1	ZINC000875296338	DE	On-Demand	Anodyne	SLC6A5	18	44
O=C(NC1CC(Nc2ccccc2)C1)N[C@H]1CCN(C2CC2)C1	ZINC000875296338	DE	On-Demand	Anodyne	EPHX2	25	41
O=C(NC1CC(Nc2ccccc2)C1)N[C@@H]1CCN(C2CC2)C1	ZINC000875296339	DE	On-Demand	Anodyne	LTA4H	19	44
O=C(NC1CC(Nc2ccccc2)C1)N[C@@H]1CCN(C2CC2)C1	ZINC000875296339	DE	On-Demand	Anodyne	SLC6A5	18	44
O=C(NC1CC(Nc2ccccc2)C1)N[C@@H]1CCN(C2CC2)C1	ZINC000875296339	DE	On-Demand	Anodyne	EPHX2	25	41
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000875296350	FE	On-Demand	Anodyne	SLC6A5	21	49
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)N[C@H]1CCN(C2CC2)C1	ZINC000875296351	FE	On-Demand	Anodyne	SLC6A5	21	49
O=C(NCC[C@@H]1CCSC1)C(=O)NC1CCN(c2cccnn2)CC1	ZINC000875296383	FC	On-Demand	Anodyne	SIRT3	41	33
O=C(NCC[C@@H]1CCSC1)C(=O)NC1CCN(c2cccnn2)CC1	ZINC000875296383	FC	On-Demand	Anodyne	SIRT2	45	33
O=C(NCC[C@@H]1CCSC1)C(=O)NC1CCN(c2cccnn2)CC1	ZINC000875296383	FC	On-Demand	Anodyne	SIRT1	41	33
O=C(NCC[C@H]1CCSC1)C(=O)NC1CCN(c2cccnn2)CC1	ZINC000875296384	FC	On-Demand	Anodyne	SIRT3	41	33
O=C(NCC[C@H]1CCSC1)C(=O)NC1CCN(c2cccnn2)CC1	ZINC000875296384	FC	On-Demand	Anodyne	SIRT2	45	33
O=C(NCC[C@H]1CCSC1)C(=O)NC1CCN(c2cccnn2)CC1	ZINC000875296384	FC	On-Demand	Anodyne	SIRT1	41	33
O=C(CCc1ccc(N2CCCS2(=O)=O)cc1)Oc1cccc(F)c1F	ZINC000875296501	GG	On-Demand	Anodyne	CDK1	15	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCCN(c2ccccc2)C1	ZINC000875296505	DF	On-Demand	Anodyne	KCNQ2	46	37
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCCN(c2ccccc2)C1	ZINC000875296505	DF	On-Demand	Anodyne	BIRC2	41	39
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCCN(c2ccccc2)C1	ZINC000875296508	DF	On-Demand	Anodyne	KCNQ2	46	37
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCCN(c2ccccc2)C1	ZINC000875296508	DF	On-Demand	Anodyne	BIRC2	41	39
CCC1(CC)CCCN1C(=O)NCc1cc(S(N)(=O)=O)ccc1F	ZINC000875296554	FE	On-Demand	Anodyne	SLC12A5	52	34
O=C(NCCOC[C@@H]1CCCO1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875296580	FE	On-Demand	Anodyne	CPT1A	58	32
O=C(NCCOC[C@@H]1CCCO1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875296583	FE	On-Demand	Anodyne	CPT1A	58	32
O=C(NCCOC[C@@H]1CCCO1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875296585	FE	On-Demand	Anodyne	CPT1A	58	32
O=C(NCCOC[C@@H]1CCCO1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875296587	FE	On-Demand	Anodyne	CPT1A	58	32
O=C(Nc1cc(N2CCCS2(=O)=O)ccc1Cl)[C@]12CCCC[C@@H]1C2	ZINC000875296596	FG	On-Demand	Anodyne	CDK1	17	41
CN1CCN(C(=O)NCc2nc(-c3cccc(Cl)c3)no2)CCC1(C)C	ZINC000875296598	GG	On-Demand	Anodyne	GRM5	18	44
O=C(Nc1cc(N2CCCS2(=O)=O)ccc1Cl)[C@]12CCCC[C@H]1C2	ZINC000875296599	FG	On-Demand	Anodyne	CDK1	17	41
O=C(Nc1cc(N2CCCS2(=O)=O)ccc1Cl)[C@@]12CCCC[C@@H]1C2	ZINC000875296600	FG	On-Demand	Anodyne	CDK1	17	41
O=C(Nc1cc(N2CCCS2(=O)=O)ccc1Cl)[C@@]12CCCC[C@H]1C2	ZINC000875296601	FG	On-Demand	Anodyne	CDK1	17	41
NS(=O)(=O)c1ccc(F)c(CNC(=O)N2C[C@H]3CC=CC[C@H]3C2)c1	ZINC000875296661	FD	On-Demand	Anodyne	CA2	37	41
NS(=O)(=O)c1ccc(F)c(CNC(=O)N2C[C@H]3CC=CC[C@H]3C2)c1	ZINC000875296661	FD	On-Demand	Anodyne	CA7	44	37
NS(=O)(=O)c1ccc(F)c(CNC(=O)N2C[C@H]3CC=CC[C@H]3C2)c1	ZINC000875296661	FD	On-Demand	Anodyne	CA5B	50	37
NS(=O)(=O)c1ccc(F)c(CNC(=O)N2C[C@H]3CC=CC[C@H]3C2)c1	ZINC000875296661	FD	On-Demand	Anodyne	CA5A	53	37
NS(=O)(=O)c1ccc(F)c(CNC(=O)N2C[C@H]3CC=CC[C@H]3C2)c1	ZINC000875296661	FD	On-Demand	Anodyne	EPHX2	15	45
COC(=O)N(C)NC(=O)N[C@H](C)CCC1CCCCC1	ZINC000875296693	CF	On-Demand	Reactive	CTSH	24	40
COC(=O)N(C)NC(=O)N[C@@H](C)CCC1CCCCC1	ZINC000875296694	CF	On-Demand	Reactive	CTSH	24	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1c(F)cccc1F)N(C)C	ZINC000875296699	GE	On-Demand	Anodyne	SLC6A3	57	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1c(F)cccc1F)N(C)C	ZINC000875296700	GE	On-Demand	Anodyne	SLC6A3	57	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1c(F)cccc1F)N(C)C	ZINC000875296701	GE	On-Demand	Anodyne	SLC6A3	57	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1c(F)cccc1F)N(C)C	ZINC000875296702	GE	On-Demand	Anodyne	SLC6A3	57	40
COC(=O)N(C)NC(=O)NCC1(c2cccc(Br)c2)CC1	ZINC000875296735	FE	On-Demand	Reactive	KCNA3	43	35
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCCN(c2ccccc2)C1	ZINC000875296741	DD	On-Demand	Anodyne	EPHX2	15	41
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCCN(c2ccccc2)C1	ZINC000875296742	DD	On-Demand	Anodyne	EPHX2	15	41
O=C(NCCCCC1CC1)C(=O)NCc1ccccc1CN1CCC(O)CC1	ZINC000875296760	GD	On-Demand	Anodyne	ACHE	31	42
O=C(NCCCCC1CC1)C(=O)NCc1ccccc1CN1CCC(O)CC1	ZINC000875296760	GD	On-Demand	Anodyne	CCR3	20	41
CONC(=O)C1CCN(C(=O)N[C@H]2CCCN(c3ccccc3)C2)CC1	ZINC000875296775	FD	On-Demand	Anodyne	EPHX2	33	43
CONC(=O)C1CCN(C(=O)N[C@@H]2CCCN(c3ccccc3)C2)CC1	ZINC000875296778	FD	On-Demand	Anodyne	EPHX2	33	43
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H]1CC[C@@H](SC)C1	ZINC000875296814	EF	On-Demand	Anodyne	ACE	43	41
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@H]1CC[C@H](SC)C1	ZINC000875296815	EF	On-Demand	Anodyne	ACE	43	41
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@H]1CC[C@@H](SC)C1	ZINC000875296817	EF	On-Demand	Anodyne	ACE	43	41
CC[C@H](CCc1ccccc1)NC(=O)C(=O)N[C@@H]1CC[C@H](SC)C1	ZINC000875296818	EF	On-Demand	Anodyne	ACE	43	41
O=C(Oc1cccc(F)c1F)c1cnn(CC2CC2)c1	ZINC000875296819	CF	On-Demand	Anodyne	PTGIR	46	41
CS[C@H]1CC[C@H](NC(=O)C(=O)NCc2cccc(F)c2F)C1	ZINC000875296869	ED	On-Demand	Anodyne	P2RX7	15	44
COc1ccc(-c2nnc(COC(=O)CCCOc3ccccc3C)o2)cc1	ZINC000875296871	GH	On-Demand	Anodyne	PPARG	43	36
COc1ccc(-c2nnc(COC(=O)CCCOc3ccccc3C)o2)cc1	ZINC000875296871	GH	On-Demand	Anodyne	PPARA	46	36
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2CCCN(c3ccccc3)C2)CC1	ZINC000875296950	FD	On-Demand	Anodyne	EPHX2	27	49
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2CCCN(c3ccccc3)C2)CC1	ZINC000875296952	FD	On-Demand	Anodyne	EPHX2	27	49
O=C(N[C@H]1CCCN(c2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875297051	ED	On-Demand	Anodyne	EPHX2	23	41
O=C(N[C@@H]1CCCN(c2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875297052	ED	On-Demand	Anodyne	EPHX2	23	41
CC(=O)N1CCC[C@@H]1C(=O)Oc1cccc(F)c1F	ZINC000875297059	CD	On-Demand	Anodyne	PREP	49	39
C[C@@H]1CN(C(=O)NCc2cc(S(N)(=O)=O)ccc2F)Cc2ccccc21	ZINC000875297100	GE	On-Demand	Anodyne	NAMPT	22	41
CN1CC[C@H]2CN(C(=O)NCc3cc(S(N)(=O)=O)ccc3F)CC[C@@H]21	ZINC000875297182	FC	On-Demand	Anodyne	CA2	31	42
CN1CC[C@H]2CN(C(=O)NCc3cc(S(N)(=O)=O)ccc3F)CC[C@@H]21	ZINC000875297182	FC	On-Demand	Anodyne	EPHX2	15	45
CN1CC[C@H]2CN(C(=O)NCc3cc(S(N)(=O)=O)ccc3F)CC[C@H]21	ZINC000875297184	FC	On-Demand	Anodyne	CA2	31	42
CN1CC[C@H]2CN(C(=O)NCc3cc(S(N)(=O)=O)ccc3F)CC[C@H]21	ZINC000875297184	FC	On-Demand	Anodyne	EPHX2	15	45
O=C(NCc1nc(-c2ccc(Cl)cc2)no1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875297211	GG	On-Demand	Anodyne	SPHK1	32	42
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCCN(c3ccccc3)C2)CC1	ZINC000875297212	FD	On-Demand	Anodyne	SLC6A1	46	32
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCCN(c3ccccc3)C2)CC1	ZINC000875297212	FD	On-Demand	Anodyne	EPHX2	32	42
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCCN(c3ccccc3)C2)CC1	ZINC000875297213	FD	On-Demand	Anodyne	SLC6A1	46	32
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCCN(c3ccccc3)C2)CC1	ZINC000875297213	FD	On-Demand	Anodyne	EPHX2	32	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2nc(-c3cccc(Cl)c3)no2)C1	ZINC000875297249	GF	On-Demand	Anodyne	GRM5	20	43
CCOC(=O)c1cc(CNC(=O)N[C@H]2CCCN(c3ccccc3)C2)on1	ZINC000875297261	FE	On-Demand	Anodyne	P2RY12	56	39
CCOC(=O)c1cc(CNC(=O)N[C@@H]2CCCN(c3ccccc3)C2)on1	ZINC000875297262	FE	On-Demand	Anodyne	P2RY12	56	39
C[C@]1(C(F)(F)F)CCN(C(=O)NCc2cc(S(N)(=O)=O)ccc2F)C1	ZINC000875297312	GD	On-Demand	Anodyne	TRPV1	65	36
O=C(Nc1cc(N2CCCS2(=O)=O)ccc1Cl)C1(F)CCOCC1	ZINC000875297317	GE	On-Demand	Anodyne	CDK1	17	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(c3ccccc3)C2)C1	ZINC000875297325	FE	On-Demand	Anodyne	ACE	48	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(c3ccccc3)C2)C1	ZINC000875297325	FE	On-Demand	Anodyne	P2RY12	59	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(c3ccccc3)C2)C1	ZINC000875297325	FE	On-Demand	Anodyne	BIRC2	41	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(c3ccccc3)C2)C1	ZINC000875297327	FE	On-Demand	Anodyne	ACE	48	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(c3ccccc3)C2)C1	ZINC000875297327	FE	On-Demand	Anodyne	P2RY12	59	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(c3ccccc3)C2)C1	ZINC000875297327	FE	On-Demand	Anodyne	BIRC2	41	42
CC(=O)c1ccc(N2CCN(C(=O)COC(=O)CCCOc3ccccc3C)CC2)c(F)c1	ZINC000875297379	JG	On-Demand	Anodyne	SLC6A9	23	47
CCCCCCCNC(=O)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000875297387	FF	On-Demand	Mild	TSPO	21	44
CCCCCCCNC(=O)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000875297387	FF	On-Demand	Mild	FAAH	34	48
CCCCCCCNC(=O)C(=O)NCc1ncc(-c2ccccc2)cn1	ZINC000875297387	FF	On-Demand	Mild	ASAH1	88	42
CC[C@]1(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2Cl)CCNC1=O	ZINC000875297411	GD	On-Demand	Anodyne	CDK1	18	42
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cccc(F)c1F	ZINC000875297542	CE	On-Demand	Anodyne	ANPEP	26	43
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cccc(F)c1F	ZINC000875297542	CE	On-Demand	Anodyne	CAPNS1	53	32
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cccc(F)c1F	ZINC000875297542	CE	On-Demand	Anodyne	CAPN1	59	40
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cccc(F)c1F	ZINC000875297542	CE	On-Demand	Anodyne	CAPN2	62	34
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cccc(F)c1F	ZINC000875297542	CE	On-Demand	Anodyne	NPR	53	35
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cccc(F)c1F	ZINC000875297542	CE	On-Demand	Anodyne	HPN	62	34
O=C(N[C@@H]1CCCN(c2ccccc2)C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875297584	GF	On-Demand	Anodyne	SMO	38	45
O=C(N[C@@H]1CCCN(c2ccccc2)C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875297584	GF	On-Demand	Anodyne	ETHR	46	34
O=C(N[C@H]1CCCN(c2ccccc2)C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875297585	GF	On-Demand	Anodyne	SMO	38	45
O=C(N[C@H]1CCCN(c2ccccc2)C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875297585	GF	On-Demand	Anodyne	ETHR	46	34
O=C(N[C@@H]1CCCN(c2ccccc2)C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875297586	GF	On-Demand	Anodyne	SMO	38	45
O=C(N[C@@H]1CCCN(c2ccccc2)C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875297586	GF	On-Demand	Anodyne	ETHR	46	34
O=C(N[C@H]1CCCN(c2ccccc2)C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875297587	GF	On-Demand	Anodyne	SMO	38	45
O=C(N[C@H]1CCCN(c2ccccc2)C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875297587	GF	On-Demand	Anodyne	ETHR	46	34
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nc(-c2ccc(Cl)cc2)no1	ZINC000875297603	GF	On-Demand	Anodyne	SLC6A2	15	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nc(-c2ccc(Cl)cc2)no1	ZINC000875297603	GF	On-Demand	Anodyne	SLC6A4	28	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nc(-c2ccc(Cl)cc2)no1	ZINC000875297603	GF	On-Demand	Anodyne	SLC6A3	58	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nc(-c2ccc(Cl)cc2)no1	ZINC000875297604	GF	On-Demand	Anodyne	SLC6A2	15	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nc(-c2ccc(Cl)cc2)no1	ZINC000875297604	GF	On-Demand	Anodyne	SLC6A4	28	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nc(-c2ccc(Cl)cc2)no1	ZINC000875297604	GF	On-Demand	Anodyne	SLC6A3	58	42
Cn1nnnc1C1CCN(C(=O)N[C@H]2CCCN(c3ccccc3)C2)CC1	ZINC000875297647	FD	On-Demand	Anodyne	EPHX2	15	40
Cn1nnnc1C1CCN(C(=O)N[C@@H]2CCCN(c3ccccc3)C2)CC1	ZINC000875297648	FD	On-Demand	Anodyne	EPHX2	15	40
CS[C@H]1CC[C@H](NC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)C1	ZINC000875297730	GE	On-Demand	Anodyne	ETHR	37	45
CN(C)C[C@@H]1CN(C(=O)N[C@H]2CCCN(c3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875297788	GE	On-Demand	Anodyne	SLC6A1	53	33
CN(C)C[C@@H]1CN(C(=O)N[C@H]2CCCN(c3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875297788	GE	On-Demand	Anodyne	EPHX2	17	42
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2CCCN(c3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875297789	GE	On-Demand	Anodyne	SLC6A1	53	33
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2CCCN(c3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875297789	GE	On-Demand	Anodyne	EPHX2	17	42
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](C)c1ccc(-c2ccncc2)cc1	ZINC000875297834	FE	On-Demand	Mild	ACACA	24	42
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](C)c1ccc(-c2ccncc2)cc1	ZINC000875297834	FE	On-Demand	Mild	ACACB	23	40
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)c1ccc(-c2ccncc2)cc1	ZINC000875297835	FE	On-Demand	Mild	ACACA	24	42
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)c1ccc(-c2ccncc2)cc1	ZINC000875297835	FE	On-Demand	Mild	ACACB	23	40
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)c1ccc(-c2ccncc2)cc1	ZINC000875297836	FE	On-Demand	Mild	ACACA	24	42
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)c1ccc(-c2ccncc2)cc1	ZINC000875297836	FE	On-Demand	Mild	ACACB	23	40
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](C)c1ccc(-c2ccncc2)cc1	ZINC000875297837	FE	On-Demand	Mild	ACACA	24	42
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](C)c1ccc(-c2ccncc2)cc1	ZINC000875297837	FE	On-Demand	Mild	ACACB	23	40
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCCN(c3ccccc3)C2)C1	ZINC000875297844	EF	On-Demand	Anodyne	SLC6A1	79	34
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCCN(c3ccccc3)C2)C1	ZINC000875297844	EF	On-Demand	Anodyne	EPHX2	22	47
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(c3ccccc3)C2)C1	ZINC000875297845	EF	On-Demand	Anodyne	SLC6A1	79	34
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(c3ccccc3)C2)C1	ZINC000875297845	EF	On-Demand	Anodyne	EPHX2	22	47
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCCN(c3ccccc3)C2)C1	ZINC000875297846	EF	On-Demand	Anodyne	SLC6A1	79	34
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCCN(c3ccccc3)C2)C1	ZINC000875297846	EF	On-Demand	Anodyne	EPHX2	22	47
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCCN(c3ccccc3)C2)C1	ZINC000875297847	EF	On-Demand	Anodyne	SLC6A1	79	34
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCCN(c3ccccc3)C2)C1	ZINC000875297847	EF	On-Demand	Anodyne	EPHX2	22	47
CN1CCN(C(=O)NCc2cc(S(N)(=O)=O)ccc2F)CCC1(C)C	ZINC000875297958	FD	On-Demand	Anodyne	CA2	22	40
O=C(Oc1cccc(F)c1F)c1ccnc(N2CCOCC2)n1	ZINC000875298010	DD	On-Demand	Anodyne	PIK3CA	20	43
CC(=O)C1CCN(C(=O)N[C@H]2CCCN(c3ccccc3)C2)CC1	ZINC000875298022	EF	On-Demand	Anodyne	EPHX2	34	44
CC(=O)C1CCN(C(=O)N[C@@H]2CCCN(c3ccccc3)C2)CC1	ZINC000875298024	EF	On-Demand	Anodyne	EPHX2	34	44
N#CCc1ccsc1C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1Cl	ZINC000875298030	GG	On-Demand	Mild	CDK1	16	41
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1CCCN(c2ccccc2)C1	ZINC000875298114	GF	On-Demand	Anodyne	ACKR3	62	33
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1CCCN(c2ccccc2)C1	ZINC000875298116	GF	On-Demand	Anodyne	ACKR3	62	33
CC[C@@H]1COCCN1CCNC(=O)NCc1nc(-c2ccc(Cl)cc2)no1	ZINC000875298136	GE	On-Demand	Anodyne	MTOR	65	40
CN1CCN(C2CCN(C(=O)N[C@H]3CCCN(c4ccccc4)C3)CC2)CC1	ZINC000875298197	GE	On-Demand	Anodyne	SLC6A5	16	41
CN1CCN(C2CCN(C(=O)N[C@H]3CCCN(c4ccccc4)C3)CC2)CC1	ZINC000875298197	GE	On-Demand	Anodyne	EPHX2	21	46
CN1CCN(C2CCN(C(=O)N[C@H]3CCCN(c4ccccc4)C3)CC2)CC1	ZINC000875298197	GE	On-Demand	Anodyne	L3MBTL3	106	43
CN1CCN(C2CCN(C(=O)N[C@@H]3CCCN(c4ccccc4)C3)CC2)CC1	ZINC000875298199	GE	On-Demand	Anodyne	SLC6A5	16	41
CN1CCN(C2CCN(C(=O)N[C@@H]3CCCN(c4ccccc4)C3)CC2)CC1	ZINC000875298199	GE	On-Demand	Anodyne	EPHX2	21	46
CN1CCN(C2CCN(C(=O)N[C@@H]3CCCN(c4ccccc4)C3)CC2)CC1	ZINC000875298199	GE	On-Demand	Anodyne	L3MBTL3	106	43
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H](C)c1ccc(-c2ccncc2)cc1	ZINC000875298235	GE	On-Demand	Mild	ACACA	24	43
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](C)c1ccc(-c2ccncc2)cc1	ZINC000875298237	GE	On-Demand	Mild	ACACA	24	43
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](C)c1ccc(-c2ccncc2)cc1	ZINC000875298239	GE	On-Demand	Mild	ACACA	24	43
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H](C)c1ccc(-c2ccncc2)cc1	ZINC000875298241	GE	On-Demand	Mild	ACACA	24	43
O=C(N[C@@H]1CCCN(c2ccccc2)C1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875298264	EG	On-Demand	Anodyne	EPHX2	15	40
O=C(N[C@@H]1CCCN(c2ccccc2)C1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875298266	EG	On-Demand	Anodyne	EPHX2	15	40
O=C(N[C@@H]1CCCN(c2ccccc2)C1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875298269	EG	On-Demand	Anodyne	EPHX2	15	40
O=C(N[C@@H]1CCCN(c2ccccc2)C1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875298271	EG	On-Demand	Anodyne	EPHX2	15	40
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)CCCOc2ccccc2C)c1	ZINC000875298273	GH	On-Demand	Anodyne	KCNK3	58	40
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)CCCOc2ccccc2C)c1	ZINC000875298273	GH	On-Demand	Anodyne	KCNK9	62	37
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)CCCOc2ccccc2C)c1	ZINC000875298276	GH	On-Demand	Anodyne	KCNK3	58	40
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)CCCOc2ccccc2C)c1	ZINC000875298276	GH	On-Demand	Anodyne	KCNK9	62	37
O=C(NCc1nc(-c2cccc(Cl)c2)no1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875298322	GG	On-Demand	Anodyne	GRM5	21	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nc(-c2cccc(Cl)c2)no1	ZINC000875298377	GF	On-Demand	Anodyne	SLC6A3	39	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nc(-c2cccc(Cl)c2)no1	ZINC000875298377	GF	On-Demand	Anodyne	GRM5	19	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nc(-c2cccc(Cl)c2)no1	ZINC000875298378	GF	On-Demand	Anodyne	SLC6A3	39	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nc(-c2cccc(Cl)c2)no1	ZINC000875298378	GF	On-Demand	Anodyne	GRM5	19	41
NS(=O)(=O)c1ccc(F)c(CNC(=O)N2CC[C@H]3CSC[C@H]3C2)c1	ZINC000875298460	FD	On-Demand	Anodyne	CA5B	45	34
NS(=O)(=O)c1ccc(F)c(CNC(=O)N2CC[C@H]3CSC[C@H]3C2)c1	ZINC000875298460	FD	On-Demand	Anodyne	CA5A	48	34
NS(=O)(=O)c1ccc(F)c(CNC(=O)N2CC[C@H]3CSC[C@H]3C2)c1	ZINC000875298460	FD	On-Demand	Anodyne	EPHX2	15	46
NS(=O)(=O)c1ccc(F)c(CNC(=O)N2CC[C@H]3CSC[C@@H]3C2)c1	ZINC000875298461	FD	On-Demand	Anodyne	CA5B	45	34
NS(=O)(=O)c1ccc(F)c(CNC(=O)N2CC[C@H]3CSC[C@@H]3C2)c1	ZINC000875298461	FD	On-Demand	Anodyne	CA5A	48	34
NS(=O)(=O)c1ccc(F)c(CNC(=O)N2CC[C@H]3CSC[C@@H]3C2)c1	ZINC000875298461	FD	On-Demand	Anodyne	EPHX2	15	46
NS(=O)(=O)c1ccc(F)c(CNC(=O)N2CC[C@@H]3CSC[C@@H]3C2)c1	ZINC000875298463	FD	On-Demand	Anodyne	CA5B	45	34
NS(=O)(=O)c1ccc(F)c(CNC(=O)N2CC[C@@H]3CSC[C@@H]3C2)c1	ZINC000875298463	FD	On-Demand	Anodyne	CA5A	48	34
NS(=O)(=O)c1ccc(F)c(CNC(=O)N2CC[C@@H]3CSC[C@@H]3C2)c1	ZINC000875298463	FD	On-Demand	Anodyne	EPHX2	15	46
O=CN1CCCN(C(=O)N[C@H]2CCCN(c3ccccc3)C2)CC1	ZINC000875298464	ED	On-Demand	Anodyne	EPHX2	15	43
O=CN1CCCN(C(=O)N[C@@H]2CCCN(c3ccccc3)C2)CC1	ZINC000875298465	ED	On-Demand	Anodyne	EPHX2	15	43
NS(=O)(=O)c1ccc(F)c(CNC(=O)N2CC[C@@H]3CSC[C@H]3C2)c1	ZINC000875298466	FD	On-Demand	Anodyne	CA5B	45	34
NS(=O)(=O)c1ccc(F)c(CNC(=O)N2CC[C@@H]3CSC[C@H]3C2)c1	ZINC000875298466	FD	On-Demand	Anodyne	CA5A	48	34
NS(=O)(=O)c1ccc(F)c(CNC(=O)N2CC[C@@H]3CSC[C@H]3C2)c1	ZINC000875298466	FD	On-Demand	Anodyne	EPHX2	15	46
O=C(NCCOC[C@@H]1CCCO1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875298482	FD	On-Demand	Anodyne	ADRB1	16	40
O=C(NCCOC[C@@H]1CCCO1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875298483	FD	On-Demand	Anodyne	ADRB1	16	40
O=C(NCCOC[C@H]1CCCO1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875298485	FD	On-Demand	Anodyne	ADRB1	16	40
O=C(NCCOC[C@H]1CCCO1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875298487	FD	On-Demand	Anodyne	ADRB1	16	40
O=CN1CCCN(C(=O)NCc2nc(-c3cccc(Cl)c3)no2)CC1	ZINC000875298577	FD	On-Demand	Anodyne	GRM5	18	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](Cc1ccc(C)cc1)c1ccccn1	ZINC000875298677	GG	On-Demand	Anodyne	SLC6A4	16	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](Cc1ccc(C)cc1)c1ccccn1	ZINC000875298677	GG	On-Demand	Anodyne	SLC6A3	39	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](Cc1ccc(C)cc1)c1ccccn1	ZINC000875298678	GG	On-Demand	Anodyne	SLC6A4	16	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](Cc1ccc(C)cc1)c1ccccn1	ZINC000875298678	GG	On-Demand	Anodyne	SLC6A3	39	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](Cc1ccc(C)cc1)c1ccccn1	ZINC000875298679	GG	On-Demand	Anodyne	SLC6A4	16	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](Cc1ccc(C)cc1)c1ccccn1	ZINC000875298679	GG	On-Demand	Anodyne	SLC6A3	39	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](Cc1ccc(C)cc1)c1ccccn1	ZINC000875298680	GG	On-Demand	Anodyne	SLC6A4	16	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](Cc1ccc(C)cc1)c1ccccn1	ZINC000875298680	GG	On-Demand	Anodyne	SLC6A3	39	40
O=C(Nc1cc(F)ccc1Cl)C1([C@@H]2CCCCO2)CCOCC1	ZINC000875298689	EH	On-Demand	Anodyne	SSTR3	18	41
O=C(Nc1cc(F)ccc1Cl)C1([C@H]2CCCCO2)CCOCC1	ZINC000875298690	EH	On-Demand	Anodyne	SSTR3	18	41
O=C(Nc1ccc(F)cc1C(F)(F)F)c1cccn(C2CC2)c1=O	ZINC000875298698	EH	On-Demand	Anodyne	RBP4	48	39
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cn1	ZINC000875298707	JG	On-Demand	Bother	CACNA1D	42	32
CCCCCCCNC(=O)C(=O)N[C@@H](CC)c1c(C)nn(C)c1C	ZINC000875298741	EF	On-Demand	Mild	ASAH1	58	35
CCCCCCCNC(=O)C(=O)N[C@H](CC)c1c(C)nn(C)c1C	ZINC000875298742	EF	On-Demand	Mild	ASAH1	58	35
COC(=O)c1ccc(C(=O)O[C@H](C(=O)Nc2cccc(OC)c2)c2ccccc2)cn1	ZINC000875298789	HG	On-Demand	Anodyne	MTNR1B	18	42
COC(=O)c1ccc(C(=O)O[C@H](C(=O)Nc2cccc(OC)c2)c2ccccc2)cn1	ZINC000875298789	HG	On-Demand	Anodyne	TAAR1	35	43
COC(=O)c1ccc(C(=O)O[C@H](C(=O)Nc2cccc(OC)c2)c2ccccc2)cn1	ZINC000875298789	HG	On-Demand	Anodyne	KCNK3	42	43
C=CC[C@H](NC(=O)N1CCc2nc(C3CC3)ncc2C1)c1ccncc1	ZINC000875298823	EG	On-Demand	Mild	MAPK1	52	39
C=CC[C@@H](NC(=O)N1CCc2nc(C3CC3)ncc2C1)c1ccncc1	ZINC000875298824	EG	On-Demand	Mild	MAPK1	52	39
COC(=O)c1ccc(C(=O)O[C@H](C(=O)Nc2cccc(C(F)(F)F)c2)c2ccccc2)cn1	ZINC000875298873	JI	On-Demand	Anodyne	LCK	27	40
COC(=O)c1ccc(C(=O)O[C@H](C(=O)Nc2cccc(C(F)(F)F)c2)c2ccccc2)cn1	ZINC000875298873	JI	On-Demand	Anodyne	KDR	17	41
COC(=O)c1ccc(C(=O)O[C@H](C(=O)Nc2cccc(C(F)(F)F)c2)c2ccccc2)cn1	ZINC000875298873	JI	On-Demand	Anodyne	TEK	33	41
COC(=O)c1ccc(C(=O)O[C@H](C(=O)Nc2cccc(C(F)(F)F)c2)c2ccccc2)cn1	ZINC000875298873	JI	On-Demand	Anodyne	BRAF	26	41
COC(=O)c1ccc(C(=O)O[C@H](C(=O)Nc2cccc(C(F)(F)F)c2)c2ccccc2)cn1	ZINC000875298873	JI	On-Demand	Anodyne	RIPK1	45	32
COC(=O)c1ccc(C(=O)O[C@H](C(=O)Nc2cccc(C(F)(F)F)c2)c2ccccc2)cn1	ZINC000875298873	JI	On-Demand	Anodyne	KCNK3	32	41
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2cccc(C(F)(F)F)c2)cn1	ZINC000875298880	GG	On-Demand	Anodyne	KIT	15	43
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2cccc(C(F)(F)F)c2)cn1	ZINC000875298880	GG	On-Demand	Anodyne	LCK	26	40
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2cccc(C(F)(F)F)c2)cn1	ZINC000875298880	GG	On-Demand	Anodyne	KDR	19	40
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2cccc(C(F)(F)F)c2)cn1	ZINC000875298880	GG	On-Demand	Anodyne	TEK	33	40
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2cccc(C(F)(F)F)c2)cn1	ZINC000875298880	GG	On-Demand	Anodyne	BRAF	29	42
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2cccc(C(F)(F)F)c2)cn1	ZINC000875298880	GG	On-Demand	Anodyne	RIPK1	41	33
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2cccc(C(F)(F)F)c2)cn1	ZINC000875298880	GG	On-Demand	Anodyne	PDS	43	39
C=CC[C@@H](NC(=O)N1C[C@@H](C(=O)OC)[C@H](c2ccc(O)cc2)C1)c1ccncc1	ZINC000875298900	GG	On-Demand	Mild	SLC6A3	16	42
C=CC[C@H](NC(=O)N1C[C@@H](C(=O)OC)[C@H](c2ccc(O)cc2)C1)c1ccncc1	ZINC000875298901	GG	On-Demand	Mild	SLC6A3	16	42
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2nc(-c3ccc(F)c(F)c3)cs2)cn1	ZINC000875298998	IG	On-Demand	Anodyne	MPL	39	45
CCCCCCCNC(=O)C(=O)NCc1ncc(CC)s1	ZINC000875299001	DE	On-Demand	Mild	ASAH1	81	36
CCC(CC)(CNC(=O)C(=O)NCc1ccc2cccnc2c1)SC	ZINC000875299002	FF	On-Demand	Anodyne	SUCNR1	53	36
CCC(CC)(CNC(=O)C(=O)NCc1cccc(F)c1F)SC	ZINC000875299005	EF	On-Demand	Anodyne	P2RX7	17	43
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000875299008	FD	On-Demand	Anodyne	MMP1	18	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000875299010	FD	On-Demand	Anodyne	MMP1	18	41
C=CC[C@H](NC(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1C)c1ccncc1	ZINC000875299071	GI	On-Demand	Mild	SLC18A2	51	36
C=CC[C@H](NC(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1C)c1ccncc1	ZINC000875299071	GI	On-Demand	Mild	MTNR1B	15	49
C=CC[C@@H](NC(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1C)c1ccncc1	ZINC000875299072	GI	On-Demand	Mild	SLC18A2	51	36
C=CC[C@@H](NC(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1C)c1ccncc1	ZINC000875299072	GI	On-Demand	Mild	MTNR1B	15	49
C=CC[C@@H](NC(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1C)c1ccncc1	ZINC000875299073	GI	On-Demand	Mild	SLC18A2	51	36
C=CC[C@@H](NC(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1C)c1ccncc1	ZINC000875299073	GI	On-Demand	Mild	MTNR1B	15	49
C=CC[C@H](NC(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1C)c1ccncc1	ZINC000875299075	GI	On-Demand	Mild	SLC18A2	51	36
C=CC[C@H](NC(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1C)c1ccncc1	ZINC000875299075	GI	On-Demand	Mild	MTNR1B	15	49
C=CC[C@H](NC(=O)N1CCc2nc(COC)ncc2C1)c1ccncc1	ZINC000875299188	FE	On-Demand	Mild	MAPK1	51	38
C=CC[C@@H](NC(=O)N1CCc2nc(COC)ncc2C1)c1ccncc1	ZINC000875299189	FE	On-Demand	Mild	MAPK1	51	38
COC(=O)c1ccc(C(=O)O[C@H](C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)c2ccccc2)cn1	ZINC000875299202	JK	On-Demand	Anodyne	RAF1	32	42
CCOC(=O)N1CCN(C(=O)COC(=O)c2ccc(C(=O)OC)nc2)CC1	ZINC000875299276	GC	On-Demand	Anodyne	P2RY12	75	41
CONC(=O)C1CCN(C(=O)N[C@@H](Cc2ccc(C)cc2)c2ccccn2)CC1	ZINC000875299288	GF	On-Demand	Anodyne	GRIN2B	17	41
CONC(=O)C1CCN(C(=O)N[C@@H](Cc2ccc(C)cc2)c2ccccn2)CC1	ZINC000875299288	GF	On-Demand	Anodyne	F11	43	40
CONC(=O)C1CCN(C(=O)N[C@@H](Cc2ccc(C)cc2)c2ccccn2)CC1	ZINC000875299288	GF	On-Demand	Anodyne	CALCRL	24	44
CONC(=O)C1CCN(C(=O)N[C@H](Cc2ccc(C)cc2)c2ccccn2)CC1	ZINC000875299289	GF	On-Demand	Anodyne	GRIN2B	17	41
CONC(=O)C1CCN(C(=O)N[C@H](Cc2ccc(C)cc2)c2ccccn2)CC1	ZINC000875299289	GF	On-Demand	Anodyne	F11	43	40
CONC(=O)C1CCN(C(=O)N[C@H](Cc2ccc(C)cc2)c2ccccn2)CC1	ZINC000875299289	GF	On-Demand	Anodyne	CALCRL	24	44
COC(=O)c1ccc(C(=O)O[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)cn1	ZINC000875299338	JH	On-Demand	Bother	COLA	17	40
COC(=O)c1ccc(C(=O)O[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)cn1	ZINC000875299338	JH	On-Demand	Bother	TAAR1	20	43
CC(=O)C1CCN(C(=O)N[C@@H](Cc2ccc(C)cc2)c2ccccn2)CC1	ZINC000875299368	FH	On-Demand	Anodyne	CALCRL	30	47
CC(=O)C1CCN(C(=O)N[C@H](Cc2ccc(C)cc2)c2ccccn2)CC1	ZINC000875299369	FH	On-Demand	Anodyne	CALCRL	30	47
CCc1cnc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)s1	ZINC000875299408	FD	On-Demand	Anodyne	SIRT3	58	37
CCc1cnc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)s1	ZINC000875299408	FD	On-Demand	Anodyne	SIRT2	57	36
CCc1cnc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)s1	ZINC000875299408	FD	On-Demand	Anodyne	SIRT1	55	35
C=CC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccncc1	ZINC000875299420	EE	On-Demand	Mild	SLC6A3	40	39
C=CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccncc1	ZINC000875299421	EE	On-Demand	Mild	SLC6A3	40	39
C=CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccncc1	ZINC000875299423	EE	On-Demand	Mild	SLC6A3	40	39
C=CC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccncc1	ZINC000875299425	EE	On-Demand	Mild	SLC6A3	40	39
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cn1	ZINC000875299435	FD	On-Demand	Bother	CACNA1C	52	39
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cn1	ZINC000875299435	FD	On-Demand	Bother	CACNA1D	82	38
C=CC[C@H](NC(=O)N1CCc2ccc(NC(C)=O)cc2C1)c1ccncc1	ZINC000875299509	FG	On-Demand	Mild	MAPK1	44	35
C=CC[C@@H](NC(=O)N1CCc2ccc(NC(C)=O)cc2C1)c1ccncc1	ZINC000875299510	FG	On-Demand	Mild	MAPK1	44	35
C=CC[C@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)c1ccncc1	ZINC000875299513	GH	On-Demand	Mild	KCNA3	43	37
C=CC[C@@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)c1ccncc1	ZINC000875299514	GH	On-Demand	Mild	KCNA3	43	37
COC(=O)c1ccc(C(=O)O[C@H](C(=O)Nc2ccc(OC)c(Cl)c2)c2ccccc2)cn1	ZINC000875299555	JI	On-Demand	Anodyne	GRM4	35	51
C=CC[C@H](NC(=O)N[C@H](CC)[C@H](O)c1ccccc1)c1ccncc1	ZINC000875299585	EH	On-Demand	Mild	TACR3	40	34
C=CC[C@H](NC(=O)N[C@@H](CC)[C@@H](O)c1ccccc1)c1ccncc1	ZINC000875299586	EH	On-Demand	Mild	TACR3	40	34
C=CC[C@H](NC(=O)N[C@@H](CC)[C@H](O)c1ccccc1)c1ccncc1	ZINC000875299587	EH	On-Demand	Mild	TACR3	40	34
C=CC[C@H](NC(=O)N[C@H](CC)[C@@H](O)c1ccccc1)c1ccncc1	ZINC000875299588	EH	On-Demand	Mild	TACR3	40	34
C=CCN(CC=C)C(=O)COC(=O)c1ccc(C(=O)OC)nc1	ZINC000875299597	DD	On-Demand	Mild	LSS	43	38
C=CC[C@@H](NC(=O)N1CC[C@]2(CCc3ccccc32)C1)c1ccncc1	ZINC000875299778	EH	On-Demand	Mild	NPY5R	17	40
C=CC[C@@H](NC(=O)N1CC[C@@]2(CCc3ccccc32)C1)c1ccncc1	ZINC000875299779	EH	On-Demand	Mild	NPY5R	17	40
C=CC[C@H](NC(=O)N1CC[C@]2(CCc3ccccc32)C1)c1ccncc1	ZINC000875299780	EH	On-Demand	Mild	NPY5R	17	40
C=CC[C@H](NC(=O)N1CC[C@@]2(CCc3ccccc32)C1)c1ccncc1	ZINC000875299781	EH	On-Demand	Mild	NPY5R	17	40
C=CC[C@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccncc1	ZINC000875299796	FE	On-Demand	Mild	L3MBTL3	45	38
C=CC[C@H](NC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1)c1ccncc1	ZINC000875299808	FH	On-Demand	Mild	EPHX2	15	42
C=CC[C@@H](NC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1)c1ccncc1	ZINC000875299809	FH	On-Demand	Mild	EPHX2	15	42
C=CC[C@H](NC(=O)NCCc1ccc(OC)c(O)c1)c1ccncc1	ZINC000875299836	EF	On-Demand	Mild	INHA	44	35
C=CC[C@@H](NC(=O)NCCc1ccc(OC)c(O)c1)c1ccncc1	ZINC000875299837	EF	On-Demand	Mild	INHA	44	35
O=C(Nc1cc(F)ccc1Cl)C1([C@@H]2CCCCO2)CCC1	ZINC000875299855	DI	On-Demand	Anodyne	SSTR3	21	42
O=C(Nc1cc(F)ccc1Cl)C1([C@H]2CCCCO2)CCC1	ZINC000875299856	DI	On-Demand	Anodyne	SSTR3	21	42
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)cn1	ZINC000875299865	ID	On-Demand	Anodyne	FPR2	58	44
C=CC[C@H](NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1)c1ccncc1	ZINC000875299875	GH	On-Demand	Mild	SMO	36	40
C=CC[C@H](NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1)c1ccncc1	ZINC000875299875	GH	On-Demand	Mild	ETHR	62	44
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2cccc(C(C)=O)c2)cn1	ZINC000875299939	FE	On-Demand	Anodyne	KCNK3	42	33
C=CC[C@H](NC(=O)N[C@H](CC)c1cccc(OC)c1OC)c1ccncc1	ZINC000875299951	FI	On-Demand	Mild	TACR3	32	40
C=CC[C@@H](NC(=O)N[C@H](CC)c1cccc(OC)c1OC)c1ccncc1	ZINC000875299953	FI	On-Demand	Mild	TACR3	32	40
C=CC[C@H](NC(=O)N[C@@H](CC)c1cccc(OC)c1OC)c1ccncc1	ZINC000875299955	FI	On-Demand	Mild	TACR3	32	40
C=CC[C@@H](NC(=O)N[C@@H](CC)c1cccc(OC)c1OC)c1ccncc1	ZINC000875299956	FI	On-Demand	Mild	TACR3	32	40
CCCc1ccc(C(=O)COC(=O)c2ccc(C(=O)OC)nc2)cc1	ZINC000875300008	EF	On-Demand	Anodyne	FAAH	21	45
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)cn1	ZINC000875300079	HD	On-Demand	Bother	KCNMA1	19	45
C=CC[C@@H](NC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)c1ccncc1	ZINC000875300236	FF	On-Demand	Mild	ETHR	46	34
C=CC[C@H](NC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)c1ccncc1	ZINC000875300237	FF	On-Demand	Mild	ETHR	46	34
C=CC[C@@H](NC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)c1ccncc1	ZINC000875300239	FF	On-Demand	Mild	ETHR	46	34
C=CC[C@H](NC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)c1ccncc1	ZINC000875300242	FF	On-Demand	Mild	ETHR	46	34
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(Oc3ccccc3)cc2)cn1	ZINC000875300331	HH	On-Demand	Anodyne	LTA4H	43	38
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(Oc3ccccc3)cc2)cn1	ZINC000875300331	HH	On-Demand	Anodyne	NPY5R	30	42
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(Oc3ccccc3)cc2)cn1	ZINC000875300331	HH	On-Demand	Anodyne	PDGFRA	41	39
C=CC[C@H](NC(=O)NC[C@@H](C)c1ccc(S(C)(=O)=O)cc1)c1ccncc1	ZINC000875300394	GG	On-Demand	Mild	CTSF	40	37
C=CC[C@@H](NC(=O)NC[C@@H](C)c1ccc(S(C)(=O)=O)cc1)c1ccncc1	ZINC000875300395	GG	On-Demand	Mild	CTSF	40	37
C=CC[C@@H](NC(=O)NC[C@H](C)c1ccc(S(C)(=O)=O)cc1)c1ccncc1	ZINC000875300396	GG	On-Demand	Mild	CTSF	40	37
C=CC[C@H](NC(=O)NC[C@H](C)c1ccc(S(C)(=O)=O)cc1)c1ccncc1	ZINC000875300397	GG	On-Demand	Mild	CTSF	40	37
C=CC[C@H](NC(=O)N1CCN(c2cccc(F)c2)CC1)c1ccncc1	ZINC000875300402	FG	On-Demand	Mild	CACNA1H	27	40
C=CC[C@@H](NC(=O)N1CCN(c2cccc(F)c2)CC1)c1ccncc1	ZINC000875300403	FG	On-Demand	Mild	CACNA1H	27	40
C=CC[C@H](NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1)c1ccncc1	ZINC000875300420	GH	On-Demand	Mild	DRD4	16	41
C=CC[C@H](NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1)c1ccncc1	ZINC000875300420	GH	On-Demand	Mild	KCNK3	41	38
C=CC[C@@H](NC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C)c1ccncc1	ZINC000875300461	GG	On-Demand	Mild	GPR119	21	41
C=CC[C@H](NC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C)c1ccncc1	ZINC000875300462	GG	On-Demand	Mild	GPR119	21	41
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](Cc2ccc(C)cc2)c2ccccn2)C1	ZINC000875300491	FH	On-Demand	Anodyne	CALCRL	29	44
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](Cc2ccc(C)cc2)c2ccccn2)C1	ZINC000875300492	FH	On-Demand	Anodyne	CALCRL	29	44
CC(=O)[C@H]1CCCN(C(=O)N[C@H](Cc2ccc(C)cc2)c2ccccn2)C1	ZINC000875300493	FH	On-Demand	Anodyne	CALCRL	29	44
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](Cc2ccc(C)cc2)c2ccccn2)C1	ZINC000875300494	FH	On-Demand	Anodyne	CALCRL	29	44
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2nc(-c3ccccc3)cs2)cn1	ZINC000875300512	HG	On-Demand	Anodyne	ROCK1	21	43
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2nc(-c3ccccc3)cs2)cn1	ZINC000875300512	HG	On-Demand	Anodyne	ROCK2	15	43
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cn1	ZINC000875300610	HC	On-Demand	Anodyne	CA2	78	50
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cn1	ZINC000875300610	HC	On-Demand	Anodyne	CA1	70	46
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cn1	ZINC000875300610	HC	On-Demand	Anodyne	CA7	35	49
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cn1	ZINC000875300610	HC	On-Demand	Anodyne	CA4	54	44
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cn1	ZINC000875300610	HC	On-Demand	Anodyne	CA14	44	49
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cn1	ZINC000875300610	HC	On-Demand	Anodyne	CA12	54	45
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cn1	ZINC000875300610	HC	On-Demand	Anodyne	CA9	56	50
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cn1	ZINC000875300610	HC	On-Demand	Anodyne	UREA_CANEN	29	42
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cn1	ZINC000875300610	HC	On-Demand	Anodyne	CYNT	39	41
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cn1	ZINC000875300610	HC	On-Demand	Anodyne	MTCA1	48	43
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cn1	ZINC000875300610	HC	On-Demand	Anodyne	P96878_MYCTU	60	43
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(N3CCOCC3)cc2)cn1	ZINC000875300652	HD	On-Demand	Anodyne	PIK3CA	34	44
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(N3CCOCC3)cc2)cn1	ZINC000875300652	HD	On-Demand	Anodyne	PRNP	42	36
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(N3CCOCC3)cc2)cn1	ZINC000875300652	HD	On-Demand	Anodyne	MAPKAPK5	40	35
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(N3CCOCC3)cc2)cn1	ZINC000875300652	HD	On-Demand	Anodyne	MTOR	68	44
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(N3CCOCC3)cc2)cn1	ZINC000875300652	HD	On-Demand	Anodyne	PIK3CG	32	44
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(N3CCOCC3)cc2)cn1	ZINC000875300652	HD	On-Demand	Anodyne	STAT6	56	37
CC(=O)C1CCN(C(=O)NCc2ccc(N(C)C)cc2C)CC1	ZINC000875300656	DF	On-Demand	Clean	EPHX2	23	47
CS[C@H](C)CNC(=O)C(=O)N1CCN(c2ccc(C#N)cc2)CC1	ZINC000875300657	ED	On-Demand	Mild	CTSK	15	50
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(OCc3ccccc3)cc2)cn1	ZINC000875300674	IH	On-Demand	Anodyne	ADRB1	16	41
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(OCc3ccccc3)cc2)cn1	ZINC000875300674	IH	On-Demand	Anodyne	TSHR	56	35
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(OCc3ccccc3)cc2)cn1	ZINC000875300674	IH	On-Demand	Anodyne	LTA4H	32	55
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(OCc3ccccc3)cc2)cn1	ZINC000875300674	IH	On-Demand	Anodyne	TIMP3	47	33
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(OCc3ccccc3)cc2)cn1	ZINC000875300674	IH	On-Demand	Anodyne	FAAH	20	43
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(C(N)=O)cc2)cn1	ZINC000875300676	FD	On-Demand	Anodyne	ACR	45	33
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)c2ccc(OC)cc2OC)cn1	ZINC000875300715	FE	On-Demand	Anodyne	LUCI_LUCLA	16	42
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)N2CCc3ccccc32)cn1	ZINC000875300743	FE	On-Demand	Anodyne	AVPR2	40	36
CCC(=O)Nc1ccc(C(=O)COC(=O)c2ccc(C(=O)OC)nc2)cc1	ZINC000875300748	FE	On-Demand	Anodyne	ACR	41	33
COC(=O)c1ccc(C(=O)O[C@H](c2ccccc2)c2ccc(Cl)cc2)cn1	ZINC000875300750	GI	On-Demand	Anodyne	UTS2	48	38
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)NC23CC4CC(CC(C4)C2)C3)cn1	ZINC000875300778	GE	On-Demand	Anodyne	EPHX2	61	46
CS[C@H](C)CNC(=O)C(=O)NC[C@@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000875300834	GD	On-Demand	Anodyne	DRD4	15	42
CS[C@H](C)CNC(=O)C(=O)NC[C@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000875300836	GD	On-Demand	Anodyne	DRD4	15	42
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)cn1	ZINC000875300837	IH	On-Demand	Anodyne	RAF1	33	44
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)cn1	ZINC000875300837	IH	On-Demand	Anodyne	BRAF	17	41
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)cn1	ZINC000875300910	JD	On-Demand	Anodyne	TGM2	54	34
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)cn1	ZINC000875300910	JD	On-Demand	Anodyne	F13A1	65	37
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)cn1	ZINC000875300910	JD	On-Demand	Anodyne	MERTK	31	42
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)cn1	ZINC000875300910	JD	On-Demand	Anodyne	NAMPT	29	43
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)N2CCCc3ccccc32)cn1	ZINC000875300927	FE	On-Demand	Anodyne	AVPR2	54	43
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)N2CCCc3ccccc32)cn1	ZINC000875300927	FE	On-Demand	Anodyne	AVPR1A	17	41
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(S(=O)(=O)N3CCCCC3)cc2)cn1	ZINC000875300931	JE	On-Demand	Anodyne	TGM2	61	38
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(S(=O)(=O)N3CCCCC3)cc2)cn1	ZINC000875300931	JE	On-Demand	Anodyne	F13A1	70	42
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(S(=O)(=O)N3CCCCC3)cc2)cn1	ZINC000875300931	JE	On-Demand	Anodyne	NAMPT	34	42
CCOC(=O)Nc1ccc2c(COC(=O)c3ccc(C(=O)OC)nc3)cc(=O)oc2c1	ZINC000875300932	IF	On-Demand	Anodyne	MAOB	15	40
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(-c3nc4ccc(C)cc4s3)cc2)cn1	ZINC000875300934	JJ	On-Demand	Anodyne	APP	21	46
CS[C@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875300982	GE	On-Demand	Anodyne	DRD2	27	49
CS[C@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875300982	GE	On-Demand	Anodyne	DRD4	47	44
CS[C@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875300982	GE	On-Demand	Anodyne	ACHE	66	61
CS[C@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875300982	GE	On-Demand	Anodyne	DRD3	18	44
CS[C@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875300982	GE	On-Demand	Anodyne	SLC6A3	20	51
CS[C@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875300982	GE	On-Demand	Anodyne	HTR4	36	45
CS[C@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875300982	GE	On-Demand	Anodyne	SIGMAR1	66	49
CS[C@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875300982	GE	On-Demand	Anodyne	BCHE	18	49
CS[C@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875300982	GE	On-Demand	Anodyne	MCHR1	25	43
CS[C@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875300982	GE	On-Demand	Anodyne	CACNA1G	30	42
CS[C@H](C)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875300982	GE	On-Demand	Anodyne	CACNA1I	53	37
CS[C@H](C)CNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875300987	FD	On-Demand	Anodyne	ETHR	55	48
CS[C@H](C)CNC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875301092	ED	On-Demand	Anodyne	OXTR	41	34
CS[C@H](C)CNC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875301093	ED	On-Demand	Anodyne	OXTR	41	34
COc1ccc(N2CCN(C(=O)C(=O)NC[C@@H](C)SC)CC2)c(OC)c1	ZINC000875301096	GD	On-Demand	Clean	DRD2	29	41
COc1ccc(N2CCN(C(=O)C(=O)NC[C@@H](C)SC)CC2)c(OC)c1	ZINC000875301096	GD	On-Demand	Clean	DRD4	41	33
COc1ccc(N2CCN(C(=O)C(=O)NC[C@@H](C)SC)CC2)c(OC)c1	ZINC000875301096	GD	On-Demand	Clean	DRD3	45	38
COc1ccc(N2CCN(C(=O)C(=O)NC[C@H](C)SC)CC2)c(OC)c1	ZINC000875301097	GD	On-Demand	Clean	DRD2	29	41
COc1ccc(N2CCN(C(=O)C(=O)NC[C@H](C)SC)CC2)c(OC)c1	ZINC000875301097	GD	On-Demand	Clean	DRD4	41	33
COc1ccc(N2CCN(C(=O)C(=O)NC[C@H](C)SC)CC2)c(OC)c1	ZINC000875301097	GD	On-Demand	Clean	DRD3	45	38
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2cccc(C)c2)cn1	ZINC000875301146	EE	On-Demand	Anodyne	KCNK3	71	39
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2cccc(C)c2)cn1	ZINC000875301146	EE	On-Demand	Anodyne	KCNK9	52	38
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NC[C@@H](C)SC)CC2	ZINC000875301229	FE	On-Demand	Anodyne	SLC18A2	52	38
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NC[C@@H](C)SC)CC2	ZINC000875301229	FE	On-Demand	Anodyne	MTNR1B	15	45
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NC[C@H](C)SC)CC2	ZINC000875301230	FE	On-Demand	Anodyne	SLC18A2	52	38
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NC[C@H](C)SC)CC2	ZINC000875301230	FE	On-Demand	Anodyne	MTNR1B	15	45
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NC[C@H](C)SC)CC2	ZINC000875301231	FE	On-Demand	Anodyne	SLC18A2	52	38
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NC[C@H](C)SC)CC2	ZINC000875301231	FE	On-Demand	Anodyne	MTNR1B	15	45
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NC[C@@H](C)SC)CC2	ZINC000875301232	FE	On-Demand	Anodyne	SLC18A2	52	38
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NC[C@@H](C)SC)CC2	ZINC000875301232	FE	On-Demand	Anodyne	MTNR1B	15	45
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)N2CCc3ccccc3C2)cn1	ZINC000875301233	FD	On-Demand	Anodyne	NOD2	40	35
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(C(C)(C)C)cc2)cn1	ZINC000875301303	GG	On-Demand	Anodyne	TRPV1	18	40
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(N(C)C)cc2C)C1	ZINC000875301331	DF	On-Demand	Clean	AVPR2	22	41
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(N(C)C)cc2C)C1	ZINC000875301332	DF	On-Demand	Clean	AVPR2	22	41
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)cn1	ZINC000875301340	FE	On-Demand	Anodyne	TPP2	67	38
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)cn1	ZINC000875301342	FE	On-Demand	Anodyne	TPP2	67	38
COC(=O)c1ccc(C(=O)O[C@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)cn1	ZINC000875301345	HH	On-Demand	Anodyne	NPY5R	19	41
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(N3CCCCC3)cc2)cn1	ZINC000875301372	HG	On-Demand	Anodyne	PRNP	47	37
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(C(F)(F)F)cc2)cn1	ZINC000875301438	GG	On-Demand	Anodyne	P2RY1	16	44
CS[C@H](C)CNC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875301486	FD	On-Demand	Anodyne	ROCK1	25	42
CS[C@H](C)CNC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875301486	FD	On-Demand	Anodyne	ROCK2	17	42
N#CCc1ccsc1C(=O)N1CCCC[C@H]1c1nc(-c2ccccc2)no1	ZINC000875301488	GI	On-Demand	Mild	CPT1A	117	52
N#CCc1ccsc1C(=O)N1CCCC[C@H]1c1nc(-c2ccccc2)no1	ZINC000875301488	GI	On-Demand	Mild	GRM5	19	58
N#CCc1ccsc1C(=O)N1CCCC[C@H]1c1nc(-c2ccccc2)no1	ZINC000875301488	GI	On-Demand	Mild	ETHR	47	41
N#CCc1ccsc1C(=O)N1CCCC[C@@H]1c1nc(-c2ccccc2)no1	ZINC000875301489	GI	On-Demand	Mild	CPT1A	117	52
N#CCc1ccsc1C(=O)N1CCCC[C@@H]1c1nc(-c2ccccc2)no1	ZINC000875301489	GI	On-Demand	Mild	GRM5	19	58
N#CCc1ccsc1C(=O)N1CCCC[C@@H]1c1nc(-c2ccccc2)no1	ZINC000875301489	GI	On-Demand	Mild	ETHR	47	41
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(C)c(S(=O)(=O)N3CCOCC3)c2)cn1	ZINC000875301491	JD	On-Demand	Anodyne	CNR2	15	59
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(C)c(S(=O)(=O)N3CCOCC3)c2)cn1	ZINC000875301491	JD	On-Demand	Anodyne	NR1H4	20	48
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)cn1	ZINC000875301530	GE	On-Demand	Bother	TAAR1	17	43
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)NCc2ccccc2)cn1	ZINC000875301611	ED	On-Demand	Anodyne	FURIN	41	32
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)NCc2ccccc2)cn1	ZINC000875301611	ED	On-Demand	Anodyne	AMP1_PLAFQ	37	40
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)NCc2ccccc2)cn1	ZINC000875301611	ED	On-Demand	Anodyne	PDS	59	38
CONC(=O)C1CCN(C(=O)NCc2ccc(N(C)C)cc2C)CC1	ZINC000875301616	ED	On-Demand	Clean	EPHX2	26	48
O=C(NC1CC(Nc2ccccc2)C1)N[C@H]1CCN(CCN2CCOCC2)C1	ZINC000875301653	GD	On-Demand	Anodyne	DRD2	15	47
O=C(NC1CC(Nc2ccccc2)C1)N[C@H]1CCN(CCN2CCOCC2)C1	ZINC000875301653	GD	On-Demand	Anodyne	DRD4	21	47
O=C(NC1CC(Nc2ccccc2)C1)N[C@H]1CCN(CCN2CCOCC2)C1	ZINC000875301653	GD	On-Demand	Anodyne	LTA4H	23	42
O=C(NC1CC(Nc2ccccc2)C1)N[C@H]1CCN(CCN2CCOCC2)C1	ZINC000875301653	GD	On-Demand	Anodyne	CASR	44	39
O=C(NC1CC(Nc2ccccc2)C1)N[C@H]1CCN(CCN2CCOCC2)C1	ZINC000875301653	GD	On-Demand	Anodyne	SIGMAR1	26	46
O=C(NC1CC(Nc2ccccc2)C1)N[C@H]1CCN(CCN2CCOCC2)C1	ZINC000875301653	GD	On-Demand	Anodyne	CCR3	38	43
O=C(NC1CC(Nc2ccccc2)C1)N[C@H]1CCN(CCN2CCOCC2)C1	ZINC000875301653	GD	On-Demand	Anodyne	EPHX2	40	44
O=C(NC1CC(Nc2ccccc2)C1)N[C@H]1CCN(CCN2CCOCC2)C1	ZINC000875301653	GD	On-Demand	Anodyne	BRD2	15	40
O=C(NC1CC(Nc2ccccc2)C1)N[C@@H]1CCN(CCN2CCOCC2)C1	ZINC000875301654	GD	On-Demand	Anodyne	DRD2	15	47
O=C(NC1CC(Nc2ccccc2)C1)N[C@@H]1CCN(CCN2CCOCC2)C1	ZINC000875301654	GD	On-Demand	Anodyne	DRD4	21	47
O=C(NC1CC(Nc2ccccc2)C1)N[C@@H]1CCN(CCN2CCOCC2)C1	ZINC000875301654	GD	On-Demand	Anodyne	LTA4H	23	42
O=C(NC1CC(Nc2ccccc2)C1)N[C@@H]1CCN(CCN2CCOCC2)C1	ZINC000875301654	GD	On-Demand	Anodyne	CASR	44	39
O=C(NC1CC(Nc2ccccc2)C1)N[C@@H]1CCN(CCN2CCOCC2)C1	ZINC000875301654	GD	On-Demand	Anodyne	SIGMAR1	26	46
O=C(NC1CC(Nc2ccccc2)C1)N[C@@H]1CCN(CCN2CCOCC2)C1	ZINC000875301654	GD	On-Demand	Anodyne	CCR3	38	43
O=C(NC1CC(Nc2ccccc2)C1)N[C@@H]1CCN(CCN2CCOCC2)C1	ZINC000875301654	GD	On-Demand	Anodyne	EPHX2	40	44
O=C(NC1CC(Nc2ccccc2)C1)N[C@@H]1CCN(CCN2CCOCC2)C1	ZINC000875301654	GD	On-Demand	Anodyne	BRD2	15	40
CCOC(=O)C1CCN(C(=O)[C@@H](C)OC(=O)c2ccc(C(=O)OC)nc2)CC1	ZINC000875301659	GD	On-Demand	Anodyne	PTR1	52	38
CCOC(=O)C1CCN(C(=O)[C@H](C)OC(=O)c2ccc(C(=O)OC)nc2)CC1	ZINC000875301660	GD	On-Demand	Anodyne	PTR1	52	38
O=C(N[C@H]1CCCN(c2cccc(F)c2)C1)N1CCC2(CCNC2=O)CC1	ZINC000875301669	FE	On-Demand	Anodyne	CACNA1H	62	42
O=C(N[C@@H]1CCCN(c2cccc(F)c2)C1)N1CCC2(CCNC2=O)CC1	ZINC000875301670	FE	On-Demand	Anodyne	CACNA1H	62	42
O=C(N[C@H]1CCCN(c2cccc(F)c2)C1)N1CCC(CO)(CO)CC1	ZINC000875301711	FD	On-Demand	Anodyne	CACNA1H	56	37
O=C(N[C@H]1CCCN(c2cccc(F)c2)C1)N1CCC(CO)(CO)CC1	ZINC000875301711	FD	On-Demand	Anodyne	CCR3	24	40
O=C(N[C@@H]1CCCN(c2cccc(F)c2)C1)N1CCC(CO)(CO)CC1	ZINC000875301712	FD	On-Demand	Anodyne	CACNA1H	56	37
O=C(N[C@@H]1CCCN(c2cccc(F)c2)C1)N1CCC(CO)(CO)CC1	ZINC000875301712	FD	On-Demand	Anodyne	CCR3	24	40
CN(C)CC[C@H](NC(=O)N1Cc2cccc(O)c2C1)C(C)(C)C	ZINC000875301825	DF	On-Demand	Clean	UTS2	41	33
CN(C)CC[C@@H](NC(=O)N1Cc2cccc(O)c2C1)C(C)(C)C	ZINC000875301826	DF	On-Demand	Clean	UTS2	41	33
Cc1ccc(CN2CC[C@H](NC(=O)N[C@@H]3CCCc4nc(C)ncc43)C2)cc1	ZINC000875301951	GG	On-Demand	Anodyne	DRD4	25	41
Cc1ccc(CN2CC[C@H](NC(=O)N[C@@H]3CCCc4nc(C)ncc43)C2)cc1	ZINC000875301951	GG	On-Demand	Anodyne	SSTR5	53	39
Cc1ccc(CN2CC[C@H](NC(=O)N[C@@H]3CCCc4nc(C)ncc43)C2)cc1	ZINC000875301951	GG	On-Demand	Anodyne	CCR3	23	46
Cc1ccc(CN2CC[C@H](NC(=O)N[C@@H]3CCCc4nc(C)ncc43)C2)cc1	ZINC000875301951	GG	On-Demand	Anodyne	BDKRB1	41	37
Cc1ccc(CN2CC[C@H](NC(=O)N[C@@H]3CCCc4nc(C)ncc43)C2)cc1	ZINC000875301951	GG	On-Demand	Anodyne	MCHR1	18	42
Cc1ccc(CN2CC[C@@H](NC(=O)N[C@H]3CCCc4nc(C)ncc43)C2)cc1	ZINC000875301952	GG	On-Demand	Anodyne	DRD4	25	41
Cc1ccc(CN2CC[C@@H](NC(=O)N[C@H]3CCCc4nc(C)ncc43)C2)cc1	ZINC000875301952	GG	On-Demand	Anodyne	SSTR5	53	39
Cc1ccc(CN2CC[C@@H](NC(=O)N[C@H]3CCCc4nc(C)ncc43)C2)cc1	ZINC000875301952	GG	On-Demand	Anodyne	CCR3	23	46
Cc1ccc(CN2CC[C@@H](NC(=O)N[C@H]3CCCc4nc(C)ncc43)C2)cc1	ZINC000875301952	GG	On-Demand	Anodyne	BDKRB1	41	37
Cc1ccc(CN2CC[C@@H](NC(=O)N[C@H]3CCCc4nc(C)ncc43)C2)cc1	ZINC000875301952	GG	On-Demand	Anodyne	MCHR1	18	42
Cc1ccc(CN2CC[C@H](NC(=O)N[C@H]3CCCc4nc(C)ncc43)C2)cc1	ZINC000875301953	GG	On-Demand	Anodyne	DRD4	25	41
Cc1ccc(CN2CC[C@H](NC(=O)N[C@H]3CCCc4nc(C)ncc43)C2)cc1	ZINC000875301953	GG	On-Demand	Anodyne	SSTR5	53	39
Cc1ccc(CN2CC[C@H](NC(=O)N[C@H]3CCCc4nc(C)ncc43)C2)cc1	ZINC000875301953	GG	On-Demand	Anodyne	CCR3	23	46
Cc1ccc(CN2CC[C@H](NC(=O)N[C@H]3CCCc4nc(C)ncc43)C2)cc1	ZINC000875301953	GG	On-Demand	Anodyne	BDKRB1	41	37
Cc1ccc(CN2CC[C@H](NC(=O)N[C@H]3CCCc4nc(C)ncc43)C2)cc1	ZINC000875301953	GG	On-Demand	Anodyne	MCHR1	18	42
Cc1ccc(CN2CC[C@@H](NC(=O)N[C@@H]3CCCc4nc(C)ncc43)C2)cc1	ZINC000875301954	GG	On-Demand	Anodyne	DRD4	25	41
Cc1ccc(CN2CC[C@@H](NC(=O)N[C@@H]3CCCc4nc(C)ncc43)C2)cc1	ZINC000875301954	GG	On-Demand	Anodyne	SSTR5	53	39
Cc1ccc(CN2CC[C@@H](NC(=O)N[C@@H]3CCCc4nc(C)ncc43)C2)cc1	ZINC000875301954	GG	On-Demand	Anodyne	CCR3	23	46
Cc1ccc(CN2CC[C@@H](NC(=O)N[C@@H]3CCCc4nc(C)ncc43)C2)cc1	ZINC000875301954	GG	On-Demand	Anodyne	BDKRB1	41	37
Cc1ccc(CN2CC[C@@H](NC(=O)N[C@@H]3CCCc4nc(C)ncc43)C2)cc1	ZINC000875301954	GG	On-Demand	Anodyne	MCHR1	18	42
Cc1ncc2c(n1)CCC[C@H]2NC(=O)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875301971	FH	On-Demand	Anodyne	EPHX2	15	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCCN(c2cccc(F)c2)C1	ZINC000875301981	EF	On-Demand	Anodyne	BIRC2	29	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCCN(c2cccc(F)c2)C1	ZINC000875301982	EF	On-Demand	Anodyne	BIRC2	29	41
CCOC(=O)N1CCC(NC(=O)COC(=O)c2ccc(C(=O)OC)nc2)CC1	ZINC000875302100	GC	On-Demand	Anodyne	P2RY12	50	34
CCOC(=O)N1CCC(NC(=O)COC(=O)c2ccc(C(=O)OC)nc2)CC1	ZINC000875302100	GC	On-Demand	Anodyne	SSTR5	46	40
CCOC(=O)N1CCC(NC(=O)COC(=O)c2ccc(C(=O)OC)nc2)CC1	ZINC000875302100	GC	On-Demand	Anodyne	CCR8	27	41
Cc1ncc2c(n1)CCC[C@H]2NC(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875302110	GF	On-Demand	Anodyne	SLC27A1	40	31
Cc1ncc2c(n1)CCC[C@H]2NC(=O)N1CCC(Oc2cccc(F)c2)CC1	ZINC000875302190	GH	On-Demand	Anodyne	EPHX2	17	43
Cc1ncc2c(n1)CCC[C@H]2NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875302197	GG	On-Demand	Anodyne	SMO	36	42
Cc1ncc2c(n1)CCC[C@H]2NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875302197	GG	On-Demand	Anodyne	ETHR	41	42
Cn1nnnc1C1CCN(C(=O)N[C@H]2CCCN(c3cccc(F)c3)C2)CC1	ZINC000875302201	GD	On-Demand	Anodyne	CCR3	40	32
Cn1nnnc1C1CCN(C(=O)N[C@@H]2CCCN(c3cccc(F)c3)C2)CC1	ZINC000875302202	GD	On-Demand	Anodyne	CCR3	40	32
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(c3cccc(F)c3)C2)C1	ZINC000875302222	GF	On-Demand	Anodyne	CCR5	44	33
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(c3cccc(F)c3)C2)C1	ZINC000875302222	GF	On-Demand	Anodyne	BIRC2	28	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(c3cccc(F)c3)C2)C1	ZINC000875302223	GF	On-Demand	Anodyne	CCR5	44	33
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(c3cccc(F)c3)C2)C1	ZINC000875302223	GF	On-Demand	Anodyne	BIRC2	28	43
Cc1ncc2c(n1)CCC[C@H]2NC(=O)N[C@@H](CCO)c1ccc(Cl)c(F)c1	ZINC000875302262	GG	On-Demand	Anodyne	MAPK1	64	38
Cc1ncc2c(n1)CCC[C@H]2NC(=O)N[C@H](CCO)c1ccc(Cl)c(F)c1	ZINC000875302265	GG	On-Demand	Anodyne	MAPK1	64	38
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)N2CCN(c3ccccc3)CC2)cn1	ZINC000875302295	GD	On-Demand	Anodyne	PRNP	57	37
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)NC(=O)NCc2ccccc2)cn1	ZINC000875302406	GD	On-Demand	Anodyne	PDS	48	35
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)NCCc2ccc(S(N)(=O)=O)cc2)cn1	ZINC000875302413	IC	On-Demand	Anodyne	CA2	96	49
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)NCCc2ccc(S(N)(=O)=O)cc2)cn1	ZINC000875302413	IC	On-Demand	Anodyne	CA1	81	49
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)NCCc2ccc(S(N)(=O)=O)cc2)cn1	ZINC000875302413	IC	On-Demand	Anodyne	CA7	48	49
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)NCCc2ccc(S(N)(=O)=O)cc2)cn1	ZINC000875302413	IC	On-Demand	Anodyne	CA5B	30	43
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)NCCc2ccc(S(N)(=O)=O)cc2)cn1	ZINC000875302413	IC	On-Demand	Anodyne	CA4	61	49
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)NCCc2ccc(S(N)(=O)=O)cc2)cn1	ZINC000875302413	IC	On-Demand	Anodyne	CA5A	29	43
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)NCCc2ccc(S(N)(=O)=O)cc2)cn1	ZINC000875302413	IC	On-Demand	Anodyne	CA14	51	45
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)NCCc2ccc(S(N)(=O)=O)cc2)cn1	ZINC000875302413	IC	On-Demand	Anodyne	CA12	53	49
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)NCCc2ccc(S(N)(=O)=O)cc2)cn1	ZINC000875302413	IC	On-Demand	Anodyne	CA9	60	49
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)NCCc2ccc(S(N)(=O)=O)cc2)cn1	ZINC000875302413	IC	On-Demand	Anodyne	CYNT	26	47
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)NCCc2ccc(S(N)(=O)=O)cc2)cn1	ZINC000875302413	IC	On-Demand	Anodyne	A6YCJ1_9METZ	17	49
CC(=O)Nc1cccc2c1CN(C(=O)NCCc1c[nH]c3ccc(F)cc13)CC2	ZINC000875302465	GH	On-Demand	Anodyne	HTR1A	20	48
CC(=O)Nc1cccc2c1CN(C(=O)NCCc1c[nH]c3ccc(F)cc13)CC2	ZINC000875302465	GH	On-Demand	Anodyne	HTR1D	51	48
CC(=O)Nc1cccc2c1CN(C(=O)NCCc1c[nH]c3ccc(F)cc13)CC2	ZINC000875302465	GH	On-Demand	Anodyne	HTR1B	42	48
CC(=O)Nc1cccc2c1CN(C(=O)NCCc1c[nH]c3ccc(F)cc13)CC2	ZINC000875302465	GH	On-Demand	Anodyne	SLC6A4	23	47
CC(=O)Nc1cccc2c1CN(C(=O)NCCc1c[nH]c3ccc(F)cc13)CC2	ZINC000875302465	GH	On-Demand	Anodyne	MPO	94	47
CC(=O)Nc1cccc2c1CN(C(=O)NCCc1c[nH]c3ccc(F)cc13)CC2	ZINC000875302465	GH	On-Demand	Anodyne	MTNR1A	17	44
CC(=O)Nc1cccc2c1CN(C(=O)NCCc1c[nH]c3ccc(F)cc13)CC2	ZINC000875302465	GH	On-Demand	Anodyne	MTNR1B	15	41
COC(=O)C1=NO[C@@]2(CCN(C(=O)NCCc3c[nH]c4ccc(F)cc34)C2)C1	ZINC000875302468	GD	On-Demand	Anodyne	HTR1A	17	46
COC(=O)C1=NO[C@@]2(CCN(C(=O)NCCc3c[nH]c4ccc(F)cc34)C2)C1	ZINC000875302468	GD	On-Demand	Anodyne	HTR1D	44	46
COC(=O)C1=NO[C@@]2(CCN(C(=O)NCCc3c[nH]c4ccc(F)cc34)C2)C1	ZINC000875302468	GD	On-Demand	Anodyne	HTR1B	37	46
COC(=O)C1=NO[C@@]2(CCN(C(=O)NCCc3c[nH]c4ccc(F)cc34)C2)C1	ZINC000875302468	GD	On-Demand	Anodyne	SLC6A4	18	42
COC(=O)C1=NO[C@@]2(CCN(C(=O)NCCc3c[nH]c4ccc(F)cc34)C2)C1	ZINC000875302468	GD	On-Demand	Anodyne	MPO	90	44
COC(=O)C1=NO[C@]2(CCN(C(=O)NCCc3c[nH]c4ccc(F)cc34)C2)C1	ZINC000875302469	GD	On-Demand	Anodyne	HTR1A	17	46
COC(=O)C1=NO[C@]2(CCN(C(=O)NCCc3c[nH]c4ccc(F)cc34)C2)C1	ZINC000875302469	GD	On-Demand	Anodyne	HTR1D	44	46
COC(=O)C1=NO[C@]2(CCN(C(=O)NCCc3c[nH]c4ccc(F)cc34)C2)C1	ZINC000875302469	GD	On-Demand	Anodyne	HTR1B	37	46
COC(=O)C1=NO[C@]2(CCN(C(=O)NCCc3c[nH]c4ccc(F)cc34)C2)C1	ZINC000875302469	GD	On-Demand	Anodyne	SLC6A4	18	42
COC(=O)C1=NO[C@]2(CCN(C(=O)NCCc3c[nH]c4ccc(F)cc34)C2)C1	ZINC000875302469	GD	On-Demand	Anodyne	MPO	90	44
CN(C)C[C@@H]1CN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C[C@H]1CN(C)C	ZINC000875302474	GE	On-Demand	Anodyne	HTR1A	29	48
CN(C)C[C@@H]1CN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C[C@H]1CN(C)C	ZINC000875302474	GE	On-Demand	Anodyne	HTR1D	123	39
CN(C)C[C@@H]1CN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C[C@H]1CN(C)C	ZINC000875302474	GE	On-Demand	Anodyne	HTR1B	94	48
CN(C)C[C@@H]1CN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C[C@H]1CN(C)C	ZINC000875302474	GE	On-Demand	Anodyne	SLC6A4	33	49
CN(C)C[C@@H]1CN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C[C@H]1CN(C)C	ZINC000875302474	GE	On-Demand	Anodyne	MPO	109	51
O=C(NCCc1c[nH]c2ccc(F)cc12)NC[C@H]1C[C@H](O)C1	ZINC000875302484	DD	On-Demand	Anodyne	HTR1A	22	49
O=C(NCCc1c[nH]c2ccc(F)cc12)NC[C@H]1C[C@H](O)C1	ZINC000875302484	DD	On-Demand	Anodyne	HTR1D	54	44
O=C(NCCc1c[nH]c2ccc(F)cc12)NC[C@H]1C[C@H](O)C1	ZINC000875302484	DD	On-Demand	Anodyne	HTR1B	47	49
O=C(NCCc1c[nH]c2ccc(F)cc12)NC[C@H]1C[C@H](O)C1	ZINC000875302484	DD	On-Demand	Anodyne	SLC6A4	28	52
O=C(NCCc1c[nH]c2ccc(F)cc12)NC[C@H]1C[C@H](O)C1	ZINC000875302484	DD	On-Demand	Anodyne	MPO	110	52
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875302489	EG	On-Demand	Anodyne	HTR1A	25	51
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875302489	EG	On-Demand	Anodyne	HTR1D	85	42
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875302489	EG	On-Demand	Anodyne	HTR1B	72	51
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875302489	EG	On-Demand	Anodyne	SLC6A4	29	48
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875302489	EG	On-Demand	Anodyne	MPO	102	48
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875302490	EG	On-Demand	Anodyne	HTR1A	25	51
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875302490	EG	On-Demand	Anodyne	HTR1D	85	42
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875302490	EG	On-Demand	Anodyne	HTR1B	72	51
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875302490	EG	On-Demand	Anodyne	SLC6A4	29	48
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875302490	EG	On-Demand	Anodyne	MPO	102	48
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@H]2CSC[C@H]2C1	ZINC000875302491	EG	On-Demand	Anodyne	HTR1A	25	51
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@H]2CSC[C@H]2C1	ZINC000875302491	EG	On-Demand	Anodyne	HTR1D	85	42
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@H]2CSC[C@H]2C1	ZINC000875302491	EG	On-Demand	Anodyne	HTR1B	72	51
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@H]2CSC[C@H]2C1	ZINC000875302491	EG	On-Demand	Anodyne	SLC6A4	29	48
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@H]2CSC[C@H]2C1	ZINC000875302491	EG	On-Demand	Anodyne	MPO	102	48
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875302492	EG	On-Demand	Anodyne	HTR1A	25	51
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875302492	EG	On-Demand	Anodyne	HTR1D	85	42
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875302492	EG	On-Demand	Anodyne	HTR1B	72	51
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875302492	EG	On-Demand	Anodyne	SLC6A4	29	48
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875302492	EG	On-Demand	Anodyne	MPO	102	48
Cn1nc(Cl)c(C(=O)N2CSC[C@@H]2C(=O)N2CCSCC2)c1Cl	ZINC000875302499	GD	On-Demand	Anodyne	PREP	17	43
Cn1nc(Cl)c(C(=O)N2CSC[C@H]2C(=O)N2CCSCC2)c1Cl	ZINC000875302500	GD	On-Demand	Anodyne	PREP	17	43
CC(C)(C)OC(=O)N1CC[C@H]([C@@H](F)C(=O)Nc2ccc(C#N)cn2)C1	ZINC000875302521	EE	On-Demand	Mild	GPR119	57	43
CC(C)(C)OC(=O)N1CC[C@H]([C@H](F)C(=O)Nc2ccc(C#N)cn2)C1	ZINC000875302522	EE	On-Demand	Mild	GPR119	57	43
CC(C)(C)OC(=O)N1CC[C@@H]([C@H](F)C(=O)Nc2ccc(C#N)cn2)C1	ZINC000875302523	EE	On-Demand	Mild	GPR119	57	43
CC(C)(C)OC(=O)N1CC[C@@H]([C@@H](F)C(=O)Nc2ccc(C#N)cn2)C1	ZINC000875302524	EE	On-Demand	Mild	GPR119	57	43
CC[C@H](NC(=O)COC(=O)c1ccc(C(=O)OC)nc1)c1ccc(Cl)cc1	ZINC000875302556	GF	On-Demand	Anodyne	UTS2	47	37
CC[C@@H](NC(=O)COC(=O)c1ccc(C(=O)OC)nc1)c1ccc(Cl)cc1	ZINC000875302557	GF	On-Demand	Anodyne	UTS2	47	37
CCO[C@@H](C(=O)Nc1ccc(C#N)cn1)C1CCCC1	ZINC000875302559	CE	On-Demand	Mild	GCK	31	41
C#Cc1cccc(N(Cc2ccccc2)C(=O)[C@H]2CCCN2C(C)=O)c1	ZINC000875302571	EG	On-Demand	Mild	ACE	44	40
C#Cc1cccc(N(Cc2ccccc2)C(=O)[C@H]2CCCN2C(C)=O)c1	ZINC000875302571	EG	On-Demand	Mild	FKBP1A	55	37
C#Cc1cccc(N(Cc2ccccc2)C(=O)[C@H]2CCCN2C(C)=O)c1	ZINC000875302571	EG	On-Demand	Mild	PREP	98	41
C#Cc1cccc(N(Cc2ccccc2)C(=O)[C@H]2CCCN2C(C)=O)c1	ZINC000875302571	EG	On-Demand	Mild	NR1H4	29	41
C#Cc1cccc(N(Cc2ccccc2)C(=O)[C@H]2CCCN2C(C)=O)c1	ZINC000875302571	EG	On-Demand	Mild	BRCA1	44	31
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)N2CCCCCC2)cn1	ZINC000875302574	ED	On-Demand	Anodyne	DPP7	55	35
COC(=O)c1ccc(C(=O)O[C@H](C(=O)NCc2ccccc2)c2ccccc2)cn1	ZINC000875302588	HG	On-Demand	Anodyne	PDS	54	38
Cc1ncc2c(n1)CCC[C@H]2NC(=O)N1CCN(c2ccc(C#N)cc2)CC1	ZINC000875302591	GF	On-Demand	Mild	FASN	41	35
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(C(C)=O)cc1C	ZINC000875302592	DF	On-Demand	Anodyne	CAPN1	37	42
COC(=O)c1ccc(C(=O)O[C@H](C(=O)Nc2ccc(OC)cc2)C(C)C)cn1	ZINC000875302601	GF	On-Demand	Anodyne	ACR	41	39
CC[C@H](OC(=O)c1ccc(C(=O)OC)nc1)C(=O)NCc1ccccc1	ZINC000875302675	FE	On-Demand	Anodyne	FURIN	45	34
CC[C@H](OC(=O)c1ccc(C(=O)OC)nc1)C(=O)NCc1ccccc1	ZINC000875302675	FE	On-Demand	Anodyne	F7	15	40
CC[C@H](OC(=O)c1ccc(C(=O)OC)nc1)C(=O)NCc1ccccc1	ZINC000875302675	FE	On-Demand	Anodyne	PDS	66	41
CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)c1ccc(C(=O)OC)nc1	ZINC000875302687	GC	On-Demand	Anodyne	FKBP1A	63	39
CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)c1ccc(C(=O)OC)nc1	ZINC000875302687	GC	On-Demand	Anodyne	CPT1A	76	39
CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)c1ccc(C(=O)OC)nc1	ZINC000875302687	GC	On-Demand	Anodyne	CPT2	43	38
CN(CCNC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)Cc1ccc(F)cc1	ZINC000875302692	FC	On-Demand	Anodyne	MLNR	50	36
CN(CCNC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)Cc1ccc(F)cc1	ZINC000875302693	FC	On-Demand	Anodyne	MLNR	50	36
COC(=O)N(C)NC(=O)N[C@H](Cc1ccccc1)c1cccs1	ZINC000875302776	EF	On-Demand	Reactive	MME	41	33
COC(=O)N(C)NC(=O)N[C@H](Cc1ccccc1)c1cccs1	ZINC000875302776	EF	On-Demand	Reactive	PAPA1_CARPA	40	33
COC(=O)N(C)NC(=O)N[C@@H](Cc1ccccc1)c1cccs1	ZINC000875302777	EF	On-Demand	Reactive	MME	41	33
COC(=O)N(C)NC(=O)N[C@@H](Cc1ccccc1)c1cccs1	ZINC000875302777	EF	On-Demand	Reactive	PAPA1_CARPA	40	33
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875302780	FG	On-Demand	Anodyne	HTR1A	24	46
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875302780	FG	On-Demand	Anodyne	HTR1D	75	37
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875302780	FG	On-Demand	Anodyne	HTR1B	64	46
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875302780	FG	On-Demand	Anodyne	SLC6A4	29	45
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875302780	FG	On-Demand	Anodyne	MPO	98	46
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875302781	FG	On-Demand	Anodyne	HTR1A	24	46
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875302781	FG	On-Demand	Anodyne	HTR1D	75	37
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875302781	FG	On-Demand	Anodyne	HTR1B	64	46
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875302781	FG	On-Demand	Anodyne	SLC6A4	29	45
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875302781	FG	On-Demand	Anodyne	MPO	98	46
O=C1OC[C@H]2CN(C(=O)NCCc3c[nH]c4ccc(F)cc34)C[C@@H]12	ZINC000875302824	ED	On-Demand	Anodyne	HTR1A	19	44
O=C1OC[C@H]2CN(C(=O)NCCc3c[nH]c4ccc(F)cc34)C[C@@H]12	ZINC000875302824	ED	On-Demand	Anodyne	HTR1D	30	44
O=C1OC[C@H]2CN(C(=O)NCCc3c[nH]c4ccc(F)cc34)C[C@@H]12	ZINC000875302824	ED	On-Demand	Anodyne	HTR1B	25	44
O=C1OC[C@H]2CN(C(=O)NCCc3c[nH]c4ccc(F)cc34)C[C@@H]12	ZINC000875302824	ED	On-Demand	Anodyne	SLC6A4	24	45
O=C1OC[C@H]2CN(C(=O)NCCc3c[nH]c4ccc(F)cc34)C[C@@H]12	ZINC000875302824	ED	On-Demand	Anodyne	MPO	98	45
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(N2C(=O)c3ccccc3C2=O)cc1	ZINC000875302826	GF	On-Demand	Anodyne	ANPEP	32	44
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(N2C(=O)c3ccccc3C2=O)cc1	ZINC000875302826	GF	On-Demand	Anodyne	CPA1	23	42
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(N2C(=O)c3ccccc3C2=O)cc1	ZINC000875302826	GF	On-Demand	Anodyne	TIMP3	47	31
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(N2C(=O)c3ccccc3C2=O)cc1	ZINC000875302826	GF	On-Demand	Anodyne	CAPNS1	50	32
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(N2C(=O)c3ccccc3C2=O)cc1	ZINC000875302826	GF	On-Demand	Anodyne	MMP2	18	48
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(N2C(=O)c3ccccc3C2=O)cc1	ZINC000875302826	GF	On-Demand	Anodyne	MMP3	45	48
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(N2C(=O)c3ccccc3C2=O)cc1	ZINC000875302826	GF	On-Demand	Anodyne	CAPN1	51	45
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(N2C(=O)c3ccccc3C2=O)cc1	ZINC000875302826	GF	On-Demand	Anodyne	MMP9	22	44
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(N2C(=O)c3ccccc3C2=O)cc1	ZINC000875302826	GF	On-Demand	Anodyne	CAPN2	50	38
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(N2C(=O)c3ccccc3C2=O)cc1	ZINC000875302826	GF	On-Demand	Anodyne	ACE2	18	42
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(N2C(=O)c3ccccc3C2=O)cc1	ZINC000875302826	GF	On-Demand	Anodyne	MMP1	29	47
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(N2C(=O)c3ccccc3C2=O)cc1	ZINC000875302826	GF	On-Demand	Anodyne	FPR1	43	39
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(N2C(=O)c3ccccc3C2=O)cc1	ZINC000875302826	GF	On-Demand	Anodyne	NPR	52	32
CN1CC[C@H]2CN(C(=O)NCCc3c[nH]c4ccc(F)cc34)CC[C@H]21	ZINC000875302832	EF	On-Demand	Anodyne	HTR1A	31	53
CN1CC[C@H]2CN(C(=O)NCCc3c[nH]c4ccc(F)cc34)CC[C@H]21	ZINC000875302832	EF	On-Demand	Anodyne	HTR1D	114	41
CN1CC[C@H]2CN(C(=O)NCCc3c[nH]c4ccc(F)cc34)CC[C@H]21	ZINC000875302832	EF	On-Demand	Anodyne	HTR1B	96	53
CN1CC[C@H]2CN(C(=O)NCCc3c[nH]c4ccc(F)cc34)CC[C@H]21	ZINC000875302832	EF	On-Demand	Anodyne	SLC6A4	33	46
CN1CC[C@H]2CN(C(=O)NCCc3c[nH]c4ccc(F)cc34)CC[C@H]21	ZINC000875302832	EF	On-Demand	Anodyne	HTR1F	56	41
CN1CC[C@H]2CN(C(=O)NCCc3c[nH]c4ccc(F)cc34)CC[C@H]21	ZINC000875302832	EF	On-Demand	Anodyne	MPO	102	51
CN1CC[C@H]2CN(C(=O)NCCc3c[nH]c4ccc(F)cc34)CC[C@H]21	ZINC000875302832	EF	On-Demand	Anodyne	HTR6	19	41
CN1CC[C@H]2CN(C(=O)NCCc3c[nH]c4ccc(F)cc34)CC[C@@H]21	ZINC000875302834	EF	On-Demand	Anodyne	HTR1A	31	53
CN1CC[C@H]2CN(C(=O)NCCc3c[nH]c4ccc(F)cc34)CC[C@@H]21	ZINC000875302834	EF	On-Demand	Anodyne	HTR1D	114	41
CN1CC[C@H]2CN(C(=O)NCCc3c[nH]c4ccc(F)cc34)CC[C@@H]21	ZINC000875302834	EF	On-Demand	Anodyne	HTR1B	96	53
CN1CC[C@H]2CN(C(=O)NCCc3c[nH]c4ccc(F)cc34)CC[C@@H]21	ZINC000875302834	EF	On-Demand	Anodyne	SLC6A4	33	46
CN1CC[C@H]2CN(C(=O)NCCc3c[nH]c4ccc(F)cc34)CC[C@@H]21	ZINC000875302834	EF	On-Demand	Anodyne	HTR1F	56	41
CN1CC[C@H]2CN(C(=O)NCCc3c[nH]c4ccc(F)cc34)CC[C@@H]21	ZINC000875302834	EF	On-Demand	Anodyne	MPO	102	51
CN1CC[C@H]2CN(C(=O)NCCc3c[nH]c4ccc(F)cc34)CC[C@@H]21	ZINC000875302834	EF	On-Demand	Anodyne	HTR6	19	41
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875302858	GD	On-Demand	Anodyne	HTR1A	26	49
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875302858	GD	On-Demand	Anodyne	HTR1D	90	42
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875302858	GD	On-Demand	Anodyne	HTR1B	75	49
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875302858	GD	On-Demand	Anodyne	SLC6A4	29	48
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875302858	GD	On-Demand	Anodyne	MPO	102	48
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875302859	GD	On-Demand	Anodyne	HTR1A	26	49
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875302859	GD	On-Demand	Anodyne	HTR1D	90	42
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875302859	GD	On-Demand	Anodyne	HTR1B	75	49
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875302859	GD	On-Demand	Anodyne	SLC6A4	29	48
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875302859	GD	On-Demand	Anodyne	MPO	102	48
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875302860	GD	On-Demand	Anodyne	HTR1A	26	49
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875302860	GD	On-Demand	Anodyne	HTR1D	90	42
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875302860	GD	On-Demand	Anodyne	HTR1B	75	49
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875302860	GD	On-Demand	Anodyne	SLC6A4	29	48
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875302860	GD	On-Demand	Anodyne	MPO	102	48
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2sc3c(c2C#N)CCCCC3)cn1	ZINC000875302895	IG	On-Demand	Mild	VIPR1	29	46
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2c(C)cccc2C)cn1	ZINC000875302899	FF	On-Demand	Anodyne	SHH	41	34
COc1ccccc1[C@@H]1CCCN(C(=O)NCC[S@@](=O)C(C)(C)C)CC1	ZINC000875302918	GH	On-Demand	Anodyne	DRD2	23	44
COc1ccccc1[C@@H]1CCCN(C(=O)NCC[S@@](=O)C(C)(C)C)CC1	ZINC000875302918	GH	On-Demand	Anodyne	DRD4	15	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCC[S@@](=O)C(C)(C)C)CC1	ZINC000875302918	GH	On-Demand	Anodyne	RBP4	34	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCC[S@](=O)C(C)(C)C)CC1	ZINC000875302919	GH	On-Demand	Anodyne	DRD2	23	44
COc1ccccc1[C@@H]1CCCN(C(=O)NCC[S@](=O)C(C)(C)C)CC1	ZINC000875302919	GH	On-Demand	Anodyne	DRD4	15	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCC[S@](=O)C(C)(C)C)CC1	ZINC000875302919	GH	On-Demand	Anodyne	RBP4	34	41
COc1ccccc1[C@H]1CCCN(C(=O)NCC[S@](=O)C(C)(C)C)CC1	ZINC000875302926	GH	On-Demand	Anodyne	DRD2	23	44
COc1ccccc1[C@H]1CCCN(C(=O)NCC[S@](=O)C(C)(C)C)CC1	ZINC000875302926	GH	On-Demand	Anodyne	DRD4	15	43
COc1ccccc1[C@H]1CCCN(C(=O)NCC[S@](=O)C(C)(C)C)CC1	ZINC000875302926	GH	On-Demand	Anodyne	RBP4	34	41
COc1ccccc1[C@H]1CCCN(C(=O)NCC[S@@](=O)C(C)(C)C)CC1	ZINC000875302928	GH	On-Demand	Anodyne	DRD2	23	44
COc1ccccc1[C@H]1CCCN(C(=O)NCC[S@@](=O)C(C)(C)C)CC1	ZINC000875302928	GH	On-Demand	Anodyne	DRD4	15	43
COc1ccccc1[C@H]1CCCN(C(=O)NCC[S@@](=O)C(C)(C)C)CC1	ZINC000875302928	GH	On-Demand	Anodyne	RBP4	34	41
CC(=O)c1ccc(OC(=O)c2ccnc(N3CCOCC3)n2)c(C)c1	ZINC000875302930	EE	On-Demand	Anodyne	MTOR	17	40
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccccc2Cl)cn1	ZINC000875302934	FF	On-Demand	Anodyne	EPHB3	43	34
Cc1ncc2c(n1)CCC[C@H]2NC(=O)NCC1(c2ccccc2)CCN(C)CC1	ZINC000875303004	GG	On-Demand	Anodyne	KCNA3	44	34
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)NCCc2ccccc2)cn1	ZINC000875303039	FD	On-Demand	Anodyne	FAAH	22	42
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)NCCc2ccccc2)cn1	ZINC000875303039	FD	On-Demand	Anodyne	AMP1_PLAFQ	23	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCN(C)Cc2ccc(F)cc2)C1	ZINC000875303159	FD	On-Demand	Anodyne	CCR3	45	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCCN(C)Cc2ccc(F)cc2)C1	ZINC000875303159	FD	On-Demand	Anodyne	DPP7	23	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCN(C)Cc2ccc(F)cc2)C1	ZINC000875303160	FD	On-Demand	Anodyne	CCR3	45	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCCN(C)Cc2ccc(F)cc2)C1	ZINC000875303160	FD	On-Demand	Anodyne	DPP7	23	41
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(OC)cc2)cn1	ZINC000875303215	FE	On-Demand	Anodyne	ACR	42	40
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(OC)c(OC)c2)cn1	ZINC000875303379	GE	On-Demand	Anodyne	PDGFRA	45	34
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(OC)c(OC)c2)cn1	ZINC000875303379	GE	On-Demand	Anodyne	ENPP1	73	35
Cc1ncc2c(n1)CCC[C@H]2NC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875303380	FG	On-Demand	Anodyne	EPHX2	18	41
O=CN1CCCN(C(=O)N[C@H]2CCCN(c3cccc(F)c3)C2)CC1	ZINC000875303383	ED	On-Demand	Anodyne	CCR3	22	42
O=CN1CCCN(C(=O)N[C@@H]2CCCN(c3cccc(F)c3)C2)CC1	ZINC000875303384	ED	On-Demand	Anodyne	CCR3	22	42
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)cn1	ZINC000875303552	HC	On-Demand	Anodyne	CA2	24	47
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)cn1	ZINC000875303552	HC	On-Demand	Anodyne	CA1	18	40
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)cn1	ZINC000875303552	HC	On-Demand	Anodyne	CA4	25	47
CCOc1ccc(S(=O)(=O)N2CCN(C(=O)COC(=O)c3ccc(C(=O)OC)nc3)CC2)cc1	ZINC000875303560	JC	On-Demand	Anodyne	TGM2	54	40
CCOc1ccc(S(=O)(=O)N2CCN(C(=O)COC(=O)c3ccc(C(=O)OC)nc3)CC2)cc1	ZINC000875303560	JC	On-Demand	Anodyne	F13A1	50	40
CC(=O)c1ccc(OC(=O)[C@@H]2CCN(C(=O)c3ccccc3)C2)c(C)c1	ZINC000875303718	FG	On-Demand	Anodyne	SLC18A3	20	43
CC(=O)c1ccc(OC(=O)[C@@H]2CCN(C(=O)c3ccccc3)C2)c(C)c1	ZINC000875303718	FG	On-Demand	Anodyne	L3MBTL3	73	38
CC(=O)c1ccc(OC(=O)[C@H]2CCN(C(=O)c3ccccc3)C2)c(C)c1	ZINC000875303719	FG	On-Demand	Anodyne	SLC18A3	20	43
CC(=O)c1ccc(OC(=O)[C@H]2CCN(C(=O)c3ccccc3)C2)c(C)c1	ZINC000875303719	FG	On-Demand	Anodyne	L3MBTL3	73	38
COC(=O)N(C)NC(=O)NCCCc1ccc(Br)cc1F	ZINC000875303720	FE	On-Demand	Reactive	MTNR1A	24	41
COC(=O)N(C)NC(=O)NCCCc1ccc(Br)cc1F	ZINC000875303720	FE	On-Demand	Reactive	MTNR1B	17	52
COC(=O)c1ccc(C(=O)O[C@H](C)c2cccc([N+](=O)[O-])c2)cn1	ZINC000875303724	EF	On-Demand	Bother	CACNA1C	63	43
COC(=O)c1ccc(C(=O)O[C@H](C)c2cccc([N+](=O)[O-])c2)cn1	ZINC000875303724	EF	On-Demand	Bother	CACNA1D	95	42
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])cn1	ZINC000875303753	HD	On-Demand	Bother	TAAR1	20	43
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)NCc2ccc(OC)c(OC)c2)cn1	ZINC000875303831	HD	On-Demand	Anodyne	MT-ND1	24	43
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)NCc2ccc(OC)c(OC)c2)cn1	ZINC000875303831	HD	On-Demand	Anodyne	DRTS_TRYCR	45	35
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875303936	GD	On-Demand	Anodyne	HTR1A	26	49
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875303936	GD	On-Demand	Anodyne	HTR1D	90	42
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875303936	GD	On-Demand	Anodyne	HTR1B	75	49
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875303936	GD	On-Demand	Anodyne	SLC6A4	29	48
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875303936	GD	On-Demand	Anodyne	MPO	102	48
CC(=O)C1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875303944	EF	On-Demand	Anodyne	HTR1A	33	51
CC(=O)C1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875303944	EF	On-Demand	Anodyne	HTR1D	120	40
CC(=O)C1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875303944	EF	On-Demand	Anodyne	HTR1B	96	51
CC(=O)C1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875303944	EF	On-Demand	Anodyne	SLC6A4	35	49
CC(=O)C1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875303944	EF	On-Demand	Anodyne	MPO	110	53
CC(=O)C1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875303944	EF	On-Demand	Anodyne	MTNR1A	19	46
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cn1	ZINC000875303963	GE	On-Demand	Bother	COLA	56	38
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875303968	FH	On-Demand	Anodyne	HTR1A	29	49
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875303968	FH	On-Demand	Anodyne	HTR1D	94	40
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875303968	FH	On-Demand	Anodyne	HTR1B	80	49
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875303968	FH	On-Demand	Anodyne	SLC6A4	32	47
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875303968	FH	On-Demand	Anodyne	MPO	102	49
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCC[C@H](OC2CCC2)CC1	ZINC000875303969	FH	On-Demand	Anodyne	HTR1A	29	49
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCC[C@H](OC2CCC2)CC1	ZINC000875303969	FH	On-Demand	Anodyne	HTR1D	94	40
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCC[C@H](OC2CCC2)CC1	ZINC000875303969	FH	On-Demand	Anodyne	HTR1B	80	49
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCC[C@H](OC2CCC2)CC1	ZINC000875303969	FH	On-Demand	Anodyne	SLC6A4	32	47
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCC[C@H](OC2CCC2)CC1	ZINC000875303969	FH	On-Demand	Anodyne	MPO	102	49
C[S@](=N)(=O)N1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875303994	FD	On-Demand	Anodyne	HTR1A	26	49
C[S@](=N)(=O)N1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875303994	FD	On-Demand	Anodyne	HTR1D	78	38
C[S@](=N)(=O)N1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875303994	FD	On-Demand	Anodyne	HTR1B	63	49
C[S@](=N)(=O)N1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875303994	FD	On-Demand	Anodyne	SLC6A4	28	47
C[S@](=N)(=O)N1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875303994	FD	On-Demand	Anodyne	MPO	107	51
CONC(=O)C1CCN(C(=O)N[C@@H](Cc2ccccc2)c2cccs2)CC1	ZINC000875304006	GG	On-Demand	Anodyne	F11	45	39
CONC(=O)C1CCN(C(=O)N[C@@H](Cc2ccccc2)c2cccs2)CC1	ZINC000875304006	GG	On-Demand	Anodyne	CAPN1	27	44
CONC(=O)C1CCN(C(=O)N[C@H](Cc2ccccc2)c2cccs2)CC1	ZINC000875304007	GG	On-Demand	Anodyne	F11	45	39
CONC(=O)C1CCN(C(=O)N[C@H](Cc2ccccc2)c2cccs2)CC1	ZINC000875304007	GG	On-Demand	Anodyne	CAPN1	27	44
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1	ZINC000875304009	FF	On-Demand	Anodyne	HTR1A	25	47
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1	ZINC000875304009	FF	On-Demand	Anodyne	HTR1D	67	37
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1	ZINC000875304009	FF	On-Demand	Anodyne	HTR1B	54	47
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1	ZINC000875304009	FF	On-Demand	Anodyne	SLC6A4	25	44
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1	ZINC000875304009	FF	On-Demand	Anodyne	MPO	103	49
O=CN1CCCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875304019	ED	On-Demand	Anodyne	HTR1A	25	48
O=CN1CCCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875304019	ED	On-Demand	Anodyne	HTR1D	78	38
O=CN1CCCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875304019	ED	On-Demand	Anodyne	HTR1B	64	48
O=CN1CCCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875304019	ED	On-Demand	Anodyne	SLC6A4	28	51
O=CN1CCCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875304019	ED	On-Demand	Anodyne	MPO	107	51
CCOC1CC2(C1)C[C@H]2C(=O)Nc1ccc(N2C(=O)c3ccccc3C2=O)cc1	ZINC000875304035	GH	On-Demand	Anodyne	TIMP3	56	32
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCOCCN(C)C)CC2	ZINC000875304040	GC	On-Demand	Anodyne	SLC18A2	47	37
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCOCCN(C)C)CC2	ZINC000875304041	GC	On-Demand	Anodyne	SLC18A2	47	37
N#CCc1ccsc1C(=O)N1CSC[C@@H]1C(=O)N1CCSCC1	ZINC000875304042	FD	On-Demand	Mild	PREP	23	44
N#CCc1ccsc1C(=O)N1CSC[C@H]1C(=O)N1CCSCC1	ZINC000875304043	FD	On-Demand	Mild	PREP	23	44
COCCN(CC1CCN(C)CC1)C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000875304048	GF	On-Demand	Anodyne	HTR1A	30	52
COCCN(CC1CCN(C)CC1)C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000875304048	GF	On-Demand	Anodyne	HTR1D	95	52
COCCN(CC1CCN(C)CC1)C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000875304048	GF	On-Demand	Anodyne	HTR1B	81	52
COCCN(CC1CCN(C)CC1)C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000875304048	GF	On-Demand	Anodyne	SLC6A4	30	44
COCCN(CC1CCN(C)CC1)C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000875304048	GF	On-Demand	Anodyne	HTR1F	67	40
COCCN(CC1CCN(C)CC1)C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000875304048	GF	On-Demand	Anodyne	MPO	96	47
COCCN(CC1CCN(C)CC1)C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000875304048	GF	On-Demand	Anodyne	ACKR3	52	35
CC(=O)C1CCN(C(=O)N[C@H](Cc2ccccc2)c2cccs2)CC1	ZINC000875304056	FI	On-Demand	Anodyne	CAPN1	23	41
CC(=O)C1CCN(C(=O)N[C@@H](Cc2ccccc2)c2cccs2)CC1	ZINC000875304057	FI	On-Demand	Anodyne	CAPN1	23	41
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCCc1c[nH]c3ccc(F)cc13)CC2	ZINC000875304070	GH	On-Demand	Anodyne	HTR1A	19	55
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCCc1c[nH]c3ccc(F)cc13)CC2	ZINC000875304070	GH	On-Demand	Anodyne	HTR1D	56	55
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCCc1c[nH]c3ccc(F)cc13)CC2	ZINC000875304070	GH	On-Demand	Anodyne	HTR1B	46	55
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCCc1c[nH]c3ccc(F)cc13)CC2	ZINC000875304070	GH	On-Demand	Anodyne	SLC6A4	20	46
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCCc1c[nH]c3ccc(F)cc13)CC2	ZINC000875304070	GH	On-Demand	Anodyne	HTR1F	31	43
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCCc1c[nH]c3ccc(F)cc13)CC2	ZINC000875304070	GH	On-Demand	Anodyne	NQO2	19	52
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCCc1c[nH]c3ccc(F)cc13)CC2	ZINC000875304070	GH	On-Demand	Anodyne	MPO	97	48
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCC2(CCNC2=O)CC1	ZINC000875304074	FE	On-Demand	Anodyne	HTR1A	23	47
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCC2(CCNC2=O)CC1	ZINC000875304074	FE	On-Demand	Anodyne	HTR1D	51	35
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCC2(CCNC2=O)CC1	ZINC000875304074	FE	On-Demand	Anodyne	HTR1B	41	47
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCC2(CCNC2=O)CC1	ZINC000875304074	FE	On-Demand	Anodyne	SLC6A4	25	47
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCC2(CCNC2=O)CC1	ZINC000875304074	FE	On-Demand	Anodyne	MPO	102	48
N#Cc1ccc(N2CCN(C(=O)NCCc3c[nH]c4ccc(F)cc34)CC2)cn1	ZINC000875304086	GF	On-Demand	Mild	HTR1A	23	51
N#Cc1ccc(N2CCN(C(=O)NCCc3c[nH]c4ccc(F)cc34)CC2)cn1	ZINC000875304086	GF	On-Demand	Mild	HTR1D	68	40
N#Cc1ccc(N2CCN(C(=O)NCCc3c[nH]c4ccc(F)cc34)CC2)cn1	ZINC000875304086	GF	On-Demand	Mild	HTR1B	55	46
N#Cc1ccc(N2CCN(C(=O)NCCc3c[nH]c4ccc(F)cc34)CC2)cn1	ZINC000875304086	GF	On-Demand	Mild	SLC6A4	25	51
N#Cc1ccc(N2CCN(C(=O)NCCc3c[nH]c4ccc(F)cc34)CC2)cn1	ZINC000875304086	GF	On-Demand	Mild	MPO	93	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000875304088	FF	On-Demand	Anodyne	HTR1A	24	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000875304088	FF	On-Demand	Anodyne	HTR1D	66	36
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000875304088	FF	On-Demand	Anodyne	HTR1B	59	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000875304088	FF	On-Demand	Anodyne	SLC6A4	37	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000875304088	FF	On-Demand	Anodyne	SLC6A3	25	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000875304088	FF	On-Demand	Anodyne	MPO	97	46
Cc1nnc(NNC(=O)NCCc2c[nH]c3ccc(F)cc23)n1C	ZINC000875304093	ED	On-Demand	Reactive	HTR1A	21	51
Cc1nnc(NNC(=O)NCCc2c[nH]c3ccc(F)cc23)n1C	ZINC000875304093	ED	On-Demand	Reactive	HTR1D	51	51
Cc1nnc(NNC(=O)NCCc2c[nH]c3ccc(F)cc23)n1C	ZINC000875304093	ED	On-Demand	Reactive	HTR1B	35	51
Cc1nnc(NNC(=O)NCCc2c[nH]c3ccc(F)cc23)n1C	ZINC000875304093	ED	On-Demand	Reactive	SLC6A4	23	47
Cc1nnc(NNC(=O)NCCc2c[nH]c3ccc(F)cc23)n1C	ZINC000875304093	ED	On-Demand	Reactive	MPO	104	49
O=C(N[C@@H](Cc1ccccc1)c1cccs1)N1CCC(CO)(CO)CC1	ZINC000875304095	FF	On-Demand	Anodyne	GHRHR	49	34
O=C(N[C@H](Cc1ccccc1)c1cccs1)N1CCC(CO)(CO)CC1	ZINC000875304096	FF	On-Demand	Anodyne	GHRHR	49	34
CN1CCN(C2CCN(C(=O)NCCc3c[nH]c4ccc(F)cc34)CC2)CC1	ZINC000875304104	GE	On-Demand	Anodyne	HTR1A	35	55
CN1CCN(C2CCN(C(=O)NCCc3c[nH]c4ccc(F)cc34)CC2)CC1	ZINC000875304104	GE	On-Demand	Anodyne	HTR1D	123	55
CN1CCN(C2CCN(C(=O)NCCc3c[nH]c4ccc(F)cc34)CC2)CC1	ZINC000875304104	GE	On-Demand	Anodyne	HTR1B	104	55
CN1CCN(C2CCN(C(=O)NCCc3c[nH]c4ccc(F)cc34)CC2)CC1	ZINC000875304104	GE	On-Demand	Anodyne	SLC6A4	38	47
CN1CCN(C2CCN(C(=O)NCCc3c[nH]c4ccc(F)cc34)CC2)CC1	ZINC000875304104	GE	On-Demand	Anodyne	HTR1F	94	42
CN1CCN(C2CCN(C(=O)NCCc3c[nH]c4ccc(F)cc34)CC2)CC1	ZINC000875304104	GE	On-Demand	Anodyne	MPO	106	58
Cn1nnnc1C1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875304135	FD	On-Demand	Anodyne	HTR1A	29	47
Cn1nnnc1C1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875304135	FD	On-Demand	Anodyne	HTR1D	105	47
Cn1nnnc1C1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875304135	FD	On-Demand	Anodyne	HTR1B	88	47
Cn1nnnc1C1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875304135	FD	On-Demand	Anodyne	SLC6A4	30	42
Cn1nnnc1C1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875304135	FD	On-Demand	Anodyne	HTR1F	69	39
Cn1nnnc1C1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875304135	FD	On-Demand	Anodyne	MPO	96	48
COC(=O)[C@@]12C[C@@H](NC(=O)NCCc3c[nH]c4ccc(F)cc34)C[C@@H]1C2	ZINC000875304146	FE	On-Demand	Anodyne	HTR1A	20	50
COC(=O)[C@@]12C[C@@H](NC(=O)NCCc3c[nH]c4ccc(F)cc34)C[C@@H]1C2	ZINC000875304146	FE	On-Demand	Anodyne	HTR1D	31	50
COC(=O)[C@@]12C[C@@H](NC(=O)NCCc3c[nH]c4ccc(F)cc34)C[C@@H]1C2	ZINC000875304146	FE	On-Demand	Anodyne	HTR1B	27	50
COC(=O)[C@@]12C[C@@H](NC(=O)NCCc3c[nH]c4ccc(F)cc34)C[C@@H]1C2	ZINC000875304146	FE	On-Demand	Anodyne	SLC6A4	24	44
COC(=O)[C@@]12C[C@@H](NC(=O)NCCc3c[nH]c4ccc(F)cc34)C[C@@H]1C2	ZINC000875304146	FE	On-Demand	Anodyne	MPO	96	46
O=C1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CCCCCCN1	ZINC000875304155	FF	On-Demand	Anodyne	HTR1A	22	46
O=C1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CCCCCCN1	ZINC000875304155	FF	On-Demand	Anodyne	HTR1D	47	39
O=C1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CCCCCCN1	ZINC000875304155	FF	On-Demand	Anodyne	HTR1B	39	46
O=C1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CCCCCCN1	ZINC000875304155	FF	On-Demand	Anodyne	SLC6A4	27	46
O=C1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CCCCCCN1	ZINC000875304155	FF	On-Demand	Anodyne	MPO	100	51
Cc1ccn(C[C@H](C)C(=O)Nc2ccc(C#N)cn2)n1	ZINC000875304188	CD	On-Demand	Mild	GCK	15	40
NC(=O)Cc1cccc2c1CCN(C(=O)NCCc1c[nH]c3ccc(F)cc13)C2	ZINC000875304200	GF	On-Demand	Anodyne	HTR1A	22	45
NC(=O)Cc1cccc2c1CCN(C(=O)NCCc1c[nH]c3ccc(F)cc13)C2	ZINC000875304200	GF	On-Demand	Anodyne	HTR1D	46	45
NC(=O)Cc1cccc2c1CCN(C(=O)NCCc1c[nH]c3ccc(F)cc13)C2	ZINC000875304200	GF	On-Demand	Anodyne	HTR1B	37	45
NC(=O)Cc1cccc2c1CCN(C(=O)NCCc1c[nH]c3ccc(F)cc13)C2	ZINC000875304200	GF	On-Demand	Anodyne	SLC6A4	24	47
NC(=O)Cc1cccc2c1CCN(C(=O)NCCc1c[nH]c3ccc(F)cc13)C2	ZINC000875304200	GF	On-Demand	Anodyne	MPO	101	48
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875304201	GF	On-Demand	Anodyne	HTR1A	15	40
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875304201	GF	On-Demand	Anodyne	HTR1D	33	40
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875304201	GF	On-Demand	Anodyne	HTR1B	28	40
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875304201	GF	On-Demand	Anodyne	MPO	85	40
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875304202	GF	On-Demand	Anodyne	HTR1A	15	40
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875304202	GF	On-Demand	Anodyne	HTR1D	33	40
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875304202	GF	On-Demand	Anodyne	HTR1B	28	40
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875304202	GF	On-Demand	Anodyne	MPO	85	40
CC(=O)N1CCC[C@@H]1C(=O)Nc1sc2c(c1C(N)=O)-c1ccccc1CCC2	ZINC000875304210	GF	On-Demand	Anodyne	TRY1_BOVIN	55	39
CN(C)[C@@H]1CN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C[C@@H]1n1ccnn1	ZINC000875304212	GD	On-Demand	Anodyne	HTR1A	16	44
CN(C)[C@@H]1CN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C[C@@H]1n1ccnn1	ZINC000875304212	GD	On-Demand	Anodyne	HTR1D	63	39
CN(C)[C@@H]1CN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C[C@@H]1n1ccnn1	ZINC000875304212	GD	On-Demand	Anodyne	HTR1B	49	44
CN(C)[C@@H]1CN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C[C@@H]1n1ccnn1	ZINC000875304212	GD	On-Demand	Anodyne	SLC6A4	19	41
CN(C)[C@@H]1CN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C[C@@H]1n1ccnn1	ZINC000875304212	GD	On-Demand	Anodyne	MPO	92	42
CC[C@H](OC(=O)c1ccc(C(=O)OC)nc1)C(=O)Nc1ccc(OC)cc1	ZINC000875304271	FE	On-Demand	Anodyne	ACR	53	43
CC[C@H](OC(=O)c1ccc(C(=O)OC)nc1)C(=O)Nc1ccc(OC)cc1	ZINC000875304271	FE	On-Demand	Anodyne	PDGFRA	44	38
O=C1c2ccccc2C(=O)N1c1ccc(NC(=O)C23CC(C2)C3)cc1	ZINC000875304273	EG	On-Demand	Anodyne	PTGS1	25	44
O=C(NCCc1c[nH]c2ccc(F)cc12)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875304295	FF	On-Demand	Anodyne	HTR1A	18	46
O=C(NCCc1c[nH]c2ccc(F)cc12)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875304295	FF	On-Demand	Anodyne	HTR1D	16	46
O=C(NCCc1c[nH]c2ccc(F)cc12)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875304295	FF	On-Demand	Anodyne	SLC6A4	23	46
O=C(NCCc1c[nH]c2ccc(F)cc12)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875304295	FF	On-Demand	Anodyne	MPO	96	45
O=C(NCCc1c[nH]c2ccc(F)cc12)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875304296	FF	On-Demand	Anodyne	HTR1A	18	46
O=C(NCCc1c[nH]c2ccc(F)cc12)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875304296	FF	On-Demand	Anodyne	HTR1D	16	46
O=C(NCCc1c[nH]c2ccc(F)cc12)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875304296	FF	On-Demand	Anodyne	SLC6A4	23	46
O=C(NCCc1c[nH]c2ccc(F)cc12)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875304296	FF	On-Demand	Anodyne	MPO	96	45
O=C(N[C@@H](Cc1ccccc1)c1cccs1)N1CCC2(CCNC2=O)CC1	ZINC000875304300	GG	On-Demand	Anodyne	GHRHR	64	36
O=C(N[C@H](Cc1ccccc1)c1cccs1)N1CCC2(CCNC2=O)CC1	ZINC000875304301	GG	On-Demand	Anodyne	GHRHR	64	36
CCO[C@@H](C(=O)Nc1ccc(C#N)cn1)C1CCOCC1	ZINC000875304326	CD	On-Demand	Mild	GCK	30	40
COC1CC(C(=O)Nc2ccc(N3C(=O)c4ccccc4C3=O)cc2)C1	ZINC000875304332	FF	On-Demand	Anodyne	PTGS1	24	40
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCC(CO)(CO)CC1	ZINC000875304337	ED	On-Demand	Anodyne	HTR1A	25	49
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCC(CO)(CO)CC1	ZINC000875304337	ED	On-Demand	Anodyne	HTR1D	85	39
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCC(CO)(CO)CC1	ZINC000875304337	ED	On-Demand	Anodyne	HTR1B	69	49
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCC(CO)(CO)CC1	ZINC000875304337	ED	On-Demand	Anodyne	SLC6A4	27	53
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCC(CO)(CO)CC1	ZINC000875304337	ED	On-Demand	Anodyne	MPO	109	53
N#Cc1ccc(NC(=O)[C@@H](Cc2cccnc2)C2CCCC2)nc1	ZINC000875304340	DG	On-Demand	Mild	C3AR1	41	43
N#Cc1ccc(NC(=O)[C@H](Cc2cccnc2)C2CCCC2)nc1	ZINC000875304341	DG	On-Demand	Mild	C3AR1	41	43
CONC(=O)C1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875304364	FD	On-Demand	Anodyne	HTR1A	32	51
CONC(=O)C1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875304364	FD	On-Demand	Anodyne	HTR1D	98	51
CONC(=O)C1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875304364	FD	On-Demand	Anodyne	HTR1B	82	51
CONC(=O)C1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875304364	FD	On-Demand	Anodyne	SLC6A4	31	45
CONC(=O)C1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875304364	FD	On-Demand	Anodyne	MPO	104	48
CONC(=O)C1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875304364	FD	On-Demand	Anodyne	MTNR1A	24	51
CONC(=O)C1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875304364	FD	On-Demand	Anodyne	MTNR1B	17	45
COC(=O)C1(O)CN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1	ZINC000875304371	EC	On-Demand	Anodyne	HTR1A	27	52
COC(=O)C1(O)CN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1	ZINC000875304371	EC	On-Demand	Anodyne	HTR1D	77	37
COC(=O)C1(O)CN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1	ZINC000875304371	EC	On-Demand	Anodyne	HTR1B	62	52
COC(=O)C1(O)CN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1	ZINC000875304371	EC	On-Demand	Anodyne	SLC6A4	29	48
COC(=O)C1(O)CN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1	ZINC000875304371	EC	On-Demand	Anodyne	MPO	107	51
COC(=O)C1(O)CN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1	ZINC000875304371	EC	On-Demand	Anodyne	MTNR1A	18	48
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1	ZINC000875304381	EG	On-Demand	Anodyne	HTR1A	31	52
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1	ZINC000875304381	EG	On-Demand	Anodyne	HTR1D	74	36
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1	ZINC000875304381	EG	On-Demand	Anodyne	HTR1B	62	52
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1	ZINC000875304381	EG	On-Demand	Anodyne	SLC6A4	33	46
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1	ZINC000875304381	EG	On-Demand	Anodyne	NQO2	30	48
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1	ZINC000875304381	EG	On-Demand	Anodyne	MPO	101	48
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1	ZINC000875304381	EG	On-Demand	Anodyne	MTNR1A	27	48
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1	ZINC000875304381	EG	On-Demand	Anodyne	MTNR1B	19	48
CC[C@H](C[C@H](C)O)NC(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000875304410	DF	On-Demand	Anodyne	HTR1A	17	47
CC[C@H](C[C@H](C)O)NC(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000875304410	DF	On-Demand	Anodyne	HTR1D	24	47
CC[C@H](C[C@H](C)O)NC(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000875304410	DF	On-Demand	Anodyne	HTR1B	20	47
CC[C@H](C[C@H](C)O)NC(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000875304410	DF	On-Demand	Anodyne	SLC6A4	22	50
CC[C@H](C[C@H](C)O)NC(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000875304410	DF	On-Demand	Anodyne	MPO	110	54
CC[C@H](C[C@H](C)O)NC(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000875304410	DF	On-Demand	Anodyne	MTNR1A	16	50
CC[C@H](C[C@H](C)O)NC(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000875304410	DF	On-Demand	Anodyne	GRPR	49	30
C[C@@H]1O[C@H](C)[C@@H](C(=O)Nc2ccc(N3C(=O)c4ccccc4C3=O)cc2)[C@H]1C	ZINC000875304415	GG	On-Demand	Anodyne	PTGS1	24	40
C[C@@H]1O[C@H](C)[C@@H](C(=O)Nc2ccc(N3C(=O)c4ccccc4C3=O)cc2)[C@@H]1C	ZINC000875304416	GG	On-Demand	Anodyne	PTGS1	24	40
C[C@@H]1O[C@H](C)[C@H](C(=O)Nc2ccc(N3C(=O)c4ccccc4C3=O)cc2)[C@H]1C	ZINC000875304417	GG	On-Demand	Anodyne	PTGS1	24	40
C[C@@H]1O[C@H](C)[C@H](C(=O)Nc2ccc(N3C(=O)c4ccccc4C3=O)cc2)[C@@H]1C	ZINC000875304418	GG	On-Demand	Anodyne	PTGS1	24	40
CC(=O)[C@H]1CCCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1	ZINC000875304457	EF	On-Demand	Anodyne	HTR1A	30	49
CC(=O)[C@H]1CCCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1	ZINC000875304457	EF	On-Demand	Anodyne	HTR1D	105	43
CC(=O)[C@H]1CCCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1	ZINC000875304457	EF	On-Demand	Anodyne	HTR1B	87	49
CC(=O)[C@H]1CCCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1	ZINC000875304457	EF	On-Demand	Anodyne	SLC6A4	32	47
CC(=O)[C@H]1CCCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1	ZINC000875304457	EF	On-Demand	Anodyne	MPO	105	52
CC(=O)[C@H]1CCCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1	ZINC000875304457	EF	On-Demand	Anodyne	HTR6	16	40
CC(=O)[C@H]1CCCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1	ZINC000875304457	EF	On-Demand	Anodyne	MTNR1A	18	44
CC(=O)[C@@H]1CCCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1	ZINC000875304458	EF	On-Demand	Anodyne	HTR1A	30	49
CC(=O)[C@@H]1CCCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1	ZINC000875304458	EF	On-Demand	Anodyne	HTR1D	105	43
CC(=O)[C@@H]1CCCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1	ZINC000875304458	EF	On-Demand	Anodyne	HTR1B	87	49
CC(=O)[C@@H]1CCCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1	ZINC000875304458	EF	On-Demand	Anodyne	SLC6A4	32	47
CC(=O)[C@@H]1CCCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1	ZINC000875304458	EF	On-Demand	Anodyne	MPO	105	52
CC(=O)[C@@H]1CCCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1	ZINC000875304458	EF	On-Demand	Anodyne	HTR6	16	40
CC(=O)[C@@H]1CCCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1	ZINC000875304458	EF	On-Demand	Anodyne	MTNR1A	18	44
COC(=O)N(C)NC(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000875304463	DD	On-Demand	Reactive	HTR1A	27	54
COC(=O)N(C)NC(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000875304463	DD	On-Demand	Reactive	HTR1D	62	54
COC(=O)N(C)NC(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000875304463	DD	On-Demand	Reactive	HTR1B	42	54
COC(=O)N(C)NC(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000875304463	DD	On-Demand	Reactive	SLC6A4	27	53
COC(=O)N(C)NC(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000875304463	DD	On-Demand	Reactive	NQO2	32	55
COC(=O)N(C)NC(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000875304463	DD	On-Demand	Reactive	MPO	116	56
COC(=O)N(C)NC(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000875304463	DD	On-Demand	Reactive	MTNR1A	51	62
COC(=O)N(C)NC(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000875304463	DD	On-Demand	Reactive	MTNR1B	31	55
Cc1ccc(N2CCC[C@@H](NC(=O)NCCC3CCN(C(C)C)CC3)C2)nn1	ZINC000875304512	GF	On-Demand	Anodyne	SIRT3	52	32
Cc1ccc(N2CCC[C@@H](NC(=O)NCCC3CCN(C(C)C)CC3)C2)nn1	ZINC000875304512	GF	On-Demand	Anodyne	SIRT2	53	33
Cc1ccc(N2CCC[C@@H](NC(=O)NCCC3CCN(C(C)C)CC3)C2)nn1	ZINC000875304512	GF	On-Demand	Anodyne	SIRT1	52	32
C[S@](=N)(=O)N1CCN(C(=O)N[C@H](Cc2ccccc2)c2cccs2)CC1	ZINC000875304576	GF	On-Demand	Anodyne	CYSP_TRYCR	17	40
C[S@](=N)(=O)N1CCN(C(=O)N[C@H](Cc2ccccc2)c2cccs2)CC1	ZINC000875304576	GF	On-Demand	Anodyne	CAPN2	45	31
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H](Cc2ccccc2)c2cccs2)CC1	ZINC000875304582	GF	On-Demand	Anodyne	CYSP_TRYCR	17	40
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H](Cc2ccccc2)c2cccs2)CC1	ZINC000875304582	GF	On-Demand	Anodyne	CAPN2	45	31
CN1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CCC1(C)C	ZINC000875304648	EF	On-Demand	Anodyne	HTR1A	27	51
CN1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CCC1(C)C	ZINC000875304648	EF	On-Demand	Anodyne	HTR1D	88	39
CN1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CCC1(C)C	ZINC000875304648	EF	On-Demand	Anodyne	HTR1B	73	51
CN1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CCC1(C)C	ZINC000875304648	EF	On-Demand	Anodyne	SLC6A4	30	47
CN1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CCC1(C)C	ZINC000875304648	EF	On-Demand	Anodyne	MPO	105	53
COC(=O)c1ccc(C(=O)O[C@H](C)C(=O)Nc2c(C(C)=O)oc3ccccc23)cn1	ZINC000875304702	HG	On-Demand	Anodyne	FAS	17	40
CCC1(CNC(=O)C(=O)NC(c2ccnn2C)c2ccnn2C)CCCCC1	ZINC000875304743	GD	On-Demand	Anodyne	HCN1	50	31
CCC1(CNC(=O)C(=O)NC(c2ccnn2C)c2ccnn2C)CCCCC1	ZINC000875304743	GD	On-Demand	Anodyne	HCN4	48	31
CCC1(CNC(=O)C(=O)N[C@H](C)c2ccnn2C)CCCCC1	ZINC000875304747	DE	On-Demand	Anodyne	HCN1	57	34
CCC1(CNC(=O)C(=O)N[C@H](C)c2ccnn2C)CCCCC1	ZINC000875304747	DE	On-Demand	Anodyne	HCN4	49	34
CCC1(CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)CCCCC1	ZINC000875304749	DE	On-Demand	Anodyne	HCN1	57	34
CCC1(CNC(=O)C(=O)N[C@@H](C)c2ccnn2C)CCCCC1	ZINC000875304749	DE	On-Demand	Anodyne	HCN4	49	34
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875304760	GE	On-Demand	Anodyne	HTR1A	21	45
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875304760	GE	On-Demand	Anodyne	HTR1D	48	36
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875304760	GE	On-Demand	Anodyne	HTR1B	39	45
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875304760	GE	On-Demand	Anodyne	SLC6A4	24	47
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875304760	GE	On-Demand	Anodyne	MPO	102	47
O=C(NCCO)C1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875304786	GD	On-Demand	Anodyne	HTR1A	26	47
O=C(NCCO)C1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875304786	GD	On-Demand	Anodyne	HTR1D	81	41
O=C(NCCO)C1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875304786	GD	On-Demand	Anodyne	HTR1B	68	47
O=C(NCCO)C1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875304786	GD	On-Demand	Anodyne	SLC6A4	29	54
O=C(NCCO)C1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875304786	GD	On-Demand	Anodyne	MPO	103	54
O=C(NCCO)C1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875304786	GD	On-Demand	Anodyne	MTNR1A	21	50
O=C(NCCO)C1CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)CC1	ZINC000875304786	GD	On-Demand	Anodyne	MTNR1B	15	41
CCO[C@@H](C(=O)Nc1ccc(N2C(=O)c3ccccc3C2=O)cc1)C1CC1	ZINC000875304787	FG	On-Demand	Anodyne	TIMP3	56	32
CCO[C@@H](C(=O)Nc1ccc(N2C(=O)c3ccccc3C2=O)cc1)C1CC1	ZINC000875304787	FG	On-Demand	Anodyne	PRNP	45	34
O=C(NCCc1c[nH]c2ccc(F)cc12)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875304789	FG	On-Demand	Anodyne	HTR1A	21	43
O=C(NCCc1c[nH]c2ccc(F)cc12)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875304789	FG	On-Demand	Anodyne	HTR1D	51	35
O=C(NCCc1c[nH]c2ccc(F)cc12)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875304789	FG	On-Demand	Anodyne	HTR1B	44	43
O=C(NCCc1c[nH]c2ccc(F)cc12)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875304789	FG	On-Demand	Anodyne	SLC6A4	28	52
O=C(NCCc1c[nH]c2ccc(F)cc12)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875304789	FG	On-Demand	Anodyne	MPO	101	52
CCOc1ccc(OC)cc1NC(=O)c1scnc1C(F)F	ZINC000875304805	EH	On-Demand	Anodyne	F10	40	30
CCOc1ccc(OC)cc1NC(=O)c1scnc1C(F)F	ZINC000875304805	EH	On-Demand	Anodyne	MTNR1A	20	41
CCOc1ccc(OC)cc1NC(=O)c1scnc1C(F)F	ZINC000875304805	EH	On-Demand	Anodyne	MTNR1B	19	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)C(=O)N2CCCC[C@@H]2C)C1	ZINC000875304808	FD	On-Demand	Anodyne	ACE	30	44
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)C(=O)N2CCCC[C@H]2C)C1	ZINC000875304809	FD	On-Demand	Anodyne	ACE	30	44
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)C(=O)N2CCCC[C@H]2C)C1	ZINC000875304810	FD	On-Demand	Anodyne	ACE	30	44
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)C(=O)N2CCCC[C@@H]2C)C1	ZINC000875304811	FD	On-Demand	Anodyne	ACE	30	44
CCOc1ccc(OC)cc1NC(=O)C1(OC(C)C)CCC1	ZINC000875304826	DG	On-Demand	Anodyne	MTNR1A	28	42
CCOc1ccc(OC)cc1NC(=O)C1(OC(C)C)CCC1	ZINC000875304826	DG	On-Demand	Anodyne	MTNR1B	32	42
CCOc1ccc(OC)cc1NC(=O)C1(F)CCOCC1	ZINC000875304889	CF	On-Demand	Anodyne	MMP13	18	41
CCOc1ccc(OC)cc1NC(=O)C1(F)CCOCC1	ZINC000875304889	CF	On-Demand	Anodyne	MTNR1A	29	40
CCOc1ccc(OC)cc1NC(=O)C1(F)CCOCC1	ZINC000875304889	CF	On-Demand	Anodyne	MTNR1B	27	40
CCOc1ccc(OC)cc1NC(=O)[C@]12CCCC[C@@H]1C2	ZINC000875304908	CH	On-Demand	Anodyne	MTNR1A	21	40
CCOc1ccc(OC)cc1NC(=O)[C@]12CCCC[C@@H]1C2	ZINC000875304908	CH	On-Demand	Anodyne	MTNR1B	21	40
CCOc1ccc(OC)cc1NC(=O)[C@]12CCCC[C@H]1C2	ZINC000875304909	CH	On-Demand	Anodyne	MTNR1A	21	40
CCOc1ccc(OC)cc1NC(=O)[C@]12CCCC[C@H]1C2	ZINC000875304909	CH	On-Demand	Anodyne	MTNR1B	21	40
CCOc1ccc(OC)cc1NC(=O)[C@@]12CCCC[C@@H]1C2	ZINC000875304910	CH	On-Demand	Anodyne	MTNR1A	21	40
CCOc1ccc(OC)cc1NC(=O)[C@@]12CCCC[C@@H]1C2	ZINC000875304910	CH	On-Demand	Anodyne	MTNR1B	21	40
CCOc1ccc(OC)cc1NC(=O)[C@@]12CCCC[C@H]1C2	ZINC000875304911	CH	On-Demand	Anodyne	MTNR1A	21	40
CCOc1ccc(OC)cc1NC(=O)[C@@]12CCCC[C@H]1C2	ZINC000875304911	CH	On-Demand	Anodyne	MTNR1B	21	40
CCC1(CNC(=O)C(=O)N2CCC(N3CCN(C)CC3)CC2)CCCCC1	ZINC000875304921	GD	On-Demand	Anodyne	L3MBTL3	44	39
Cc1ccc(N2CCC[C@@H](NC(=O)NCCCCC3CC3)C2)nn1	ZINC000875304940	EF	On-Demand	Anodyne	SCD1	24	41
Cc1ccc(N2CCC[C@@H](NC(=O)NCCCCC3CC3)C2)nn1	ZINC000875304940	EF	On-Demand	Anodyne	SCD	15	41
CCOc1ccc(OC)cc1NC(=O)c1sccc1CC#N	ZINC000875305019	DG	On-Demand	Mild	MTNR1A	21	40
CCCCCCCNC(=O)C(=O)NCc1ncnn1CC	ZINC000875305049	CD	On-Demand	Mild	ASAH1	96	36
CCC1(CNC(=O)C(=O)NCc2nc(-c3ccncc3)cs2)CCCCC1	ZINC000875305164	GG	On-Demand	Anodyne	ROCK1	23	40
CCC1(CNC(=O)C(=O)NCc2nc(-c3ccncc3)cs2)CCCCC1	ZINC000875305164	GG	On-Demand	Anodyne	ROCK2	17	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1C	ZINC000875305180	DD	On-Demand	Anodyne	RIR1_HHV11	44	36
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1C	ZINC000875305181	DD	On-Demand	Anodyne	RIR1_HHV11	44	36
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1C	ZINC000875305182	DD	On-Demand	Anodyne	RIR1_HHV11	44	36
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1C	ZINC000875305183	DD	On-Demand	Anodyne	RIR1_HHV11	44	36
C[C@@H](NC(=O)N1Cc2cccc(O)c2C1)C(=O)N1CCCC[C@H]1C	ZINC000875305207	EE	On-Demand	Clean	ACE	32	40
C[C@@H](NC(=O)N1Cc2cccc(O)c2C1)C(=O)N1CCCC[C@H]1C	ZINC000875305207	EE	On-Demand	Clean	PREP	35	45
C[C@@H](NC(=O)N1Cc2cccc(O)c2C1)C(=O)N1CCCC[C@H]1C	ZINC000875305207	EE	On-Demand	Clean	XIAP	41	34
C[C@H](NC(=O)N1Cc2cccc(O)c2C1)C(=O)N1CCCC[C@H]1C	ZINC000875305208	EE	On-Demand	Clean	ACE	32	40
C[C@H](NC(=O)N1Cc2cccc(O)c2C1)C(=O)N1CCCC[C@H]1C	ZINC000875305208	EE	On-Demand	Clean	PREP	35	45
C[C@H](NC(=O)N1Cc2cccc(O)c2C1)C(=O)N1CCCC[C@H]1C	ZINC000875305208	EE	On-Demand	Clean	XIAP	41	34
C[C@H]1CCCCN1C(=O)[C@@H](C)NC(=O)N1Cc2cccc(O)c2C1	ZINC000875305209	EE	On-Demand	Clean	ACE	32	40
C[C@H]1CCCCN1C(=O)[C@@H](C)NC(=O)N1Cc2cccc(O)c2C1	ZINC000875305209	EE	On-Demand	Clean	PREP	35	45
C[C@H]1CCCCN1C(=O)[C@@H](C)NC(=O)N1Cc2cccc(O)c2C1	ZINC000875305209	EE	On-Demand	Clean	XIAP	41	34
C[C@H](NC(=O)N1Cc2cccc(O)c2C1)C(=O)N1CCCC[C@@H]1C	ZINC000875305210	EE	On-Demand	Clean	ACE	32	40
C[C@H](NC(=O)N1Cc2cccc(O)c2C1)C(=O)N1CCCC[C@@H]1C	ZINC000875305210	EE	On-Demand	Clean	PREP	35	45
C[C@H](NC(=O)N1Cc2cccc(O)c2C1)C(=O)N1CCCC[C@@H]1C	ZINC000875305210	EE	On-Demand	Clean	XIAP	41	34
CCOc1ccc(OC)cc1NC(=O)[C@@H](NC=O)C(C)C	ZINC000875305223	CD	On-Demand	Anodyne	MTNR1A	45	44
CCOc1ccc(OC)cc1NC(=O)[C@@H](NC=O)C(C)C	ZINC000875305223	CD	On-Demand	Anodyne	MTNR1B	39	44
Cc1ccncc1NC(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875305262	EI	On-Demand	Anodyne	KCNK3	65	37
CCOc1ccc(OC)cc1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875305269	GG	On-Demand	Anodyne	CTSK	17	48
CCOc1ccc(OC)cc1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875305269	GG	On-Demand	Anodyne	CAPN2	46	40
CCOc1ccc(OC)cc1NC(=O)C1(C)CC(F)(F)C1	ZINC000875305274	CG	On-Demand	Anodyne	MTNR1A	46	41
CCOc1ccc(OC)cc1NC(=O)C1(C)CC(F)(F)C1	ZINC000875305274	CG	On-Demand	Anodyne	MTNR1B	41	41
CCOc1ccc(OC)cc1NC(=O)C(C)(C)c1cccc(OC)c1	ZINC000875305287	EI	On-Demand	Anodyne	MTNR1A	51	41
CCOc1ccc(OC)cc1NC(=O)C(C)(C)c1cccc(OC)c1	ZINC000875305287	EI	On-Demand	Anodyne	MTNR1B	49	41
C[C@H](NC(=O)C(=O)NCC(C)(C)Cc1cccc(Cl)c1)c1ccnn1C	ZINC000875305321	GF	On-Demand	Anodyne	CTSL	16	42
C[C@H](NC(=O)C(=O)NCC(C)(C)Cc1cccc(Cl)c1)c1ccnn1C	ZINC000875305321	GF	On-Demand	Anodyne	CTSV	53	42
CCOc1ccc(OC)cc1NC(=O)C1(c2ccnc3ccccc23)CC1	ZINC000875305373	FI	On-Demand	Anodyne	PDGFRB	49	38
CCOc1ccc(OC)cc1NC(=O)C1(c2ccnc3ccccc23)CC1	ZINC000875305373	FI	On-Demand	Anodyne	KDR	64	37
CCOc1ccc(OC)cc1NC(=O)C1(c2ccnc3ccccc23)CC1	ZINC000875305373	FI	On-Demand	Anodyne	MTNR1A	27	40
CCOc1ccc(OC)cc1NC(=O)C1(c2ccnc3ccccc23)CC1	ZINC000875305373	FI	On-Demand	Anodyne	MTNR1B	30	40
CCOc1ccc(OC)cc1NC(=O)C1(c2ccnc3ccccc23)CC1	ZINC000875305373	FI	On-Demand	Anodyne	PDGFRA	54	38
CC(=O)C1CCN(C(=O)C(=O)NCC(C)(C)Cc2cccc(Cl)c2)CC1	ZINC000875305493	GF	On-Demand	Anodyne	EPHX2	15	40
COC[C@H](C)CNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875305591	EE	On-Demand	Anodyne	OPRL1	15	44
COC[C@@H](C)CNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875305592	EE	On-Demand	Anodyne	OPRL1	15	44
NC(=O)[C@@H]1CCCN(CCCNC(=O)N2C[C@@H]3C[C@H]2CN3c2ccccc2)C1	ZINC000875305598	GD	On-Demand	Anodyne	SLC6A1	144	40
NC(=O)[C@H]1CCCN(CCCNC(=O)N2C[C@@H]3C[C@H]2CN3c2ccccc2)C1	ZINC000875305599	GD	On-Demand	Anodyne	SLC6A1	144	40
CCOc1ccc(OC)cc1NC(=O)c1c(C)ccc([N+](=O)[O-])c1C	ZINC000875305653	EH	On-Demand	Bother	MTNR1A	15	40
CCOc1ccc(OC)cc1NC(=O)c1c(C)ccc([N+](=O)[O-])c1C	ZINC000875305653	EH	On-Demand	Bother	MTNR1B	15	40
CCOc1ccc(OC)cc1NC(=O)c1c(C)ccc([N+](=O)[O-])c1C	ZINC000875305653	EH	On-Demand	Bother	TAAR1	19	40
Cc1ccc(N2CCC[C@@H](NC(=O)NCC[C@@H]3CCSC3)C2)nn1	ZINC000875305677	EE	On-Demand	Anodyne	SIRT2	44	31
Cc1ccc(N2CCC[C@@H](NC(=O)NCC[C@@H]3CCSC3)C2)nn1	ZINC000875305677	EE	On-Demand	Anodyne	SIRT1	40	32
Cc1ccc(N2CCC[C@@H](NC(=O)NCC[C@H]3CCSC3)C2)nn1	ZINC000875305678	EE	On-Demand	Anodyne	SIRT2	44	31
Cc1ccc(N2CCC[C@@H](NC(=O)NCC[C@H]3CCSC3)C2)nn1	ZINC000875305678	EE	On-Demand	Anodyne	SIRT1	40	32
CCOc1ccc(OC)cc1NC(=O)[C@]12CCC[C@@]1(OC)OCC2	ZINC000875305700	EF	On-Demand	Anodyne	MTNR1A	24	43
CCOc1ccc(OC)cc1NC(=O)[C@]12CCC[C@@]1(OC)OCC2	ZINC000875305700	EF	On-Demand	Anodyne	MTNR1B	26	43
CN(C)C[C@@H]1CN(C(=O)NCCCN2CCC[C@@H](C(N)=O)C2)C[C@H]1CN(C)C	ZINC000875305704	GB	On-Demand	Anodyne	SLC6A1	62	37
CN(C)C[C@@H]1CN(C(=O)NCCCN2CCC[C@H](C(N)=O)C2)C[C@H]1CN(C)C	ZINC000875305705	GB	On-Demand	Anodyne	SLC6A1	62	37
COC(=O)C1(O)CN(C(=O)NCCCCN2CCN(C)CC2)C1	ZINC000875305725	EA	On-Demand	Anodyne	DRD3	40	38
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875305762	GF	On-Demand	Anodyne	ABCC8	19	41
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875305762	GF	On-Demand	Anodyne	CAPN2	74	34
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875305762	GF	On-Demand	Anodyne	HCN1	41	35
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875305763	GF	On-Demand	Anodyne	ABCC8	19	41
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875305763	GF	On-Demand	Anodyne	CAPN2	74	34
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875305763	GF	On-Demand	Anodyne	HCN1	41	35
CCOc1ccccc1[C@H](CC(C)C)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875305764	GF	On-Demand	Anodyne	ABCC8	19	41
CCOc1ccccc1[C@H](CC(C)C)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875305764	GF	On-Demand	Anodyne	CAPN2	74	34
CCOc1ccccc1[C@H](CC(C)C)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875305764	GF	On-Demand	Anodyne	HCN1	41	35
CCOc1ccccc1[C@H](CC(C)C)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875305765	GF	On-Demand	Anodyne	ABCC8	19	41
CCOc1ccccc1[C@H](CC(C)C)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875305765	GF	On-Demand	Anodyne	CAPN2	74	34
CCOc1ccccc1[C@H](CC(C)C)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875305765	GF	On-Demand	Anodyne	HCN1	41	35
COC[C@H](C)CNC(=O)N[C@@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875305772	ED	On-Demand	Anodyne	MTNR1B	29	40
COC[C@H](C)CNC(=O)N[C@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875305773	ED	On-Demand	Anodyne	MTNR1B	29	40
COC[C@H](C)CNC(=O)N[C@@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875305774	ED	On-Demand	Anodyne	MTNR1B	29	40
COC[C@H](C)CNC(=O)N[C@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875305775	ED	On-Demand	Anodyne	MTNR1B	29	40
COC[C@H](C)CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875305800	DF	On-Demand	Anodyne	FKBP1A	48	42
COC[C@H](C)CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875305800	DF	On-Demand	Anodyne	CPT1A	106	36
COC[C@H](C)CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875305800	DF	On-Demand	Anodyne	CPT2	43	34
COC[C@H](C)CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875305801	DF	On-Demand	Anodyne	FKBP1A	48	42
COC[C@H](C)CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875305801	DF	On-Demand	Anodyne	CPT1A	106	36
COC[C@H](C)CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875305801	DF	On-Demand	Anodyne	CPT2	43	34
COC[C@H](C)CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875305802	DF	On-Demand	Anodyne	FKBP1A	48	42
COC[C@H](C)CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875305802	DF	On-Demand	Anodyne	CPT1A	106	36
COC[C@H](C)CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875305802	DF	On-Demand	Anodyne	CPT2	43	34
COC[C@H](C)CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875305803	DF	On-Demand	Anodyne	FKBP1A	48	42
COC[C@H](C)CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875305803	DF	On-Demand	Anodyne	CPT1A	106	36
COC[C@H](C)CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875305803	DF	On-Demand	Anodyne	CPT2	43	34
C[C@H](NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1)C(=O)N1CCCC[C@@H]1C	ZINC000875305831	FE	On-Demand	Anodyne	ACE	35	42
C[C@H](NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1)C(=O)N1CCCC[C@@H]1C	ZINC000875305831	FE	On-Demand	Anodyne	XIAP	43	33
C[C@H](NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1)C(=O)N1CCCC[C@@H]1C	ZINC000875305831	FE	On-Demand	Anodyne	BIRC2	42	33
C[C@@H](NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1)C(=O)N1CCCC[C@H]1C	ZINC000875305832	FE	On-Demand	Anodyne	ACE	35	42
C[C@@H](NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1)C(=O)N1CCCC[C@H]1C	ZINC000875305832	FE	On-Demand	Anodyne	XIAP	43	33
C[C@@H](NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1)C(=O)N1CCCC[C@H]1C	ZINC000875305832	FE	On-Demand	Anodyne	BIRC2	42	33
C[C@H]1CCCCN1C(=O)[C@@H](C)NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875305833	FE	On-Demand	Anodyne	ACE	35	42
C[C@H]1CCCCN1C(=O)[C@@H](C)NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875305833	FE	On-Demand	Anodyne	XIAP	43	33
C[C@H]1CCCCN1C(=O)[C@@H](C)NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875305833	FE	On-Demand	Anodyne	BIRC2	42	33
C[C@H](NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1)C(=O)N1CCCC[C@H]1C	ZINC000875305834	FE	On-Demand	Anodyne	ACE	35	42
C[C@H](NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1)C(=O)N1CCCC[C@H]1C	ZINC000875305834	FE	On-Demand	Anodyne	XIAP	43	33
C[C@H](NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1)C(=O)N1CCCC[C@H]1C	ZINC000875305834	FE	On-Demand	Anodyne	BIRC2	42	33
C[C@H]1CCCCN1C(=O)[C@@H](C)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875305839	GG	On-Demand	Anodyne	ACE	28	42
C[C@H]1CCCCN1C(=O)[C@@H](C)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875305839	GG	On-Demand	Anodyne	OPRL1	17	42
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)C(=O)N1CCCC[C@H]1C	ZINC000875305840	GG	On-Demand	Anodyne	ACE	28	42
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)C(=O)N1CCCC[C@H]1C	ZINC000875305840	GG	On-Demand	Anodyne	OPRL1	17	42
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)C(=O)N1CCCC[C@H]1C	ZINC000875305841	GG	On-Demand	Anodyne	ACE	28	42
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)C(=O)N1CCCC[C@H]1C	ZINC000875305841	GG	On-Demand	Anodyne	OPRL1	17	42
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)C(=O)N1CCCC[C@@H]1C	ZINC000875305842	GG	On-Demand	Anodyne	ACE	28	42
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)C(=O)N1CCCC[C@@H]1C	ZINC000875305842	GG	On-Demand	Anodyne	OPRL1	17	42
NC(=O)[C@@H]1CCCN(CCCNC(=O)NNc2cccc(F)c2Cl)C1	ZINC000875305986	FD	On-Demand	Reactive	SLC6A1	139	40
NC(=O)[C@@H]1CCCN(CCCNC(=O)NNc2cccc(F)c2Cl)C1	ZINC000875305986	FD	On-Demand	Reactive	CCR3	27	43
NC(=O)[C@H]1CCCN(CCCNC(=O)NNc2cccc(F)c2Cl)C1	ZINC000875305987	FD	On-Demand	Reactive	SLC6A1	139	40
NC(=O)[C@H]1CCCN(CCCNC(=O)NNc2cccc(F)c2Cl)C1	ZINC000875305987	FD	On-Demand	Reactive	CCR3	27	43
COC[C@H](C)CNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875305995	DD	On-Demand	Anodyne	ADRB2	15	40
COC[C@H](C)CNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875305995	DD	On-Demand	Anodyne	MAOB	16	45
COC[C@H](C)CNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875305995	DD	On-Demand	Anodyne	CTSV	31	41
COC[C@H](C)CNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875305995	DD	On-Demand	Anodyne	PDS	69	39
COC[C@@H](C)CNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875305997	DD	On-Demand	Anodyne	ADRB2	15	40
COC[C@@H](C)CNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875305997	DD	On-Demand	Anodyne	MAOB	16	45
COC[C@@H](C)CNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875305997	DD	On-Demand	Anodyne	CTSV	31	41
COC[C@@H](C)CNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875305997	DD	On-Demand	Anodyne	PDS	69	39
COC[C@H](C)CNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875305998	DD	On-Demand	Anodyne	ADRB2	15	40
COC[C@H](C)CNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875305998	DD	On-Demand	Anodyne	MAOB	16	45
COC[C@H](C)CNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875305998	DD	On-Demand	Anodyne	CTSV	31	41
COC[C@H](C)CNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875305998	DD	On-Demand	Anodyne	PDS	69	39
COC[C@@H](C)CNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875305999	DD	On-Demand	Anodyne	ADRB2	15	40
COC[C@@H](C)CNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875305999	DD	On-Demand	Anodyne	MAOB	16	45
COC[C@@H](C)CNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875305999	DD	On-Demand	Anodyne	CTSV	31	41
COC[C@@H](C)CNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875305999	DD	On-Demand	Anodyne	PDS	69	39
CCOc1ccc(OC)cc1NC(=O)c1c(OC)ccc(F)c1OC	ZINC000875306086	EH	On-Demand	Anodyne	MTNR1A	37	42
CCOc1ccc(OC)cc1NC(=O)c1c(OC)ccc(F)c1OC	ZINC000875306086	EH	On-Demand	Anodyne	MTNR1B	36	42
CCOc1ccc(OC)cc1NC(=O)c1c(OC)ccc(F)c1OC	ZINC000875306086	EH	On-Demand	Anodyne	MET	40	37
CCOc1ccc(OC)cc1NC(=O)c1c(OC)ccc(F)c1OC	ZINC000875306086	EH	On-Demand	Anodyne	LUCI_LUCLA	15	40
CCOc1ccc(OC)cc1NC(=O)c1c(OC)ccc(F)c1OC	ZINC000875306086	EH	On-Demand	Anodyne	GPR35	43	36
NC(=O)[C@H]1CCCN(CCCNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875306132	GD	On-Demand	Anodyne	SLC6A1	146	40
NC(=O)[C@H]1CCCN(CCCNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875306132	GD	On-Demand	Anodyne	NPFFR1	41	36
NC(=O)[C@@H]1CCCN(CCCNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875306133	GD	On-Demand	Anodyne	SLC6A1	146	40
NC(=O)[C@@H]1CCCN(CCCNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875306133	GD	On-Demand	Anodyne	NPFFR1	41	36
C[C@@H]1CN(CCCNC(=O)C(=O)NCc2cccc3ncccc23)CCCO1	ZINC000875306142	GD	On-Demand	Anodyne	HNMT	75	38
CC[C@@H](NC(=O)NCCCCN1CCN(C)CC1)[C@@H](O)c1ccccc1	ZINC000875306156	FD	On-Demand	Anodyne	HTR1A	34	42
CC[C@@H](NC(=O)NCCCCN1CCN(C)CC1)[C@@H](O)c1ccccc1	ZINC000875306156	FD	On-Demand	Anodyne	DRD2	42	46
CC[C@@H](NC(=O)NCCCCN1CCN(C)CC1)[C@@H](O)c1ccccc1	ZINC000875306156	FD	On-Demand	Anodyne	ADRA1A	22	42
CC[C@@H](NC(=O)NCCCCN1CCN(C)CC1)[C@@H](O)c1ccccc1	ZINC000875306156	FD	On-Demand	Anodyne	DRD3	76	46
CC[C@@H](NC(=O)NCCCCN1CCN(C)CC1)[C@@H](O)c1ccccc1	ZINC000875306156	FD	On-Demand	Anodyne	HTR4	15	42
CC[C@@H](NC(=O)NCCCCN1CCN(C)CC1)[C@@H](O)c1ccccc1	ZINC000875306156	FD	On-Demand	Anodyne	CAPN2	18	43
CC[C@@H](NC(=O)NCCCCN1CCN(C)CC1)[C@H](O)c1ccccc1	ZINC000875306159	FD	On-Demand	Anodyne	HTR1A	34	42
CC[C@@H](NC(=O)NCCCCN1CCN(C)CC1)[C@H](O)c1ccccc1	ZINC000875306159	FD	On-Demand	Anodyne	DRD2	42	46
CC[C@@H](NC(=O)NCCCCN1CCN(C)CC1)[C@H](O)c1ccccc1	ZINC000875306159	FD	On-Demand	Anodyne	ADRA1A	22	42
CC[C@@H](NC(=O)NCCCCN1CCN(C)CC1)[C@H](O)c1ccccc1	ZINC000875306159	FD	On-Demand	Anodyne	DRD3	76	46
CC[C@@H](NC(=O)NCCCCN1CCN(C)CC1)[C@H](O)c1ccccc1	ZINC000875306159	FD	On-Demand	Anodyne	HTR4	15	42
CC[C@@H](NC(=O)NCCCCN1CCN(C)CC1)[C@H](O)c1ccccc1	ZINC000875306159	FD	On-Demand	Anodyne	CAPN2	18	43
CCOC1CC2(C1)C[C@H]2C(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1	ZINC000875306203	FI	On-Demand	Anodyne	TIMP3	47	32
NC(=O)[C@@H]1CCCN(CCCNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)C1	ZINC000875306243	GD	On-Demand	Anodyne	SLC6A1	150	45
NC(=O)[C@@H]1CCCN(CCCNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)C1	ZINC000875306243	GD	On-Demand	Anodyne	TRY1_BOVIN	50	36
NC(=O)[C@@H]1CCCN(CCCNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)C1	ZINC000875306243	GD	On-Demand	Anodyne	C3AR1	52	33
NC(=O)[C@@H]1CCCN(CCCNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)C1	ZINC000875306245	GD	On-Demand	Anodyne	SLC6A1	150	45
NC(=O)[C@@H]1CCCN(CCCNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)C1	ZINC000875306245	GD	On-Demand	Anodyne	TRY1_BOVIN	50	36
NC(=O)[C@@H]1CCCN(CCCNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)C1	ZINC000875306245	GD	On-Demand	Anodyne	C3AR1	52	33
NC(=O)[C@@H]1CCCN(CCCNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)C1	ZINC000875306246	GD	On-Demand	Anodyne	SLC6A1	150	45
NC(=O)[C@@H]1CCCN(CCCNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)C1	ZINC000875306246	GD	On-Demand	Anodyne	TRY1_BOVIN	50	36
NC(=O)[C@@H]1CCCN(CCCNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)C1	ZINC000875306246	GD	On-Demand	Anodyne	C3AR1	52	33
NC(=O)[C@@H]1CCCN(CCCNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)C1	ZINC000875306247	GD	On-Demand	Anodyne	SLC6A1	150	45
NC(=O)[C@@H]1CCCN(CCCNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)C1	ZINC000875306247	GD	On-Demand	Anodyne	TRY1_BOVIN	50	36
NC(=O)[C@@H]1CCCN(CCCNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)C1	ZINC000875306247	GD	On-Demand	Anodyne	C3AR1	52	33
CCCCCCCNC(=O)C(=O)NCCc1ccnn1C	ZINC000875306252	CD	On-Demand	Mild	ASAH1	98	41
COC[C@H](C)CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875306415	DE	On-Demand	Anodyne	ACE	37	40
COC[C@H](C)CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875306415	DE	On-Demand	Anodyne	CPT1A	47	33
COC[C@H](C)CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875306416	DE	On-Demand	Anodyne	ACE	37	40
COC[C@H](C)CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875306416	DE	On-Demand	Anodyne	CPT1A	47	33
COC[C@H](C)CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875306417	DE	On-Demand	Anodyne	ACE	37	40
COC[C@H](C)CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875306417	DE	On-Demand	Anodyne	CPT1A	47	33
COC[C@H](C)CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875306418	DE	On-Demand	Anodyne	ACE	37	40
COC[C@H](C)CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875306418	DE	On-Demand	Anodyne	CPT1A	47	33
CC[C@H]1CCCCN1CCNC(=O)N1Cc2cccc(O)c2C1	ZINC000875306444	DF	On-Demand	Clean	DRD2	24	41
CC[C@@H]1CCCCN1CCNC(=O)N1Cc2cccc(O)c2C1	ZINC000875306445	DF	On-Demand	Clean	DRD2	24	41
CCCCCCCNC(=O)C(=O)N[C@H]1CCCN(c2nccn(C)c2=O)C1	ZINC000875306469	GC	On-Demand	Mild	ASAH1	69	35
CCCCCCCNC(=O)C(=O)N[C@@H]1CCCN(c2nccn(C)c2=O)C1	ZINC000875306470	GC	On-Demand	Mild	ASAH1	69	35
C[C@@H]1CN(CCCNC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CCCO1	ZINC000875306491	GD	On-Demand	Anodyne	OXTR	46	34
C[C@@H]1CN(CCCNC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CCCO1	ZINC000875306496	GD	On-Demand	Anodyne	OXTR	46	34
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1	ZINC000875306533	GC	On-Demand	Mild	ADRA1A	43	33
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1	ZINC000875306534	GC	On-Demand	Mild	ADRA1A	43	33
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1	ZINC000875306535	GC	On-Demand	Mild	ADRA1A	43	33
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1	ZINC000875306536	GC	On-Demand	Mild	ADRA1A	43	33
CCC(CC)CNC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O	ZINC000875306580	EE	On-Demand	Anodyne	GPR119	31	42
CCC(CC)CNC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O	ZINC000875306581	EE	On-Demand	Anodyne	GPR119	31	42
CCC(CC)CNC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O	ZINC000875306582	EE	On-Demand	Anodyne	GPR119	31	42
CCC(CC)CNC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O	ZINC000875306583	EE	On-Demand	Anodyne	GPR119	31	42
O=C(CCCOC1CCOCC1)Nc1ccc(C(F)(F)C(F)(F)F)cc1	ZINC000875306642	GI	On-Demand	Anodyne	EPHX2	22	40
COc1ccc([N+](=O)[O-])cc1COc1ccc(Oc2ccccn2)cc1	ZINC000875306653	FI	On-Demand	Bother	TSHR	53	32
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCc3cnc(C)s3)C2)cc1	ZINC000875306670	GD	On-Demand	Anodyne	DRD4	26	46
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCc3cnc(C)s3)C2)cc1	ZINC000875306670	GD	On-Demand	Anodyne	LTA4H	15	43
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCc3cnc(C)s3)C2)cc1	ZINC000875306670	GD	On-Demand	Anodyne	SSTR5	47	38
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCc3cnc(C)s3)C2)cc1	ZINC000875306670	GD	On-Demand	Anodyne	UTS2R	23	40
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCc3cnc(C)s3)C2)cc1	ZINC000875306670	GD	On-Demand	Anodyne	CCR2	15	43
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCc3cnc(C)s3)C2)cc1	ZINC000875306670	GD	On-Demand	Anodyne	MCHR1	33	41
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCc3cnc(C)s3)C2)cc1	ZINC000875306671	GD	On-Demand	Anodyne	DRD4	26	46
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCc3cnc(C)s3)C2)cc1	ZINC000875306671	GD	On-Demand	Anodyne	LTA4H	15	43
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCc3cnc(C)s3)C2)cc1	ZINC000875306671	GD	On-Demand	Anodyne	SSTR5	47	38
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCc3cnc(C)s3)C2)cc1	ZINC000875306671	GD	On-Demand	Anodyne	UTS2R	23	40
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCc3cnc(C)s3)C2)cc1	ZINC000875306671	GD	On-Demand	Anodyne	CCR2	15	43
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCc3cnc(C)s3)C2)cc1	ZINC000875306671	GD	On-Demand	Anodyne	MCHR1	33	41
COC[C@H](C)CNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875306693	EE	On-Demand	Mild	ADRB1	41	31
COC[C@H](C)CNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875306693	EE	On-Demand	Mild	ITK	20	52
COC[C@H](C)CNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875306693	EE	On-Demand	Mild	PANC	41	37
COC[C@@H](C)CNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875306694	EE	On-Demand	Mild	ADRB1	41	31
COC[C@@H](C)CNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875306694	EE	On-Demand	Mild	ITK	20	52
COC[C@@H](C)CNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875306694	EE	On-Demand	Mild	PANC	41	37
CCC(CC)CNC(=O)N[C@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875306703	EF	On-Demand	Anodyne	MTNR1A	43	38
CCC(CC)CNC(=O)N[C@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875306703	EF	On-Demand	Anodyne	MTNR1B	38	41
CCC(CC)CNC(=O)N[C@@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875306704	EF	On-Demand	Anodyne	MTNR1A	43	38
CCC(CC)CNC(=O)N[C@@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875306704	EF	On-Demand	Anodyne	MTNR1B	38	41
CCC(CC)CNC(=O)N[C@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875306705	EF	On-Demand	Anodyne	MTNR1A	43	38
CCC(CC)CNC(=O)N[C@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875306705	EF	On-Demand	Anodyne	MTNR1B	38	41
CCC(CC)CNC(=O)N[C@@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875306706	EF	On-Demand	Anodyne	MTNR1A	43	38
CCC(CC)CNC(=O)N[C@@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875306706	EF	On-Demand	Anodyne	MTNR1B	38	41
CC[C@@H]1COCCN1CCNC(=O)NCCc1ccc(NC(=O)OC)cc1	ZINC000875306709	GD	On-Demand	Anodyne	MTOR	50	38
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCC[C@@H]2Cc2ccccc2)CC1	ZINC000875306740	FD	On-Demand	Anodyne	EPHX2	29	40
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCC[C@H]2Cc2ccccc2)CC1	ZINC000875306741	FD	On-Demand	Anodyne	EPHX2	29	40
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCC[C@H]2Cc2ccccc2)CC1	ZINC000875306742	FD	On-Demand	Anodyne	EPHX2	29	40
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCC[C@@H]2Cc2ccccc2)CC1	ZINC000875306743	FD	On-Demand	Anodyne	EPHX2	29	40
O=C(N[C@H]1C[C@H]2CC[C@H]1C2)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875306762	GH	On-Demand	Anodyne	EPHX2	15	47
O=C(N[C@@H]1C[C@H]2CC[C@H]1C2)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875306763	GH	On-Demand	Anodyne	EPHX2	15	47
COC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)C(=O)NCc2cccc(F)c2F)C1	ZINC000875306769	GD	On-Demand	Anodyne	P2RX7	19	42
COC(=O)N1CCC[C@@H]([C@H](C)NC(=O)C(=O)NCc2cccc(F)c2F)C1	ZINC000875306770	GD	On-Demand	Anodyne	P2RX7	19	42
COC(=O)N1CCC[C@H]([C@@H](C)NC(=O)C(=O)NCc2cccc(F)c2F)C1	ZINC000875306771	GD	On-Demand	Anodyne	P2RX7	19	42
NC(=O)[C@@H]1CCCN(CCCNC(=O)NC2CC(Nc3ccccc3)C2)C1	ZINC000875306826	FD	On-Demand	Anodyne	SLC6A1	153	42
NC(=O)[C@@H]1CCCN(CCCNC(=O)NC2CC(Nc3ccccc3)C2)C1	ZINC000875306826	FD	On-Demand	Anodyne	CCR3	39	43
NC(=O)[C@H]1CCCN(CCCNC(=O)NC2CC(Nc3ccccc3)C2)C1	ZINC000875306827	FD	On-Demand	Anodyne	SLC6A1	153	42
NC(=O)[C@H]1CCCN(CCCNC(=O)NC2CC(Nc3ccccc3)C2)C1	ZINC000875306827	FD	On-Demand	Anodyne	CCR3	39	43
COC[C@@H](C)CNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875306868	EF	On-Demand	Mild	CTSF	40	35
COC[C@@H](C)CNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875306868	EF	On-Demand	Mild	CTSK	22	41
COC[C@@H](C)CNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875306868	EF	On-Demand	Mild	CTSL	21	41
COC[C@@H](C)CNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875306868	EF	On-Demand	Mild	CTSS	15	41
COC[C@@H](C)CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875306871	EF	On-Demand	Mild	CTSF	40	35
COC[C@@H](C)CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875306871	EF	On-Demand	Mild	CTSK	22	41
COC[C@@H](C)CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875306871	EF	On-Demand	Mild	CTSL	21	41
COC[C@@H](C)CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875306871	EF	On-Demand	Mild	CTSS	15	41
COC[C@H](C)CNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875306873	EF	On-Demand	Mild	CTSF	40	35
COC[C@H](C)CNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875306873	EF	On-Demand	Mild	CTSK	22	41
COC[C@H](C)CNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875306873	EF	On-Demand	Mild	CTSL	21	41
COC[C@H](C)CNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875306873	EF	On-Demand	Mild	CTSS	15	41
COC[C@H](C)CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875306874	EF	On-Demand	Mild	CTSF	40	35
COC[C@H](C)CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875306874	EF	On-Demand	Mild	CTSK	22	41
COC[C@H](C)CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875306874	EF	On-Demand	Mild	CTSL	21	41
COC[C@H](C)CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875306874	EF	On-Demand	Mild	CTSS	15	41
CC(=O)N1CCN(C(=O)CCNC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875306889	GD	On-Demand	Anodyne	EPHX2	32	46
NC(=O)[C@@H]1CCCN(CCCNC(=O)N2CCC[C@](O)(c3ccccc3)C2)C1	ZINC000875306918	GD	On-Demand	Anodyne	SLC6A1	142	40
NC(=O)[C@@H]1CCCN(CCCNC(=O)N2CCC[C@](O)(c3ccccc3)C2)C1	ZINC000875306918	GD	On-Demand	Anodyne	ADRA1A	41	39
NC(=O)[C@H]1CCCN(CCCNC(=O)N2CCC[C@](O)(c3ccccc3)C2)C1	ZINC000875306920	GD	On-Demand	Anodyne	SLC6A1	142	40
NC(=O)[C@H]1CCCN(CCCNC(=O)N2CCC[C@](O)(c3ccccc3)C2)C1	ZINC000875306920	GD	On-Demand	Anodyne	ADRA1A	41	39
NC(=O)[C@@H]1CCCN(CCCNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)C1	ZINC000875306922	GD	On-Demand	Anodyne	SLC6A1	142	40
NC(=O)[C@@H]1CCCN(CCCNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)C1	ZINC000875306922	GD	On-Demand	Anodyne	ADRA1A	41	39
NC(=O)[C@H]1CCCN(CCCNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)C1	ZINC000875306924	GD	On-Demand	Anodyne	SLC6A1	142	40
NC(=O)[C@H]1CCCN(CCCNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)C1	ZINC000875306924	GD	On-Demand	Anodyne	ADRA1A	41	39
CN1CC[C@H](NC(=O)C(=O)N[C@@H]2CC23CCC3)[C@H]1c1ccc(Cl)c(F)c1	ZINC000875306954	GE	On-Demand	Anodyne	ENV	48	42
CN1CC[C@H](NC(=O)C(=O)N[C@H]2CC23CCC3)[C@H]1c1ccc(Cl)c(F)c1	ZINC000875306955	GE	On-Demand	Anodyne	ENV	48	42
CN1CC[C@H](NC(=O)C(=O)N[C@H]2CC23CCC3)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000875306957	GE	On-Demand	Anodyne	ENV	48	42
CCOc1ccccc1[C@H](CC(C)C)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875306958	GG	On-Demand	Anodyne	ABCC8	20	44
CCOc1ccccc1[C@H](CC(C)C)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875306958	GG	On-Demand	Anodyne	CAPN2	43	33
CCOc1ccccc1[C@H](CC(C)C)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875306958	GG	On-Demand	Anodyne	HCN1	50	37
CCOc1ccccc1[C@H](CC(C)C)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875306958	GG	On-Demand	Anodyne	HCN4	42	35
CN1CC[C@H](NC(=O)C(=O)N[C@@H]2CC23CCC3)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000875306959	GE	On-Demand	Anodyne	ENV	48	42
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875306960	GG	On-Demand	Anodyne	ABCC8	20	44
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875306960	GG	On-Demand	Anodyne	CAPN2	43	33
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875306960	GG	On-Demand	Anodyne	HCN1	50	37
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875306960	GG	On-Demand	Anodyne	HCN4	42	35
Cc1ncc(CCNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)s1	ZINC000875306973	FD	On-Demand	Anodyne	SIRT3	64	39
Cc1ncc(CCNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)s1	ZINC000875306973	FD	On-Demand	Anodyne	SIRT2	59	38
Cc1ncc(CCNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)s1	ZINC000875306973	FD	On-Demand	Anodyne	SIRT1	57	38
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCc1ccnn1C	ZINC000875307020	ED	On-Demand	Anodyne	MME	41	35
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCc1ccnn1C	ZINC000875307020	ED	On-Demand	Anodyne	CAPN2	51	39
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCc1ccnn1C	ZINC000875307022	ED	On-Demand	Anodyne	MME	41	35
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCc1ccnn1C	ZINC000875307022	ED	On-Demand	Anodyne	CAPN2	51	39
COC[C@H](C)CNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875307044	EG	On-Demand	Anodyne	RBP4	37	40
COC[C@@H](C)CNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875307045	EG	On-Demand	Anodyne	RBP4	37	40
COC[C@H](C)CNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875307046	EG	On-Demand	Anodyne	RBP4	37	40
COC[C@@H](C)CNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875307048	EG	On-Demand	Anodyne	RBP4	37	40
CCC(CC)CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875307148	DG	On-Demand	Anodyne	ACE	38	43
CCC(CC)CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875307149	DG	On-Demand	Anodyne	ACE	38	43
CCC(CC)CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875307151	DG	On-Demand	Anodyne	ACE	38	43
CCC(CC)CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875307152	DG	On-Demand	Anodyne	ACE	38	43
CCOC(=O)N1CCC[C@@H]([C@H](C)NC(=O)C(=O)NCc2cccc(F)c2F)C1	ZINC000875307154	GD	On-Demand	Anodyne	P2RX7	20	43
CCOC(=O)N1CCC[C@H]([C@H](C)NC(=O)C(=O)NCc2cccc(F)c2F)C1	ZINC000875307155	GD	On-Demand	Anodyne	P2RX7	20	43
CCOC(=O)N1CCC[C@H]([C@@H](C)NC(=O)C(=O)NCc2cccc(F)c2F)C1	ZINC000875307156	GD	On-Demand	Anodyne	P2RX7	20	43
CCOC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)C(=O)NCc2cccc(F)c2F)C1	ZINC000875307157	GD	On-Demand	Anodyne	P2RX7	20	43
O=C(COc1ccc(Oc2ccccn2)cc1)NCCN1C(=O)S/C(=C/c2ccccc2F)C1=O	ZINC000875307261	JI	On-Demand	Anodyne	AKR1B1	33	41
CCOc1ccccc1[C@H](CC(C)C)NC(=O)C(=O)NCc1cnn(CC)n1	ZINC000875307339	GE	On-Demand	Anodyne	ABCC8	19	41
CCOc1ccccc1[C@H](CC(C)C)NC(=O)C(=O)NCc1cnn(CC)n1	ZINC000875307339	GE	On-Demand	Anodyne	CAPN2	44	36
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)C(=O)NCc1cnn(CC)n1	ZINC000875307341	GE	On-Demand	Anodyne	ABCC8	19	41
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)C(=O)NCc1cnn(CC)n1	ZINC000875307341	GE	On-Demand	Anodyne	CAPN2	44	36
NC(=O)[C@H]1CCCN(CCCNC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875307343	ED	On-Demand	Clean	SLC6A1	122	37
NC(=O)[C@@H]1CCCN(CCCNC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875307345	ED	On-Demand	Clean	SLC6A1	122	37
Cc1ncc(CCNC(=O)C(=O)NCc2cccc(F)c2F)s1	ZINC000875307347	ED	On-Demand	Anodyne	P2RX7	15	42
CN1CC[C@H](CNC(=O)C(=O)N[C@H]2CC23CCC3)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000875307349	GF	On-Demand	Anodyne	ENV	42	37
CN1CC[C@H](CNC(=O)C(=O)N[C@@H]2CC23CCC3)[C@H]1c1ccc(Cl)c(F)c1	ZINC000875307350	GF	On-Demand	Anodyne	ENV	42	37
CN1CC[C@H](CNC(=O)C(=O)N[C@H]2CC23CCC3)[C@H]1c1ccc(Cl)c(F)c1	ZINC000875307351	GF	On-Demand	Anodyne	ENV	42	37
CN1CC[C@H](CNC(=O)C(=O)N[C@@H]2CC23CCC3)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000875307352	GF	On-Demand	Anodyne	ENV	42	37
Cc1ncc(CCNC(=O)C(=O)N2CCN(c3cccc(F)c3)CC2)s1	ZINC000875307401	GD	On-Demand	Anodyne	MLYCD	18	40
Cn1nccc1CCNC(=O)C(=O)N1CC[C@@H](Oc2cccc(Cl)c2)C1	ZINC000875307442	GD	On-Demand	Anodyne	CCR3	35	41
CN1CC[C@H](NC(=O)C(=O)N[C@@H]2CC23CCC3)[C@H]1c1ccc(F)c(F)c1	ZINC000875307447	FD	On-Demand	Anodyne	ADRA1A	40	33
CN1CC[C@H](NC(=O)C(=O)N[C@H]2CC23CCC3)[C@H]1c1ccc(F)c(F)c1	ZINC000875307448	FD	On-Demand	Anodyne	ADRA1A	40	33
CN1CC[C@H](NC(=O)C(=O)N[C@H]2CC23CCC3)[C@@H]1c1ccc(F)c(F)c1	ZINC000875307449	FD	On-Demand	Anodyne	ADRA1A	40	33
CN1CC[C@H](NC(=O)C(=O)N[C@@H]2CC23CCC3)[C@@H]1c1ccc(F)c(F)c1	ZINC000875307450	FD	On-Demand	Anodyne	ADRA1A	40	33
CC[C@@H](NC(=O)NCCc1ccc(NC(=O)OC)cc1)[C@@H](O)c1ccccc1	ZINC000875307451	GG	On-Demand	Anodyne	ADRB1	34	40
CC[C@@H](NC(=O)NCCc1ccc(NC(=O)OC)cc1)[C@@H](O)c1ccccc1	ZINC000875307451	GG	On-Demand	Anodyne	ADRB3	48	40
CC[C@@H](NC(=O)NCCc1ccc(NC(=O)OC)cc1)[C@H](O)c1ccccc1	ZINC000875307454	GG	On-Demand	Anodyne	ADRB1	34	40
CC[C@@H](NC(=O)NCCc1ccc(NC(=O)OC)cc1)[C@H](O)c1ccccc1	ZINC000875307454	GG	On-Demand	Anodyne	ADRB3	48	40
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1	ZINC000875307522	GE	On-Demand	Anodyne	ADRA1A	57	37
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1	ZINC000875307523	GE	On-Demand	Anodyne	ADRA1A	57	37
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1	ZINC000875307524	GE	On-Demand	Anodyne	ADRA1A	57	37
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1	ZINC000875307525	GE	On-Demand	Anodyne	ADRA1A	57	37
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CCC[C@H]2Cc2ccccc2)CC1	ZINC000875307549	EG	On-Demand	Anodyne	ACE	42	35
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CCC[C@H]2Cc2ccccc2)CC1	ZINC000875307549	EG	On-Demand	Anodyne	MME	24	46
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CCC[C@H]2Cc2ccccc2)CC1	ZINC000875307549	EG	On-Demand	Anodyne	EPHX2	25	41
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CCC[C@H]2Cc2ccccc2)CC1	ZINC000875307549	EG	On-Demand	Anodyne	BIRC2	44	39
C[C@@H](O)C1CCN(C(=O)N[C@H]2CCC[C@H]2Cc2ccccc2)CC1	ZINC000875307550	EG	On-Demand	Anodyne	ACE	42	35
C[C@@H](O)C1CCN(C(=O)N[C@H]2CCC[C@H]2Cc2ccccc2)CC1	ZINC000875307550	EG	On-Demand	Anodyne	MME	24	46
C[C@@H](O)C1CCN(C(=O)N[C@H]2CCC[C@H]2Cc2ccccc2)CC1	ZINC000875307550	EG	On-Demand	Anodyne	EPHX2	25	41
C[C@@H](O)C1CCN(C(=O)N[C@H]2CCC[C@H]2Cc2ccccc2)CC1	ZINC000875307550	EG	On-Demand	Anodyne	BIRC2	44	39
COc1ccc(OC(C)C)c(NC(=O)c2c(C(F)(F)F)coc2C)c1	ZINC000875307557	FJ	On-Demand	Anodyne	GPR35	40	32
O=C(N[C@H]1C[C@H]2CC[C@H]1C2)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875307603	EG	On-Demand	Anodyne	SMO	37	42
O=C(N[C@H]1C[C@H]2CC[C@H]1C2)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875307603	EG	On-Demand	Anodyne	ETHR	56	50
O=C(N[C@@H]1C[C@H]2CC[C@H]1C2)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875307604	EG	On-Demand	Anodyne	SMO	37	42
O=C(N[C@@H]1C[C@H]2CC[C@H]1C2)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875307604	EG	On-Demand	Anodyne	ETHR	56	50
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1	ZINC000875307658	GD	On-Demand	Mild	ADRA1A	43	33
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1	ZINC000875307659	GD	On-Demand	Mild	ADRA1A	43	33
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1	ZINC000875307660	GD	On-Demand	Mild	ADRA1A	43	33
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1	ZINC000875307661	GD	On-Demand	Mild	ADRA1A	43	33
COCC(C)(C)NC(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875307692	FD	On-Demand	Anodyne	FKBP1A	31	42
COCC(C)(C)NC(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875307692	FD	On-Demand	Anodyne	PREP	27	41
COCC(C)(C)NC(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875307692	FD	On-Demand	Anodyne	LGMN	66	39
COCC(C)(C)NC(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875307692	FD	On-Demand	Anodyne	Q9NAW4_PLAFA	39	45
COCC(C)(C)NC(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875307694	FD	On-Demand	Anodyne	FKBP1A	31	42
COCC(C)(C)NC(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875307694	FD	On-Demand	Anodyne	PREP	27	41
COCC(C)(C)NC(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875307694	FD	On-Demand	Anodyne	LGMN	66	39
COCC(C)(C)NC(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875307694	FD	On-Demand	Anodyne	Q9NAW4_PLAFA	39	45
CCC(CC)CNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875307735	EH	On-Demand	Anodyne	OPRL1	20	48
O=C(NCCCCCCc1ccccc1)N[C@H]1CCc2ncnn2C1	ZINC000875307768	EF	On-Demand	Anodyne	MTNR1A	18	40
O=C(NCCCCCCc1ccccc1)N[C@H]1CCc2ncnn2C1	ZINC000875307768	EF	On-Demand	Anodyne	MTNR1B	18	40
O=C(NCCCCCCc1ccccc1)N[C@@H]1CCc2ncnn2C1	ZINC000875307770	EF	On-Demand	Anodyne	MTNR1A	18	40
O=C(NCCCCCCc1ccccc1)N[C@@H]1CCc2ncnn2C1	ZINC000875307770	EF	On-Demand	Anodyne	MTNR1B	18	40
COCC(C)(C)NC(=O)c1cnn(-c2cccc(F)c2)c1C(F)(F)F	ZINC000875307776	FG	On-Demand	Anodyne	MST1R	43	41
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1	ZINC000875307788	GE	On-Demand	Anodyne	CACNA1I	41	33
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1	ZINC000875307791	GE	On-Demand	Anodyne	CACNA1I	41	33
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(C)[C@H]1c1ccc(Cl)cc1	ZINC000875307793	GE	On-Demand	Anodyne	CACNA1I	41	33
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccc(Cl)cc1	ZINC000875307795	GE	On-Demand	Anodyne	CACNA1I	41	33
COC(=O)N1CCC[C@H]([C@@H](C)NC(=O)C(=O)N2Cc3cccc(OC)c3C2)C1	ZINC000875307840	GD	On-Demand	Anodyne	SSTR1	50	35
COC(=O)N1CCC[C@@H]([C@H](C)NC(=O)C(=O)N2Cc3cccc(OC)c3C2)C1	ZINC000875307841	GD	On-Demand	Anodyne	SSTR1	50	35
COC(=O)N1CCC[C@@H]([C@@H](C)NC(=O)C(=O)N2Cc3cccc(OC)c3C2)C1	ZINC000875307842	GD	On-Demand	Anodyne	SSTR1	50	35
O=C(N[C@H]1CCC[C@@H]1Cc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875307869	EE	On-Demand	Anodyne	EPHX2	26	40
O=C(N[C@@H]1CCC[C@@H]1Cc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875307871	EE	On-Demand	Anodyne	EPHX2	26	40
O=C(N[C@H]1CCC[C@H]1Cc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875307872	EE	On-Demand	Anodyne	EPHX2	26	40
O=C(N[C@@H]1CCC[C@H]1Cc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875307873	EE	On-Demand	Anodyne	EPHX2	26	40
O=C(N[C@@H]1C[C@H]2CC[C@H]1C2)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875308073	EE	On-Demand	Anodyne	ETHR	47	36
O=C(N[C@H]1C[C@H]2CC[C@H]1C2)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875308075	EE	On-Demand	Anodyne	ETHR	47	36
O=C(N[C@H]1C[C@H]2CC[C@H]1C2)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875308077	EE	On-Demand	Anodyne	ETHR	47	36
O=C(N[C@@H]1C[C@H]2CC[C@H]1C2)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875308079	EE	On-Demand	Anodyne	ETHR	47	36
CN1CC[C@H](NC(=O)C(=O)NCc2ncc(Cl)s2)[C@H]1c1ccccc1	ZINC000875308144	GD	On-Demand	Anodyne	PARE	100	39
CN1CC[C@H](NC(=O)C(=O)NCc2ncc(Cl)s2)[C@@H]1c1ccccc1	ZINC000875308146	GD	On-Demand	Anodyne	PARE	100	39
Cc1nnc(NNC(=O)N[C@H]2CCC[C@@H]2Cc2ccccc2)n1C	ZINC000875308148	EE	On-Demand	Reactive	CCR3	49	39
Cc1nnc(NNC(=O)N[C@H]2CCC[C@H]2Cc2ccccc2)n1C	ZINC000875308151	EE	On-Demand	Reactive	CCR3	49	39
Cc1nnc(NNC(=O)N[C@@H]2CCC[C@@H]2Cc2ccccc2)n1C	ZINC000875308153	EE	On-Demand	Reactive	CCR3	49	39
Cc1nnc(NNC(=O)N[C@@H]2CCC[C@H]2Cc2ccccc2)n1C	ZINC000875308156	EE	On-Demand	Reactive	CCR3	49	39
CN1CCC(CNC(=O)N[C@H]2CCc3ncnn3C2)(c2ccccc2)CC1	ZINC000875308289	FD	On-Demand	Anodyne	KCNA3	45	38
CN1CCC(CNC(=O)N[C@H]2CCc3ncnn3C2)(c2ccccc2)CC1	ZINC000875308289	FD	On-Demand	Anodyne	NPFFR1	21	40
CN1CCC(CNC(=O)N[C@@H]2CCc3ncnn3C2)(c2ccccc2)CC1	ZINC000875308291	FD	On-Demand	Anodyne	KCNA3	45	38
CN1CCC(CNC(=O)N[C@@H]2CCc3ncnn3C2)(c2ccccc2)CC1	ZINC000875308291	FD	On-Demand	Anodyne	NPFFR1	21	40
CCCCCCCNC(=O)C(=O)N[C@H](C)[C@H]1CCCN(C(=O)OC)C1	ZINC000875308319	FE	On-Demand	Mild	NOD1	71	36
CCCCCCCNC(=O)C(=O)N[C@@H](C)[C@H]1CCCN(C(=O)OC)C1	ZINC000875308321	FE	On-Demand	Mild	NOD1	71	36
CCCCCCCNC(=O)C(=O)N[C@H](C)[C@@H]1CCCN(C(=O)OC)C1	ZINC000875308323	FE	On-Demand	Mild	NOD1	71	36
CCCCCCCNC(=O)C(=O)N[C@@H](C)[C@@H]1CCCN(C(=O)OC)C1	ZINC000875308324	FE	On-Demand	Mild	NOD1	71	36
O=CN1CCCN(C(=O)N[C@H]2CCC[C@@H]2Cc2ccccc2)CC1	ZINC000875308326	EE	On-Demand	Anodyne	CCR3	19	40
O=CN1CCCN(C(=O)N[C@@H]2CCC[C@@H]2Cc2ccccc2)CC1	ZINC000875308328	EE	On-Demand	Anodyne	CCR3	19	40
O=CN1CCCN(C(=O)N[C@H]2CCC[C@H]2Cc2ccccc2)CC1	ZINC000875308329	EE	On-Demand	Anodyne	CCR3	19	40
O=CN1CCCN(C(=O)N[C@@H]2CCC[C@H]2Cc2ccccc2)CC1	ZINC000875308331	EE	On-Demand	Anodyne	CCR3	19	40
CN1CC[C@H](NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)[C@H]1c1ccc(Cl)cc1	ZINC000875308357	GD	On-Demand	Anodyne	CCR1	28	41
CN1CC[C@H](NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)[C@H]1c1ccc(Cl)cc1	ZINC000875308359	GD	On-Demand	Anodyne	CCR1	28	41
CN1CC[C@H](NC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)[C@@H]1c1ccc(Cl)cc1	ZINC000875308361	GD	On-Demand	Anodyne	CCR1	28	41
CN1CC[C@H](NC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)[C@@H]1c1ccc(Cl)cc1	ZINC000875308363	GD	On-Demand	Anodyne	CCR1	28	41
CCC(CC)CNC(=O)NNc1cccc(C)n1	ZINC000875308408	CE	On-Demand	Reactive	GRM5	19	41
CN1CC[C@H](NC(=O)C(=O)NCC[C@H]2CCSC2)[C@H]1c1ccc(F)c(F)c1	ZINC000875308410	GE	On-Demand	Anodyne	ADRA1A	41	36
CN1CC[C@H](NC(=O)C(=O)NCC[C@@H]2CCSC2)[C@@H]1c1ccc(F)c(F)c1	ZINC000875308411	GE	On-Demand	Anodyne	ADRA1A	41	36
CN1CC[C@H](NC(=O)C(=O)NCC[C@@H]2CCSC2)[C@H]1c1ccc(F)c(F)c1	ZINC000875308412	GE	On-Demand	Anodyne	ADRA1A	41	36
CN1CC[C@H](NC(=O)C(=O)NCC[C@H]2CCSC2)[C@@H]1c1ccc(F)c(F)c1	ZINC000875308413	GE	On-Demand	Anodyne	ADRA1A	41	36
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)N[C@H]1CCc2ncnn2C1	ZINC000875308443	GE	On-Demand	Anodyne	SIGMAR1	15	41
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)N[C@@H]1CCc2ncnn2C1	ZINC000875308444	GE	On-Demand	Anodyne	SIGMAR1	15	41
O=C(N[C@@H]1CCc2ncnn2C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875308495	ED	On-Demand	Anodyne	EPHX2	23	46
O=C(N[C@H]1CCc2ncnn2C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875308497	ED	On-Demand	Anodyne	EPHX2	23	46
CN1CCN(C2CCN(C(=O)N[C@@H]3C[C@H]4CC[C@H]3C4)CC2)CC1	ZINC000875308559	DD	On-Demand	Anodyne	L3MBTL3	43	39
CN1CCN(C2CCN(C(=O)N[C@H]3C[C@H]4CC[C@H]3C4)CC2)CC1	ZINC000875308561	DD	On-Demand	Anodyne	L3MBTL3	43	39
CN1CC[C@H](NC(=O)C(=O)NCCCCC2CC2)[C@@H]1c1ccccc1	ZINC000875308628	EE	On-Demand	Anodyne	DRD2	36	43
CN1CC[C@H](NC(=O)C(=O)NCCCCC2CC2)[C@@H]1c1ccccc1	ZINC000875308628	EE	On-Demand	Anodyne	DRD3	68	43
CN1CC[C@H](NC(=O)C(=O)NCCCCC2CC2)[C@H]1c1ccccc1	ZINC000875308629	EE	On-Demand	Anodyne	DRD2	36	43
CN1CC[C@H](NC(=O)C(=O)NCCCCC2CC2)[C@H]1c1ccccc1	ZINC000875308629	EE	On-Demand	Anodyne	DRD3	68	43
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCc2ncnn2C1	ZINC000875308687	GE	On-Demand	Reactive	LTA4H	29	42
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCc2ncnn2C1	ZINC000875308687	GE	On-Demand	Reactive	ADAM17	26	41
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCc2ncnn2C1	ZINC000875308688	GE	On-Demand	Reactive	LTA4H	29	42
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCc2ncnn2C1	ZINC000875308688	GE	On-Demand	Reactive	ADAM17	26	41
O=C(NCc1ccc(OC(F)F)cc1F)N[C@H]1CCc2ncnn2C1	ZINC000875309004	FD	On-Demand	Anodyne	P2RX7	44	34
O=C(NCc1ccc(OC(F)F)cc1F)N[C@@H]1CCc2ncnn2C1	ZINC000875309005	FD	On-Demand	Anodyne	P2RX7	44	34
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@H]1CCc2ncnn2C1	ZINC000875309142	GE	On-Demand	Anodyne	DRD2	15	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@H]1CCc2ncnn2C1	ZINC000875309142	GE	On-Demand	Anodyne	DRD4	37	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@H]1CCc2ncnn2C1	ZINC000875309142	GE	On-Demand	Anodyne	ACHE	57	55
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@H]1CCc2ncnn2C1	ZINC000875309142	GE	On-Demand	Anodyne	HRH2	19	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@H]1CCc2ncnn2C1	ZINC000875309142	GE	On-Demand	Anodyne	SIGMAR1	43	46
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@H]1CCc2ncnn2C1	ZINC000875309142	GE	On-Demand	Anodyne	SSTR5	43	35
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@H]1CCc2ncnn2C1	ZINC000875309142	GE	On-Demand	Anodyne	MCHR1	24	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@H]1CCc2ncnn2C1	ZINC000875309142	GE	On-Demand	Anodyne	NPFFR1	44	38
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@@H]1CCc2ncnn2C1	ZINC000875309143	GE	On-Demand	Anodyne	DRD2	15	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@@H]1CCc2ncnn2C1	ZINC000875309143	GE	On-Demand	Anodyne	DRD4	37	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@@H]1CCc2ncnn2C1	ZINC000875309143	GE	On-Demand	Anodyne	ACHE	57	55
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@@H]1CCc2ncnn2C1	ZINC000875309143	GE	On-Demand	Anodyne	HRH2	19	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@@H]1CCc2ncnn2C1	ZINC000875309143	GE	On-Demand	Anodyne	SIGMAR1	43	46
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@@H]1CCc2ncnn2C1	ZINC000875309143	GE	On-Demand	Anodyne	SSTR5	43	35
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@@H]1CCc2ncnn2C1	ZINC000875309143	GE	On-Demand	Anodyne	MCHR1	24	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@@H]1CCc2ncnn2C1	ZINC000875309143	GE	On-Demand	Anodyne	NPFFR1	44	38
COc1ccc(N2CCN(C(=O)N[C@H]3CCc4ncnn4C3)CC2)c(OC)c1	ZINC000875309294	GD	On-Demand	Clean	PDGFRB	54	39
COc1ccc(N2CCN(C(=O)N[C@@H]3CCc4ncnn4C3)CC2)c(OC)c1	ZINC000875309295	GD	On-Demand	Clean	PDGFRB	54	39
Cc1cccc(CN2CCO[C@@H](CNC(=O)N[C@@H]3CCc4ncnn4C3)C2)c1	ZINC000875309296	GD	On-Demand	Anodyne	DRD4	29	40
Cc1cccc(CN2CCO[C@@H](CNC(=O)N[C@@H]3CCc4ncnn4C3)C2)c1	ZINC000875309296	GD	On-Demand	Anodyne	CCR3	15	45
Cc1cccc(CN2CCO[C@H](CNC(=O)N[C@@H]3CCc4ncnn4C3)C2)c1	ZINC000875309297	GD	On-Demand	Anodyne	DRD4	29	40
Cc1cccc(CN2CCO[C@H](CNC(=O)N[C@@H]3CCc4ncnn4C3)C2)c1	ZINC000875309297	GD	On-Demand	Anodyne	CCR3	15	45
Cc1cccc(CN2CCO[C@@H](CNC(=O)N[C@H]3CCc4ncnn4C3)C2)c1	ZINC000875309298	GD	On-Demand	Anodyne	DRD4	29	40
Cc1cccc(CN2CCO[C@@H](CNC(=O)N[C@H]3CCc4ncnn4C3)C2)c1	ZINC000875309298	GD	On-Demand	Anodyne	CCR3	15	45
Cc1cccc(CN2CCO[C@H](CNC(=O)N[C@H]3CCc4ncnn4C3)C2)c1	ZINC000875309299	GD	On-Demand	Anodyne	DRD4	29	40
Cc1cccc(CN2CCO[C@H](CNC(=O)N[C@H]3CCc4ncnn4C3)C2)c1	ZINC000875309299	GD	On-Demand	Anodyne	CCR3	15	45
O=C(N[C@H]1CCc2ncnn2C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875309304	FD	On-Demand	Anodyne	DRD4	17	40
O=C(N[C@H]1CCc2ncnn2C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875309304	FD	On-Demand	Anodyne	SIGMAR1	21	41
O=C(N[C@@H]1CCc2ncnn2C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875309305	FD	On-Demand	Anodyne	DRD4	17	40
O=C(N[C@@H]1CCc2ncnn2C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875309305	FD	On-Demand	Anodyne	SIGMAR1	21	41
CC(=O)[C@H]1CCCN(C(=O)N[C@H](CCCO)c2ccccc2)C1	ZINC000875309493	DF	On-Demand	Anodyne	SLC6A1	66	39
CC(=O)[C@H]1CCCN(C(=O)N[C@H](CCCO)c2ccccc2)C1	ZINC000875309493	DF	On-Demand	Anodyne	CCR5	32	47
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](CCCO)c2ccccc2)C1	ZINC000875309494	DF	On-Demand	Anodyne	SLC6A1	66	39
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](CCCO)c2ccccc2)C1	ZINC000875309494	DF	On-Demand	Anodyne	CCR5	32	47
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](CCCO)c2ccccc2)C1	ZINC000875309495	DF	On-Demand	Anodyne	SLC6A1	66	39
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](CCCO)c2ccccc2)C1	ZINC000875309495	DF	On-Demand	Anodyne	CCR5	32	47
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](CCCO)c2ccccc2)C1	ZINC000875309496	DF	On-Demand	Anodyne	SLC6A1	66	39
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](CCCO)c2ccccc2)C1	ZINC000875309496	DF	On-Demand	Anodyne	CCR5	32	47
CC(=O)C1CCN(C(=O)N[C@@H](CCCO)c2ccccc2)CC1	ZINC000875309505	DF	On-Demand	Anodyne	CCR5	38	44
CC(=O)C1CCN(C(=O)N[C@H](CCCO)c2ccccc2)CC1	ZINC000875309506	DF	On-Demand	Anodyne	CCR5	38	44
O=C(N[C@H](CCCO)c1ccccc1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875309515	FH	On-Demand	Anodyne	OXTR	37	40
O=C(N[C@H](CCCO)c1ccccc1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875309515	FH	On-Demand	Anodyne	GHRHR	50	46
O=C(N[C@H](CCCO)c1ccccc1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875309516	FH	On-Demand	Anodyne	OXTR	37	40
O=C(N[C@H](CCCO)c1ccccc1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875309516	FH	On-Demand	Anodyne	GHRHR	50	46
O=C(N[C@@H](CCCO)c1ccccc1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875309517	FH	On-Demand	Anodyne	OXTR	37	40
O=C(N[C@@H](CCCO)c1ccccc1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875309517	FH	On-Demand	Anodyne	GHRHR	50	46
O=C(N[C@@H](CCCO)c1ccccc1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875309518	FH	On-Demand	Anodyne	OXTR	37	40
O=C(N[C@@H](CCCO)c1ccccc1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875309518	FH	On-Demand	Anodyne	GHRHR	50	46
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)C1=O	ZINC000875309531	GC	On-Demand	Anodyne	HTR1A	24	46
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)C1=O	ZINC000875309531	GC	On-Demand	Anodyne	DRD2	15	45
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)C1=O	ZINC000875309532	GC	On-Demand	Anodyne	HTR1A	24	46
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)C1=O	ZINC000875309532	GC	On-Demand	Anodyne	DRD2	15	45
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)C1=O	ZINC000875309533	GC	On-Demand	Anodyne	HTR1A	24	46
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)C1=O	ZINC000875309533	GC	On-Demand	Anodyne	DRD2	15	45
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)C1=O	ZINC000875309534	GC	On-Demand	Anodyne	HTR1A	24	46
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)C1=O	ZINC000875309534	GC	On-Demand	Anodyne	DRD2	15	45
O=C(N[C@@H](CCCO)c1ccccc1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875309540	GH	On-Demand	Anodyne	CCR5	19	52
O=C(N[C@@H](CCCO)c1ccccc1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875309540	GH	On-Demand	Anodyne	SMO	43	44
O=C(N[C@@H](CCCO)c1ccccc1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875309540	GH	On-Demand	Anodyne	ETHR	65	45
O=C(N[C@H](CCCO)c1ccccc1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875309541	GH	On-Demand	Anodyne	CCR5	19	52
O=C(N[C@H](CCCO)c1ccccc1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875309541	GH	On-Demand	Anodyne	SMO	43	44
O=C(N[C@H](CCCO)c1ccccc1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875309541	GH	On-Demand	Anodyne	ETHR	65	45
CONC(=O)C1CCN(C(=O)N[C@@H](CCCO)c2ccccc2)CC1	ZINC000875309556	ED	On-Demand	Anodyne	CCR5	33	42
CONC(=O)C1CCN(C(=O)N[C@@H](CCCO)c2ccccc2)CC1	ZINC000875309556	ED	On-Demand	Anodyne	AMY2	44	31
CONC(=O)C1CCN(C(=O)N[C@H](CCCO)c2ccccc2)CC1	ZINC000875309557	ED	On-Demand	Anodyne	CCR5	33	42
CONC(=O)C1CCN(C(=O)N[C@H](CCCO)c2ccccc2)CC1	ZINC000875309557	ED	On-Demand	Anodyne	AMY2	44	31
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@H]2CC23CCC3)C1=O	ZINC000875309563	FC	On-Demand	Anodyne	HTR1A	47	44
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@H]2CC23CCC3)C1=O	ZINC000875309563	FC	On-Demand	Anodyne	DRD2	29	44
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@@H]2CC23CCC3)C1=O	ZINC000875309564	FC	On-Demand	Anodyne	HTR1A	47	44
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N[C@@H]2CC23CCC3)C1=O	ZINC000875309564	FC	On-Demand	Anodyne	DRD2	29	44
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@@H]2CC23CCC3)C1=O	ZINC000875309565	FC	On-Demand	Anodyne	HTR1A	47	44
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@@H]2CC23CCC3)C1=O	ZINC000875309565	FC	On-Demand	Anodyne	DRD2	29	44
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@H]2CC23CCC3)C1=O	ZINC000875309566	FC	On-Demand	Anodyne	HTR1A	47	44
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N[C@H]2CC23CCC3)C1=O	ZINC000875309566	FC	On-Demand	Anodyne	DRD2	29	44
CCOC(=O)[C@@H]1CN(C(=O)N[C@@H](CCCO)c2ccccc2)CCC1(F)F	ZINC000875309572	GF	On-Demand	Anodyne	GHRHR	58	36
CCOC(=O)[C@@H]1CN(C(=O)N[C@H](CCCO)c2ccccc2)CCC1(F)F	ZINC000875309574	GF	On-Demand	Anodyne	GHRHR	58	36
O=C(N[C@H](CCCO)c1ccccc1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875309575	GH	On-Demand	Anodyne	OPRL1	16	51
O=C(N[C@@H](CCCO)c1ccccc1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875309576	GH	On-Demand	Anodyne	OPRL1	16	51
N#Cc1cccc([C@@H](NC(=O)N[C@H](CCO)c2ccccc2)C(F)(F)F)c1	ZINC000875309577	GH	On-Demand	Mild	CTSF	66	33
N#Cc1cccc([C@H](NC(=O)N[C@H](CCO)c2ccccc2)C(F)(F)F)c1	ZINC000875309578	GH	On-Demand	Mild	CTSF	66	33
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@H](CCO)c1ccccc1	ZINC000875309603	DE	On-Demand	Anodyne	TIMP3	79	37
COc1ccc([C@@H]2CN(C(=O)N[C@H](CCCO)c3ccccc3)CCO2)cc1	ZINC000875309606	GG	On-Demand	Anodyne	EDNRB	37	43
COc1ccc([C@@H]2CN(C(=O)N[C@H](CCCO)c3ccccc3)CCO2)cc1	ZINC000875309606	GG	On-Demand	Anodyne	EDNRA	30	43
COc1ccc([C@@H]2CN(C(=O)N[C@@H](CCCO)c3ccccc3)CCO2)cc1	ZINC000875309607	GG	On-Demand	Anodyne	EDNRB	37	43
COc1ccc([C@@H]2CN(C(=O)N[C@@H](CCCO)c3ccccc3)CCO2)cc1	ZINC000875309607	GG	On-Demand	Anodyne	EDNRA	30	43
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1=O	ZINC000875309622	GC	On-Demand	Mild	HTR1A	41	41
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1=O	ZINC000875309622	GC	On-Demand	Mild	DRD2	36	41
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1=O	ZINC000875309622	GC	On-Demand	Mild	DRD3	46	35
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1=O	ZINC000875309622	GC	On-Demand	Mild	XIAP	40	34
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1=O	ZINC000875309623	GC	On-Demand	Mild	HTR1A	41	41
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1=O	ZINC000875309623	GC	On-Demand	Mild	DRD2	36	41
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1=O	ZINC000875309623	GC	On-Demand	Mild	DRD3	46	35
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1=O	ZINC000875309623	GC	On-Demand	Mild	XIAP	40	34
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O	ZINC000875309624	GC	On-Demand	Mild	HTR1A	41	41
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O	ZINC000875309624	GC	On-Demand	Mild	DRD2	36	41
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O	ZINC000875309624	GC	On-Demand	Mild	DRD3	46	35
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O	ZINC000875309624	GC	On-Demand	Mild	XIAP	40	34
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O	ZINC000875309625	GC	On-Demand	Mild	HTR1A	41	41
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O	ZINC000875309625	GC	On-Demand	Mild	DRD2	36	41
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O	ZINC000875309625	GC	On-Demand	Mild	DRD3	46	35
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O	ZINC000875309625	GC	On-Demand	Mild	XIAP	40	34
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CCCO)c1ccccc1	ZINC000875309626	EE	On-Demand	Anodyne	SLC6A4	25	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CCCO)c1ccccc1	ZINC000875309626	EE	On-Demand	Anodyne	SLC6A3	60	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CCCO)c1ccccc1	ZINC000875309627	EE	On-Demand	Anodyne	SLC6A4	25	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CCCO)c1ccccc1	ZINC000875309627	EE	On-Demand	Anodyne	SLC6A3	60	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CCCO)c1ccccc1	ZINC000875309628	EE	On-Demand	Anodyne	SLC6A4	25	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CCCO)c1ccccc1	ZINC000875309628	EE	On-Demand	Anodyne	SLC6A3	60	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CCCO)c1ccccc1	ZINC000875309629	EE	On-Demand	Anodyne	SLC6A4	25	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CCCO)c1ccccc1	ZINC000875309629	EE	On-Demand	Anodyne	SLC6A3	60	42
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1=O	ZINC000875309648	FC	On-Demand	Mild	HTR1A	42	42
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1=O	ZINC000875309648	FC	On-Demand	Mild	DRD2	31	42
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1=O	ZINC000875309649	FC	On-Demand	Mild	HTR1A	42	42
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1=O	ZINC000875309649	FC	On-Demand	Mild	DRD2	31	42
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O	ZINC000875309650	FC	On-Demand	Mild	HTR1A	42	42
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O	ZINC000875309650	FC	On-Demand	Mild	DRD2	31	42
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O	ZINC000875309651	FC	On-Demand	Mild	HTR1A	42	42
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O	ZINC000875309651	FC	On-Demand	Mild	DRD2	31	42
O=C(NC[C@H](O)Cc1cccc(Cl)c1)N[C@@H](CCCO)c1ccccc1	ZINC000875309652	GG	On-Demand	Anodyne	ADRB3	33	43
O=C(NC[C@H](O)Cc1cccc(Cl)c1)N[C@@H](CCCO)c1ccccc1	ZINC000875309652	GG	On-Demand	Anodyne	CTSV	28	41
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)N[C@@H](CCCO)c1ccccc1	ZINC000875309653	GG	On-Demand	Anodyne	ADRB3	33	43
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)N[C@@H](CCCO)c1ccccc1	ZINC000875309653	GG	On-Demand	Anodyne	CTSV	28	41
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)N[C@H](CCCO)c1ccccc1	ZINC000875309654	GG	On-Demand	Anodyne	ADRB3	33	43
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)N[C@H](CCCO)c1ccccc1	ZINC000875309654	GG	On-Demand	Anodyne	CTSV	28	41
O=C(NC[C@H](O)Cc1cccc(Cl)c1)N[C@H](CCCO)c1ccccc1	ZINC000875309655	GG	On-Demand	Anodyne	ADRB3	33	43
O=C(NC[C@H](O)Cc1cccc(Cl)c1)N[C@H](CCCO)c1ccccc1	ZINC000875309655	GG	On-Demand	Anodyne	CTSV	28	41
CC(C)(C)OC(=O)NC1CC(CNC(=O)N[C@H](CCO)c2ccccc2)C1	ZINC000875309666	GF	On-Demand	Anodyne	FPR1	43	36
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC(=O)N[C@H](CCO)c2ccccc2)C1	ZINC000875309667	GF	On-Demand	Anodyne	FPR1	43	36
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O	ZINC000875309700	GG	On-Demand	Anodyne	CPT1A	95	40
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O	ZINC000875309701	GG	On-Demand	Anodyne	CPT1A	95	40
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCCC[C@@H]1[C@H]1CCCC[C@H]1O	ZINC000875309702	GG	On-Demand	Anodyne	CPT1A	95	40
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O	ZINC000875309703	GG	On-Demand	Anodyne	CPT1A	95	40
O=C(N[C@H](CCCO)c1ccccc1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875309721	EF	On-Demand	Anodyne	CCR5	21	40
O=C(N[C@H](CCCO)c1ccccc1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875309722	EF	On-Demand	Anodyne	CCR5	21	40
O=C(N[C@H](CCCO)c1ccccc1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875309723	EF	On-Demand	Anodyne	CCR5	21	40
O=C(N[C@H](CCCO)c1ccccc1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875309724	EF	On-Demand	Anodyne	CCR5	21	40
CN1CCO[C@H](CN(C)C(=O)NCc2nc(-c3ccccc3)n[nH]2)C1	ZINC000875309740	EC	On-Demand	Anodyne	CPT1A	40	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@@H](CCCO)c1ccccc1)CC2	ZINC000875309754	GH	On-Demand	Anodyne	SLC18A2	50	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@@H](CCCO)c1ccccc1)CC2	ZINC000875309754	GH	On-Demand	Anodyne	HCRTR1	15	49
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@@H](CCCO)c1ccccc1)CC2	ZINC000875309754	GH	On-Demand	Anodyne	MTNR1B	18	57
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@H](CCCO)c1ccccc1)CC2	ZINC000875309755	GH	On-Demand	Anodyne	SLC18A2	50	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@H](CCCO)c1ccccc1)CC2	ZINC000875309755	GH	On-Demand	Anodyne	HCRTR1	15	49
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@H](CCCO)c1ccccc1)CC2	ZINC000875309755	GH	On-Demand	Anodyne	MTNR1B	18	57
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)N[C@H](CCCO)c1ccccc1)CC2	ZINC000875309756	GH	On-Demand	Anodyne	SLC18A2	50	37
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)N[C@H](CCCO)c1ccccc1)CC2	ZINC000875309756	GH	On-Demand	Anodyne	HCRTR1	15	49
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)N[C@H](CCCO)c1ccccc1)CC2	ZINC000875309756	GH	On-Demand	Anodyne	MTNR1B	18	57
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)N[C@@H](CCCO)c1ccccc1)CC2	ZINC000875309757	GH	On-Demand	Anodyne	SLC18A2	50	37
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)N[C@@H](CCCO)c1ccccc1)CC2	ZINC000875309757	GH	On-Demand	Anodyne	HCRTR1	15	49
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)N[C@@H](CCCO)c1ccccc1)CC2	ZINC000875309757	GH	On-Demand	Anodyne	MTNR1B	18	57
CC[C@@H](NC(=O)N[C@@H](CCCO)c1ccccc1)c1cccc(OC)c1OC	ZINC000875309764	GH	On-Demand	Anodyne	TACR3	49	44
CC[C@@H](NC(=O)N[C@@H](CCCO)c1ccccc1)c1cccc(OC)c1OC	ZINC000875309764	GH	On-Demand	Anodyne	SOAT1	35	40
CC[C@@H](NC(=O)N[C@H](CCCO)c1ccccc1)c1cccc(OC)c1OC	ZINC000875309767	GH	On-Demand	Anodyne	TACR3	49	44
CC[C@@H](NC(=O)N[C@H](CCCO)c1ccccc1)c1cccc(OC)c1OC	ZINC000875309767	GH	On-Demand	Anodyne	SOAT1	35	40
O=C(NCc1ccc(O)c(Cl)c1)N[C@@H](CCCO)c1ccccc1	ZINC000875309815	EG	On-Demand	Anodyne	NCE103	18	50
O=C(NCc1ccc(O)c(Cl)c1)N[C@H](CCCO)c1ccccc1	ZINC000875309817	EG	On-Demand	Anodyne	NCE103	18	50
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@H](CCCO)c1ccccc1	ZINC000875309829	EF	On-Demand	Anodyne	TIMP3	77	36
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@@H](CCCO)c1ccccc1	ZINC000875309831	EF	On-Demand	Anodyne	TIMP3	77	36
CC[C@@H](NC(=O)N[C@H](CCO)c1ccccc1)c1cccc(OC)c1OC	ZINC000875309856	FH	On-Demand	Anodyne	TACR3	50	45
CC[C@@H](NC(=O)N[C@H](CCO)c1ccccc1)c1cccc(OC)c1OC	ZINC000875309856	FH	On-Demand	Anodyne	SOAT1	32	41
CN1CCN(C2CCN(C(=O)N[C@@H](CCCO)c3ccccc3)CC2)CC1	ZINC000875309866	FD	On-Demand	Anodyne	CCR5	37	48
CN1CCN(C2CCN(C(=O)N[C@@H](CCCO)c3ccccc3)CC2)CC1	ZINC000875309866	FD	On-Demand	Anodyne	L3MBTL3	62	40
CN1CCN(C2CCN(C(=O)N[C@H](CCCO)c3ccccc3)CC2)CC1	ZINC000875309867	FD	On-Demand	Anodyne	CCR5	37	48
CN1CCN(C2CCN(C(=O)N[C@H](CCCO)c3ccccc3)CC2)CC1	ZINC000875309867	FD	On-Demand	Anodyne	L3MBTL3	62	40
CSc1ccc(C)c(C(=O)OCC(=O)c2ccc(NC(C)=O)cc2)c1	ZINC000875309882	FH	On-Demand	Anodyne	ACR	44	34
O=C(NCC[C@@H]1CCSC1)NCc1nc(-c2ccccc2)n[nH]1	ZINC000875309895	EE	On-Demand	Anodyne	VCP	51	33
O=C(NCC[C@H]1CCSC1)NCc1nc(-c2ccccc2)n[nH]1	ZINC000875309896	EE	On-Demand	Anodyne	VCP	51	33
C[C@H]1C[C@H](CO)CCN1C(=O)NCc1nc(-c2ccccc2)n[nH]1	ZINC000875309900	ED	On-Demand	Anodyne	PKNB	36	40
COc1cccc(Oc2ncccc2CNC(=O)N2CC[C@@H]3[C@@H](CCN3C)C2)c1	ZINC000875309903	GG	On-Demand	Anodyne	DRD4	42	33
COc1cccc(Oc2ncccc2CNC(=O)N2CC[C@H]3[C@@H](CCN3C)C2)c1	ZINC000875309905	GG	On-Demand	Anodyne	DRD4	42	33
O=C(NCc1nc(-c2ccccc2)n[nH]1)NCC1CC=CC1	ZINC000875309906	CE	On-Demand	Anodyne	VCP	58	35
COc1cccc(Oc2ncccc2CNC(=O)N2CC[C@H]3[C@H](CCN3C)C2)c1	ZINC000875309907	GG	On-Demand	Anodyne	DRD4	42	33
COc1cccc(Oc2ncccc2CNC(=O)N2CC[C@@H]3[C@H](CCN3C)C2)c1	ZINC000875309909	GG	On-Demand	Anodyne	DRD4	42	33
CSc1ccc(C)c(C(=O)OCC(=O)NC(=O)CCSc2ccccc2)c1	ZINC000875309911	HH	On-Demand	Anodyne	FAS	30	40
CC(=O)N(C)c1ccc(CNC(=O)N[C@H](CCO)c2ccccc2)cc1	ZINC000875309914	FF	On-Demand	Anodyne	ANPEP	18	43
O=C(NCc1nc(-c2ccccc2)n[nH]1)N[C@@H](c1ccccn1)C1CCC1	ZINC000875309917	FG	On-Demand	Anodyne	TTK	37	42
O=C(NCc1nc(-c2ccccc2)n[nH]1)N[C@H](c1ccccn1)C1CCC1	ZINC000875309918	FG	On-Demand	Anodyne	TTK	37	42
Cc1cccc([C@@H](C)CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875309948	EI	On-Demand	Anodyne	EPHX2	15	41
Cc1cccc([C@@H](C)CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875309949	EI	On-Demand	Anodyne	EPHX2	15	41
Cc1cc(F)ccc1CCNC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875309953	GE	On-Demand	Anodyne	ADAMTS4	41	40
Cc1cc(F)ccc1CCNC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875309953	GE	On-Demand	Anodyne	SIRT3	51	31
Cc1cc(F)ccc1CCNC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875309953	GE	On-Demand	Anodyne	SIRT2	52	32
Cc1cc(F)ccc1CCNC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875309953	GE	On-Demand	Anodyne	SIRT1	51	31
CSc1ccc(C)c(C(=O)OCC(=O)NC(=O)NC2CCCCC2)c1	ZINC000875309987	FG	On-Demand	Anodyne	EPHX2	23	41
CSc1ccc(C)c(C(=O)OCC(=O)N2CCN(S(=O)(=O)c3ccccc3)CC2)c1	ZINC000875309995	IE	On-Demand	Anodyne	TGM2	44	38
CSc1ccc(C)c(C(=O)OCC(=O)N2CCN(S(=O)(=O)c3ccccc3)CC2)c1	ZINC000875309995	IE	On-Demand	Anodyne	F13A1	61	38
O=C(NCCCCC1CC1)NCc1nc(-c2ccccc2)n[nH]1	ZINC000875310009	DF	On-Demand	Anodyne	VCP	48	33
O=C(NCc1nc(-c2ccncc2)cs1)N[C@@H](CCCO)c1ccccc1	ZINC000875310019	GH	On-Demand	Anodyne	ROCK1	28	58
O=C(NCc1nc(-c2ccncc2)cs1)N[C@@H](CCCO)c1ccccc1	ZINC000875310019	GH	On-Demand	Anodyne	ROCK2	21	58
O=C(NCc1nc(-c2ccncc2)cs1)N[C@H](CCCO)c1ccccc1	ZINC000875310020	GH	On-Demand	Anodyne	ROCK1	28	58
O=C(NCc1nc(-c2ccncc2)cs1)N[C@H](CCCO)c1ccccc1	ZINC000875310020	GH	On-Demand	Anodyne	ROCK2	21	58
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875310041	GF	On-Demand	Anodyne	CPT1A	57	38
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875310042	GF	On-Demand	Anodyne	CPT1A	57	38
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875310043	GF	On-Demand	Anodyne	CPT1A	57	38
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875310044	GF	On-Demand	Anodyne	CPT1A	57	38
CN1CCCC[C@H](N(C)C(=O)NCc2nc(-c3ccccc3)n[nH]2)C1=O	ZINC000875310048	FD	On-Demand	Anodyne	CPT1A	83	40
CN1CCCC[C@@H](N(C)C(=O)NCc2nc(-c3ccccc3)n[nH]2)C1=O	ZINC000875310049	FD	On-Demand	Anodyne	CPT1A	83	40
CC[C@@H](NC(=O)N1CCC([C@@H](O)c2cccc(OC)c2)CC1)c1ccncc1	ZINC000875310059	GH	On-Demand	Anodyne	PDE4A	15	41
CC[C@@H](NC(=O)N1CCC([C@H](O)c2cccc(OC)c2)CC1)c1ccncc1	ZINC000875310060	GH	On-Demand	Anodyne	PDE4A	15	41
O=C(Nc1ccccc1)[C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310062	FF	On-Demand	Anodyne	ACE	38	42
O=C(Nc1ccccc1)[C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310062	FF	On-Demand	Anodyne	OPRM1	24	42
O=C(Nc1ccccc1)[C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310062	FF	On-Demand	Anodyne	MME	118	44
O=C(Nc1ccccc1)[C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310062	FF	On-Demand	Anodyne	ANPEP	63	34
O=C(Nc1ccccc1)[C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310062	FF	On-Demand	Anodyne	FCER2	91	36
O=C(Nc1ccccc1)[C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310062	FF	On-Demand	Anodyne	TACR2	21	41
O=C(Nc1ccccc1)[C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310062	FF	On-Demand	Anodyne	PAPA1_CARPA	41	38
O=C(Nc1ccccc1)[C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310062	FF	On-Demand	Anodyne	CYSP_TRYCR	46	40
O=C(Nc1ccccc1)[C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310062	FF	On-Demand	Anodyne	TIMP3	112	52
O=C(Nc1ccccc1)[C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310062	FF	On-Demand	Anodyne	HDAC8	18	44
O=C(Nc1ccccc1)[C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310062	FF	On-Demand	Anodyne	CAPNS1	52	32
O=C(Nc1ccccc1)[C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310062	FF	On-Demand	Anodyne	MMP2	23	42
O=C(Nc1ccccc1)[C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310062	FF	On-Demand	Anodyne	MMP3	46	42
O=C(Nc1ccccc1)[C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310062	FF	On-Demand	Anodyne	MMP8	19	40
O=C(Nc1ccccc1)[C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310062	FF	On-Demand	Anodyne	ECE1	40	40
O=C(Nc1ccccc1)[C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310062	FF	On-Demand	Anodyne	CTSS	16	40
O=C(Nc1ccccc1)[C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310062	FF	On-Demand	Anodyne	CAPN1	45	37
O=C(Nc1ccccc1)[C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310062	FF	On-Demand	Anodyne	MMP9	24	52
O=C(Nc1ccccc1)[C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310062	FF	On-Demand	Anodyne	ACE2	59	38
O=C(Nc1ccccc1)[C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310062	FF	On-Demand	Anodyne	MMP1	35	47
O=C(Nc1ccccc1)[C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310062	FF	On-Demand	Anodyne	FPR1	59	43
O=C(Nc1ccccc1)[C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310062	FF	On-Demand	Anodyne	BLA1_STEMA	45	32
O=C(Nc1ccccc1)[C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310062	FF	On-Demand	Anodyne	PSMB8	59	36
O=C(Nc1ccccc1)[C@@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310062	FF	On-Demand	Anodyne	GPR142	57	36
O=C(Nc1ccccc1)[C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310063	FF	On-Demand	Anodyne	ACE	38	42
O=C(Nc1ccccc1)[C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310063	FF	On-Demand	Anodyne	OPRM1	24	42
O=C(Nc1ccccc1)[C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310063	FF	On-Demand	Anodyne	MME	118	44
O=C(Nc1ccccc1)[C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310063	FF	On-Demand	Anodyne	ANPEP	63	34
O=C(Nc1ccccc1)[C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310063	FF	On-Demand	Anodyne	FCER2	91	36
O=C(Nc1ccccc1)[C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310063	FF	On-Demand	Anodyne	TACR2	21	41
O=C(Nc1ccccc1)[C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310063	FF	On-Demand	Anodyne	PAPA1_CARPA	41	38
O=C(Nc1ccccc1)[C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310063	FF	On-Demand	Anodyne	CYSP_TRYCR	46	40
O=C(Nc1ccccc1)[C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310063	FF	On-Demand	Anodyne	TIMP3	112	52
O=C(Nc1ccccc1)[C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310063	FF	On-Demand	Anodyne	HDAC8	18	44
O=C(Nc1ccccc1)[C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310063	FF	On-Demand	Anodyne	CAPNS1	52	32
O=C(Nc1ccccc1)[C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310063	FF	On-Demand	Anodyne	MMP2	23	42
O=C(Nc1ccccc1)[C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310063	FF	On-Demand	Anodyne	MMP3	46	42
O=C(Nc1ccccc1)[C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310063	FF	On-Demand	Anodyne	MMP8	19	40
O=C(Nc1ccccc1)[C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310063	FF	On-Demand	Anodyne	ECE1	40	40
O=C(Nc1ccccc1)[C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310063	FF	On-Demand	Anodyne	CTSS	16	40
O=C(Nc1ccccc1)[C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310063	FF	On-Demand	Anodyne	CAPN1	45	37
O=C(Nc1ccccc1)[C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310063	FF	On-Demand	Anodyne	MMP9	24	52
O=C(Nc1ccccc1)[C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310063	FF	On-Demand	Anodyne	ACE2	59	38
O=C(Nc1ccccc1)[C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310063	FF	On-Demand	Anodyne	MMP1	35	47
O=C(Nc1ccccc1)[C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310063	FF	On-Demand	Anodyne	FPR1	59	43
O=C(Nc1ccccc1)[C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310063	FF	On-Demand	Anodyne	BLA1_STEMA	45	32
O=C(Nc1ccccc1)[C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310063	FF	On-Demand	Anodyne	PSMB8	59	36
O=C(Nc1ccccc1)[C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1	ZINC000875310063	FF	On-Demand	Anodyne	GPR142	57	36
Cc1cccc(NC(=O)[C@@H]2CSCN2C(=O)CN2CCCCC(=O)C2=O)c1	ZINC000875310073	GD	On-Demand	Anodyne	CCKAR	15	40
Cc1cccc(NC(=O)[C@@H]2CSCN2C(=O)CN2CCCCC(=O)C2=O)c1	ZINC000875310073	GD	On-Demand	Anodyne	CCKBR	22	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)c1cccc(C)c1	ZINC000875310079	EF	On-Demand	Anodyne	SLC6A3	50	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)c1cccc(C)c1	ZINC000875310082	EF	On-Demand	Anodyne	SLC6A3	50	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)c1cccc(C)c1	ZINC000875310083	EF	On-Demand	Anodyne	SLC6A3	50	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)c1cccc(C)c1	ZINC000875310085	EF	On-Demand	Anodyne	SLC6A3	50	38
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCC(CCF)CC1	ZINC000875310091	EF	On-Demand	Anodyne	ETHR	26	40
COc1cccc(Oc2ncccc2CNC(=O)NC2(C)CC(F)(F)C2)c1	ZINC000875310104	GH	On-Demand	Anodyne	P2RY1	21	42
COC(=O)c1ccc(CC(=O)N2CSC[C@H]2C(=O)Nc2cccc(C)c2)cn1	ZINC000875310108	GE	On-Demand	Anodyne	CFTR	42	30
COC(=O)c1ccc(CC(=O)N2CSC[C@@H]2C(=O)Nc2cccc(C)c2)cn1	ZINC000875310109	GE	On-Demand	Anodyne	CFTR	42	30
CSc1ccc(C)c(C(=O)O[C@@H](C)C(=O)NCc2ccccc2)c1	ZINC000875310139	EH	On-Demand	Anodyne	FURIN	40	32
CSc1ccc(C)c(C(=O)O[C@@H](C)C(=O)NCc2ccccc2)c1	ZINC000875310139	EH	On-Demand	Anodyne	AMP1_PLAFQ	51	39
CSc1ccc(C)c(C(=O)O[C@@H](C)C(=O)NCc2ccccc2)c1	ZINC000875310139	EH	On-Demand	Anodyne	PDS	57	38
CSc1ccc(C)c(C(=O)O[C@H](C)C(=O)NCc2ccccc2)c1	ZINC000875310141	EH	On-Demand	Anodyne	FURIN	40	32
CSc1ccc(C)c(C(=O)O[C@H](C)C(=O)NCc2ccccc2)c1	ZINC000875310141	EH	On-Demand	Anodyne	AMP1_PLAFQ	51	39
CSc1ccc(C)c(C(=O)O[C@H](C)C(=O)NCc2ccccc2)c1	ZINC000875310141	EH	On-Demand	Anodyne	PDS	57	38
CSc1ccc(C)c(C(=O)OCC(=O)Nc2ccccc2C(=O)Nc2ccccc2)c1	ZINC000875310155	IJ	On-Demand	Anodyne	NR1H4	15	46
CSc1ccc(C)c(C(=O)OCC(=O)Nc2ccccc2C(=O)Nc2ccccc2)c1	ZINC000875310155	IJ	On-Demand	Anodyne	KCNK3	53	40
CSc1ccc(C)c(C(=O)OCC(=O)Nc2ccccc2C(=O)Nc2ccccc2)c1	ZINC000875310155	IJ	On-Demand	Anodyne	KCNK9	53	35
COC(=O)C1CCN(C(=O)COC(=O)c2cc(SC)ccc2C)CC1	ZINC000875310156	FE	On-Demand	Anodyne	PTR1	46	32
CC[C@@H](NC(=O)NNc1cccc(C)n1)c1ccncc1	ZINC000875310165	CF	On-Demand	Reactive	TACR3	43	37
Cc1cc(F)ccc1CCNC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875310178	ED	On-Demand	Anodyne	P2RX7	17	40
Cc1cc(F)ccc1CCNC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875310179	ED	On-Demand	Anodyne	P2RX7	17	40
N#Cc1cccc([C@H](NC(=O)N[C@H](CCCO)c2ccccc2)C(F)(F)F)c1	ZINC000875310208	GH	On-Demand	Mild	CTSF	63	33
N#Cc1cccc([C@H](NC(=O)N[C@H](CCCO)c2ccccc2)C(F)(F)F)c1	ZINC000875310208	GH	On-Demand	Mild	CTRB_BOVIN	45	31
N#Cc1cccc([C@@H](NC(=O)N[C@H](CCCO)c2ccccc2)C(F)(F)F)c1	ZINC000875310209	GH	On-Demand	Mild	CTSF	63	33
N#Cc1cccc([C@@H](NC(=O)N[C@H](CCCO)c2ccccc2)C(F)(F)F)c1	ZINC000875310209	GH	On-Demand	Mild	CTRB_BOVIN	45	31
N#Cc1cccc([C@H](NC(=O)N[C@@H](CCCO)c2ccccc2)C(F)(F)F)c1	ZINC000875310210	GH	On-Demand	Mild	CTSF	63	33
N#Cc1cccc([C@H](NC(=O)N[C@@H](CCCO)c2ccccc2)C(F)(F)F)c1	ZINC000875310210	GH	On-Demand	Mild	CTRB_BOVIN	45	31
N#Cc1cccc([C@@H](NC(=O)N[C@@H](CCCO)c2ccccc2)C(F)(F)F)c1	ZINC000875310211	GH	On-Demand	Mild	CTSF	63	33
N#Cc1cccc([C@@H](NC(=O)N[C@@H](CCCO)c2ccccc2)C(F)(F)F)c1	ZINC000875310211	GH	On-Demand	Mild	CTRB_BOVIN	45	31
CC(C)(C)OC(=O)CN1CCC(NC(=O)N[C@H](CCO)c2ccccc2)CC1	ZINC000875310225	GE	On-Demand	Anodyne	CCR5	25	44
CN1CCC(CNC(=O)N[C@H](CCCO)c2ccccc2)(c2ccccc2)CC1	ZINC000875310273	GG	On-Demand	Anodyne	KCNA3	42	35
CN1CCC(CNC(=O)N[C@H](CCCO)c2ccccc2)(c2ccccc2)CC1	ZINC000875310273	GG	On-Demand	Anodyne	SOAT1	27	43
CN1CCC(CNC(=O)N[C@@H](CCCO)c2ccccc2)(c2ccccc2)CC1	ZINC000875310274	GG	On-Demand	Anodyne	KCNA3	42	35
CN1CCC(CNC(=O)N[C@@H](CCCO)c2ccccc2)(c2ccccc2)CC1	ZINC000875310274	GG	On-Demand	Anodyne	SOAT1	27	43
CN1CCN(C(=O)N[C@H](CCCO)c2ccccc2)Cc2cccnc21	ZINC000875310286	FF	On-Demand	Anodyne	PTAFR	22	40
CN1CCN(C(=O)N[C@@H](CCCO)c2ccccc2)Cc2cccnc21	ZINC000875310287	FF	On-Demand	Anodyne	PTAFR	22	40
CSc1ccc(C)c(C(=O)O[C@@H](C)C(=O)Nc2ccc(C)c(S(=O)(=O)N3CCOCC3)c2)c1	ZINC000875310326	JG	On-Demand	Anodyne	NR1H4	21	49
CSc1ccc(C)c(C(=O)O[C@H](C)C(=O)Nc2ccc(C)c(S(=O)(=O)N3CCOCC3)c2)c1	ZINC000875310327	JG	On-Demand	Anodyne	NR1H4	21	49
Cc1cccc([C@@H](C)CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875310331	DG	On-Demand	Anodyne	REN	16	44
Cc1cccc([C@@H](C)CNC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875310333	DG	On-Demand	Anodyne	REN	16	44
CSc1ccc(C)c(C(=O)OCc2ccccc2[N+](=O)[O-])c1	ZINC000875310347	DH	On-Demand	Bother	COLA	102	36
COc1cccc(Oc2ncccc2CNC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875310355	FE	On-Demand	Anodyne	P2RY1	20	40
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCNC1=O	ZINC000875310379	GE	On-Demand	Anodyne	ACE	43	37
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCNC1=O	ZINC000875310379	GE	On-Demand	Anodyne	MME	124	40
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCNC1=O	ZINC000875310379	GE	On-Demand	Anodyne	ANPEP	57	34
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCNC1=O	ZINC000875310379	GE	On-Demand	Anodyne	MC4R	29	41
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCNC1=O	ZINC000875310379	GE	On-Demand	Anodyne	FCER2	76	36
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCNC1=O	ZINC000875310379	GE	On-Demand	Anodyne	PAPA1_CARPA	50	37
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCNC1=O	ZINC000875310379	GE	On-Demand	Anodyne	CYSP_TRYCR	52	33
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCNC1=O	ZINC000875310379	GE	On-Demand	Anodyne	CTSL	43	37
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCNC1=O	ZINC000875310379	GE	On-Demand	Anodyne	TIMP3	114	52
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCNC1=O	ZINC000875310379	GE	On-Demand	Anodyne	HDAC8	20	42
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCNC1=O	ZINC000875310379	GE	On-Demand	Anodyne	MMP2	26	41
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCNC1=O	ZINC000875310379	GE	On-Demand	Anodyne	MMP3	50	41
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCNC1=O	ZINC000875310379	GE	On-Demand	Anodyne	GRIA1	42	34
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCNC1=O	ZINC000875310379	GE	On-Demand	Anodyne	ECE1	41	37
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCNC1=O	ZINC000875310379	GE	On-Demand	Anodyne	MMP9	24	52
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCNC1=O	ZINC000875310379	GE	On-Demand	Anodyne	ACE2	73	35
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCNC1=O	ZINC000875310379	GE	On-Demand	Anodyne	MC1R	35	41
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCNC1=O	ZINC000875310379	GE	On-Demand	Anodyne	HDAC11	45	38
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCNC1=O	ZINC000875310379	GE	On-Demand	Anodyne	MMP1	38	48
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCNC1=O	ZINC000875310379	GE	On-Demand	Anodyne	FPR1	69	42
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCNC1=O	ZINC000875310379	GE	On-Demand	Anodyne	PSMB8	59	33
CC[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCNC1=O	ZINC000875310379	GE	On-Demand	Anodyne	GPR142	76	36
Cc1csc([C@H]2CCN(C(=O)N[C@H](CCCO)c3ccccc3)C2)n1	ZINC000875310398	FG	On-Demand	Anodyne	CCR5	26	43
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2C[C@@H](OC)CC[C@H]2C)C1=O	ZINC000875310453	GC	On-Demand	Anodyne	HTR1A	23	40
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2C[C@H](OC)CC[C@H]2C)C1=O	ZINC000875310454	GC	On-Demand	Anodyne	HTR1A	23	40
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2C[C@@H](OC)CC[C@@H]2C)C1=O	ZINC000875310455	GC	On-Demand	Anodyne	HTR1A	23	40
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2C[C@H](OC)CC[C@@H]2C)C1=O	ZINC000875310456	GC	On-Demand	Anodyne	HTR1A	23	40
CC(C)[C@H]1CN(C(=O)NCc2nc(-c3ccccc3)n[nH]2)CCN1C	ZINC000875310461	ED	On-Demand	Anodyne	P2RY12	160	37
CCn1ncc(CNC(=O)N[C@H](CCO)c2ccccc2)n1	ZINC000875310462	DD	On-Demand	Anodyne	TACR3	46	37
CN(Cc1ccc2cc[nH]c2c1)C(=O)N[C@@H](CCCO)c1ccccc1	ZINC000875310464	FH	On-Demand	Anodyne	UTS2	50	33
CN(Cc1ccc2cc[nH]c2c1)C(=O)N[C@H](CCCO)c1ccccc1	ZINC000875310465	FH	On-Demand	Anodyne	UTS2	50	33
O=C(NCc1nc(-c2ccccc2)n[nH]1)NC[C@H]1CCCN1CC(F)F	ZINC000875310468	FE	On-Demand	Anodyne	HCRTR1	27	40
O=C(NCc1nc(-c2ccccc2)n[nH]1)NC[C@@H]1CCCN1CC(F)F	ZINC000875310469	FE	On-Demand	Anodyne	HCRTR1	27	40
Cc1cc(F)ccc1CCNC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875310519	GD	On-Demand	Anodyne	L3MBTL3	48	38
Cc1cc(F)ccc1CCNC(=O)C(=O)N[C@H](C)c1ccc(C(F)(F)F)nc1	ZINC000875310525	GG	On-Demand	Anodyne	TRPV1	91	36
Cc1cc(F)ccc1CCNC(=O)C(=O)N[C@@H](C)c1ccc(C(F)(F)F)nc1	ZINC000875310526	GG	On-Demand	Anodyne	TRPV1	91	36
Cc1ccnn1CC(=O)N1CCCc2cc(Cl)cc(F)c21	ZINC000875310543	DF	On-Demand	Anodyne	CNR1	41	31
CSc1ccc(C)c(C(=O)OCc2cc(=O)oc3cc(O)ccc23)c1	ZINC000875310553	FH	On-Demand	Anodyne	MAOB	22	40
CSc1ccc(C)c(C(=O)OCc2cc(=O)oc3cc(O)ccc23)c1	ZINC000875310553	FH	On-Demand	Anodyne	HSD17B3	42	52
CSc1ccc(C)c(C(=O)O[C@@H](C)C(=O)NC23CC4CC(CC(C4)C2)C3)c1	ZINC000875310576	GI	On-Demand	Anodyne	EPHX2	67	46
CSc1ccc(C)c(C(=O)O[C@H](C)C(=O)NC23CC4CC(CC(C4)C2)C3)c1	ZINC000875310577	GI	On-Demand	Anodyne	EPHX2	67	46
CSc1ccc(C)c(C(=O)OCc2cc(=O)oc3cc(C)ccc23)c1	ZINC000875310582	FI	On-Demand	Anodyne	HSD17B3	23	41
O=C(NCc1nc(-c2ccccc2)n[nH]1)NC[C@@H]1CC[C@@H]2C[C@H]2C1	ZINC000875310649	EF	On-Demand	Anodyne	VCP	43	34
O=C(NCc1nc(-c2ccccc2)n[nH]1)NC[C@@H]1CC[C@H]2C[C@@H]2C1	ZINC000875310650	EF	On-Demand	Anodyne	VCP	43	34
O=C(NCc1nc(-c2ccccc2)n[nH]1)NC[C@@H]1CC[C@H]2C[C@H]2C1	ZINC000875310651	EF	On-Demand	Anodyne	VCP	43	34
O=C(NCc1nc(-c2ccccc2)n[nH]1)NC[C@@H]1CC[C@@H]2C[C@@H]2C1	ZINC000875310652	EF	On-Demand	Anodyne	VCP	43	34
CCC1(N2CCOCC2)CCN(C(=O)NCc2nc(-c3ccccc3)n[nH]2)CC1	ZINC000875310672	GE	On-Demand	Anodyne	SMO	19	40
O=C(NCc1nc(-c2ccccc2)n[nH]1)NC[C@@H]1CCN1C1CCCC1	ZINC000875310674	FE	On-Demand	Anodyne	HCRTR1	16	40
O=C(NCc1nc(-c2ccccc2)n[nH]1)NC[C@@H]1CCN1C1CCCC1	ZINC000875310674	FE	On-Demand	Anodyne	CPT1A	43	38
O=C(NCc1nc(-c2ccccc2)n[nH]1)NC[C@H]1CCN1C1CCCC1	ZINC000875310675	FE	On-Demand	Anodyne	HCRTR1	16	40
O=C(NCc1nc(-c2ccccc2)n[nH]1)NC[C@H]1CCN1C1CCCC1	ZINC000875310675	FE	On-Demand	Anodyne	CPT1A	43	38
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCC(Cc2nccs2)CC1	ZINC000875310677	GG	On-Demand	Anodyne	ETHR	40	32
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CCC(C(C)=O)CC2)C1=O	ZINC000875310683	GC	On-Demand	Anodyne	HTR1A	32	42
COc1ccccc1N1CC[C@H](NC(=O)C(=O)N2CCC(C(C)=O)CC2)C1=O	ZINC000875310683	GC	On-Demand	Anodyne	DRD2	19	41
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CCC(C(C)=O)CC2)C1=O	ZINC000875310684	GC	On-Demand	Anodyne	HTR1A	32	42
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)N2CCC(C(C)=O)CC2)C1=O	ZINC000875310684	GC	On-Demand	Anodyne	DRD2	19	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccnc1Oc1cccc(OC)c1	ZINC000875310706	FG	On-Demand	Anodyne	MTNR1A	23	40
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccnc1Oc1cccc(OC)c1	ZINC000875310706	FG	On-Demand	Anodyne	MTNR1B	23	40
CSc1ccc(C)c(C(=O)O[C@H](C)C(=O)NC(=O)NC2CCCCC2)c1	ZINC000875310731	GG	On-Demand	Anodyne	EPHX2	15	40
CSc1ccc(C)c(C(=O)O[C@@H](C)C(=O)NC(=O)NC2CCCCC2)c1	ZINC000875310732	GG	On-Demand	Anodyne	EPHX2	15	40
CSc1ccc(C)c(C(=O)O[C@@H](C)C(=O)Nc2cccc(C)c2)c1	ZINC000875310737	EI	On-Demand	Anodyne	KCNK3	67	38
CSc1ccc(C)c(C(=O)O[C@@H](C)C(=O)Nc2cccc(C)c2)c1	ZINC000875310737	EI	On-Demand	Anodyne	KCNK9	60	38
CSc1ccc(C)c(C(=O)O[C@H](C)C(=O)Nc2cccc(C)c2)c1	ZINC000875310738	EI	On-Demand	Anodyne	KCNK3	67	38
CSc1ccc(C)c(C(=O)O[C@H](C)C(=O)Nc2cccc(C)c2)c1	ZINC000875310738	EI	On-Demand	Anodyne	KCNK9	60	38
CSc1ccc(C)c(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	ZINC000875310747	HE	On-Demand	Reactive	CACNA1C	59	38
CSc1ccc(C)c(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1	ZINC000875310747	HE	On-Demand	Reactive	CACNA1D	88	37
CSc1ccc(C)c(C(=O)OCC(=O)NC(=O)NCc2ccccc2)c1	ZINC000875310774	FF	On-Demand	Anodyne	PDS	45	34
COCCN(CC1CCN(C)CC1)C(=O)NCc1nc(-c2ccccc2)n[nH]1	ZINC000875310794	GD	On-Demand	Anodyne	PKNB	24	40
O=C(N[C@@H](CCCO)c1ccccc1)N1CCC2(CCNC2=O)CC1	ZINC000875310795	ED	On-Demand	Anodyne	CACNA1H	20	41
O=C(N[C@@H](CCCO)c1ccccc1)N1CCC2(CCNC2=O)CC1	ZINC000875310795	ED	On-Demand	Anodyne	GHRHR	51	36
O=C(N[C@H](CCCO)c1ccccc1)N1CCC2(CCNC2=O)CC1	ZINC000875310796	ED	On-Demand	Anodyne	CACNA1H	20	41
O=C(N[C@H](CCCO)c1ccccc1)N1CCC2(CCNC2=O)CC1	ZINC000875310796	ED	On-Demand	Anodyne	GHRHR	51	36
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC[C@H]2CCSC2)C1=O	ZINC000875310802	GD	On-Demand	Anodyne	HTR1A	60	42
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC[C@H]2CCSC2)C1=O	ZINC000875310802	GD	On-Demand	Anodyne	DRD2	42	42
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC[C@H]2CCSC2)C1=O	ZINC000875310802	GD	On-Demand	Anodyne	ADRA1D	43	35
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC[C@H]2CCSC2)C1=O	ZINC000875310802	GD	On-Demand	Anodyne	ADRA1A	40	36
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC[C@H]2CCSC2)C1=O	ZINC000875310802	GD	On-Demand	Anodyne	DRD3	52	42
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC[C@@H]2CCSC2)C1=O	ZINC000875310803	GD	On-Demand	Anodyne	HTR1A	60	42
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC[C@@H]2CCSC2)C1=O	ZINC000875310803	GD	On-Demand	Anodyne	DRD2	42	42
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC[C@@H]2CCSC2)C1=O	ZINC000875310803	GD	On-Demand	Anodyne	ADRA1D	43	35
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC[C@@H]2CCSC2)C1=O	ZINC000875310803	GD	On-Demand	Anodyne	ADRA1A	40	36
COc1ccccc1N1CC[C@H](NC(=O)C(=O)NCC[C@@H]2CCSC2)C1=O	ZINC000875310803	GD	On-Demand	Anodyne	DRD3	52	42
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC[C@H]2CCSC2)C1=O	ZINC000875310804	GD	On-Demand	Anodyne	HTR1A	60	42
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC[C@H]2CCSC2)C1=O	ZINC000875310804	GD	On-Demand	Anodyne	DRD2	42	42
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC[C@H]2CCSC2)C1=O	ZINC000875310804	GD	On-Demand	Anodyne	ADRA1D	43	35
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC[C@H]2CCSC2)C1=O	ZINC000875310804	GD	On-Demand	Anodyne	ADRA1A	40	36
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC[C@H]2CCSC2)C1=O	ZINC000875310804	GD	On-Demand	Anodyne	DRD3	52	42
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC[C@@H]2CCSC2)C1=O	ZINC000875310805	GD	On-Demand	Anodyne	HTR1A	60	42
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC[C@@H]2CCSC2)C1=O	ZINC000875310805	GD	On-Demand	Anodyne	DRD2	42	42
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC[C@@H]2CCSC2)C1=O	ZINC000875310805	GD	On-Demand	Anodyne	ADRA1D	43	35
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC[C@@H]2CCSC2)C1=O	ZINC000875310805	GD	On-Demand	Anodyne	ADRA1A	40	36
COc1ccccc1N1CC[C@@H](NC(=O)C(=O)NCC[C@@H]2CCSC2)C1=O	ZINC000875310805	GD	On-Demand	Anodyne	DRD3	52	42
Cc1cncc([C@@H]2CCCN2C(=O)NCc2nc(-c3ccccc3)n[nH]2)c1	ZINC000875310823	FG	On-Demand	Anodyne	CPT1A	85	41
Cc1cncc([C@H]2CCCN2C(=O)NCc2nc(-c3ccccc3)n[nH]2)c1	ZINC000875310825	FG	On-Demand	Anodyne	CPT1A	85	41
CN1CCN(C2CCN(C(=O)NCc3nc(-c4ccccc4)n[nH]3)CC2)CC1	ZINC000875310885	GD	On-Demand	Anodyne	CALCRL	48	38
CN1CCN(C2CCN(C(=O)NCc3nc(-c4ccccc4)n[nH]3)CC2)CC1	ZINC000875310885	GD	On-Demand	Anodyne	L3MBTL3	68	40
CSc1ccc(C)c(C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000875310902	HF	On-Demand	Anodyne	CA2	67	49
CSc1ccc(C)c(C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000875310902	HF	On-Demand	Anodyne	CA1	61	45
CSc1ccc(C)c(C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000875310902	HF	On-Demand	Anodyne	CA7	26	48
CSc1ccc(C)c(C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000875310902	HF	On-Demand	Anodyne	CA4	52	42
CSc1ccc(C)c(C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000875310902	HF	On-Demand	Anodyne	CA14	29	48
CSc1ccc(C)c(C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000875310902	HF	On-Demand	Anodyne	CA12	48	44
CSc1ccc(C)c(C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000875310902	HF	On-Demand	Anodyne	CA9	50	49
CSc1ccc(C)c(C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000875310902	HF	On-Demand	Anodyne	MTCA1	46	42
CSc1ccc(C)c(C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000875310902	HF	On-Demand	Anodyne	P96878_MYCTU	58	42
CSc1ccc(C)c(C(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000875310903	HF	On-Demand	Anodyne	CA2	67	49
CSc1ccc(C)c(C(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000875310903	HF	On-Demand	Anodyne	CA1	61	45
CSc1ccc(C)c(C(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000875310903	HF	On-Demand	Anodyne	CA7	26	48
CSc1ccc(C)c(C(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000875310903	HF	On-Demand	Anodyne	CA4	52	42
CSc1ccc(C)c(C(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000875310903	HF	On-Demand	Anodyne	CA14	29	48
CSc1ccc(C)c(C(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000875310903	HF	On-Demand	Anodyne	CA12	48	44
CSc1ccc(C)c(C(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000875310903	HF	On-Demand	Anodyne	CA9	50	49
CSc1ccc(C)c(C(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000875310903	HF	On-Demand	Anodyne	MTCA1	46	42
CSc1ccc(C)c(C(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000875310903	HF	On-Demand	Anodyne	P96878_MYCTU	58	42
Cc1cc(F)ccc1CCNC(=O)C(=O)NC(c1ccnn1C)c1ccnn1C	ZINC000875310904	GD	On-Demand	Anodyne	P2RX7	19	41
CSc1ccc(C)c(C(=O)O[C@@H](C)C(=O)N2CCc3ccccc3C2)c1	ZINC000875310910	FH	On-Demand	Anodyne	DPP8	19	41
CSc1ccc(C)c(C(=O)O[C@H](C)C(=O)N2CCc3ccccc3C2)c1	ZINC000875310911	FH	On-Demand	Anodyne	DPP8	19	41
CSc1ccc(C)c(C(=O)OCC(=O)NC(=O)NC23CC4CC(CC(C4)C2)C3)c1	ZINC000875310915	HH	On-Demand	Anodyne	EPHX2	99	49
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875310917	FG	On-Demand	Anodyne	EPHX2	28	42
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875310917	FG	On-Demand	Anodyne	SMO	33	40
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875310927	FG	On-Demand	Anodyne	EPHX2	28	42
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875310927	FG	On-Demand	Anodyne	SMO	33	40
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CC[C@H](O)[C@H]2CCCC[C@@H]21	ZINC000875310935	FE	On-Demand	Anodyne	CPT1A	44	37
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CC[C@H](O)[C@@H]2CCCC[C@H]21	ZINC000875310936	FE	On-Demand	Anodyne	CPT1A	44	37
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CC[C@H](O)[C@@H]2CCCC[C@@H]21	ZINC000875310937	FE	On-Demand	Anodyne	CPT1A	44	37
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CC[C@H](O)[C@H]2CCCC[C@H]21	ZINC000875310938	FE	On-Demand	Anodyne	CPT1A	44	37
N#Cc1cc(F)ccc1N1CCN(C(=O)N[C@@H](CCCO)c2ccccc2)CC1	ZINC000875310975	GG	On-Demand	Mild	NPY2R	60	38
N#C[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310976	GF	On-Demand	Mild	ACE	28	41
N#C[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310976	GF	On-Demand	Mild	OPRM1	17	41
N#C[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310976	GF	On-Demand	Mild	MME	75	42
N#C[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310976	GF	On-Demand	Mild	FCER2	67	35
N#C[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310976	GF	On-Demand	Mild	PAPA1_CARPA	50	41
N#C[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310976	GF	On-Demand	Mild	CTSL	29	40
N#C[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310976	GF	On-Demand	Mild	TIMP3	103	47
N#C[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310976	GF	On-Demand	Mild	HDAC8	17	45
N#C[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310976	GF	On-Demand	Mild	MMP2	15	43
N#C[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310976	GF	On-Demand	Mild	MMP3	35	43
N#C[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310976	GF	On-Demand	Mild	CTSS	18	41
N#C[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310976	GF	On-Demand	Mild	MMP9	19	48
N#C[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310976	GF	On-Demand	Mild	ACE2	44	36
N#C[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310976	GF	On-Demand	Mild	CTSC	44	41
N#C[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310976	GF	On-Demand	Mild	MMP1	28	43
N#C[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310976	GF	On-Demand	Mild	FPR1	48	39
N#C[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310976	GF	On-Demand	Mild	PSMB8	57	34
N#C[C@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310976	GF	On-Demand	Mild	GPR142	42	33
N#Cc1cc(F)ccc1N1CCN(C(=O)N[C@H](CCCO)c2ccccc2)CC1	ZINC000875310977	GG	On-Demand	Mild	NPY2R	60	38
N#C[C@@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310978	GF	On-Demand	Mild	ACE	28	41
N#C[C@@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310978	GF	On-Demand	Mild	OPRM1	17	41
N#C[C@@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310978	GF	On-Demand	Mild	MME	75	42
N#C[C@@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310978	GF	On-Demand	Mild	FCER2	67	35
N#C[C@@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310978	GF	On-Demand	Mild	PAPA1_CARPA	50	41
N#C[C@@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310978	GF	On-Demand	Mild	CTSL	29	40
N#C[C@@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310978	GF	On-Demand	Mild	TIMP3	103	47
N#C[C@@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310978	GF	On-Demand	Mild	HDAC8	17	45
N#C[C@@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310978	GF	On-Demand	Mild	MMP2	15	43
N#C[C@@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310978	GF	On-Demand	Mild	MMP3	35	43
N#C[C@@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310978	GF	On-Demand	Mild	CTSS	18	41
N#C[C@@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310978	GF	On-Demand	Mild	MMP9	19	48
N#C[C@@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310978	GF	On-Demand	Mild	ACE2	44	36
N#C[C@@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310978	GF	On-Demand	Mild	CTSC	44	41
N#C[C@@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310978	GF	On-Demand	Mild	MMP1	28	43
N#C[C@@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310978	GF	On-Demand	Mild	FPR1	48	39
N#C[C@@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310978	GF	On-Demand	Mild	PSMB8	57	34
N#C[C@@]1(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310978	GF	On-Demand	Mild	GPR142	42	33
N#C[C@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310979	GF	On-Demand	Mild	ACE	28	41
N#C[C@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310979	GF	On-Demand	Mild	OPRM1	17	41
N#C[C@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310979	GF	On-Demand	Mild	MME	75	42
N#C[C@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310979	GF	On-Demand	Mild	FCER2	67	35
N#C[C@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310979	GF	On-Demand	Mild	PAPA1_CARPA	50	41
N#C[C@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310979	GF	On-Demand	Mild	CTSL	29	40
N#C[C@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310979	GF	On-Demand	Mild	TIMP3	103	47
N#C[C@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310979	GF	On-Demand	Mild	HDAC8	17	45
N#C[C@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310979	GF	On-Demand	Mild	MMP2	15	43
N#C[C@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310979	GF	On-Demand	Mild	MMP3	35	43
N#C[C@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310979	GF	On-Demand	Mild	CTSS	18	41
N#C[C@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310979	GF	On-Demand	Mild	MMP9	19	48
N#C[C@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310979	GF	On-Demand	Mild	ACE2	44	36
N#C[C@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310979	GF	On-Demand	Mild	CTSC	44	41
N#C[C@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310979	GF	On-Demand	Mild	MMP1	28	43
N#C[C@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310979	GF	On-Demand	Mild	FPR1	48	39
N#C[C@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310979	GF	On-Demand	Mild	PSMB8	57	34
N#C[C@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310979	GF	On-Demand	Mild	GPR142	42	33
N#C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310982	GF	On-Demand	Mild	ACE	28	41
N#C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310982	GF	On-Demand	Mild	OPRM1	17	41
N#C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310982	GF	On-Demand	Mild	MME	75	42
N#C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310982	GF	On-Demand	Mild	FCER2	67	35
N#C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310982	GF	On-Demand	Mild	PAPA1_CARPA	50	41
N#C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310982	GF	On-Demand	Mild	CTSL	29	40
N#C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310982	GF	On-Demand	Mild	TIMP3	103	47
N#C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310982	GF	On-Demand	Mild	HDAC8	17	45
N#C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310982	GF	On-Demand	Mild	MMP2	15	43
N#C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310982	GF	On-Demand	Mild	MMP3	35	43
N#C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310982	GF	On-Demand	Mild	CTSS	18	41
N#C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310982	GF	On-Demand	Mild	MMP9	19	48
N#C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310982	GF	On-Demand	Mild	ACE2	44	36
N#C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310982	GF	On-Demand	Mild	CTSC	44	41
N#C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310982	GF	On-Demand	Mild	MMP1	28	43
N#C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310982	GF	On-Demand	Mild	FPR1	48	39
N#C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310982	GF	On-Demand	Mild	PSMB8	57	34
N#C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCCOC1	ZINC000875310982	GF	On-Demand	Mild	GPR142	42	33
CSc1ccc(C)c(C(=O)O[C@@H](C)C(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	ZINC000875310984	JF	On-Demand	Anodyne	TGM2	53	38
CSc1ccc(C)c(C(=O)O[C@@H](C)C(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	ZINC000875310984	JF	On-Demand	Anodyne	F13A1	72	38
CSc1ccc(C)c(C(=O)O[C@H](C)C(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	ZINC000875310986	JF	On-Demand	Anodyne	TGM2	53	38
CSc1ccc(C)c(C(=O)O[C@H](C)C(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1	ZINC000875310986	JF	On-Demand	Anodyne	F13A1	72	38
Cc1cc(F)ccc1CCNC(=O)C(=O)NCc1ncc(Cl)s1	ZINC000875311016	FE	On-Demand	Anodyne	P2RX7	42	40
CSc1ccc(C)c(C(=O)OCC(=O)N2CCN(S(=O)(=O)c3ccc(Cl)cc3)CC2)c1	ZINC000875311028	JG	On-Demand	Anodyne	TGM2	49	38
CSc1ccc(C)c(C(=O)OCC(=O)N2CCN(S(=O)(=O)c3ccc(Cl)cc3)CC2)c1	ZINC000875311028	JG	On-Demand	Anodyne	F13A1	54	38
CSc1ccc(C)c(C(=O)O[C@@H](C)C(=O)Nc2ccc(N3CCOCC3)cc2)c1	ZINC000875311030	HH	On-Demand	Anodyne	STAT6	53	33
CSc1ccc(C)c(C(=O)O[C@H](C)C(=O)Nc2ccc(N3CCOCC3)cc2)c1	ZINC000875311033	HH	On-Demand	Anodyne	STAT6	53	33
COc1ccc2c(COC(=O)c3cc(SC)ccc3C)cc(=O)oc2c1	ZINC000875311035	FI	On-Demand	Anodyne	MAOA	52	41
COc1ccc2c(COC(=O)c3cc(SC)ccc3C)cc(=O)oc2c1	ZINC000875311035	FI	On-Demand	Anodyne	MAOB	46	42
O=C(N[C@@H](CCCO)c1ccccc1)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875311043	GG	On-Demand	Anodyne	KCNQ2	41	36
O=C(N[C@@H](CCCO)c1ccccc1)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875311043	GG	On-Demand	Anodyne	NPY2R	104	39
O=C(N[C@H](CCCO)c1ccccc1)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875311044	GG	On-Demand	Anodyne	KCNQ2	41	36
O=C(N[C@H](CCCO)c1ccccc1)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875311044	GG	On-Demand	Anodyne	NPY2R	104	39
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1=O	ZINC000875311059	GD	On-Demand	Anodyne	HTR1A	66	43
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1=O	ZINC000875311059	GD	On-Demand	Anodyne	DRD2	50	44
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1=O	ZINC000875311059	GD	On-Demand	Anodyne	DRD4	34	40
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1=O	ZINC000875311059	GD	On-Demand	Anodyne	ADRA1D	46	38
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1=O	ZINC000875311059	GD	On-Demand	Anodyne	HTR2A	17	42
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1=O	ZINC000875311059	GD	On-Demand	Anodyne	ADRA1A	44	38
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1=O	ZINC000875311059	GD	On-Demand	Anodyne	DRD3	62	40
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(c2ccccc2OC)C1=O	ZINC000875311059	GD	On-Demand	Anodyne	HTR7	42	37
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O	ZINC000875311061	GD	On-Demand	Anodyne	HTR1A	66	43
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O	ZINC000875311061	GD	On-Demand	Anodyne	DRD2	50	44
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O	ZINC000875311061	GD	On-Demand	Anodyne	DRD4	34	40
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O	ZINC000875311061	GD	On-Demand	Anodyne	ADRA1D	46	38
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O	ZINC000875311061	GD	On-Demand	Anodyne	HTR2A	17	42
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O	ZINC000875311061	GD	On-Demand	Anodyne	ADRA1A	44	38
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O	ZINC000875311061	GD	On-Demand	Anodyne	DRD3	62	40
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O	ZINC000875311061	GD	On-Demand	Anodyne	HTR7	42	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC(=O)N[C@H](CCCO)c2ccccc2)C1	ZINC000875311068	GG	On-Demand	Anodyne	FPR1	40	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](CNC(=O)N[C@@H](CCCO)c2ccccc2)C1	ZINC000875311069	GG	On-Demand	Anodyne	FPR1	40	35
CC(C)(C)OC(=O)NC1CC(CNC(=O)N[C@@H](CCCO)c2ccccc2)C1	ZINC000875311070	GG	On-Demand	Anodyne	FPR1	40	35
CC(C)(C)OC(=O)NC1CC(CNC(=O)N[C@H](CCCO)c2ccccc2)C1	ZINC000875311071	GG	On-Demand	Anodyne	FPR1	40	35
CC(C)(C)OC(=O)CCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875311083	EF	On-Demand	Anodyne	F2	26	40
CC(C)(C)OC(=O)CCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875311083	EF	On-Demand	Anodyne	FKBP1A	27	41
CC(C)(C)OC(=O)CCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875311084	EF	On-Demand	Anodyne	F2	26	40
CC(C)(C)OC(=O)CCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875311084	EF	On-Demand	Anodyne	FKBP1A	27	41
CC(C)(C)OC(=O)CCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875311085	EF	On-Demand	Anodyne	F2	26	40
CC(C)(C)OC(=O)CCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875311085	EF	On-Demand	Anodyne	FKBP1A	27	41
CC(C)(C)OC(=O)CCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875311086	EF	On-Demand	Anodyne	F2	26	40
CC(C)(C)OC(=O)CCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875311086	EF	On-Demand	Anodyne	FKBP1A	27	41
Cc1cc(F)ccc1CCNC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875311092	ED	On-Demand	Anodyne	TACR1	21	41
Cc1cc(F)ccc1CCNC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875311093	ED	On-Demand	Anodyne	TACR1	21	41
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCC(=O)N1	ZINC000875311119	FE	On-Demand	Anodyne	ACE	46	38
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCC(=O)N1	ZINC000875311119	FE	On-Demand	Anodyne	OPRM1	45	42
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCC(=O)N1	ZINC000875311119	FE	On-Demand	Anodyne	OPRD1	46	42
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCC(=O)N1	ZINC000875311119	FE	On-Demand	Anodyne	MME	129	43
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCC(=O)N1	ZINC000875311119	FE	On-Demand	Anodyne	ANPEP	61	34
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCC(=O)N1	ZINC000875311119	FE	On-Demand	Anodyne	FCER2	78	37
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCC(=O)N1	ZINC000875311119	FE	On-Demand	Anodyne	PAPA1_CARPA	46	38
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCC(=O)N1	ZINC000875311119	FE	On-Demand	Anodyne	CYSP_TRYCR	40	33
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCC(=O)N1	ZINC000875311119	FE	On-Demand	Anodyne	TIMP3	112	52
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCC(=O)N1	ZINC000875311119	FE	On-Demand	Anodyne	HDAC8	24	42
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCC(=O)N1	ZINC000875311119	FE	On-Demand	Anodyne	CAPNS1	55	31
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCC(=O)N1	ZINC000875311119	FE	On-Demand	Anodyne	MMP2	26	40
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCC(=O)N1	ZINC000875311119	FE	On-Demand	Anodyne	MMP3	51	40
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCC(=O)N1	ZINC000875311119	FE	On-Demand	Anodyne	MMP8	19	40
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCC(=O)N1	ZINC000875311119	FE	On-Demand	Anodyne	ECE1	43	38
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCC(=O)N1	ZINC000875311119	FE	On-Demand	Anodyne	HLA-DRB1	44	33
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCC(=O)N1	ZINC000875311119	FE	On-Demand	Anodyne	MMP9	27	52
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCC(=O)N1	ZINC000875311119	FE	On-Demand	Anodyne	ACE2	63	36
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCC(=O)N1	ZINC000875311119	FE	On-Demand	Anodyne	HDAC11	53	38
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCC(=O)N1	ZINC000875311119	FE	On-Demand	Anodyne	MMP1	41	47
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCC(=O)N1	ZINC000875311119	FE	On-Demand	Anodyne	FPR1	67	43
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCC(=O)N1	ZINC000875311119	FE	On-Demand	Anodyne	PSMB8	60	33
C[C@@]1(C(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)CCC(=O)N1	ZINC000875311119	FE	On-Demand	Anodyne	GPR142	61	34
CC(C)(C)OC(=O)CCNC(=O)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875311120	ED	On-Demand	Anodyne	MLYCD	17	40
CC(C)(C)OC(=O)CCNC(=O)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875311121	ED	On-Demand	Anodyne	MLYCD	17	40
COc1cccc(Oc2ncccc2CNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875311151	GG	On-Demand	Anodyne	DRD4	40	30
COc1cccc(Oc2ncccc2CNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875311151	GG	On-Demand	Anodyne	CALCRL	22	40
COc1cccc(Oc2ncccc2CNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875311152	GG	On-Demand	Anodyne	DRD4	40	30
COc1cccc(Oc2ncccc2CNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875311152	GG	On-Demand	Anodyne	CALCRL	22	40
COc1cccc(Oc2ncccc2CNC(=O)N2CCC(C(C)=O)CC2)c1	ZINC000875311173	GG	On-Demand	Anodyne	DRD4	40	31
COc1cccc(Oc2ncccc2CNC(=O)N2CCC(C(C)=O)CC2)c1	ZINC000875311173	GG	On-Demand	Anodyne	EPHX2	18	44
COc1cccc(Oc2ncccc2CNC(=O)N(C)OCC(F)(F)F)c1	ZINC000875311177	GH	On-Demand	Anodyne	P2RY1	28	45
N#CCc1ccsc1C(=O)N1CCC[C@H]1C(=O)OCc1ccccc1	ZINC000875311209	FG	On-Demand	Mild	ACE	25	40
N#CCc1ccsc1C(=O)N1CCC[C@H]1C(=O)OCc1ccccc1	ZINC000875311209	FG	On-Demand	Mild	FKBP1A	76	48
N#CCc1ccsc1C(=O)N1CCC[C@H]1C(=O)OCc1ccccc1	ZINC000875311209	FG	On-Demand	Mild	CELA1	21	45
N#CCc1ccsc1C(=O)N1CCC[C@H]1C(=O)OCc1ccccc1	ZINC000875311209	FG	On-Demand	Mild	PREP	106	48
N#CCc1ccsc1C(=O)N1CCC[C@H]1C(=O)OCc1ccccc1	ZINC000875311209	FG	On-Demand	Mild	LGMN	79	46
N#CCc1ccsc1C(=O)N1CCC[C@H]1C(=O)OCc1ccccc1	ZINC000875311209	FG	On-Demand	Mild	KLK5	24	45
N#CCc1ccsc1C(=O)N1CCC[C@H]1C(=O)OCc1ccccc1	ZINC000875311209	FG	On-Demand	Mild	SLC12A5	50	34
N#CCc1ccsc1C(=O)N1CCC[C@@H]1C(=O)OCc1ccccc1	ZINC000875311210	FG	On-Demand	Mild	ACE	25	40
N#CCc1ccsc1C(=O)N1CCC[C@@H]1C(=O)OCc1ccccc1	ZINC000875311210	FG	On-Demand	Mild	FKBP1A	76	48
N#CCc1ccsc1C(=O)N1CCC[C@@H]1C(=O)OCc1ccccc1	ZINC000875311210	FG	On-Demand	Mild	CELA1	21	45
N#CCc1ccsc1C(=O)N1CCC[C@@H]1C(=O)OCc1ccccc1	ZINC000875311210	FG	On-Demand	Mild	PREP	106	48
N#CCc1ccsc1C(=O)N1CCC[C@@H]1C(=O)OCc1ccccc1	ZINC000875311210	FG	On-Demand	Mild	LGMN	79	46
N#CCc1ccsc1C(=O)N1CCC[C@@H]1C(=O)OCc1ccccc1	ZINC000875311210	FG	On-Demand	Mild	KLK5	24	45
N#CCc1ccsc1C(=O)N1CCC[C@@H]1C(=O)OCc1ccccc1	ZINC000875311210	FG	On-Demand	Mild	SLC12A5	50	34
CSc1ccc(C)c(C(=O)OCC(=O)Nc2ccc(S(=O)(=O)N3C[C@H](C)O[C@H](C)C3)cc2)c1	ZINC000875311221	JG	On-Demand	Anodyne	TGM2	43	38
CSc1ccc(C)c(C(=O)OCC(=O)Nc2ccc(S(=O)(=O)N3C[C@H](C)O[C@H](C)C3)cc2)c1	ZINC000875311221	JG	On-Demand	Anodyne	F13A1	64	38
CSc1ccc(C)c(C(=O)OCC(=O)Nc2ccc(S(=O)(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)c1	ZINC000875311222	JG	On-Demand	Anodyne	TGM2	43	38
CSc1ccc(C)c(C(=O)OCC(=O)Nc2ccc(S(=O)(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)c1	ZINC000875311222	JG	On-Demand	Anodyne	F13A1	64	38
CSc1ccc(C)c(C(=O)OCC(=O)Nc2ccc(S(=O)(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)c1	ZINC000875311223	JG	On-Demand	Anodyne	TGM2	43	38
CSc1ccc(C)c(C(=O)OCC(=O)Nc2ccc(S(=O)(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)c1	ZINC000875311223	JG	On-Demand	Anodyne	F13A1	64	38
Cc1cccc([C@@H](C)CNC(=O)N2CCC(C(=O)NCCO)CC2)c1	ZINC000875311277	ED	On-Demand	Anodyne	EPHX2	30	44
C[C@@H](O)CC(C)(C)CNC(=O)NCC1(c2ccccc2)CCN(C)CC1	ZINC000875311313	FF	On-Demand	Anodyne	KCNA3	51	39
C[C@@H](O)CC(C)(C)CNC(=O)NCC1(c2ccccc2)CCN(C)CC1	ZINC000875311313	FF	On-Demand	Anodyne	SOAT1	17	46
C[C@@H](O)CC(C)(C)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875311329	GF	On-Demand	Anodyne	FKBP1A	21	46
C[C@@H](O)CC(C)(C)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875311329	GF	On-Demand	Anodyne	DRD4	16	40
C[C@@H](O)CC(C)(C)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875311329	GF	On-Demand	Anodyne	GHRHR	48	34
C[C@@H](O)CC(C)(C)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875311329	GF	On-Demand	Anodyne	SIGMAR1	17	41
C[C@@H](O)CC(C)(C)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875311329	GF	On-Demand	Anodyne	CTSB	53	50
C[C@@H](O)CC(C)(C)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875311329	GF	On-Demand	Anodyne	PAPA1_CARPA	44	33
C[C@@H](O)CC(C)(C)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875311329	GF	On-Demand	Anodyne	CYSP_TRYCR	49	36
C[C@@H](O)CC(C)(C)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875311329	GF	On-Demand	Anodyne	CTSK	37	50
C[C@@H](O)CC(C)(C)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875311329	GF	On-Demand	Anodyne	CTSL	42	50
C[C@@H](O)CC(C)(C)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875311329	GF	On-Demand	Anodyne	PREP	20	42
C[C@@H](O)CC(C)(C)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875311329	GF	On-Demand	Anodyne	CAPNS1	58	34
C[C@@H](O)CC(C)(C)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875311329	GF	On-Demand	Anodyne	CTSS	24	42
C[C@@H](O)CC(C)(C)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875311329	GF	On-Demand	Anodyne	CAPN1	73	38
C[C@@H](O)CC(C)(C)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875311329	GF	On-Demand	Anodyne	CAPN2	123	36
C[C@@H](O)CC(C)(C)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875311329	GF	On-Demand	Anodyne	EPHX2	47	40
C[C@@H](O)CC(C)(C)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875311329	GF	On-Demand	Anodyne	TGM2	38	43
C[C@@H](O)CC(C)(C)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875311329	GF	On-Demand	Anodyne	NPR	62	38
C[C@@H](O)CC(C)(C)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875311329	GF	On-Demand	Anodyne	F13A1	23	43
C[C@@H](O)CC(C)(C)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875311329	GF	On-Demand	Anodyne	NAAA	46	34
C[C@@H](O)CC(C)(C)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875311329	GF	On-Demand	Anodyne	BIRC2	27	42
C[C@@H](O)CC(C)(C)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875311329	GF	On-Demand	Anodyne	Q6PRC7_IXORI	44	34
COc1ccccc1[C@@H]1CCCN(C(=O)NCC[S@](C)=O)CC1	ZINC000875311370	EE	On-Demand	Anodyne	DRD2	31	46
COc1ccccc1[C@@H]1CCCN(C(=O)NCC[S@](C)=O)CC1	ZINC000875311370	EE	On-Demand	Anodyne	DRD4	20	45
COc1ccccc1[C@@H]1CCCN(C(=O)NCC[S@](C)=O)CC1	ZINC000875311370	EE	On-Demand	Anodyne	RBP4	29	40
COc1ccccc1[C@H]1CCCN(C(=O)NCC[S@@](C)=O)CC1	ZINC000875311371	EE	On-Demand	Anodyne	DRD2	31	46
COc1ccccc1[C@H]1CCCN(C(=O)NCC[S@@](C)=O)CC1	ZINC000875311371	EE	On-Demand	Anodyne	DRD4	20	45
COc1ccccc1[C@H]1CCCN(C(=O)NCC[S@@](C)=O)CC1	ZINC000875311371	EE	On-Demand	Anodyne	RBP4	29	40
COc1ccccc1[C@H]1CCCN(C(=O)NCC[S@](C)=O)CC1	ZINC000875311372	EE	On-Demand	Anodyne	DRD2	31	46
COc1ccccc1[C@H]1CCCN(C(=O)NCC[S@](C)=O)CC1	ZINC000875311372	EE	On-Demand	Anodyne	DRD4	20	45
COc1ccccc1[C@H]1CCCN(C(=O)NCC[S@](C)=O)CC1	ZINC000875311372	EE	On-Demand	Anodyne	RBP4	29	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCC[S@@](C)=O)CC1	ZINC000875311373	EE	On-Demand	Anodyne	DRD2	31	46
COc1ccccc1[C@@H]1CCCN(C(=O)NCC[S@@](C)=O)CC1	ZINC000875311373	EE	On-Demand	Anodyne	DRD4	20	45
COc1ccccc1[C@@H]1CCCN(C(=O)NCC[S@@](C)=O)CC1	ZINC000875311373	EE	On-Demand	Anodyne	RBP4	29	40
C[S@@](=O)CCNC(=O)NCCc1cccc2c1OC(F)(F)O2	ZINC000875311418	ED	On-Demand	Anodyne	MTNR1A	19	41
C[C@H](NC(=O)NCC(C)(C)C[C@@H](C)O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875311435	GG	On-Demand	Anodyne	GPR119	29	44
C[C@@H](O)CC(C)(C)CNC(=O)N[C@H](C)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875311437	GG	On-Demand	Anodyne	GPR119	29	44
O=C(NCc1ccc(N2CCCS2(=O)=O)cc1)C(=O)N[C@H]1CC12CCC2	ZINC000875311457	GC	On-Demand	Anodyne	CDK1	17	40
O=C(NCc1ccc(N2CCCS2(=O)=O)cc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875311458	GC	On-Demand	Anodyne	CDK1	17	40
C[S@@](=O)CCNC(=O)N1c2ccccc2C[C@@H]1Cc1ccccc1	ZINC000875311463	EF	On-Demand	Anodyne	TPP2	56	38
C[S@@](=O)CCNC(=O)N1c2ccccc2C[C@H]1Cc1ccccc1	ZINC000875311464	EF	On-Demand	Anodyne	TPP2	56	38
C[C@@H](O)CC(C)(C)CNC(=O)N1CCC(c2nnnn2C)CC1	ZINC000875311489	DC	On-Demand	Anodyne	IL2RA	40	33
C[C@@H](O)CC(C)(C)CNC(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875311538	FF	On-Demand	Anodyne	MC4R	41	39
C[C@@H](O)CC(C)(C)CNC(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875311538	FF	On-Demand	Anodyne	NPY2R	79	39
C[C@@H](O)CC(C)(C)CNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875311577	FG	On-Demand	Anodyne	OPRL1	16	43
C[C@@H](NC(=O)NCC[S@@](C)=O)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000875311635	FF	On-Demand	Anodyne	PRCP	28	51
C[C@@H](NC(=O)NCC[S@](C)=O)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000875311638	FF	On-Demand	Anodyne	PRCP	28	51
C[S@@](=O)CCNC(=O)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875311648	FD	On-Demand	Anodyne	ABL1	15	46
C[C@@H](O)CC(C)(C)CNC(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875311676	EG	On-Demand	Anodyne	GHRHR	79	43
C[C@@H](O)CC(C)(C)CNC(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875311678	EG	On-Demand	Anodyne	GHRHR	79	43
C[S@@](=O)CCNC(=O)NCC[C@@H](O)COCc1ccccc1	ZINC000875311759	EC	On-Demand	Anodyne	CAPN2	52	35
C[S@@](=O)CCNC(=O)NCC[C@@H](O)COCc1ccccc1	ZINC000875311759	EC	On-Demand	Anodyne	NPR	40	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCC(C)(C)C[C@H](C)O)CC2	ZINC000875311761	FG	On-Demand	Anodyne	SLC18A2	52	41
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCC(C)(C)C[C@@H](C)O)CC2	ZINC000875311762	FG	On-Demand	Anodyne	SLC18A2	52	41
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCC(C)(C)C[C@H](C)O)CC2	ZINC000875311763	FG	On-Demand	Anodyne	SLC18A2	52	41
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCC(C)(C)C[C@@H](C)O)CC2	ZINC000875311764	FG	On-Demand	Anodyne	SLC18A2	52	41
C[S@@](=O)CCNC(=O)N(Cc1cccc(O)c1)[C@@H]1CC[C@@H](O)CC1	ZINC000875311805	FD	On-Demand	Anodyne	HSD17B2	20	40
C[C@@H](O)CC(C)(C)CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875311816	FG	On-Demand	Mild	CTSF	66	35
C[C@@H](O)CC(C)(C)CNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875311818	FG	On-Demand	Mild	CTSF	66	35
CCCCCCCNC(=O)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000875311882	GD	On-Demand	Mild	CDK1	17	42
CCCCCCCNC(=O)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000875311882	GD	On-Demand	Mild	ASAH1	60	32
C[S@@](=O)CCNC(=O)NC(C)(C)c1ccc2ccccc2c1	ZINC000875311891	DF	On-Demand	Anodyne	IMDH_CRYPV	48	44
CCOC(=O)[C@@H]1CCCN(C(=O)COC(=O)c2sc3cccc(C)c3c2Cl)C1	ZINC000875311902	HH	On-Demand	Anodyne	FDFT1	15	41
COc1ccc(N2CCN(C(=O)NCC(C)(C)C[C@H](C)O)CC2)c(OC)c1	ZINC000875311936	GE	On-Demand	Clean	HTR1A	34	41
COc1ccc(N2CCN(C(=O)NCC(C)(C)C[C@H](C)O)CC2)c(OC)c1	ZINC000875311936	GE	On-Demand	Clean	DRD2	29	40
COc1ccc(N2CCN(C(=O)NCC(C)(C)C[C@H](C)O)CC2)c(OC)c1	ZINC000875311936	GE	On-Demand	Clean	DRD4	43	34
COc1ccc(N2CCN(C(=O)NCC(C)(C)C[C@H](C)O)CC2)c(OC)c1	ZINC000875311936	GE	On-Demand	Clean	HTR1B	15	41
COc1ccc(N2CCN(C(=O)NCC(C)(C)C[C@H](C)O)CC2)c(OC)c1	ZINC000875311936	GE	On-Demand	Clean	DRD3	43	41
COc1ccc(N2CCN(C(=O)NCC(C)(C)C[C@@H](C)O)CC2)c(OC)c1	ZINC000875311937	GE	On-Demand	Clean	HTR1A	34	41
COc1ccc(N2CCN(C(=O)NCC(C)(C)C[C@@H](C)O)CC2)c(OC)c1	ZINC000875311937	GE	On-Demand	Clean	DRD2	29	40
COc1ccc(N2CCN(C(=O)NCC(C)(C)C[C@@H](C)O)CC2)c(OC)c1	ZINC000875311937	GE	On-Demand	Clean	DRD4	43	34
COc1ccc(N2CCN(C(=O)NCC(C)(C)C[C@@H](C)O)CC2)c(OC)c1	ZINC000875311937	GE	On-Demand	Clean	HTR1B	15	41
COc1ccc(N2CCN(C(=O)NCC(C)(C)C[C@@H](C)O)CC2)c(OC)c1	ZINC000875311937	GE	On-Demand	Clean	DRD3	43	41
C[C@@H](O)CC(C)(C)CNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875311976	EE	On-Demand	Anodyne	PDS	42	36
C[C@@H](O)CC(C)(C)CNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875311977	EE	On-Demand	Anodyne	PDS	42	36
C[S@@](=O)CCNC(=O)N1CCC[C@@]1(C)Cc1ccc(F)c(F)c1	ZINC000875312109	EE	On-Demand	Anodyne	SLC12A5	57	39
C[S@@](=O)CCNC(=O)N1CCC[C@]1(C)Cc1ccc(F)c(F)c1	ZINC000875312110	EE	On-Demand	Anodyne	SLC12A5	57	39
C[S@@](=O)CCNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875312137	ED	On-Demand	Mild	ITK	17	52
C[S@@](=O)CCNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875312137	ED	On-Demand	Mild	PANC	49	35
C[C@@H](O)CC(C)(C)CNC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875312145	FG	On-Demand	Anodyne	SMO	39	46
C[C@@H](O)CC(C)(C)CNC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875312145	FG	On-Demand	Anodyne	ETHR	66	52
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccnc(OC(C)C)c2)C1	ZINC000875312178	ED	On-Demand	Anodyne	HCRTR1	18	42
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccnc(OC(C)C)c2)C1	ZINC000875312178	ED	On-Demand	Anodyne	HCRTR2	32	42
CN(CCNC(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1)CC(F)(F)F	ZINC000875312225	GG	On-Demand	Anodyne	DRD4	40	30
O=C(NCCc1cnc(C2CC2)nc1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875312233	GD	On-Demand	Anodyne	PREP	41	32
O=C(NCCc1cnc(C2CC2)nc1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875312234	GD	On-Demand	Anodyne	PREP	41	32
O=C(NCCc1cnc(C2CC2)nc1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875312235	GD	On-Demand	Anodyne	PREP	41	32
O=C(NCCc1cnc(C2CC2)nc1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875312236	GD	On-Demand	Anodyne	PREP	41	32
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](C)Cc1cccs1	ZINC000875312245	CF	On-Demand	Anodyne	CTSC	38	41
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](C)Cc1cccs1	ZINC000875312247	CF	On-Demand	Anodyne	CTSC	38	41
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)c1sc2cccc(C)c2c1Cl	ZINC000875312317	IJ	On-Demand	Bother	KCNMA1	19	43
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)c1sc2cccc(C)c2c1Cl	ZINC000875312318	IJ	On-Demand	Bother	KCNMA1	19	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCC(C)(C)C[C@H](C)O)CC1	ZINC000875312363	FH	On-Demand	Anodyne	RBP4	31	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCC(C)(C)C[C@@H](C)O)CC1	ZINC000875312364	FH	On-Demand	Anodyne	RBP4	31	42
COc1ccccc1[C@H]1CCCN(C(=O)NCC(C)(C)C[C@H](C)O)CC1	ZINC000875312365	FH	On-Demand	Anodyne	RBP4	31	42
COc1ccccc1[C@H]1CCCN(C(=O)NCC(C)(C)C[C@@H](C)O)CC1	ZINC000875312366	FH	On-Demand	Anodyne	RBP4	31	42
C[C@@H](CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F)CN1CCN(C)CC1	ZINC000875312442	GE	On-Demand	Mild	MCHR1	23	41
COc1ccc([C@@H]2CCCN2C(=O)COC(=O)c2sc3cccc(C)c3c2Cl)cc1OC	ZINC000875312461	JK	On-Demand	Anodyne	CPT1A	64	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)Cc1cccs1	ZINC000875312482	EF	On-Demand	Anodyne	SLC6A3	42	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)Cc1cccs1	ZINC000875312483	EF	On-Demand	Anodyne	SLC6A3	42	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)Cc1cccs1	ZINC000875312484	EF	On-Demand	Anodyne	SLC6A3	42	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)Cc1cccs1	ZINC000875312485	EF	On-Demand	Anodyne	SLC6A3	42	43
CC(=O)Nc1ccccc1CNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875312506	ED	On-Demand	Anodyne	CCR3	22	44
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)C(=O)N[C@H]1CC12CCC2	ZINC000875312562	GC	On-Demand	Anodyne	CDK1	17	42
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)C(=O)N[C@@H]1CC12CCC2	ZINC000875312563	GC	On-Demand	Anodyne	CDK1	17	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)CN(C)Cc2ccccc2)C1	ZINC000875312598	FD	On-Demand	Anodyne	DPP7	42	39
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)CN(C)Cc2ccccc2)C1	ZINC000875312599	FD	On-Demand	Anodyne	DPP7	42	39
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)CN(C)Cc2ccccc2)C1	ZINC000875312600	FD	On-Demand	Anodyne	DPP7	42	39
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)CN(C)Cc2ccccc2)C1	ZINC000875312601	FD	On-Demand	Anodyne	DPP7	42	39
CC(C)[C@H]1CN(Cc2ccccc2)CCN1C(=O)NCC[S@@](C)=O	ZINC000875312602	FD	On-Demand	Anodyne	DRD2	15	40
CC(C)[C@H]1CN(Cc2ccccc2)CCN1C(=O)NCC[S@@](C)=O	ZINC000875312602	FD	On-Demand	Anodyne	DRD4	34	40
CC(C)[C@H]1CN(Cc2ccccc2)CCN1C(=O)NCC[S@@](C)=O	ZINC000875312602	FD	On-Demand	Anodyne	HTR4	15	40
CC(C)[C@H]1CN(Cc2ccccc2)CCN1C(=O)NCC[S@@](C)=O	ZINC000875312602	FD	On-Demand	Anodyne	SIGMAR1	35	40
CC(C)[C@H]1CN(Cc2ccccc2)CCN1C(=O)NCC[S@](C)=O	ZINC000875312603	FD	On-Demand	Anodyne	DRD2	15	40
CC(C)[C@H]1CN(Cc2ccccc2)CCN1C(=O)NCC[S@](C)=O	ZINC000875312603	FD	On-Demand	Anodyne	DRD4	34	40
CC(C)[C@H]1CN(Cc2ccccc2)CCN1C(=O)NCC[S@](C)=O	ZINC000875312603	FD	On-Demand	Anodyne	HTR4	15	40
CC(C)[C@H]1CN(Cc2ccccc2)CCN1C(=O)NCC[S@](C)=O	ZINC000875312603	FD	On-Demand	Anodyne	SIGMAR1	35	40
COC(=O)N(C)NC(=O)NC[C@H](C)Cc1cccs1	ZINC000875312697	CD	On-Demand	Reactive	CTSC	31	42
COC(=O)N(C)NC(=O)NC[C@@H](C)Cc1cccs1	ZINC000875312698	CD	On-Demand	Reactive	CTSC	31	42
O=C(NCCCCC1CC1)C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000875312726	GD	On-Demand	Anodyne	CDK1	16	40
CCCCCCCNC(=O)C(=O)NCc1ccc(N2CCCS2(=O)=O)cc1	ZINC000875312729	GD	On-Demand	Mild	CDK1	17	40
CCCCCCCNC(=O)C(=O)NCc1ccc(N2CCCS2(=O)=O)cc1	ZINC000875312729	GD	On-Demand	Mild	ASAH1	79	34
C[S@@](=O)CCNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875312798	ED	On-Demand	Anodyne	OPRL1	17	46
C[C@@H](O)CC(C)(C)CNC(=O)NCc1ccc(O)c(Cl)c1	ZINC000875312811	DF	On-Demand	Anodyne	NCE103	16	47
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1NC(C)=O	ZINC000875312896	ED	On-Demand	Anodyne	SLC6A3	52	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1NC(C)=O	ZINC000875312897	ED	On-Demand	Anodyne	SLC6A3	52	40
CC(=O)C1CCN(C(=O)C(=O)NCC(C)(C)c2ccc(C(F)(F)F)cc2)CC1	ZINC000875312939	GF	On-Demand	Anodyne	EPHX2	25	42
CC(=O)C1CCN(C(=O)C(=O)NCC(C)(C)c2ccc(C(F)(F)F)cc2)CC1	ZINC000875312939	GF	On-Demand	Anodyne	MCHR1	15	40
CC(=O)C1CCN(C(=O)C(=O)NCC(C)(C)c2ccc(C(F)(F)F)cc2)CC1	ZINC000875312939	GF	On-Demand	Anodyne	SFRP1	43	35
CCCCCCCNC(=O)C(=O)NCc1ccnc(N(C)C)n1	ZINC000875312985	DD	On-Demand	Mild	ASAH1	77	36
CC(=O)Nc1ccccc1CNC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875313031	DD	On-Demand	Anodyne	EPHX2	21	44
CC(=O)Nc1ccccc1CNC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875313032	DD	On-Demand	Anodyne	EPHX2	21	44
C[C@@H](CNC(=O)N1CCC(CO)(CO)CC1)Cc1cccs1	ZINC000875313147	ED	On-Demand	Anodyne	CTSC	27	40
C[C@H](CNC(=O)N1CCC(CO)(CO)CC1)Cc1cccs1	ZINC000875313148	ED	On-Demand	Anodyne	CTSC	27	40
CN1CC[C@@H](C(=O)OCC(=O)Nc2ccccc2)[C@@H](c2cnn(C)c2)C1	ZINC000875313153	FD	On-Demand	Anodyne	SLC6A3	16	44
CN1CC[C@@H](C(=O)OCC(=O)Nc2ccccc2)[C@H](c2cnn(C)c2)C1	ZINC000875313155	FD	On-Demand	Anodyne	SLC6A3	16	44
CC(=O)Nc1ccccc1CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875313183	GG	On-Demand	Anodyne	KCNQ2	59	38
CC(=O)Nc1ccccc1CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875313184	GG	On-Demand	Anodyne	KCNQ2	59	38
CC(=O)Nc1ccccc1CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875313185	GG	On-Demand	Anodyne	KCNQ2	59	38
CC(=O)Nc1ccccc1CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875313186	GG	On-Demand	Anodyne	KCNQ2	59	38
CN1CCN(C2CCN(C(=O)N[C@@H]3CC[C@H]4CCC[C@H]4C3)CC2)CC1	ZINC000875313219	EE	On-Demand	Anodyne	L3MBTL3	74	44
CN1CCN(C2CCN(C(=O)N[C@@H]3CC[C@H]4CCC[C@@H]4C3)CC2)CC1	ZINC000875313220	EE	On-Demand	Anodyne	L3MBTL3	74	44
CN1CCN(C2CCN(C(=O)N[C@@H]3CC[C@@H]4CCC[C@H]4C3)CC2)CC1	ZINC000875313221	EE	On-Demand	Anodyne	L3MBTL3	74	44
CN1CCN(C2CCN(C(=O)N[C@@H]3CC[C@@H]4CCC[C@@H]4C3)CC2)CC1	ZINC000875313222	EE	On-Demand	Anodyne	L3MBTL3	74	44
O=C(N[C@H]1CCc2c(O)cccc21)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875313269	GH	On-Demand	Anodyne	SMO	43	45
O=C(N[C@H]1CCc2c(O)cccc21)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875313269	GH	On-Demand	Anodyne	ETHR	65	44
O=C(N[C@@H]1CCc2c(O)cccc21)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875313272	GH	On-Demand	Anodyne	SMO	43	45
O=C(N[C@@H]1CCc2c(O)cccc21)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875313272	GH	On-Demand	Anodyne	ETHR	65	44
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(c2cccc(Cl)c2)C1	ZINC000875313315	GE	On-Demand	Anodyne	HTR1A	15	41
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(c2cccc(Cl)c2)C1	ZINC000875313315	GE	On-Demand	Anodyne	DRD2	19	44
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(c2cccc(Cl)c2)C1	ZINC000875313315	GE	On-Demand	Anodyne	DRD4	40	33
COCC(C)(C)CCNC(=O)C(=O)N[C@H]1CCN(c2cccc(Cl)c2)C1	ZINC000875313315	GE	On-Demand	Anodyne	DRD3	27	44
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(c2cccc(Cl)c2)C1	ZINC000875313316	GE	On-Demand	Anodyne	HTR1A	15	41
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(c2cccc(Cl)c2)C1	ZINC000875313316	GE	On-Demand	Anodyne	DRD2	19	44
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(c2cccc(Cl)c2)C1	ZINC000875313316	GE	On-Demand	Anodyne	DRD4	40	33
COCC(C)(C)CCNC(=O)C(=O)N[C@@H]1CCN(c2cccc(Cl)c2)C1	ZINC000875313316	GE	On-Demand	Anodyne	DRD3	27	44
Cn1nc(Cl)c(C(=O)N2CCCc3ccc([N+](=O)[O-])cc32)c1Cl	ZINC000875313337	FG	On-Demand	Bother	AVPR2	17	44
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccccc2NC(C)=O)CC1	ZINC000875313473	GI	On-Demand	Anodyne	TSHR	41	30
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccccc2NC(C)=O)CC1	ZINC000875313473	GI	On-Demand	Anodyne	EPHX2	17	46
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccccc2NC(C)=O)CC1	ZINC000875313473	GI	On-Demand	Anodyne	RBP4	31	42
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccccc2NC(C)=O)CC1	ZINC000875313474	GI	On-Demand	Anodyne	TSHR	41	30
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccccc2NC(C)=O)CC1	ZINC000875313474	GI	On-Demand	Anodyne	EPHX2	17	46
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccccc2NC(C)=O)CC1	ZINC000875313474	GI	On-Demand	Anodyne	RBP4	31	42
CCN(C)C(=O)CNC(=O)C(=O)N(C)C[C@H]1CCCCN1Cc1ccccc1	ZINC000875313515	GD	On-Demand	Anodyne	SIGMAR1	17	44
CN(C)C[C@@H]1CN(C(=O)N[C@H](CC2CC2)c2ccccc2)C[C@H]1CN(C)C	ZINC000875313520	FF	On-Demand	Anodyne	UTS2	48	36
CN(C)C[C@@H]1CN(C(=O)N[C@@H](CC2CC2)c2ccccc2)C[C@H]1CN(C)C	ZINC000875313521	FF	On-Demand	Anodyne	UTS2	48	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CC2CC2)c2ccccc2)C1	ZINC000875313532	EG	On-Demand	Anodyne	ACE	23	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CC2CC2)c2ccccc2)C1	ZINC000875313532	EG	On-Demand	Anodyne	REN	36	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](CC2CC2)c2ccccc2)C1	ZINC000875313532	EG	On-Demand	Anodyne	Q6PRC7_IXORI	43	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CC2CC2)c2ccccc2)C1	ZINC000875313534	EG	On-Demand	Anodyne	ACE	23	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CC2CC2)c2ccccc2)C1	ZINC000875313534	EG	On-Demand	Anodyne	REN	36	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](CC2CC2)c2ccccc2)C1	ZINC000875313534	EG	On-Demand	Anodyne	Q6PRC7_IXORI	43	35
Cn1nnnc1C1CCN(C(=O)N[C@@H](CC2CC2)c2ccccc2)CC1	ZINC000875313542	FF	On-Demand	Anodyne	CCR5	23	40
Cn1nnnc1C1CCN(C(=O)N[C@H](CC2CC2)c2ccccc2)CC1	ZINC000875313543	FF	On-Demand	Anodyne	CCR5	23	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](CC2CC2)c2ccccc2)C1	ZINC000875313548	DH	On-Demand	Anodyne	SLC6A1	97	39
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](CC2CC2)c2ccccc2)C1	ZINC000875313548	DH	On-Demand	Anodyne	CCR5	39	48
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](CC2CC2)c2ccccc2)C1	ZINC000875313548	DH	On-Demand	Anodyne	REN	30	45
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](CC2CC2)c2ccccc2)C1	ZINC000875313548	DH	On-Demand	Anodyne	BIRC2	28	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](CC2CC2)c2ccccc2)C1	ZINC000875313550	DH	On-Demand	Anodyne	SLC6A1	97	39
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](CC2CC2)c2ccccc2)C1	ZINC000875313550	DH	On-Demand	Anodyne	CCR5	39	48
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](CC2CC2)c2ccccc2)C1	ZINC000875313550	DH	On-Demand	Anodyne	REN	30	45
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](CC2CC2)c2ccccc2)C1	ZINC000875313550	DH	On-Demand	Anodyne	BIRC2	28	40
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](CC2CC2)c2ccccc2)C1	ZINC000875313552	DH	On-Demand	Anodyne	SLC6A1	97	39
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](CC2CC2)c2ccccc2)C1	ZINC000875313552	DH	On-Demand	Anodyne	CCR5	39	48
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](CC2CC2)c2ccccc2)C1	ZINC000875313552	DH	On-Demand	Anodyne	REN	30	45
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](CC2CC2)c2ccccc2)C1	ZINC000875313552	DH	On-Demand	Anodyne	BIRC2	28	40
CC(=O)[C@H]1CCCN(C(=O)N[C@H](CC2CC2)c2ccccc2)C1	ZINC000875313553	DH	On-Demand	Anodyne	SLC6A1	97	39
CC(=O)[C@H]1CCCN(C(=O)N[C@H](CC2CC2)c2ccccc2)C1	ZINC000875313553	DH	On-Demand	Anodyne	CCR5	39	48
CC(=O)[C@H]1CCCN(C(=O)N[C@H](CC2CC2)c2ccccc2)C1	ZINC000875313553	DH	On-Demand	Anodyne	REN	30	45
CC(=O)[C@H]1CCCN(C(=O)N[C@H](CC2CC2)c2ccccc2)C1	ZINC000875313553	DH	On-Demand	Anodyne	BIRC2	28	40
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](C)Oc1cccc(C)c1	ZINC000875313560	DF	On-Demand	Anodyne	PDS	36	40
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](C)Oc1cccc(C)c1	ZINC000875313562	DF	On-Demand	Anodyne	PDS	36	40
CC(=O)C1CCN(C(=O)N[C@@H]2CC[C@@H]3CCC[C@@H]3C2)CC1	ZINC000875313586	CF	On-Demand	Anodyne	EPHX2	18	40
CC(=O)C1CCN(C(=O)N[C@@H]2CC[C@H]3CCC[C@@H]3C2)CC1	ZINC000875313588	CF	On-Demand	Anodyne	EPHX2	18	40
CC(=O)C1CCN(C(=O)N[C@@H]2CC[C@@H]3CCC[C@H]3C2)CC1	ZINC000875313590	CF	On-Demand	Anodyne	EPHX2	18	40
CC(=O)C1CCN(C(=O)N[C@@H]2CC[C@H]3CCC[C@H]3C2)CC1	ZINC000875313592	CF	On-Demand	Anodyne	EPHX2	18	40
CC(=O)C1CCN(C(=O)N[C@H](CC2CC2)c2ccccc2)CC1	ZINC000875313639	DH	On-Demand	Anodyne	CCR5	33	43
CC(=O)C1CCN(C(=O)N[C@@H](CC2CC2)c2ccccc2)CC1	ZINC000875313641	DH	On-Demand	Anodyne	CCR5	33	43
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000875313657	GD	On-Demand	Mild	SFRP1	99	35
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000875313657	GD	On-Demand	Mild	WNT3	62	35
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000875313659	GD	On-Demand	Mild	SFRP1	99	35
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000875313659	GD	On-Demand	Mild	WNT3	62	35
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000875313661	GD	On-Demand	Mild	SFRP1	99	35
C#CC[C@H](COC)NC(=O)C(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000875313661	GD	On-Demand	Mild	WNT3	62	35
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000875313663	GD	On-Demand	Mild	SFRP1	99	35
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000875313663	GD	On-Demand	Mild	WNT3	62	35
CCN(C)C(=O)CNC(=O)C(=O)NC[C@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000875313670	GB	On-Demand	Anodyne	DRD4	15	41
CCN(C)C(=O)CNC(=O)C(=O)NC[C@@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000875313671	GB	On-Demand	Anodyne	DRD4	15	41
O=C(N[C@@H]1CCc2c(O)cccc21)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875313686	EH	On-Demand	Anodyne	RBP4	58	34
O=C(N[C@H]1CCc2c(O)cccc21)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875313687	EH	On-Demand	Anodyne	RBP4	58	34
CCSCCCNC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875313688	FD	On-Demand	Anodyne	FKBP1A	26	40
CCSCCCNC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875313689	FD	On-Demand	Anodyne	FKBP1A	26	40
CCSCCCNC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875313690	FD	On-Demand	Anodyne	FKBP1A	26	40
CCSCCCNC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875313691	FD	On-Demand	Anodyne	FKBP1A	26	40
CC[C@@H](C(=O)OC)N(C(=O)[C@@H]1CC[C@@H]1C(=O)OC)c1ccccc1	ZINC000875313698	EE	On-Demand	Anodyne	AMY2	46	32
CC(=O)Nc1ccccc1CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875313731	FG	On-Demand	Anodyne	KCNQ2	52	36
CC(=O)Nc1ccccc1CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875313732	FG	On-Demand	Anodyne	KCNQ2	52	36
CC(=O)Nc1ccccc1CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875313733	FG	On-Demand	Anodyne	KCNQ2	52	36
CC(=O)Nc1ccccc1CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875313734	FG	On-Demand	Anodyne	KCNQ2	52	36
CC(=O)Nc1ccccc1CNC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875313741	FF	On-Demand	Anodyne	EPHX2	17	51
CC(=O)Nc1ccccc1CNC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875313742	FF	On-Demand	Anodyne	EPHX2	17	51
CC(=O)Nc1ccccc1CNC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875313793	FF	On-Demand	Anodyne	EPHX2	23	42
CC(=O)Nc1ccccc1CNC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875313794	FF	On-Demand	Anodyne	EPHX2	23	42
CC(=O)Nc1ccccc1CNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875313805	GF	On-Demand	Anodyne	CTSV	30	41
CC(=O)Nc1ccccc1CNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875313805	GF	On-Demand	Anodyne	PDS	42	36
CC(=O)Nc1ccccc1CNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875313806	GF	On-Demand	Anodyne	CTSV	30	41
CC(=O)Nc1ccccc1CNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875313806	GF	On-Demand	Anodyne	PDS	42	36
CC(=O)Nc1ccccc1CNC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875313813	FG	On-Demand	Anodyne	EPHX2	29	46
CN1CCN(C2CCN(C(=O)N[C@@H](CC3CC3)c3ccccc3)CC2)CC1	ZINC000875313818	FF	On-Demand	Anodyne	CCR5	33	49
CN1CCN(C2CCN(C(=O)N[C@@H](CC3CC3)c3ccccc3)CC2)CC1	ZINC000875313818	FF	On-Demand	Anodyne	CALCRL	40	38
CN1CCN(C2CCN(C(=O)N[C@@H](CC3CC3)c3ccccc3)CC2)CC1	ZINC000875313818	FF	On-Demand	Anodyne	L3MBTL3	73	41
CN1CCN(C2CCN(C(=O)N[C@H](CC3CC3)c3ccccc3)CC2)CC1	ZINC000875313819	FF	On-Demand	Anodyne	CCR5	33	49
CN1CCN(C2CCN(C(=O)N[C@H](CC3CC3)c3ccccc3)CC2)CC1	ZINC000875313819	FF	On-Demand	Anodyne	CALCRL	40	38
CN1CCN(C2CCN(C(=O)N[C@H](CC3CC3)c3ccccc3)CC2)CC1	ZINC000875313819	FF	On-Demand	Anodyne	L3MBTL3	73	41
CCSCCCNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875313828	GE	On-Demand	Anodyne	ETHR	54	46
CC[C@@H](C(=O)OC)N(C(=O)CCCOC1CCOCC1)c1ccccc1	ZINC000875313838	FF	On-Demand	Anodyne	AMY2	44	31
CC(=O)Nc1ccccc1CNC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875313840	FG	On-Demand	Anodyne	EPHX2	29	46
CCN(C)C(=O)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875313843	GC	On-Demand	Anodyne	CHRM2	17	40
CCN(C)C(=O)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875313843	GC	On-Demand	Anodyne	DRD2	23	44
CCN(C)C(=O)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875313843	GC	On-Demand	Anodyne	DRD4	44	43
CCN(C)C(=O)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875313843	GC	On-Demand	Anodyne	ACHE	66	59
CCN(C)C(=O)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875313843	GC	On-Demand	Anodyne	DRD3	18	43
CCN(C)C(=O)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875313843	GC	On-Demand	Anodyne	HTR4	26	42
CCN(C)C(=O)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875313843	GC	On-Demand	Anodyne	TACR2	16	40
CCN(C)C(=O)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875313843	GC	On-Demand	Anodyne	SIGMAR1	56	52
CCN(C)C(=O)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875313843	GC	On-Demand	Anodyne	BCHE	18	48
CCN(C)C(=O)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875313843	GC	On-Demand	Anodyne	MCHR1	22	41
CCN(C)C(=O)CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875313843	GC	On-Demand	Anodyne	CACNA1G	30	41
Cc1cnc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)s1	ZINC000875313881	EG	On-Demand	Anodyne	CPT1A	63	34
Cc1cnc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)s1	ZINC000875313883	EG	On-Demand	Anodyne	CPT1A	63	34
Cc1cnc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)s1	ZINC000875313884	EG	On-Demand	Anodyne	CPT1A	63	34
Cc1cnc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)s1	ZINC000875313885	EG	On-Demand	Anodyne	CPT1A	63	34
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)CCc1cccn1C	ZINC000875313887	EE	On-Demand	Anodyne	SLC6A3	57	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)CCc1cccn1C	ZINC000875313889	EE	On-Demand	Anodyne	SLC6A3	57	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)CCc1cccn1C	ZINC000875313890	EE	On-Demand	Anodyne	SLC6A3	57	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)CCc1cccn1C	ZINC000875313892	EE	On-Demand	Anodyne	SLC6A3	57	39
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H]2CC[C@H]3CCC[C@H]3C2)cc1	ZINC000875313909	EG	On-Demand	Anodyne	FASN	33	41
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H]2CC[C@H]3CCC[C@@H]3C2)cc1	ZINC000875313911	EG	On-Demand	Anodyne	FASN	33	41
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H]2CC[C@@H]3CCC[C@H]3C2)cc1	ZINC000875313912	EG	On-Demand	Anodyne	FASN	33	41
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H]2CC[C@@H]3CCC[C@@H]3C2)cc1	ZINC000875313913	EG	On-Demand	Anodyne	FASN	33	41
CCC(CC)c1cc(CNC(=O)N(CCOC)CC2CCN(C)CC2)on1	ZINC000875313917	GG	On-Demand	Anodyne	SLC5A7	24	44
CCN(C)C(=O)CNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875313949	GB	On-Demand	Clean	DRD2	26	40
CCN(C)C(=O)CNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875313949	GB	On-Demand	Clean	DRD4	41	32
CCN(C)C(=O)CNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875313949	GB	On-Demand	Clean	DRD3	41	37
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](CC1CC1)c1ccccc1	ZINC000875313959	DG	On-Demand	Anodyne	TACR3	42	35
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](CC1CC1)c1ccccc1	ZINC000875313961	DG	On-Demand	Anodyne	TACR3	42	35
CC(=O)Nc1ccccc1CNC(=O)N1CC[C@@H](C(F)(F)F)O[C@H](C)C1	ZINC000875314007	FF	On-Demand	Anodyne	EPHX2	16	41
CC(=O)Nc1ccccc1CNC(=O)N1CC[C@H](C(F)(F)F)O[C@H](C)C1	ZINC000875314008	FF	On-Demand	Anodyne	EPHX2	16	41
CC(=O)Nc1ccccc1CNC(=O)N1CC[C@@H](C(F)(F)F)O[C@@H](C)C1	ZINC000875314009	FF	On-Demand	Anodyne	EPHX2	16	41
CC(=O)Nc1ccccc1CNC(=O)N1CC[C@H](C(F)(F)F)O[C@@H](C)C1	ZINC000875314010	FF	On-Demand	Anodyne	EPHX2	16	41
COc1cccc([C@H](O)C2CCN(C(=O)N[C@@H]3CCc4c(O)cccc43)CC2)c1	ZINC000875314024	GH	On-Demand	Anodyne	DRD4	42	33
COc1cccc([C@H](O)C2CCN(C(=O)N[C@H]3CCc4c(O)cccc43)CC2)c1	ZINC000875314026	GH	On-Demand	Anodyne	DRD4	42	33
CC(=O)Nc1ccccc1CNC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875314064	EE	On-Demand	Anodyne	EPHX2	18	42
CC(=O)Nc1ccccc1CNC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875314065	EE	On-Demand	Anodyne	EPHX2	18	42
CCN(C)C(=O)CNC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1C	ZINC000875314137	GC	On-Demand	Anodyne	SLC18A2	47	34
CCN(C)C(=O)CNC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1C	ZINC000875314138	GC	On-Demand	Anodyne	SLC18A2	47	34
CN1CCN(C2CCN(C(=O)N[C@@H]3CCc4c(O)cccc43)CC2)CC1	ZINC000875314159	FD	On-Demand	Anodyne	L3MBTL3	82	44
CCN(C)C(=O)CNC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875314161	EC	On-Demand	Anodyne	OXTR	43	36
CN1CCN(C2CCN(C(=O)N[C@H]3CCc4c(O)cccc43)CC2)CC1	ZINC000875314162	FD	On-Demand	Anodyne	L3MBTL3	82	44
CCN(C)C(=O)CNC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875314163	EC	On-Demand	Anodyne	OXTR	43	36
O=C(N[C@H](CC1CC1)c1ccccc1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875314196	GH	On-Demand	Anodyne	ETHR	59	36
O=C(N[C@H](CC1CC1)c1ccccc1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875314197	GH	On-Demand	Anodyne	ETHR	59	36
O=C(N[C@@H](CC1CC1)c1ccccc1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875314198	GH	On-Demand	Anodyne	ETHR	59	36
O=C(N[C@@H](CC1CC1)c1ccccc1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875314200	GH	On-Demand	Anodyne	ETHR	59	36
CCC1(CC)CCCN1C(=O)NCc1ccccc1NC(C)=O	ZINC000875314353	DH	On-Demand	Anodyne	KCNQ2	60	34
CCC1(CC)CCCN1C(=O)NCc1ccccc1NC(C)=O	ZINC000875314353	DH	On-Demand	Anodyne	SLC12A5	56	35
C[C@@H](CNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)CN1CCN(C)CC1	ZINC000875314354	GD	On-Demand	Mild	ITK	17	49
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1NC(C)=O	ZINC000875314387	DD	On-Demand	Anodyne	ANPEP	28	44
C[C@@H](CNC(=O)NC1(C)CC(F)(F)C1)Cc1cccs1	ZINC000875314389	DG	On-Demand	Anodyne	CTSC	30	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CC1CC1)c1ccccc1	ZINC000875314427	EG	On-Demand	Anodyne	SLC6A4	31	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CC1CC1)c1ccccc1	ZINC000875314427	EG	On-Demand	Anodyne	SLC6A3	72	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CC1CC1)c1ccccc1	ZINC000875314428	EG	On-Demand	Anodyne	SLC6A4	31	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CC1CC1)c1ccccc1	ZINC000875314428	EG	On-Demand	Anodyne	SLC6A3	72	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CC1CC1)c1ccccc1	ZINC000875314429	EG	On-Demand	Anodyne	SLC6A4	31	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CC1CC1)c1ccccc1	ZINC000875314429	EG	On-Demand	Anodyne	SLC6A3	72	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CC1CC1)c1ccccc1	ZINC000875314430	EG	On-Demand	Anodyne	SLC6A4	31	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CC1CC1)c1ccccc1	ZINC000875314430	EG	On-Demand	Anodyne	SLC6A3	72	44
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1cccnc1	ZINC000875314439	FG	On-Demand	Anodyne	ELANE	33	41
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1cccnc1	ZINC000875314439	FG	On-Demand	Anodyne	KLK3	83	37
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1cccnc1	ZINC000875314439	FG	On-Demand	Anodyne	CTSB	70	47
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1cccnc1	ZINC000875314439	FG	On-Demand	Anodyne	PAPA1_CARPA	81	47
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1cccnc1	ZINC000875314439	FG	On-Demand	Anodyne	CYSP_TRYCR	57	47
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1cccnc1	ZINC000875314439	FG	On-Demand	Anodyne	CTSK	40	49
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1cccnc1	ZINC000875314439	FG	On-Demand	Anodyne	CTSL	45	49
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1cccnc1	ZINC000875314439	FG	On-Demand	Anodyne	CAPNS1	69	40
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1cccnc1	ZINC000875314439	FG	On-Demand	Anodyne	CTSS	20	47
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1cccnc1	ZINC000875314439	FG	On-Demand	Anodyne	CAPN1	77	51
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1cccnc1	ZINC000875314439	FG	On-Demand	Anodyne	CAPN2	118	46
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1cccnc1	ZINC000875314439	FG	On-Demand	Anodyne	CYP3A4	33	41
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1cccnc1	ZINC000875314439	FG	On-Demand	Anodyne	NPR	75	43
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1cccnc1	ZINC000875314439	FG	On-Demand	Anodyne	PSMB5	33	40
CONC(=O)C1CCN(C(=O)N[C@@H](CC2CC2)c2ccccc2)CC1	ZINC000875314504	EF	On-Demand	Anodyne	CCR5	29	42
CONC(=O)C1CCN(C(=O)N[C@@H](CC2CC2)c2ccccc2)CC1	ZINC000875314504	EF	On-Demand	Anodyne	REN	16	40
CONC(=O)C1CCN(C(=O)N[C@H](CC2CC2)c2ccccc2)CC1	ZINC000875314507	EF	On-Demand	Anodyne	CCR5	29	42
CONC(=O)C1CCN(C(=O)N[C@H](CC2CC2)c2ccccc2)CC1	ZINC000875314507	EF	On-Demand	Anodyne	REN	16	40
CC[C@@H](C(=O)OC)N(C(=O)c1cc(C(F)(F)F)ncn1)c1ccccc1	ZINC000875314560	FG	On-Demand	Anodyne	CARM1	40	32
CCOC1CC2(C1)C[C@H]2C(=O)N(c1ccccc1)[C@@H](CC)C(=O)OC	ZINC000875314612	EG	On-Demand	Anodyne	TIMP3	57	32
CCOC1CC2(C1)C[C@H]2C(=O)N(c1ccccc1)[C@H](CC)C(=O)OC	ZINC000875314615	EG	On-Demand	Anodyne	TIMP3	57	32
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H](CC2CC2)c2ccccc2)CC1	ZINC000875314670	FE	On-Demand	Anodyne	CCR5	38	40
C[S@](=N)(=O)N1CCN(C(=O)N[C@H](CC2CC2)c2ccccc2)CC1	ZINC000875314671	FE	On-Demand	Anodyne	CCR5	38	40
C[C@@H]1C[C@@H]1[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(Cl)cc1	ZINC000875314720	FF	On-Demand	Anodyne	CACNA1H	52	38
C[C@@H]1C[C@@H]1[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(Cl)cc1	ZINC000875314720	FF	On-Demand	Anodyne	CCR1	50	36
C[C@@H]1C[C@H]1[C@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(Cl)cc1	ZINC000875314721	FF	On-Demand	Anodyne	CACNA1H	52	38
C[C@@H]1C[C@H]1[C@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(Cl)cc1	ZINC000875314721	FF	On-Demand	Anodyne	CCR1	50	36
C[C@@H]1C[C@@H]1[C@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(Cl)cc1	ZINC000875314722	FF	On-Demand	Anodyne	CACNA1H	52	38
C[C@@H]1C[C@@H]1[C@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(Cl)cc1	ZINC000875314722	FF	On-Demand	Anodyne	CCR1	50	36
C[C@@H]1C[C@H]1[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(Cl)cc1	ZINC000875314723	FF	On-Demand	Anodyne	CACNA1H	52	38
C[C@@H]1C[C@H]1[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(Cl)cc1	ZINC000875314723	FF	On-Demand	Anodyne	CCR1	50	36
Cc1nnc(NNC(=O)N[C@@H](CC2CC2)c2ccccc2)n1C	ZINC000875314852	DE	On-Demand	Reactive	CCR5	27	41
Cc1nnc(NNC(=O)N[C@H](CC2CC2)c2ccccc2)n1C	ZINC000875314853	DE	On-Demand	Reactive	CCR5	27	41
O=C(N[C@@H](CC1CC1)c1ccccc1)N1CCC2(CCNC2=O)CC1	ZINC000875314854	EF	On-Demand	Anodyne	GHRHR	50	32
O=C(N[C@H](CC1CC1)c1ccccc1)N1CCC2(CCNC2=O)CC1	ZINC000875314855	EF	On-Demand	Anodyne	GHRHR	50	32
COC(=O)N(C)NC(=O)N[C@H](c1ccc(Cl)cc1)[C@H]1C[C@H]1C	ZINC000875314878	EF	On-Demand	Reactive	UTS2	41	32
COC(=O)N(C)NC(=O)N[C@H](c1ccc(Cl)cc1)[C@@H]1C[C@H]1C	ZINC000875314879	EF	On-Demand	Reactive	UTS2	41	32
COC(=O)N(C)NC(=O)N[C@H](c1ccc(Cl)cc1)[C@H]1C[C@@H]1C	ZINC000875314880	EF	On-Demand	Reactive	UTS2	41	32
COC(=O)N(C)NC(=O)N[C@H](c1ccc(Cl)cc1)[C@@H]1C[C@@H]1C	ZINC000875314881	EF	On-Demand	Reactive	UTS2	41	32
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ncc(C)s2)CC1	ZINC000875314893	FH	On-Demand	Anodyne	MAP3K12	27	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ncc(C)s2)CC1	ZINC000875314894	FH	On-Demand	Anodyne	MAP3K12	27	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)Oc1cccc(C)c1	ZINC000875315149	EE	On-Demand	Anodyne	SLC6A4	24	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)Oc1cccc(C)c1	ZINC000875315149	EE	On-Demand	Anodyne	SLC6A3	50	41
O=C(NCCC[C@@H]1CCOC1=O)N[C@@H]1CCc2c(O)cccc21	ZINC000875315223	DE	On-Demand	Anodyne	LUXR	62	33
O=C(NCCC[C@@H]1CCOC1=O)N[C@@H]1CCc2c(O)cccc21	ZINC000875315223	DE	On-Demand	Anodyne	TRAR	72	33
O=C(NCCC[C@@H]1CCOC1=O)N[C@@H]1CCc2c(O)cccc21	ZINC000875315223	DE	On-Demand	Anodyne	LASR	42	33
O=C(NCCC[C@H]1CCOC1=O)N[C@H]1CCc2c(O)cccc21	ZINC000875315224	DE	On-Demand	Anodyne	LUXR	62	33
O=C(NCCC[C@H]1CCOC1=O)N[C@H]1CCc2c(O)cccc21	ZINC000875315224	DE	On-Demand	Anodyne	TRAR	72	33
O=C(NCCC[C@H]1CCOC1=O)N[C@H]1CCc2c(O)cccc21	ZINC000875315224	DE	On-Demand	Anodyne	LASR	42	33
O=C(NCCC[C@@H]1CCOC1=O)N[C@H]1CCc2c(O)cccc21	ZINC000875315225	DE	On-Demand	Anodyne	LUXR	62	33
O=C(NCCC[C@@H]1CCOC1=O)N[C@H]1CCc2c(O)cccc21	ZINC000875315225	DE	On-Demand	Anodyne	TRAR	72	33
O=C(NCCC[C@@H]1CCOC1=O)N[C@H]1CCc2c(O)cccc21	ZINC000875315225	DE	On-Demand	Anodyne	LASR	42	33
O=C(NCCC[C@H]1CCOC1=O)N[C@@H]1CCc2c(O)cccc21	ZINC000875315226	DE	On-Demand	Anodyne	LUXR	62	33
O=C(NCCC[C@H]1CCOC1=O)N[C@@H]1CCc2c(O)cccc21	ZINC000875315226	DE	On-Demand	Anodyne	TRAR	72	33
O=C(NCCC[C@H]1CCOC1=O)N[C@@H]1CCc2c(O)cccc21	ZINC000875315226	DE	On-Demand	Anodyne	LASR	42	33
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)Oc1cccc(C)c1	ZINC000875315250	EE	On-Demand	Anodyne	SLC6A4	24	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)Oc1cccc(C)c1	ZINC000875315250	EE	On-Demand	Anodyne	SLC6A3	50	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)Oc1cccc(C)c1	ZINC000875315251	EE	On-Demand	Anodyne	SLC6A4	24	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)Oc1cccc(C)c1	ZINC000875315251	EE	On-Demand	Anodyne	SLC6A3	50	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)Oc1cccc(C)c1	ZINC000875315252	EE	On-Demand	Anodyne	SLC6A4	24	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)Oc1cccc(C)c1	ZINC000875315252	EE	On-Demand	Anodyne	SLC6A3	50	41
CCN(C)C(=O)CNC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875315278	FC	On-Demand	Anodyne	NPY2R	78	42
CCCC[C@H](CCC)NC(=O)C(=O)NC(c1ccnn1C)c1ccnn1C	ZINC000875315279	FD	On-Demand	Anodyne	CTSK	21	44
CCCC[C@@H](CCC)NC(=O)C(=O)NC(c1ccnn1C)c1ccnn1C	ZINC000875315280	FD	On-Demand	Anodyne	CTSK	21	44
COC(=O)N(C)NC(=O)NC[C@@H](C)Oc1cccc(C)c1	ZINC000875315343	CD	On-Demand	Reactive	MTNR1A	30	50
COC(=O)N(C)NC(=O)NC[C@@H](C)Oc1cccc(C)c1	ZINC000875315343	CD	On-Demand	Reactive	MTNR1B	25	50
COC(=O)N(C)NC(=O)NC[C@H](C)Oc1cccc(C)c1	ZINC000875315344	CD	On-Demand	Reactive	MTNR1A	30	50
COC(=O)N(C)NC(=O)NC[C@H](C)Oc1cccc(C)c1	ZINC000875315344	CD	On-Demand	Reactive	MTNR1B	25	50
CC[C@@H](C(=O)OC)N(C(=O)[C@H]1CCC(=O)O1)c1ccccc1	ZINC000875315438	DD	On-Demand	Anodyne	AMY2	43	30
O=C(N[C@H]1CCc2c(O)cccc21)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875315447	FG	On-Demand	Anodyne	EPHX2	15	42
O=C(N[C@@H]1CCc2c(O)cccc21)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875315448	FG	On-Demand	Anodyne	EPHX2	15	42
O=C(N[C@H]1CCc2c(O)cccc21)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875315449	FG	On-Demand	Anodyne	EPHX2	15	42
CONC(=O)C1CCN(C(=O)NCc2ccc(-c3cccc(OC)c3)cc2)CC1	ZINC000875315473	GF	On-Demand	Anodyne	DRD4	42	32
CONC(=O)C1CCN(C(=O)NCc2ccc(-c3cccc(OC)c3)cc2)CC1	ZINC000875315473	GF	On-Demand	Anodyne	MMP13	28	42
CONC(=O)C1CCN(C(=O)NCc2ccc(-c3cccc(OC)c3)cc2)CC1	ZINC000875315473	GF	On-Demand	Anodyne	MTNR1A	34	44
CONC(=O)C1CCN(C(=O)NCc2ccc(-c3cccc(OC)c3)cc2)CC1	ZINC000875315473	GF	On-Demand	Anodyne	MTNR1B	37	44
CONC(=O)C1CCN(C(=O)NCc2ccc(-c3cccc(OC)c3)cc2)CC1	ZINC000875315473	GF	On-Demand	Anodyne	LGMN	43	44
CONC(=O)C1CCN(C(=O)NCc2ccc(-c3cccc(OC)c3)cc2)CC1	ZINC000875315473	GF	On-Demand	Anodyne	FAAH	19	40
CONC(=O)C1CCN(C(=O)NCc2ccc(-c3cccc(OC)c3)cc2)CC1	ZINC000875315473	GF	On-Demand	Anodyne	EPHX2	21	41
CONC(=O)C1CCN(C(=O)NCc2ccc(-c3cccc(OC)c3)cc2)CC1	ZINC000875315473	GF	On-Demand	Anodyne	CACNA1G	24	40
CC1(C)CC[C@@H](CNC(=O)C(=O)N2CC[C@H](C(C)(C)O)C2)c2ccccc21	ZINC000875315515	FF	On-Demand	Anodyne	GHRHR	48	33
CC1(C)CC[C@@H](CNC(=O)C(=O)N2CC[C@@H](C(C)(C)O)C2)c2ccccc21	ZINC000875315517	FF	On-Demand	Anodyne	GHRHR	48	33
O=C(N[C@@H]1CCc2c(O)cccc21)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875315550	FG	On-Demand	Anodyne	EPHX2	15	42
CCC(CC)c1cc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)on1	ZINC000875315611	FI	On-Demand	Anodyne	SLC5A7	25	44
CCC(CC)c1cc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)on1	ZINC000875315612	FI	On-Demand	Anodyne	SLC5A7	25	44
CCO[C@H](C(=O)N(c1ccccc1)[C@H](CC)C(=O)OC)C1CCOCC1	ZINC000875315629	FF	On-Demand	Anodyne	AMY2	44	31
CCO[C@@H](C(=O)N(c1ccccc1)[C@H](CC)C(=O)OC)C1CCOCC1	ZINC000875315630	FF	On-Demand	Anodyne	AMY2	44	31
CCO[C@H](C(=O)N(c1ccccc1)[C@@H](CC)C(=O)OC)C1CCOCC1	ZINC000875315631	FF	On-Demand	Anodyne	AMY2	44	31
CCO[C@@H](C(=O)N(c1ccccc1)[C@@H](CC)C(=O)OC)C1CCOCC1	ZINC000875315632	FF	On-Demand	Anodyne	AMY2	44	31
Cc1cnc(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)s1	ZINC000875315666	EF	On-Demand	Anodyne	CTSV	28	41
Cc1cnc(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)s1	ZINC000875315667	EF	On-Demand	Anodyne	CTSV	28	41
O=C(N[C@@H]1CC[C@@H]2CCC[C@H]2C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875315705	FF	On-Demand	Anodyne	SMO	30	40
O=C(N[C@@H]1CC[C@@H]2CCC[C@H]2C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875315706	FF	On-Demand	Anodyne	SMO	30	40
O=C(N[C@@H]1CC[C@@H]2CCC[C@@H]2C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875315707	FF	On-Demand	Anodyne	SMO	30	40
O=C(N[C@@H]1CC[C@@H]2CCC[C@@H]2C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875315708	FF	On-Demand	Anodyne	SMO	30	40
C[C@@H](CCc1cccn1C)NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875315784	GG	On-Demand	Mild	ITK	15	48
CCCC[C@H](CCC)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875315794	FG	On-Demand	Anodyne	ROCK1	24	40
CCCC[C@H](CCC)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875315794	FG	On-Demand	Anodyne	ROCK2	15	40
CCCC[C@@H](CCC)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875315795	FG	On-Demand	Anodyne	ROCK1	24	40
CCCC[C@@H](CCC)NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875315795	FG	On-Demand	Anodyne	ROCK2	15	40
CCCC[C@@H](CCC)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875315830	DE	On-Demand	Anodyne	CTSK	44	45
CCCC[C@H](CCC)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875315831	DE	On-Demand	Anodyne	CTSK	44	45
CCCC[C@@H](CCC)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875315832	DE	On-Demand	Anodyne	CTSK	44	45
CCCC[C@H](CCC)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875315833	DE	On-Demand	Anodyne	CTSK	44	45
CCCCCCCNC(=O)C(=O)NCC(=O)N(C)CC	ZINC000875315834	CC	On-Demand	Mild	ASAH1	79	33
NC(=O)COc1cccc(CNC(=O)N[C@H]2CCc3ccc(Cl)cc32)c1	ZINC000875315843	FF	On-Demand	Anodyne	PDS	57	37
NC(=O)COc1cccc(CNC(=O)N[C@@H]2CCc3ccc(Cl)cc32)c1	ZINC000875315844	FF	On-Demand	Anodyne	PDS	57	37
COc1ccccc1[C@H]1CCCN(C(=O)NCCS(=O)(=O)C(C)(C)C)CC1	ZINC000875315852	GG	On-Demand	Anodyne	DRD2	15	43
COc1ccccc1[C@H]1CCCN(C(=O)NCCS(=O)(=O)C(C)(C)C)CC1	ZINC000875315852	GG	On-Demand	Anodyne	RBP4	35	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCCS(=O)(=O)C(C)(C)C)CC1	ZINC000875315853	GG	On-Demand	Anodyne	DRD2	15	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCCS(=O)(=O)C(C)(C)C)CC1	ZINC000875315853	GG	On-Demand	Anodyne	RBP4	35	41
NC(=O)COc1cccc(CNC(=O)NC[C@@H]2CC=CC[C@H]2C(F)(F)F)c1	ZINC000875315867	GE	On-Demand	Anodyne	PDS	51	37
COc1ccc(O[C@@H](C)CNC(=O)N[C@@H]2CCOC[C@H]2O)cc1	ZINC000875315885	DC	On-Demand	Anodyne	MTNR1A	18	46
C[C@]1(C(F)(F)F)CCN(C(=O)NCc2cccc(OCC(N)=O)c2)C1	ZINC000875315890	FE	On-Demand	Anodyne	PDS	49	36
COc1ccc(O[C@@H](C)CNC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875315892	ED	On-Demand	Anodyne	MMP13	15	41
COc1ccc(O[C@@H](C)CNC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875315892	ED	On-Demand	Anodyne	MMP3	15	41
COc1ccc(O[C@@H](C)CNC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875315892	ED	On-Demand	Anodyne	MMP1	18	41
COc1ccc(O[C@H](C)CNC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875315893	ED	On-Demand	Anodyne	MMP13	15	41
COc1ccc(O[C@H](C)CNC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875315893	ED	On-Demand	Anodyne	MMP3	15	41
COc1ccc(O[C@H](C)CNC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875315893	ED	On-Demand	Anodyne	MMP1	18	41
COC(=O)N(C)NC(=O)NC[C@H](C)Oc1ccc(OC)cc1	ZINC000875315914	DD	On-Demand	Reactive	MTNR1A	36	49
COC(=O)N(C)NC(=O)NC[C@H](C)Oc1ccc(OC)cc1	ZINC000875315914	DD	On-Demand	Reactive	MTNR1B	26	49
COC(=O)N(C)NC(=O)NC[C@@H](C)Oc1ccc(OC)cc1	ZINC000875315915	DD	On-Demand	Reactive	MTNR1A	36	49
COC(=O)N(C)NC(=O)NC[C@@H](C)Oc1ccc(OC)cc1	ZINC000875315915	DD	On-Demand	Reactive	MTNR1B	26	49
COc1ccc(O[C@@H](C)CNC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875315923	EE	On-Demand	Anodyne	MTNR1A	18	46
COc1ccc(O[C@@H](C)CNC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875315923	EE	On-Demand	Anodyne	MTNR1B	17	46
COc1ccc(O[C@H](C)CNC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875315924	EE	On-Demand	Anodyne	MTNR1A	18	46
COc1ccc(O[C@H](C)CNC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875315924	EE	On-Demand	Anodyne	MTNR1B	17	46
COc1ccc(O[C@@H](C)CNC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875315925	EE	On-Demand	Anodyne	MTNR1A	18	46
COc1ccc(O[C@@H](C)CNC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875315925	EE	On-Demand	Anodyne	MTNR1B	17	46
COc1ccc(O[C@H](C)CNC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875315926	EE	On-Demand	Anodyne	MTNR1A	18	46
COc1ccc(O[C@H](C)CNC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875315926	EE	On-Demand	Anodyne	MTNR1B	17	46
NC(=O)COc1cccc(CNC(=O)N2C[C@@H]3[C@@H](C[C@H]3c3ccccc3)C2)c1	ZINC000875315937	GE	On-Demand	Anodyne	PDS	40	34
NC(=O)COc1cccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875315958	GE	On-Demand	Anodyne	EPHX2	21	43
NC(=O)COc1cccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875315959	GE	On-Demand	Anodyne	EPHX2	21	43
NC(=O)COc1cccc(CNC(=O)NCC[C@@H]2CCCS2)c1	ZINC000875315994	ED	On-Demand	Anodyne	HRH2	25	42
NC(=O)COc1cccc(CNC(=O)NCC[C@H]2CCCS2)c1	ZINC000875315995	ED	On-Demand	Anodyne	HRH2	25	42
Cc1cncc([C@H]2CCCN2C(=O)NCc2cccc(OCC(N)=O)c2)c1	ZINC000875316008	FE	On-Demand	Anodyne	F2	15	40
Cc1cncc([C@H]2CCCN2C(=O)NCc2cccc(OCC(N)=O)c2)c1	ZINC000875316008	FE	On-Demand	Anodyne	CPT1A	107	42
Cc1cncc([C@@H]2CCCN2C(=O)NCc2cccc(OCC(N)=O)c2)c1	ZINC000875316009	FE	On-Demand	Anodyne	F2	15	40
Cc1cncc([C@@H]2CCCN2C(=O)NCc2cccc(OCC(N)=O)c2)c1	ZINC000875316009	FE	On-Demand	Anodyne	CPT1A	107	42
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](C)Oc1ccc(OC)cc1	ZINC000875316026	DE	On-Demand	Anodyne	MTNR1A	24	46
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](C)Oc1ccc(OC)cc1	ZINC000875316026	DE	On-Demand	Anodyne	MTNR1B	17	46
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](C)Oc1ccc(OC)cc1	ZINC000875316028	DE	On-Demand	Anodyne	MTNR1A	24	46
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](C)Oc1ccc(OC)cc1	ZINC000875316028	DE	On-Demand	Anodyne	MTNR1B	17	46
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H](C)COCc3ccccc3)C[C@@H]1C2	ZINC000875316063	EE	On-Demand	Anodyne	CAPN2	45	32
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H](C)COCc3ccccc3)C[C@@H]1C2	ZINC000875316064	EE	On-Demand	Anodyne	CAPN2	45	32
COc1ccc(N=C2NC(=O)[C@@H](CC(=O)Nc3ccc(Oc4ccccc4)cc3)S2)cc1OC	ZINC000875316067	JJ	On-Demand	Mild	TSHR	49	33
COc1ccc(N=C2NC(=O)[C@@H](CC(=O)Nc3ccc(Oc4ccccc4)cc3)S2)cc1OC	ZINC000875316067	JJ	On-Demand	Mild	PDGFRA	43	35
COc1ccc(N=C2NC(=O)[C@@H](CC(=O)Nc3ccc(Oc4ccccc4)cc3)S2)cc1OC	ZINC000875316067	JJ	On-Demand	Mild	ENPP1	67	33
COc1ccc(N=C2NC(=O)[C@H](CC(=O)Nc3ccc(Oc4ccccc4)cc3)S2)cc1OC	ZINC000875316068	JJ	On-Demand	Mild	TSHR	49	33
COc1ccc(N=C2NC(=O)[C@H](CC(=O)Nc3ccc(Oc4ccccc4)cc3)S2)cc1OC	ZINC000875316068	JJ	On-Demand	Mild	PDGFRA	43	35
COc1ccc(N=C2NC(=O)[C@H](CC(=O)Nc3ccc(Oc4ccccc4)cc3)S2)cc1OC	ZINC000875316068	JJ	On-Demand	Mild	ENPP1	67	33
O=C(NC[C@H]1CCCCS1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875316094	GE	On-Demand	Anodyne	ETHR	58	49
NC(=O)COc1cccc(CNC(=O)N2CCC[C@@](F)(c3ccccc3)C2)c1	ZINC000875316148	GF	On-Demand	Anodyne	HRH2	20	40
NC(=O)COc1cccc(CNC(=O)N2CCC[C@@](F)(c3ccccc3)C2)c1	ZINC000875316148	GF	On-Demand	Anodyne	PDS	42	35
NC(=O)COc1cccc(CNC(=O)N2CCC[C@](F)(c3ccccc3)C2)c1	ZINC000875316149	GF	On-Demand	Anodyne	HRH2	20	40
NC(=O)COc1cccc(CNC(=O)N2CCC[C@](F)(c3ccccc3)C2)c1	ZINC000875316149	GF	On-Demand	Anodyne	PDS	42	35
NC(=O)COc1cccc(CNC(=O)N[C@@H]2CC23CCC3)c1	ZINC000875316173	DD	On-Demand	Anodyne	PDS	41	33
NC(=O)COc1cccc(CNC(=O)N[C@H]2CC23CCC3)c1	ZINC000875316174	DD	On-Demand	Anodyne	PDS	41	33
CN(C)C[C@@H]1CN(C(=O)NCc2cccc(OCC(N)=O)c2)C[C@H]1CN(C)C	ZINC000875316175	GC	On-Demand	Anodyne	PDS	42	32
COc1ccc(O[C@H](C)CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875316225	FD	On-Demand	Anodyne	BIRC2	25	41
COc1ccc(O[C@@H](C)CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875316227	FD	On-Demand	Anodyne	BIRC2	25	41
CO[C@H]1C[C@H](NC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)C1(C)C	ZINC000875316236	GD	On-Demand	Anodyne	ETHR	41	43
CO[C@@H]1C[C@@H](NC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)C1(C)C	ZINC000875316238	GD	On-Demand	Anodyne	ETHR	41	43
COCCN(CC1CCN(C)CC1)C(=O)NC[C@H](C)Oc1ccccc1OC	ZINC000875316367	GE	On-Demand	Anodyne	ACKR3	67	35
COCCN(CC1CCN(C)CC1)C(=O)NC[C@@H](C)Oc1ccccc1OC	ZINC000875316368	GE	On-Demand	Anodyne	ACKR3	67	35
CCN(C)C(=O)c1cccc(OC(=O)[C@H]2CCCN2C(C)=O)c1	ZINC000875316404	DD	On-Demand	Anodyne	FKBP1A	61	38
CCN(C)C(=O)c1cccc(OC(=O)[C@H]2CCCN2C(C)=O)c1	ZINC000875316404	DD	On-Demand	Anodyne	PREP	55	41
C=CC(C)(C)CCCNC(=O)NCc1cccc(OCC(N)=O)c1	ZINC000875316450	EE	On-Demand	Mild	HRH2	26	43
C=CC(C)(C)CCCNC(=O)NCc1cccc(OCC(N)=O)c1	ZINC000875316450	EE	On-Demand	Mild	PDS	53	33
CN1Cc2ccccc2[C@H]1CNC(=O)NCc1cccc(OCC(N)=O)c1	ZINC000875316462	FD	On-Demand	Anodyne	PDS	42	33
CN1Cc2ccccc2[C@@H]1CNC(=O)NCc1cccc(OCC(N)=O)c1	ZINC000875316463	FD	On-Demand	Anodyne	PDS	42	33
COc1cccc([C@H](O)C2CCN(C(=O)NC[C@@H](C)C(=O)OC(C)C)CC2)c1	ZINC000875316590	GF	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@H](O)C2CCN(C(=O)NC[C@@H](C)C(=O)OC(C)C)CC2)c1	ZINC000875316590	GF	On-Demand	Anodyne	MTNR1A	22	41
COc1cccc([C@H](O)C2CCN(C(=O)NC[C@@H](C)C(=O)OC(C)C)CC2)c1	ZINC000875316590	GF	On-Demand	Anodyne	MTNR1B	29	41
COc1cccc([C@H](O)C2CCN(C(=O)NC[C@H](C)C(=O)OC(C)C)CC2)c1	ZINC000875316592	GF	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@H](O)C2CCN(C(=O)NC[C@H](C)C(=O)OC(C)C)CC2)c1	ZINC000875316592	GF	On-Demand	Anodyne	MTNR1A	22	41
COc1cccc([C@H](O)C2CCN(C(=O)NC[C@H](C)C(=O)OC(C)C)CC2)c1	ZINC000875316592	GF	On-Demand	Anodyne	MTNR1B	29	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)COCc1ccccc1	ZINC000875316611	DE	On-Demand	Anodyne	MME	48	44
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)COCc1ccccc1	ZINC000875316611	DE	On-Demand	Anodyne	KLK3	46	30
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)COCc1ccccc1	ZINC000875316611	DE	On-Demand	Anodyne	CTSB	58	39
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)COCc1ccccc1	ZINC000875316611	DE	On-Demand	Anodyne	PAPA1_CARPA	66	36
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)COCc1ccccc1	ZINC000875316611	DE	On-Demand	Anodyne	CTSK	28	43
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)COCc1ccccc1	ZINC000875316611	DE	On-Demand	Anodyne	CAPNS1	55	34
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)COCc1ccccc1	ZINC000875316611	DE	On-Demand	Anodyne	CAPN1	81	42
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)COCc1ccccc1	ZINC000875316611	DE	On-Demand	Anodyne	CAPN2	112	39
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)COCc1ccccc1	ZINC000875316611	DE	On-Demand	Anodyne	ACE2	43	36
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)COCc1ccccc1	ZINC000875316611	DE	On-Demand	Anodyne	NPR	70	35
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)COCc1ccccc1	ZINC000875316612	DE	On-Demand	Anodyne	MME	48	44
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)COCc1ccccc1	ZINC000875316612	DE	On-Demand	Anodyne	KLK3	46	30
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)COCc1ccccc1	ZINC000875316612	DE	On-Demand	Anodyne	CTSB	58	39
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)COCc1ccccc1	ZINC000875316612	DE	On-Demand	Anodyne	PAPA1_CARPA	66	36
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)COCc1ccccc1	ZINC000875316612	DE	On-Demand	Anodyne	CTSK	28	43
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)COCc1ccccc1	ZINC000875316612	DE	On-Demand	Anodyne	CAPNS1	55	34
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)COCc1ccccc1	ZINC000875316612	DE	On-Demand	Anodyne	CAPN1	81	42
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)COCc1ccccc1	ZINC000875316612	DE	On-Demand	Anodyne	CAPN2	112	39
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)COCc1ccccc1	ZINC000875316612	DE	On-Demand	Anodyne	ACE2	43	36
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)COCc1ccccc1	ZINC000875316612	DE	On-Demand	Anodyne	NPR	70	35
CO[C@@]1(C)C[C@@H](NC(=O)C(=O)NCc2nc(-c3ccncc3)cs2)C1(C)C	ZINC000875316631	GE	On-Demand	Anodyne	ROCK2	16	40
CO[C@@]1(C)C[C@H](NC(=O)C(=O)NCc2nc(-c3ccncc3)cs2)C1(C)C	ZINC000875316632	GE	On-Demand	Anodyne	ROCK2	16	40
COc1ccc(N=C2NC(=O)[C@H](CC(=O)Nc3cccc([N+](=O)[O-])c3)S2)cc1OC	ZINC000875316668	IF	On-Demand	Mild	CACNA1C	52	40
COc1ccc(N=C2NC(=O)[C@H](CC(=O)Nc3cccc([N+](=O)[O-])c3)S2)cc1OC	ZINC000875316668	IF	On-Demand	Mild	CACNA1D	84	40
COc1ccc(N=C2NC(=O)[C@H](CC(=O)Nc3cccc([N+](=O)[O-])c3)S2)cc1OC	ZINC000875316668	IF	On-Demand	Mild	ENPP1	65	32
COc1ccc(N=C2NC(=O)[C@@H](CC(=O)Nc3cccc([N+](=O)[O-])c3)S2)cc1OC	ZINC000875316670	IF	On-Demand	Mild	CACNA1C	52	40
COc1ccc(N=C2NC(=O)[C@@H](CC(=O)Nc3cccc([N+](=O)[O-])c3)S2)cc1OC	ZINC000875316670	IF	On-Demand	Mild	CACNA1D	84	40
COc1ccc(N=C2NC(=O)[C@@H](CC(=O)Nc3cccc([N+](=O)[O-])c3)S2)cc1OC	ZINC000875316670	IF	On-Demand	Mild	ENPP1	65	32
COc1ccc(N=C2NC(=O)[C@H](CC(=O)Nc3cc(Cl)cc(Cl)c3)S2)cc1OC	ZINC000875316686	JI	On-Demand	Mild	ENPP1	67	37
COc1ccc(N=C2NC(=O)[C@@H](CC(=O)Nc3cc(Cl)cc(Cl)c3)S2)cc1OC	ZINC000875316688	JI	On-Demand	Mild	ENPP1	67	37
CCCOc1ccc(NC(=O)C[C@@H]2SC(=Nc3ccc(OC)c(OC)c3)NC2=O)cc1	ZINC000875316689	IH	On-Demand	Mild	TSHR	42	33
CCCOc1ccc(NC(=O)C[C@@H]2SC(=Nc3ccc(OC)c(OC)c3)NC2=O)cc1	ZINC000875316689	IH	On-Demand	Mild	ENPP1	68	34
CCCOc1ccc(NC(=O)C[C@H]2SC(=Nc3ccc(OC)c(OC)c3)NC2=O)cc1	ZINC000875316690	IH	On-Demand	Mild	TSHR	42	33
CCCOc1ccc(NC(=O)C[C@H]2SC(=Nc3ccc(OC)c(OC)c3)NC2=O)cc1	ZINC000875316690	IH	On-Demand	Mild	ENPP1	68	34
C#CCCCNC(=O)N[C@@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875316716	DD	On-Demand	Mild	MTNR1A	44	43
C#CCCCNC(=O)N[C@@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875316716	DD	On-Demand	Mild	MTNR1B	40	43
C#CCCCNC(=O)N[C@@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875316717	DD	On-Demand	Mild	MTNR1A	44	43
C#CCCCNC(=O)N[C@@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875316717	DD	On-Demand	Mild	MTNR1B	40	43
C#CCCCNC(=O)N[C@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875316718	DD	On-Demand	Mild	MTNR1A	44	43
C#CCCCNC(=O)N[C@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875316718	DD	On-Demand	Mild	MTNR1B	40	43
C#CCCCNC(=O)N[C@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875316719	DD	On-Demand	Mild	MTNR1A	44	43
C#CCCCNC(=O)N[C@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875316719	DD	On-Demand	Mild	MTNR1B	40	43
NC(=O)COc1cccc(CNC(=O)NCC2CCC3(CC2)CC3)c1	ZINC000875316737	EE	On-Demand	Anodyne	HRH2	23	41
NC(=O)COc1cccc(CNC(=O)NCC2CCC3(CC2)CC3)c1	ZINC000875316737	EE	On-Demand	Anodyne	PDS	44	33
CCC1(CC)CCCN1C(=O)NCc1cccc(OCC(N)=O)c1	ZINC000875316745	EE	On-Demand	Anodyne	HRH2	29	41
CCC1(CC)CCCN1C(=O)NCc1cccc(OCC(N)=O)c1	ZINC000875316745	EE	On-Demand	Anodyne	SLC12A5	61	34
CCC1(CC)CCCN1C(=O)NCc1cccc(OCC(N)=O)c1	ZINC000875316745	EE	On-Demand	Anodyne	PDS	50	33
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H](C)Oc2ccc(OC)cc2)C1	ZINC000875316753	FE	On-Demand	Anodyne	MTNR1A	15	44
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H](C)Oc2ccc(OC)cc2)C1	ZINC000875316754	FE	On-Demand	Anodyne	MTNR1A	15	44
C#C[C@@H]1CC[C@@H](NC(=O)NCc2cccc(OCC(N)=O)c2)CC1	ZINC000875316775	ED	On-Demand	Mild	HRH2	22	47
CS[C@@H]1C[C@@H](NC(=O)NCc2cccc(OCC(N)=O)c2)C1	ZINC000875316797	DD	On-Demand	Anodyne	PDS	67	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)Oc1ccc(OC)cc1	ZINC000875316801	FE	On-Demand	Anodyne	SLC6A4	27	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)Oc1ccc(OC)cc1	ZINC000875316801	FE	On-Demand	Anodyne	SLC6A3	54	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)Oc1ccc(OC)cc1	ZINC000875316802	FE	On-Demand	Anodyne	SLC6A4	27	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)Oc1ccc(OC)cc1	ZINC000875316802	FE	On-Demand	Anodyne	SLC6A3	54	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)Oc1ccc(OC)cc1	ZINC000875316806	FE	On-Demand	Anodyne	SLC6A4	27	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)Oc1ccc(OC)cc1	ZINC000875316806	FE	On-Demand	Anodyne	SLC6A3	54	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)Oc1ccc(OC)cc1	ZINC000875316809	FE	On-Demand	Anodyne	SLC6A4	27	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)Oc1ccc(OC)cc1	ZINC000875316809	FE	On-Demand	Anodyne	SLC6A3	54	45
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2CCSC2)CC1	ZINC000875316817	EG	On-Demand	Anodyne	EPHX2	15	40
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2CCSC2)CC1	ZINC000875316817	EG	On-Demand	Anodyne	RBP4	31	40
COc1ccccc1[C@H]1CCCN(C(=O)N[C@H]2CCSC2)CC1	ZINC000875316821	EG	On-Demand	Anodyne	EPHX2	15	40
COc1ccccc1[C@H]1CCCN(C(=O)N[C@H]2CCSC2)CC1	ZINC000875316821	EG	On-Demand	Anodyne	RBP4	31	40
COCCN(CC1CCN(C)CC1)C(=O)NCc1cccc(OCC(N)=O)c1	ZINC000875316822	GD	On-Demand	Anodyne	ACKR3	50	31
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CCSC2)CC1	ZINC000875316824	EG	On-Demand	Anodyne	EPHX2	15	40
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CCSC2)CC1	ZINC000875316824	EG	On-Demand	Anodyne	RBP4	31	40
COc1ccccc1[C@H]1CCCN(C(=O)N[C@@H]2CCSC2)CC1	ZINC000875316827	EG	On-Demand	Anodyne	EPHX2	15	40
COc1ccccc1[C@H]1CCCN(C(=O)N[C@@H]2CCSC2)CC1	ZINC000875316827	EG	On-Demand	Anodyne	RBP4	31	40
COc1ccc(O[C@H](C)CNC(=O)NNc2cccc(C)n2)cc1	ZINC000875316865	EE	On-Demand	Reactive	MTNR1A	25	52
COc1ccc(O[C@H](C)CNC(=O)NNc2cccc(C)n2)cc1	ZINC000875316865	EE	On-Demand	Reactive	MTNR1B	22	52
COc1ccc(O[C@H](C)CNC(=O)NNc2cccc(C)n2)cc1	ZINC000875316865	EE	On-Demand	Reactive	GRM5	17	42
COc1ccc(O[C@@H](C)CNC(=O)NNc2cccc(C)n2)cc1	ZINC000875316866	EE	On-Demand	Reactive	MTNR1A	25	52
COc1ccc(O[C@@H](C)CNC(=O)NNc2cccc(C)n2)cc1	ZINC000875316866	EE	On-Demand	Reactive	MTNR1B	22	52
COc1ccc(O[C@@H](C)CNC(=O)NNc2cccc(C)n2)cc1	ZINC000875316866	EE	On-Demand	Reactive	GRM5	17	42
O=C(NCCC1CC1)NC1CC(Nc2ccccc2)C1	ZINC000875316914	CF	On-Demand	Anodyne	EPHX2	18	46
O=C(NCCC1CC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875316946	CF	On-Demand	Anodyne	F2	35	42
O=C(NCCC1CC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875316946	CF	On-Demand	Anodyne	PRSS1	17	42
O=C(NCCC1CC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875316946	CF	On-Demand	Anodyne	PREP	44	38
O=C(NCCC1CC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875316948	CF	On-Demand	Anodyne	F2	35	42
O=C(NCCC1CC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875316948	CF	On-Demand	Anodyne	PRSS1	17	42
O=C(NCCC1CC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875316948	CF	On-Demand	Anodyne	PREP	44	38
O=C(NCCC1CC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875316949	CF	On-Demand	Anodyne	F2	35	42
O=C(NCCC1CC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875316949	CF	On-Demand	Anodyne	PRSS1	17	42
O=C(NCCC1CC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875316949	CF	On-Demand	Anodyne	PREP	44	38
O=C(NCCC1CC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875316951	CF	On-Demand	Anodyne	F2	35	42
O=C(NCCC1CC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875316951	CF	On-Demand	Anodyne	PRSS1	17	42
O=C(NCCC1CC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875316951	CF	On-Demand	Anodyne	PREP	44	38
COC(=O)C1=NO[C@]2(CCN(C(=O)N[C@H](C)COCc3ccccc3)C2)C1	ZINC000875316996	GD	On-Demand	Anodyne	GHRHR	25	43
COC(=O)C1=NO[C@]2(CCN(C(=O)N[C@H](C)COCc3ccccc3)C2)C1	ZINC000875316996	GD	On-Demand	Anodyne	GHSR	18	43
COC(=O)C1=NO[C@]2(CCN(C(=O)N[C@@H](C)COCc3ccccc3)C2)C1	ZINC000875316999	GD	On-Demand	Anodyne	GHRHR	25	43
COC(=O)C1=NO[C@]2(CCN(C(=O)N[C@@H](C)COCc3ccccc3)C2)C1	ZINC000875316999	GD	On-Demand	Anodyne	GHSR	18	43
COC(=O)C1=NO[C@@]2(CCN(C(=O)N[C@H](C)COCc3ccccc3)C2)C1	ZINC000875317001	GD	On-Demand	Anodyne	GHRHR	25	43
COC(=O)C1=NO[C@@]2(CCN(C(=O)N[C@H](C)COCc3ccccc3)C2)C1	ZINC000875317001	GD	On-Demand	Anodyne	GHSR	18	43
COC(=O)C1=NO[C@@]2(CCN(C(=O)N[C@@H](C)COCc3ccccc3)C2)C1	ZINC000875317002	GD	On-Demand	Anodyne	GHRHR	25	43
COC(=O)C1=NO[C@@]2(CCN(C(=O)N[C@@H](C)COCc3ccccc3)C2)C1	ZINC000875317002	GD	On-Demand	Anodyne	GHSR	18	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)COCc2ccccc2)C1	ZINC000875317009	EE	On-Demand	Anodyne	ACE	43	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)COCc2ccccc2)C1	ZINC000875317009	EE	On-Demand	Anodyne	GHRHR	40	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)COCc2ccccc2)C1	ZINC000875317009	EE	On-Demand	Anodyne	CTSB	42	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)COCc2ccccc2)C1	ZINC000875317009	EE	On-Demand	Anodyne	CYSP_TRYCR	40	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)COCc2ccccc2)C1	ZINC000875317009	EE	On-Demand	Anodyne	CTSK	41	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)COCc2ccccc2)C1	ZINC000875317009	EE	On-Demand	Anodyne	CAPNS1	52	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)COCc2ccccc2)C1	ZINC000875317009	EE	On-Demand	Anodyne	CTSS	38	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)COCc2ccccc2)C1	ZINC000875317009	EE	On-Demand	Anodyne	GHSR	40	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)COCc2ccccc2)C1	ZINC000875317009	EE	On-Demand	Anodyne	CAPN1	62	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)COCc2ccccc2)C1	ZINC000875317009	EE	On-Demand	Anodyne	CAPN2	80	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)COCc2ccccc2)C1	ZINC000875317009	EE	On-Demand	Anodyne	NPR	43	33
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)COCc2ccccc2)C1	ZINC000875317009	EE	On-Demand	Anodyne	Q6PRC7_IXORI	54	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)COCc2ccccc2)C1	ZINC000875317010	EE	On-Demand	Anodyne	ACE	43	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)COCc2ccccc2)C1	ZINC000875317010	EE	On-Demand	Anodyne	GHRHR	40	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)COCc2ccccc2)C1	ZINC000875317010	EE	On-Demand	Anodyne	CTSB	42	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)COCc2ccccc2)C1	ZINC000875317010	EE	On-Demand	Anodyne	CYSP_TRYCR	40	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)COCc2ccccc2)C1	ZINC000875317010	EE	On-Demand	Anodyne	CTSK	41	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)COCc2ccccc2)C1	ZINC000875317010	EE	On-Demand	Anodyne	CAPNS1	52	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)COCc2ccccc2)C1	ZINC000875317010	EE	On-Demand	Anodyne	CTSS	38	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)COCc2ccccc2)C1	ZINC000875317010	EE	On-Demand	Anodyne	GHSR	40	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)COCc2ccccc2)C1	ZINC000875317010	EE	On-Demand	Anodyne	CAPN1	62	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)COCc2ccccc2)C1	ZINC000875317010	EE	On-Demand	Anodyne	CAPN2	80	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)COCc2ccccc2)C1	ZINC000875317010	EE	On-Demand	Anodyne	NPR	43	33
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)COCc2ccccc2)C1	ZINC000875317010	EE	On-Demand	Anodyne	Q6PRC7_IXORI	54	38
CCC(CC)(CNC(=O)NCc1cccc(OCC(N)=O)c1)C(F)(F)F	ZINC000875317067	GF	On-Demand	Anodyne	ROCK2	23	41
CCC(CC)(CNC(=O)NCc1cccc(OCC(N)=O)c1)C(F)(F)F	ZINC000875317067	GF	On-Demand	Anodyne	PDS	73	40
COc1ccc(O[C@H](C)CNC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875317086	EF	On-Demand	Clean	MTNR1A	24	48
COc1ccc(O[C@H](C)CNC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875317086	EF	On-Demand	Clean	MTNR1B	21	48
COc1ccc(O[C@@H](C)CNC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875317087	EF	On-Demand	Clean	MTNR1A	24	48
COc1ccc(O[C@@H](C)CNC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875317087	EF	On-Demand	Clean	MTNR1B	21	48
CC(C)(C)OC(=O)N1CC[C@H]2[C@H]1CCCN2C(=O)NCCC1CC1	ZINC000875317140	EF	On-Demand	Anodyne	PREP	18	43
CC(C)(C)OC(=O)N1CC[C@H]2[C@@H]1CCCN2C(=O)NCCC1CC1	ZINC000875317141	EF	On-Demand	Anodyne	PREP	18	43
CC(C)(C)OC(=O)N1CC[C@@H]2[C@H]1CCCN2C(=O)NCCC1CC1	ZINC000875317142	EF	On-Demand	Anodyne	PREP	18	43
CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H]1CCCN2C(=O)NCCC1CC1	ZINC000875317143	EF	On-Demand	Anodyne	PREP	18	43
Cc1cc(N2CC[C@H](NC(=O)N3CC[C@@]4(CCc5ccccc54)C3)C2=O)n(C)n1	ZINC000875317150	GE	On-Demand	Anodyne	OXTR	53	36
Cc1cc(N2CC[C@H](NC(=O)N3CC[C@]4(CCc5ccccc54)C3)C2=O)n(C)n1	ZINC000875317152	GE	On-Demand	Anodyne	OXTR	53	36
COc1ccc(N=C2NC(=O)[C@H](CC(=O)Nc3ccc(SC(F)F)cc3)S2)cc1OC	ZINC000875317180	JI	On-Demand	Mild	ENPP1	68	33
COc1ccc(N=C2NC(=O)[C@@H](CC(=O)Nc3ccc(SC(F)F)cc3)S2)cc1OC	ZINC000875317183	JI	On-Demand	Mild	ENPP1	68	33
C#CCCNC(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875317208	DF	On-Demand	Mild	DRD4	43	33
COc1ccc(N=C2NC(=O)[C@@H](CC(=O)Nc3ccc(OC)c(OC)c3)S2)cc1OC	ZINC000875317255	IF	On-Demand	Mild	ENPP1	81	39
COc1ccc(N=C2NC(=O)[C@H](CC(=O)Nc3ccc(OC)c(OC)c3)S2)cc1OC	ZINC000875317256	IF	On-Demand	Mild	ENPP1	81	39
O=C(NCCC1CC1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875317264	DG	On-Demand	Anodyne	FKBP1A	31	42
O=C(NCCC1CC1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875317265	DG	On-Demand	Anodyne	FKBP1A	31	42
O=C(NCCC1CC1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875317266	DG	On-Demand	Anodyne	FKBP1A	31	42
O=C(NCCC1CC1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875317267	DG	On-Demand	Anodyne	FKBP1A	31	42
Cc1nnc(NNC(=O)N[C@H](C)COCc2ccccc2)n1C	ZINC000875317297	DD	On-Demand	Reactive	CAPN2	50	36
COc1ccc(O[C@H](C)CNC(=O)NC2(C)CC(F)(F)C2)cc1	ZINC000875317336	EF	On-Demand	Anodyne	MTNR1A	18	47
COc1ccc(O[C@@H](C)CNC(=O)NC2(C)CC(F)(F)C2)cc1	ZINC000875317337	EF	On-Demand	Anodyne	MTNR1A	18	47
COC(=O)C1(O)CN(C(=O)NC[C@@H](C)Oc2ccc(OC)cc2)C1	ZINC000875317338	EC	On-Demand	Anodyne	MTNR1A	18	45
COC(=O)C1(O)CN(C(=O)NC[C@@H](C)Oc2ccc(OC)cc2)C1	ZINC000875317338	EC	On-Demand	Anodyne	MTNR1B	17	45
COC(=O)C1(O)CN(C(=O)NC[C@H](C)Oc2ccc(OC)cc2)C1	ZINC000875317339	EC	On-Demand	Anodyne	MTNR1A	18	45
COC(=O)C1(O)CN(C(=O)NC[C@H](C)Oc2ccc(OC)cc2)C1	ZINC000875317339	EC	On-Demand	Anodyne	MTNR1B	17	45
Cc1nnc(NNC(=O)N[C@@H](C)COCc2ccccc2)n1C	ZINC000875317403	DD	On-Demand	Reactive	CAPN2	50	36
COc1ccc(N=C2NC(=O)[C@H](CC(=O)Nc3ccccc3)S2)cc1OC	ZINC000875317423	GF	On-Demand	Mild	TSHR	40	31
COc1ccc(N=C2NC(=O)[C@H](CC(=O)Nc3ccccc3)S2)cc1OC	ZINC000875317423	GF	On-Demand	Mild	ENPP1	67	33
COc1ccc(N=C2NC(=O)[C@@H](CC(=O)Nc3ccccc3)S2)cc1OC	ZINC000875317424	GF	On-Demand	Mild	TSHR	40	31
COc1ccc(N=C2NC(=O)[C@@H](CC(=O)Nc3ccccc3)S2)cc1OC	ZINC000875317424	GF	On-Demand	Mild	ENPP1	67	33
C[C@@H](CN(C)C(=O)C(=O)N[C@H](C)CCC1CC1)NC(=O)OC(C)(C)C	ZINC000875317475	FE	On-Demand	Anodyne	CTSK	15	46
C[C@@H](CN(C)C(=O)C(=O)N[C@@H](C)CCC1CC1)NC(=O)OC(C)(C)C	ZINC000875317477	FE	On-Demand	Anodyne	CTSK	15	46
O=C(NCCOC1CCC1)N(Cc1cccc(O)c1)[C@@H]1CC[C@@H](O)CC1	ZINC000875317486	FF	On-Demand	Anodyne	HSD17B2	18	41
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCSC3)cn2)cc1	ZINC000875317489	EE	On-Demand	Mild	ITK	19	49
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCSC3)cn2)cc1	ZINC000875317489	EE	On-Demand	Mild	PANC	54	37
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCSC3)cn2)cc1	ZINC000875317490	EE	On-Demand	Mild	ITK	19	49
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCSC3)cn2)cc1	ZINC000875317490	EE	On-Demand	Mild	PANC	54	37
O=C(NCCC1CC1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875317503	CE	On-Demand	Anodyne	ADRB1	22	40
O=C(NCCC1CC1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875317503	CE	On-Demand	Anodyne	PTGER4	17	43
O=C(NCCC1CC1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875317504	CE	On-Demand	Anodyne	ADRB1	22	40
O=C(NCCC1CC1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875317504	CE	On-Demand	Anodyne	PTGER4	17	43
C#CCCCNC(=O)N[C@](C)(CO)Cc1ccc(OC)cc1	ZINC000875317572	DD	On-Demand	Mild	PROKR1	41	30
C#CCCCNC(=O)N[C@@](C)(CO)Cc1ccc(OC)cc1	ZINC000875317573	DD	On-Demand	Mild	PROKR1	41	30
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)COCc1ccccc1	ZINC000875317574	EE	On-Demand	Anodyne	SLC6A4	26	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)COCc1ccccc1	ZINC000875317574	EE	On-Demand	Anodyne	SLC6A3	59	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)COCc1ccccc1	ZINC000875317574	EE	On-Demand	Anodyne	CAPN1	41	35
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)COCc1ccccc1	ZINC000875317579	EE	On-Demand	Anodyne	SLC6A4	26	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)COCc1ccccc1	ZINC000875317579	EE	On-Demand	Anodyne	SLC6A3	59	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)COCc1ccccc1	ZINC000875317579	EE	On-Demand	Anodyne	CAPN1	41	35
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)COCc1ccccc1	ZINC000875317581	EE	On-Demand	Anodyne	SLC6A4	26	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)COCc1ccccc1	ZINC000875317581	EE	On-Demand	Anodyne	SLC6A3	59	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)COCc1ccccc1	ZINC000875317581	EE	On-Demand	Anodyne	CAPN1	41	35
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)COCc1ccccc1	ZINC000875317584	EE	On-Demand	Anodyne	SLC6A4	26	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)COCc1ccccc1	ZINC000875317584	EE	On-Demand	Anodyne	SLC6A3	59	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)COCc1ccccc1	ZINC000875317584	EE	On-Demand	Anodyne	CAPN1	41	35
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCCC2CC2)[C@H](O)C1	ZINC000875317603	ED	On-Demand	Anodyne	GPR119	34	40
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCCC2CC2)[C@@H](O)C1	ZINC000875317607	ED	On-Demand	Anodyne	GPR119	34	40
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NCCC2CC2)[C@H](O)C1	ZINC000875317611	ED	On-Demand	Anodyne	GPR119	34	40
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NCCC2CC2)[C@@H](O)C1	ZINC000875317615	ED	On-Demand	Anodyne	GPR119	34	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)Sc1ccccc1	ZINC000875317619	EF	On-Demand	Anodyne	SLC6A4	29	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)Sc1ccccc1	ZINC000875317619	EF	On-Demand	Anodyne	SLC6A3	58	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)Sc1ccccc1	ZINC000875317633	EF	On-Demand	Anodyne	SLC6A4	29	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)Sc1ccccc1	ZINC000875317633	EF	On-Demand	Anodyne	SLC6A3	58	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)Sc1ccccc1	ZINC000875317636	EF	On-Demand	Anodyne	SLC6A4	29	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)Sc1ccccc1	ZINC000875317636	EF	On-Demand	Anodyne	SLC6A3	58	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)Sc1ccccc1	ZINC000875317639	EF	On-Demand	Anodyne	SLC6A4	29	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)Sc1ccccc1	ZINC000875317639	EF	On-Demand	Anodyne	SLC6A3	58	44
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CC[C@@H](Cc3ccccc3)C2)CC1	ZINC000875317645	FE	On-Demand	Anodyne	GRIN2B	57	40
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CC[C@@H](Cc3ccccc3)C2)CC1	ZINC000875317645	FE	On-Demand	Anodyne	SIGMAR1	21	40
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CC[C@H](Cc3ccccc3)C2)CC1	ZINC000875317649	FE	On-Demand	Anodyne	GRIN2B	57	40
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CC[C@H](Cc3ccccc3)C2)CC1	ZINC000875317649	FE	On-Demand	Anodyne	SIGMAR1	21	40
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CC[C@H](Cc3ccccc3)C2)CC1	ZINC000875317653	FE	On-Demand	Anodyne	GRIN2B	57	40
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CC[C@H](Cc3ccccc3)C2)CC1	ZINC000875317653	FE	On-Demand	Anodyne	SIGMAR1	21	40
C#CCCCNC(=O)N(CC)[C@H](C)[C@@H](O)c1ccccc1	ZINC000875317655	CF	On-Demand	Mild	NPY5R	22	42
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CC[C@@H](Cc3ccccc3)C2)CC1	ZINC000875317656	FE	On-Demand	Anodyne	GRIN2B	57	40
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CC[C@@H](Cc3ccccc3)C2)CC1	ZINC000875317656	FE	On-Demand	Anodyne	SIGMAR1	21	40
C#CCCCNC(=O)N(CC)[C@@H](C)[C@@H](O)c1ccccc1	ZINC000875317658	CF	On-Demand	Mild	NPY5R	22	42
C#CCCCNC(=O)N(CC)[C@@H](C)[C@H](O)c1ccccc1	ZINC000875317661	CF	On-Demand	Mild	NPY5R	22	42
C#CCCCNC(=O)N(CC)[C@H](C)[C@H](O)c1ccccc1	ZINC000875317665	CF	On-Demand	Mild	NPY5R	22	42
COc1ccc(N=C2NC(=O)[C@@H](CC(=O)Nc3ccc(C(C)=O)cc3)S2)cc1OC	ZINC000875317749	IG	On-Demand	Mild	ENPP1	68	33
COc1ccc(N=C2NC(=O)[C@H](CC(=O)Nc3ccc(C(C)=O)cc3)S2)cc1OC	ZINC000875317753	IG	On-Demand	Mild	ENPP1	68	33
CCCCCCCNC(=O)C(=O)N[C@H]1CCN(C(C)=O)c2ccccc21	ZINC000875317756	FF	On-Demand	Mild	HTR1A	21	42
CCCCCCCNC(=O)C(=O)N[C@H]1CCN(C(C)=O)c2ccccc21	ZINC000875317756	FF	On-Demand	Mild	DRD2	24	41
CCCCCCCNC(=O)C(=O)N[C@H]1CCN(C(C)=O)c2ccccc21	ZINC000875317756	FF	On-Demand	Mild	DRD3	50	35
CCCCCCCNC(=O)C(=O)N[C@H]1CCN(C(C)=O)c2ccccc21	ZINC000875317756	FF	On-Demand	Mild	ASAH1	63	34
CCCCCCCNC(=O)C(=O)N[C@@H]1CCN(C(C)=O)c2ccccc21	ZINC000875317759	FF	On-Demand	Mild	HTR1A	21	42
CCCCCCCNC(=O)C(=O)N[C@@H]1CCN(C(C)=O)c2ccccc21	ZINC000875317759	FF	On-Demand	Mild	DRD2	24	41
CCCCCCCNC(=O)C(=O)N[C@@H]1CCN(C(C)=O)c2ccccc21	ZINC000875317759	FF	On-Demand	Mild	DRD3	50	35
CCCCCCCNC(=O)C(=O)N[C@@H]1CCN(C(C)=O)c2ccccc21	ZINC000875317759	FF	On-Demand	Mild	ASAH1	63	34
C#CCCCNC(=O)NNc1ccc(OC)cc1Br	ZINC000875317761	EE	On-Demand	Reactive	MTNR1A	45	40
C[S@](=N)(=O)N1CCN(C(=O)C(=O)N[C@@H]2CC[C@@H](Cc3ccccc3)C2)CC1	ZINC000875317802	GD	On-Demand	Anodyne	GRIN2B	53	39
C[S@](=N)(=O)N1CCN(C(=O)C(=O)N[C@@H]2CC[C@@H](Cc3ccccc3)C2)CC1	ZINC000875317802	GD	On-Demand	Anodyne	SIGMAR1	17	40
C[S@](=N)(=O)N1CCN(C(=O)C(=O)N[C@@H]2CC[C@H](Cc3ccccc3)C2)CC1	ZINC000875317806	GD	On-Demand	Anodyne	GRIN2B	53	39
C[S@](=N)(=O)N1CCN(C(=O)C(=O)N[C@@H]2CC[C@H](Cc3ccccc3)C2)CC1	ZINC000875317806	GD	On-Demand	Anodyne	SIGMAR1	17	40
C[S@](=N)(=O)N1CCN(C(=O)C(=O)N[C@H]2CC[C@@H](Cc3ccccc3)C2)CC1	ZINC000875317809	GD	On-Demand	Anodyne	GRIN2B	53	39
C[S@](=N)(=O)N1CCN(C(=O)C(=O)N[C@H]2CC[C@@H](Cc3ccccc3)C2)CC1	ZINC000875317809	GD	On-Demand	Anodyne	SIGMAR1	17	40
C[S@](=N)(=O)N1CCN(C(=O)C(=O)N[C@H]2CC[C@H](Cc3ccccc3)C2)CC1	ZINC000875317811	GD	On-Demand	Anodyne	GRIN2B	53	39
C[S@](=N)(=O)N1CCN(C(=O)C(=O)N[C@H]2CC[C@H](Cc3ccccc3)C2)CC1	ZINC000875317811	GD	On-Demand	Anodyne	SIGMAR1	17	40
NC(=O)COc1cccc(CNC(=O)NCCCCC2CC2)c1	ZINC000875317835	DD	On-Demand	Anodyne	HRH2	30	47
NC(=O)COc1cccc(CNC(=O)NCCCCC2CC2)c1	ZINC000875317835	DD	On-Demand	Anodyne	PDS	42	35
N#Cc1ccc(Cn2cc(NC(=O)NC[C@H]3OCCc4sccc43)cn2)cc1	ZINC000875317849	GG	On-Demand	Mild	ITK	17	46
N#Cc1ccc(Cn2cc(NC(=O)NC[C@H]3OCCc4sccc43)cn2)cc1	ZINC000875317849	GG	On-Demand	Mild	PANC	41	35
N#Cc1ccc(Cn2cc(NC(=O)NC[C@@H]3OCCc4sccc43)cn2)cc1	ZINC000875317850	GG	On-Demand	Mild	ITK	17	46
N#Cc1ccc(Cn2cc(NC(=O)NC[C@@H]3OCCc4sccc43)cn2)cc1	ZINC000875317850	GG	On-Demand	Mild	PANC	41	35
C#CCCCNC(=O)N[C@H](C)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000875317979	EH	On-Demand	Mild	PRCP	25	50
C#CCCCNC(=O)N[C@@H](C)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000875317982	EH	On-Demand	Mild	PRCP	25	50
O=C(N[C@@H]1CCSC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875318126	DE	On-Demand	Anodyne	EPHX2	18	44
O=C(N[C@H]1CCSC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875318128	DE	On-Demand	Anodyne	EPHX2	18	44
O=C(N[C@H]1CCSC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875318132	DE	On-Demand	Anodyne	EPHX2	18	44
O=C(N[C@@H]1CCSC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875318135	DE	On-Demand	Anodyne	EPHX2	18	44
COc1ccc(N=C2NC(=O)[C@H](CC(=O)Nc3ccc(C)c(Cl)c3)S2)cc1OC	ZINC000875318197	IH	On-Demand	Mild	ENPP1	71	37
COc1ccc(N=C2NC(=O)[C@@H](CC(=O)Nc3ccc(C)c(Cl)c3)S2)cc1OC	ZINC000875318202	IH	On-Demand	Mild	ENPP1	71	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC(C1CC1)C1CC1	ZINC000875318268	DE	On-Demand	Anodyne	SLC6A3	40	38
O=C(NCCOC1CCC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875318273	DE	On-Demand	Anodyne	EPHX2	21	44
O=C(NCCOC1CCC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875318275	DE	On-Demand	Anodyne	EPHX2	21	44
NC(=O)COc1cccc(CNC(=O)N2C[C@@H]3C[C@H]2CN3c2ccccc2)c1	ZINC000875318340	GD	On-Demand	Anodyne	PDS	50	34
NC(=O)COc1cccc(CNC(=O)NCc2ccc(C(F)(F)F)s2)c1	ZINC000875318357	GF	On-Demand	Anodyne	PDS	65	41
CO[C@H]1C[C@H](NC(=O)C(=O)NCc2nc(-c3ccncc3)cs2)C1(C)C	ZINC000875318363	FD	On-Demand	Anodyne	ROCK1	23	40
CO[C@H]1C[C@H](NC(=O)C(=O)NCc2nc(-c3ccncc3)cs2)C1(C)C	ZINC000875318363	FD	On-Demand	Anodyne	ROCK2	17	41
CO[C@@H]1C[C@@H](NC(=O)C(=O)NCc2nc(-c3ccncc3)cs2)C1(C)C	ZINC000875318366	FD	On-Demand	Anodyne	ROCK1	23	40
CO[C@@H]1C[C@@H](NC(=O)C(=O)NCc2nc(-c3ccncc3)cs2)C1(C)C	ZINC000875318366	FD	On-Demand	Anodyne	ROCK2	17	41
COc1ccc(O[C@@H](C)CNC(=O)NC[C@H]2C[C@H](O)C2)cc1	ZINC000875318437	DD	On-Demand	Anodyne	MTNR1A	22	47
COc1ccc(O[C@@H](C)CNC(=O)NC[C@H]2C[C@H](O)C2)cc1	ZINC000875318437	DD	On-Demand	Anodyne	MTNR1B	15	47
COc1ccc(O[C@H](C)CNC(=O)NC[C@H]2C[C@H](O)C2)cc1	ZINC000875318439	DD	On-Demand	Anodyne	MTNR1A	22	47
COc1ccc(O[C@H](C)CNC(=O)NC[C@H]2C[C@H](O)C2)cc1	ZINC000875318439	DD	On-Demand	Anodyne	MTNR1B	15	47
COc1ccc(N=C2NC(=O)[C@H](CC(=O)NCc3ccccc3)S2)cc1OC	ZINC000875318524	GF	On-Demand	Mild	HCRTR2	15	42
COc1ccc(N=C2NC(=O)[C@H](CC(=O)NCc3ccccc3)S2)cc1OC	ZINC000875318524	GF	On-Demand	Mild	CACNA1G	23	41
COc1ccc(N=C2NC(=O)[C@@H](CC(=O)NCc3ccccc3)S2)cc1OC	ZINC000875318526	GF	On-Demand	Mild	HCRTR2	15	42
COc1ccc(N=C2NC(=O)[C@@H](CC(=O)NCc3ccccc3)S2)cc1OC	ZINC000875318526	GF	On-Demand	Mild	CACNA1G	23	41
COc1ccc([N+](=O)[O-])cc1NC(=O)C[C@@H]1SC(=Nc2ccc(OC)c(OC)c2)NC1=O	ZINC000875318558	JF	On-Demand	Mild	KCNMA1	19	43
COc1ccc([N+](=O)[O-])cc1NC(=O)C[C@H]1SC(=Nc2ccc(OC)c(OC)c2)NC1=O	ZINC000875318561	JF	On-Demand	Mild	KCNMA1	19	43
O=C(NCC(C1CC1)C1CC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875318582	FH	On-Demand	Anodyne	SMO	40	46
O=C(NCC(C1CC1)C1CC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875318582	FH	On-Demand	Anodyne	ETHR	63	52
CCc1cnc(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)s1	ZINC000875318743	FF	On-Demand	Anodyne	PDS	47	37
CCc1cnc(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)s1	ZINC000875318744	FF	On-Demand	Anodyne	PDS	47	37
NC(=O)COc1cccc(CNC(=O)NCCC[C@H]2C=CCC2)c1	ZINC000875318863	EE	On-Demand	Anodyne	HRH2	26	43
NC(=O)COc1cccc(CNC(=O)NCCC[C@@H]2C=CCC2)c1	ZINC000875318864	EE	On-Demand	Anodyne	HRH2	26	43
CCN(C)C(=O)c1cccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318893	FG	On-Demand	Anodyne	CHRM2	18	45
CCN(C)C(=O)c1cccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318893	FG	On-Demand	Anodyne	DRD2	18	42
CCN(C)C(=O)c1cccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318893	FG	On-Demand	Anodyne	DRD4	48	42
CCN(C)C(=O)c1cccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318893	FG	On-Demand	Anodyne	ACHE	39	48
CCN(C)C(=O)c1cccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318893	FG	On-Demand	Anodyne	SLC6A1	56	37
CCN(C)C(=O)c1cccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318893	FG	On-Demand	Anodyne	OPRM1	17	44
CCN(C)C(=O)c1cccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318893	FG	On-Demand	Anodyne	DRD3	15	40
CCN(C)C(=O)c1cccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318893	FG	On-Demand	Anodyne	OPRD1	27	46
CCN(C)C(=O)c1cccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318893	FG	On-Demand	Anodyne	OPRK1	16	47
CCN(C)C(=O)c1cccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318893	FG	On-Demand	Anodyne	LTA4H	19	41
CCN(C)C(=O)c1cccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318893	FG	On-Demand	Anodyne	TACR2	34	42
CCN(C)C(=O)c1cccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318893	FG	On-Demand	Anodyne	SIGMAR1	43	46
CCN(C)C(=O)c1cccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318893	FG	On-Demand	Anodyne	CCR3	31	41
CCN(C)C(=O)c1cccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318893	FG	On-Demand	Anodyne	CCR5	40	40
CCN(C)C(=O)c1cccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318893	FG	On-Demand	Anodyne	SLC18A3	25	44
CCN(C)C(=O)c1cccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318893	FG	On-Demand	Anodyne	MLNR	40	40
CCN(C)C(=O)c1cccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318893	FG	On-Demand	Anodyne	S1PR1	16	42
CCN(C)C(=O)c1cccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318893	FG	On-Demand	Anodyne	S1PR5	22	42
CCN(C)C(=O)c1cccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318893	FG	On-Demand	Anodyne	MCHR1	22	42
CCN(C)C(=O)c1cccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318893	FG	On-Demand	Anodyne	CACNA1G	40	41
CCN(C)C(=O)c1cccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318895	FG	On-Demand	Anodyne	CHRM2	18	45
CCN(C)C(=O)c1cccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318895	FG	On-Demand	Anodyne	DRD2	18	42
CCN(C)C(=O)c1cccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318895	FG	On-Demand	Anodyne	DRD4	48	42
CCN(C)C(=O)c1cccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318895	FG	On-Demand	Anodyne	ACHE	39	48
CCN(C)C(=O)c1cccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318895	FG	On-Demand	Anodyne	SLC6A1	56	37
CCN(C)C(=O)c1cccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318895	FG	On-Demand	Anodyne	OPRM1	17	44
CCN(C)C(=O)c1cccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318895	FG	On-Demand	Anodyne	DRD3	15	40
CCN(C)C(=O)c1cccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318895	FG	On-Demand	Anodyne	OPRD1	27	46
CCN(C)C(=O)c1cccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318895	FG	On-Demand	Anodyne	OPRK1	16	47
CCN(C)C(=O)c1cccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318895	FG	On-Demand	Anodyne	LTA4H	19	41
CCN(C)C(=O)c1cccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318895	FG	On-Demand	Anodyne	TACR2	34	42
CCN(C)C(=O)c1cccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318895	FG	On-Demand	Anodyne	SIGMAR1	43	46
CCN(C)C(=O)c1cccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318895	FG	On-Demand	Anodyne	CCR3	31	41
CCN(C)C(=O)c1cccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318895	FG	On-Demand	Anodyne	CCR5	40	40
CCN(C)C(=O)c1cccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318895	FG	On-Demand	Anodyne	SLC18A3	25	44
CCN(C)C(=O)c1cccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318895	FG	On-Demand	Anodyne	MLNR	40	40
CCN(C)C(=O)c1cccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318895	FG	On-Demand	Anodyne	S1PR1	16	42
CCN(C)C(=O)c1cccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318895	FG	On-Demand	Anodyne	S1PR5	22	42
CCN(C)C(=O)c1cccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318895	FG	On-Demand	Anodyne	MCHR1	22	42
CCN(C)C(=O)c1cccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000875318895	FG	On-Demand	Anodyne	CACNA1G	40	41
COc1ccc(O[C@H](C)CNC(=O)NN=c2cc[nH]c(C)c2)cc1	ZINC000875318921	ED	On-Demand	Reactive	MTNR1A	17	44
COc1ccc(O[C@@H](C)CNC(=O)NN=c2cc[nH]c(C)c2)cc1	ZINC000875318925	ED	On-Demand	Reactive	MTNR1A	17	44
NC(=O)COc1cccc(CNC(=O)N[C@@H]2CCCC[C@@H]2F)c1	ZINC000875318932	DD	On-Demand	Anodyne	HRH2	24	42
NC(=O)COc1cccc(CNC(=O)N[C@@H]2CCCC[C@@H]2F)c1	ZINC000875318932	DD	On-Demand	Anodyne	PDS	45	35
COC(=O)N(C)NC(=O)N[C@H](C)COCc1ccccc1	ZINC000875318965	CD	On-Demand	Reactive	MME	26	41
COC(=O)N(C)NC(=O)N[C@H](C)COCc1ccccc1	ZINC000875318965	CD	On-Demand	Reactive	CTSB	48	35
COC(=O)N(C)NC(=O)N[C@H](C)COCc1ccccc1	ZINC000875318965	CD	On-Demand	Reactive	PAPA1_CARPA	41	35
COC(=O)N(C)NC(=O)N[C@H](C)COCc1ccccc1	ZINC000875318965	CD	On-Demand	Reactive	CTSK	21	41
COC(=O)N(C)NC(=O)N[C@H](C)COCc1ccccc1	ZINC000875318965	CD	On-Demand	Reactive	CAPNS1	52	35
COC(=O)N(C)NC(=O)N[C@H](C)COCc1ccccc1	ZINC000875318965	CD	On-Demand	Reactive	CAPN1	48	40
COC(=O)N(C)NC(=O)N[C@H](C)COCc1ccccc1	ZINC000875318965	CD	On-Demand	Reactive	CAPN2	58	37
COC(=O)N(C)NC(=O)N[C@H](C)COCc1ccccc1	ZINC000875318965	CD	On-Demand	Reactive	NPR	66	33
COC(=O)N(C)NC(=O)N[C@@H](C)COCc1ccccc1	ZINC000875318967	CD	On-Demand	Reactive	MME	26	41
COC(=O)N(C)NC(=O)N[C@@H](C)COCc1ccccc1	ZINC000875318967	CD	On-Demand	Reactive	CTSB	48	35
COC(=O)N(C)NC(=O)N[C@@H](C)COCc1ccccc1	ZINC000875318967	CD	On-Demand	Reactive	PAPA1_CARPA	41	35
COC(=O)N(C)NC(=O)N[C@@H](C)COCc1ccccc1	ZINC000875318967	CD	On-Demand	Reactive	CTSK	21	41
COC(=O)N(C)NC(=O)N[C@@H](C)COCc1ccccc1	ZINC000875318967	CD	On-Demand	Reactive	CAPNS1	52	35
COC(=O)N(C)NC(=O)N[C@@H](C)COCc1ccccc1	ZINC000875318967	CD	On-Demand	Reactive	CAPN1	48	40
COC(=O)N(C)NC(=O)N[C@@H](C)COCc1ccccc1	ZINC000875318967	CD	On-Demand	Reactive	CAPN2	58	37
COC(=O)N(C)NC(=O)N[C@@H](C)COCc1ccccc1	ZINC000875318967	CD	On-Demand	Reactive	NPR	66	33
COc1ccc(N=C2NC(=O)[C@H](CC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)S2)cc1OC	ZINC000875318983	JJ	On-Demand	Mild	ENPP1	68	36
COc1ccc(N=C2NC(=O)[C@H](CC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)S2)cc1OC	ZINC000875318983	JJ	On-Demand	Mild	IMDH_CRYPV	18	41
COc1ccc(N=C2NC(=O)[C@@H](CC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)S2)cc1OC	ZINC000875318993	JJ	On-Demand	Mild	ENPP1	68	36
COc1ccc(N=C2NC(=O)[C@@H](CC(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)S2)cc1OC	ZINC000875318993	JJ	On-Demand	Mild	IMDH_CRYPV	18	41
C#CCCCNC(=O)NCCc1ccc(OC)c(O)c1	ZINC000875319052	CD	On-Demand	Mild	INHA	87	36
C#CCCCNC(=O)NCCc1ccc(OC)c(O)c1	ZINC000875319052	CD	On-Demand	Mild	MTNR1A	16	48
C#CCCCNC(=O)NCCc1ccc(OC)c(O)c1	ZINC000875319052	CD	On-Demand	Mild	MTNR1B	15	48
COc1ccc(N=C2NC(=O)[C@H](CC(=O)Nc3ccc(Br)cc3)S2)cc1OC	ZINC000875319133	JH	On-Demand	Mild	ENPP1	71	37
O=C(NCCOC1CCC1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875319134	EE	On-Demand	Anodyne	ADRB1	32	54
COc1ccc(N=C2NC(=O)[C@@H](CC(=O)Nc3ccc(Br)cc3)S2)cc1OC	ZINC000875319135	JH	On-Demand	Mild	ENPP1	71	37
O=C(NCCOC1CCC1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875319136	EE	On-Demand	Anodyne	ADRB1	32	54
O=C(NCC(C1CC1)C1CC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875319147	FH	On-Demand	Anodyne	OPRL1	17	49
C[C@]1(C(F)(F)F)CN(C(=O)NCc2cccc(OCC(N)=O)c2)CCO1	ZINC000875319322	GD	On-Demand	Anodyne	PDS	45	37
NC(=O)COc1cccc(CNC(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)c1	ZINC000875319405	FE	On-Demand	Anodyne	PDS	40	38
NC(=O)COc1cccc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)c1	ZINC000875319407	GD	On-Demand	Anodyne	HRH2	28	45
NC(=O)COc1cccc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)c1	ZINC000875319407	GD	On-Demand	Anodyne	PLA2G2A	49	34
NC(=O)COc1cccc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)c1	ZINC000875319407	GD	On-Demand	Anodyne	FAAH	28	46
NC(=O)COc1cccc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)c1	ZINC000875319407	GD	On-Demand	Anodyne	PDS	50	35
CO[C@@H]1CC[C@@H](C)N(C(=O)NCc2cccc(OCC(N)=O)c2)C1	ZINC000875319414	ED	On-Demand	Anodyne	PDS	43	34
COc1ccc(N=C2NC(=O)[C@H](CC(=O)Nc3ccc(F)c(Cl)c3)S2)cc1OC	ZINC000875319465	IH	On-Demand	Mild	EGFR	35	41
COc1ccc(N=C2NC(=O)[C@H](CC(=O)Nc3ccc(F)c(Cl)c3)S2)cc1OC	ZINC000875319465	IH	On-Demand	Mild	ERBB2	16	41
COc1ccc(N=C2NC(=O)[C@H](CC(=O)Nc3ccc(F)c(Cl)c3)S2)cc1OC	ZINC000875319465	IH	On-Demand	Mild	ENPP1	71	39
COc1ccc(N=C2NC(=O)[C@@H](CC(=O)Nc3ccc(F)c(Cl)c3)S2)cc1OC	ZINC000875319475	IH	On-Demand	Mild	EGFR	35	41
COc1ccc(N=C2NC(=O)[C@@H](CC(=O)Nc3ccc(F)c(Cl)c3)S2)cc1OC	ZINC000875319475	IH	On-Demand	Mild	ERBB2	16	41
COc1ccc(N=C2NC(=O)[C@@H](CC(=O)Nc3ccc(F)c(Cl)c3)S2)cc1OC	ZINC000875319475	IH	On-Demand	Mild	ENPP1	71	39
O=C(NCCOC1CCC1)N1CC(c2ccccc2)C1	ZINC000875319592	CE	On-Demand	Anodyne	EPHX2	23	40
CCc1cnc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)s1	ZINC000875319605	EG	On-Demand	Anodyne	TRY1_BOVIN	40	36
CCc1cnc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)s1	ZINC000875319605	EG	On-Demand	Anodyne	PREP	43	39
CCc1cnc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)s1	ZINC000875319607	EG	On-Demand	Anodyne	TRY1_BOVIN	40	36
CCc1cnc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)s1	ZINC000875319607	EG	On-Demand	Anodyne	PREP	43	39
CCc1cnc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)s1	ZINC000875319608	EG	On-Demand	Anodyne	TRY1_BOVIN	40	36
CCc1cnc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)s1	ZINC000875319608	EG	On-Demand	Anodyne	PREP	43	39
CCc1cnc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)s1	ZINC000875319609	EG	On-Demand	Anodyne	TRY1_BOVIN	40	36
CCc1cnc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)s1	ZINC000875319609	EG	On-Demand	Anodyne	PREP	43	39
CCc1cnc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)s1	ZINC000875319633	FH	On-Demand	Anodyne	CPT1A	79	34
CCc1cnc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)s1	ZINC000875319633	FH	On-Demand	Anodyne	CPT2	42	33
CCc1cnc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)s1	ZINC000875319635	FH	On-Demand	Anodyne	CPT1A	79	34
CCc1cnc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)s1	ZINC000875319635	FH	On-Demand	Anodyne	CPT2	42	33
CCc1cnc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)s1	ZINC000875319636	FH	On-Demand	Anodyne	CPT1A	79	34
CCc1cnc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)s1	ZINC000875319636	FH	On-Demand	Anodyne	CPT2	42	33
CCc1cnc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)s1	ZINC000875319638	FH	On-Demand	Anodyne	CPT1A	79	34
CCc1cnc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)s1	ZINC000875319638	FH	On-Demand	Anodyne	CPT2	42	33
O=C(N[C@H]1CC[C@H](Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875319644	FD	On-Demand	Anodyne	GRIN2B	54	35
O=C(N[C@@H]1CC[C@H](Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875319646	FD	On-Demand	Anodyne	GRIN2B	54	35
O=C(N[C@H]1CC[C@@H](Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875319648	FD	On-Demand	Anodyne	GRIN2B	54	35
O=C(N[C@@H]1CC[C@@H](Cc2ccccc2)C1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875319650	FD	On-Demand	Anodyne	GRIN2B	54	35
NC(=O)COc1cccc(CNC(=O)NCC[C@@H]2CCSC2)c1	ZINC000875319758	ED	On-Demand	Anodyne	HRH2	23	40
NC(=O)COc1cccc(CNC(=O)NCC[C@H]2CCSC2)c1	ZINC000875319759	ED	On-Demand	Anodyne	HRH2	23	40
NC(=O)COc1cccc(CNC(=O)NC[C@H]2CCN2C2CCCCCC2)c1	ZINC000875319764	GE	On-Demand	Anodyne	HRH2	29	43
NC(=O)COc1cccc(CNC(=O)NC[C@@H]2CCN2C2CCCCCC2)c1	ZINC000875319765	GE	On-Demand	Anodyne	HRH2	29	43
NC(=O)COc1cccc(CNC(=O)NC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)c1	ZINC000875319781	ED	On-Demand	Anodyne	PDS	42	31
NC(=O)COc1cccc(CNC(=O)NC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)c1	ZINC000875319782	ED	On-Demand	Anodyne	PDS	42	31
NC(=O)COc1cccc(CNC(=O)NC[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)c1	ZINC000875319783	ED	On-Demand	Anodyne	PDS	42	31
NC(=O)COc1cccc(CNC(=O)NC[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)c1	ZINC000875319784	ED	On-Demand	Anodyne	PDS	42	31
COc1ccc(N=C2NC(=O)[C@H](CC(=O)Nc3ccc(Cl)c(Cl)c3)S2)cc1OC	ZINC000875319813	JI	On-Demand	Mild	ENPP1	76	40
COc1ccc(N=C2NC(=O)[C@@H](CC(=O)Nc3ccc(Cl)c(Cl)c3)S2)cc1OC	ZINC000875319814	JI	On-Demand	Mild	ENPP1	76	40
COc1ccc(N=C2NC(=O)[C@H](CC(=O)Nc3ccc4ccccc4c3)S2)cc1OC	ZINC000875319827	II	On-Demand	Mild	ENPP1	74	36
COc1ccc(N=C2NC(=O)[C@@H](CC(=O)Nc3ccc4ccccc4c3)S2)cc1OC	ZINC000875319828	II	On-Demand	Mild	ENPP1	74	36
CCN(C)C(=O)c1cccc(OC(=O)C(C)(C)[C@@H]2CCCCO2)c1	ZINC000875319833	EG	On-Demand	Anodyne	AMY2	46	32
CCN(C)C(=O)c1cccc(OC(=O)C(C)(C)[C@H]2CCCCO2)c1	ZINC000875319834	EG	On-Demand	Anodyne	AMY2	46	32
C#CCCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875319850	DG	On-Demand	Mild	HTR1A	31	42
C#CCCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875319850	DG	On-Demand	Mild	DRD2	33	43
C#CCCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875319850	DG	On-Demand	Mild	DRD4	18	43
C#CCCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875319850	DG	On-Demand	Mild	RBP4	38	41
C#CCCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875319851	DG	On-Demand	Mild	HTR1A	31	42
C#CCCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875319851	DG	On-Demand	Mild	DRD2	33	43
C#CCCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875319851	DG	On-Demand	Mild	DRD4	18	43
C#CCCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875319851	DG	On-Demand	Mild	RBP4	38	41
COc1ccc(N=C2NC(=O)[C@H](CC(=O)Nc3cccc(C(F)(F)F)c3)S2)cc1OC	ZINC000875319854	JH	On-Demand	Mild	ENPP1	64	31
COc1ccc(N=C2NC(=O)[C@@H](CC(=O)Nc3cccc(C(F)(F)F)c3)S2)cc1OC	ZINC000875319855	JH	On-Demand	Mild	ENPP1	64	31
CCN(C)C(=O)c1cccc(OC(=O)[C@@H](CC(C)C)NC(C)=O)c1	ZINC000875319879	EE	On-Demand	Anodyne	ANPEP	26	40
CCN(C)C(=O)c1cccc(OC(=O)[C@@H](CC(C)C)NC(C)=O)c1	ZINC000875319879	EE	On-Demand	Anodyne	CTSK	28	42
CCN(C)C(=O)c1cccc(OC(=O)[C@@H](CC(C)C)NC(C)=O)c1	ZINC000875319879	EE	On-Demand	Anodyne	CTSL	21	42
CCN(C)C(=O)c1cccc(OC(=O)[C@@H](CC(C)C)NC(C)=O)c1	ZINC000875319879	EE	On-Demand	Anodyne	CAPN1	49	36
CCN(C)C(=O)c1cccc(OC(=O)[C@@H](CC(C)C)NC(C)=O)c1	ZINC000875319879	EE	On-Demand	Anodyne	CAPN2	79	35
CCN(C)C(=O)c1cccc(OC(=O)[C@@H](CC(C)C)NC(C)=O)c1	ZINC000875319879	EE	On-Demand	Anodyne	NPR	62	32
COC(=O)C1(O)CN(C(=O)N[C@H](C)COCc2ccccc2)C1	ZINC000875319894	DC	On-Demand	Anodyne	GHRHR	24	43
COC(=O)C1(O)CN(C(=O)N[C@H](C)COCc2ccccc2)C1	ZINC000875319894	DC	On-Demand	Anodyne	CTSS	19	42
COC(=O)C1(O)CN(C(=O)N[C@H](C)COCc2ccccc2)C1	ZINC000875319894	DC	On-Demand	Anodyne	GHSR	29	43
COC(=O)C1(O)CN(C(=O)N[C@H](C)COCc2ccccc2)C1	ZINC000875319894	DC	On-Demand	Anodyne	CAPN1	42	36
COC(=O)C1(O)CN(C(=O)N[C@H](C)COCc2ccccc2)C1	ZINC000875319894	DC	On-Demand	Anodyne	CAPN2	49	35
COC(=O)C1(O)CN(C(=O)N[C@H](C)COCc2ccccc2)C1	ZINC000875319894	DC	On-Demand	Anodyne	SLC12A5	62	37
COC(=O)C1(O)CN(C(=O)N[C@@H](C)COCc2ccccc2)C1	ZINC000875319895	DC	On-Demand	Anodyne	GHRHR	24	43
COC(=O)C1(O)CN(C(=O)N[C@@H](C)COCc2ccccc2)C1	ZINC000875319895	DC	On-Demand	Anodyne	CTSS	19	42
COC(=O)C1(O)CN(C(=O)N[C@@H](C)COCc2ccccc2)C1	ZINC000875319895	DC	On-Demand	Anodyne	GHSR	29	43
COC(=O)C1(O)CN(C(=O)N[C@@H](C)COCc2ccccc2)C1	ZINC000875319895	DC	On-Demand	Anodyne	CAPN1	42	36
COC(=O)C1(O)CN(C(=O)N[C@@H](C)COCc2ccccc2)C1	ZINC000875319895	DC	On-Demand	Anodyne	CAPN2	49	35
COC(=O)C1(O)CN(C(=O)N[C@@H](C)COCc2ccccc2)C1	ZINC000875319895	DC	On-Demand	Anodyne	SLC12A5	62	37
CCN(C)C(=O)c1cccc(OC(=O)COCc2ccc(OC)nc2)c1	ZINC000875319903	FE	On-Demand	Anodyne	OXTR	15	41
CCN(C)C(=O)c1cccc(OC(=O)C2(NC(=O)OCc3ccccc3)CC2)c1	ZINC000875319912	GG	On-Demand	Anodyne	CTSK	18	46
CCN(C)C(=O)c1cccc(OC(=O)C2(NC(=O)OCc3ccccc3)CC2)c1	ZINC000875319912	GG	On-Demand	Anodyne	CAPNS1	44	36
CCN(C)C(=O)c1cccc(OC(=O)C2(NC(=O)OCc3ccccc3)CC2)c1	ZINC000875319912	GG	On-Demand	Anodyne	CAPN2	72	34
CCN(C)C(=O)c1cccc(OC(=O)C2(NC(=O)OCc3ccccc3)CC2)c1	ZINC000875319912	GG	On-Demand	Anodyne	NPR	56	34
CCN(C)C(=O)c1cccc(OC(=O)C2(NC(=O)OCc3ccccc3)CC2)c1	ZINC000875319912	GG	On-Demand	Anodyne	SLC12A5	51	33
COc1cccc([C@H](O)C2CCN(C(=O)NCC(C3CC3)C3CC3)CC2)c1	ZINC000875319953	FH	On-Demand	Anodyne	DRD4	46	36
COc1cccc([C@H](O)C2CCN(C(=O)NCC(C3CC3)C3CC3)CC2)c1	ZINC000875319953	FH	On-Demand	Anodyne	MTNR1A	40	41
COc1cccc([C@H](O)C2CCN(C(=O)NCC(C3CC3)C3CC3)CC2)c1	ZINC000875319953	FH	On-Demand	Anodyne	MTNR1B	45	41
O=C(NCCOC1CCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875319963	EE	On-Demand	Anodyne	SIGMAR1	28	44
CC[C@@H](NC(=O)NCCOC1CCC1)[C@@H](O)c1ccccc1	ZINC000875319975	DE	On-Demand	Anodyne	ADRB1	15	41
CC[C@@H](NC(=O)NCCOC1CCC1)[C@H](O)c1ccccc1	ZINC000875319979	DE	On-Demand	Anodyne	ADRB1	15	41
O=C(NCCOC1CCC1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875319985	EF	On-Demand	Anodyne	CPT1A	43	32
O=C(NCCOC1CCC1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875319990	EF	On-Demand	Anodyne	CPT1A	43	32
O=C(NCCOC1CCC1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875319992	EF	On-Demand	Anodyne	CPT1A	43	32
O=C(NCCOC1CCC1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875319993	EF	On-Demand	Anodyne	CPT1A	43	32
CN1CCN(C2CCN(C(=O)NCC(C3CC3)C3CC3)CC2)CC1	ZINC000875320007	ED	On-Demand	Anodyne	L3MBTL3	52	42
N#Cc1ccc(Cn2cc(NC(=O)NCCC3CC3)cn2)cc1	ZINC000875320012	DF	On-Demand	Mild	CCR3	38	48
N#Cc1ccc(Cn2cc(NC(=O)NCCC3CC3)cn2)cc1	ZINC000875320012	DF	On-Demand	Mild	ITK	18	52
N#Cc1ccc(Cn2cc(NC(=O)NCCC3CC3)cn2)cc1	ZINC000875320012	DF	On-Demand	Mild	PANC	58	39
O=C(NCCOC1CCC1)NC1CC(Nc2ccccc2)C1	ZINC000875320109	DE	On-Demand	Anodyne	EPHX2	21	44
O=C(NCC(C1CC1)C1CC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875320112	EE	On-Demand	Anodyne	ETHR	53	37
O=C(NCC(C1CC1)C1CC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875320113	EE	On-Demand	Anodyne	ETHR	53	37
N#Cc1ccc(Cn2cc(NC(=O)NCCOC3CCC3)cn2)cc1	ZINC000875320114	EE	On-Demand	Mild	CCR3	15	42
N#Cc1ccc(Cn2cc(NC(=O)NCCOC3CCC3)cn2)cc1	ZINC000875320114	EE	On-Demand	Mild	ITK	19	51
N#Cc1ccc(Cn2cc(NC(=O)NCCOC3CCC3)cn2)cc1	ZINC000875320114	EE	On-Demand	Mild	PANC	55	37
O=C(N[C@H]1CCSC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875320164	DE	On-Demand	Anodyne	DRD4	24	42
O=C(N[C@H]1CCSC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875320164	DE	On-Demand	Anodyne	SIGMAR1	29	43
O=C(N[C@@H]1CCSC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875320165	DE	On-Demand	Anodyne	DRD4	24	42
O=C(N[C@@H]1CCSC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875320165	DE	On-Demand	Anodyne	SIGMAR1	29	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)Oc1ccccc1OC	ZINC000875320192	FE	On-Demand	Anodyne	SLC6A4	25	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)Oc1ccccc1OC	ZINC000875320192	FE	On-Demand	Anodyne	SLC6A3	53	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)Oc1ccccc1OC	ZINC000875320193	FE	On-Demand	Anodyne	SLC6A4	25	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)Oc1ccccc1OC	ZINC000875320193	FE	On-Demand	Anodyne	SLC6A3	53	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)Oc1ccccc1OC	ZINC000875320194	FE	On-Demand	Anodyne	SLC6A4	25	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)Oc1ccccc1OC	ZINC000875320194	FE	On-Demand	Anodyne	SLC6A3	53	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)Oc1ccccc1OC	ZINC000875320195	FE	On-Demand	Anodyne	SLC6A4	25	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)Oc1ccccc1OC	ZINC000875320195	FE	On-Demand	Anodyne	SLC6A3	53	41
O=C(NCCC1CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875320202	CE	On-Demand	Anodyne	EPHX2	20	47
O=C(NCCC1CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875320203	CE	On-Demand	Anodyne	EPHX2	20	47
C[C@@H](CNC(=O)N1CCC[C@H](C(C)(C)O)C1)Sc1ccccc1	ZINC000875320430	EG	On-Demand	Anodyne	AMY2	43	29
C[C@@H](CNC(=O)N1CCC[C@@H](C(C)(C)O)C1)Sc1ccccc1	ZINC000875320432	EG	On-Demand	Anodyne	AMY2	43	29
CCO[C@@H](CCNC(=O)C(=O)N[C@@H](C)c1ccc(C(F)(F)F)nc1)C(C)C	ZINC000875320477	GF	On-Demand	Anodyne	TRPV1	47	33
CCO[C@@H](CCNC(=O)C(=O)N[C@H](C)c1ccc(C(F)(F)F)nc1)C(C)C	ZINC000875320478	GF	On-Demand	Anodyne	TRPV1	47	33
CCc1cnc(CNC(=O)N[C@H](C)C2CN(C(=O)OC(C)(C)C)C2)s1	ZINC000875320556	FF	On-Demand	Anodyne	GPR119	34	40
CCc1cnc(CNC(=O)N[C@@H](C)C2CN(C(=O)OC(C)(C)C)C2)s1	ZINC000875320557	FF	On-Demand	Anodyne	GPR119	34	40
Cc1ccc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)c(CN(C)C)c1	ZINC000875320562	GJ	On-Demand	Anodyne	KCNK3	57	39
Cc1ccc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)c(CN(C)C)c1	ZINC000875320562	GJ	On-Demand	Anodyne	KCNK9	42	36
O=C(NCCC1CC1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875320603	FG	On-Demand	Anodyne	ABL1	15	44
C#CCCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875320604	CE	On-Demand	Mild	TRY1_BOVIN	43	33
C#CCCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875320605	CE	On-Demand	Mild	TRY1_BOVIN	43	33
C#CCCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875320606	CE	On-Demand	Mild	TRY1_BOVIN	43	33
C#CCCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875320607	CE	On-Demand	Mild	TRY1_BOVIN	43	33
COC(=O)c1ccc(OC)c2c1CCN(C(=O)NCCC1CC1)C2	ZINC000875320608	EE	On-Demand	Anodyne	MTNR1A	24	40
COC(=O)c1ccc(OC)c2c1CCN(C(=O)NCCC1CC1)C2	ZINC000875320608	EE	On-Demand	Anodyne	MTNR1B	18	40
N#Cc1cccc([C@@H](NC(=O)NCCC2CC2)C(F)(F)F)c1	ZINC000875320620	DG	On-Demand	Mild	CCR3	16	43
N#Cc1cccc([C@H](NC(=O)NCCC2CC2)C(F)(F)F)c1	ZINC000875320621	DG	On-Demand	Mild	CCR3	16	43
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCSC1	ZINC000875320630	EG	On-Demand	Reactive	MAOB	15	40
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCSC1	ZINC000875320630	EG	On-Demand	Reactive	LTA4H	37	46
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCSC1	ZINC000875320630	EG	On-Demand	Reactive	ADAM17	31	49
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCSC1	ZINC000875320630	EG	On-Demand	Reactive	SLC6A5	33	42
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCSC1	ZINC000875320630	EG	On-Demand	Reactive	EPHX2	20	47
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCSC1	ZINC000875320630	EG	On-Demand	Reactive	FFAR1	21	40
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCSC1	ZINC000875320631	EG	On-Demand	Reactive	MAOB	15	40
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCSC1	ZINC000875320631	EG	On-Demand	Reactive	LTA4H	37	46
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCSC1	ZINC000875320631	EG	On-Demand	Reactive	ADAM17	31	49
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCSC1	ZINC000875320631	EG	On-Demand	Reactive	SLC6A5	33	42
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCSC1	ZINC000875320631	EG	On-Demand	Reactive	EPHX2	20	47
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCSC1	ZINC000875320631	EG	On-Demand	Reactive	FFAR1	21	40
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320719	JH	On-Demand	Anodyne	CA2	25	44
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320719	JH	On-Demand	Anodyne	ELANE	28	41
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320719	JH	On-Demand	Anodyne	NPR1	41	33
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320719	JH	On-Demand	Anodyne	CASP3	17	52
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320719	JH	On-Demand	Anodyne	BMP1	52	55
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320719	JH	On-Demand	Anodyne	CA7	15	43
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320719	JH	On-Demand	Anodyne	MMP13	29	40
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320719	JH	On-Demand	Anodyne	KLK3	80	37
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320719	JH	On-Demand	Anodyne	CTSB	76	53
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320719	JH	On-Demand	Anodyne	PAPA1_CARPA	85	45
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320719	JH	On-Demand	Anodyne	CYSP_TRYCR	51	40
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320719	JH	On-Demand	Anodyne	CTSK	39	55
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320719	JH	On-Demand	Anodyne	CTSL	56	53
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320719	JH	On-Demand	Anodyne	PGA	22	41
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320719	JH	On-Demand	Anodyne	CA4	20	44
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320719	JH	On-Demand	Anodyne	CA14	15	43
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320719	JH	On-Demand	Anodyne	CAPNS1	73	40
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320719	JH	On-Demand	Anodyne	MMP2	27	44
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320719	JH	On-Demand	Anodyne	MMP3	32	44
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320719	JH	On-Demand	Anodyne	CTSS	17	55
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320719	JH	On-Demand	Anodyne	CAPN1	100	52
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320719	JH	On-Demand	Anodyne	MMP9	24	44
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320719	JH	On-Demand	Anodyne	CASP1	24	43
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320719	JH	On-Demand	Anodyne	CAPN2	144	43
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320719	JH	On-Demand	Anodyne	MMP12	40	36
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320719	JH	On-Demand	Anodyne	CASP6	21	42
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320719	JH	On-Demand	Anodyne	CASP9	40	43
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320719	JH	On-Demand	Anodyne	NPR	86	47
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320719	JH	On-Demand	Anodyne	CASP10	36	43
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320719	JH	On-Demand	Anodyne	F13A1	35	44
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320719	JH	On-Demand	Anodyne	PSMB5	54	47
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320719	JH	On-Demand	Anodyne	Q6PRC7_IXORI	25	45
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320731	JH	On-Demand	Anodyne	CA2	25	44
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320731	JH	On-Demand	Anodyne	ELANE	28	41
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320731	JH	On-Demand	Anodyne	NPR1	41	33
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320731	JH	On-Demand	Anodyne	CASP3	17	52
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320731	JH	On-Demand	Anodyne	BMP1	52	55
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320731	JH	On-Demand	Anodyne	CA7	15	43
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320731	JH	On-Demand	Anodyne	MMP13	29	40
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320731	JH	On-Demand	Anodyne	KLK3	80	37
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320731	JH	On-Demand	Anodyne	CTSB	76	53
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320731	JH	On-Demand	Anodyne	PAPA1_CARPA	85	45
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320731	JH	On-Demand	Anodyne	CYSP_TRYCR	51	40
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320731	JH	On-Demand	Anodyne	CTSK	39	55
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320731	JH	On-Demand	Anodyne	CTSL	56	53
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320731	JH	On-Demand	Anodyne	PGA	22	41
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320731	JH	On-Demand	Anodyne	CA4	20	44
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320731	JH	On-Demand	Anodyne	CA14	15	43
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320731	JH	On-Demand	Anodyne	CAPNS1	73	40
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320731	JH	On-Demand	Anodyne	MMP2	27	44
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320731	JH	On-Demand	Anodyne	MMP3	32	44
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320731	JH	On-Demand	Anodyne	CTSS	17	55
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320731	JH	On-Demand	Anodyne	CAPN1	100	52
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320731	JH	On-Demand	Anodyne	MMP9	24	44
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320731	JH	On-Demand	Anodyne	CASP1	24	43
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320731	JH	On-Demand	Anodyne	CAPN2	144	43
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320731	JH	On-Demand	Anodyne	MMP12	40	36
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320731	JH	On-Demand	Anodyne	CASP6	21	42
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320731	JH	On-Demand	Anodyne	CASP9	40	43
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320731	JH	On-Demand	Anodyne	NPR	86	47
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320731	JH	On-Demand	Anodyne	CASP10	36	43
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320731	JH	On-Demand	Anodyne	F13A1	35	44
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320731	JH	On-Demand	Anodyne	PSMB5	54	47
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)N(C)C(C)C)cc1	ZINC000875320731	JH	On-Demand	Anodyne	Q6PRC7_IXORI	25	45
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCc1ccn(C)n1)CC2	ZINC000875320741	GD	On-Demand	Anodyne	MTNR1B	15	41
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCc1ccn(C)n1)CC2	ZINC000875320743	GD	On-Demand	Anodyne	MTNR1B	15	41
CCc1cnc(CNC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)s1	ZINC000875320755	DD	On-Demand	Anodyne	SLC6A4	18	41
CCc1cnc(CNC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)s1	ZINC000875320757	DD	On-Demand	Anodyne	SLC6A4	18	41
CC(C)(C)OC(=O)N1CCC2(CC1)CN(C(=O)NCCC1CC1)C2	ZINC000875320778	EF	On-Demand	Anodyne	GPR119	32	42
CCCCCCCNC(=O)C(=O)NCCc1ccn(C)n1	ZINC000875320822	CD	On-Demand	Mild	ASAH1	99	44
COc1ccccc1[C@H]1CCCN(C(=O)NCCOC2CCC2)CC1	ZINC000875320956	EH	On-Demand	Anodyne	HTR1A	21	40
COc1ccccc1[C@H]1CCCN(C(=O)NCCOC2CCC2)CC1	ZINC000875320956	EH	On-Demand	Anodyne	DRD2	19	44
COc1ccccc1[C@H]1CCCN(C(=O)NCCOC2CCC2)CC1	ZINC000875320956	EH	On-Demand	Anodyne	EPHX2	16	40
COc1ccccc1[C@H]1CCCN(C(=O)NCCOC2CCC2)CC1	ZINC000875320956	EH	On-Demand	Anodyne	RBP4	28	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCCOC2CCC2)CC1	ZINC000875320957	EH	On-Demand	Anodyne	HTR1A	21	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCCOC2CCC2)CC1	ZINC000875320957	EH	On-Demand	Anodyne	DRD2	19	44
COc1ccccc1[C@@H]1CCCN(C(=O)NCCOC2CCC2)CC1	ZINC000875320957	EH	On-Demand	Anodyne	EPHX2	16	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCCOC2CCC2)CC1	ZINC000875320957	EH	On-Demand	Anodyne	RBP4	28	40
COc1ccccc1[C@@H]1CN(C(=O)NCC(C2CC2)C2CC2)CCO1	ZINC000875321002	EG	On-Demand	Anodyne	DRD2	18	41
COc1ccccc1[C@@H]1CN(C(=O)NCC(C2CC2)C2CC2)CCO1	ZINC000875321002	EG	On-Demand	Anodyne	DRD4	17	41
COc1ccccc1[C@H]1CN(C(=O)NCC(C2CC2)C2CC2)CCO1	ZINC000875321003	EG	On-Demand	Anodyne	DRD2	18	41
COc1ccccc1[C@H]1CN(C(=O)NCC(C2CC2)C2CC2)CCO1	ZINC000875321003	EG	On-Demand	Anodyne	DRD4	17	41
N#Cc1ccc(Cn2cc(NC(=O)NCC(C3CC3)C3CC3)cn2)cc1	ZINC000875321065	EG	On-Demand	Mild	CCR3	20	43
N#Cc1ccc(Cn2cc(NC(=O)NCC(C3CC3)C3CC3)cn2)cc1	ZINC000875321065	EG	On-Demand	Mild	ITK	19	54
N#Cc1ccc(Cn2cc(NC(=O)NCC(C3CC3)C3CC3)cn2)cc1	ZINC000875321065	EG	On-Demand	Mild	PANC	58	39
O=C(NCC(C1CC1)C1CC1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875321091	GH	On-Demand	Anodyne	ABL1	15	43
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCC(C1CC1)C1CC1)CC2	ZINC000875321122	EG	On-Demand	Anodyne	HTR1F	22	40
CCC(CC)(CNC(=O)NNc1cccc(C)n1)SC	ZINC000875321185	CF	On-Demand	Reactive	GRM5	17	40
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC2(CCCO2)C1	ZINC000875321248	FE	On-Demand	Anodyne	HTR4	48	35
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CC2(CCCO2)C1	ZINC000875321249	FE	On-Demand	Anodyne	HTR4	48	35
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1cccc(-n2ccnc2)c1	ZINC000875321260	EG	On-Demand	Anodyne	CYP26A1	54	34
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875321264	GF	On-Demand	Anodyne	CACNA1I	43	35
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875321265	GF	On-Demand	Anodyne	CACNA1I	43	35
O=C(NCC1CC=CC1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875321266	FF	On-Demand	Anodyne	SLC6A3	26	45
O=C(NCC1CC=CC1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875321266	FF	On-Demand	Anodyne	HTR4	56	38
O=C(NCC1CC=CC1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875321266	FF	On-Demand	Anodyne	GRIN2B	27	50
O=C(NCC1CC=CC1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875321266	FF	On-Demand	Anodyne	CCR3	23	46
O=C(NCC1CC=CC1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875321266	FF	On-Demand	Anodyne	CACNA1I	66	39
O=C(NCC1CC=CC1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875321266	FF	On-Demand	Anodyne	Q8WSF8_APLCA	24	40
O=C(NCC1CC=CC1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875321267	FF	On-Demand	Anodyne	SLC6A3	26	45
O=C(NCC1CC=CC1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875321267	FF	On-Demand	Anodyne	HTR4	56	38
O=C(NCC1CC=CC1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875321267	FF	On-Demand	Anodyne	GRIN2B	27	50
O=C(NCC1CC=CC1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875321267	FF	On-Demand	Anodyne	CCR3	23	46
O=C(NCC1CC=CC1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875321267	FF	On-Demand	Anodyne	CACNA1I	66	39
O=C(NCC1CC=CC1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875321267	FF	On-Demand	Anodyne	Q8WSF8_APLCA	24	40
CCC[C@@H](CCO)NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875321268	GE	On-Demand	Anodyne	HTR4	61	37
CCC[C@@H](CCO)NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875321268	GE	On-Demand	Anodyne	CACNA1I	54	37
CCC[C@H](CCO)NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875321269	GE	On-Demand	Anodyne	HTR4	61	37
CCC[C@H](CCO)NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875321269	GE	On-Demand	Anodyne	CACNA1I	54	37
CCC[C@@H](CCO)NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875321270	GE	On-Demand	Anodyne	HTR4	61	37
CCC[C@@H](CCO)NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875321270	GE	On-Demand	Anodyne	CACNA1I	54	37
CCC[C@H](CCO)NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875321271	GE	On-Demand	Anodyne	HTR4	61	37
CCC[C@H](CCO)NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875321271	GE	On-Demand	Anodyne	CACNA1I	54	37
COCC(C)(C)CCNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875321305	GF	On-Demand	Anodyne	HTR4	49	38
COCC(C)(C)CCNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875321305	GF	On-Demand	Anodyne	CACNA1I	75	41
COCC(C)(C)CCNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875321306	GF	On-Demand	Anodyne	HTR4	49	38
COCC(C)(C)CCNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875321306	GF	On-Demand	Anodyne	CACNA1I	75	41
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1OC2CCC1CC2	ZINC000875321318	FF	On-Demand	Anodyne	SLC6A3	24	44
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1OC2CCC1CC2	ZINC000875321318	FF	On-Demand	Anodyne	HTR4	62	38
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1OC2CCC1CC2	ZINC000875321318	FF	On-Demand	Anodyne	GRIN2B	17	46
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1OC2CCC1CC2	ZINC000875321318	FF	On-Demand	Anodyne	CCR3	15	41
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1OC2CCC1CC2	ZINC000875321318	FF	On-Demand	Anodyne	CACNA1I	58	37
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1OC2CCC1CC2	ZINC000875321318	FF	On-Demand	Anodyne	Q8WSF8_APLCA	23	40
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1OC2CCC1CC2	ZINC000875321319	FF	On-Demand	Anodyne	SLC6A3	24	44
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1OC2CCC1CC2	ZINC000875321319	FF	On-Demand	Anodyne	HTR4	62	38
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1OC2CCC1CC2	ZINC000875321319	FF	On-Demand	Anodyne	GRIN2B	17	46
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1OC2CCC1CC2	ZINC000875321319	FF	On-Demand	Anodyne	CCR3	15	41
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1OC2CCC1CC2	ZINC000875321319	FF	On-Demand	Anodyne	CACNA1I	58	37
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1OC2CCC1CC2	ZINC000875321319	FF	On-Demand	Anodyne	Q8WSF8_APLCA	23	40
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1O[C@H]2C=C[C@H]1CC2	ZINC000875321324	FE	On-Demand	Anodyne	HTR4	48	35
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1O[C@H]2C=C[C@H]1CC2	ZINC000875321324	FE	On-Demand	Anodyne	CACNA1I	52	36
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1O[C@H]2C=C[C@H]1CC2	ZINC000875321324	FE	On-Demand	Anodyne	Q8WSF8_APLCA	23	41
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1O[C@H]2C=C[C@H]1CC2	ZINC000875321325	FE	On-Demand	Anodyne	HTR4	48	35
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1O[C@H]2C=C[C@H]1CC2	ZINC000875321325	FE	On-Demand	Anodyne	CACNA1I	52	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1O[C@H]2C=C[C@H]1CC2	ZINC000875321325	FE	On-Demand	Anodyne	Q8WSF8_APLCA	23	41
C[C@H](NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1ccnn1C	ZINC000875321326	GE	On-Demand	Anodyne	HTR4	57	39
C[C@H](NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1ccnn1C	ZINC000875321326	GE	On-Demand	Anodyne	CACNA1I	51	37
C[C@H](NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1ccnn1C	ZINC000875321327	GE	On-Demand	Anodyne	HTR4	57	39
C[C@H](NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1ccnn1C	ZINC000875321327	GE	On-Demand	Anodyne	CACNA1I	51	37
C[C@@H](NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1ccnn1C	ZINC000875321328	GE	On-Demand	Anodyne	HTR4	57	39
C[C@@H](NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1ccnn1C	ZINC000875321328	GE	On-Demand	Anodyne	CACNA1I	51	37
C[C@@H](NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1ccnn1C	ZINC000875321329	GE	On-Demand	Anodyne	HTR4	57	39
C[C@@H](NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1ccnn1C	ZINC000875321329	GE	On-Demand	Anodyne	CACNA1I	51	37
CO[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000875321338	FD	On-Demand	Anodyne	HTR4	64	39
CO[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000875321338	FD	On-Demand	Anodyne	CCR3	20	40
CO[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000875321338	FD	On-Demand	Anodyne	EPHX2	15	41
CO[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000875321338	FD	On-Demand	Anodyne	CACNA1I	55	37
CO[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000875321338	FD	On-Demand	Anodyne	Q8WSF8_APLCA	24	40
CO[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000875321339	FD	On-Demand	Anodyne	HTR4	64	39
CO[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000875321339	FD	On-Demand	Anodyne	CCR3	20	40
CO[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000875321339	FD	On-Demand	Anodyne	EPHX2	15	41
CO[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000875321339	FD	On-Demand	Anodyne	CACNA1I	55	37
CO[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000875321339	FD	On-Demand	Anodyne	Q8WSF8_APLCA	24	40
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CCCC(F)(F)CC1	ZINC000875321353	GG	On-Demand	Anodyne	HTR4	43	36
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CCCC(F)(F)CC1	ZINC000875321354	GG	On-Demand	Anodyne	HTR4	43	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1C[C@@H](O)C[C@H]1C1CC1	ZINC000875321364	GD	On-Demand	Anodyne	OPRK1	24	41
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1C[C@@H](O)C[C@@H]1C1CC1	ZINC000875321365	GD	On-Demand	Anodyne	OPRK1	24	41
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1C[C@H](O)C[C@H]1C1CC1	ZINC000875321366	GD	On-Demand	Anodyne	OPRK1	24	41
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1C[C@H](O)C[C@@H]1C1CC1	ZINC000875321367	GD	On-Demand	Anodyne	OPRK1	24	41
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CCO[C@@H](CCF)C1	ZINC000875321368	GE	On-Demand	Anodyne	HTR4	46	37
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CCO[C@H](CCF)C1	ZINC000875321369	GE	On-Demand	Anodyne	HTR4	46	37
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CCO[C@@H](CCF)C1	ZINC000875321370	GE	On-Demand	Anodyne	HTR4	46	37
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CCO[C@H](CCF)C1	ZINC000875321371	GE	On-Demand	Anodyne	HTR4	46	37
CN(CCNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)CC(F)F	ZINC000875321374	GD	On-Demand	Anodyne	CACNA1I	44	36
CN(CCNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)CC(F)F	ZINC000875321375	GD	On-Demand	Anodyne	CACNA1I	44	36
O=C(NCC[C@H](O)C(F)F)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875321388	GD	On-Demand	Anodyne	SLC6A3	20	40
O=C(NCC[C@H](O)C(F)F)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875321388	GD	On-Demand	Anodyne	CCR3	26	41
O=C(NCC[C@H](O)C(F)F)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875321388	GD	On-Demand	Anodyne	CACNA1I	51	37
O=C(NCC[C@@H](O)C(F)F)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875321389	GD	On-Demand	Anodyne	SLC6A3	20	40
O=C(NCC[C@@H](O)C(F)F)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875321389	GD	On-Demand	Anodyne	CCR3	26	41
O=C(NCC[C@@H](O)C(F)F)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875321389	GD	On-Demand	Anodyne	CACNA1I	51	37
O=C(NCC[C@H](O)C(F)F)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875321390	GD	On-Demand	Anodyne	SLC6A3	20	40
O=C(NCC[C@H](O)C(F)F)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875321390	GD	On-Demand	Anodyne	CCR3	26	41
O=C(NCC[C@H](O)C(F)F)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875321390	GD	On-Demand	Anodyne	CACNA1I	51	37
O=C(NCC[C@@H](O)C(F)F)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875321391	GD	On-Demand	Anodyne	SLC6A3	20	40
O=C(NCC[C@@H](O)C(F)F)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875321391	GD	On-Demand	Anodyne	CCR3	26	41
O=C(NCC[C@@H](O)C(F)F)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875321391	GD	On-Demand	Anodyne	CACNA1I	51	37
C=CC[C@@H]1CCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000875321402	FG	On-Demand	Mild	GRIN2B	20	43
C=CC[C@@H]1CCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000875321402	FG	On-Demand	Mild	CACNA1I	50	37
C=CC[C@H]1CCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000875321403	FG	On-Demand	Mild	GRIN2B	20	43
C=CC[C@H]1CCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000875321403	FG	On-Demand	Mild	CACNA1I	50	37
C=CC[C@H]1CCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000875321404	FG	On-Demand	Mild	GRIN2B	20	43
C=CC[C@H]1CCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000875321404	FG	On-Demand	Mild	CACNA1I	50	37
C=CC[C@@H]1CCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000875321405	FG	On-Demand	Mild	GRIN2B	20	43
C=CC[C@@H]1CCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000875321405	FG	On-Demand	Mild	CACNA1I	50	37
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1cccc(-n2ccnc2)c1	ZINC000875321417	FD	On-Demand	Anodyne	CACNA1H	23	41
O=C(NCCc1ccc(-c2ccccc2)cc1)C(=O)N[C@H]1CCCn2nccc21	ZINC000875321423	GF	On-Demand	Anodyne	GPBAR1	22	41
O=C(NCCc1ccc(-c2ccccc2)cc1)C(=O)N[C@@H]1CCCn2nccc21	ZINC000875321424	GF	On-Demand	Anodyne	GPBAR1	22	41
O=CN1CCCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CC1	ZINC000875321427	GD	On-Demand	Anodyne	HTR4	41	35
O=CN1CCCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CC1	ZINC000875321427	GD	On-Demand	Anodyne	CACNA1I	42	35
O=CN1CCCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CC1	ZINC000875321428	GD	On-Demand	Anodyne	HTR4	41	35
O=CN1CCCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CC1	ZINC000875321428	GD	On-Demand	Anodyne	CACNA1I	42	35
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875321434	FD	On-Demand	Anodyne	OPRK1	27	40
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875321434	FD	On-Demand	Anodyne	SLC6A3	29	44
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875321434	FD	On-Demand	Anodyne	HTR4	59	37
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875321434	FD	On-Demand	Anodyne	GRIN2B	25	49
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875321434	FD	On-Demand	Anodyne	SIGMAR1	19	40
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875321434	FD	On-Demand	Anodyne	CCR3	21	45
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875321434	FD	On-Demand	Anodyne	CACNA1I	65	39
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875321434	FD	On-Demand	Anodyne	Q8WSF8_APLCA	24	42
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NCC1CC(O)C1	ZINC000875321435	FD	On-Demand	Anodyne	OPRK1	27	40
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NCC1CC(O)C1	ZINC000875321435	FD	On-Demand	Anodyne	SLC6A3	29	44
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NCC1CC(O)C1	ZINC000875321435	FD	On-Demand	Anodyne	HTR4	59	37
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NCC1CC(O)C1	ZINC000875321435	FD	On-Demand	Anodyne	GRIN2B	25	49
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NCC1CC(O)C1	ZINC000875321435	FD	On-Demand	Anodyne	SIGMAR1	19	40
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NCC1CC(O)C1	ZINC000875321435	FD	On-Demand	Anodyne	CCR3	21	45
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NCC1CC(O)C1	ZINC000875321435	FD	On-Demand	Anodyne	CACNA1I	65	39
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NCC1CC(O)C1	ZINC000875321435	FD	On-Demand	Anodyne	Q8WSF8_APLCA	24	42
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NCC1CC(O)C1	ZINC000875321436	FD	On-Demand	Anodyne	OPRK1	27	40
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NCC1CC(O)C1	ZINC000875321436	FD	On-Demand	Anodyne	SLC6A3	29	44
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NCC1CC(O)C1	ZINC000875321436	FD	On-Demand	Anodyne	HTR4	59	37
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NCC1CC(O)C1	ZINC000875321436	FD	On-Demand	Anodyne	GRIN2B	25	49
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NCC1CC(O)C1	ZINC000875321436	FD	On-Demand	Anodyne	SIGMAR1	19	40
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NCC1CC(O)C1	ZINC000875321436	FD	On-Demand	Anodyne	CCR3	21	45
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NCC1CC(O)C1	ZINC000875321436	FD	On-Demand	Anodyne	CACNA1I	65	39
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NCC1CC(O)C1	ZINC000875321436	FD	On-Demand	Anodyne	Q8WSF8_APLCA	24	42
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NC[C@@H]1C[C@H](O)C1	ZINC000875321437	FD	On-Demand	Anodyne	OPRK1	27	40
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NC[C@@H]1C[C@H](O)C1	ZINC000875321437	FD	On-Demand	Anodyne	SLC6A3	29	44
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NC[C@@H]1C[C@H](O)C1	ZINC000875321437	FD	On-Demand	Anodyne	HTR4	59	37
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NC[C@@H]1C[C@H](O)C1	ZINC000875321437	FD	On-Demand	Anodyne	GRIN2B	25	49
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NC[C@@H]1C[C@H](O)C1	ZINC000875321437	FD	On-Demand	Anodyne	SIGMAR1	19	40
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NC[C@@H]1C[C@H](O)C1	ZINC000875321437	FD	On-Demand	Anodyne	CCR3	21	45
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NC[C@@H]1C[C@H](O)C1	ZINC000875321437	FD	On-Demand	Anodyne	CACNA1I	65	39
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NC[C@@H]1C[C@H](O)C1	ZINC000875321437	FD	On-Demand	Anodyne	Q8WSF8_APLCA	24	42
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC[C@@H]1C[C@H](O)C1	ZINC000875321438	FD	On-Demand	Anodyne	OPRK1	27	40
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC[C@@H]1C[C@H](O)C1	ZINC000875321438	FD	On-Demand	Anodyne	SLC6A3	29	44
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC[C@@H]1C[C@H](O)C1	ZINC000875321438	FD	On-Demand	Anodyne	HTR4	59	37
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC[C@@H]1C[C@H](O)C1	ZINC000875321438	FD	On-Demand	Anodyne	GRIN2B	25	49
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC[C@@H]1C[C@H](O)C1	ZINC000875321438	FD	On-Demand	Anodyne	SIGMAR1	19	40
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC[C@@H]1C[C@H](O)C1	ZINC000875321438	FD	On-Demand	Anodyne	CCR3	21	45
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC[C@@H]1C[C@H](O)C1	ZINC000875321438	FD	On-Demand	Anodyne	CACNA1I	65	39
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC[C@@H]1C[C@H](O)C1	ZINC000875321438	FD	On-Demand	Anodyne	Q8WSF8_APLCA	24	42
C[C@H]1CCCCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875321497	EG	On-Demand	Anodyne	ACE	38	44
C[C@H]1CCCCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875321497	EG	On-Demand	Anodyne	FKBP1A	57	49
C[C@H]1CCCCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875321497	EG	On-Demand	Anodyne	CELA1	25	40
C[C@H]1CCCCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875321497	EG	On-Demand	Anodyne	ELANE	24	43
C[C@H]1CCCCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875321497	EG	On-Demand	Anodyne	CTRA_BOVIN	63	34
C[C@H]1CCCCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875321497	EG	On-Demand	Anodyne	CTSB	31	47
C[C@H]1CCCCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875321497	EG	On-Demand	Anodyne	TRY1_BOVIN	49	34
C[C@H]1CCCCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875321497	EG	On-Demand	Anodyne	CTSG	44	34
C[C@H]1CCCCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875321497	EG	On-Demand	Anodyne	CTSK	36	52
C[C@H]1CCCCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875321497	EG	On-Demand	Anodyne	PREP	58	45
C[C@H]1CCCCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875321497	EG	On-Demand	Anodyne	CAPNS1	56	34
C[C@H]1CCCCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875321497	EG	On-Demand	Anodyne	CELA2A	52	34
C[C@H]1CCCCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875321497	EG	On-Demand	Anodyne	LGMN	48	38
C[C@H]1CCCCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875321497	EG	On-Demand	Anodyne	CAPN1	41	38
C[C@H]1CCCCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875321497	EG	On-Demand	Anodyne	CASP1	16	41
C[C@H]1CCCCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875321497	EG	On-Demand	Anodyne	CAPN2	60	36
C[C@H]1CCCCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875321497	EG	On-Demand	Anodyne	DPP7	30	42
C[C@H]1CCCCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875321497	EG	On-Demand	Anodyne	NPR	44	32
C[C@H]1CCCCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875321497	EG	On-Demand	Anodyne	NAAA	52	40
C[C@H]1CCCCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875321497	EG	On-Demand	Anodyne	SLC12A5	79	43
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875321505	FD	On-Demand	Anodyne	OPRK1	27	40
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875321505	FD	On-Demand	Anodyne	SLC6A3	29	44
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875321505	FD	On-Demand	Anodyne	HTR4	59	37
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875321505	FD	On-Demand	Anodyne	GRIN2B	25	49
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875321505	FD	On-Demand	Anodyne	SIGMAR1	19	40
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875321505	FD	On-Demand	Anodyne	CCR3	21	45
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875321505	FD	On-Demand	Anodyne	CACNA1I	65	39
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875321505	FD	On-Demand	Anodyne	Q8WSF8_APLCA	24	42
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H](C)C[S@](C)=O)CC2)c(OC)c1	ZINC000875321541	GC	On-Demand	Clean	DRD2	20	41
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H](C)C[S@@](C)=O)CC2)c(OC)c1	ZINC000875321543	GC	On-Demand	Clean	DRD2	20	41
COc1ccc(N2CCN(C(=O)C(=O)N[C@H](C)C[S@@](C)=O)CC2)c(OC)c1	ZINC000875321545	GC	On-Demand	Clean	DRD2	20	41
COc1ccc(N2CCN(C(=O)C(=O)N[C@H](C)C[S@](C)=O)CC2)c(OC)c1	ZINC000875321547	GC	On-Demand	Clean	DRD2	20	41
C[C@@H]1O[C@H](C)[C@H](NC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)[C@@H]1C	ZINC000875321578	GF	On-Demand	Anodyne	HTR4	50	36
C[C@@H]1O[C@H](C)[C@H](NC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)[C@@H]1C	ZINC000875321578	GF	On-Demand	Anodyne	CACNA1I	50	36
C[C@@H]1O[C@H](C)[C@H](NC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)[C@H]1C	ZINC000875321579	GF	On-Demand	Anodyne	HTR4	50	36
C[C@@H]1O[C@H](C)[C@H](NC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)[C@H]1C	ZINC000875321579	GF	On-Demand	Anodyne	CACNA1I	50	36
C[C@@H]1O[C@H](C)[C@H](NC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)[C@@H]1C	ZINC000875321580	GF	On-Demand	Anodyne	HTR4	50	36
C[C@@H]1O[C@H](C)[C@H](NC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)[C@@H]1C	ZINC000875321580	GF	On-Demand	Anodyne	CACNA1I	50	36
C[C@@H]1O[C@H](C)[C@H](NC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)[C@H]1C	ZINC000875321581	GF	On-Demand	Anodyne	HTR4	50	36
C[C@@H]1O[C@H](C)[C@H](NC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)[C@H]1C	ZINC000875321581	GF	On-Demand	Anodyne	CACNA1I	50	36
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CC(Cc2ccco2)C1	ZINC000875321589	GF	On-Demand	Anodyne	HTR4	40	37
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CC(Cc2ccco2)C1	ZINC000875321589	GF	On-Demand	Anodyne	CACNA1I	46	35
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC(Cc2ccco2)C1	ZINC000875321590	GF	On-Demand	Anodyne	HTR4	40	37
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC(Cc2ccco2)C1	ZINC000875321590	GF	On-Demand	Anodyne	CACNA1I	46	35
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CC=CC1	ZINC000875321598	EE	On-Demand	Anodyne	SLC6A3	22	43
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CC=CC1	ZINC000875321598	EE	On-Demand	Anodyne	HTR4	53	38
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CC=CC1	ZINC000875321598	EE	On-Demand	Anodyne	GRIN2B	26	48
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CC=CC1	ZINC000875321598	EE	On-Demand	Anodyne	CACNA1I	59	38
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC=CC1	ZINC000875321599	EE	On-Demand	Anodyne	SLC6A3	22	43
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC=CC1	ZINC000875321599	EE	On-Demand	Anodyne	HTR4	53	38
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC=CC1	ZINC000875321599	EE	On-Demand	Anodyne	GRIN2B	26	48
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC=CC1	ZINC000875321599	EE	On-Demand	Anodyne	CACNA1I	59	38
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CC(OCC(F)F)C1	ZINC000875321604	GE	On-Demand	Anodyne	SLC6A3	17	41
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC(OCC(F)F)C1	ZINC000875321605	GE	On-Demand	Anodyne	SLC6A3	17	41
CC(=O)[C@H]1CCCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000875321607	GE	On-Demand	Anodyne	SLC6A1	56	40
CC(=O)[C@H]1CCCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000875321607	GE	On-Demand	Anodyne	HTR4	56	38
CC(=O)[C@H]1CCCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000875321607	GE	On-Demand	Anodyne	CCR5	41	39
CC(=O)[C@H]1CCCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000875321607	GE	On-Demand	Anodyne	CACNA1I	57	36
CC(=O)[C@@H]1CCCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000875321608	GE	On-Demand	Anodyne	SLC6A1	56	40
CC(=O)[C@@H]1CCCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000875321608	GE	On-Demand	Anodyne	HTR4	56	38
CC(=O)[C@@H]1CCCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000875321608	GE	On-Demand	Anodyne	CCR5	41	39
CC(=O)[C@@H]1CCCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000875321608	GE	On-Demand	Anodyne	CACNA1I	57	36
CC(=O)[C@@H]1CCCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000875321609	GE	On-Demand	Anodyne	SLC6A1	56	40
CC(=O)[C@@H]1CCCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000875321609	GE	On-Demand	Anodyne	HTR4	56	38
CC(=O)[C@@H]1CCCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000875321609	GE	On-Demand	Anodyne	CCR5	41	39
CC(=O)[C@@H]1CCCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000875321609	GE	On-Demand	Anodyne	CACNA1I	57	36
CC(=O)[C@H]1CCCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000875321610	GE	On-Demand	Anodyne	SLC6A1	56	40
CC(=O)[C@H]1CCCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000875321610	GE	On-Demand	Anodyne	HTR4	56	38
CC(=O)[C@H]1CCCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000875321610	GE	On-Demand	Anodyne	CCR5	41	39
CC(=O)[C@H]1CCCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000875321610	GE	On-Demand	Anodyne	CACNA1I	57	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CCC(CCF)CC1	ZINC000875321616	GG	On-Demand	Anodyne	SLC6A3	25	43
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CCC(CCF)CC1	ZINC000875321616	GG	On-Demand	Anodyne	HTR4	46	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CCC(CCF)CC1	ZINC000875321616	GG	On-Demand	Anodyne	GRIN2B	32	46
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CCC(CCF)CC1	ZINC000875321616	GG	On-Demand	Anodyne	CACNA1I	64	38
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CCC(CCF)CC1	ZINC000875321617	GG	On-Demand	Anodyne	SLC6A3	25	43
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CCC(CCF)CC1	ZINC000875321617	GG	On-Demand	Anodyne	HTR4	46	36
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CCC(CCF)CC1	ZINC000875321617	GG	On-Demand	Anodyne	GRIN2B	32	46
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CCC(CCF)CC1	ZINC000875321617	GG	On-Demand	Anodyne	CACNA1I	64	38
COCC1CC(NC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000875321618	GE	On-Demand	Anodyne	HTR4	56	39
COCC1CC(NC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000875321618	GE	On-Demand	Anodyne	GRIN2B	16	43
COCC1CC(NC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000875321618	GE	On-Demand	Anodyne	CCR3	18	40
COCC1CC(NC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000875321618	GE	On-Demand	Anodyne	CACNA1I	55	37
COCC1CC(NC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000875321619	GE	On-Demand	Anodyne	HTR4	56	39
COCC1CC(NC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000875321619	GE	On-Demand	Anodyne	GRIN2B	16	43
COCC1CC(NC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000875321619	GE	On-Demand	Anodyne	CCR3	18	40
COCC1CC(NC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000875321619	GE	On-Demand	Anodyne	CACNA1I	55	37
CSC1(CNC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)CCC1	ZINC000875321703	GE	On-Demand	Anodyne	ETHR	53	46
COc1ccc(N2CCN(C(=O)C(=O)NCC3(SC)CC3)CC2)c(OC)c1	ZINC000875321800	GD	On-Demand	Clean	DRD2	26	42
COc1ccc(N2CCN(C(=O)C(=O)NCC3(SC)CC3)CC2)c(OC)c1	ZINC000875321800	GD	On-Demand	Clean	DRD4	41	32
COc1ccc(N2CCN(C(=O)C(=O)NCC3(SC)CC3)CC2)c(OC)c1	ZINC000875321800	GD	On-Demand	Clean	DRD3	41	37
CC[C@@H](NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1)[C@@H]1CCCO1	ZINC000875321801	GE	On-Demand	Anodyne	ETHR	61	46
CC[C@@H](NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1)[C@H]1CCCO1	ZINC000875321803	GE	On-Demand	Anodyne	ETHR	61	46
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CCO[C@@H]2CCC[C@@H]21	ZINC000875321858	GE	On-Demand	Anodyne	HTR4	53	36
COC(=O)C1(O)CN(C(=O)N[C@@H]2CC(=O)N([C@H]3C[C@H]3c3ccccc3)C2)C1	ZINC000875321867	FC	On-Demand	Anodyne	SMO	30	43
COC(=O)C1(O)CN(C(=O)N[C@@H]2CC(=O)N([C@H]3C[C@@H]3c3ccccc3)C2)C1	ZINC000875321868	FC	On-Demand	Anodyne	SMO	30	43
COC(=O)C1(O)CN(C(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@H]3c3ccccc3)C2)C1	ZINC000875321869	FC	On-Demand	Anodyne	SMO	30	43
COC(=O)C1(O)CN(C(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@@H]3c3ccccc3)C2)C1	ZINC000875321870	FC	On-Demand	Anodyne	SMO	30	43
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N[C@H]1CC12CCC2	ZINC000875321951	FF	On-Demand	Anodyne	CACNA1I	43	34
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@H]1CC12CCC2	ZINC000875321952	FF	On-Demand	Anodyne	CACNA1I	43	34
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@@H]1CC12CCC2	ZINC000875321955	FF	On-Demand	Anodyne	CACNA1I	43	34
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N[C@@H]1CC12CCC2	ZINC000875321957	FF	On-Demand	Anodyne	CACNA1I	43	34
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N[C@@H]1C[C@H]1C(F)(F)F	ZINC000875322023	GF	On-Demand	Anodyne	CACNA1I	56	37
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@@H]1C[C@H]1C(F)(F)F	ZINC000875322027	GF	On-Demand	Anodyne	CACNA1I	56	37
Cc1cc(/C=C(/C#N)C(=O)Nc2ccc(S(=O)(=O)N(C)C(C)C)cc2)c(C)n1C[C@@H]1CCCO1	ZINC000875322081	JH	On-Demand	Reactive	CA12	15	41
CN(C(=O)[C@H]1CCN(C(=O)c2ccccc2)C1)c1ccc(Cl)nn1	ZINC000875322082	EE	On-Demand	Anodyne	SMO	43	40
CN(C(=O)[C@H]1CCN(C(=O)c2ccccc2)C1)c1ccc(Cl)nn1	ZINC000875322082	EE	On-Demand	Anodyne	L3MBTL3	49	38
Cc1cc(/C=C(/C#N)C(=O)Nc2ccc(S(=O)(=O)N(C)C(C)C)cc2)c(C)n1C[C@H]1CCCO1	ZINC000875322084	JH	On-Demand	Reactive	CA12	15	41
CN(C(=O)[C@H](F)[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccc(Cl)nn1	ZINC000875322105	FF	On-Demand	Anodyne	GPR119	41	38
CN(C(=O)[C@H](F)[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccc(Cl)nn1	ZINC000875322109	FF	On-Demand	Anodyne	GPR119	41	38
C/C=C/CNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875322145	EE	On-Demand	Anodyne	OPRK1	23	40
C/C=C/CNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875322145	EE	On-Demand	Anodyne	SLC6A3	18	40
C/C=C/CNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875322145	EE	On-Demand	Anodyne	HTR4	56	37
C/C=C/CNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875322145	EE	On-Demand	Anodyne	GRIN2B	15	45
C/C=C/CNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875322145	EE	On-Demand	Anodyne	CACNA1I	60	38
C/C=C\CNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875322147	EE	On-Demand	Anodyne	OPRK1	23	40
C/C=C\CNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875322147	EE	On-Demand	Anodyne	SLC6A3	18	40
C/C=C\CNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875322147	EE	On-Demand	Anodyne	HTR4	56	37
C/C=C\CNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875322147	EE	On-Demand	Anodyne	GRIN2B	15	45
C/C=C\CNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875322147	EE	On-Demand	Anodyne	CACNA1I	60	38
C/C=C\CNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875322149	EE	On-Demand	Anodyne	OPRK1	23	40
C/C=C\CNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875322149	EE	On-Demand	Anodyne	SLC6A3	18	40
C/C=C\CNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875322149	EE	On-Demand	Anodyne	HTR4	56	37
C/C=C\CNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875322149	EE	On-Demand	Anodyne	GRIN2B	15	45
C/C=C\CNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875322149	EE	On-Demand	Anodyne	CACNA1I	60	38
C/C=C/CNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875322151	EE	On-Demand	Anodyne	OPRK1	23	40
C/C=C/CNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875322151	EE	On-Demand	Anodyne	SLC6A3	18	40
C/C=C/CNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875322151	EE	On-Demand	Anodyne	HTR4	56	37
C/C=C/CNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875322151	EE	On-Demand	Anodyne	GRIN2B	15	45
C/C=C/CNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875322151	EE	On-Demand	Anodyne	CACNA1I	60	38
CCO[C@@]1(C)C[C@H]1NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875322153	GE	On-Demand	Anodyne	CACNA1I	40	35
CCO[C@@]1(C)C[C@H]1NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875322154	GE	On-Demand	Anodyne	CACNA1I	40	35
C[C@@H]1C[C@H](O)CCN1C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875322218	GD	On-Demand	Anodyne	OPRK1	25	42
C[C@@H]1C[C@H](O)CCN1C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875322218	GD	On-Demand	Anodyne	HTR4	41	36
C[C@@H]1C[C@H](O)CCN1C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875322218	GD	On-Demand	Anodyne	CACNA1I	54	36
C[C@@H]1C[C@H](O)CCN1C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875322219	GD	On-Demand	Anodyne	OPRK1	25	42
C[C@@H]1C[C@H](O)CCN1C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875322219	GD	On-Demand	Anodyne	HTR4	41	36
C[C@@H]1C[C@H](O)CCN1C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875322219	GD	On-Demand	Anodyne	CACNA1I	54	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N(C1CC1)C1CC1	ZINC000875322310	FF	On-Demand	Anodyne	SLC6A3	22	43
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N(C1CC1)C1CC1	ZINC000875322310	FF	On-Demand	Anodyne	HTR4	60	39
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N(C1CC1)C1CC1	ZINC000875322310	FF	On-Demand	Anodyne	GRIN2B	25	48
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N(C1CC1)C1CC1	ZINC000875322310	FF	On-Demand	Anodyne	CCR5	33	42
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N(C1CC1)C1CC1	ZINC000875322310	FF	On-Demand	Anodyne	CACNA1I	60	38
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N(C1CC1)C1CC1	ZINC000875322313	FF	On-Demand	Anodyne	SLC6A3	22	43
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N(C1CC1)C1CC1	ZINC000875322313	FF	On-Demand	Anodyne	HTR4	60	39
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N(C1CC1)C1CC1	ZINC000875322313	FF	On-Demand	Anodyne	GRIN2B	25	48
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N(C1CC1)C1CC1	ZINC000875322313	FF	On-Demand	Anodyne	CCR5	33	42
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N(C1CC1)C1CC1	ZINC000875322313	FF	On-Demand	Anodyne	CACNA1I	60	38
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875322370	GF	On-Demand	Clean	CACNA1I	53	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875322371	GF	On-Demand	Clean	CACNA1I	53	36
CCCCCCCNC(=O)C(=O)N[C@@H](C)C[S@@](C)=O	ZINC000875322391	CC	On-Demand	Mild	ASAH1	61	33
CCCCCCCNC(=O)C(=O)N[C@@H](C)C[S@@](C)=O	ZINC000875322391	CC	On-Demand	Mild	NOD1	45	40
CCCCCCCNC(=O)C(=O)N[C@H](C)C[S@@](C)=O	ZINC000875322392	CC	On-Demand	Mild	ASAH1	61	33
CCCCCCCNC(=O)C(=O)N[C@H](C)C[S@@](C)=O	ZINC000875322392	CC	On-Demand	Mild	NOD1	45	40
CCCCCCCNC(=O)C(=O)N[C@@H](C)C[S@](C)=O	ZINC000875322393	CC	On-Demand	Mild	ASAH1	61	33
CCCCCCCNC(=O)C(=O)N[C@@H](C)C[S@](C)=O	ZINC000875322393	CC	On-Demand	Mild	NOD1	45	40
CCCCCCCNC(=O)C(=O)N[C@H](C)C[S@](C)=O	ZINC000875322394	CC	On-Demand	Mild	ASAH1	61	33
CCCCCCCNC(=O)C(=O)N[C@H](C)C[S@](C)=O	ZINC000875322394	CC	On-Demand	Mild	NOD1	45	40
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H](C)C[S@@](C)=O)CC2	ZINC000875322404	GD	On-Demand	Anodyne	SLC18A2	51	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H](C)C[S@@](C)=O)CC2	ZINC000875322405	GD	On-Demand	Anodyne	SLC18A2	51	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H](C)C[S@](C)=O)CC2	ZINC000875322406	GD	On-Demand	Anodyne	SLC18A2	51	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H](C)C[S@](C)=O)CC2	ZINC000875322407	GD	On-Demand	Anodyne	SLC18A2	51	37
Cn1nc(Cl)c(C(=O)N[C@@H](c2ccccc2)C2CCOCC2)c1Cl	ZINC000875322418	FH	On-Demand	Anodyne	TACR3	27	42
Cn1nc(Cl)c(C(=O)N[C@H](c2ccccc2)C2CCOCC2)c1Cl	ZINC000875322419	FH	On-Demand	Anodyne	TACR3	27	42
CCOC1CC2(C1)C[C@H]2C(=O)Nc1cc(-c2ccccc2)ns1	ZINC000875322425	EH	On-Demand	Anodyne	TIMP3	64	33
CC(C)[C@H]1CCC[C@H](NC(=O)C(=O)N2CCC(N3CCN(C)CC3)CC2)CC1	ZINC000875322450	GD	On-Demand	Anodyne	L3MBTL3	40	41
CC(C)[C@H]1CCC[C@@H](NC(=O)C(=O)N2CCC(N3CCN(C)CC3)CC2)CC1	ZINC000875322451	GD	On-Demand	Anodyne	L3MBTL3	40	41
CSC1(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875322521	GE	On-Demand	Anodyne	CHRM2	19	40
CSC1(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875322521	GE	On-Demand	Anodyne	DRD2	26	51
CSC1(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875322521	GE	On-Demand	Anodyne	DRD4	48	42
CSC1(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875322521	GE	On-Demand	Anodyne	ACHE	65	60
CSC1(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875322521	GE	On-Demand	Anodyne	DRD3	17	43
CSC1(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875322521	GE	On-Demand	Anodyne	SLC6A3	15	47
CSC1(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875322521	GE	On-Demand	Anodyne	HTR4	23	40
CSC1(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875322521	GE	On-Demand	Anodyne	CHRM3	24	40
CSC1(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875322521	GE	On-Demand	Anodyne	SIGMAR1	76	51
CSC1(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875322521	GE	On-Demand	Anodyne	BCHE	19	48
CSC1(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875322521	GE	On-Demand	Anodyne	CCR3	51	39
CSC1(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875322521	GE	On-Demand	Anodyne	MCHR1	29	41
CSC1(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875322521	GE	On-Demand	Anodyne	CACNA1G	38	45
CSC1(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875322521	GE	On-Demand	Anodyne	CACNA1I	43	38
CSC1(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875322521	GE	On-Demand	Anodyne	NPFFR1	45	39
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1nc(-c2cccc(F)c2)no1	ZINC000875322545	GG	On-Demand	Anodyne	BMP1	27	41
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1nc(-c2cccc(F)c2)no1	ZINC000875322545	GG	On-Demand	Anodyne	GRM5	24	49
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1nc(-c2cccc(F)c2)no1	ZINC000875322545	GG	On-Demand	Anodyne	ETHR	17	43
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1nc(-c2cccc(F)c2)no1	ZINC000875322546	GG	On-Demand	Anodyne	BMP1	27	41
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1nc(-c2cccc(F)c2)no1	ZINC000875322546	GG	On-Demand	Anodyne	GRM5	24	49
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1nc(-c2cccc(F)c2)no1	ZINC000875322546	GG	On-Demand	Anodyne	ETHR	17	43
C#C[C@H](NC(=O)C(=O)N[C@@H]1CCN(Cc2ccc(C)cc2)C1)[C@H]1CCCO1	ZINC000875322568	FC	On-Demand	Mild	DRD4	23	43
C#C[C@H](NC(=O)C(=O)N[C@H]1CCN(Cc2ccc(C)cc2)C1)[C@@H]1CCCO1	ZINC000875322571	FC	On-Demand	Mild	DRD4	23	43
C#C[C@H](NC(=O)C(=O)N[C@H]1CCN(Cc2ccc(C)cc2)C1)[C@H]1CCCO1	ZINC000875322572	FC	On-Demand	Mild	DRD4	23	43
C#C[C@H](NC(=O)C(=O)N[C@@H]1CCN(Cc2ccc(C)cc2)C1)[C@@H]1CCCO1	ZINC000875322573	FC	On-Demand	Mild	DRD4	23	43
C#C[C@H](NC(=O)C(=O)N[C@@H](c1ccccn1)C1CCC1)[C@@H]1CCCO1	ZINC000875322624	ED	On-Demand	Mild	TTK	20	41
C#C[C@H](NC(=O)C(=O)N[C@H](c1ccccn1)C1CCC1)[C@H]1CCCO1	ZINC000875322626	ED	On-Demand	Mild	TTK	20	41
C#C[C@H](NC(=O)C(=O)N[C@@H](c1ccccn1)C1CCC1)[C@H]1CCCO1	ZINC000875322628	ED	On-Demand	Mild	TTK	20	41
C#C[C@H](NC(=O)C(=O)N[C@H](c1ccccn1)C1CCC1)[C@@H]1CCCO1	ZINC000875322629	ED	On-Demand	Mild	TTK	20	41
COC(=O)N(C)NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875322632	FD	On-Demand	Reactive	SLC6A3	18	40
COC(=O)N(C)NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875322632	FD	On-Demand	Reactive	HTR4	45	37
COC(=O)N(C)NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875322632	FD	On-Demand	Reactive	CCR3	21	43
COC(=O)N(C)NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875322632	FD	On-Demand	Reactive	CACNA1I	56	37
COC(=O)N(C)NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875322634	FD	On-Demand	Reactive	SLC6A3	18	40
COC(=O)N(C)NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875322634	FD	On-Demand	Reactive	HTR4	45	37
COC(=O)N(C)NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875322634	FD	On-Demand	Reactive	CCR3	21	43
COC(=O)N(C)NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875322634	FD	On-Demand	Reactive	CACNA1I	56	37
CCN(C(=O)c1c(Cl)nn(C)c1Cl)[C@H](C)c1cccnc1	ZINC000875322678	EG	On-Demand	Anodyne	GPBAR1	15	43
CCN(C(=O)c1c(Cl)nn(C)c1Cl)[C@@H](C)c1cccnc1	ZINC000875322679	EG	On-Demand	Anodyne	GPBAR1	15	43
O=C(NCCC(F)(F)F)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875322684	GG	On-Demand	Anodyne	ABL1	15	43
O=C(NCCC(F)(F)F)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875322684	GG	On-Demand	Anodyne	CALCRL	29	42
O=C(NCCC(F)(F)F)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875322684	GG	On-Demand	Anodyne	ETHR	52	38
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NCC1COC1	ZINC000875322686	ED	On-Demand	Anodyne	SLC6A3	21	43
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NCC1COC1	ZINC000875322686	ED	On-Demand	Anodyne	HTR4	59	38
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NCC1COC1	ZINC000875322686	ED	On-Demand	Anodyne	GRIN2B	24	48
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NCC1COC1	ZINC000875322686	ED	On-Demand	Anodyne	CCR3	18	44
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NCC1COC1	ZINC000875322686	ED	On-Demand	Anodyne	CACNA1I	60	38
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NCC1COC1	ZINC000875322687	ED	On-Demand	Anodyne	SLC6A3	21	43
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NCC1COC1	ZINC000875322687	ED	On-Demand	Anodyne	HTR4	59	38
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NCC1COC1	ZINC000875322687	ED	On-Demand	Anodyne	GRIN2B	24	48
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NCC1COC1	ZINC000875322687	ED	On-Demand	Anodyne	CCR3	18	44
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NCC1COC1	ZINC000875322687	ED	On-Demand	Anodyne	CACNA1I	60	38
O=CN1CCCN(C(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@H]3c3ccccc3)C2)CC1	ZINC000875322688	FD	On-Demand	Anodyne	EPHX2	21	42
O=CN1CCCN(C(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@H]3c3ccccc3)C2)CC1	ZINC000875322688	FD	On-Demand	Anodyne	SMO	35	52
O=CN1CCCN(C(=O)N[C@@H]2CC(=O)N([C@H]3C[C@@H]3c3ccccc3)C2)CC1	ZINC000875322689	FD	On-Demand	Anodyne	EPHX2	21	42
O=CN1CCCN(C(=O)N[C@@H]2CC(=O)N([C@H]3C[C@@H]3c3ccccc3)C2)CC1	ZINC000875322689	FD	On-Demand	Anodyne	SMO	35	52
O=CN1CCCN(C(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@@H]3c3ccccc3)C2)CC1	ZINC000875322690	FD	On-Demand	Anodyne	EPHX2	21	42
O=CN1CCCN(C(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@@H]3c3ccccc3)C2)CC1	ZINC000875322690	FD	On-Demand	Anodyne	SMO	35	52
O=CN1CCCN(C(=O)N[C@@H]2CC(=O)N([C@H]3C[C@H]3c3ccccc3)C2)CC1	ZINC000875322691	FD	On-Demand	Anodyne	EPHX2	21	42
O=CN1CCCN(C(=O)N[C@@H]2CC(=O)N([C@H]3C[C@H]3c3ccccc3)C2)CC1	ZINC000875322691	FD	On-Demand	Anodyne	SMO	35	52
O=C(NCCSCCC(F)(F)F)NCc1cccc(N2CC=CC2)c1	ZINC000875322712	FH	On-Demand	Anodyne	CARM1	40	32
O=C(NCC[C@@H]1CCCS1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875322717	GG	On-Demand	Anodyne	CACNA1I	50	35
O=C(NCC[C@H]1CCCS1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875322718	GG	On-Demand	Anodyne	CACNA1I	50	35
O=C(NCC[C@@H]1CCCS1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875322719	GG	On-Demand	Anodyne	CACNA1I	50	35
O=C(NCC[C@H]1CCCS1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875322720	GG	On-Demand	Anodyne	CACNA1I	50	35
COC(=O)N(C)NC(=O)N[C@H](C)c1cccc(-n2ccnc2)c1	ZINC000875322723	DD	On-Demand	Reactive	CYP26A1	62	34
COC(=O)N(C)NC(=O)N[C@@H](C)c1cccc(-n2ccnc2)c1	ZINC000875322724	DD	On-Demand	Reactive	CYP26A1	62	34
COc1ccccc1[C@H]1CCCN(C(=O)NCc2nnnn2C2CC2)CC1	ZINC000875322774	FE	On-Demand	Anodyne	SMO	31	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2nnnn2C2CC2)CC1	ZINC000875322775	FE	On-Demand	Anodyne	SMO	31	40
CC(=O)C1CCN(C(=O)C(=O)NCC2(c3ccc(F)cc3F)CCCC2)CC1	ZINC000875322803	GF	On-Demand	Anodyne	CACNA1G	16	40
Cc1cccc2c1CCCN2C(=O)c1sccc1CC#N	ZINC000875322831	CH	On-Demand	Mild	AVPR2	56	39
CC[C@@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)[C@H]1CCCO1	ZINC000875322844	FC	On-Demand	Anodyne	L3MBTL3	53	40
CC[C@@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)[C@@H]1CCCO1	ZINC000875322846	FC	On-Demand	Anodyne	L3MBTL3	53	40
COc1ccccc1-c1noc([C@H](C)NC(=O)NC2(C)CC(F)(F)C2)n1	ZINC000875322879	FG	On-Demand	Anodyne	LUCI_PHOPE	31	44
COc1ccccc1-c1noc([C@@H](C)NC(=O)NC2(C)CC(F)(F)C2)n1	ZINC000875322880	FG	On-Demand	Anodyne	LUCI_PHOPE	31	44
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2nc(-c3cccc(F)c3)no2)C1	ZINC000875322894	GF	On-Demand	Anodyne	GRM5	18	45
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2nc(-c3cccc(F)c3)no2)C1	ZINC000875322901	GF	On-Demand	Anodyne	GRM5	18	45
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCC1(SC)CC1)CC2	ZINC000875322915	GE	On-Demand	Anodyne	SLC18A2	47	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCC1(SC)CC1)CC2	ZINC000875322918	GE	On-Demand	Anodyne	SLC18A2	47	34
CSC1(CNC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)CC1	ZINC000875322920	GE	On-Demand	Anodyne	ETHR	54	47
Cc1nccnc1[C@H](C)NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875322957	GF	On-Demand	Anodyne	HTR4	54	39
Cc1nccnc1[C@H](C)NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875322957	GF	On-Demand	Anodyne	GRIN2B	20	41
Cc1nccnc1[C@H](C)NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875322957	GF	On-Demand	Anodyne	CACNA1I	47	37
Cc1nccnc1[C@H](C)NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875322959	GF	On-Demand	Anodyne	HTR4	54	39
Cc1nccnc1[C@H](C)NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875322959	GF	On-Demand	Anodyne	GRIN2B	20	41
Cc1nccnc1[C@H](C)NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875322959	GF	On-Demand	Anodyne	CACNA1I	47	37
Cc1nccnc1[C@@H](C)NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875322962	GF	On-Demand	Anodyne	HTR4	54	39
Cc1nccnc1[C@@H](C)NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875322962	GF	On-Demand	Anodyne	GRIN2B	20	41
Cc1nccnc1[C@@H](C)NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875322962	GF	On-Demand	Anodyne	CACNA1I	47	37
Cc1nccnc1[C@@H](C)NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875322965	GF	On-Demand	Anodyne	HTR4	54	39
Cc1nccnc1[C@@H](C)NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875322965	GF	On-Demand	Anodyne	GRIN2B	20	41
Cc1nccnc1[C@@H](C)NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875322965	GF	On-Demand	Anodyne	CACNA1I	47	37
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875322968	GG	On-Demand	Anodyne	SLC6A3	15	40
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875322968	GG	On-Demand	Anodyne	HTR4	41	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875322968	GG	On-Demand	Anodyne	GRIN2B	22	45
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875322968	GG	On-Demand	Anodyne	CACNA1I	49	36
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875322971	GG	On-Demand	Anodyne	SLC6A3	15	40
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875322971	GG	On-Demand	Anodyne	HTR4	41	36
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875322971	GG	On-Demand	Anodyne	GRIN2B	22	45
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875322971	GG	On-Demand	Anodyne	CACNA1I	49	36
Cc1nnc([C@@H](C)NC(=O)C(=O)NCCCCC2CC2)s1	ZINC000875322984	DD	On-Demand	Anodyne	SIRT3	48	30
Cc1nnc([C@@H](C)NC(=O)C(=O)NCCCCC2CC2)s1	ZINC000875322984	DD	On-Demand	Anodyne	SIRT2	49	31
Cc1nnc([C@@H](C)NC(=O)C(=O)NCCCCC2CC2)s1	ZINC000875322984	DD	On-Demand	Anodyne	SIRT1	49	35
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](CC1CCC1)c1ccccc1	ZINC000875323024	FF	On-Demand	Mild	REN	16	40
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H](CC1CCC1)c1ccccc1	ZINC000875323026	FF	On-Demand	Mild	REN	16	40
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H](CC1CCC1)c1ccccc1	ZINC000875323028	FF	On-Demand	Mild	REN	16	40
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](CC1CCC1)c1ccccc1	ZINC000875323030	FF	On-Demand	Mild	REN	16	40
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1nc(-c2cccc(F)c2)no1	ZINC000875323048	GG	On-Demand	Anodyne	GRM5	17	43
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1nc(-c2cccc(F)c2)no1	ZINC000875323048	GG	On-Demand	Anodyne	ETHR	16	41
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1nc(-c2cccc(F)c2)no1	ZINC000875323050	GG	On-Demand	Anodyne	GRM5	17	43
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1nc(-c2cccc(F)c2)no1	ZINC000875323050	GG	On-Demand	Anodyne	ETHR	16	41
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC[C@@H](O)[C@@H]1CCCO1	ZINC000875323082	GD	On-Demand	Anodyne	HTR4	48	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC[C@@H](O)[C@@H]1CCCO1	ZINC000875323082	GD	On-Demand	Anodyne	CACNA1I	50	35
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC[C@@H](O)[C@H]1CCCO1	ZINC000875323084	GD	On-Demand	Anodyne	HTR4	48	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC[C@@H](O)[C@H]1CCCO1	ZINC000875323084	GD	On-Demand	Anodyne	CACNA1I	50	35
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC[C@H](O)[C@H]1CCCO1	ZINC000875323086	GD	On-Demand	Anodyne	HTR4	48	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC[C@H](O)[C@H]1CCCO1	ZINC000875323086	GD	On-Demand	Anodyne	CACNA1I	50	35
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC[C@H](O)[C@@H]1CCCO1	ZINC000875323087	GD	On-Demand	Anodyne	HTR4	48	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC[C@H](O)[C@@H]1CCCO1	ZINC000875323087	GD	On-Demand	Anodyne	CACNA1I	50	35
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875323098	GD	On-Demand	Anodyne	HTR4	45	36
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875323098	GD	On-Demand	Anodyne	CACNA1I	53	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875323099	GD	On-Demand	Anodyne	HTR4	45	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875323099	GD	On-Demand	Anodyne	CACNA1I	53	36
CSc1nn(C)c(NC(=O)c2cccc(OC(C)(C)C)c2)c1C(N)=O	ZINC000875323101	FF	On-Demand	Anodyne	DRD4	40	30
C#C[C@@H]1CC[C@@H](NC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CC1	ZINC000875323103	GF	On-Demand	Mild	CACNA1I	42	34
C#C[C@@H]1CC[C@@H](NC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CC1	ZINC000875323105	GF	On-Demand	Mild	CACNA1I	42	34
COc1ccccc1[C@H]1CCCN(C(=O)NCc2c(C)nn(C)c2C)CC1	ZINC000875323114	FH	On-Demand	Anodyne	HTR1A	18	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2c(C)nn(C)c2C)CC1	ZINC000875323125	FH	On-Demand	Anodyne	HTR1A	18	40
COC(=O)C1(O)CN(C(=O)N[C@H](C)c2cccc(-n3ccnc3)c2)C1	ZINC000875323128	EC	On-Demand	Anodyne	CYP26A1	72	34
COC(=O)C1(O)CN(C(=O)N[C@@H](C)c2cccc(-n3ccnc3)c2)C1	ZINC000875323130	EC	On-Demand	Anodyne	CYP26A1	72	34
C[C@H]1CCCCCN1C(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875323136	EI	On-Demand	Anodyne	PREP	29	41
CN(CC1(C)COC1)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875323175	GE	On-Demand	Anodyne	HTR4	49	36
CN(CC1(C)COC1)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875323175	GE	On-Demand	Anodyne	CACNA1I	46	37
CN(CC1(C)COC1)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875323177	GE	On-Demand	Anodyne	HTR4	49	36
CN(CC1(C)COC1)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875323177	GE	On-Demand	Anodyne	CACNA1I	46	37
O=C(NCc1ccnc(F)c1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875323181	GE	On-Demand	Anodyne	HTR4	41	37
O=C(NCc1ccnc(F)c1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875323181	GE	On-Demand	Anodyne	GRIN2B	24	42
O=C(NCc1ccnc(F)c1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875323181	GE	On-Demand	Anodyne	CCR3	32	41
O=C(NCc1ccnc(F)c1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875323181	GE	On-Demand	Anodyne	CACNA1I	47	34
O=C(NCc1ccnc(F)c1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875323334	GE	On-Demand	Anodyne	HTR4	41	37
O=C(NCc1ccnc(F)c1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875323334	GE	On-Demand	Anodyne	GRIN2B	24	42
O=C(NCc1ccnc(F)c1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875323334	GE	On-Demand	Anodyne	CCR3	32	41
O=C(NCc1ccnc(F)c1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875323334	GE	On-Demand	Anodyne	CACNA1I	47	34
N#CCCN1CCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CC1	ZINC000875323337	GD	On-Demand	Mild	SLC6A3	19	45
N#CCCN1CCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CC1	ZINC000875323337	GD	On-Demand	Mild	HTR4	47	37
N#CCCN1CCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CC1	ZINC000875323337	GD	On-Demand	Mild	CACNA1I	44	34
N#CCCN1CCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CC1	ZINC000875323341	GD	On-Demand	Mild	SLC6A3	19	45
N#CCCN1CCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CC1	ZINC000875323341	GD	On-Demand	Mild	HTR4	47	37
N#CCCN1CCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CC1	ZINC000875323341	GD	On-Demand	Mild	CACNA1I	44	34
O=C(N[C@@H]1CC(=O)N([C@@H]2C[C@H]2c2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875323357	GC	On-Demand	Anodyne	EPHX2	23	45
O=C(N[C@@H]1CC(=O)N([C@@H]2C[C@H]2c2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875323357	GC	On-Demand	Anodyne	SMO	32	46
O=C(N[C@@H]1CC(=O)N([C@H]2C[C@@H]2c2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875323361	GC	On-Demand	Anodyne	EPHX2	23	45
O=C(N[C@@H]1CC(=O)N([C@H]2C[C@@H]2c2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875323361	GC	On-Demand	Anodyne	SMO	32	46
O=C(N[C@@H]1CC(=O)N([C@@H]2C[C@@H]2c2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875323365	GC	On-Demand	Anodyne	EPHX2	23	45
O=C(N[C@@H]1CC(=O)N([C@@H]2C[C@@H]2c2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875323365	GC	On-Demand	Anodyne	SMO	32	46
O=C(N[C@@H]1CC(=O)N([C@H]2C[C@H]2c2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875323367	GC	On-Demand	Anodyne	EPHX2	23	45
O=C(N[C@@H]1CC(=O)N([C@H]2C[C@H]2c2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875323367	GC	On-Demand	Anodyne	SMO	32	46
O=C(NCCN1CC[C@H](O)C1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875323381	GC	On-Demand	Anodyne	OPRK1	25	44
O=C(NCCN1CC[C@H](O)C1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875323381	GC	On-Demand	Anodyne	SLC6A3	17	41
O=C(NCCN1CC[C@H](O)C1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875323381	GC	On-Demand	Anodyne	HTR4	49	37
O=C(NCCN1CC[C@H](O)C1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875323381	GC	On-Demand	Anodyne	CCR3	21	40
O=C(NCCN1CC[C@H](O)C1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875323381	GC	On-Demand	Anodyne	CACNA1I	51	35
O=C(NCCN1CC[C@@H](O)C1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875323383	GC	On-Demand	Anodyne	OPRK1	25	44
O=C(NCCN1CC[C@@H](O)C1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875323383	GC	On-Demand	Anodyne	SLC6A3	17	41
O=C(NCCN1CC[C@@H](O)C1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875323383	GC	On-Demand	Anodyne	HTR4	49	37
O=C(NCCN1CC[C@@H](O)C1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875323383	GC	On-Demand	Anodyne	CCR3	21	40
O=C(NCCN1CC[C@@H](O)C1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875323383	GC	On-Demand	Anodyne	CACNA1I	51	35
O=C(NCCN1CC[C@H](O)C1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875323385	GC	On-Demand	Anodyne	OPRK1	25	44
O=C(NCCN1CC[C@H](O)C1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875323385	GC	On-Demand	Anodyne	SLC6A3	17	41
O=C(NCCN1CC[C@H](O)C1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875323385	GC	On-Demand	Anodyne	HTR4	49	37
O=C(NCCN1CC[C@H](O)C1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875323385	GC	On-Demand	Anodyne	CCR3	21	40
O=C(NCCN1CC[C@H](O)C1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875323385	GC	On-Demand	Anodyne	CACNA1I	51	35
O=C(NCCN1CC[C@@H](O)C1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875323386	GC	On-Demand	Anodyne	OPRK1	25	44
O=C(NCCN1CC[C@@H](O)C1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875323386	GC	On-Demand	Anodyne	SLC6A3	17	41
O=C(NCCN1CC[C@@H](O)C1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875323386	GC	On-Demand	Anodyne	HTR4	49	37
O=C(NCCN1CC[C@@H](O)C1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875323386	GC	On-Demand	Anodyne	CCR3	21	40
O=C(NCCN1CC[C@@H](O)C1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875323386	GC	On-Demand	Anodyne	CACNA1I	51	35
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875323395	GE	On-Demand	Anodyne	HTR4	58	37
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875323395	GE	On-Demand	Anodyne	CACNA1I	59	41
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875323400	GE	On-Demand	Anodyne	HTR4	58	37
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875323400	GE	On-Demand	Anodyne	CACNA1I	59	41
CN(C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)[C@H]1C[C@@H](C(N)=O)C1	ZINC000875323443	GD	On-Demand	Anodyne	HTR4	41	35
CN(C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)[C@H]1C[C@@H](C(N)=O)C1	ZINC000875323443	GD	On-Demand	Anodyne	CCR5	24	45
CN(C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)[C@H]1C[C@@H](C(N)=O)C1	ZINC000875323443	GD	On-Demand	Anodyne	CACNA1I	55	37
CN(C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)[C@H]1C[C@@H](C(N)=O)C1	ZINC000875323446	GD	On-Demand	Anodyne	HTR4	41	35
CN(C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)[C@H]1C[C@@H](C(N)=O)C1	ZINC000875323446	GD	On-Demand	Anodyne	CCR5	24	45
CN(C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)[C@H]1C[C@@H](C(N)=O)C1	ZINC000875323446	GD	On-Demand	Anodyne	CACNA1I	55	37
CN(C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)[C@@H]1CCCC[C@H]1O	ZINC000875323514	GE	On-Demand	Anodyne	OPRK1	38	46
CN(C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)[C@@H]1CCCC[C@H]1O	ZINC000875323514	GE	On-Demand	Anodyne	HTR4	52	36
CN(C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)[C@@H]1CCCC[C@H]1O	ZINC000875323514	GE	On-Demand	Anodyne	CCR5	29	45
CN(C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)[C@@H]1CCCC[C@H]1O	ZINC000875323514	GE	On-Demand	Anodyne	CACNA1I	57	36
CN(C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)[C@@H]1CCCC[C@H]1O	ZINC000875323515	GE	On-Demand	Anodyne	OPRK1	38	46
CN(C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)[C@@H]1CCCC[C@H]1O	ZINC000875323515	GE	On-Demand	Anodyne	HTR4	52	36
CN(C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)[C@@H]1CCCC[C@H]1O	ZINC000875323515	GE	On-Demand	Anodyne	CCR5	29	45
CN(C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)[C@@H]1CCCC[C@H]1O	ZINC000875323515	GE	On-Demand	Anodyne	CACNA1I	57	36
CN(C(=O)[C@@H]1C[C@H]1c1ccsc1)c1ccc(Cl)nn1	ZINC000875323556	CF	On-Demand	Anodyne	NPBWR1	93	36
O=C(NCCC(F)(F)F)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875323687	DF	On-Demand	Anodyne	EPHX2	20	47
O=C(NCCC(F)(F)F)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875323688	DF	On-Demand	Anodyne	EPHX2	20	47
CCn1ncc(CNC(=O)NCc2cccc(N3CC=CC3)c2)n1	ZINC000875323742	ED	On-Demand	Anodyne	CARM1	43	34
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1C[C@H]2COC[C@H]2C1	ZINC000875323759	FD	On-Demand	Anodyne	SLC6A3	16	40
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1C[C@H]2COC[C@H]2C1	ZINC000875323759	FD	On-Demand	Anodyne	HTR4	51	36
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1C[C@H]2COC[C@H]2C1	ZINC000875323759	FD	On-Demand	Anodyne	GRIN2B	21	45
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1C[C@H]2COC[C@H]2C1	ZINC000875323759	FD	On-Demand	Anodyne	CACNA1I	49	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1C[C@H]2COC[C@H]2C1	ZINC000875323760	FD	On-Demand	Anodyne	SLC6A3	16	40
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1C[C@H]2COC[C@H]2C1	ZINC000875323760	FD	On-Demand	Anodyne	HTR4	51	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1C[C@H]2COC[C@H]2C1	ZINC000875323760	FD	On-Demand	Anodyne	GRIN2B	21	45
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1C[C@H]2COC[C@H]2C1	ZINC000875323760	FD	On-Demand	Anodyne	CACNA1I	49	36
O=C(NCc1cccnc1O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875323774	GE	On-Demand	Anodyne	GRIN2B	30	46
O=C(NCc1cccnc1O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875323774	GE	On-Demand	Anodyne	CCR3	18	41
O=C(NCc1cccnc1O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875323774	GE	On-Demand	Anodyne	CACNA1I	42	33
O=C(NCc1cccnc1O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875323775	GE	On-Demand	Anodyne	GRIN2B	30	46
O=C(NCc1cccnc1O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875323775	GE	On-Demand	Anodyne	CCR3	18	41
O=C(NCc1cccnc1O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875323775	GE	On-Demand	Anodyne	CACNA1I	42	33
O=C(N[C@H]1CC(=O)N([C@@H]2C[C@@H]2c2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875323777	GE	On-Demand	Anodyne	SMO	24	40
O=C1C[C@H](NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)CN1[C@H]1C[C@@H]1c1ccccc1	ZINC000875323778	GE	On-Demand	Anodyne	SMO	24	40
O=C1C[C@H](NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)CN1[C@H]1C[C@H]1c1ccccc1	ZINC000875323779	GE	On-Demand	Anodyne	SMO	24	40
O=C(N[C@H]1CC(=O)N([C@@H]2C[C@H]2c2ccccc2)C1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875323780	GE	On-Demand	Anodyne	SMO	24	40
C#CC[C@@H](CCOC)NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875323793	GE	On-Demand	Mild	CACNA1I	54	36
C#CC[C@H](CCOC)NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875323794	GE	On-Demand	Mild	CACNA1I	54	36
C#CC[C@H](CCOC)NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875323795	GE	On-Demand	Mild	CACNA1I	54	36
C#CC[C@@H](CCOC)NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875323796	GE	On-Demand	Mild	CACNA1I	54	36
C[C@@H](NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1ccns1	ZINC000875323801	GF	On-Demand	Anodyne	CACNA1I	43	37
C[C@H](NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1ccns1	ZINC000875323802	GF	On-Demand	Anodyne	CACNA1I	43	37
C[C@@H](NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1ccns1	ZINC000875323803	GF	On-Demand	Anodyne	CACNA1I	43	37
C[C@H](NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1ccns1	ZINC000875323804	GF	On-Demand	Anodyne	CACNA1I	43	37
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@@H]1CCCn2nccc21	ZINC000875323818	GE	On-Demand	Anodyne	HTR4	47	35
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@H]1CCCn2nccc21	ZINC000875323820	GE	On-Demand	Anodyne	HTR4	47	35
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N[C@H]1CCCn2nccc21	ZINC000875323822	GE	On-Demand	Anodyne	HTR4	47	35
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N[C@@H]1CCCn2nccc21	ZINC000875323824	GE	On-Demand	Anodyne	HTR4	47	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CC(=O)N([C@H]3C[C@@H]3c3ccccc3)C2)C1	ZINC000875323826	GD	On-Demand	Anodyne	SMO	27	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@H]3c3ccccc3)C2)C1	ZINC000875323828	GD	On-Demand	Anodyne	SMO	27	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CC(=O)N([C@H]3C[C@H]3c3ccccc3)C2)C1	ZINC000875323831	GD	On-Demand	Anodyne	SMO	27	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@@H]3c3ccccc3)C2)C1	ZINC000875323833	GD	On-Demand	Anodyne	SMO	27	41
C[C@H](NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1ccccc1O	ZINC000875323857	GG	On-Demand	Clean	SLC6A3	27	45
C[C@H](NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1ccccc1O	ZINC000875323857	GG	On-Demand	Clean	HTR4	57	38
C[C@H](NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1ccccc1O	ZINC000875323857	GG	On-Demand	Clean	GRIN2B	22	47
C[C@H](NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1ccccc1O	ZINC000875323857	GG	On-Demand	Clean	CCR3	18	43
C[C@H](NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1ccccc1O	ZINC000875323857	GG	On-Demand	Clean	CACNA1I	60	39
C[C@H](NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1ccccc1O	ZINC000875323859	GG	On-Demand	Clean	SLC6A3	27	45
C[C@H](NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1ccccc1O	ZINC000875323859	GG	On-Demand	Clean	HTR4	57	38
C[C@H](NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1ccccc1O	ZINC000875323859	GG	On-Demand	Clean	GRIN2B	22	47
C[C@H](NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1ccccc1O	ZINC000875323859	GG	On-Demand	Clean	CCR3	18	43
C[C@H](NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1ccccc1O	ZINC000875323859	GG	On-Demand	Clean	CACNA1I	60	39
C[C@@H](NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1ccccc1O	ZINC000875323861	GG	On-Demand	Clean	SLC6A3	27	45
C[C@@H](NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1ccccc1O	ZINC000875323861	GG	On-Demand	Clean	HTR4	57	38
C[C@@H](NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1ccccc1O	ZINC000875323861	GG	On-Demand	Clean	GRIN2B	22	47
C[C@@H](NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1ccccc1O	ZINC000875323861	GG	On-Demand	Clean	CCR3	18	43
C[C@@H](NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1ccccc1O	ZINC000875323861	GG	On-Demand	Clean	CACNA1I	60	39
C[C@@H](NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1ccccc1O	ZINC000875323863	GG	On-Demand	Clean	SLC6A3	27	45
C[C@@H](NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1ccccc1O	ZINC000875323863	GG	On-Demand	Clean	HTR4	57	38
C[C@@H](NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1ccccc1O	ZINC000875323863	GG	On-Demand	Clean	GRIN2B	22	47
C[C@@H](NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1ccccc1O	ZINC000875323863	GG	On-Demand	Clean	CCR3	18	43
C[C@@H](NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1ccccc1O	ZINC000875323863	GG	On-Demand	Clean	CACNA1I	60	39
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CC(=O)N([C@H]3C[C@@H]3c3ccccc3)C2)CC1	ZINC000875323871	FD	On-Demand	Anodyne	EPHX2	25	41
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CC(=O)N([C@H]3C[C@@H]3c3ccccc3)C2)CC1	ZINC000875323871	FD	On-Demand	Anodyne	SMO	36	47
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@H]3c3ccccc3)C2)CC1	ZINC000875323873	FD	On-Demand	Anodyne	EPHX2	25	41
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@H]3c3ccccc3)C2)CC1	ZINC000875323873	FD	On-Demand	Anodyne	SMO	36	47
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CC(=O)N([C@H]3C[C@H]3c3ccccc3)C2)CC1	ZINC000875323876	FD	On-Demand	Anodyne	EPHX2	25	41
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CC(=O)N([C@H]3C[C@H]3c3ccccc3)C2)CC1	ZINC000875323876	FD	On-Demand	Anodyne	SMO	36	47
CSC1(CNC(=O)C(=O)NCc2nc(-c3ccncc3)cs2)CC1	ZINC000875323910	FD	On-Demand	Anodyne	ROCK1	23	42
CSC1(CNC(=O)C(=O)NCc2nc(-c3ccncc3)cs2)CC1	ZINC000875323910	FD	On-Demand	Anodyne	ROCK2	15	42
C[C@@H](NC(=O)NC(C)(C)[C@@H]1CCCCO1)c1nc(-c2cccc(F)c2)no1	ZINC000875323934	GH	On-Demand	Anodyne	GRM5	16	43
C[C@@H](NC(=O)NC(C)(C)[C@H]1CCCCO1)c1nc(-c2cccc(F)c2)no1	ZINC000875323936	GH	On-Demand	Anodyne	GRM5	16	43
C[C@H](NC(=O)NC(C)(C)[C@H]1CCCCO1)c1nc(-c2cccc(F)c2)no1	ZINC000875323939	GH	On-Demand	Anodyne	GRM5	16	43
C[C@H](NC(=O)NC(C)(C)[C@@H]1CCCCO1)c1nc(-c2cccc(F)c2)no1	ZINC000875323941	GH	On-Demand	Anodyne	GRM5	16	43
C#C[C@@H](NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1)[C@@H]1CCCO1	ZINC000875324011	GD	On-Demand	Mild	ETHR	52	43
C#C[C@H](NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1)[C@@H]1CCCO1	ZINC000875324012	GD	On-Demand	Mild	ETHR	52	43
C#C[C@@H](NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1)[C@H]1CCCO1	ZINC000875324013	GD	On-Demand	Mild	ETHR	52	43
C#C[C@H](NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1)[C@H]1CCCO1	ZINC000875324014	GD	On-Demand	Mild	ETHR	52	43
C[C@H]1CCCCCN1C(=O)c1scnc1C(F)F	ZINC000875324109	CG	On-Demand	Anodyne	TRPC6	15	43
C[C@H]1CCCCCN1C(=O)c1scnc1C(F)F	ZINC000875324109	CG	On-Demand	Anodyne	TRPC3	17	43
CO[C@@H]1CC[C@@H](C)N(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000875324146	GF	On-Demand	Anodyne	HTR4	49	37
CO[C@@H]1CC[C@@H](C)N(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000875324148	GF	On-Demand	Anodyne	HTR4	49	37
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CC(c2ccccc2)C1	ZINC000875324157	GG	On-Demand	Anodyne	SLC6A3	24	44
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CC(c2ccccc2)C1	ZINC000875324157	GG	On-Demand	Anodyne	HTR4	49	37
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CC(c2ccccc2)C1	ZINC000875324157	GG	On-Demand	Anodyne	GRIN2B	19	46
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CC(c2ccccc2)C1	ZINC000875324157	GG	On-Demand	Anodyne	CCR5	45	41
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CC(c2ccccc2)C1	ZINC000875324157	GG	On-Demand	Anodyne	SLC18A3	32	52
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CC(c2ccccc2)C1	ZINC000875324157	GG	On-Demand	Anodyne	CACNA1I	57	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC(c2ccccc2)C1	ZINC000875324159	GG	On-Demand	Anodyne	SLC6A3	24	44
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC(c2ccccc2)C1	ZINC000875324159	GG	On-Demand	Anodyne	HTR4	49	37
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC(c2ccccc2)C1	ZINC000875324159	GG	On-Demand	Anodyne	GRIN2B	19	46
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC(c2ccccc2)C1	ZINC000875324159	GG	On-Demand	Anodyne	CCR5	45	41
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC(c2ccccc2)C1	ZINC000875324159	GG	On-Demand	Anodyne	SLC18A3	32	52
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC(c2ccccc2)C1	ZINC000875324159	GG	On-Demand	Anodyne	CACNA1I	57	36
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N[C@@H]1COC[C@@H]1O	ZINC000875324190	FC	On-Demand	Anodyne	HTR4	45	36
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N[C@@H]1COC[C@@H]1O	ZINC000875324190	FC	On-Demand	Anodyne	CACNA1I	50	35
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@@H]1COC[C@@H]1O	ZINC000875324196	FC	On-Demand	Anodyne	HTR4	45	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@@H]1COC[C@@H]1O	ZINC000875324196	FC	On-Demand	Anodyne	CACNA1I	50	35
CS[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000875324219	GF	On-Demand	Anodyne	HTR4	48	36
CS[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000875324219	GF	On-Demand	Anodyne	CCR3	16	40
CS[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000875324219	GF	On-Demand	Anodyne	CACNA1I	54	36
CS[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000875324221	GF	On-Demand	Anodyne	HTR4	48	36
CS[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000875324221	GF	On-Demand	Anodyne	CCR3	16	40
CS[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000875324221	GF	On-Demand	Anodyne	CACNA1I	54	36
C[C@@H](NC(=O)N1CCN(C)C(C)(C)CC1)c1nc(-c2cccc(F)c2)no1	ZINC000875324272	GG	On-Demand	Anodyne	GRM5	15	47
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1nc(-c2cccc(F)c2)no1	ZINC000875324283	FF	On-Demand	Anodyne	BMP1	22	40
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1nc(-c2cccc(F)c2)no1	ZINC000875324283	FF	On-Demand	Anodyne	GRM5	22	48
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1nc(-c2cccc(F)c2)no1	ZINC000875324283	FF	On-Demand	Anodyne	ETHR	23	46
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1nc(-c2cccc(F)c2)no1	ZINC000875324286	FF	On-Demand	Anodyne	BMP1	22	40
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1nc(-c2cccc(F)c2)no1	ZINC000875324286	FF	On-Demand	Anodyne	GRM5	22	48
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1nc(-c2cccc(F)c2)no1	ZINC000875324286	FF	On-Demand	Anodyne	ETHR	23	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](Cc1nccn1C)c1ccccc1	ZINC000875324425	GE	On-Demand	Anodyne	SLC6A4	19	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](Cc1nccn1C)c1ccccc1	ZINC000875324425	GE	On-Demand	Anodyne	SLC6A3	48	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](Cc1nccn1C)c1ccccc1	ZINC000875324427	GE	On-Demand	Anodyne	SLC6A4	19	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](Cc1nccn1C)c1ccccc1	ZINC000875324427	GE	On-Demand	Anodyne	SLC6A3	48	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](Cc1nccn1C)c1ccccc1	ZINC000875324430	GE	On-Demand	Anodyne	SLC6A4	19	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](Cc1nccn1C)c1ccccc1	ZINC000875324430	GE	On-Demand	Anodyne	SLC6A3	48	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](Cc1nccn1C)c1ccccc1	ZINC000875324432	GE	On-Demand	Anodyne	SLC6A4	19	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](Cc1nccn1C)c1ccccc1	ZINC000875324432	GE	On-Demand	Anodyne	SLC6A3	48	41
CSC1(CNC(=O)C(=O)NC[C@H]2CN(Cc3ccc(C)cc3)CCO2)CC1	ZINC000875324484	GD	On-Demand	Anodyne	DRD4	18	42
CSC1(CNC(=O)C(=O)NC[C@@H]2CN(Cc3ccc(C)cc3)CCO2)CC1	ZINC000875324486	GD	On-Demand	Anodyne	DRD4	18	42
C[C@@H](CNC(=O)N1CC[C@@H](C(C)(C)O)C1)Oc1ccc(Cl)cc1	ZINC000875324532	EF	On-Demand	Anodyne	CCR1	46	39
C[C@@H](CNC(=O)N1CC[C@@H](C(C)(C)O)C1)Oc1ccc(Cl)cc1	ZINC000875324532	EF	On-Demand	Anodyne	EBP	18	46
C[C@@H](CNC(=O)N1CC[C@@H](C(C)(C)O)C1)Oc1ccc(Cl)cc1	ZINC000875324532	EF	On-Demand	Anodyne	CACNA1I	54	35
C[C@@H](CNC(=O)N1CC[C@H](C(C)(C)O)C1)Oc1ccc(Cl)cc1	ZINC000875324533	EF	On-Demand	Anodyne	CCR1	46	39
C[C@@H](CNC(=O)N1CC[C@H](C(C)(C)O)C1)Oc1ccc(Cl)cc1	ZINC000875324533	EF	On-Demand	Anodyne	EBP	18	46
C[C@@H](CNC(=O)N1CC[C@H](C(C)(C)O)C1)Oc1ccc(Cl)cc1	ZINC000875324533	EF	On-Demand	Anodyne	CACNA1I	54	35
COC(=O)N(C)NC(=O)NC[C@@H](C)Oc1cccc(Br)c1	ZINC000875324548	FE	On-Demand	Reactive	MTNR1A	25	49
COC(=O)N(C)NC(=O)NC[C@@H](C)Oc1cccc(Br)c1	ZINC000875324548	FE	On-Demand	Reactive	MTNR1B	21	49
COC(=O)N(C)NC(=O)NC[C@H](C)Oc1cccc(Br)c1	ZINC000875324549	FE	On-Demand	Reactive	MTNR1A	25	49
COC(=O)N(C)NC(=O)NC[C@H](C)Oc1cccc(Br)c1	ZINC000875324549	FE	On-Demand	Reactive	MTNR1B	21	49
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ccc(Cl)nn1	ZINC000875324574	GG	On-Demand	Anodyne	ELANE	25	43
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ccc(Cl)nn1	ZINC000875324574	GG	On-Demand	Anodyne	CASP3	18	42
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ccc(Cl)nn1	ZINC000875324574	GG	On-Demand	Anodyne	KLK3	66	34
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ccc(Cl)nn1	ZINC000875324574	GG	On-Demand	Anodyne	CTSB	68	45
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ccc(Cl)nn1	ZINC000875324574	GG	On-Demand	Anodyne	PAPA1_CARPA	77	45
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ccc(Cl)nn1	ZINC000875324574	GG	On-Demand	Anodyne	CYSP_TRYCR	50	39
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ccc(Cl)nn1	ZINC000875324574	GG	On-Demand	Anodyne	CTSK	35	48
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ccc(Cl)nn1	ZINC000875324574	GG	On-Demand	Anodyne	CTSL	44	48
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ccc(Cl)nn1	ZINC000875324574	GG	On-Demand	Anodyne	CAPNS1	64	38
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ccc(Cl)nn1	ZINC000875324574	GG	On-Demand	Anodyne	CTSS	17	45
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ccc(Cl)nn1	ZINC000875324574	GG	On-Demand	Anodyne	CAPN1	74	48
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ccc(Cl)nn1	ZINC000875324574	GG	On-Demand	Anodyne	CASP1	20	42
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ccc(Cl)nn1	ZINC000875324574	GG	On-Demand	Anodyne	CAPN2	114	41
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ccc(Cl)nn1	ZINC000875324574	GG	On-Demand	Anodyne	CASP9	35	42
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ccc(Cl)nn1	ZINC000875324574	GG	On-Demand	Anodyne	NPR	70	41
CC(=O)N1CCC[C@@H]1C(=O)O[C@@H](Cc1ccc(Cl)cc1)C(F)(F)F	ZINC000875324617	FG	On-Demand	Anodyne	FKBP1A	60	38
CC(=O)N1CCC[C@@H]1C(=O)O[C@@H](Cc1ccc(Cl)cc1)C(F)(F)F	ZINC000875324617	FG	On-Demand	Anodyne	CCR1	20	41
CC(=O)N1CCC[C@@H]1C(=O)O[C@@H](Cc1ccc(Cl)cc1)C(F)(F)F	ZINC000875324617	FG	On-Demand	Anodyne	LGMN	69	40
CC(=O)N1CCC[C@@H]1C(=O)O[C@H](Cc1ccc(Cl)cc1)C(F)(F)F	ZINC000875324621	FG	On-Demand	Anodyne	FKBP1A	60	38
CC(=O)N1CCC[C@@H]1C(=O)O[C@H](Cc1ccc(Cl)cc1)C(F)(F)F	ZINC000875324621	FG	On-Demand	Anodyne	CCR1	20	41
CC(=O)N1CCC[C@@H]1C(=O)O[C@H](Cc1ccc(Cl)cc1)C(F)(F)F	ZINC000875324621	FG	On-Demand	Anodyne	LGMN	69	40
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@H]1CCCC12CC2	ZINC000875324667	FG	On-Demand	Anodyne	HTR4	40	33
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@H]1CCCC12CC2	ZINC000875324667	FG	On-Demand	Anodyne	CACNA1I	43	34
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N[C@H]1CCCC12CC2	ZINC000875324669	FG	On-Demand	Anodyne	HTR4	40	33
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N[C@H]1CCCC12CC2	ZINC000875324669	FG	On-Demand	Anodyne	CACNA1I	43	34
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@@H]1CCCC12CC2	ZINC000875324671	FG	On-Demand	Anodyne	HTR4	40	33
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@@H]1CCCC12CC2	ZINC000875324671	FG	On-Demand	Anodyne	CACNA1I	43	34
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N[C@@H]1CCCC12CC2	ZINC000875324673	FG	On-Demand	Anodyne	HTR4	40	33
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N[C@@H]1CCCC12CC2	ZINC000875324673	FG	On-Demand	Anodyne	CACNA1I	43	34
CC(=O)C1CCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CC1	ZINC000875324730	GE	On-Demand	Anodyne	SLC6A3	19	40
CC(=O)C1CCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CC1	ZINC000875324730	GE	On-Demand	Anodyne	HTR4	63	39
CC(=O)C1CCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CC1	ZINC000875324730	GE	On-Demand	Anodyne	GRIN2B	24	45
CC(=O)C1CCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CC1	ZINC000875324730	GE	On-Demand	Anodyne	CACNA1I	59	38
CC(=O)C1CCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CC1	ZINC000875324733	GE	On-Demand	Anodyne	SLC6A3	19	40
CC(=O)C1CCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CC1	ZINC000875324733	GE	On-Demand	Anodyne	HTR4	63	39
CC(=O)C1CCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CC1	ZINC000875324733	GE	On-Demand	Anodyne	GRIN2B	24	45
CC(=O)C1CCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CC1	ZINC000875324733	GE	On-Demand	Anodyne	CACNA1I	59	38
O=C1OC[C@H]2CN(C(=O)NCC3CCN(C[C@@H](O)c4ccccc4)CC3)C[C@@H]12	ZINC000875324765	GD	On-Demand	Anodyne	HTR4	41	35
O=C1OC[C@H]2CN(C(=O)NCC3CCN(C[C@H](O)c4ccccc4)CC3)C[C@@H]12	ZINC000875324768	GD	On-Demand	Anodyne	HTR4	41	35
O=C(NCc1nnnn1C1CC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875324793	ED	On-Demand	Anodyne	PREP	17	40
O=C(NCc1nnnn1C1CC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875324793	ED	On-Demand	Anodyne	TMPRSS11D	43	32
O=C(NCC[C@H]1CCCOC1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875324808	GF	On-Demand	Anodyne	HTR4	45	35
O=C(NCC[C@@H]1CCCOC1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875324809	GF	On-Demand	Anodyne	HTR4	45	35
O=C(NCC[C@@H]1CCCOC1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875324810	GF	On-Demand	Anodyne	HTR4	45	35
O=C(NCC[C@H]1CCCOC1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875324811	GF	On-Demand	Anodyne	HTR4	45	35
CN(C[C@@H]1C[C@H](O)C1)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875324822	GD	On-Demand	Anodyne	OPRK1	32	43
CN(C[C@@H]1C[C@H](O)C1)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875324822	GD	On-Demand	Anodyne	HTR4	46	36
CN(C[C@@H]1C[C@H](O)C1)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875324822	GD	On-Demand	Anodyne	CACNA1I	64	39
CN(C[C@@H]1C[C@H](O)C1)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875324823	GD	On-Demand	Anodyne	OPRK1	32	43
CN(C[C@@H]1C[C@H](O)C1)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875324823	GD	On-Demand	Anodyne	HTR4	46	36
CN(C[C@@H]1C[C@H](O)C1)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875324823	GD	On-Demand	Anodyne	CACNA1I	64	39
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@@H]1CCOC[C@H]1O	ZINC000875324824	GC	On-Demand	Anodyne	HTR4	46	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@@H]1CCOC[C@H]1O	ZINC000875324824	GC	On-Demand	Anodyne	CACNA1I	42	34
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@H]1CCOC[C@@H]1O	ZINC000875324825	GC	On-Demand	Anodyne	HTR4	46	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@H]1CCOC[C@@H]1O	ZINC000875324825	GC	On-Demand	Anodyne	CACNA1I	42	34
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@H]1CCOC[C@H]1O	ZINC000875324826	GC	On-Demand	Anodyne	HTR4	46	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@H]1CCOC[C@H]1O	ZINC000875324826	GC	On-Demand	Anodyne	CACNA1I	42	34
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N[C@@H]1CCOC[C@H]1O	ZINC000875324827	GC	On-Demand	Anodyne	HTR4	46	36
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N[C@@H]1CCOC[C@H]1O	ZINC000875324827	GC	On-Demand	Anodyne	CACNA1I	42	34
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@@H]1CCOC[C@@H]1O	ZINC000875324828	GC	On-Demand	Anodyne	HTR4	46	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@@H]1CCOC[C@@H]1O	ZINC000875324828	GC	On-Demand	Anodyne	CACNA1I	42	34
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N[C@@H]1C[C@H](CO)C1	ZINC000875324837	FD	On-Demand	Anodyne	HTR4	49	36
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N[C@@H]1C[C@H](CO)C1	ZINC000875324837	FD	On-Demand	Anodyne	GRIN2B	15	45
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N[C@@H]1C[C@H](CO)C1	ZINC000875324837	FD	On-Demand	Anodyne	CCR3	16	42
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N[C@@H]1C[C@H](CO)C1	ZINC000875324837	FD	On-Demand	Anodyne	CACNA1I	54	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@@H]1C[C@H](CO)C1	ZINC000875324838	FD	On-Demand	Anodyne	HTR4	49	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@@H]1C[C@H](CO)C1	ZINC000875324838	FD	On-Demand	Anodyne	GRIN2B	15	45
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@@H]1C[C@H](CO)C1	ZINC000875324838	FD	On-Demand	Anodyne	CCR3	16	42
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@@H]1C[C@H](CO)C1	ZINC000875324838	FD	On-Demand	Anodyne	CACNA1I	54	36
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N[C@@H]1COCC[C@H]1O	ZINC000875324856	GC	On-Demand	Anodyne	HTR4	50	36
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N[C@@H]1COCC[C@H]1O	ZINC000875324856	GC	On-Demand	Anodyne	CACNA1I	45	34
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@@H]1COCC[C@H]1O	ZINC000875324857	GC	On-Demand	Anodyne	HTR4	50	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@@H]1COCC[C@H]1O	ZINC000875324857	GC	On-Demand	Anodyne	CACNA1I	45	34
C[C@@H]1CC(F)(F)CCN1C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875324860	GG	On-Demand	Anodyne	CACNA1I	43	35
C[C@H]1CC(F)(F)CCN1C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000875324861	GG	On-Demand	Anodyne	CACNA1I	43	35
C[C@H]1CC(F)(F)CCN1C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875324862	GG	On-Demand	Anodyne	CACNA1I	43	35
C[C@@H]1CC(F)(F)CCN1C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000875324863	GG	On-Demand	Anodyne	CACNA1I	43	35
C=CC(C)(C)CCCNC(=O)C(=O)NC[C@H](c1cccnc1)C(C)C	ZINC000875324945	EG	On-Demand	Mild	KCNA5	20	43
C=CC(C)(C)CCCNC(=O)C(=O)NC[C@@H](c1cccnc1)C(C)C	ZINC000875324947	EG	On-Demand	Mild	KCNA5	20	43
CC(C)[C@H](CNC(=O)C(=O)NC[C@H]1c2ccccc2CN1C)c1cccnc1	ZINC000875325020	GE	On-Demand	Anodyne	KCNA5	22	43
CC(C)[C@H](CNC(=O)C(=O)NC[C@@H]1c2ccccc2CN1C)c1cccnc1	ZINC000875325022	GE	On-Demand	Anodyne	KCNA5	22	43
CC(C)[C@H](CNC(=O)C(=O)NC1CCC(C)(N(C)C)CC1)c1cccnc1	ZINC000875325074	FE	On-Demand	Anodyne	KCNA5	22	44
CC(C)[C@H](CNC(=O)C(=O)NC1CCC(C)(N(C)C)CC1)c1cccnc1	ZINC000875325074	FE	On-Demand	Anodyne	C3AR1	37	40
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H](c1cccnc1)C(C)C	ZINC000875325110	ED	On-Demand	Mild	KCNA5	20	42
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H](c1cccnc1)C(C)C	ZINC000875325112	ED	On-Demand	Mild	KCNA5	20	42
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H](c1cccnc1)C(C)C	ZINC000875325114	ED	On-Demand	Mild	KCNA5	20	42
O=C(NCc1nnnn1C1CC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875325153	ED	On-Demand	Anodyne	PREP	17	40
O=C(NCc1nnnn1C1CC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875325153	ED	On-Demand	Anodyne	TMPRSS11D	43	32
O=C(NCc1nnnn1C1CC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875325154	ED	On-Demand	Anodyne	PREP	17	40
O=C(NCc1nnnn1C1CC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875325154	ED	On-Demand	Anodyne	TMPRSS11D	43	32
O=C(NCc1nnnn1C1CC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875325155	ED	On-Demand	Anodyne	PREP	17	40
O=C(NCc1nnnn1C1CC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875325155	ED	On-Demand	Anodyne	TMPRSS11D	43	32
Cc1cccc2c1CCCN2C(=O)c1c(Cl)nn(C)c1Cl	ZINC000875325185	DH	On-Demand	Anodyne	AVPR2	62	41
Cc1cccc2c1CCCN2C(=O)c1c(C(F)F)nc2n1CCCC2	ZINC000875325204	EI	On-Demand	Anodyne	AVPR2	47	39
Cc1nnc([C@@H](C)NC(=O)C(=O)N2CCN(c3ccc(F)cc3F)CC2)s1	ZINC000875325352	GD	On-Demand	Anodyne	NPY2R	54	35
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H](c1cccnc1)C(C)C	ZINC000875325453	ED	On-Demand	Mild	KCNA5	20	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@H](c2cccnc2)C(C)C)C1	ZINC000875325545	ED	On-Demand	Anodyne	KCNA5	21	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@H](c2cccnc2)C(C)C)C1	ZINC000875325547	ED	On-Demand	Anodyne	KCNA5	21	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@H](c2cccnc2)C(C)C)C1	ZINC000875325548	ED	On-Demand	Anodyne	KCNA5	21	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@H](c2cccnc2)C(C)C)C1	ZINC000875325551	ED	On-Demand	Anodyne	KCNA5	21	41
CCC(CC)(CNC(=O)N1CCCN(C=O)CC1)c1ccccc1	ZINC000875325553	EF	On-Demand	Anodyne	CACNA1G	35	42
CCC(CC)(CNC(=O)NCCc1ccc(OC)c(O)c1)SC	ZINC000875325651	EG	On-Demand	Anodyne	INHA	78	35
CCC(CC)(CNC(=O)NCCc1ccc(OC)c(O)c1)SC	ZINC000875325651	EG	On-Demand	Anodyne	MTNR1A	15	41
CC(=O)C1CCN(C(=O)N[C@H](Cc2nccn2C)c2ccccc2)CC1	ZINC000875325667	FF	On-Demand	Anodyne	CCR5	27	44
CC(=O)C1CCN(C(=O)N[C@H](Cc2nccn2C)c2ccccc2)CC1	ZINC000875325667	FF	On-Demand	Anodyne	CALCRL	27	41
CC(=O)C1CCN(C(=O)N[C@@H](Cc2nccn2C)c2ccccc2)CC1	ZINC000875325669	FF	On-Demand	Anodyne	CCR5	27	44
CC(=O)C1CCN(C(=O)N[C@@H](Cc2nccn2C)c2ccccc2)CC1	ZINC000875325669	FF	On-Demand	Anodyne	CALCRL	27	41
CCC(CC)(CNC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1	ZINC000875325710	GE	On-Demand	Anodyne	EPHX2	21	40
CCC(CC)(CNC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1	ZINC000875325710	GE	On-Demand	Anodyne	CACNA1G	47	55
CC(=O)C1CCN(C(=O)C(=O)NC[C@H](c2cccnc2)C(C)C)CC1	ZINC000875325724	ED	On-Demand	Anodyne	PTAFR	23	42
CC(=O)C1CCN(C(=O)C(=O)NC[C@H](c2cccnc2)C(C)C)CC1	ZINC000875325724	ED	On-Demand	Anodyne	KCNA5	24	43
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H](c2cccnc2)C(C)C)CC1	ZINC000875325727	ED	On-Demand	Anodyne	PTAFR	23	42
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H](c2cccnc2)C(C)C)CC1	ZINC000875325727	ED	On-Demand	Anodyne	KCNA5	24	43
CC(C)[C@H](CNC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1)c1cccnc1	ZINC000875325737	EE	On-Demand	Anodyne	PTAFR	18	40
CC(C)[C@H](CNC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1)c1cccnc1	ZINC000875325737	EE	On-Demand	Anodyne	KCNA5	22	44
CCCCCCCNC(=O)C(=O)NCC1(SC)CC1	ZINC000875325756	CE	On-Demand	Mild	ASAH1	75	32
CSC1(CNC(=O)C(=O)NCc2nc(-c3ccncc3)cs2)CCC1	ZINC000875325782	GE	On-Demand	Anodyne	ROCK1	22	41
CSC1(CNC(=O)C(=O)NCc2nc(-c3ccncc3)cs2)CCC1	ZINC000875325782	GE	On-Demand	Anodyne	ROCK2	15	41
COc1ccccc1-c1noc([C@@H](C)NC(=O)N(C)OCC(F)(F)F)n1	ZINC000875325784	FF	On-Demand	Anodyne	LUCI_PHOPE	24	40
COc1ccccc1-c1noc([C@H](C)NC(=O)N(C)OCC(F)(F)F)n1	ZINC000875325787	FF	On-Demand	Anodyne	LUCI_PHOPE	24	40
C#C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)[C@H]1CCCO1	ZINC000875325891	GD	On-Demand	Mild	ACHE	53	54
C#C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)[C@H]1CCCO1	ZINC000875325891	GD	On-Demand	Mild	SIGMAR1	36	43
C#C[C@@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)[C@H]1CCCO1	ZINC000875325892	GD	On-Demand	Mild	ACHE	53	54
C#C[C@@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)[C@H]1CCCO1	ZINC000875325892	GD	On-Demand	Mild	SIGMAR1	36	43
C#C[C@@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCO1	ZINC000875325893	GD	On-Demand	Mild	ACHE	53	54
C#C[C@@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCO1	ZINC000875325893	GD	On-Demand	Mild	SIGMAR1	36	43
C#C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCO1	ZINC000875325894	GD	On-Demand	Mild	ACHE	53	54
C#C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCO1	ZINC000875325894	GD	On-Demand	Mild	SIGMAR1	36	43
Cc1nnc([C@@H](C)NC(=O)C(=O)NCC[C@@H]2CCSC2)s1	ZINC000875325895	ED	On-Demand	Anodyne	SIRT2	44	31
Cc1nnc([C@@H](C)NC(=O)C(=O)NCC[C@@H]2CCSC2)s1	ZINC000875325895	ED	On-Demand	Anodyne	SIRT1	40	31
Cc1nnc([C@@H](C)NC(=O)C(=O)NCC[C@H]2CCSC2)s1	ZINC000875325896	ED	On-Demand	Anodyne	SIRT2	44	31
Cc1nnc([C@@H](C)NC(=O)C(=O)NCC[C@H]2CCSC2)s1	ZINC000875325896	ED	On-Demand	Anodyne	SIRT1	40	31
COCc1csc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)n1	ZINC000875325930	GH	On-Demand	Anodyne	CPT1A	27	49
C#C[C@@H](NC(=O)C(=O)N1Cc2cccc(OC)c2C1)[C@H]1CCCO1	ZINC000875325936	EC	On-Demand	Mild	SSTR1	41	33
C#C[C@H](NC(=O)C(=O)N1Cc2cccc(OC)c2C1)[C@H]1CCCO1	ZINC000875325937	EC	On-Demand	Mild	SSTR1	41	33
C#C[C@H](NC(=O)C(=O)N1Cc2cccc(OC)c2C1)[C@@H]1CCCO1	ZINC000875325938	EC	On-Demand	Mild	SSTR1	41	33
C#C[C@@H](NC(=O)C(=O)N1Cc2cccc(OC)c2C1)[C@@H]1CCCO1	ZINC000875325939	EC	On-Demand	Mild	SSTR1	41	33
CNC(=O)[C@@H]1CCC[C@H]1NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875326061	FD	On-Demand	Anodyne	OXTR	50	38
CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875326066	FD	On-Demand	Anodyne	OXTR	50	38
CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875326070	FD	On-Demand	Anodyne	OXTR	50	38
CNC(=O)[C@@H]1CCC[C@H]1NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875326074	FD	On-Demand	Anodyne	OXTR	50	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C1CCC(OC)CC1	ZINC000875326090	FF	On-Demand	Anodyne	F2	21	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C1CCC(OC)CC1	ZINC000875326090	FF	On-Demand	Anodyne	ACE	52	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C1CCC(OC)CC1	ZINC000875326090	FF	On-Demand	Anodyne	MME	72	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C1CCC(OC)CC1	ZINC000875326090	FF	On-Demand	Anodyne	ANPEP	50	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C1CCC(OC)CC1	ZINC000875326090	FF	On-Demand	Anodyne	TACR1	27	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C1CCC(OC)CC1	ZINC000875326090	FF	On-Demand	Anodyne	CTRA_BOVIN	33	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C1CCC(OC)CC1	ZINC000875326090	FF	On-Demand	Anodyne	FCER2	40	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C1CCC(OC)CC1	ZINC000875326090	FF	On-Demand	Anodyne	KLK3	50	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C1CCC(OC)CC1	ZINC000875326090	FF	On-Demand	Anodyne	CTSB	67	48
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C1CCC(OC)CC1	ZINC000875326090	FF	On-Demand	Anodyne	PAPA1_CARPA	79	48
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C1CCC(OC)CC1	ZINC000875326090	FF	On-Demand	Anodyne	CYSP_TRYCR	65	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C1CCC(OC)CC1	ZINC000875326090	FF	On-Demand	Anodyne	CTSK	44	48
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C1CCC(OC)CC1	ZINC000875326090	FF	On-Demand	Anodyne	CTSL	52	48
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C1CCC(OC)CC1	ZINC000875326090	FF	On-Demand	Anodyne	TIMP3	93	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C1CCC(OC)CC1	ZINC000875326090	FF	On-Demand	Anodyne	CAPNS1	91	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C1CCC(OC)CC1	ZINC000875326090	FF	On-Demand	Anodyne	HLA-DRB1	86	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C1CCC(OC)CC1	ZINC000875326090	FF	On-Demand	Anodyne	CELA2A	42	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C1CCC(OC)CC1	ZINC000875326090	FF	On-Demand	Anodyne	REN	39	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C1CCC(OC)CC1	ZINC000875326090	FF	On-Demand	Anodyne	CTSS	25	48
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C1CCC(OC)CC1	ZINC000875326090	FF	On-Demand	Anodyne	CAPN1	115	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C1CCC(OC)CC1	ZINC000875326090	FF	On-Demand	Anodyne	MMP9	16	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C1CCC(OC)CC1	ZINC000875326090	FF	On-Demand	Anodyne	CAPN2	122	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C1CCC(OC)CC1	ZINC000875326090	FF	On-Demand	Anodyne	ACE2	58	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C1CCC(OC)CC1	ZINC000875326090	FF	On-Demand	Anodyne	MMP1	16	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C1CCC(OC)CC1	ZINC000875326090	FF	On-Demand	Anodyne	FPR1	54	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C1CCC(OC)CC1	ZINC000875326090	FF	On-Demand	Anodyne	CTRB_BOVIN	50	41
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H](c1cccnc1)C(C)C	ZINC000875326097	ED	On-Demand	Mild	KCNA5	20	41
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H](c1cccnc1)C(C)C	ZINC000875326098	ED	On-Demand	Mild	KCNA5	20	41
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H](c1cccnc1)C(C)C	ZINC000875326099	ED	On-Demand	Mild	KCNA5	20	41
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H](c1cccnc1)C(C)C	ZINC000875326100	ED	On-Demand	Mild	KCNA5	20	41
CO[C@H](CNC(=O)N1CCC(N2CCN(C)CC2)CC1)c1cccc(Cl)c1	ZINC000875326102	GE	On-Demand	Anodyne	IGF1R	16	41
CO[C@H](CNC(=O)N1CCC(N2CCN(C)CC2)CC1)c1cccc(Cl)c1	ZINC000875326102	GE	On-Demand	Anodyne	CYP3A4	46	41
CO[C@H](CNC(=O)N1CCC(N2CCN(C)CC2)CC1)c1cccc(Cl)c1	ZINC000875326102	GE	On-Demand	Anodyne	L3MBTL3	53	37
CCc1nncn1CCNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875326138	GF	On-Demand	Reactive	LTA4H	15	40
N#Cc1ccc(Cn2cc(NC(=O)NCCC(F)(F)F)cn2)cc1	ZINC000875326157	EF	On-Demand	Mild	ITK	15	53
N#Cc1ccc(Cn2cc(NC(=O)NCCC(F)(F)F)cn2)cc1	ZINC000875326157	EF	On-Demand	Mild	PANC	44	36
COc1ccccc1[C@@H]1CCCN(C(=O)NCCC(F)(F)F)CC1	ZINC000875326188	EH	On-Demand	Anodyne	DRD2	25	45
COc1ccccc1[C@@H]1CCCN(C(=O)NCCC(F)(F)F)CC1	ZINC000875326188	EH	On-Demand	Anodyne	DRD4	15	45
COc1ccccc1[C@@H]1CCCN(C(=O)NCCC(F)(F)F)CC1	ZINC000875326188	EH	On-Demand	Anodyne	EPHX2	16	44
COc1ccccc1[C@@H]1CCCN(C(=O)NCCC(F)(F)F)CC1	ZINC000875326188	EH	On-Demand	Anodyne	RBP4	69	46
COc1ccccc1[C@@H]1CCCN(C(=O)NCCC(F)(F)F)CC1	ZINC000875326188	EH	On-Demand	Anodyne	ETHR	42	33
COc1ccccc1[C@H]1CCCN(C(=O)NCCC(F)(F)F)CC1	ZINC000875326190	EH	On-Demand	Anodyne	DRD2	25	45
COc1ccccc1[C@H]1CCCN(C(=O)NCCC(F)(F)F)CC1	ZINC000875326190	EH	On-Demand	Anodyne	DRD4	15	45
COc1ccccc1[C@H]1CCCN(C(=O)NCCC(F)(F)F)CC1	ZINC000875326190	EH	On-Demand	Anodyne	EPHX2	16	44
COc1ccccc1[C@H]1CCCN(C(=O)NCCC(F)(F)F)CC1	ZINC000875326190	EH	On-Demand	Anodyne	RBP4	69	46
COc1ccccc1[C@H]1CCCN(C(=O)NCCC(F)(F)F)CC1	ZINC000875326190	EH	On-Demand	Anodyne	ETHR	42	33
CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875326191	FD	On-Demand	Anodyne	FKBP1A	16	42
CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875326191	FD	On-Demand	Anodyne	AMP1_PLAFQ	21	42
CNC(=O)[C@@H]1CCC[C@H]1NC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875326193	FD	On-Demand	Anodyne	FKBP1A	16	42
CNC(=O)[C@@H]1CCC[C@H]1NC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875326193	FD	On-Demand	Anodyne	AMP1_PLAFQ	21	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1nc(-c2cccc(F)c2)no1	ZINC000875326201	GF	On-Demand	Anodyne	SLC6A3	23	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1nc(-c2cccc(F)c2)no1	ZINC000875326201	GF	On-Demand	Anodyne	GRM5	15	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1nc(-c2cccc(F)c2)no1	ZINC000875326202	GF	On-Demand	Anodyne	SLC6A3	23	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1nc(-c2cccc(F)c2)no1	ZINC000875326202	GF	On-Demand	Anodyne	GRM5	15	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1nc(-c2cccc(F)c2)no1	ZINC000875326203	GF	On-Demand	Anodyne	SLC6A3	23	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1nc(-c2cccc(F)c2)no1	ZINC000875326203	GF	On-Demand	Anodyne	GRM5	15	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1nc(-c2cccc(F)c2)no1	ZINC000875326204	GF	On-Demand	Anodyne	SLC6A3	23	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1nc(-c2cccc(F)c2)no1	ZINC000875326204	GF	On-Demand	Anodyne	GRM5	15	43
Cc1nnc([C@@H](C)NC(=O)C(=O)NCCC2CCN(C(C)C)CC2)s1	ZINC000875326212	FD	On-Demand	Anodyne	SIRT3	65	39
Cc1nnc([C@@H](C)NC(=O)C(=O)NCCC2CCN(C(C)C)CC2)s1	ZINC000875326212	FD	On-Demand	Anodyne	SIRT2	61	38
Cc1nnc([C@@H](C)NC(=O)C(=O)NCCC2CCN(C(C)C)CC2)s1	ZINC000875326212	FD	On-Demand	Anodyne	SIRT1	59	37
C#C[C@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)[C@H]1CCCO1	ZINC000875326278	FB	On-Demand	Mild	L3MBTL3	68	42
CO[C@H](CNC(=O)N1CCC(c2nnnn2C)CC1)c1cccc(Cl)c1	ZINC000875326286	GE	On-Demand	Anodyne	IL2RA	53	37
C#C[C@@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)[C@H]1CCCO1	ZINC000875326323	FB	On-Demand	Mild	L3MBTL3	68	42
C#C[C@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)[C@@H]1CCCO1	ZINC000875326324	FB	On-Demand	Mild	L3MBTL3	68	42
C#C[C@@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)[C@@H]1CCCO1	ZINC000875326325	FB	On-Demand	Mild	L3MBTL3	68	42
CC(C)[C@H](CNC(=O)C(=O)NCCCCC1CC1)c1cccnc1	ZINC000875326341	EF	On-Demand	Anodyne	KCNA5	23	44
CC(C)[C@H](CNC(=O)C(=O)NCCCCC1CC1)c1cccnc1	ZINC000875326341	EF	On-Demand	Anodyne	NAMPT	15	45
CO[C@H](CNC(=O)N1CCC2(CCNC2=O)CC1)c1cccc(Cl)c1	ZINC000875326372	FE	On-Demand	Anodyne	CACNA1H	58	36
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](CC2CCC2)c2ccccc2)CC1	ZINC000875326374	FF	On-Demand	Anodyne	CCR5	30	43
CC(=O)C1CCN(C(=O)C(=O)N[C@H](CC2CCC2)c2ccccc2)CC1	ZINC000875326376	FF	On-Demand	Anodyne	CCR5	30	43
O=C(NCCC(F)(F)F)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875326424	EG	On-Demand	Anodyne	FKBP1A	25	41
O=C(NCCC(F)(F)F)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875326425	EG	On-Demand	Anodyne	FKBP1A	25	41
O=C(NCCC(F)(F)F)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875326426	EG	On-Demand	Anodyne	FKBP1A	25	41
O=C(NCCC(F)(F)F)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875326427	EG	On-Demand	Anodyne	FKBP1A	25	41
Cn1ccnc1C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875326483	FF	On-Demand	Anodyne	GRIN2B	18	41
Cn1ccnc1C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875326484	FF	On-Demand	Anodyne	GRIN2B	18	41
Cn1ccnc1C[C@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875326485	FF	On-Demand	Anodyne	GRIN2B	18	41
Cn1ccnc1C[C@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875326486	FF	On-Demand	Anodyne	GRIN2B	18	41
COCCN(CC1CCN(C)CC1)C(=O)NC[C@H](OC)c1cccc(Cl)c1	ZINC000875326491	GG	On-Demand	Anodyne	CACNA1I	51	39
COCCN(CC1CCN(C)CC1)C(=O)NC[C@@H](OC)c1cccc(Cl)c1	ZINC000875326492	GG	On-Demand	Anodyne	CACNA1I	51	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](OC)c1cccc(Cl)c1	ZINC000875326532	FF	On-Demand	Anodyne	SLC6A4	24	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](OC)c1cccc(Cl)c1	ZINC000875326532	FF	On-Demand	Anodyne	SLC6A3	51	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](OC)c1cccc(Cl)c1	ZINC000875326532	FF	On-Demand	Anodyne	CYP3A4	42	33
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](OC)c1cccc(Cl)c1	ZINC000875326533	FF	On-Demand	Anodyne	SLC6A4	24	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](OC)c1cccc(Cl)c1	ZINC000875326533	FF	On-Demand	Anodyne	SLC6A3	51	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](OC)c1cccc(Cl)c1	ZINC000875326533	FF	On-Demand	Anodyne	CYP3A4	42	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](OC)c1cccc(Cl)c1	ZINC000875326534	FF	On-Demand	Anodyne	SLC6A4	24	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](OC)c1cccc(Cl)c1	ZINC000875326534	FF	On-Demand	Anodyne	SLC6A3	51	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](OC)c1cccc(Cl)c1	ZINC000875326534	FF	On-Demand	Anodyne	CYP3A4	42	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](OC)c1cccc(Cl)c1	ZINC000875326535	FF	On-Demand	Anodyne	SLC6A4	24	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](OC)c1cccc(Cl)c1	ZINC000875326535	FF	On-Demand	Anodyne	SLC6A3	51	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](OC)c1cccc(Cl)c1	ZINC000875326535	FF	On-Demand	Anodyne	CYP3A4	42	33
CONC(=O)C1CCN(C(=O)NC[C@H](OC)c2cccc(Cl)c2)CC1	ZINC000875326545	FE	On-Demand	Anodyne	EPHX2	19	45
CONC(=O)C1CCN(C(=O)NC[C@@H](OC)c2cccc(Cl)c2)CC1	ZINC000875326546	FE	On-Demand	Anodyne	EPHX2	19	45
CO[C@H](CNC(=O)N1CC(CNC(=O)C(F)(F)F)C1)c1cccc(Cl)c1	ZINC000875326582	GE	On-Demand	Anodyne	CACNA1I	43	36
CC(C)[C@H](CNC(=O)C(=O)NCCC1CCN(C(C)C)CC1)c1cccnc1	ZINC000875326621	GF	On-Demand	Anodyne	KCNA5	23	42
CC(C)[C@H](CNC(=O)C(=O)NCCC1CCN(C(C)C)CC1)c1cccnc1	ZINC000875326621	GF	On-Demand	Anodyne	SIRT3	41	33
CC(C)[C@H](CNC(=O)C(=O)NCCC1CCN(C(C)C)CC1)c1cccnc1	ZINC000875326621	GF	On-Demand	Anodyne	SIRT2	44	33
CC(C)[C@H](CNC(=O)C(=O)NCCC1CCN(C(C)C)CC1)c1cccnc1	ZINC000875326621	GF	On-Demand	Anodyne	SIRT1	41	33
CC(C)[C@H](CNC(=O)C(=O)N[C@H](C)c1ccnn1C)c1cccnc1	ZINC000875326624	ED	On-Demand	Anodyne	KCNA5	23	47
CC(C)[C@H](CNC(=O)C(=O)N[C@@H](C)c1ccnn1C)c1cccnc1	ZINC000875326626	ED	On-Demand	Anodyne	KCNA5	23	47
CC(C)[C@H](CNC(=O)C(=O)N1CCN(C)C(C)(C)CC1)c1cccnc1	ZINC000875326664	FD	On-Demand	Anodyne	PTAFR	18	40
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@@H](c2cccnc2)C(C)C)C1	ZINC000875326670	ED	On-Demand	Anodyne	KCNA5	20	40
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@H](c2cccnc2)C(C)C)C1	ZINC000875326671	ED	On-Demand	Anodyne	KCNA5	20	40
Cn1ccnc1C[C@H](NC(=O)N1CCCN(C=O)CC1)c1ccccc1	ZINC000875326710	FD	On-Demand	Anodyne	PTAFR	15	43
Cn1ccnc1C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccccc1	ZINC000875326711	FD	On-Demand	Anodyne	PTAFR	15	43
CC(C)[C@H](CNC(=O)C(=O)NCc1ccc(C(C)(C)C)o1)c1cccnc1	ZINC000875326757	FG	On-Demand	Anodyne	KCNA5	21	41
CC(C)[C@H](CNC(=O)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1)c1cccnc1	ZINC000875326781	FE	On-Demand	Anodyne	KCNA5	19	41
CC(C)[C@H](CNC(=O)C(=O)N[C@@H](C1CCC1)[C@H]1CCOC1)c1cccnc1	ZINC000875326782	FE	On-Demand	Anodyne	KCNA5	19	41
CC(C)[C@H](CNC(=O)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1)c1cccnc1	ZINC000875326783	FE	On-Demand	Anodyne	KCNA5	19	41
CC(C)[C@H](CNC(=O)C(=O)N[C@@H](C1CCC1)[C@@H]1CCOC1)c1cccnc1	ZINC000875326784	FE	On-Demand	Anodyne	KCNA5	19	41
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](OC)c1cccc(Cl)c1	ZINC000875326795	EF	On-Demand	Anodyne	PDS	40	39
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](OC)c1cccc(Cl)c1	ZINC000875326797	EF	On-Demand	Anodyne	PDS	40	39
CCc1nncn1CCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875326802	FD	On-Demand	Anodyne	CTSV	32	41
CCc1nncn1CCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875326803	FD	On-Demand	Anodyne	CTSV	32	41
CO[C@H](CNC(=O)N1CCC(C(=O)NCCO)CC1)c1cccc(Cl)c1	ZINC000875326824	GD	On-Demand	Anodyne	EPHX2	20	51
CC(C)[C@H](CNC(=O)C(=O)NCC[C@H]1CCSC1)c1cccnc1	ZINC000875326827	EE	On-Demand	Anodyne	KCNA5	21	45
CC(C)[C@H](CNC(=O)C(=O)NCC[C@@H]1CCSC1)c1cccnc1	ZINC000875326828	EE	On-Demand	Anodyne	KCNA5	21	45
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2ccc(S(=O)(=O)N(C)C(C)C)cc2)c1	ZINC000875326869	JJ	On-Demand	Anodyne	AVPR2	20	40
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2ccc(S(=O)(=O)N(C)C(C)C)cc2)c1	ZINC000875326869	JJ	On-Demand	Anodyne	NR1H4	17	45
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2ccc(S(=O)(=O)N(C)C(C)C)cc2)c1	ZINC000875326869	JJ	On-Demand	Anodyne	UREA_CANEN	17	45
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2ccc(S(=O)(=O)N(C)C(C)C)cc2)c1	ZINC000875326869	JJ	On-Demand	Anodyne	KCNK3	123	54
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2ccc(S(=O)(=O)N(C)C(C)C)cc2)c1	ZINC000875326869	JJ	On-Demand	Anodyne	KCNK9	84	50
CC(C)[C@H](CNC(=O)C(=O)NCc1ncc(Cl)s1)c1cccnc1	ZINC000875326873	FE	On-Demand	Anodyne	KCNA5	21	45
CC(C)[C@H](CNC(=O)C(=O)N1CCCCCCNC(=O)CC1)c1cccnc1	ZINC000875326894	GD	On-Demand	Anodyne	KCNA5	20	40
CC(C)[C@H](CNC(=O)C(=O)N[C@H](C)c1cc2cnccc2o1)c1cccnc1	ZINC000875326895	GF	On-Demand	Anodyne	KCNA5	19	42
CC(C)[C@H](CNC(=O)C(=O)N[C@@H](C)c1cc2cnccc2o1)c1cccnc1	ZINC000875326898	GF	On-Demand	Anodyne	KCNA5	19	42
CC(C)[C@H](CNC(=O)C(=O)N1CC[C@H]2CSC[C@H]2C1)c1cccnc1	ZINC000875326919	FE	On-Demand	Anodyne	KCNA5	19	40
CC(C)[C@H](CNC(=O)C(=O)N1CC[C@@H]2CSC[C@@H]2C1)c1cccnc1	ZINC000875326920	FE	On-Demand	Anodyne	KCNA5	19	40
CC(C)[C@H](CNC(=O)C(=O)N1CC[C@H]2CSC[C@@H]2C1)c1cccnc1	ZINC000875326921	FE	On-Demand	Anodyne	KCNA5	19	40
CC(C)[C@H](CNC(=O)C(=O)N1CC[C@@H]2CSC[C@H]2C1)c1cccnc1	ZINC000875326922	FE	On-Demand	Anodyne	KCNA5	19	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](Cc2nccn2C)c2ccccc2)C1	ZINC000875326923	FF	On-Demand	Anodyne	CCR5	28	41
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](Cc2nccn2C)c2ccccc2)C1	ZINC000875326924	FF	On-Demand	Anodyne	CCR5	28	41
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](Cc2nccn2C)c2ccccc2)C1	ZINC000875326925	FF	On-Demand	Anodyne	CCR5	28	41
CC(=O)[C@H]1CCCN(C(=O)N[C@H](Cc2nccn2C)c2ccccc2)C1	ZINC000875326926	FF	On-Demand	Anodyne	CCR5	28	41
CCC(CC)(CNC(=O)N1CCC(CO)(CO)CC1)c1ccccc1	ZINC000875326953	EF	On-Demand	Anodyne	CACNA1G	36	43
CO[C@H](CNC(=O)N1CCC[C@@H](C(C)=O)C1)c1cccc(Cl)c1	ZINC000875326958	EG	On-Demand	Anodyne	REN	15	48
CO[C@H](CNC(=O)N1CCC[C@@H](C(C)=O)C1)c1cccc(Cl)c1	ZINC000875326958	EG	On-Demand	Anodyne	CYP3A4	46	34
CO[C@H](CNC(=O)N1CCC[C@H](C(C)=O)C1)c1cccc(Cl)c1	ZINC000875326959	EG	On-Demand	Anodyne	REN	15	48
CO[C@H](CNC(=O)N1CCC[C@H](C(C)=O)C1)c1cccc(Cl)c1	ZINC000875326959	EG	On-Demand	Anodyne	CYP3A4	46	34
CC(C)[C@H](CNC(=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)c1cccnc1	ZINC000875326962	GF	On-Demand	Anodyne	KCNA5	25	44
CC(C)[C@H](CNC(=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)c1cccnc1	ZINC000875326963	GF	On-Demand	Anodyne	KCNA5	25	44
CC(C)[C@H](CNC(=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)c1cccnc1	ZINC000875326964	GF	On-Demand	Anodyne	KCNA5	25	44
CC(C)[C@H](CNC(=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)c1cccnc1	ZINC000875326965	GF	On-Demand	Anodyne	KCNA5	25	44
CCC(CC)(CNC(=O)NC[C@H]1C[C@H](O)C1)c1ccccc1	ZINC000875326971	DF	On-Demand	Anodyne	CACNA1G	34	40
CO[C@H](CNC(=O)N1CCC(CO)(CO)CC1)c1cccc(Cl)c1	ZINC000875326987	FD	On-Demand	Anodyne	CACNA1H	50	35
CCOC(=O)COc1ccc(CCNC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875326988	GD	On-Demand	Anodyne	ADRB1	15	41
CC(C)[C@H](CNC(=O)C(=O)NCc1cccc2ncccc12)c1cccnc1	ZINC000875326989	GF	On-Demand	Anodyne	KCNA5	23	44
C[C@@H]1[C@@H](CNC(=O)C(=O)N2CCC(N3CCN(C)CC3)CC2)CCC[C@H]1C	ZINC000875327006	GD	On-Demand	Anodyne	L3MBTL3	53	40
C[C@H]1[C@H](C)CCC[C@H]1CNC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875327009	GD	On-Demand	Anodyne	L3MBTL3	53	40
CC(C)[C@H](CNC(=O)C(=O)N1CCC[C@H](OC2CCC2)CC1)c1cccnc1	ZINC000875327020	GF	On-Demand	Anodyne	KCNA5	20	40
CC(C)[C@H](CNC(=O)C(=O)N1CCC[C@@H](OC2CCC2)CC1)c1cccnc1	ZINC000875327021	GF	On-Demand	Anodyne	KCNA5	20	40
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NC[C@H](c2cccnc2)C(C)C)c1	ZINC000875327044	GG	On-Demand	Anodyne	KCNA5	21	40
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NC[C@@H](c2cccnc2)C(C)C)c1	ZINC000875327045	GG	On-Demand	Anodyne	KCNA5	21	40
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NC[C@H](c2cccnc2)C(C)C)c1	ZINC000875327046	GG	On-Demand	Anodyne	KCNA5	21	40
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NC[C@@H](c2cccnc2)C(C)C)c1	ZINC000875327047	GG	On-Demand	Anodyne	KCNA5	21	40
C[C@@H](CNC(=O)N1CC(CNC(=O)C(F)(F)F)C1)Oc1ccc(Cl)cc1	ZINC000875327074	GE	On-Demand	Anodyne	CACNA1I	42	33
C[C@H](CNC(=O)N1CC(CNC(=O)C(F)(F)F)C1)Oc1ccc(Cl)cc1	ZINC000875327075	GE	On-Demand	Anodyne	CACNA1I	42	33
C[C@H](CNC(=O)N1CCC(CO)(CO)CC1)Oc1ccc(Cl)cc1	ZINC000875327089	FD	On-Demand	Anodyne	CACNA1H	50	39
C[C@H](CNC(=O)N1CCC(CO)(CO)CC1)Oc1ccc(Cl)cc1	ZINC000875327089	FD	On-Demand	Anodyne	CCR1	45	36
C[C@@H](CNC(=O)N1CCC(CO)(CO)CC1)Oc1ccc(Cl)cc1	ZINC000875327090	FD	On-Demand	Anodyne	CACNA1H	50	39
C[C@@H](CNC(=O)N1CCC(CO)(CO)CC1)Oc1ccc(Cl)cc1	ZINC000875327090	FD	On-Demand	Anodyne	CCR1	45	36
C[C@H](CNC(=O)N1CCC(C(=O)NCCO)CC1)Oc1ccc(Cl)cc1	ZINC000875327091	GD	On-Demand	Anodyne	EBP	17	44
C[C@H](CNC(=O)N1CCC(C(=O)NCCO)CC1)Oc1ccc(Cl)cc1	ZINC000875327091	GD	On-Demand	Anodyne	EPHX2	19	49
C[C@@H](CNC(=O)N1CCC(C(=O)NCCO)CC1)Oc1ccc(Cl)cc1	ZINC000875327092	GD	On-Demand	Anodyne	EBP	17	44
C[C@@H](CNC(=O)N1CCC(C(=O)NCCO)CC1)Oc1ccc(Cl)cc1	ZINC000875327092	GD	On-Demand	Anodyne	EPHX2	19	49
CO[C@H](CNC(=O)N1CCC(C(C)=O)CC1)c1cccc(Cl)c1	ZINC000875327096	EG	On-Demand	Anodyne	EPHX2	18	43
CO[C@H](CNC(=O)N1CCC(C(C)=O)CC1)c1cccc(Cl)c1	ZINC000875327096	EG	On-Demand	Anodyne	CYP3A4	45	33
CC(C)[C@H](CNC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)c1cccnc1	ZINC000875327099	ED	On-Demand	Anodyne	KCNA5	22	41
CC(C)[C@H](CNC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)c1cccnc1	ZINC000875327100	ED	On-Demand	Anodyne	KCNA5	22	41
CC(C)(C)OC(=O)CCCCCNC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875327130	DD	On-Demand	Anodyne	EPHX2	28	59
C[C@@H](CNC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)Oc1ccc(Cl)cc1	ZINC000875327136	GE	On-Demand	Anodyne	UTS2	40	33
COCC(C)(C)CCNC(=O)C(=O)NC[C@H](c1cccnc1)C(C)C	ZINC000875327173	EE	On-Demand	Anodyne	KCNA5	22	42
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H](c1cccnc1)C(C)C	ZINC000875327174	EE	On-Demand	Anodyne	KCNA5	22	42
CC(C)[C@H](CNC(=O)C(=O)NCCC[C@@H]1C=CCC1)c1cccnc1	ZINC000875327175	EF	On-Demand	Anodyne	KCNA5	20	41
CC(C)[C@H](CNC(=O)C(=O)NCCC[C@H]1C=CCC1)c1cccnc1	ZINC000875327178	EF	On-Demand	Anodyne	KCNA5	20	41
C=CC[C@H](NC(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1)c1ccncc1	ZINC000875327182	GJ	On-Demand	Mild	UTS2	56	36
C=CC[C@@H](NC(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1)c1ccncc1	ZINC000875327183	GJ	On-Demand	Mild	UTS2	56	36
CC(C)[C@H](CNC(=O)C(=O)N[C@H]1CC12CCC2)c1cccnc1	ZINC000875327189	DD	On-Demand	Anodyne	KCNA5	22	43
CC(C)[C@H](CNC(=O)C(=O)N[C@@H]1CC12CCC2)c1cccnc1	ZINC000875327191	DD	On-Demand	Anodyne	KCNA5	22	43
CCOC(=O)COc1ccc(CCNC(=O)N2CCC[C@H](C(C)=O)C2)cc1	ZINC000875327229	GE	On-Demand	Anodyne	GPBAR1	24	40
CCOC(=O)COc1ccc(CCNC(=O)N2CCC[C@@H](C(C)=O)C2)cc1	ZINC000875327230	GE	On-Demand	Anodyne	GPBAR1	24	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2nc(C3CCCCC3)no2)C1	ZINC000875327248	GG	On-Demand	Anodyne	BMP1	51	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2nc(C3CCCCC3)no2)C1	ZINC000875327249	GG	On-Demand	Anodyne	BMP1	51	37
CCSc1ccccc1OC(=O)c1cc(CC)nn1C	ZINC000875327266	CG	On-Demand	Anodyne	INHA	51	34
CCOC(=O)CCCCCCCNC(=O)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875327300	FF	On-Demand	Anodyne	ASAH1	57	36
CCOC(=O)CCCCCCCNC(=O)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875327301	FF	On-Demand	Anodyne	ASAH1	57	36
CCOC(=O)CCCCCCCNC(=O)N1Cc2cccc(O)c2C1	ZINC000875327304	EG	On-Demand	Clean	ASAH1	55	33
CCOC(=O)CCCCCCCNC(=O)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875327316	EE	On-Demand	Anodyne	EPHX2	17	47
CCOC(=O)CCCCCCCNC(=O)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875327316	EE	On-Demand	Anodyne	ASAH1	71	37
CC(=O)NC[C@@H]1CCCCN1C(=O)NCc1cccn1C	ZINC000875327322	CD	On-Demand	Anodyne	HCRTR1	18	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(N(C)C)nc2ccccc12	ZINC000875327347	GF	On-Demand	Anodyne	SLC6A3	42	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(N(C)C)nc2ccccc12	ZINC000875327347	GF	On-Demand	Anodyne	ADAM17	36	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(N(C)C)nc2ccccc12	ZINC000875327348	GF	On-Demand	Anodyne	SLC6A3	42	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(N(C)C)nc2ccccc12	ZINC000875327348	GF	On-Demand	Anodyne	ADAM17	36	40
CCOC(=O)CCCCCCCNC(=O)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875327349	EE	On-Demand	Anodyne	EPHX2	21	49
CCOC(=O)CCCCCCCNC(=O)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875327350	EE	On-Demand	Anodyne	EPHX2	21	49
O=C(NCC[C@H]1CCCS1)NCc1ccc(-c2cccnc2)cc1	ZINC000875327363	EH	On-Demand	Anodyne	NAMPT	57	42
O=C(NCC[C@@H]1CCCS1)NCc1ccc(-c2cccnc2)cc1	ZINC000875327365	EH	On-Demand	Anodyne	NAMPT	57	42
CN1CC[C@H]2CN(C(=O)NCc3ccc(-c4cccnc4)cc3)CC[C@@H]21	ZINC000875327376	FF	On-Demand	Anodyne	CHRNA7	52	42
CN1CC[C@H]2CN(C(=O)NCc3ccc(-c4cccnc4)cc3)CC[C@@H]21	ZINC000875327376	FF	On-Demand	Anodyne	NAMPT	93	42
CN1CC[C@H]2CN(C(=O)NCc3ccc(-c4cccnc4)cc3)CC[C@H]21	ZINC000875327380	FF	On-Demand	Anodyne	CHRNA7	52	42
CN1CC[C@H]2CN(C(=O)NCc3ccc(-c4cccnc4)cc3)CC[C@H]21	ZINC000875327380	FF	On-Demand	Anodyne	NAMPT	93	42
O=C(NCCC[C@H]1CCOC1=O)NCc1ccc(-c2cccnc2)cc1	ZINC000875327383	FF	On-Demand	Anodyne	NAMPT	49	39
O=C(NCCC[C@@H]1CCOC1=O)NCc1ccc(-c2cccnc2)cc1	ZINC000875327385	FF	On-Demand	Anodyne	NAMPT	49	39
Cc1ccc2nc(C(=O)Nc3ccc(C4CC4)nn3)cn2c1	ZINC000875327387	CF	On-Demand	Anodyne	MAP3K5	53	45
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccc(-n2cccn2)cc1	ZINC000875327391	GD	On-Demand	Anodyne	ADAM17	15	44
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccc(-n2cccn2)cc1	ZINC000875327391	GD	On-Demand	Anodyne	AMP1_PLAFQ	60	44
O=C(NCc1ccc(-c2cccnc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875327402	FE	On-Demand	Anodyne	NAMPT	87	45
Cc1nc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)sc1C	ZINC000875327427	EG	On-Demand	Anodyne	TRY1_BOVIN	48	34
Cc1nc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)sc1C	ZINC000875327429	EG	On-Demand	Anodyne	TRY1_BOVIN	48	34
CCCCCCCNC(=O)C(=O)NC1CCC(O)(c2cccnc2)CC1	ZINC000875327430	FE	On-Demand	Mild	ASAH1	60	32
Cc1nc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)sc1C	ZINC000875327431	EG	On-Demand	Anodyne	TRY1_BOVIN	48	34
Cc1nc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)sc1C	ZINC000875327433	EG	On-Demand	Anodyne	TRY1_BOVIN	48	34
O=C(NCc1ccc(-c2cccnc2)cc1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875327445	GF	On-Demand	Anodyne	NAMPT	58	38
C[C@@H](NC(=O)N(C)C[C@@H]1C[C@H](O)C1)c1nc(-c2ccc(Cl)cc2)no1	ZINC000875327449	FF	On-Demand	Anodyne	UTS2	40	31
C#CC[C@@H](CCOC)NC(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000875327459	EF	On-Demand	Mild	NAMPT	52	38
C#CC[C@H](CCOC)NC(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000875327460	EF	On-Demand	Mild	NAMPT	52	38
Cc1nc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)sc1C	ZINC000875327475	FH	On-Demand	Anodyne	CPT1A	52	34
C[C@@H](NC(=O)N(C)Cc1ccns1)c1nc(-c2ccc(Cl)cc2)no1	ZINC000875327484	GH	On-Demand	Anodyne	UTS2	41	31
Cc1nc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)sc1C	ZINC000875327485	FH	On-Demand	Anodyne	CPT1A	52	34
Cc1nc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)sc1C	ZINC000875327487	FH	On-Demand	Anodyne	CPT1A	52	34
Cc1nc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)sc1C	ZINC000875327489	FH	On-Demand	Anodyne	CPT1A	52	34
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H](C)c1cccc(C#N)c1	ZINC000875327500	FF	On-Demand	Mild	MCHR1	24	43
COCCN(CC1CCN(C)CC1)C(=O)N[C@H](C)c1cccc(C#N)c1	ZINC000875327501	FF	On-Demand	Mild	MCHR1	24	43
O=C(NCc1ccc(-c2cccnc2)cc1)NC[C@@]12COCCN1C(=O)OC2	ZINC000875327506	GD	On-Demand	Anodyne	NAMPT	54	41
O=C(NCc1ccc(-c2cccnc2)cc1)NC[C@]12COCCN1C(=O)OC2	ZINC000875327507	GD	On-Demand	Anodyne	NAMPT	54	41
O=C(NCc1ccc(-c2cccnc2)cc1)N1CCC2(CCNC2=O)CC1	ZINC000875327512	FF	On-Demand	Anodyne	NAMPT	60	38
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccc(-n2cccn2)cc1	ZINC000875327519	FG	On-Demand	Anodyne	ADAM17	17	49
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccc(-n2cccn2)cc1	ZINC000875327519	FG	On-Demand	Anodyne	AMP1_PLAFQ	64	46
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccc(-n2cccn2)cc1	ZINC000875327521	FG	On-Demand	Anodyne	ADAM17	17	49
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccc(-n2cccn2)cc1	ZINC000875327521	FG	On-Demand	Anodyne	AMP1_PLAFQ	64	46
O=C(NCc1ccc(-c2cccnc2)cc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875327522	GH	On-Demand	Anodyne	CHRNA7	18	40
O=C(NCc1ccc(-c2cccnc2)cc1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875327522	GH	On-Demand	Anodyne	NAMPT	60	39
O=C(NCc1ccc(-c2cccnc2)cc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875327523	GH	On-Demand	Anodyne	CHRNA7	18	40
O=C(NCc1ccc(-c2cccnc2)cc1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875327523	GH	On-Demand	Anodyne	NAMPT	60	39
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1ccc(-n2cccn2)cc1	ZINC000875327526	GG	On-Demand	Anodyne	ADAM17	15	45
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1ccc(-n2cccn2)cc1	ZINC000875327526	GG	On-Demand	Anodyne	AMP1_PLAFQ	65	46
COC(=O)N(C)NC(=O)N[C@H](C)c1ccc(-n2cccn2)cc1	ZINC000875327528	DD	On-Demand	Reactive	ADAM17	15	45
COC(=O)N(C)NC(=O)N[C@H](C)c1ccc(-n2cccn2)cc1	ZINC000875327528	DD	On-Demand	Reactive	AMP1_PLAFQ	69	48
COC(=O)N(C)NC(=O)N[C@@H](C)c1ccc(-n2cccn2)cc1	ZINC000875327529	DD	On-Demand	Reactive	ADAM17	15	45
COC(=O)N(C)NC(=O)N[C@@H](C)c1ccc(-n2cccn2)cc1	ZINC000875327529	DD	On-Demand	Reactive	AMP1_PLAFQ	69	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccn1C	ZINC000875327531	CD	On-Demand	Anodyne	SLC6A4	37	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccn1C	ZINC000875327531	CD	On-Demand	Anodyne	SLC6A3	74	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccn1C	ZINC000875327532	CD	On-Demand	Anodyne	SLC6A4	37	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccn1C	ZINC000875327532	CD	On-Demand	Anodyne	SLC6A3	74	41
Cn1cccc1CNC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O	ZINC000875327550	FD	On-Demand	Anodyne	GPR119	37	41
Cn1cccc1CNC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O	ZINC000875327551	FD	On-Demand	Anodyne	GPR119	37	41
Cn1cccc1CNC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O	ZINC000875327552	FD	On-Demand	Anodyne	GPR119	37	41
Cn1cccc1CNC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O	ZINC000875327553	FD	On-Demand	Anodyne	GPR119	37	41
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCC(O)(c4cccnc4)CC3)CC[C@H]21	ZINC000875327676	GC	On-Demand	Anodyne	CHRNA7	40	33
CN1CC[C@H]2CN(C(=O)C(=O)NC3CCC(O)(c4cccnc4)CC3)CC[C@@H]21	ZINC000875327679	GC	On-Demand	Anodyne	CHRNA7	40	33
O=C(NCc1ccc(-c2cccnc2)cc1)NC[C@@]12COCCN1C(=O)COC2	ZINC000875327687	GD	On-Demand	Anodyne	NAMPT	55	41
O=C(NCc1ccc(-c2cccnc2)cc1)NC[C@]12COCCN1C(=O)COC2	ZINC000875327691	GD	On-Demand	Anodyne	NAMPT	55	41
COC(=O)C1=NO[C@]2(CCN(C(=O)N[C@H](C)c3ccc(-n4cccn4)cc3)C2)C1	ZINC000875327693	GE	On-Demand	Anodyne	AMP1_PLAFQ	55	38
COC(=O)C1=NO[C@]2(CCN(C(=O)N[C@@H](C)c3ccc(-n4cccn4)cc3)C2)C1	ZINC000875327696	GE	On-Demand	Anodyne	AMP1_PLAFQ	55	38
COC(=O)C1=NO[C@@]2(CCN(C(=O)N[C@H](C)c3ccc(-n4cccn4)cc3)C2)C1	ZINC000875327699	GE	On-Demand	Anodyne	AMP1_PLAFQ	55	38
COC(=O)C1=NO[C@@]2(CCN(C(=O)N[C@@H](C)c3ccc(-n4cccn4)cc3)C2)C1	ZINC000875327703	GE	On-Demand	Anodyne	AMP1_PLAFQ	55	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000875327708	FF	On-Demand	Anodyne	SLC6A4	24	55
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000875327708	FF	On-Demand	Anodyne	SLC6A3	43	55
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000875327708	FF	On-Demand	Anodyne	CHRNA7	24	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000875327708	FF	On-Demand	Anodyne	NAMPT	58	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000875327710	FF	On-Demand	Anodyne	SLC6A4	24	55
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000875327710	FF	On-Demand	Anodyne	SLC6A3	43	55
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000875327710	FF	On-Demand	Anodyne	CHRNA7	24	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000875327710	FF	On-Demand	Anodyne	NAMPT	58	36
C[C@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccc(-n2cccn2)cc1	ZINC000875327717	GE	On-Demand	Anodyne	ADAM17	15	45
C[C@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccc(-n2cccn2)cc1	ZINC000875327717	GE	On-Demand	Anodyne	AMP1_PLAFQ	64	45
C[C@@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccc(-n2cccn2)cc1	ZINC000875327719	GE	On-Demand	Anodyne	ADAM17	15	45
C[C@@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccc(-n2cccn2)cc1	ZINC000875327719	GE	On-Demand	Anodyne	AMP1_PLAFQ	64	45
CN1CCN(C2CCN(C(=O)NCc3ccc(-c4cccnc4)cc3)CC2)CC1	ZINC000875327729	GF	On-Demand	Anodyne	CHRNA7	44	44
CN1CCN(C2CCN(C(=O)NCc3ccc(-c4cccnc4)cc3)CC2)CC1	ZINC000875327729	GF	On-Demand	Anodyne	CYP2C9	15	45
CN1CCN(C2CCN(C(=O)NCc3ccc(-c4cccnc4)cc3)CC2)CC1	ZINC000875327729	GF	On-Demand	Anodyne	CALCRL	40	41
CN1CCN(C2CCN(C(=O)NCc3ccc(-c4cccnc4)cc3)CC2)CC1	ZINC000875327729	GF	On-Demand	Anodyne	L3MBTL3	54	38
CN1CCN(C2CCN(C(=O)NCc3ccc(-c4cccnc4)cc3)CC2)CC1	ZINC000875327729	GF	On-Demand	Anodyne	NAMPT	81	49
COCCN(CC1CCN(C)CC1)C(=O)N[C@H](C)c1ccc(-n2cccn2)cc1	ZINC000875327731	GF	On-Demand	Anodyne	ADAM17	15	44
COCCN(CC1CCN(C)CC1)C(=O)N[C@H](C)c1ccc(-n2cccn2)cc1	ZINC000875327731	GF	On-Demand	Anodyne	AMP1_PLAFQ	57	41
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H](C)c1ccc(-n2cccn2)cc1	ZINC000875327733	GF	On-Demand	Anodyne	ADAM17	15	44
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H](C)c1ccc(-n2cccn2)cc1	ZINC000875327733	GF	On-Demand	Anodyne	AMP1_PLAFQ	57	41
C#C[C@@H]1CC[C@@H](NC(=O)NCc2ccc(-c3cccnc3)cc2)CC1	ZINC000875327767	EH	On-Demand	Mild	CHRNA7	17	41
C#C[C@@H]1CC[C@@H](NC(=O)NCc2ccc(-c3cccnc3)cc2)CC1	ZINC000875327767	EH	On-Demand	Mild	NAMPT	64	42
CN(C)[C@@H]1CN(C(=O)NCc2ccc(-c3cccnc3)cc2)C[C@@H]1n1ccnn1	ZINC000875327778	GE	On-Demand	Anodyne	NAMPT	51	36
O=C(NCc1ccc(-c2cccnc2)cc1)NCC1C[C@@H]2CC[C@H](C1)S2(=O)=O	ZINC000875327815	GF	On-Demand	Anodyne	NAMPT	58	42
C[C@@H]1CN(C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)CC[C@H](C(F)(F)F)O1	ZINC000875327821	GH	On-Demand	Anodyne	ADAM17	15	44
C[C@@H]1CN(C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)CC[C@H](C(F)(F)F)O1	ZINC000875327821	GH	On-Demand	Anodyne	AMP1_PLAFQ	59	42
C[C@@H]1CN(C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000875327822	GH	On-Demand	Anodyne	ADAM17	15	44
C[C@@H]1CN(C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000875327822	GH	On-Demand	Anodyne	AMP1_PLAFQ	59	42
O=C(NCCCCC1CC1)C(=O)NC1CCC(O)(c2cccnc2)CC1	ZINC000875327903	FE	On-Demand	Anodyne	NAMPT	15	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000875327909	EG	On-Demand	Anodyne	ANPEP	24	42
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000875327909	EG	On-Demand	Anodyne	NAMPT	43	40
C[C@@H](NC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1nc(C2CCCCC2)no1	ZINC000875327920	GH	On-Demand	Anodyne	ETHR	22	41
C[C@@H](NC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1nc(C2CCCCC2)no1	ZINC000875327925	GH	On-Demand	Anodyne	ETHR	22	41
C[C@H](NC(=O)NCCN(C)CC(F)F)c1nc(-c2ccc(Cl)cc2)no1	ZINC000875327929	GF	On-Demand	Anodyne	UTS2	41	32
C[C@@H](NC(=O)NC[C@H]1CC(C(F)(F)F)=NO1)c1ccc(-n2cccn2)cc1	ZINC000875327931	GF	On-Demand	Anodyne	AMP1_PLAFQ	59	41
C[C@@H](NC(=O)NC[C@@H]1CC(C(F)(F)F)=NO1)c1ccc(-n2cccn2)cc1	ZINC000875327933	GF	On-Demand	Anodyne	AMP1_PLAFQ	59	41
C[C@H](NC(=O)NC[C@H]1CC(C(F)(F)F)=NO1)c1ccc(-n2cccn2)cc1	ZINC000875327934	GF	On-Demand	Anodyne	AMP1_PLAFQ	59	41
C[C@@H]1CN(C(=O)NCc2ccc(-c3cccnc3)cc2)CC[C@@H](C(F)(F)F)O1	ZINC000875327941	GH	On-Demand	Anodyne	NAMPT	72	41
C[C@@H]1CN(C(=O)NCc2ccc(-c3cccnc3)cc2)CC[C@H](C(F)(F)F)O1	ZINC000875327943	GH	On-Demand	Anodyne	NAMPT	72	41
COC(=O)C1=NO[C@@]2(CCN(C(=O)NCc3ccc(-c4cccnc4)cc3)C2)C1	ZINC000875327944	GE	On-Demand	Anodyne	NAMPT	40	35
COC(=O)C1=NO[C@]2(CCN(C(=O)NCc3ccc(-c4cccnc4)cc3)C2)C1	ZINC000875327945	GE	On-Demand	Anodyne	NAMPT	40	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)c2cccc(N3CCCC3)c2)C1	ZINC000875327993	FE	On-Demand	Anodyne	KCNQ2	24	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)c2cccc(N3CCCC3)c2)C1	ZINC000875327994	FE	On-Demand	Anodyne	KCNQ2	24	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@H](C)c2cccc(N3CCCC3)c2)C1	ZINC000875327995	FE	On-Demand	Anodyne	KCNQ2	24	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)N[C@@H](C)c2cccc(N3CCCC3)c2)C1	ZINC000875327996	FE	On-Demand	Anodyne	KCNQ2	24	43
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H](C)c3ccc(-n4cccn4)cc3)C[C@@H]1C2	ZINC000875328004	FF	On-Demand	Anodyne	ADAM17	15	45
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H](C)c3ccc(-n4cccn4)cc3)C[C@@H]1C2	ZINC000875328004	FF	On-Demand	Anodyne	AMP1_PLAFQ	59	41
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H](C)c3ccc(-n4cccn4)cc3)C[C@@H]1C2	ZINC000875328005	FF	On-Demand	Anodyne	ADAM17	15	45
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H](C)c3ccc(-n4cccn4)cc3)C[C@@H]1C2	ZINC000875328005	FF	On-Demand	Anodyne	AMP1_PLAFQ	59	41
C[C@@H](NC(=O)NCCN(C)CC(F)F)c1nc(-c2ccc(Cl)cc2)no1	ZINC000875328009	GF	On-Demand	Anodyne	UTS2	41	32
O=C(NCc1ccc(-c2cccnc2)cc1)NC[C@@H]1CCC12CCOCC2	ZINC000875328036	FH	On-Demand	Anodyne	NAMPT	69	41
O=C(NCc1ccc(-c2cccnc2)cc1)NC[C@H]1CCC12CCOCC2	ZINC000875328038	FH	On-Demand	Anodyne	NAMPT	69	41
O=C(CCc1ccc(N2CCCS2(=O)=O)cc1)Nc1ccc(C2CC2)nn1	ZINC000875328045	GE	On-Demand	Anodyne	CDK2	15	43
O=C(CCc1ccc(N2CCCS2(=O)=O)cc1)Nc1ccc(C2CC2)nn1	ZINC000875328045	GE	On-Demand	Anodyne	CDK1	18	43
O=C(NC1CCC(O)(c2cccnc2)CC1)C(=O)N1CCC(CCF)CC1	ZINC000875328046	GD	On-Demand	Anodyne	C3AR1	41	39
O=C(NC1CCC(O)(c2cccnc2)CC1)C(=O)N1CCC(CCF)CC1	ZINC000875328046	GD	On-Demand	Anodyne	CCR2	23	44
CCc1nc2n(n1)CCC[C@@H]2NC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875328051	GF	On-Demand	Anodyne	FKBP1A	27	40
CCc1nc2n(n1)CCC[C@@H]2NC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875328051	GF	On-Demand	Anodyne	PREP	44	34
O=C(NCc1ccc(-c2cccnc2)cc1)NC[C@@H]1CC2(CCOCC2)CO1	ZINC000875328054	GG	On-Demand	Anodyne	NAMPT	61	39
O=C(NCc1ccc(-c2cccnc2)cc1)NC[C@H]1CC2(CCOCC2)CO1	ZINC000875328056	GG	On-Demand	Anodyne	NAMPT	61	39
O=C(NCc1ccc(-c2cccnc2)cc1)N[C@H]1CCCC[C@H]1F	ZINC000875328058	EH	On-Demand	Anodyne	CHRNA7	21	42
O=C(NCc1ccc(-c2cccnc2)cc1)N[C@H]1CCCC[C@H]1F	ZINC000875328058	EH	On-Demand	Anodyne	NAMPT	55	41
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1nc(C2CCCCC2)no1	ZINC000875328061	GH	On-Demand	Anodyne	BMP1	64	35
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1nc(C2CCCCC2)no1	ZINC000875328063	GH	On-Demand	Anodyne	BMP1	64	35
CCOC1CC2(C1)C[C@H]2NC(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000875328081	FH	On-Demand	Anodyne	TIMP3	43	40
CCOC1CC2(C1)C[C@H]2NC(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000875328081	FH	On-Demand	Anodyne	CYP11B2	16	42
CCOC1CC2(C1)C[C@@H]2NC(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000875328086	FH	On-Demand	Anodyne	TIMP3	43	40
CCOC1CC2(C1)C[C@@H]2NC(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000875328086	FH	On-Demand	Anodyne	CYP11B2	16	42
C[C@@H](NC(=O)N1CC(CNC(=O)C(F)(F)F)C1)c1ccc(-n2cccn2)cc1	ZINC000875328098	GE	On-Demand	Anodyne	AMP1_PLAFQ	61	42
COCC1CC(NC(=O)NCc2ccc(-c3cccnc3)cc2)C1	ZINC000875328112	EF	On-Demand	Anodyne	CYP11B2	28	41
COCC1CC(NC(=O)NCc2ccc(-c3cccnc3)cc2)C1	ZINC000875328112	EF	On-Demand	Anodyne	NAMPT	47	39
O=C(NCc1ccc(-c2cccnc2)cc1)N[C@H]1CC12CCC2	ZINC000875328120	DG	On-Demand	Anodyne	NAMPT	51	42
O=C(NCc1ccc(-c2cccnc2)cc1)N[C@@H]1CC12CCC2	ZINC000875328122	DG	On-Demand	Anodyne	NAMPT	51	42
COC(=O)C1(O)CN(C(=O)NCc2ccc(-c3cccnc3)cc2)C1	ZINC000875328143	ED	On-Demand	Anodyne	CYP11B2	30	41
COC(=O)C1(O)CN(C(=O)NCc2ccc(-c3cccnc3)cc2)C1	ZINC000875328143	ED	On-Demand	Anodyne	NAMPT	65	40
Cn1nnnc1C1CCN(C(=O)NCc2ccc(-c3cccnc3)cc2)CC1	ZINC000875328148	GE	On-Demand	Anodyne	NAMPT	57	41
CC(=O)c1ccc(NC(=O)N(C)CC(=O)Nc2ccc(N3CCOCC3)cc2)cc1	ZINC000875328156	HF	On-Demand	Anodyne	PIK3CA	37	42
CC(=O)c1ccc(NC(=O)N(C)CC(=O)Nc2ccc(N3CCOCC3)cc2)cc1	ZINC000875328156	HF	On-Demand	Anodyne	PRNP	45	37
CC(=O)c1ccc(NC(=O)N(C)CC(=O)Nc2ccc(N3CCOCC3)cc2)cc1	ZINC000875328156	HF	On-Demand	Anodyne	MTOR	72	42
CC(=O)c1ccc(NC(=O)N(C)CC(=O)Nc2ccc(N3CCOCC3)cc2)cc1	ZINC000875328156	HF	On-Demand	Anodyne	PIK3CG	35	42
CC(=O)c1ccc(NC(=O)N(C)CC(=O)Nc2ccc(N3CCOCC3)cc2)cc1	ZINC000875328156	HF	On-Demand	Anodyne	STAT6	51	31
O=C(NCc1ccc(-c2cccnc2)cc1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875328158	FH	On-Demand	Anodyne	CHRNA7	51	41
O=C(NCc1ccc(-c2cccnc2)cc1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875328158	FH	On-Demand	Anodyne	NAMPT	81	41
O=C(NCc1ccc(-c2cccnc2)cc1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875328160	FH	On-Demand	Anodyne	CHRNA7	51	41
O=C(NCc1ccc(-c2cccnc2)cc1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875328160	FH	On-Demand	Anodyne	NAMPT	81	41
O=C(NCc1ccc(-c2cccnc2)cc1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875328162	FH	On-Demand	Anodyne	CHRNA7	51	41
O=C(NCc1ccc(-c2cccnc2)cc1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875328162	FH	On-Demand	Anodyne	NAMPT	81	41
O=C(NCc1ccc(-c2cccnc2)cc1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875328165	FH	On-Demand	Anodyne	CHRNA7	51	41
O=C(NCc1ccc(-c2cccnc2)cc1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875328165	FH	On-Demand	Anodyne	NAMPT	81	41
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(-n2cccn2)cc1	ZINC000875328167	DE	On-Demand	Anodyne	ADAM17	15	48
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(-n2cccn2)cc1	ZINC000875328167	DE	On-Demand	Anodyne	AMP1_PLAFQ	67	47
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(-n2cccn2)cc1	ZINC000875328169	DE	On-Demand	Anodyne	ADAM17	15	48
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(-n2cccn2)cc1	ZINC000875328169	DE	On-Demand	Anodyne	AMP1_PLAFQ	67	47
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)c2cccc(N3CCCC3)c2)CC1	ZINC000875328189	FE	On-Demand	Anodyne	KCNQ2	40	45
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)c2cccc(N3CCCC3)c2)CC1	ZINC000875328190	FE	On-Demand	Anodyne	KCNQ2	40	45
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C)C(=O)C2)c1nc(-c2ccc(Cl)cc2)no1	ZINC000875328226	GH	On-Demand	Anodyne	SLC6A3	15	41
C[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C)C(=O)C2)c1nc(-c2ccc(Cl)cc2)no1	ZINC000875328228	GH	On-Demand	Anodyne	SLC6A3	15	41
C[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C)C(=O)C2)c1nc(-c2ccc(Cl)cc2)no1	ZINC000875328234	GH	On-Demand	Anodyne	SLC6A3	15	41
C[C@H](NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)c1cccc(N2CCCC2)c1	ZINC000875328235	FE	On-Demand	Anodyne	KCNQ2	21	41
C[C@H](NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)c1cccc(N2CCCC2)c1	ZINC000875328239	FE	On-Demand	Anodyne	KCNQ2	21	41
CCC1(CC)CCCN1C(=O)NCc1cccn1C	ZINC000875328277	CF	On-Demand	Anodyne	SLC12A5	63	37
COc1ccc([C@@H]2CN(C(=O)C(=O)N[C@H]3C[C@@H](C)N(C4CC4)C3)CCO2)cc1	ZINC000875328324	GD	On-Demand	Anodyne	NPBWR1	61	30
COc1ccc([C@@H]2CN(C(=O)C(=O)N[C@@H]3C[C@H](C)N(C4CC4)C3)CCO2)cc1	ZINC000875328327	GD	On-Demand	Anodyne	NPBWR1	61	30
COc1ccc([C@@H]2CN(C(=O)C(=O)N[C@@H]3C[C@@H](C)N(C4CC4)C3)CCO2)cc1	ZINC000875328328	GD	On-Demand	Anodyne	NPBWR1	61	30
COc1ccc([C@@H]2CN(C(=O)C(=O)N[C@H]3C[C@H](C)N(C4CC4)C3)CCO2)cc1	ZINC000875328329	GD	On-Demand	Anodyne	NPBWR1	61	30
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)c1ccc(-n2cccn2)cc1	ZINC000875328358	EF	On-Demand	Anodyne	ADAM17	15	44
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)c1ccc(-n2cccn2)cc1	ZINC000875328358	EF	On-Demand	Anodyne	AMP1_PLAFQ	68	50
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)c1ccc(-n2cccn2)cc1	ZINC000875328359	EF	On-Demand	Anodyne	ADAM17	15	44
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)c1ccc(-n2cccn2)cc1	ZINC000875328359	EF	On-Demand	Anodyne	AMP1_PLAFQ	68	50
CC(C)(C)OC(=O)N1CC[C@@H]([C@H](F)C(=O)Nc2ccc(C3CC3)nn2)C1	ZINC000875328360	FF	On-Demand	Anodyne	GPR119	54	44
CC(C)(C)OC(=O)N1CC[C@@H]([C@@H](F)C(=O)Nc2ccc(C3CC3)nn2)C1	ZINC000875328361	FF	On-Demand	Anodyne	GPR119	54	44
CC(C)(C)OC(=O)N1CC[C@H]([C@@H](F)C(=O)Nc2ccc(C3CC3)nn2)C1	ZINC000875328362	FF	On-Demand	Anodyne	GPR119	54	44
CC(C)(C)OC(=O)N1CC[C@H]([C@H](F)C(=O)Nc2ccc(C3CC3)nn2)C1	ZINC000875328364	FF	On-Demand	Anodyne	GPR119	54	44
O=C(NCc1ccc(-c2cccnc2)cc1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875328369	GH	On-Demand	Anodyne	NAMPT	45	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCCO[C@@H]1c1ccc(C)cc1	ZINC000875328374	GG	On-Demand	Anodyne	SLC6A4	24	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCCO[C@@H]1c1ccc(C)cc1	ZINC000875328374	GG	On-Demand	Anodyne	SLC6A3	50	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCCO[C@@H]1c1ccc(C)cc1	ZINC000875328375	GG	On-Demand	Anodyne	SLC6A4	24	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCCO[C@@H]1c1ccc(C)cc1	ZINC000875328375	GG	On-Demand	Anodyne	SLC6A3	50	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCCO[C@H]1c1ccc(C)cc1	ZINC000875328376	GG	On-Demand	Anodyne	SLC6A4	24	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CCCO[C@H]1c1ccc(C)cc1	ZINC000875328376	GG	On-Demand	Anodyne	SLC6A3	50	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCCO[C@H]1c1ccc(C)cc1	ZINC000875328377	GG	On-Demand	Anodyne	SLC6A4	24	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CCCO[C@H]1c1ccc(C)cc1	ZINC000875328377	GG	On-Demand	Anodyne	SLC6A3	50	40
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000875328383	GG	On-Demand	Anodyne	NAMPT	58	38
NC(=O)C1CC(NC(=O)NCc2ccc(-c3cccnc3)cc2)C1	ZINC000875328385	DD	On-Demand	Anodyne	CHRNA7	15	41
NC(=O)C1CC(NC(=O)NCc2ccc(-c3cccnc3)cc2)C1	ZINC000875328385	DD	On-Demand	Anodyne	VCP	24	42
NC(=O)C1CC(NC(=O)NCc2ccc(-c3cccnc3)cc2)C1	ZINC000875328385	DD	On-Demand	Anodyne	NAMPT	76	44
CC(=O)C1CCN(C(=O)NCc2ccc(-c3cccnc3)cc2)CC1	ZINC000875328394	EG	On-Demand	Anodyne	GRIN2B	16	41
CC(=O)C1CCN(C(=O)NCc2ccc(-c3cccnc3)cc2)CC1	ZINC000875328394	EG	On-Demand	Anodyne	CHRNA7	45	42
CC(=O)C1CCN(C(=O)NCc2ccc(-c3cccnc3)cc2)CC1	ZINC000875328394	EG	On-Demand	Anodyne	CYP2C9	18	42
CC(=O)C1CCN(C(=O)NCc2ccc(-c3cccnc3)cc2)CC1	ZINC000875328394	EG	On-Demand	Anodyne	NAMPT	119	46
COC(=O)C1(O)CN(C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)C1	ZINC000875328396	EC	On-Demand	Anodyne	ADAM17	15	44
COC(=O)C1(O)CN(C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)C1	ZINC000875328396	EC	On-Demand	Anodyne	AMP1_PLAFQ	66	47
COC(=O)C1(O)CN(C(=O)N[C@@H](C)c2ccc(-n3cccn3)cc2)C1	ZINC000875328398	EC	On-Demand	Anodyne	ADAM17	15	44
COC(=O)C1(O)CN(C(=O)N[C@@H](C)c2ccc(-n3cccn3)cc2)C1	ZINC000875328398	EC	On-Demand	Anodyne	AMP1_PLAFQ	66	47
CONC(=O)C1CCN(C(=O)NCc2ccc(-c3cccnc3)cc2)CC1	ZINC000875328431	FE	On-Demand	Anodyne	GRIN2B	20	42
CONC(=O)C1CCN(C(=O)NCc2ccc(-c3cccnc3)cc2)CC1	ZINC000875328431	FE	On-Demand	Anodyne	CHRNA7	33	40
CONC(=O)C1CCN(C(=O)NCc2ccc(-c3cccnc3)cc2)CC1	ZINC000875328431	FE	On-Demand	Anodyne	CYP11B2	18	40
CONC(=O)C1CCN(C(=O)NCc2ccc(-c3cccnc3)cc2)CC1	ZINC000875328431	FE	On-Demand	Anodyne	CYP2C9	16	40
CONC(=O)C1CCN(C(=O)NCc2ccc(-c3cccnc3)cc2)CC1	ZINC000875328431	FE	On-Demand	Anodyne	NAMPT	89	41
CO[C@@H]1CC[C@@H](C)N(C(=O)NCc2ccc(-c3cccnc3)cc2)C1	ZINC000875328437	EG	On-Demand	Anodyne	CHRNA7	17	40
CO[C@@H]1CC[C@@H](C)N(C(=O)NCc2ccc(-c3cccnc3)cc2)C1	ZINC000875328437	EG	On-Demand	Anodyne	CYP11B2	27	44
CO[C@@H]1CC[C@@H](C)N(C(=O)NCc2ccc(-c3cccnc3)cc2)C1	ZINC000875328437	EG	On-Demand	Anodyne	NAMPT	53	35
O=C(NCc1ccc(-c2cccnc2)cc1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875328440	FH	On-Demand	Anodyne	NAMPT	58	37
O=C(NCc1ccc(-c2cccnc2)cc1)NC[C@@H]1CCO[C@H]1c1cn[nH]c1	ZINC000875328441	GG	On-Demand	Anodyne	ROCK2	19	40
O=C(NCc1ccc(-c2cccnc2)cc1)NC[C@@H]1CCO[C@H]1c1cn[nH]c1	ZINC000875328441	GG	On-Demand	Anodyne	NAMPT	41	38
C[C@@H](NC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccc(-n2cccn2)cc1	ZINC000875328442	GI	On-Demand	Anodyne	ADAM17	16	51
C[C@@H](NC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccc(-n2cccn2)cc1	ZINC000875328442	GI	On-Demand	Anodyne	AMP1_PLAFQ	62	45
C[C@@H](NC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccc(-n2cccn2)cc1	ZINC000875328444	GI	On-Demand	Anodyne	ADAM17	16	51
C[C@@H](NC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccc(-n2cccn2)cc1	ZINC000875328444	GI	On-Demand	Anodyne	AMP1_PLAFQ	62	45
O=C(NCc1ccc(-c2cccnc2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875328460	DE	On-Demand	Anodyne	CHRNA7	15	40
O=C(NCc1ccc(-c2cccnc2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875328460	DE	On-Demand	Anodyne	NAMPT	65	45
CSc1ccc(F)cc1CNC(=O)NC1(C)CC(F)(F)C1	ZINC000875328476	DH	On-Demand	Anodyne	P2RX7	30	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)c1cccc(-n2cccn2)c1	ZINC000875328503	EF	On-Demand	Anodyne	AMP1_PLAFQ	56	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)c1cccc(-n2cccn2)c1	ZINC000875328505	EF	On-Demand	Anodyne	AMP1_PLAFQ	56	40
C[C@@H](NC(=O)N1CC(CNC(=O)C(F)(F)F)C1)c1cccc(-n2cccn2)c1	ZINC000875328508	GE	On-Demand	Anodyne	AMP1_PLAFQ	51	35
O=C(Nc1ccc(C2CC2)nn1)[C@@H]1CC[C@H](Cc2ccccc2)O1	ZINC000875328532	DG	On-Demand	Anodyne	LUCI_PHOPY	49	30
Cn1cccc1CNC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875328588	DF	On-Demand	Anodyne	EPHX2	24	41
CO[C@H](CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)C(C)C	ZINC000875328589	DF	On-Demand	Anodyne	ACE	36	40
Cn1cccc1CNC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875328591	DF	On-Demand	Anodyne	EPHX2	24	41
CO[C@H](CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)C(C)C	ZINC000875328594	DF	On-Demand	Anodyne	ACE	36	40
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cccn2C)CC1	ZINC000875328597	EH	On-Demand	Anodyne	DRD2	17	45
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cccn2C)CC1	ZINC000875328597	EH	On-Demand	Anodyne	EPHX2	15	43
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cccn2C)CC1	ZINC000875328597	EH	On-Demand	Anodyne	ACKR3	60	30
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cccn2C)CC1	ZINC000875328598	EH	On-Demand	Anodyne	DRD2	17	45
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cccn2C)CC1	ZINC000875328598	EH	On-Demand	Anodyne	EPHX2	15	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cccn2C)CC1	ZINC000875328598	EH	On-Demand	Anodyne	ACKR3	60	30
CO[C@H](CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)C(C)C	ZINC000875328599	DF	On-Demand	Anodyne	ACE	36	40
CO[C@H](CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)C(C)C	ZINC000875328603	DF	On-Demand	Anodyne	ACE	36	40
Cn1cccc1CNC(=O)NCCN1CC[C@@H](O)C1	ZINC000875328615	CB	On-Demand	Anodyne	CCR3	21	40
CCc1cc(NC(=O)C2(c3ccnc4ccccc34)CC2)n(C)n1	ZINC000875328646	DG	On-Demand	Anodyne	INHA	58	35
CCc1cc(NC(=O)C2(c3ccnc4ccccc34)CC2)n(C)n1	ZINC000875328646	DG	On-Demand	Anodyne	HNMT	41	34
C[C@@H](NC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1cccc(-n2cccn2)c1	ZINC000875328649	GG	On-Demand	Anodyne	KCNQ2	15	47
C[C@@H](NC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1cccc(-n2cccn2)c1	ZINC000875328649	GG	On-Demand	Anodyne	AMP1_PLAFQ	46	35
C[C@@H](NC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1cccc(-n2cccn2)c1	ZINC000875328654	GG	On-Demand	Anodyne	KCNQ2	15	47
C[C@@H](NC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1cccc(-n2cccn2)c1	ZINC000875328654	GG	On-Demand	Anodyne	AMP1_PLAFQ	46	35
CCCCCCCNC(=O)C(=O)NCCc1nn(C)c2ccccc12	ZINC000875328680	EE	On-Demand	Mild	CNR1	23	42
CCCCCCCNC(=O)C(=O)NCCc1nn(C)c2ccccc12	ZINC000875328680	EE	On-Demand	Mild	CNR2	29	42
CCCCCCCNC(=O)C(=O)NCCc1nn(C)c2ccccc12	ZINC000875328680	EE	On-Demand	Mild	ASAH1	91	38
CCCCCCCNC(=O)C(=O)NCCc1nn(C)c2ccccc12	ZINC000875328680	EE	On-Demand	Mild	OXER1	42	39
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1nc(C2CCCCC2)no1	ZINC000875328709	FF	On-Demand	Anodyne	BMP1	59	36
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1nc(C2CCCCC2)no1	ZINC000875328711	FF	On-Demand	Anodyne	BMP1	59	36
C[C@@H](NC(=O)NC[C@H]1CC(C(F)(F)F)=NO1)c1cccc(-n2cccn2)c1	ZINC000875328727	GF	On-Demand	Anodyne	AMP1_PLAFQ	45	34
C[C@@H](NC(=O)NC[C@@H]1CC(C(F)(F)F)=NO1)c1cccc(-n2cccn2)c1	ZINC000875328731	GF	On-Demand	Anodyne	AMP1_PLAFQ	45	34
C[C@H](NC(=O)NC[C@H]1CC(C(F)(F)F)=NO1)c1cccc(-n2cccn2)c1	ZINC000875328733	GF	On-Demand	Anodyne	AMP1_PLAFQ	45	34
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H](C)c3cccc(-n4cccn4)c3)C[C@@H]1C2	ZINC000875328743	FF	On-Demand	Anodyne	AMP1_PLAFQ	41	33
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H](C)c3cccc(-n4cccn4)c3)C[C@@H]1C2	ZINC000875328744	FF	On-Demand	Anodyne	AMP1_PLAFQ	41	33
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1cccc(C#N)c1	ZINC000875328753	DD	On-Demand	Mild	CACNA1H	35	40
Cc1nnc([C@@H](C)NC(=O)C(=O)NCCCCCCc2ccccc2)s1	ZINC000875328767	FF	On-Demand	Anodyne	SCNN1A	46	39
Cc1nnc([C@@H](C)NC(=O)C(=O)NCCCCCCc2ccccc2)s1	ZINC000875328767	FF	On-Demand	Anodyne	FAAH	53	42
Cc1nnc([C@@H](C)NC(=O)C(=O)NCCCCCCc2ccccc2)s1	ZINC000875328767	FF	On-Demand	Anodyne	CES1	52	35
Cc1nnc([C@@H](C)NC(=O)C(=O)NCCCCCCc2ccccc2)s1	ZINC000875328767	FF	On-Demand	Anodyne	AMP1_PLAFQ	25	45
O=C(NCC[C@H]1CCSC1)NCc1ccc(-c2cccnc2)cc1	ZINC000875328839	EH	On-Demand	Anodyne	NAMPT	46	40
O=C(NCC[C@@H]1CCSC1)NCc1ccc(-c2cccnc2)cc1	ZINC000875328840	EH	On-Demand	Anodyne	NAMPT	46	40
O=C(NCCO)C1CCN(C(=O)NCc2ccc(-c3cccnc3)cc2)CC1	ZINC000875328853	GD	On-Demand	Anodyne	CHRNA7	20	41
O=C(NCCO)C1CCN(C(=O)NCc2ccc(-c3cccnc3)cc2)CC1	ZINC000875328853	GD	On-Demand	Anodyne	NAMPT	81	40
CN(C)C[C@@H]1CN(C(=O)NCc2ccc(-c3cccnc3)cc2)C[C@H]1CN(C)C	ZINC000875328866	GF	On-Demand	Anodyne	NAMPT	66	39
C#CC[C@H](COC)NC(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000875328871	DF	On-Demand	Mild	NAMPT	40	40
C#CC[C@@H](COC)NC(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000875328872	DF	On-Demand	Mild	NAMPT	40	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(-n2cccn2)cc1	ZINC000875328880	FF	On-Demand	Anodyne	ADAM17	15	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(-n2cccn2)cc1	ZINC000875328880	FF	On-Demand	Anodyne	AMP1_PLAFQ	61	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(-n2cccn2)cc1	ZINC000875328881	FF	On-Demand	Anodyne	ADAM17	15	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(-n2cccn2)cc1	ZINC000875328881	FF	On-Demand	Anodyne	AMP1_PLAFQ	61	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(-n2cccn2)cc1	ZINC000875328882	FF	On-Demand	Anodyne	ADAM17	15	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(-n2cccn2)cc1	ZINC000875328882	FF	On-Demand	Anodyne	AMP1_PLAFQ	61	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(-n2cccn2)cc1	ZINC000875328883	FF	On-Demand	Anodyne	ADAM17	15	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(-n2cccn2)cc1	ZINC000875328883	FF	On-Demand	Anodyne	AMP1_PLAFQ	61	44
COCC(C)(C)CCNC(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000875328884	EH	On-Demand	Anodyne	NAMPT	38	42
CCOC(=O)CCCCCCCNC(=O)N1CCCCCCNC(=O)CC1	ZINC000875328906	GF	On-Demand	Anodyne	ASAH1	46	32
CCC[C@H]1C[C@H]1NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875328912	DG	On-Demand	Mild	ITK	15	49
CCC[C@H]1C[C@H]1NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875328912	DG	On-Demand	Mild	PANC	48	35
CCC[C@H]1C[C@@H]1NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875328914	DG	On-Demand	Mild	ITK	15	49
CCC[C@H]1C[C@@H]1NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875328914	DG	On-Demand	Mild	PANC	48	35
Cn1cccc1CNC(=O)NCCN1CC[C@H](O)C1	ZINC000875328921	CB	On-Demand	Anodyne	CCR3	21	40
O=C(NCc1ccc(-c2cccnc2)cc1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875328993	GG	On-Demand	Anodyne	NAMPT	40	38
O=C(NCc1ccc(-c2cccnc2)cc1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875328995	GG	On-Demand	Anodyne	NAMPT	40	38
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(-c3cccnc3)cc2)C1	ZINC000875329006	EG	On-Demand	Anodyne	CHRNA7	35	44
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(-c3cccnc3)cc2)C1	ZINC000875329006	EG	On-Demand	Anodyne	NAMPT	90	43
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(-c3cccnc3)cc2)C1	ZINC000875329008	EG	On-Demand	Anodyne	CHRNA7	35	44
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(-c3cccnc3)cc2)C1	ZINC000875329008	EG	On-Demand	Anodyne	NAMPT	90	43
C[C@H](NC(=O)C(=O)N1CCC(CO)(CO)CC1)c1cccc(N2CCCC2)c1	ZINC000875329017	GD	On-Demand	Anodyne	KCNQ2	40	45
O=C(NCc1ccc(-c2cccnc2)cc1)NC[C@@H]1C[C@H]1C1CCOCC1	ZINC000875329020	FH	On-Demand	Anodyne	NAMPT	63	40
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(-n2cccn2)cc1	ZINC000875329029	FD	On-Demand	Anodyne	ADAM17	15	45
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(-n2cccn2)cc1	ZINC000875329029	FD	On-Demand	Anodyne	AMP1_PLAFQ	65	46
Cn1cccc1CNC(=O)N[C@H]1Cc2ccccc2NC1=O	ZINC000875329032	CD	On-Demand	Anodyne	PYGM	30	42
Cn1cccc1CNC(=O)N[C@@H]1Cc2ccccc2NC1=O	ZINC000875329035	CD	On-Demand	Anodyne	PYGM	30	42
COC(=O)CN(C(=O)[C@H](Cc1cccnc1)C1CCCC1)c1cccc(C)n1	ZINC000875329055	GG	On-Demand	Anodyne	C3AR1	37	40
CO[C@H](CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1)C(C)C	ZINC000875329056	EF	On-Demand	Anodyne	ACE	27	40
CO[C@H](CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1)C(C)C	ZINC000875329056	EF	On-Demand	Anodyne	FKBP1A	39	40
CO[C@H](CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1)C(C)C	ZINC000875329056	EF	On-Demand	Anodyne	CPT1A	46	33
CO[C@H](CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1)C(C)C	ZINC000875329058	EF	On-Demand	Anodyne	ACE	27	40
CO[C@H](CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1)C(C)C	ZINC000875329058	EF	On-Demand	Anodyne	FKBP1A	39	40
CO[C@H](CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1)C(C)C	ZINC000875329058	EF	On-Demand	Anodyne	CPT1A	46	33
CO[C@H](CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1)C(C)C	ZINC000875329060	EF	On-Demand	Anodyne	ACE	27	40
CO[C@H](CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1)C(C)C	ZINC000875329060	EF	On-Demand	Anodyne	FKBP1A	39	40
CO[C@H](CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1)C(C)C	ZINC000875329060	EF	On-Demand	Anodyne	CPT1A	46	33
CO[C@H](CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1)C(C)C	ZINC000875329062	EF	On-Demand	Anodyne	ACE	27	40
CO[C@H](CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1)C(C)C	ZINC000875329062	EF	On-Demand	Anodyne	FKBP1A	39	40
CO[C@H](CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1)C(C)C	ZINC000875329062	EF	On-Demand	Anodyne	CPT1A	46	33
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2ccc(-n3cccn3)cc2)C1	ZINC000875329064	FF	On-Demand	Anodyne	ADAM17	15	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2ccc(-n3cccn3)cc2)C1	ZINC000875329064	FF	On-Demand	Anodyne	AMP1_PLAFQ	63	45
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)C1	ZINC000875329068	FF	On-Demand	Anodyne	ADAM17	15	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)C1	ZINC000875329068	FF	On-Demand	Anodyne	AMP1_PLAFQ	63	45
CC(=O)C1CCN(C(=O)N[C@H](Cc2ccc(F)cc2)C(C)C)CC1	ZINC000875329103	EG	On-Demand	Anodyne	CCR1	19	40
CC(=O)C1CCN(C(=O)N[C@H](Cc2ccc(F)cc2)C(C)C)CC1	ZINC000875329103	EG	On-Demand	Anodyne	CCR3	41	35
CC(=O)C1CCN(C(=O)N[C@@H](Cc2ccc(F)cc2)C(C)C)CC1	ZINC000875329105	EG	On-Demand	Anodyne	CCR1	19	40
CC(=O)C1CCN(C(=O)N[C@@H](Cc2ccc(F)cc2)C(C)C)CC1	ZINC000875329105	EG	On-Demand	Anodyne	CCR3	41	35
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1cccc(-n2cccn2)c1	ZINC000875329112	FG	On-Demand	Anodyne	AMP1_PLAFQ	51	37
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1cccc(-n2cccn2)c1	ZINC000875329114	FG	On-Demand	Anodyne	AMP1_PLAFQ	51	37
CSc1ccc(F)cc1CNC(=O)N1CCC(CO)(CO)CC1	ZINC000875329120	ED	On-Demand	Anodyne	CACNA1H	43	37
CCC1(O)CCC(NC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000875329156	FE	On-Demand	Anodyne	OXTR	55	38
CCC1(O)CCC(NC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000875329158	FE	On-Demand	Anodyne	OXTR	55	38
COCCN(CC1CCN(C)CC1)C(=O)N[C@H](C)c1cccc(-n2cccn2)c1	ZINC000875329160	GF	On-Demand	Anodyne	AMP1_PLAFQ	44	33
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H](C)c1cccc(-n2cccn2)c1	ZINC000875329162	GF	On-Demand	Anodyne	AMP1_PLAFQ	44	33
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1nc(-c2ccc(Cl)cc2)no1	ZINC000875329226	GH	On-Demand	Anodyne	PRCP	18	42
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1nc(-c2ccc(Cl)cc2)no1	ZINC000875329227	GH	On-Demand	Anodyne	PRCP	18	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(-c3cccnc3)cc2)C1	ZINC000875329254	FG	On-Demand	Anodyne	NAMPT	64	38
CS[C@@H]1C[C@@H](NC(=O)NCc2ccc(-c3cccnc3)cc2)C1	ZINC000875329458	EG	On-Demand	Anodyne	NAMPT	57	40
O=C(NC1(C(=O)Nc2ccc(C3CC3)nn2)CC1)OCc1ccccc1	ZINC000875329461	FF	On-Demand	Anodyne	CTSK	20	49
O=C(NC1(C(=O)Nc2ccc(C3CC3)nn2)CC1)OCc1ccccc1	ZINC000875329461	FF	On-Demand	Anodyne	CTSL	23	48
COC(=O)C1(O)CN(C(=O)NCc2cc(N(C)C)nc3ccccc23)C1	ZINC000875329486	FC	On-Demand	Anodyne	ADAM17	42	36
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1nnc(C)s1	ZINC000875329562	DE	On-Demand	Mild	ASAH1	52	32
CCCCCCCNC(=O)C(=O)N[C@H](C)c1nnc(C)s1	ZINC000875329563	DE	On-Demand	Mild	ASAH1	52	32
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)c2nc(C3CCCCC3)no2)C1	ZINC000875329564	EG	On-Demand	Anodyne	BMP1	60	38
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)c2nc(C3CCCCC3)no2)C1	ZINC000875329565	EG	On-Demand	Anodyne	BMP1	60	38
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)c2nc(C3CCCCC3)no2)C1	ZINC000875329566	EG	On-Demand	Anodyne	BMP1	60	38
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)c2nc(C3CCCCC3)no2)C1	ZINC000875329567	EG	On-Demand	Anodyne	BMP1	60	38
C[C@@H](NC(=O)NCC[C@@H]1CCCS1)c1nc(C2CCCCC2)no1	ZINC000875329571	FH	On-Demand	Anodyne	BMP1	48	35
C[C@@H](NC(=O)NCC[C@H]1CCCS1)c1nc(C2CCCCC2)no1	ZINC000875329572	FH	On-Demand	Anodyne	BMP1	48	35
COC(=O)N(C)NC(=O)NCc1csc(-c2ccc(C(F)(F)F)cc2)n1	ZINC000875329585	GG	On-Demand	Reactive	PPARA	16	50
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](Cc2ccc(F)cc2)C(C)C)C1	ZINC000875329602	EG	On-Demand	Anodyne	MC4R	27	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](Cc2ccc(F)cc2)C(C)C)C1	ZINC000875329602	EG	On-Demand	Anodyne	CCR3	70	38
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](Cc2ccc(F)cc2)C(C)C)C1	ZINC000875329602	EG	On-Demand	Anodyne	MC3R	22	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](Cc2ccc(F)cc2)C(C)C)C1	ZINC000875329602	EG	On-Demand	Anodyne	MC5R	24	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](Cc2ccc(F)cc2)C(C)C)C1	ZINC000875329602	EG	On-Demand	Anodyne	DPP7	41	37
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](Cc2ccc(F)cc2)C(C)C)C1	ZINC000875329602	EG	On-Demand	Anodyne	BIRC2	32	41
CC(=O)[C@H]1CCCN(C(=O)N[C@H](Cc2ccc(F)cc2)C(C)C)C1	ZINC000875329603	EG	On-Demand	Anodyne	MC4R	27	40
CC(=O)[C@H]1CCCN(C(=O)N[C@H](Cc2ccc(F)cc2)C(C)C)C1	ZINC000875329603	EG	On-Demand	Anodyne	CCR3	70	38
CC(=O)[C@H]1CCCN(C(=O)N[C@H](Cc2ccc(F)cc2)C(C)C)C1	ZINC000875329603	EG	On-Demand	Anodyne	MC3R	22	40
CC(=O)[C@H]1CCCN(C(=O)N[C@H](Cc2ccc(F)cc2)C(C)C)C1	ZINC000875329603	EG	On-Demand	Anodyne	MC5R	24	40
CC(=O)[C@H]1CCCN(C(=O)N[C@H](Cc2ccc(F)cc2)C(C)C)C1	ZINC000875329603	EG	On-Demand	Anodyne	DPP7	41	37
CC(=O)[C@H]1CCCN(C(=O)N[C@H](Cc2ccc(F)cc2)C(C)C)C1	ZINC000875329603	EG	On-Demand	Anodyne	BIRC2	32	41
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](Cc2ccc(F)cc2)C(C)C)C1	ZINC000875329604	EG	On-Demand	Anodyne	MC4R	27	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](Cc2ccc(F)cc2)C(C)C)C1	ZINC000875329604	EG	On-Demand	Anodyne	CCR3	70	38
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](Cc2ccc(F)cc2)C(C)C)C1	ZINC000875329604	EG	On-Demand	Anodyne	MC3R	22	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](Cc2ccc(F)cc2)C(C)C)C1	ZINC000875329604	EG	On-Demand	Anodyne	MC5R	24	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](Cc2ccc(F)cc2)C(C)C)C1	ZINC000875329604	EG	On-Demand	Anodyne	DPP7	41	37
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](Cc2ccc(F)cc2)C(C)C)C1	ZINC000875329604	EG	On-Demand	Anodyne	BIRC2	32	41
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](Cc2ccc(F)cc2)C(C)C)C1	ZINC000875329605	EG	On-Demand	Anodyne	MC4R	27	40
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](Cc2ccc(F)cc2)C(C)C)C1	ZINC000875329605	EG	On-Demand	Anodyne	CCR3	70	38
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](Cc2ccc(F)cc2)C(C)C)C1	ZINC000875329605	EG	On-Demand	Anodyne	MC3R	22	40
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](Cc2ccc(F)cc2)C(C)C)C1	ZINC000875329605	EG	On-Demand	Anodyne	MC5R	24	40
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](Cc2ccc(F)cc2)C(C)C)C1	ZINC000875329605	EG	On-Demand	Anodyne	DPP7	41	37
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](Cc2ccc(F)cc2)C(C)C)C1	ZINC000875329605	EG	On-Demand	Anodyne	BIRC2	32	41
O=C(Nc1ccc(C2CC2)nn1)[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875329632	EH	On-Demand	Anodyne	C3AR1	43	45
O=C(Nc1ccc(C2CC2)nn1)[C@H](Cc1cccnc1)C1CCCC1	ZINC000875329633	EH	On-Demand	Anodyne	C3AR1	43	45
O=C1OC[C@H]2CN(C(=O)NCc3ccc(-c4cccnc4)cc3)C[C@@H]12	ZINC000875329640	EE	On-Demand	Anodyne	NAMPT	57	39
O=C(NCc1ccc(-c2cccnc2)cc1)N[C@@H]1[C@@H]2C[C@@H]3[C@@H]1OC[C@@H]3C2	ZINC000875329643	EF	On-Demand	Anodyne	CHRNA7	17	44
O=C(NCc1ccc(-c2cccnc2)cc1)N[C@@H]1[C@H]2C[C@@H]3CO[C@@H]1[C@H]3C2	ZINC000875329644	EF	On-Demand	Anodyne	CHRNA7	17	44
O=C(NCc1ccc(-c2cccnc2)cc1)N[C@@H]1[C@@H]2C[C@H]3[C@H](CO[C@H]31)C2	ZINC000875329645	EF	On-Demand	Anodyne	CHRNA7	17	44
O=C(NCc1ccc(-c2cccnc2)cc1)N[C@@H]1[C@H]2C[C@@H]3CO[C@H]1[C@H]3C2	ZINC000875329646	EF	On-Demand	Anodyne	CHRNA7	17	44
C[C@@H](NC(=O)N1CCN(C)C(C)(C)CC1)c1ccc(-n2cccn2)cc1	ZINC000875329651	FG	On-Demand	Anodyne	ADAM17	15	45
C[C@@H](NC(=O)N1CCN(C)C(C)(C)CC1)c1ccc(-n2cccn2)cc1	ZINC000875329651	FG	On-Demand	Anodyne	AMP1_PLAFQ	63	44
O=C(NCc1ccc(-c2cccnc2)cc1)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875329652	FH	On-Demand	Anodyne	NAMPT	56	39
O=C(NCc1ccc(-c2cccnc2)cc1)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875329653	FH	On-Demand	Anodyne	NAMPT	56	39
O=C(NCc1ccc(-c2cccnc2)cc1)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875329654	FH	On-Demand	Anodyne	NAMPT	56	39
O=C(NCc1ccc(-c2cccnc2)cc1)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875329655	FH	On-Demand	Anodyne	NAMPT	56	39
Cn1nc(Cl)c(C(=O)Nc2ccc(C3CC3)nn2)c1Cl	ZINC000875329665	DF	On-Demand	Anodyne	HTR1F	48	37
Cc1cncc([C@H]2CCCN2C(=O)NCc2ccc(-c3cccnc3)cc2)c1	ZINC000875329681	FI	On-Demand	Anodyne	PREP	20	40
Cc1cncc([C@H]2CCCN2C(=O)NCc2ccc(-c3cccnc3)cc2)c1	ZINC000875329681	FI	On-Demand	Anodyne	NAMPT	66	37
Cc1cncc([C@@H]2CCCN2C(=O)NCc2ccc(-c3cccnc3)cc2)c1	ZINC000875329683	FI	On-Demand	Anodyne	PREP	20	40
Cc1cncc([C@@H]2CCCN2C(=O)NCc2ccc(-c3cccnc3)cc2)c1	ZINC000875329683	FI	On-Demand	Anodyne	NAMPT	66	37
C[C@H](NC(=O)C(=O)NC[C@H]1COCCN1C)c1cccc(OC(F)(F)F)c1	ZINC000875329684	GD	On-Demand	Anodyne	CASR	36	46
C[C@H](NC(=O)C(=O)NC[C@@H]1COCCN1C)c1cccc(OC(F)(F)F)c1	ZINC000875329687	GD	On-Demand	Anodyne	CASR	36	46
C[C@@H](NC(=O)N1CCCCCCNC(=O)CC1)c1ccc(-n2cccn2)cc1	ZINC000875329705	GG	On-Demand	Anodyne	ADAM17	15	43
C[C@@H](NC(=O)N1CCCCCCNC(=O)CC1)c1ccc(-n2cccn2)cc1	ZINC000875329705	GG	On-Demand	Anodyne	AMP1_PLAFQ	61	45
Cn1cccc1CNC(=O)NCCC1(O)CCN(c2ccccc2)CC1	ZINC000875329714	FE	On-Demand	Anodyne	UTS2R	15	42
Cn1cccc1CNC(=O)N1CC2(CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000875329716	FF	On-Demand	Anodyne	GPR119	25	41
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3ccc(-c4cccnc4)cc3)C[C@@H]1C2	ZINC000875329722	FF	On-Demand	Anodyne	CHRNA7	23	41
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3ccc(-c4cccnc4)cc3)C[C@@H]1C2	ZINC000875329722	FF	On-Demand	Anodyne	CYP11B2	15	40
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1ccc(-n2cccn2)cc1	ZINC000875329724	FG	On-Demand	Anodyne	ADAM17	16	46
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1ccc(-n2cccn2)cc1	ZINC000875329724	FG	On-Demand	Anodyne	AMP1_PLAFQ	62	45
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1ccc(-n2cccn2)cc1	ZINC000875329727	FG	On-Demand	Anodyne	ADAM17	16	46
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1ccc(-n2cccn2)cc1	ZINC000875329727	FG	On-Demand	Anodyne	AMP1_PLAFQ	62	45
COCC(C)(C)CCNC(=O)C(=O)N[C@@H](C)c1cccc(N2CCCC2)c1	ZINC000875329738	GF	On-Demand	Anodyne	KCNQ2	35	42
C[C@@H](NC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1ccc(-n2cccn2)cc1	ZINC000875329739	GG	On-Demand	Anodyne	ADAM17	15	44
C[C@@H](NC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1ccc(-n2cccn2)cc1	ZINC000875329739	GG	On-Demand	Anodyne	AMP1_PLAFQ	60	43
C[C@@H](NC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1ccc(-n2cccn2)cc1	ZINC000875329740	GG	On-Demand	Anodyne	ADAM17	15	44
C[C@@H](NC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1ccc(-n2cccn2)cc1	ZINC000875329740	GG	On-Demand	Anodyne	AMP1_PLAFQ	60	43
COCC(C)(C)CCNC(=O)C(=O)N[C@H](C)c1cccc(N2CCCC2)c1	ZINC000875329741	GF	On-Demand	Anodyne	KCNQ2	35	42
O=C(NCc1ccc(-c2cccnc2)cc1)N[C@@H]1C[C@H]1C1CCOCC1	ZINC000875329744	FG	On-Demand	Anodyne	CHRNA7	22	42
O=C(NCc1ccc(-c2cccnc2)cc1)N[C@@H]1C[C@H]1C1CCOCC1	ZINC000875329744	FG	On-Demand	Anodyne	NAMPT	65	39
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)c1cccc(N2CCCC2)c1	ZINC000875329748	FD	On-Demand	Mild	KCNQ2	40	43
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)c1cccc(N2CCCC2)c1	ZINC000875329750	FD	On-Demand	Mild	KCNQ2	40	43
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](C)c1cccc(N2CCCC2)c1	ZINC000875329751	FD	On-Demand	Mild	KCNQ2	40	43
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](C)c1cccc(N2CCCC2)c1	ZINC000875329752	FD	On-Demand	Mild	KCNQ2	40	43
O=C(NCc1ccc(-c2cccnc2)cc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875329755	GI	On-Demand	Anodyne	CHRNA7	28	41
O=C(NCc1ccc(-c2cccnc2)cc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875329755	GI	On-Demand	Anodyne	EPHX2	21	43
O=C(NCc1ccc(-c2cccnc2)cc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875329755	GI	On-Demand	Anodyne	NAMPT	69	41
O=C(NCc1ccc(-c2cccnc2)cc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875329758	GI	On-Demand	Anodyne	CHRNA7	28	41
O=C(NCc1ccc(-c2cccnc2)cc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875329758	GI	On-Demand	Anodyne	EPHX2	21	43
O=C(NCc1ccc(-c2cccnc2)cc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875329758	GI	On-Demand	Anodyne	NAMPT	69	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	F2	22	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	ACE	69	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	OPRM1	60	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	OPRD1	51	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	MME	93	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	ANPEP	62	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	TACR1	25	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	PGC	53	31
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	MC4R	26	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	CMA1	49	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	CTRA_BOVIN	39	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	FCER2	95	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	KLK3	69	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	CTSB	74	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	PAPA1_CARPA	88	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	TRY1_BOVIN	46	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	CYSP_TRYCR	69	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	CCKAR	48	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	CTSK	47	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	CTSL	64	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	NPFFR2	68	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	TIMP3	99	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	CAPNS1	81	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	HLA-DRB1	118	51
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	CELA2A	49	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	REN	84	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	REN1	42	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	MMP11	43	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	CTSS	30	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	CAPN1	108	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	MMP9	24	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	CAPN2	127	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	ACE2	67	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	MC1R	54	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	MMP1	28	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	FPR1	76	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	GAG-PRO	41	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	NPFFR1	62	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc(C2CC2)nn1	ZINC000875329766	FF	On-Demand	Anodyne	GPR142	74	40
O=C1CCN(C(=O)NCc2ccc(-c3cccnc3)cc2)CCCCCCN1	ZINC000875329768	GG	On-Demand	Anodyne	NAMPT	65	43
C[C@@H](NC(=O)N(C)CCN1CC2(CCOCC2)C1)c1ccc(-n2cccn2)cc1	ZINC000875329782	GF	On-Demand	Anodyne	AMP1_PLAFQ	57	39
CC[C@H](C[C@H](C)O)NC(=O)NCc1cc(N(C)C)nc2ccccc12	ZINC000875329838	EF	On-Demand	Anodyne	ANPEP	15	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1cc(N(C)C)nc2ccccc12	ZINC000875329838	EF	On-Demand	Anodyne	TACR3	44	36
COCCN(CC1CCN(C)CC1)C(=O)NCc1cc(F)ccc1SC	ZINC000875329914	GG	On-Demand	Anodyne	ACKR3	65	34
C[C@@H](NC(=O)N1CCCC(F)(F)CC1)c1nc(-c2ccc(Cl)cc2)no1	ZINC000875329961	GI	On-Demand	Anodyne	CACNA1H	43	35
CCC1(O)CCC(NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875329967	GE	On-Demand	Anodyne	C3AR1	42	41
CCC1(O)CCC(NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875329968	GE	On-Demand	Anodyne	C3AR1	42	41
CCC1(O)CCC(NC(=O)C(=O)N2CCN(c3ccc(F)cc3F)CC2)CC1	ZINC000875329989	GD	On-Demand	Anodyne	NPY2R	45	37
Cn1nc(CCNC(=O)C(=O)NCCCCC2CC2)c2ccccc21	ZINC000875329992	ED	On-Demand	Anodyne	HTR3A	15	44
CCc1nc2n(n1)CCC[C@@H]2NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875330010	GD	On-Demand	Anodyne	OXTR	45	35
CCc1nc2n(n1)CCC[C@@H]2NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875330011	GD	On-Demand	Anodyne	OXTR	45	35
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccc(-n2cccn2)cc1	ZINC000875330033	ED	On-Demand	Anodyne	ADAM17	15	45
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccc(-n2cccn2)cc1	ZINC000875330033	ED	On-Demand	Anodyne	AMP1_PLAFQ	64	45
C[S@](=N)(=O)N1CCN(C(=O)NCc2ccc(-c3cccnc3)cc2)CC1	ZINC000875330040	FE	On-Demand	Anodyne	CYP2C9	17	43
C[S@](=N)(=O)N1CCN(C(=O)NCc2ccc(-c3cccnc3)cc2)CC1	ZINC000875330040	FE	On-Demand	Anodyne	NAMPT	106	48
Cc1nc(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)sc1C	ZINC000875330042	FF	On-Demand	Anodyne	CTSV	28	43
Cc1nc(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)sc1C	ZINC000875330042	FF	On-Demand	Anodyne	PDS	64	38
Cc1nc(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)sc1C	ZINC000875330043	FF	On-Demand	Anodyne	CTSV	28	43
Cc1nc(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)sc1C	ZINC000875330043	FF	On-Demand	Anodyne	PDS	64	38
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(-n2cccn2)cc1	ZINC000875330079	EF	On-Demand	Anodyne	ADAM17	16	47
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(-n2cccn2)cc1	ZINC000875330079	EF	On-Demand	Anodyne	AMP1_PLAFQ	66	47
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(-n2cccn2)cc1	ZINC000875330082	EF	On-Demand	Anodyne	ADAM17	16	47
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(-n2cccn2)cc1	ZINC000875330082	EF	On-Demand	Anodyne	AMP1_PLAFQ	66	47
C[C@@H](NC(=O)N(C)CCN1CC2(CCOCC2)C1)c1cccc(C#N)c1	ZINC000875330088	FE	On-Demand	Mild	CASR	28	43
C[C@@H](NC(=O)NC1(C)CC(F)(F)C1)c1ccc(-n2cccn2)cc1	ZINC000875330098	EG	On-Demand	Anodyne	ADAM17	15	44
C[C@@H](NC(=O)NC1(C)CC(F)(F)C1)c1ccc(-n2cccn2)cc1	ZINC000875330098	EG	On-Demand	Anodyne	AMP1_PLAFQ	69	50
C[C@H](NC(=O)NC1(C)CC(F)(F)C1)c1ccc(-n2cccn2)cc1	ZINC000875330099	EG	On-Demand	Anodyne	ADAM17	15	44
C[C@H](NC(=O)NC1(C)CC(F)(F)C1)c1ccc(-n2cccn2)cc1	ZINC000875330099	EG	On-Demand	Anodyne	AMP1_PLAFQ	69	50
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1ccc(-n2cccn2)cc1	ZINC000875330129	EG	On-Demand	Anodyne	AMP1_PLAFQ	66	45
CCSc1ccccc1OC(=O)[C@H]1CCCN1C(C)=O	ZINC000875330137	CF	On-Demand	Anodyne	ACE	41	41
CCSc1ccccc1OC(=O)[C@H]1CCCN1C(C)=O	ZINC000875330137	CF	On-Demand	Anodyne	FKBP1A	80	40
CCSc1ccccc1OC(=O)[C@H]1CCCN1C(C)=O	ZINC000875330137	CF	On-Demand	Anodyne	ELANE	42	35
CCSc1ccccc1OC(=O)[C@H]1CCCN1C(C)=O	ZINC000875330137	CF	On-Demand	Anodyne	PREP	67	35
CCSc1ccccc1OC(=O)[C@H]1CCCN1C(C)=O	ZINC000875330137	CF	On-Demand	Anodyne	LGMN	45	34
CCSc1ccccc1OC(=O)[C@H]1CCCN1C(C)=O	ZINC000875330137	CF	On-Demand	Anodyne	XIAP	40	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cccc(-n2cccn2)c1	ZINC000875330163	FF	On-Demand	Anodyne	AMP1_PLAFQ	50	36
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cccc(-n2cccn2)c1	ZINC000875330164	FF	On-Demand	Anodyne	AMP1_PLAFQ	50	36
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cccc(-n2cccn2)c1	ZINC000875330165	FF	On-Demand	Anodyne	AMP1_PLAFQ	50	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cccc(-n2cccn2)c1	ZINC000875330166	FF	On-Demand	Anodyne	AMP1_PLAFQ	50	36
O=CN1CCCN(C(=O)NCc2ccc(-c3cccnc3)cc2)CC1	ZINC000875330225	EE	On-Demand	Anodyne	NAMPT	68	42
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1cccc(-n2cccn2)c1	ZINC000875330227	ED	On-Demand	Anodyne	KCNQ2	22	53
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1cccc(-n2cccn2)c1	ZINC000875330227	ED	On-Demand	Anodyne	AMP1_PLAFQ	53	36
C[C@@H]1[C@H](C(=O)NNC(=O)NCc2ccc(-c3cccnc3)cc2)CCCN1C	ZINC000875330228	GE	On-Demand	Reactive	CHRNA7	30	41
C[C@@H]1[C@H](C(=O)NNC(=O)NCc2ccc(-c3cccnc3)cc2)CCCN1C	ZINC000875330228	GE	On-Demand	Reactive	NAMPT	78	41
O=C(NCc1ccc(-c2cccnc2)cc1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875330281	GE	On-Demand	Anodyne	CHRNA7	50	41
O=C(NCc1ccc(-c2cccnc2)cc1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875330281	GE	On-Demand	Anodyne	NAMPT	93	43
O=C(NCc1ccc(-c2cccnc2)cc1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875330285	GE	On-Demand	Anodyne	CHRNA7	50	41
O=C(NCc1ccc(-c2cccnc2)cc1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875330285	GE	On-Demand	Anodyne	NAMPT	93	43
O=C(NCc1ccc(-c2cccnc2)cc1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875330288	GE	On-Demand	Anodyne	CHRNA7	50	41
O=C(NCc1ccc(-c2cccnc2)cc1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875330288	GE	On-Demand	Anodyne	NAMPT	93	43
O=C(NCc1ccc(-c2cccnc2)cc1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875330293	GE	On-Demand	Anodyne	CHRNA7	50	41
O=C(NCc1ccc(-c2cccnc2)cc1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875330293	GE	On-Demand	Anodyne	NAMPT	93	43
CCOC(=O)CCCCCCCNC(=O)N1CC=CC1	ZINC000875330357	CE	On-Demand	Anodyne	EPHX2	15	49
CCOC(=O)CCCCCCCNC(=O)N1CC=CC1	ZINC000875330357	CE	On-Demand	Anodyne	ASAH1	80	38
CCCCCCCNC(=O)C(=O)NC1CCC(O)(CC)CC1	ZINC000875330371	DE	On-Demand	Mild	ASAH1	49	32
CCCCCCCNC(=O)C(=O)NC1CCC(O)(CC)CC1	ZINC000875330371	DE	On-Demand	Mild	LASR	44	32
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1cccc(-n2cccn2)c1	ZINC000875330478	FG	On-Demand	Anodyne	AMP1_PLAFQ	53	37
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1cccc(-n2cccn2)c1	ZINC000875330483	FG	On-Demand	Anodyne	AMP1_PLAFQ	53	37
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1cccc(-n2cccn2)c1	ZINC000875330487	GD	On-Demand	Anodyne	AMP1_PLAFQ	46	36
C[C@H](NC(=O)C(=O)N1CCN(C)C(C)(C)CC1)c1cccc(N2CCCC2)c1	ZINC000875330520	GE	On-Demand	Anodyne	KCNQ2	16	41
C[C@@H](NC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1cccc(-n2cccn2)c1	ZINC000875330524	GI	On-Demand	Anodyne	AMP1_PLAFQ	51	37
C[C@@H](NC(=O)N1CCC[C@H](OC2CCC2)CC1)c1cccc(-n2cccn2)c1	ZINC000875330528	GI	On-Demand	Anodyne	AMP1_PLAFQ	51	37
C[C@@H](NC(=O)NC1(C)CC(F)(F)C1)c1cccc(-n2cccn2)c1	ZINC000875330539	EG	On-Demand	Anodyne	AMP1_PLAFQ	56	40
C[C@H](NC(=O)NC1(C)CC(F)(F)C1)c1cccc(-n2cccn2)c1	ZINC000875330542	EG	On-Demand	Anodyne	AMP1_PLAFQ	56	40
C[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C)[C@@H](O)C2)c1nc(-c2ccc(Cl)cc2)no1	ZINC000875330690	GG	On-Demand	Anodyne	SLC6A3	22	43
C[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C)[C@@H](O)C2)c1nc(-c2ccc(Cl)cc2)no1	ZINC000875330691	GG	On-Demand	Anodyne	SLC6A3	22	43
C[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C)[C@H](O)C2)c1nc(-c2ccc(Cl)cc2)no1	ZINC000875330692	GG	On-Demand	Anodyne	SLC6A3	22	43
C[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C)[C@H](O)C2)c1nc(-c2ccc(Cl)cc2)no1	ZINC000875330693	GG	On-Demand	Anodyne	SLC6A3	22	43
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1nc(C2CCCCC2)no1	ZINC000875330742	FG	On-Demand	Anodyne	BMP1	57	35
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1nc(C2CCCCC2)no1	ZINC000875330743	FG	On-Demand	Anodyne	BMP1	57	35
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@H](C)c1cccc(N2CCCC2)c1	ZINC000875330770	FE	On-Demand	Mild	KCNQ2	37	42
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](C)c1cccc(N2CCCC2)c1	ZINC000875330771	FE	On-Demand	Mild	KCNQ2	37	42
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](C)c1cccc(N2CCCC2)c1	ZINC000875330772	FE	On-Demand	Mild	KCNQ2	37	42
C#CC[C@@H](CCOC)NC(=O)C(=O)N[C@@H](C)c1cccc(N2CCCC2)c1	ZINC000875330773	FE	On-Demand	Mild	KCNQ2	37	42
Cn1cccc1CNC(=O)N(Cc1cccc(O)c1)[C@@H]1CC[C@@H](O)CC1	ZINC000875330788	FF	On-Demand	Anodyne	HSD17B2	19	42
CCOC(=O)CCCCCCCNC(=O)N1OC2CCC1CC2	ZINC000875330843	EG	On-Demand	Anodyne	EPHX2	15	48
CCSCC[C@H](C)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875330954	EG	On-Demand	Anodyne	ACE	43	42
CCSCC[C@H](C)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875330955	EG	On-Demand	Anodyne	ACE	43	42
CCSCC[C@H](C)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875330956	EG	On-Demand	Anodyne	ACE	43	42
CCSCC[C@H](C)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875330957	EG	On-Demand	Anodyne	ACE	43	42
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1cccc(-n2cccn2)c1	ZINC000875331090	DE	On-Demand	Anodyne	AMP1_PLAFQ	57	39
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1cccc(-n2cccn2)c1	ZINC000875331091	DE	On-Demand	Anodyne	AMP1_PLAFQ	57	39
C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875331119	GD	On-Demand	Anodyne	CHRNA7	41	35
C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875331119	GD	On-Demand	Anodyne	C3AR1	40	40
C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875331120	GD	On-Demand	Anodyne	CHRNA7	41	35
C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875331120	GD	On-Demand	Anodyne	C3AR1	40	40
C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875331121	GD	On-Demand	Anodyne	CHRNA7	41	35
C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875331121	GD	On-Demand	Anodyne	C3AR1	40	40
C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875331122	GD	On-Demand	Anodyne	CHRNA7	41	35
C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875331122	GD	On-Demand	Anodyne	C3AR1	40	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2cccc(-n3cccn3)c2)C1	ZINC000875331123	FF	On-Demand	Anodyne	AMP1_PLAFQ	52	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2cccc(-n3cccn3)c2)C1	ZINC000875331125	FF	On-Demand	Anodyne	AMP1_PLAFQ	52	37
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1cccc(-n2cccn2)c1	ZINC000875331154	EG	On-Demand	Anodyne	AMP1_PLAFQ	54	36
COC(=O)N(C)NC(=O)N[C@H](C)c1cccc(-n2cccn2)c1	ZINC000875331166	DD	On-Demand	Reactive	AMP1_PLAFQ	57	39
COC(=O)N(C)NC(=O)N[C@@H](C)c1cccc(-n2cccn2)c1	ZINC000875331167	DD	On-Demand	Reactive	AMP1_PLAFQ	57	39
C[C@@H](NC(=O)N1CCN(C)C(C)(C)CC1)c1cccc(-n2cccn2)c1	ZINC000875331186	FG	On-Demand	Anodyne	AMP1_PLAFQ	52	36
C[C@@H](NC(=O)N1CCCCCCNC(=O)CC1)c1cccc(-n2cccn2)c1	ZINC000875331252	GG	On-Demand	Anodyne	AMP1_PLAFQ	50	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(F)ccc1SC	ZINC000875331274	FF	On-Demand	Anodyne	SLC6A4	31	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(F)ccc1SC	ZINC000875331274	FF	On-Demand	Anodyne	SLC6A3	65	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(F)ccc1SC	ZINC000875331275	FF	On-Demand	Anodyne	SLC6A4	31	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(F)ccc1SC	ZINC000875331275	FF	On-Demand	Anodyne	SLC6A3	65	43
CCCCCCCNC(=O)C(=O)N[C@@H]1CN(C2CC2)C[C@@H]1C	ZINC000875331276	DD	On-Demand	Mild	ASAH1	49	32
CCCCCCCNC(=O)C(=O)N[C@H]1CN(C2CC2)C[C@H]1C	ZINC000875331277	DD	On-Demand	Mild	ASAH1	49	32
CCCCCCCNC(=O)C(=O)N[C@@H]1CN(C2CC2)C[C@H]1C	ZINC000875331278	DD	On-Demand	Mild	ASAH1	49	32
CCCCCCCNC(=O)C(=O)N[C@H]1CN(C2CC2)C[C@@H]1C	ZINC000875331279	DD	On-Demand	Mild	ASAH1	49	32
CSc1ccc(F)cc1CNC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875331284	FD	On-Demand	Anodyne	EPHX2	28	49
C[C@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1cccc(-n2cccn2)c1	ZINC000875331295	GE	On-Demand	Anodyne	AMP1_PLAFQ	53	36
C[C@@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1cccc(-n2cccn2)c1	ZINC000875331296	GE	On-Demand	Anodyne	AMP1_PLAFQ	53	36
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1cccc(-n2cccn2)c1	ZINC000875331322	EF	On-Demand	Anodyne	AMP1_PLAFQ	54	38
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1cccc(-n2cccn2)c1	ZINC000875331325	EF	On-Demand	Anodyne	AMP1_PLAFQ	54	38
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1cccc(-n2cccn2)c1	ZINC000875331347	GG	On-Demand	Anodyne	CACNA1H	23	40
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1cccc(-n2cccn2)c1	ZINC000875331347	GG	On-Demand	Anodyne	AMP1_PLAFQ	53	37
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1cccc(-n2cccn2)c1	ZINC000875331369	FD	On-Demand	Anodyne	CACNA1H	25	42
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1cccc(-n2cccn2)c1	ZINC000875331369	FD	On-Demand	Anodyne	AMP1_PLAFQ	54	37
CSc1ccc(F)cc1CNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875331425	FE	On-Demand	Anodyne	CCR3	31	43
C[C@@H]1CN(C(=O)N[C@H](C)c2cccc(-n3cccn3)c2)CC[C@H](C(F)(F)F)O1	ZINC000875331444	GH	On-Demand	Anodyne	AMP1_PLAFQ	45	35
C[C@@H]1CN(C(=O)N[C@H](C)c2cccc(-n3cccn3)c2)CC[C@@H](C(F)(F)F)O1	ZINC000875331445	GH	On-Demand	Anodyne	AMP1_PLAFQ	45	35
COC(=O)C1(O)CN(C(=O)N[C@H](C)c2cccc(-n3cccn3)c2)C1	ZINC000875331463	EC	On-Demand	Anodyne	KCNQ2	18	50
COC(=O)C1(O)CN(C(=O)N[C@H](C)c2cccc(-n3cccn3)c2)C1	ZINC000875331463	EC	On-Demand	Anodyne	AMP1_PLAFQ	54	38
COC(=O)C1(O)CN(C(=O)N[C@@H](C)c2cccc(-n3cccn3)c2)C1	ZINC000875331464	EC	On-Demand	Anodyne	KCNQ2	18	50
COC(=O)C1(O)CN(C(=O)N[C@@H](C)c2cccc(-n3cccn3)c2)C1	ZINC000875331464	EC	On-Demand	Anodyne	AMP1_PLAFQ	54	38
C[C@@H](NC(=O)N(C)CCN1CC2(CCOCC2)C1)c1cccc(-n2cccn2)c1	ZINC000875331465	GF	On-Demand	Anodyne	CASR	40	34
CC(C)(C)OC(=O)CCCNC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875331528	CD	On-Demand	Anodyne	EPHX2	17	53
Cc1cscc1CNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875331595	GF	On-Demand	Anodyne	ETHR	62	45
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cc(Cl)ccc2OC(F)F)C1	ZINC000875331707	GG	On-Demand	Anodyne	F2	17	41
CONC(=O)C1CCN(C(=O)NCc2coc(-c3ccc(C)cc3)n2)CC1	ZINC000875331710	FE	On-Demand	Anodyne	PDE8B	58	35
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nc2ccc(C)cc2[nH]1	ZINC000875331721	EE	On-Demand	Anodyne	SLC6A3	43	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nc2ccc(C)cc2[nH]1	ZINC000875331722	EE	On-Demand	Anodyne	SLC6A3	43	37
COCCN(CC1CCN(C)CC1)C(=O)NCc1nc2ccc(C)cc2[nH]1	ZINC000875331740	FE	On-Demand	Anodyne	HTR1F	41	35
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCC(=O)OC(C)(C)C)C[C@@H]1C2	ZINC000875331770	ED	On-Demand	Anodyne	EPHX2	17	50
CCCCCCCNC(=O)C(=O)NCc1cscc1C	ZINC000875331809	CF	On-Demand	Mild	ASAH1	94	38
COC(=O)c1ccc(CC(=O)Nc2sccc2C(=O)C(C)(C)C)cn1	ZINC000875331876	FG	On-Demand	Anodyne	FAS	34	42
CC(=O)C1CCN(C(=O)NCc2coc(-c3ccc(C)cc3)n2)CC1	ZINC000875331913	EG	On-Demand	Anodyne	PDE8B	40	32
O=C(NCCO)C1CCN(C(=O)NCc2c(F)cccc2OC(F)F)CC1	ZINC000875331914	GD	On-Demand	Anodyne	EPHX2	15	43
COCCN(CC1CCN(C)CC1)C(=O)NCC1CCC(C(F)(F)F)CC1	ZINC000875331916	GG	On-Demand	Anodyne	CACNA1I	49	33
CC(=O)[C@H]1CCCN(C(=O)NCc2coc(-c3ccc(C)cc3)n2)C1	ZINC000875331928	EG	On-Demand	Anodyne	PDE8B	44	32
CC(=O)[C@@H]1CCCN(C(=O)NCc2coc(-c3ccc(C)cc3)n2)C1	ZINC000875331929	EG	On-Demand	Anodyne	PDE8B	44	32
CC(C)(C)OC(=O)CCCNC(=O)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875331938	FE	On-Demand	Anodyne	MLYCD	15	43
CC(C)(C)OC(=O)CCCNC(=O)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875331939	FE	On-Demand	Anodyne	MLYCD	15	43
Cc1cscc1CNC(=O)C(=O)N[C@@H](C)c1ccc(C(F)(F)F)nc1	ZINC000875331991	FF	On-Demand	Anodyne	TRPV1	69	32
Cc1cscc1CNC(=O)C(=O)N[C@H](C)c1ccc(C(F)(F)F)nc1	ZINC000875331992	FF	On-Demand	Anodyne	TRPV1	69	32
CC[C@@H]1COCCN1CCNC(=O)NCc1coc(-c2ccc(C)cc2)n1	ZINC000875331996	FF	On-Demand	Anodyne	MTOR	47	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1c(F)cccc1OC(F)F	ZINC000875332063	FF	On-Demand	Anodyne	SLC6A4	28	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1c(F)cccc1OC(F)F	ZINC000875332063	FF	On-Demand	Anodyne	SLC6A3	66	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1c(F)cccc1OC(F)F	ZINC000875332064	FF	On-Demand	Anodyne	SLC6A4	28	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1c(F)cccc1OC(F)F	ZINC000875332064	FF	On-Demand	Anodyne	SLC6A3	66	41
CCC1(CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CCOCC1	ZINC000875332096	FG	On-Demand	Mild	ITK	15	48
CCC1(CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CCOCC1	ZINC000875332096	FG	On-Demand	Mild	PANC	41	35
O=C(NCC1CCC(C(F)(F)F)CC1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875332116	GE	On-Demand	Anodyne	CACNA1I	52	36
O=C(NCC1CCC(C(F)(F)F)CC1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875332117	GE	On-Demand	Anodyne	CACNA1I	52	36
O=C(NCC1CCC(C(F)(F)F)CC1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875332118	GE	On-Demand	Anodyne	CACNA1I	52	36
O=C(NCC1CCC(C(F)(F)F)CC1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875332119	GE	On-Demand	Anodyne	CACNA1I	52	36
Cc1cscc1CNC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875332121	FC	On-Demand	Anodyne	L3MBTL3	42	39
Cc1nnc(NNC(=O)NCc2cc(Cl)ccc2OC(F)F)n1C	ZINC000875332126	FE	On-Demand	Reactive	P2RX7	40	38
CCCCCCCNC(=O)C(=O)N[C@@H]1CCc2nc(COC)nn2C1	ZINC000875332136	FC	On-Demand	Mild	ASAH1	42	32
CCCCCCCNC(=O)C(=O)N[C@H]1CCc2nc(COC)nn2C1	ZINC000875332137	FC	On-Demand	Mild	ASAH1	42	32
CC(C)(C)C(=O)c1ccsc1NC(=O)c1cnc2nccn2c1	ZINC000875332144	EG	On-Demand	Anodyne	MAP3K5	40	32
CC(C)(C)OC(=O)CCCNC(=O)NC1([C@@H]2CCCCO2)CCC1	ZINC000875332160	EF	On-Demand	Anodyne	EPHX2	15	48
CC(C)(C)OC(=O)CCCNC(=O)NC1([C@H]2CCCCO2)CCC1	ZINC000875332161	EF	On-Demand	Anodyne	EPHX2	15	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1coc(-c2ccc(C)cc2)n1	ZINC000875332234	FF	On-Demand	Anodyne	SLC6A4	24	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1coc(-c2ccc(C)cc2)n1	ZINC000875332234	FF	On-Demand	Anodyne	SLC6A3	47	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1coc(-c2ccc(C)cc2)n1	ZINC000875332234	FF	On-Demand	Anodyne	PDE8B	40	32
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1coc(-c2ccc(C)cc2)n1	ZINC000875332235	FF	On-Demand	Anodyne	SLC6A4	24	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1coc(-c2ccc(C)cc2)n1	ZINC000875332235	FF	On-Demand	Anodyne	SLC6A3	47	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1coc(-c2ccc(C)cc2)n1	ZINC000875332235	FF	On-Demand	Anodyne	PDE8B	40	32
CN1CC[C@H]2CN(C(=O)NCC3CCC(C(F)(F)F)CC3)CC[C@H]21	ZINC000875332273	EG	On-Demand	Anodyne	CACNA1I	46	35
CN1CC[C@H]2CN(C(=O)NCC3CCC(C(F)(F)F)CC3)CC[C@@H]21	ZINC000875332274	EG	On-Demand	Anodyne	CACNA1I	46	35
CC(=O)c1ccc(NC(=O)N(C)c2ccc3ccccc3c2)cc1	ZINC000875332311	DJ	On-Demand	Anodyne	PRNP	32	43
COc1ccc(N2CCN(C(=O)NC[C@@H](CCO)CC(C)C)CC2)c(OC)c1	ZINC000875332465	GF	On-Demand	Clean	HTR1A	31	41
COc1ccc(N2CCN(C(=O)NC[C@@H](CCO)CC(C)C)CC2)c(OC)c1	ZINC000875332465	GF	On-Demand	Clean	DRD2	26	41
COc1ccc(N2CCN(C(=O)NC[C@@H](CCO)CC(C)C)CC2)c(OC)c1	ZINC000875332465	GF	On-Demand	Clean	DRD4	40	32
COc1ccc(N2CCN(C(=O)NC[C@@H](CCO)CC(C)C)CC2)c(OC)c1	ZINC000875332465	GF	On-Demand	Clean	HTR1B	16	41
COc1ccc(N2CCN(C(=O)NC[C@@H](CCO)CC(C)C)CC2)c(OC)c1	ZINC000875332465	GF	On-Demand	Clean	DRD3	43	39
COc1ccc(N2CCN(C(=O)NC[C@H](CCO)CC(C)C)CC2)c(OC)c1	ZINC000875332466	GF	On-Demand	Clean	HTR1A	31	41
COc1ccc(N2CCN(C(=O)NC[C@H](CCO)CC(C)C)CC2)c(OC)c1	ZINC000875332466	GF	On-Demand	Clean	DRD2	26	41
COc1ccc(N2CCN(C(=O)NC[C@H](CCO)CC(C)C)CC2)c(OC)c1	ZINC000875332466	GF	On-Demand	Clean	DRD4	40	32
COc1ccc(N2CCN(C(=O)NC[C@H](CCO)CC(C)C)CC2)c(OC)c1	ZINC000875332466	GF	On-Demand	Clean	HTR1B	16	41
COc1ccc(N2CCN(C(=O)NC[C@H](CCO)CC(C)C)CC2)c(OC)c1	ZINC000875332466	GF	On-Demand	Clean	DRD3	43	39
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccc(-c2ccncc2)cc1	ZINC000875332472	GE	On-Demand	Anodyne	PRKD1	22	41
CN(C(=O)Nc1nccs1)c1ccc2ccccc2c1	ZINC000875332507	CH	On-Demand	Anodyne	MAP1	122	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2ccc(-c3ccncc3)cc2)C1	ZINC000875332508	GH	On-Demand	Anodyne	ACACB	25	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2ccc(-c3ccncc3)cc2)C1	ZINC000875332510	GH	On-Demand	Anodyne	ACACB	25	42
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NC[C@@H](CCO)CC(C)C)CC2	ZINC000875332661	GG	On-Demand	Anodyne	SLC18A2	56	42
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NC[C@@H](CCO)CC(C)C)CC2	ZINC000875332662	GG	On-Demand	Anodyne	SLC18A2	56	42
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NC[C@H](CCO)CC(C)C)CC2	ZINC000875332663	GG	On-Demand	Anodyne	SLC18A2	56	42
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NC[C@H](CCO)CC(C)C)CC2	ZINC000875332664	GG	On-Demand	Anodyne	SLC18A2	56	42
C[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1ccc(-c2ccncc2)cc1	ZINC000875332692	GG	On-Demand	Anodyne	CACNA1H	23	43
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1ccc(-c2ccncc2)cc1	ZINC000875332908	FH	On-Demand	Anodyne	ACACA	24	40
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1ccc(-c2ccncc2)cc1	ZINC000875332908	FH	On-Demand	Anodyne	ACACB	24	40
Cc1nccnc1[C@H](C)NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875332935	GF	On-Demand	Anodyne	IL2RA	50	31
Cc1nccnc1[C@H](C)NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875332935	GF	On-Demand	Anodyne	GRIN2B	82	41
Cc1nccnc1[C@H](C)NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875332935	GF	On-Demand	Anodyne	CCR3	52	42
Cc1nccnc1[C@@H](C)NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875332936	GF	On-Demand	Anodyne	IL2RA	50	31
Cc1nccnc1[C@@H](C)NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875332936	GF	On-Demand	Anodyne	GRIN2B	82	41
Cc1nccnc1[C@@H](C)NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875332936	GF	On-Demand	Anodyne	CCR3	52	42
COC[C@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)c1ccc(C)o1	ZINC000875332945	GG	On-Demand	Anodyne	KCNA3	46	37
COC[C@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)c1ccc(C)o1	ZINC000875332945	GG	On-Demand	Anodyne	SOAT1	17	42
COC[C@@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)c1ccc(C)o1	ZINC000875332946	GG	On-Demand	Anodyne	KCNA3	46	37
COC[C@@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)c1ccc(C)o1	ZINC000875332946	GG	On-Demand	Anodyne	SOAT1	17	42
C#CC[C@@H](COC)NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875332947	FD	On-Demand	Mild	GRIN2B	59	39
C#CC[C@@H](COC)NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875332947	FD	On-Demand	Mild	CCR3	41	38
C#CC[C@H](COC)NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875332948	FD	On-Demand	Mild	GRIN2B	59	39
C#CC[C@H](COC)NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875332948	FD	On-Demand	Mild	CCR3	41	38
C[C@H](NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)[C@H]1CN(C)CCO1	ZINC000875332961	FC	On-Demand	Anodyne	OXTR	57	39
C[C@H](NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)[C@H]1CN(C)CCO1	ZINC000875332962	FC	On-Demand	Anodyne	OXTR	57	39
C[C@H](NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)[C@@H]1CN(C)CCO1	ZINC000875332963	FC	On-Demand	Anodyne	OXTR	57	39
C[C@H](NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)[C@@H]1CN(C)CCO1	ZINC000875332964	FC	On-Demand	Anodyne	OXTR	57	39
COCC1CC(NC(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)C1	ZINC000875333053	FE	On-Demand	Anodyne	GRIN2B	78	42
COCC1CC(NC(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)C1	ZINC000875333053	FE	On-Demand	Anodyne	SIGMAR1	25	41
COCC1CC(NC(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)C1	ZINC000875333053	FE	On-Demand	Anodyne	CCR3	60	41
COCC1CC(NC(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)C1	ZINC000875333053	FE	On-Demand	Anodyne	EPHX2	42	43
CONC(=O)C1CCN(C(=O)N[C@@H](CC(C)C)c2ccccc2OC)CC1	ZINC000875333064	GF	On-Demand	Anodyne	ABCC8	20	43
CONC(=O)C1CCN(C(=O)N[C@@H](CC(C)C)c2ccccc2OC)CC1	ZINC000875333064	GF	On-Demand	Anodyne	CCR5	15	41
CONC(=O)C1CCN(C(=O)N[C@H](CC(C)C)c2ccccc2OC)CC1	ZINC000875333065	GF	On-Demand	Anodyne	ABCC8	20	43
CONC(=O)C1CCN(C(=O)N[C@H](CC(C)C)c2ccccc2OC)CC1	ZINC000875333065	GF	On-Demand	Anodyne	CCR5	15	41
CC[C@@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)C1CCOCC1	ZINC000875333067	FG	On-Demand	Anodyne	KCNA3	48	38
CC[C@@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)C1CCOCC1	ZINC000875333067	FG	On-Demand	Anodyne	SOAT1	16	43
O=C(NCCCCNC(=O)Nc1cccc([N+](=O)[O-])c1)Nc1cccc([N+](=O)[O-])c1	ZINC000875333113	HG	On-Demand	Bother	CACNA1C	48	37
O=C(NCCCCNC(=O)Nc1cccc([N+](=O)[O-])c1)Nc1cccc([N+](=O)[O-])c1	ZINC000875333113	HG	On-Demand	Bother	PPIA	17	48
O=C(NCCCCNC(=O)Nc1cccc([N+](=O)[O-])c1)Nc1cccc([N+](=O)[O-])c1	ZINC000875333113	HG	On-Demand	Bother	TBXA2R	18	46
O=C(NCCCCNC(=O)Nc1cccc([N+](=O)[O-])c1)Nc1cccc([N+](=O)[O-])c1	ZINC000875333113	HG	On-Demand	Bother	CACNA1D	77	37
O=C(NCCCCNC(=O)Nc1cccc([N+](=O)[O-])c1)Nc1cccc([N+](=O)[O-])c1	ZINC000875333113	HG	On-Demand	Bother	CCR3	26	58
O=C(NCCCCNC(=O)Nc1cccc([N+](=O)[O-])c1)Nc1cccc([N+](=O)[O-])c1	ZINC000875333113	HG	On-Demand	Bother	EPHX2	16	47
O=C(NCCCCNC(=O)Nc1cccc([N+](=O)[O-])c1)Nc1cccc([N+](=O)[O-])c1	ZINC000875333113	HG	On-Demand	Bother	PRMT3	24	40
CC[C@H](C[C@H](C)O)NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875333277	GE	On-Demand	Anodyne	GRIN2B	69	42
CC[C@H](C[C@H](C)O)NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875333277	GE	On-Demand	Anodyne	ANPEP	26	49
CC[C@H](C[C@H](C)O)NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875333277	GE	On-Demand	Anodyne	RIR1_HHV11	53	43
CC[C@H](C[C@H](C)O)NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875333277	GE	On-Demand	Anodyne	CCR3	43	41
CC[C@H](C[C@H](C)O)NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875333277	GE	On-Demand	Anodyne	REN	42	38
CC[C@H](C[C@H](C)O)NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875333277	GE	On-Demand	Anodyne	CAPN1	62	38
CC[C@H](C[C@H](C)O)NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875333277	GE	On-Demand	Anodyne	CAPN2	106	38
CC[C@H](C[C@H](C)O)NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875333277	GE	On-Demand	Anodyne	GRIN2C	17	42
CC[C@H](C[C@H](C)O)NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875333277	GE	On-Demand	Anodyne	AMP1_PLAFQ	19	49
CN(C)[C@@H](CNC(=O)N1CCC(c2nnnn2C)CC1)c1ccc(Cl)cc1	ZINC000875333294	GE	On-Demand	Anodyne	IL2RA	50	34
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)NCc1ccnc(F)c1	ZINC000875333313	GF	On-Demand	Anodyne	GRIN2B	83	41
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)NCc1ccnc(F)c1	ZINC000875333313	GF	On-Demand	Anodyne	CCR3	60	49
CC[C@@H](NC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1)C1CCOCC1	ZINC000875333379	FG	On-Demand	Anodyne	EPHX2	22	42
O=C(NCCCNC(=O)Nc1cccc([N+](=O)[O-])c1)Nc1cccc([N+](=O)[O-])c1	ZINC000875333428	HF	On-Demand	Bother	CACNA1C	48	37
O=C(NCCCNC(=O)Nc1cccc([N+](=O)[O-])c1)Nc1cccc([N+](=O)[O-])c1	ZINC000875333428	HF	On-Demand	Bother	PPIA	15	48
O=C(NCCCNC(=O)Nc1cccc([N+](=O)[O-])c1)Nc1cccc([N+](=O)[O-])c1	ZINC000875333428	HF	On-Demand	Bother	TBXA2R	17	44
O=C(NCCCNC(=O)Nc1cccc([N+](=O)[O-])c1)Nc1cccc([N+](=O)[O-])c1	ZINC000875333428	HF	On-Demand	Bother	CACNA1D	77	37
O=C(NCCCNC(=O)Nc1cccc([N+](=O)[O-])c1)Nc1cccc([N+](=O)[O-])c1	ZINC000875333428	HF	On-Demand	Bother	CCR3	26	58
O=C(NCCCNC(=O)Nc1cccc([N+](=O)[O-])c1)Nc1cccc([N+](=O)[O-])c1	ZINC000875333428	HF	On-Demand	Bother	EPHX2	15	47
O=C(NCCCNC(=O)Nc1cccc([N+](=O)[O-])c1)Nc1cccc([N+](=O)[O-])c1	ZINC000875333428	HF	On-Demand	Bother	PRMT3	24	40
CONC(=O)C1CCN(C(=O)N[C@@H](C)c2ccc(-c3ccncc3)cc2)CC1	ZINC000875333486	GF	On-Demand	Anodyne	ACACA	21	41
CONC(=O)C1CCN(C(=O)N[C@@H](C)c2ccc(-c3ccncc3)cc2)CC1	ZINC000875333486	GF	On-Demand	Anodyne	ACACB	21	41
CONC(=O)C1CCN(C(=O)N[C@H](C)c2ccc(-c3ccncc3)cc2)CC1	ZINC000875333487	GF	On-Demand	Anodyne	ACACA	21	41
CONC(=O)C1CCN(C(=O)N[C@H](C)c2ccc(-c3ccncc3)cc2)CC1	ZINC000875333487	GF	On-Demand	Anodyne	ACACB	21	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(-c2ccncc2)cc1	ZINC000875333520	GH	On-Demand	Anodyne	SLC6A4	23	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(-c2ccncc2)cc1	ZINC000875333520	GH	On-Demand	Anodyne	SLC6A3	46	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(-c2ccncc2)cc1	ZINC000875333521	GH	On-Demand	Anodyne	SLC6A4	23	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(-c2ccncc2)cc1	ZINC000875333521	GH	On-Demand	Anodyne	SLC6A3	46	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(-c2ccncc2)cc1	ZINC000875333522	GH	On-Demand	Anodyne	SLC6A4	23	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(-c2ccncc2)cc1	ZINC000875333522	GH	On-Demand	Anodyne	SLC6A3	46	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(-c2ccncc2)cc1	ZINC000875333523	GH	On-Demand	Anodyne	SLC6A4	23	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(-c2ccncc2)cc1	ZINC000875333523	GH	On-Demand	Anodyne	SLC6A3	46	43
CONC(=O)C1CCN(C(=O)NC[C@@H](c2ccc(Cl)cc2)N(C)C)CC1	ZINC000875333536	GE	On-Demand	Anodyne	EPHX2	15	45
CONC(=O)C1CCN(C(=O)NC[C@H](c2ccc(Cl)cc2)N(C)C)CC1	ZINC000875333537	GE	On-Demand	Anodyne	EPHX2	15	45
COC(=O)C1(O)CN(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)C1	ZINC000875333566	GC	On-Demand	Anodyne	GRIN2B	78	42
COC(=O)C1(O)CN(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)C1	ZINC000875333566	GC	On-Demand	Anodyne	SIGMAR1	18	48
COC(=O)C1(O)CN(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)C1	ZINC000875333566	GC	On-Demand	Anodyne	CCR3	42	41
CN(C)[C@@H](CNC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(Cl)cc1	ZINC000875333573	FF	On-Demand	Anodyne	CCR1	44	36
CN(C)[C@@H](CNC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(Cl)cc1	ZINC000875333573	FF	On-Demand	Anodyne	UTS2	42	34
CN(C)[C@@H](CNC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(Cl)cc1	ZINC000875333574	FF	On-Demand	Anodyne	CCR1	44	36
CN(C)[C@@H](CNC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(Cl)cc1	ZINC000875333574	FF	On-Demand	Anodyne	UTS2	42	34
CC[C@@H](NC(=O)N1CCN(c2ccc(F)cc2C#N)CC1)C1CCOCC1	ZINC000875333609	FF	On-Demand	Mild	CTSS	23	46
COc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875333615	GE	On-Demand	Anodyne	ABCC8	20	41
O=C1OC[C@H]2CN(C(=O)NCC(=O)N3CCC(Cc4ccccc4)CC3)C[C@@H]12	ZINC000875333633	GD	On-Demand	Anodyne	GRIN2B	59	40
CC[C@H](C[C@H](C)O)NC(=O)NCC[C@@H](C)N(C)Cc1ccccc1	ZINC000875333688	EF	On-Demand	Anodyne	CAPN2	49	32
CC[C@H](C[C@H](C)O)NC(=O)NCC[C@@H](C)N(C)Cc1ccccc1	ZINC000875333688	EF	On-Demand	Anodyne	NPR	49	32
CC[C@H](C[C@H](C)O)NC(=O)NCC[C@H](C)N(C)Cc1ccccc1	ZINC000875333690	EF	On-Demand	Anodyne	CAPN2	49	32
CC[C@H](C[C@H](C)O)NC(=O)NCC[C@H](C)N(C)Cc1ccccc1	ZINC000875333690	EF	On-Demand	Anodyne	NPR	49	32
COC(=O)C1(O)CN(C(=O)N[C@@H](CC(C)C)c2ccccc2OC)C1	ZINC000875333703	FD	On-Demand	Anodyne	ABCC8	19	41
COC(=O)C1(O)CN(C(=O)N[C@H](CC(C)C)c2ccccc2OC)C1	ZINC000875333704	FD	On-Demand	Anodyne	ABCC8	19	41
C[C@@H](CCNC(=O)N1CCC(CO)(CO)CC1)c1cccc(C(F)(F)F)c1	ZINC000875333708	GF	On-Demand	Anodyne	CCR2	73	38
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1ccnc(C)n1	ZINC000875333768	CE	On-Demand	Anodyne	PPARD	45	44
CC(=O)N(C)c1ccc(CNC(=O)NC[C@@H](CCO)CC(C)C)cc1	ZINC000875333781	EF	On-Demand	Anodyne	ANPEP	15	40
CC(=O)N(C)c1ccc(CNC(=O)NC[C@H](CCO)CC(C)C)cc1	ZINC000875333782	EF	On-Demand	Anodyne	ANPEP	15	40
C[C@@H](CCNC(=O)N[C@@H]1CCOC[C@H]1O)c1cccc(C(F)(F)F)c1	ZINC000875333871	FF	On-Demand	Anodyne	CCR2	65	42
CC(=O)C1CCN(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)CC1	ZINC000875333897	GE	On-Demand	Anodyne	GRIN2B	88	48
CC(=O)C1CCN(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)CC1	ZINC000875333897	GE	On-Demand	Anodyne	SIGMAR1	22	46
CC(=O)C1CCN(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)CC1	ZINC000875333897	GE	On-Demand	Anodyne	CCR3	54	44
CC(=O)C1CCN(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)CC1	ZINC000875333897	GE	On-Demand	Anodyne	CCR5	17	48
CC(=O)C1CCN(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)CC1	ZINC000875333897	GE	On-Demand	Anodyne	GRIN2C	20	44
CC(=O)C1CCN(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)CC1	ZINC000875333897	GE	On-Demand	Anodyne	AMP1_PLAFQ	24	49
C[C@H](NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1)c1ccnn1C	ZINC000875333943	GE	On-Demand	Anodyne	IL2RA	54	34
C[C@H](NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1)c1ccnn1C	ZINC000875333943	GE	On-Demand	Anodyne	GRIN2B	78	40
C[C@H](NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1)c1ccnn1C	ZINC000875333943	GE	On-Demand	Anodyne	CCR3	55	42
C[C@@H](NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1)c1ccnn1C	ZINC000875333944	GE	On-Demand	Anodyne	IL2RA	54	34
C[C@@H](NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1)c1ccnn1C	ZINC000875333944	GE	On-Demand	Anodyne	GRIN2B	78	40
C[C@@H](NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1)c1ccnn1C	ZINC000875333944	GE	On-Demand	Anodyne	CCR3	55	42
COC[C@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccc(C)o1	ZINC000875333953	DE	On-Demand	Anodyne	REN	16	42
COC[C@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccc(C)o1	ZINC000875333954	DE	On-Demand	Anodyne	REN	16	42
COC[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccc(C)o1	ZINC000875333955	DE	On-Demand	Anodyne	REN	16	42
COC[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccc(C)o1	ZINC000875333956	DE	On-Demand	Anodyne	REN	16	42
COc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875333983	EH	On-Demand	Anodyne	ABCC8	22	47
COc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875333983	EH	On-Demand	Anodyne	CACNA1B	22	41
COc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875333983	EH	On-Demand	Anodyne	CCR5	19	43
COc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875333983	EH	On-Demand	Anodyne	Q9N6S8_PLAFA	21	41
COc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875333990	EH	On-Demand	Anodyne	ABCC8	22	47
COc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875333990	EH	On-Demand	Anodyne	CACNA1B	22	41
COc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875333990	EH	On-Demand	Anodyne	CCR5	19	43
COc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875333990	EH	On-Demand	Anodyne	Q9N6S8_PLAFA	21	41
COC[C@H](NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1)c1ccc(C)o1	ZINC000875334036	GH	On-Demand	Anodyne	SMO	40	44
COC[C@H](NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1)c1ccc(C)o1	ZINC000875334036	GH	On-Demand	Anodyne	ETHR	60	43
COC[C@@H](NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1)c1ccc(C)o1	ZINC000875334039	GH	On-Demand	Anodyne	SMO	40	44
COC[C@@H](NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1)c1ccc(C)o1	ZINC000875334039	GH	On-Demand	Anodyne	ETHR	60	43
Cc1cc(C(F)(F)F)nc(C(=O)Nc2ccnc(C)n2)n1	ZINC000875334108	CE	On-Demand	Anodyne	SORT1	30	47
CC[C@@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)C1CCOCC1	ZINC000875334215	FG	On-Demand	Mild	ITK	17	48
CC[C@@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)C1CCOCC1	ZINC000875334215	FG	On-Demand	Mild	PANC	57	38
COC[C@@H](NC(=O)NCc1ccc(O)c(Cl)c1)c1ccc(C)o1	ZINC000875334261	EG	On-Demand	Anodyne	NCE103	15	46
COC[C@H](NC(=O)NCc1ccc(O)c(Cl)c1)c1ccc(C)o1	ZINC000875334263	EG	On-Demand	Anodyne	NCE103	15	46
CCCCCCCNC(=O)C(=O)NCc1ccc(N2CCOC2=O)cc1	ZINC000875334283	FE	On-Demand	Mild	ASAH1	87	38
COc1ccccc1[C@H](CC(C)C)NC(=O)N1C[C@H]2C(=O)N(C)C(=O)[C@H]2C1	ZINC000875334291	FE	On-Demand	Anodyne	ABCC8	19	40
CC[C@@H](NC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)C1CCOCC1	ZINC000875334308	FE	On-Demand	Anodyne	ETHR	41	35
CC[C@@H](NC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)C1CCOCC1	ZINC000875334310	FE	On-Demand	Anodyne	ETHR	41	35
O=CN1CCCN(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)CC1	ZINC000875334313	GD	On-Demand	Anodyne	GRIN2B	72	46
O=CN1CCCN(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)CC1	ZINC000875334313	GD	On-Demand	Anodyne	SIGMAR1	16	40
O=CN1CCCN(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)CC1	ZINC000875334313	GD	On-Demand	Anodyne	CCR3	35	42
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)N[C@@H]1[C@H]2C[C@@H]3CO[C@H]1[C@H]3C2	ZINC000875334315	GE	On-Demand	Anodyne	GRIN2B	49	38
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)N[C@@H]1[C@H]2C[C@@H]3CO[C@@H]1[C@H]3C2	ZINC000875334317	GE	On-Demand	Anodyne	GRIN2B	49	38
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)N[C@@H]1[C@@H]2C[C@H]3[C@H](CO[C@H]31)C2	ZINC000875334320	GE	On-Demand	Anodyne	GRIN2B	49	38
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)N[C@@H]1[C@@H]2C[C@@H]3[C@@H]1OC[C@@H]3C2	ZINC000875334323	GE	On-Demand	Anodyne	GRIN2B	49	38
CN1CC[C@H]2CN(C(=O)NCC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@H]21	ZINC000875334357	GE	On-Demand	Anodyne	CHRM2	17	40
CN1CC[C@H]2CN(C(=O)NCC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@H]21	ZINC000875334357	GE	On-Demand	Anodyne	GRIN2B	73	42
CN1CC[C@H]2CN(C(=O)NCC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@H]21	ZINC000875334357	GE	On-Demand	Anodyne	SIGMAR1	15	41
CN1CC[C@H]2CN(C(=O)NCC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@H]21	ZINC000875334357	GE	On-Demand	Anodyne	CCR3	51	45
CN1CC[C@H]2CN(C(=O)NCC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@H]21	ZINC000875334357	GE	On-Demand	Anodyne	CCR5	19	40
CN1CC[C@H]2CN(C(=O)NCC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@H]21	ZINC000875334357	GE	On-Demand	Anodyne	AMP1_PLAFQ	17	47
CN1CC[C@H]2CN(C(=O)NCC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@@H]21	ZINC000875334360	GE	On-Demand	Anodyne	CHRM2	17	40
CN1CC[C@H]2CN(C(=O)NCC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@@H]21	ZINC000875334360	GE	On-Demand	Anodyne	GRIN2B	73	42
CN1CC[C@H]2CN(C(=O)NCC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@@H]21	ZINC000875334360	GE	On-Demand	Anodyne	SIGMAR1	15	41
CN1CC[C@H]2CN(C(=O)NCC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@@H]21	ZINC000875334360	GE	On-Demand	Anodyne	CCR3	51	45
CN1CC[C@H]2CN(C(=O)NCC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@@H]21	ZINC000875334360	GE	On-Demand	Anodyne	CCR5	19	40
CN1CC[C@H]2CN(C(=O)NCC(=O)N3CCC(Cc4ccccc4)CC3)CC[C@@H]21	ZINC000875334360	GE	On-Demand	Anodyne	AMP1_PLAFQ	17	47
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)N[C@@H]1C[C@H]1C1CCOCC1	ZINC000875334377	GF	On-Demand	Anodyne	GRIN2B	61	40
C[C@H](NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1)c1ccns1	ZINC000875334381	GF	On-Demand	Anodyne	GRIN2B	77	40
C[C@H](NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1)c1ccns1	ZINC000875334381	GF	On-Demand	Anodyne	CCR3	42	39
C[C@@H](NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1)c1ccns1	ZINC000875334382	GF	On-Demand	Anodyne	GRIN2B	77	40
C[C@@H](NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1)c1ccns1	ZINC000875334382	GF	On-Demand	Anodyne	CCR3	42	39
COc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC(c2nnnn2C)CC1	ZINC000875334402	GF	On-Demand	Anodyne	IL2RA	53	34
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCC(C(=O)NOC)CC1	ZINC000875334434	GG	On-Demand	Anodyne	ABCC8	20	43
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCC(C(=O)NOC)CC1	ZINC000875334434	GG	On-Demand	Anodyne	HCN1	46	31
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCC(C(=O)NOC)CC1	ZINC000875334434	GG	On-Demand	Anodyne	HCN4	40	31
CCOc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC(C(=O)NOC)CC1	ZINC000875334435	GG	On-Demand	Anodyne	ABCC8	20	43
CCOc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC(C(=O)NOC)CC1	ZINC000875334435	GG	On-Demand	Anodyne	HCN1	46	31
CCOc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC(C(=O)NOC)CC1	ZINC000875334435	GG	On-Demand	Anodyne	HCN4	40	31
COc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC(C(C)=O)CC1	ZINC000875334447	EH	On-Demand	Anodyne	ABCC8	21	45
COc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC(C(C)=O)CC1	ZINC000875334447	EH	On-Demand	Anodyne	CACNA1B	16	40
CC[C@@H](NC(=O)N1CC[C@@]2(CCc3ccccc32)C1)C1CCOCC1	ZINC000875334478	EG	On-Demand	Anodyne	OXTR	66	38
CC[C@@H](NC(=O)N1CC[C@@]2(CCc3ccccc32)C1)C1CCOCC1	ZINC000875334478	EG	On-Demand	Anodyne	GHRHR	48	41
CC[C@@H](NC(=O)N1CC[C@]2(CCc3ccccc32)C1)C1CCOCC1	ZINC000875334481	EG	On-Demand	Anodyne	OXTR	66	38
CC[C@@H](NC(=O)N1CC[C@]2(CCc3ccccc32)C1)C1CCOCC1	ZINC000875334481	EG	On-Demand	Anodyne	GHRHR	48	41
CC[C@@H](NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1)C1CCOCC1	ZINC000875334483	GG	On-Demand	Anodyne	SMO	36	41
CC[C@@H](NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1)C1CCOCC1	ZINC000875334483	GG	On-Demand	Anodyne	ETHR	54	47
CCOC1CC2(C1)C[C@@H]2NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875334487	GF	On-Demand	Anodyne	GRIN2B	67	39
CCOC1CC2(C1)C[C@@H]2NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875334487	GF	On-Demand	Anodyne	TIMP3	81	37
CCOC1CC2(C1)C[C@H]2NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875334488	GF	On-Demand	Anodyne	GRIN2B	67	39
CCOC1CC2(C1)C[C@H]2NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875334488	GF	On-Demand	Anodyne	TIMP3	81	37
CCOC(=O)[C@H](C)C1CN(C(=O)NCC[C@H](C)N(C)Cc2ccccc2)C1	ZINC000875334496	GF	On-Demand	Anodyne	Q6PRC7_IXORI	40	35
CCOC(=O)[C@H](C)C1CN(C(=O)NCC[C@@H](C)N(C)Cc2ccccc2)C1	ZINC000875334497	GF	On-Demand	Anodyne	Q6PRC7_IXORI	40	35
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875334570	GF	On-Demand	Anodyne	GHRHR	49	32
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875334570	GF	On-Demand	Anodyne	ABCC8	21	45
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875334570	GF	On-Demand	Anodyne	HCN1	57	36
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875334570	GF	On-Demand	Anodyne	HCN4	44	36
CCOc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875334571	GF	On-Demand	Anodyne	GHRHR	49	32
CCOc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875334571	GF	On-Demand	Anodyne	ABCC8	21	45
CCOc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875334571	GF	On-Demand	Anodyne	HCN1	57	36
CCOc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875334571	GF	On-Demand	Anodyne	HCN4	44	36
COc1ccccc1[C@H](CC(C)C)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875334609	EH	On-Demand	Anodyne	ABCC8	19	42
COc1ccccc1[C@H](CC(C)C)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875334610	EH	On-Demand	Anodyne	ABCC8	19	42
CC[C@@H](NC(=O)N1CCCN(C(=O)CC(C)C)CC1)C1CCOCC1	ZINC000875334614	FE	On-Demand	Anodyne	RIR1_HHV11	54	32
CCCCCCCNC(=O)C(=O)NCC1CN(S(C)(=O)=O)C1	ZINC000875334620	EC	On-Demand	Mild	ASAH1	79	36
COC(=O)N(C)NC(=O)NC[C@H](c1ccc(Cl)cc1)N(C)C	ZINC000875334624	ED	On-Demand	Reactive	UTS2	43	34
COC(=O)N(C)NC(=O)NC[C@@H](c1ccc(Cl)cc1)N(C)C	ZINC000875334625	ED	On-Demand	Reactive	UTS2	43	34
COc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875334638	FF	On-Demand	Anodyne	ABCC8	21	45
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875334641	EG	On-Demand	Anodyne	ABCC8	18	40
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875334641	EG	On-Demand	Anodyne	HCN1	46	31
CCOc1ccccc1[C@H](CC(C)C)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875334642	EG	On-Demand	Anodyne	ABCC8	18	40
CCOc1ccccc1[C@H](CC(C)C)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875334642	EG	On-Demand	Anodyne	HCN1	46	31
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCCN(C=O)CC1	ZINC000875334651	FG	On-Demand	Anodyne	ABCC8	21	44
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCCN(C=O)CC1	ZINC000875334651	FG	On-Demand	Anodyne	HCN1	49	34
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCCN(C=O)CC1	ZINC000875334651	FG	On-Demand	Anodyne	HCN4	41	34
CCOc1ccccc1[C@H](CC(C)C)NC(=O)N1CCCN(C=O)CC1	ZINC000875334652	FG	On-Demand	Anodyne	ABCC8	21	44
CCOc1ccccc1[C@H](CC(C)C)NC(=O)N1CCCN(C=O)CC1	ZINC000875334652	FG	On-Demand	Anodyne	HCN1	49	34
CCOc1ccccc1[C@H](CC(C)C)NC(=O)N1CCCN(C=O)CC1	ZINC000875334652	FG	On-Demand	Anodyne	HCN4	41	34
COc1ccccc1[C@H](CC(C)C)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875334654	DF	On-Demand	Anodyne	ANPEP	21	45
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2(Cc3ccc(F)cc3)CC2)C1	ZINC000875334656	FE	On-Demand	Anodyne	CCR3	40	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2(Cc3ccc(F)cc3)CC2)C1	ZINC000875334656	FE	On-Demand	Anodyne	HCN1	40	31
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2(Cc3ccc(F)cc3)CC2)C1	ZINC000875334656	FE	On-Demand	Anodyne	HCN4	40	31
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2(Cc3ccc(F)cc3)CC2)C1	ZINC000875334657	FE	On-Demand	Anodyne	CCR3	40	34
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2(Cc3ccc(F)cc3)CC2)C1	ZINC000875334657	FE	On-Demand	Anodyne	HCN1	40	31
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2(Cc3ccc(F)cc3)CC2)C1	ZINC000875334657	FE	On-Demand	Anodyne	HCN4	40	31
O=C(NCCNC(=O)Nc1ccc(Cl)cc1Cl)Nc1ccc(Cl)cc1Cl	ZINC000875334676	IK	On-Demand	Anodyne	CXCL8	21	40
O=C(NCCNC(=O)Nc1ccc(Cl)cc1Cl)Nc1ccc(Cl)cc1Cl	ZINC000875334676	IK	On-Demand	Anodyne	PYGL	20	51
O=C(NCCNC(=O)Nc1ccc(Cl)cc1Cl)Nc1ccc(Cl)cc1Cl	ZINC000875334676	IK	On-Demand	Anodyne	EPHX2	20	43
O=C(NCCNC(=O)Nc1ccc(Cl)cc1Cl)Nc1ccc(Cl)cc1Cl	ZINC000875334676	IK	On-Demand	Anodyne	ALPL	50	38
CN(C)[C@@H](CNC(=O)N1CCC2(CCNC2=O)CC1)c1ccc(Cl)cc1	ZINC000875334691	GE	On-Demand	Anodyne	CACNA1H	58	40
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875334705	FD	On-Demand	Anodyne	GRIN2B	84	45
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875334705	FD	On-Demand	Anodyne	SIGMAR1	17	45
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875334705	FD	On-Demand	Anodyne	CCR3	45	44
COc1ccccc1[C@H](CC(C)C)NC(=O)N1CCCN(C=O)CC1	ZINC000875334715	EF	On-Demand	Anodyne	ABCC8	21	44
CC(=O)[C@H]1CCCN(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)C1	ZINC000875334793	GE	On-Demand	Anodyne	ACE	46	38
CC(=O)[C@H]1CCCN(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)C1	ZINC000875334793	GE	On-Demand	Anodyne	GRIN2B	73	45
CC(=O)[C@H]1CCCN(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)C1	ZINC000875334793	GE	On-Demand	Anodyne	SIGMAR1	17	41
CC(=O)[C@H]1CCCN(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)C1	ZINC000875334793	GE	On-Demand	Anodyne	CCR3	51	44
CC(=O)[C@H]1CCCN(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)C1	ZINC000875334793	GE	On-Demand	Anodyne	CCR5	25	42
CC(=O)[C@H]1CCCN(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)C1	ZINC000875334793	GE	On-Demand	Anodyne	C3AR1	47	36
CC(=O)[C@H]1CCCN(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)C1	ZINC000875334793	GE	On-Demand	Anodyne	PREP	59	39
CC(=O)[C@H]1CCCN(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)C1	ZINC000875334793	GE	On-Demand	Anodyne	DPP7	47	37
CC(=O)[C@H]1CCCN(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)C1	ZINC000875334793	GE	On-Demand	Anodyne	GRIN2C	17	41
CC(=O)[C@@H]1CCCN(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)C1	ZINC000875334796	GE	On-Demand	Anodyne	ACE	46	38
CC(=O)[C@@H]1CCCN(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)C1	ZINC000875334796	GE	On-Demand	Anodyne	GRIN2B	73	45
CC(=O)[C@@H]1CCCN(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)C1	ZINC000875334796	GE	On-Demand	Anodyne	SIGMAR1	17	41
CC(=O)[C@@H]1CCCN(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)C1	ZINC000875334796	GE	On-Demand	Anodyne	CCR3	51	44
CC(=O)[C@@H]1CCCN(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)C1	ZINC000875334796	GE	On-Demand	Anodyne	CCR5	25	42
CC(=O)[C@@H]1CCCN(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)C1	ZINC000875334796	GE	On-Demand	Anodyne	C3AR1	47	36
CC(=O)[C@@H]1CCCN(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)C1	ZINC000875334796	GE	On-Demand	Anodyne	PREP	59	39
CC(=O)[C@@H]1CCCN(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)C1	ZINC000875334796	GE	On-Demand	Anodyne	DPP7	47	37
CC(=O)[C@@H]1CCCN(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)C1	ZINC000875334796	GE	On-Demand	Anodyne	GRIN2C	17	41
CN(C)[C@@H](CNC(=O)NNC(=O)c1ccc(=O)n(C)c1)c1ccc(Cl)cc1	ZINC000875334811	GD	On-Demand	Reactive	UL54	53	34
CN(C)[C@@H](CNC(=O)NNC(=O)c1ccc(=O)n(C)c1)c1ccc(Cl)cc1	ZINC000875334811	GD	On-Demand	Reactive	UTS2	46	37
CN(C)[C@@H](CNC(=O)N1CCC(CO)(CO)CC1)c1ccc(Cl)cc1	ZINC000875334836	FD	On-Demand	Anodyne	CACNA1H	43	35
CN(C)[C@@H](CNC(=O)N1CCC(CO)(CO)CC1)c1ccc(Cl)cc1	ZINC000875334836	FD	On-Demand	Anodyne	CCR1	41	36
COc1ccccc1[C@H](CC(C)C)NC(=O)N1CCN([S@](C)(=N)=O)CC1	ZINC000875334841	GF	On-Demand	Anodyne	ABCC8	20	44
COc1ccccc1[C@H](CC(C)C)NC(=O)N1CCN([S@@](C)(=N)=O)CC1	ZINC000875334843	GF	On-Demand	Anodyne	ABCC8	20	44
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](c1ccc(Cl)cc1)N(C)C	ZINC000875334870	EF	On-Demand	Anodyne	UTS2	42	33
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](c1ccc(Cl)cc1)N(C)C	ZINC000875334873	EF	On-Demand	Anodyne	UTS2	42	33
COC[C@H](NC(=O)NC[C@H](O)Cc1cccc(Cl)c1)c1ccc(C)o1	ZINC000875334887	FF	On-Demand	Anodyne	MAOB	24	42
COC[C@H](NC(=O)NC[C@@H](O)Cc1cccc(Cl)c1)c1ccc(C)o1	ZINC000875334888	FF	On-Demand	Anodyne	MAOB	24	42
COC[C@@H](NC(=O)NC[C@H](O)Cc1cccc(Cl)c1)c1ccc(C)o1	ZINC000875334889	FF	On-Demand	Anodyne	MAOB	24	42
COC[C@@H](NC(=O)NC[C@@H](O)Cc1cccc(Cl)c1)c1ccc(C)o1	ZINC000875334890	FF	On-Demand	Anodyne	MAOB	24	42
COC[C@@H](Cc1ccccc1)NC(=O)NC1(C)CC(F)(F)C1	ZINC000875334900	DF	On-Demand	Anodyne	MME	62	40
COC[C@@H](Cc1ccccc1)NC(=O)NC1(C)CC(F)(F)C1	ZINC000875334900	DF	On-Demand	Anodyne	CAPNS1	42	31
COC[C@@H](Cc1ccccc1)NC(=O)NC1(C)CC(F)(F)C1	ZINC000875334900	DF	On-Demand	Anodyne	CAPN2	45	31
COC[C@H](Cc1ccccc1)NC(=O)NC1(C)CC(F)(F)C1	ZINC000875334901	DF	On-Demand	Anodyne	MME	62	40
COC[C@H](Cc1ccccc1)NC(=O)NC1(C)CC(F)(F)C1	ZINC000875334901	DF	On-Demand	Anodyne	CAPNS1	42	31
COC[C@H](Cc1ccccc1)NC(=O)NC1(C)CC(F)(F)C1	ZINC000875334901	DF	On-Demand	Anodyne	CAPN2	45	31
CCCN(CC)CCNC(=O)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875334910	GG	On-Demand	Anodyne	ABL1	15	44
COC[C@@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)c1ccco1	ZINC000875334929	FF	On-Demand	Anodyne	KCNA3	46	38
COC[C@@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)c1ccco1	ZINC000875334929	FF	On-Demand	Anodyne	SOAT1	18	42
COC[C@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)c1ccco1	ZINC000875334930	FF	On-Demand	Anodyne	KCNA3	46	38
COC[C@H](NC(=O)NCC1(c2ccccc2)CCN(C)CC1)c1ccco1	ZINC000875334930	FF	On-Demand	Anodyne	SOAT1	18	42
COC[C@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875334934	ED	On-Demand	Anodyne	SLC6A4	30	47
COC[C@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875334934	ED	On-Demand	Anodyne	SLC6A3	67	47
COC[C@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875334934	ED	On-Demand	Anodyne	MME	46	37
COC[C@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875334934	ED	On-Demand	Anodyne	TIMP3	74	34
COC[C@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875334935	ED	On-Demand	Anodyne	SLC6A4	30	47
COC[C@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875334935	ED	On-Demand	Anodyne	SLC6A3	67	47
COC[C@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875334935	ED	On-Demand	Anodyne	MME	46	37
COC[C@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875334935	ED	On-Demand	Anodyne	TIMP3	74	34
COC[C@@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875334936	ED	On-Demand	Anodyne	SLC6A4	30	47
COC[C@@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875334936	ED	On-Demand	Anodyne	SLC6A3	67	47
COC[C@@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875334936	ED	On-Demand	Anodyne	MME	46	37
COC[C@@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875334936	ED	On-Demand	Anodyne	TIMP3	74	34
COC[C@@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875334937	ED	On-Demand	Anodyne	SLC6A4	30	47
COC[C@@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875334937	ED	On-Demand	Anodyne	SLC6A3	67	47
COC[C@@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875334937	ED	On-Demand	Anodyne	MME	46	37
COC[C@@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875334937	ED	On-Demand	Anodyne	TIMP3	74	34
N#C[C@@]1(C(=O)Nc2nc(-c3ccccc3C(F)(F)F)cs2)CCCOC1	ZINC000875334944	GI	On-Demand	Mild	MPL	50	37
N#C[C@]1(C(=O)Nc2nc(-c3ccccc3C(F)(F)F)cs2)CCCOC1	ZINC000875334945	GI	On-Demand	Mild	MPL	50	37
COC[C@@H](Cc1ccccc1)NC(=O)N(C)OCC(F)(F)F	ZINC000875334955	DE	On-Demand	Anodyne	MME	40	40
COC[C@H](Cc1ccccc1)NC(=O)N(C)OCC(F)(F)F	ZINC000875334956	DE	On-Demand	Anodyne	MME	40	40
COC[C@H](Cc1ccccc1)NC(=O)NNc1cccc(C)n1	ZINC000875334957	DE	On-Demand	Reactive	PAPA1_CARPA	47	35
COC[C@@H](Cc1ccccc1)NC(=O)NNc1cccc(C)n1	ZINC000875334958	DE	On-Demand	Reactive	PAPA1_CARPA	47	35
COC[C@@H](NC(=O)N[C@H](C)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccco1	ZINC000875334959	GG	On-Demand	Anodyne	GPR119	36	43
COC[C@@H](NC(=O)N[C@@H](C)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccco1	ZINC000875334960	GG	On-Demand	Anodyne	GPR119	36	43
COC[C@H](NC(=O)N[C@@H](C)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccco1	ZINC000875334961	GG	On-Demand	Anodyne	GPR119	36	43
COC[C@H](NC(=O)N[C@H](C)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccco1	ZINC000875334962	GG	On-Demand	Anodyne	GPR119	36	43
C[C@H](NC(=O)C(=O)N1CC[C@@H]2[C@@H](CCN2C)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875334969	GD	On-Demand	Anodyne	SIGMAR1	29	43
C[C@H](NC(=O)C(=O)N1CC[C@@H]2[C@H](CCN2C)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875334970	GD	On-Demand	Anodyne	SIGMAR1	29	43
C[C@H](NC(=O)C(=O)N1CC[C@@H]2[C@H](CCN2C)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875334971	GD	On-Demand	Anodyne	SIGMAR1	29	43
C[C@H](NC(=O)C(=O)N1CC[C@@H]2[C@@H](CCN2C)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875334972	GD	On-Demand	Anodyne	SIGMAR1	29	43
CC(=O)C1CCN(C(=O)NC[C@@H](c2ccc(Cl)cc2)N(C)C)CC1	ZINC000875335042	FF	On-Demand	Anodyne	CCR1	47	34
CC(=O)C1CCN(C(=O)NC[C@@H](c2ccc(Cl)cc2)N(C)C)CC1	ZINC000875335042	FF	On-Demand	Anodyne	UTS2	41	33
CC(=O)C1CCN(C(=O)NC[C@H](c2ccc(Cl)cc2)N(C)C)CC1	ZINC000875335044	FF	On-Demand	Anodyne	CCR1	47	34
CC(=O)C1CCN(C(=O)NC[C@H](c2ccc(Cl)cc2)N(C)C)CC1	ZINC000875335044	FF	On-Demand	Anodyne	UTS2	41	33
COc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875335087	FG	On-Demand	Anodyne	GHRHR	68	35
CC[C@@H](NC(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1C)C1CCOCC1	ZINC000875335111	GH	On-Demand	Anodyne	SLC18A2	48	34
CC[C@@H](NC(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1C)C1CCOCC1	ZINC000875335111	GH	On-Demand	Anodyne	MTNR1B	15	46
CC[C@@H](NC(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1C)C1CCOCC1	ZINC000875335125	GH	On-Demand	Anodyne	SLC18A2	48	34
CC[C@@H](NC(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1C)C1CCOCC1	ZINC000875335125	GH	On-Demand	Anodyne	MTNR1B	15	46
COC(=O)N(C)NC(=O)N[C@H](CC(C)C)c1ccccc1OC	ZINC000875335137	DF	On-Demand	Reactive	ABCC8	18	40
COC(=O)N(C)NC(=O)N[C@H](CC(C)C)c1ccccc1OC	ZINC000875335137	DF	On-Demand	Reactive	ANPEP	21	44
COC(=O)N(C)NC(=O)N[C@@H](CC(C)C)c1ccccc1OC	ZINC000875335138	DF	On-Demand	Reactive	ABCC8	18	40
COC(=O)N(C)NC(=O)N[C@@H](CC(C)C)c1ccccc1OC	ZINC000875335138	DF	On-Demand	Reactive	ANPEP	21	44
C[C@@H](CCNC(=O)N1CCCN(C=O)CC1)c1cccc(C(F)(F)F)c1	ZINC000875335140	FG	On-Demand	Anodyne	CCR2	48	37
COC[C@@H](Cc1ccccc1)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875335213	ED	On-Demand	Anodyne	ACE	18	41
COC[C@@H](Cc1ccccc1)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875335213	ED	On-Demand	Anodyne	DRD4	23	40
COC[C@@H](Cc1ccccc1)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875335213	ED	On-Demand	Anodyne	CHRM3	20	40
COC[C@@H](Cc1ccccc1)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875335213	ED	On-Demand	Anodyne	MME	24	41
COC[C@@H](Cc1ccccc1)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875335213	ED	On-Demand	Anodyne	BIRC2	40	39
COC[C@H](Cc1ccccc1)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875335214	ED	On-Demand	Anodyne	ACE	18	41
COC[C@H](Cc1ccccc1)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875335214	ED	On-Demand	Anodyne	DRD4	23	40
COC[C@H](Cc1ccccc1)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875335214	ED	On-Demand	Anodyne	CHRM3	20	40
COC[C@H](Cc1ccccc1)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875335214	ED	On-Demand	Anodyne	MME	24	41
COC[C@H](Cc1ccccc1)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875335214	ED	On-Demand	Anodyne	BIRC2	40	39
COCC(C)(C)CCNC(=O)C(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875335240	GE	On-Demand	Anodyne	DRD2	15	40
COCC(C)(C)CCNC(=O)C(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875335240	GE	On-Demand	Anodyne	DRD4	34	40
COCC(C)(C)CCNC(=O)C(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875335240	GE	On-Demand	Anodyne	ACHE	38	41
COCC(C)(C)CCNC(=O)C(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875335240	GE	On-Demand	Anodyne	SIGMAR1	32	45
COCC(C)(C)CCNC(=O)C(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875335241	GE	On-Demand	Anodyne	DRD2	15	40
COCC(C)(C)CCNC(=O)C(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875335241	GE	On-Demand	Anodyne	DRD4	34	40
COCC(C)(C)CCNC(=O)C(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875335241	GE	On-Demand	Anodyne	ACHE	38	41
COCC(C)(C)CCNC(=O)C(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875335241	GE	On-Demand	Anodyne	SIGMAR1	32	45
COCC(C)(C)CCNC(=O)C(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875335242	GE	On-Demand	Anodyne	DRD2	15	40
COCC(C)(C)CCNC(=O)C(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875335242	GE	On-Demand	Anodyne	DRD4	34	40
COCC(C)(C)CCNC(=O)C(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875335242	GE	On-Demand	Anodyne	ACHE	38	41
COCC(C)(C)CCNC(=O)C(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875335242	GE	On-Demand	Anodyne	SIGMAR1	32	45
COCC(C)(C)CCNC(=O)C(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875335243	GE	On-Demand	Anodyne	DRD2	15	40
COCC(C)(C)CCNC(=O)C(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875335243	GE	On-Demand	Anodyne	DRD4	34	40
COCC(C)(C)CCNC(=O)C(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875335243	GE	On-Demand	Anodyne	ACHE	38	41
COCC(C)(C)CCNC(=O)C(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875335243	GE	On-Demand	Anodyne	SIGMAR1	32	45
COC[C@H](NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1)c1ccc(C)o1	ZINC000875335294	GG	On-Demand	Anodyne	DRD4	15	42
COC[C@H](NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1)c1ccc(C)o1	ZINC000875335294	GG	On-Demand	Anodyne	CTSL	17	41
COC[C@@H](NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1)c1ccc(C)o1	ZINC000875335295	GG	On-Demand	Anodyne	DRD4	15	42
COC[C@@H](NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1)c1ccc(C)o1	ZINC000875335295	GG	On-Demand	Anodyne	CTSL	17	41
C[C@@H](CCNC(=O)N1CCCN(C=O)CC1)N(C)Cc1ccccc1	ZINC000875335384	ED	On-Demand	Anodyne	DPP7	40	37
C[C@@H](CCNC(=O)N1CCCN(C=O)CC1)N(C)Cc1ccccc1	ZINC000875335384	ED	On-Demand	Anodyne	Q6PRC7_IXORI	47	39
COC(=O)N(C)NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875335391	FD	On-Demand	Reactive	CHRM2	20	41
COC(=O)N(C)NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875335391	FD	On-Demand	Reactive	GRIN2B	83	43
COC(=O)N(C)NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875335391	FD	On-Demand	Reactive	SIGMAR1	19	44
COC(=O)N(C)NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875335391	FD	On-Demand	Reactive	CCR3	54	45
COC(=O)N(C)NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875335391	FD	On-Demand	Reactive	CCR5	25	41
O=C(NCCNC(=O)Nc1cccc([N+](=O)[O-])c1)Nc1cccc([N+](=O)[O-])c1	ZINC000875335415	GE	On-Demand	Bother	CACNA1C	53	36
O=C(NCCNC(=O)Nc1cccc([N+](=O)[O-])c1)Nc1cccc([N+](=O)[O-])c1	ZINC000875335415	GE	On-Demand	Bother	PPIA	26	50
O=C(NCCNC(=O)Nc1cccc([N+](=O)[O-])c1)Nc1cccc([N+](=O)[O-])c1	ZINC000875335415	GE	On-Demand	Bother	TBXA2R	16	40
O=C(NCCNC(=O)Nc1cccc([N+](=O)[O-])c1)Nc1cccc([N+](=O)[O-])c1	ZINC000875335415	GE	On-Demand	Bother	CACNA1D	84	36
O=C(NCCNC(=O)Nc1cccc([N+](=O)[O-])c1)Nc1cccc([N+](=O)[O-])c1	ZINC000875335415	GE	On-Demand	Bother	CCR3	21	54
O=C(NCCNC(=O)Nc1cccc([N+](=O)[O-])c1)Nc1cccc([N+](=O)[O-])c1	ZINC000875335415	GE	On-Demand	Bother	EPHX2	15	48
O=C(NCCNC(=O)Nc1cccc([N+](=O)[O-])c1)Nc1cccc([N+](=O)[O-])c1	ZINC000875335415	GE	On-Demand	Bother	PRMT3	25	42
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875335421	GG	On-Demand	Anodyne	GHRHR	76	34
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875335421	GG	On-Demand	Anodyne	ABCC8	19	40
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875335421	GG	On-Demand	Anodyne	HCN1	49	34
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875335421	GG	On-Demand	Anodyne	HCN4	41	33
CCOc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875335422	GG	On-Demand	Anodyne	GHRHR	76	34
CCOc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875335422	GG	On-Demand	Anodyne	ABCC8	19	40
CCOc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875335422	GG	On-Demand	Anodyne	HCN1	49	34
CCOc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875335422	GG	On-Demand	Anodyne	HCN4	41	33
C[C@@H](CCNC(=O)N[C@H]1CCN(CC(C)(C)O)C1)N(C)Cc1ccccc1	ZINC000875335434	GE	On-Demand	Anodyne	DRD4	22	40
C[C@@H](CCNC(=O)N[C@H]1CCN(CC(C)(C)O)C1)N(C)Cc1ccccc1	ZINC000875335434	GE	On-Demand	Anodyne	CCR5	21	41
C[C@H](CCNC(=O)N[C@H]1CCN(CC(C)(C)O)C1)N(C)Cc1ccccc1	ZINC000875335435	GE	On-Demand	Anodyne	DRD4	22	40
C[C@H](CCNC(=O)N[C@H]1CCN(CC(C)(C)O)C1)N(C)Cc1ccccc1	ZINC000875335435	GE	On-Demand	Anodyne	CCR5	21	41
CCOc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC(C(C)=O)CC1	ZINC000875335451	FI	On-Demand	Anodyne	ABCC8	21	45
CCOc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC(C(C)=O)CC1	ZINC000875335451	FI	On-Demand	Anodyne	HCN1	51	38
CCOc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC(C(C)=O)CC1	ZINC000875335451	FI	On-Demand	Anodyne	HCN4	43	36
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCC(C(C)=O)CC1	ZINC000875335452	FI	On-Demand	Anodyne	ABCC8	21	45
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCC(C(C)=O)CC1	ZINC000875335452	FI	On-Demand	Anodyne	HCN1	51	38
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCC(C(C)=O)CC1	ZINC000875335452	FI	On-Demand	Anodyne	HCN4	43	36
CC[C@@H](NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1)C1CCOCC1	ZINC000875335483	GG	On-Demand	Anodyne	DRD4	15	43
CC[C@@H](NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1)C1CCOCC1	ZINC000875335483	GG	On-Demand	Anodyne	EPHX2	15	42
CC[C@@H](NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1)C1CCOCC1	ZINC000875335483	GG	On-Demand	Anodyne	KCNK3	48	36
COc1ccccc1[C@H](CC(C)C)NC(=O)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875335485	GF	On-Demand	Anodyne	ABCC8	19	40
COc1ccccc1[C@H](CC(C)C)NC(=O)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875335486	GF	On-Demand	Anodyne	ABCC8	19	40
CN1CC[C@@H](C(=O)Oc2cc(Cl)ccc2F)[C@H](c2cnn(C)c2)C1	ZINC000875335519	FF	On-Demand	Anodyne	SLC6A3	20	44
CN1CC[C@@H](C(=O)Oc2cc(Cl)ccc2F)[C@@H](c2cnn(C)c2)C1	ZINC000875335521	FF	On-Demand	Anodyne	SLC6A3	20	44
COC[C@H](Cc1ccccc1)NC(=O)NC1CC(C(=O)OC)C1	ZINC000875335538	DD	On-Demand	Anodyne	ACE	31	46
COC[C@H](Cc1ccccc1)NC(=O)NC1CC(C(=O)OC)C1	ZINC000875335538	DD	On-Demand	Anodyne	MME	72	46
COC[C@H](Cc1ccccc1)NC(=O)NC1CC(C(=O)OC)C1	ZINC000875335538	DD	On-Demand	Anodyne	PAPA1_CARPA	45	37
COC[C@H](Cc1ccccc1)NC(=O)NC1CC(C(=O)OC)C1	ZINC000875335538	DD	On-Demand	Anodyne	CAPNS1	64	31
COC[C@H](Cc1ccccc1)NC(=O)NC1CC(C(=O)OC)C1	ZINC000875335538	DD	On-Demand	Anodyne	CAPN1	50	39
COC[C@H](Cc1ccccc1)NC(=O)NC1CC(C(=O)OC)C1	ZINC000875335538	DD	On-Demand	Anodyne	CAPN2	46	32
COC[C@@H](Cc1ccccc1)NC(=O)NC1CC(C(=O)OC)C1	ZINC000875335539	DD	On-Demand	Anodyne	ACE	31	46
COC[C@@H](Cc1ccccc1)NC(=O)NC1CC(C(=O)OC)C1	ZINC000875335539	DD	On-Demand	Anodyne	MME	72	46
COC[C@@H](Cc1ccccc1)NC(=O)NC1CC(C(=O)OC)C1	ZINC000875335539	DD	On-Demand	Anodyne	PAPA1_CARPA	45	37
COC[C@@H](Cc1ccccc1)NC(=O)NC1CC(C(=O)OC)C1	ZINC000875335539	DD	On-Demand	Anodyne	CAPNS1	64	31
COC[C@@H](Cc1ccccc1)NC(=O)NC1CC(C(=O)OC)C1	ZINC000875335539	DD	On-Demand	Anodyne	CAPN1	50	39
COC[C@@H](Cc1ccccc1)NC(=O)NC1CC(C(=O)OC)C1	ZINC000875335539	DD	On-Demand	Anodyne	CAPN2	46	32
COC[C@H](NC(=O)N1CCN(c2ccc(OC)cc2OC)CC1)c1ccco1	ZINC000875335544	GF	On-Demand	Clean	HTR1A	45	42
COC[C@H](NC(=O)N1CCN(c2ccc(OC)cc2OC)CC1)c1ccco1	ZINC000875335544	GF	On-Demand	Clean	DRD2	37	41
COC[C@H](NC(=O)N1CCN(c2ccc(OC)cc2OC)CC1)c1ccco1	ZINC000875335544	GF	On-Demand	Clean	DRD3	49	39
COC[C@H](NC(=O)N1CCN(c2ccc(OC)cc2OC)CC1)c1ccco1	ZINC000875335544	GF	On-Demand	Clean	PDGFRB	40	39
COC[C@@H](NC(=O)N1CCN(c2ccc(OC)cc2OC)CC1)c1ccco1	ZINC000875335545	GF	On-Demand	Clean	HTR1A	45	42
COC[C@@H](NC(=O)N1CCN(c2ccc(OC)cc2OC)CC1)c1ccco1	ZINC000875335545	GF	On-Demand	Clean	DRD2	37	41
COC[C@@H](NC(=O)N1CCN(c2ccc(OC)cc2OC)CC1)c1ccco1	ZINC000875335545	GF	On-Demand	Clean	DRD3	49	39
COC[C@@H](NC(=O)N1CCN(c2ccc(OC)cc2OC)CC1)c1ccco1	ZINC000875335545	GF	On-Demand	Clean	PDGFRB	40	39
COc1ccccc1[C@H](CC(C)C)NC(=O)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875335587	GF	On-Demand	Anodyne	ABCC8	19	40
COc1ccccc1[C@H](CC(C)C)NC(=O)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875335588	GF	On-Demand	Anodyne	ABCC8	19	40
CCOc1ccccc1[C@H](CC(C)C)NC(=O)N1C[C@H]2C(=O)N(C)C(=O)[C@H]2C1	ZINC000875335592	GE	On-Demand	Anodyne	ABCC8	19	42
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)N1C[C@H]2C(=O)N(C)C(=O)[C@H]2C1	ZINC000875335593	GE	On-Demand	Anodyne	ABCC8	19	42
CN(C)[C@@H](CNC(=O)N1CCC(C(=O)NCCO)CC1)c1ccc(Cl)cc1	ZINC000875335661	GD	On-Demand	Anodyne	EPHX2	17	47
COC[C@H](Cc1ccccc1)NC(=O)NC(C)(C)[C@H]1CCCCO1	ZINC000875335737	EF	On-Demand	Anodyne	AMY2	46	31
COC[C@@H](Cc1ccccc1)NC(=O)NC(C)(C)[C@H]1CCCCO1	ZINC000875335738	EF	On-Demand	Anodyne	AMY2	46	31
COC[C@H](Cc1ccccc1)NC(=O)NC(C)(C)[C@@H]1CCCCO1	ZINC000875335739	EF	On-Demand	Anodyne	AMY2	46	31
COC[C@@H](Cc1ccccc1)NC(=O)NC(C)(C)[C@@H]1CCCCO1	ZINC000875335740	EF	On-Demand	Anodyne	AMY2	46	31
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](COC)Cc2ccccc2)C1	ZINC000875335769	EE	On-Demand	Anodyne	ACE	47	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](COC)Cc2ccccc2)C1	ZINC000875335769	EE	On-Demand	Anodyne	MME	59	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](COC)Cc2ccccc2)C1	ZINC000875335769	EE	On-Demand	Anodyne	TIMP3	47	33
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](COC)Cc2ccccc2)C1	ZINC000875335769	EE	On-Demand	Anodyne	CAPNS1	64	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](COC)Cc2ccccc2)C1	ZINC000875335769	EE	On-Demand	Anodyne	REN	42	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](COC)Cc2ccccc2)C1	ZINC000875335769	EE	On-Demand	Anodyne	CAPN1	45	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](COC)Cc2ccccc2)C1	ZINC000875335769	EE	On-Demand	Anodyne	ACE2	40	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](COC)Cc2ccccc2)C1	ZINC000875335769	EE	On-Demand	Anodyne	CTRB_BOVIN	47	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](COC)Cc2ccccc2)C1	ZINC000875335770	EE	On-Demand	Anodyne	ACE	47	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](COC)Cc2ccccc2)C1	ZINC000875335770	EE	On-Demand	Anodyne	MME	59	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](COC)Cc2ccccc2)C1	ZINC000875335770	EE	On-Demand	Anodyne	TIMP3	47	33
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](COC)Cc2ccccc2)C1	ZINC000875335770	EE	On-Demand	Anodyne	CAPNS1	64	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](COC)Cc2ccccc2)C1	ZINC000875335770	EE	On-Demand	Anodyne	REN	42	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](COC)Cc2ccccc2)C1	ZINC000875335770	EE	On-Demand	Anodyne	CAPN1	45	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](COC)Cc2ccccc2)C1	ZINC000875335770	EE	On-Demand	Anodyne	ACE2	40	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](COC)Cc2ccccc2)C1	ZINC000875335770	EE	On-Demand	Anodyne	CTRB_BOVIN	47	35
COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1C(=O)c1sccc1CC#N	ZINC000875335792	GG	On-Demand	Mild	LGMN	72	38
COc1ccc(C)cc1NC(=O)[C@H]1CCCN1C(=O)c1sccc1CC#N	ZINC000875335793	GG	On-Demand	Mild	LGMN	72	38
COC[C@@H](Cc1ccccc1)NC(=O)N[C@H](C)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875335801	GF	On-Demand	Anodyne	REN	52	36
COC[C@@H](Cc1ccccc1)NC(=O)N[C@H](C)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875335801	GF	On-Demand	Anodyne	FPR1	52	37
COC[C@@H](Cc1ccccc1)NC(=O)N[C@@H](C)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875335802	GF	On-Demand	Anodyne	REN	52	36
COC[C@@H](Cc1ccccc1)NC(=O)N[C@@H](C)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875335802	GF	On-Demand	Anodyne	FPR1	52	37
COC[C@H](Cc1ccccc1)NC(=O)N[C@H](C)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875335803	GF	On-Demand	Anodyne	REN	52	36
COC[C@H](Cc1ccccc1)NC(=O)N[C@H](C)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875335803	GF	On-Demand	Anodyne	FPR1	52	37
COC[C@H](Cc1ccccc1)NC(=O)N[C@@H](C)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875335804	GF	On-Demand	Anodyne	REN	52	36
COC[C@H](Cc1ccccc1)NC(=O)N[C@@H](C)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875335804	GF	On-Demand	Anodyne	FPR1	52	37
C[C@H](NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875335805	GD	On-Demand	Anodyne	SIGMAR1	33	45
C[C@H](NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875335805	GD	On-Demand	Anodyne	MLNR	40	33
C[C@H](NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875335805	GD	On-Demand	Anodyne	CYP2J2	46	34
C[C@H](NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875335805	GD	On-Demand	Anodyne	BIRC2	23	40
C[C@H](NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875335806	GD	On-Demand	Anodyne	SIGMAR1	33	45
C[C@H](NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875335806	GD	On-Demand	Anodyne	MLNR	40	33
C[C@H](NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875335806	GD	On-Demand	Anodyne	CYP2J2	46	34
C[C@H](NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875335806	GD	On-Demand	Anodyne	BIRC2	23	40
C[C@H](NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875335807	GD	On-Demand	Anodyne	SIGMAR1	33	45
C[C@H](NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875335807	GD	On-Demand	Anodyne	MLNR	40	33
C[C@H](NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875335807	GD	On-Demand	Anodyne	CYP2J2	46	34
C[C@H](NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875335807	GD	On-Demand	Anodyne	BIRC2	23	40
C[C@H](NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875335808	GD	On-Demand	Anodyne	SIGMAR1	33	45
C[C@H](NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875335808	GD	On-Demand	Anodyne	MLNR	40	33
C[C@H](NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875335808	GD	On-Demand	Anodyne	CYP2J2	46	34
C[C@H](NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875335808	GD	On-Demand	Anodyne	BIRC2	23	40
COC[C@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccco1	ZINC000875335828	FD	On-Demand	Anodyne	L3MBTL3	46	38
COC[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccco1	ZINC000875335829	FD	On-Demand	Anodyne	L3MBTL3	46	38
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875335836	FG	On-Demand	Anodyne	ACE	43	37
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875335836	FG	On-Demand	Anodyne	MME	41	39
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875335836	FG	On-Demand	Anodyne	TIMP3	47	34
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875335836	FG	On-Demand	Anodyne	REN	42	40
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875335836	FG	On-Demand	Anodyne	Q9N6S8_PLAFA	17	40
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875335836	FG	On-Demand	Anodyne	BRCA1	51	32
C#CC[C@@H](CCOC)NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875335886	GE	On-Demand	Mild	GRIN2B	56	40
C#CC[C@@H](CCOC)NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875335886	GE	On-Demand	Mild	CCR3	40	39
C#CC[C@H](CCOC)NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875335887	GE	On-Demand	Mild	GRIN2B	56	40
C#CC[C@H](CCOC)NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000875335887	GE	On-Demand	Mild	CCR3	40	39
CN1CC[C@@H](C(=O)OCc2ccc(Cl)nc2)[C@H](c2cnn(C)c2)C1	ZINC000875335916	EE	On-Demand	Anodyne	SLC6A3	16	41
CN1CC[C@@H](C(=O)OCc2ccc(Cl)nc2)[C@@H](c2cnn(C)c2)C1	ZINC000875335918	EE	On-Demand	Anodyne	SLC6A3	16	41
COC[C@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccc(C)o1	ZINC000875335945	FD	On-Demand	Anodyne	L3MBTL3	44	38
COC[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1ccc(C)o1	ZINC000875335946	FD	On-Demand	Anodyne	L3MBTL3	44	38
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875335956	FG	On-Demand	Anodyne	ACE	43	37
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875335956	FG	On-Demand	Anodyne	MME	41	39
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875335956	FG	On-Demand	Anodyne	TIMP3	47	34
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875335956	FG	On-Demand	Anodyne	REN	42	40
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875335956	FG	On-Demand	Anodyne	Q9N6S8_PLAFA	17	40
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875335956	FG	On-Demand	Anodyne	BRCA1	51	32
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875335957	FG	On-Demand	Anodyne	ACE	43	37
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875335957	FG	On-Demand	Anodyne	MME	41	39
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875335957	FG	On-Demand	Anodyne	TIMP3	47	34
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875335957	FG	On-Demand	Anodyne	REN	42	40
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875335957	FG	On-Demand	Anodyne	Q9N6S8_PLAFA	17	40
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875335957	FG	On-Demand	Anodyne	BRCA1	51	32
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875335958	FG	On-Demand	Anodyne	ACE	43	37
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875335958	FG	On-Demand	Anodyne	MME	41	39
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875335958	FG	On-Demand	Anodyne	TIMP3	47	34
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875335958	FG	On-Demand	Anodyne	REN	42	40
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875335958	FG	On-Demand	Anodyne	Q9N6S8_PLAFA	17	40
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875335958	FG	On-Demand	Anodyne	BRCA1	51	32
COC[C@H](Cc1ccccc1)NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875336012	FC	On-Demand	Anodyne	CAPN1	26	42
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875336013	FC	On-Demand	Anodyne	CAPN1	26	42
COC[C@H](Cc1ccccc1)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875336018	CD	On-Demand	Anodyne	MME	56	42
COC[C@H](Cc1ccccc1)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875336018	CD	On-Demand	Anodyne	TIMP3	46	32
COC[C@@H](Cc1ccccc1)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875336019	CD	On-Demand	Anodyne	MME	56	42
COC[C@@H](Cc1ccccc1)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875336019	CD	On-Demand	Anodyne	TIMP3	46	32
COC[C@@H](NC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C)c1ccco1	ZINC000875336036	GF	On-Demand	Anodyne	GPR119	17	42
COC[C@H](NC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C)c1ccco1	ZINC000875336037	GF	On-Demand	Anodyne	GPR119	17	42
COC[C@H](NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)[C@@H]1CCCO1	ZINC000875336062	FD	On-Demand	Anodyne	OXTR	48	35
COC[C@H](NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)[C@@H]1CCCO1	ZINC000875336062	FD	On-Demand	Anodyne	GHRHR	27	40
COC[C@H](NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)[C@H]1CCCO1	ZINC000875336063	FD	On-Demand	Anodyne	OXTR	48	35
COC[C@H](NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)[C@H]1CCCO1	ZINC000875336063	FD	On-Demand	Anodyne	GHRHR	27	40
COC[C@H](NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)[C@H]1CCCO1	ZINC000875336064	FD	On-Demand	Anodyne	OXTR	48	35
COC[C@H](NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)[C@H]1CCCO1	ZINC000875336064	FD	On-Demand	Anodyne	GHRHR	27	40
COC[C@H](NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)[C@@H]1CCCO1	ZINC000875336065	FD	On-Demand	Anodyne	OXTR	48	35
COC[C@H](NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)[C@@H]1CCCO1	ZINC000875336065	FD	On-Demand	Anodyne	GHRHR	27	40
COC[C@H](Cc1ccccc1)NC(=O)N[C@@H]1C[C@H]2C[C@@]2(C(=O)OC)C1	ZINC000875336082	ED	On-Demand	Anodyne	MME	23	41
COC[C@@H](Cc1ccccc1)NC(=O)N[C@@H]1C[C@H]2C[C@@]2(C(=O)OC)C1	ZINC000875336083	ED	On-Demand	Anodyne	MME	23	41
COC[C@@H](Cc1ccccc1)NC(=O)NCC[C@H](O)C1CCCC1	ZINC000875336088	EE	On-Demand	Anodyne	MME	56	40
COC[C@@H](Cc1ccccc1)NC(=O)NCC[C@H](O)C1CCCC1	ZINC000875336088	EE	On-Demand	Anodyne	REN	74	38
COC[C@@H](Cc1ccccc1)NC(=O)NCC[C@@H](O)C1CCCC1	ZINC000875336089	EE	On-Demand	Anodyne	MME	56	40
COC[C@@H](Cc1ccccc1)NC(=O)NCC[C@@H](O)C1CCCC1	ZINC000875336089	EE	On-Demand	Anodyne	REN	74	38
COC[C@H](Cc1ccccc1)NC(=O)NCC[C@H](O)C1CCCC1	ZINC000875336090	EE	On-Demand	Anodyne	MME	56	40
COC[C@H](Cc1ccccc1)NC(=O)NCC[C@H](O)C1CCCC1	ZINC000875336090	EE	On-Demand	Anodyne	REN	74	38
COC[C@H](Cc1ccccc1)NC(=O)NCC[C@@H](O)C1CCCC1	ZINC000875336091	EE	On-Demand	Anodyne	MME	56	40
COC[C@H](Cc1ccccc1)NC(=O)NCC[C@@H](O)C1CCCC1	ZINC000875336091	EE	On-Demand	Anodyne	REN	74	38
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](COC)Cc1ccccc1	ZINC000875336104	DE	On-Demand	Anodyne	ACE	33	42
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](COC)Cc1ccccc1	ZINC000875336104	DE	On-Demand	Anodyne	MME	109	45
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](COC)Cc1ccccc1	ZINC000875336104	DE	On-Demand	Anodyne	ANPEP	71	38
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](COC)Cc1ccccc1	ZINC000875336104	DE	On-Demand	Anodyne	FCER2	41	35
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](COC)Cc1ccccc1	ZINC000875336104	DE	On-Demand	Anodyne	CTSB	48	37
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](COC)Cc1ccccc1	ZINC000875336104	DE	On-Demand	Anodyne	PAPA1_CARPA	73	39
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](COC)Cc1ccccc1	ZINC000875336104	DE	On-Demand	Anodyne	CPA1	30	42
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](COC)Cc1ccccc1	ZINC000875336104	DE	On-Demand	Anodyne	NAALAD2	24	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](COC)Cc1ccccc1	ZINC000875336104	DE	On-Demand	Anodyne	CAPNS1	61	34
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](COC)Cc1ccccc1	ZINC000875336104	DE	On-Demand	Anodyne	CAPN1	82	37
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](COC)Cc1ccccc1	ZINC000875336104	DE	On-Demand	Anodyne	CAPN2	98	36
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](COC)Cc1ccccc1	ZINC000875336104	DE	On-Demand	Anodyne	ACE2	58	42
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](COC)Cc1ccccc1	ZINC000875336104	DE	On-Demand	Anodyne	FPR1	64	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](COC)Cc1ccccc1	ZINC000875336104	DE	On-Demand	Anodyne	NPR	43	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](COC)Cc1ccccc1	ZINC000875336104	DE	On-Demand	Anodyne	PDS	44	34
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](COC)Cc1ccccc1	ZINC000875336105	DE	On-Demand	Anodyne	ACE	33	42
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](COC)Cc1ccccc1	ZINC000875336105	DE	On-Demand	Anodyne	MME	109	45
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](COC)Cc1ccccc1	ZINC000875336105	DE	On-Demand	Anodyne	ANPEP	71	38
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](COC)Cc1ccccc1	ZINC000875336105	DE	On-Demand	Anodyne	FCER2	41	35
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](COC)Cc1ccccc1	ZINC000875336105	DE	On-Demand	Anodyne	CTSB	48	37
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](COC)Cc1ccccc1	ZINC000875336105	DE	On-Demand	Anodyne	PAPA1_CARPA	73	39
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](COC)Cc1ccccc1	ZINC000875336105	DE	On-Demand	Anodyne	CPA1	30	42
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](COC)Cc1ccccc1	ZINC000875336105	DE	On-Demand	Anodyne	NAALAD2	24	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](COC)Cc1ccccc1	ZINC000875336105	DE	On-Demand	Anodyne	CAPNS1	61	34
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](COC)Cc1ccccc1	ZINC000875336105	DE	On-Demand	Anodyne	CAPN1	82	37
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](COC)Cc1ccccc1	ZINC000875336105	DE	On-Demand	Anodyne	CAPN2	98	36
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](COC)Cc1ccccc1	ZINC000875336105	DE	On-Demand	Anodyne	ACE2	58	42
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](COC)Cc1ccccc1	ZINC000875336105	DE	On-Demand	Anodyne	FPR1	64	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](COC)Cc1ccccc1	ZINC000875336105	DE	On-Demand	Anodyne	NPR	43	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](COC)Cc1ccccc1	ZINC000875336105	DE	On-Demand	Anodyne	PDS	44	34
COC[C@H](Cc1ccccc1)NC(=O)N1CCN(C)C(C)(C)CC1	ZINC000875336106	EE	On-Demand	Anodyne	GHRHR	47	32
COC[C@H](Cc1ccccc1)NC(=O)N1CCN(C)C(C)(C)CC1	ZINC000875336106	EE	On-Demand	Anodyne	TIMP3	47	34
COC[C@@H](Cc1ccccc1)NC(=O)N1CCN(C)C(C)(C)CC1	ZINC000875336107	EE	On-Demand	Anodyne	GHRHR	47	32
COC[C@@H](Cc1ccccc1)NC(=O)N1CCN(C)C(C)(C)CC1	ZINC000875336107	EE	On-Demand	Anodyne	TIMP3	47	34
C[C@H](NC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875336110	GE	On-Demand	Anodyne	SIGMAR1	37	46
C[C@H](NC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875336110	GE	On-Demand	Anodyne	BIRC2	24	41
C[C@H](NC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875336113	GE	On-Demand	Anodyne	SIGMAR1	37	46
C[C@H](NC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875336113	GE	On-Demand	Anodyne	BIRC2	24	41
COC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccco1	ZINC000875336150	DD	On-Demand	Anodyne	SLC6A4	25	42
COC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccco1	ZINC000875336150	DD	On-Demand	Anodyne	SLC6A3	48	42
COC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccco1	ZINC000875336151	DD	On-Demand	Anodyne	SLC6A4	25	42
COC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccco1	ZINC000875336151	DD	On-Demand	Anodyne	SLC6A3	48	42
COC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccco1	ZINC000875336152	DD	On-Demand	Anodyne	SLC6A4	25	42
COC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccco1	ZINC000875336152	DD	On-Demand	Anodyne	SLC6A3	48	42
COC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccco1	ZINC000875336153	DD	On-Demand	Anodyne	SLC6A4	25	42
COC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccco1	ZINC000875336153	DD	On-Demand	Anodyne	SLC6A3	48	42
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(-n3cccn3)nc2)ccc1Cl	ZINC000875336154	HC	On-Demand	Reactive	CA2	15	47
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(-n3cccn3)nc2)ccc1Cl	ZINC000875336154	HC	On-Demand	Reactive	CA6	21	47
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(-n3cccn3)nc2)ccc1Cl	ZINC000875336154	HC	On-Demand	Reactive	CA1	15	47
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(-n3cccn3)nc2)ccc1Cl	ZINC000875336154	HC	On-Demand	Reactive	CA7	21	47
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(-n3cccn3)nc2)ccc1Cl	ZINC000875336154	HC	On-Demand	Reactive	CA13	40	47
NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(-n3cccn3)nc2)ccc1Cl	ZINC000875336154	HC	On-Demand	Reactive	CA4	15	47
COC(=O)c1ccc(C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cn1	ZINC000875336178	FD	On-Demand	Reactive	BRS3	23	40
COC(=O)c1ccc(C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cn1	ZINC000875336178	FD	On-Demand	Reactive	GRPR	43	31
COC(=O)c1ccc(C(=O)NNC(=O)Cc2c[nH]c3ccccc23)cn1	ZINC000875336178	FD	On-Demand	Reactive	MMP11	43	31
CSc1ccc(C)c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1	ZINC000875336185	HE	On-Demand	Reactive	CA2	23	54
CSc1ccc(C)c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1	ZINC000875336185	HE	On-Demand	Reactive	CA6	21	45
CSc1ccc(C)c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1	ZINC000875336185	HE	On-Demand	Reactive	CA1	22	49
CSc1ccc(C)c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1	ZINC000875336185	HE	On-Demand	Reactive	CA7	24	45
CSc1ccc(C)c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1	ZINC000875336185	HE	On-Demand	Reactive	CA13	41	45
CSc1ccc(C)c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1	ZINC000875336185	HE	On-Demand	Reactive	CA4	23	49
COC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccc(C)o1	ZINC000875336191	EE	On-Demand	Anodyne	SLC6A3	42	37
COC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccc(C)o1	ZINC000875336192	EE	On-Demand	Anodyne	SLC6A3	42	37
COC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccc(C)o1	ZINC000875336193	EE	On-Demand	Anodyne	SLC6A3	42	37
COC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccc(C)o1	ZINC000875336194	EE	On-Demand	Anodyne	SLC6A3	42	37
COC[C@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875336210	GG	On-Demand	Anodyne	OPRL1	19	44
COC[C@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875336210	GG	On-Demand	Anodyne	TIMP3	69	34
COC[C@@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875336211	GG	On-Demand	Anodyne	OPRL1	19	44
COC[C@@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875336211	GG	On-Demand	Anodyne	TIMP3	69	34
COC[C@H](NC(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1C)c1ccco1	ZINC000875336251	FG	On-Demand	Anodyne	SLC18A2	47	35
COC[C@H](NC(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1C)c1ccco1	ZINC000875336252	FG	On-Demand	Anodyne	SLC18A2	47	35
COC[C@@H](NC(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1C)c1ccco1	ZINC000875336253	FG	On-Demand	Anodyne	SLC18A2	47	35
COC[C@@H](NC(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1C)c1ccco1	ZINC000875336254	FG	On-Demand	Anodyne	SLC18A2	47	35
COC[C@H](Cc1ccccc1)NC(=O)N(C)CCN1CC2(CCOCC2)C1	ZINC000875336257	GD	On-Demand	Anodyne	PSMB8	42	35
COC[C@@H](Cc1ccccc1)NC(=O)N(C)CCN1CC2(CCOCC2)C1	ZINC000875336258	GD	On-Demand	Anodyne	PSMB8	42	35
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@H](CCC(=O)OC)C1	ZINC000875336265	FF	On-Demand	Anodyne	PREP	24	42
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@H](CCC(=O)OC)C1	ZINC000875336265	FF	On-Demand	Anodyne	REN	59	45
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@H](CCC(=O)OC)C1	ZINC000875336266	FF	On-Demand	Anodyne	PREP	24	42
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@H](CCC(=O)OC)C1	ZINC000875336266	FF	On-Demand	Anodyne	REN	59	45
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](CCC(=O)OC)C1	ZINC000875336267	FF	On-Demand	Anodyne	PREP	24	42
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](CCC(=O)OC)C1	ZINC000875336267	FF	On-Demand	Anodyne	REN	59	45
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](CCC(=O)OC)C1	ZINC000875336268	FF	On-Demand	Anodyne	PREP	24	42
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](CCC(=O)OC)C1	ZINC000875336268	FF	On-Demand	Anodyne	REN	59	45
COC[C@H](Cc1ccccc1)NC(=O)N1CCCN(C=O)CC1	ZINC000875336285	DD	On-Demand	Anodyne	ACE	19	41
COC[C@H](Cc1ccccc1)NC(=O)N1CCCN(C=O)CC1	ZINC000875336285	DD	On-Demand	Anodyne	MME	40	41
COC[C@H](Cc1ccccc1)NC(=O)N1CCCN(C=O)CC1	ZINC000875336285	DD	On-Demand	Anodyne	CAPN1	55	36
COC[C@H](Cc1ccccc1)NC(=O)N1CCCN(C=O)CC1	ZINC000875336285	DD	On-Demand	Anodyne	CAPN2	47	34
COC[C@@H](Cc1ccccc1)NC(=O)N1CCCN(C=O)CC1	ZINC000875336286	DD	On-Demand	Anodyne	ACE	19	41
COC[C@@H](Cc1ccccc1)NC(=O)N1CCCN(C=O)CC1	ZINC000875336286	DD	On-Demand	Anodyne	MME	40	41
COC[C@@H](Cc1ccccc1)NC(=O)N1CCCN(C=O)CC1	ZINC000875336286	DD	On-Demand	Anodyne	CAPN1	55	36
COC[C@@H](Cc1ccccc1)NC(=O)N1CCCN(C=O)CC1	ZINC000875336286	DD	On-Demand	Anodyne	CAPN2	47	34
COC[C@H](Cc1ccccc1)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875336287	ED	On-Demand	Anodyne	GHRHR	59	38
COC[C@H](Cc1ccccc1)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875336287	ED	On-Demand	Anodyne	MME	53	40
COC[C@H](Cc1ccccc1)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875336287	ED	On-Demand	Anodyne	TIMP3	70	36
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875336288	ED	On-Demand	Anodyne	GHRHR	59	38
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875336288	ED	On-Demand	Anodyne	MME	53	40
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875336288	ED	On-Demand	Anodyne	TIMP3	70	36
COC[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccco1	ZINC000875336294	DE	On-Demand	Anodyne	REN	17	43
COC[C@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccco1	ZINC000875336295	DE	On-Demand	Anodyne	REN	17	43
COC[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccco1	ZINC000875336296	DE	On-Demand	Anodyne	REN	17	43
COC[C@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccco1	ZINC000875336297	DE	On-Demand	Anodyne	REN	17	43
COC[C@@H](Cc1ccccc1)NC(=O)NN(C)C(=O)OC	ZINC000875336329	CD	On-Demand	Reactive	MME	74	43
COC[C@@H](Cc1ccccc1)NC(=O)NN(C)C(=O)OC	ZINC000875336329	CD	On-Demand	Reactive	ANPEP	46	34
COC[C@@H](Cc1ccccc1)NC(=O)NN(C)C(=O)OC	ZINC000875336329	CD	On-Demand	Reactive	PAPA1_CARPA	48	35
COC[C@@H](Cc1ccccc1)NC(=O)NN(C)C(=O)OC	ZINC000875336329	CD	On-Demand	Reactive	CAPN2	44	31
COC[C@@H](Cc1ccccc1)NC(=O)NN(C)C(=O)OC	ZINC000875336329	CD	On-Demand	Reactive	PIN1	26	40
COC[C@H](Cc1ccccc1)NC(=O)NN(C)C(=O)OC	ZINC000875336330	CD	On-Demand	Reactive	MME	74	43
COC[C@H](Cc1ccccc1)NC(=O)NN(C)C(=O)OC	ZINC000875336330	CD	On-Demand	Reactive	ANPEP	46	34
COC[C@H](Cc1ccccc1)NC(=O)NN(C)C(=O)OC	ZINC000875336330	CD	On-Demand	Reactive	PAPA1_CARPA	48	35
COC[C@H](Cc1ccccc1)NC(=O)NN(C)C(=O)OC	ZINC000875336330	CD	On-Demand	Reactive	CAPN2	44	31
COC[C@H](Cc1ccccc1)NC(=O)NN(C)C(=O)OC	ZINC000875336330	CD	On-Demand	Reactive	PIN1	26	40
COC[C@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875336342	EF	On-Demand	Anodyne	SLC6A3	34	41
COC[C@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875336342	EF	On-Demand	Anodyne	TIMP3	50	32
COC[C@@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875336343	EF	On-Demand	Anodyne	SLC6A3	34	41
COC[C@@H](Cc1ccccc1)NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875336343	EF	On-Demand	Anodyne	TIMP3	50	32
COC(=O)N(C)NC(=O)NCCCc1ccc(Cl)cc1Cl	ZINC000875336359	EF	On-Demand	Reactive	MTNR1A	25	41
CCCCCCCNC(=O)C(=O)N[C@H]1CCOC2(CCSCC2)C1	ZINC000875336360	FF	On-Demand	Mild	EPHX2	17	42
CCCCCCCNC(=O)C(=O)N[C@@H]1CCOC2(CCSCC2)C1	ZINC000875336361	FF	On-Demand	Mild	EPHX2	17	42
COC[C@H](Cc1ccccc1)NC(=O)N1Cc2cccc(O)c2C1	ZINC000875336370	EF	On-Demand	Clean	MME	40	38
COC[C@H](Cc1ccccc1)NC(=O)N1Cc2cccc(O)c2C1	ZINC000875336370	EF	On-Demand	Clean	PIN1	31	40
COC[C@@H](Cc1ccccc1)NC(=O)N1Cc2cccc(O)c2C1	ZINC000875336371	EF	On-Demand	Clean	MME	40	38
COC[C@@H](Cc1ccccc1)NC(=O)N1Cc2cccc(O)c2C1	ZINC000875336371	EF	On-Demand	Clean	PIN1	31	40
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875336372	EE	On-Demand	Anodyne	F2	32	40
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875336372	EE	On-Demand	Anodyne	ACE	47	39
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875336372	EE	On-Demand	Anodyne	GHRHR	51	32
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875336372	EE	On-Demand	Anodyne	MME	45	39
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875336372	EE	On-Demand	Anodyne	TRY1_BOVIN	49	35
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875336372	EE	On-Demand	Anodyne	AMY2	47	32
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875336372	EE	On-Demand	Anodyne	REN	54	51
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875336372	EE	On-Demand	Anodyne	PIN1	17	41
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875336372	EE	On-Demand	Anodyne	BRCA1	58	32
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875336373	EE	On-Demand	Anodyne	F2	32	40
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875336373	EE	On-Demand	Anodyne	ACE	47	39
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875336373	EE	On-Demand	Anodyne	GHRHR	51	32
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875336373	EE	On-Demand	Anodyne	MME	45	39
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875336373	EE	On-Demand	Anodyne	TRY1_BOVIN	49	35
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875336373	EE	On-Demand	Anodyne	AMY2	47	32
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875336373	EE	On-Demand	Anodyne	REN	54	51
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875336373	EE	On-Demand	Anodyne	PIN1	17	41
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875336373	EE	On-Demand	Anodyne	BRCA1	58	32
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875336374	EE	On-Demand	Anodyne	F2	32	40
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875336374	EE	On-Demand	Anodyne	ACE	47	39
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875336374	EE	On-Demand	Anodyne	GHRHR	51	32
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875336374	EE	On-Demand	Anodyne	MME	45	39
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875336374	EE	On-Demand	Anodyne	TRY1_BOVIN	49	35
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875336374	EE	On-Demand	Anodyne	AMY2	47	32
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875336374	EE	On-Demand	Anodyne	REN	54	51
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875336374	EE	On-Demand	Anodyne	PIN1	17	41
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875336374	EE	On-Demand	Anodyne	BRCA1	58	32
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875336375	EE	On-Demand	Anodyne	F2	32	40
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875336375	EE	On-Demand	Anodyne	ACE	47	39
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875336375	EE	On-Demand	Anodyne	GHRHR	51	32
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875336375	EE	On-Demand	Anodyne	MME	45	39
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875336375	EE	On-Demand	Anodyne	TRY1_BOVIN	49	35
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875336375	EE	On-Demand	Anodyne	AMY2	47	32
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875336375	EE	On-Demand	Anodyne	REN	54	51
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875336375	EE	On-Demand	Anodyne	PIN1	17	41
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875336375	EE	On-Demand	Anodyne	BRCA1	58	32
COC[C@@H](NC(=O)NCc1ccc(O)c(Cl)c1)c1ccco1	ZINC000875336417	DF	On-Demand	Anodyne	NCE103	16	46
COC[C@H](NC(=O)NCc1ccc(O)c(Cl)c1)c1ccco1	ZINC000875336418	DF	On-Demand	Anodyne	NCE103	16	46
C[C@H](NC(=O)C(=O)NCC[C@@H]1CCSC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875336437	GE	On-Demand	Anodyne	ACHE	36	45
C[C@H](NC(=O)C(=O)NCC[C@@H]1CCSC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875336437	GE	On-Demand	Anodyne	SIGMAR1	27	42
C[C@H](NC(=O)C(=O)NCC[C@@H]1CCSC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875336438	GE	On-Demand	Anodyne	ACHE	36	45
C[C@H](NC(=O)C(=O)NCC[C@@H]1CCSC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875336438	GE	On-Demand	Anodyne	SIGMAR1	27	42
C[C@H](NC(=O)C(=O)NCC[C@H]1CCSC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875336439	GE	On-Demand	Anodyne	ACHE	36	45
C[C@H](NC(=O)C(=O)NCC[C@H]1CCSC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875336439	GE	On-Demand	Anodyne	SIGMAR1	27	42
C[C@H](NC(=O)C(=O)NCC[C@H]1CCSC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875336440	GE	On-Demand	Anodyne	ACHE	36	45
C[C@H](NC(=O)C(=O)NCC[C@H]1CCSC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875336440	GE	On-Demand	Anodyne	SIGMAR1	27	42
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875336441	FD	On-Demand	Mild	DRD4	28	41
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875336441	FD	On-Demand	Mild	SIGMAR1	33	45
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875336441	FD	On-Demand	Mild	BIRC2	18	41
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875336442	FD	On-Demand	Mild	DRD4	28	41
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875336442	FD	On-Demand	Mild	SIGMAR1	33	45
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875336442	FD	On-Demand	Mild	BIRC2	18	41
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875336443	FD	On-Demand	Mild	DRD4	28	41
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875336443	FD	On-Demand	Mild	SIGMAR1	33	45
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875336443	FD	On-Demand	Mild	BIRC2	18	41
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875336444	FD	On-Demand	Mild	DRD4	28	41
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875336444	FD	On-Demand	Mild	SIGMAR1	33	45
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875336444	FD	On-Demand	Mild	BIRC2	18	41
COC[C@H](NC(=O)N1CCN(c2ccc(F)cc2C#N)CC1)c1ccco1	ZINC000875336466	FF	On-Demand	Mild	KISS1R	46	34
COC[C@@H](NC(=O)N1CCN(c2ccc(F)cc2C#N)CC1)c1ccco1	ZINC000875336467	FF	On-Demand	Mild	KISS1R	46	34
COC[C@H](Cc1ccccc1)NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1	ZINC000875336521	GD	On-Demand	Anodyne	MME	44	39
COC[C@@H](Cc1ccccc1)NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1	ZINC000875336522	GD	On-Demand	Anodyne	MME	44	39
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cc(Cl)ccc1F	ZINC000875336530	DF	On-Demand	Anodyne	MC4R	20	41
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cc(Cl)ccc1F	ZINC000875336530	DF	On-Demand	Anodyne	CAPN1	47	40
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cc(Cl)ccc1F	ZINC000875336530	DF	On-Demand	Anodyne	CAPN2	56	34
COC[C@H](NC(=O)N1CC[C@]2(CCc3ccccc32)C1)c1ccco1	ZINC000875336540	EG	On-Demand	Anodyne	OXTR	44	35
COC[C@H](NC(=O)N1CC[C@]2(CCc3ccccc32)C1)c1ccco1	ZINC000875336540	EG	On-Demand	Anodyne	GHRHR	43	44
COC[C@H](NC(=O)N1CC[C@@]2(CCc3ccccc32)C1)c1ccco1	ZINC000875336541	EG	On-Demand	Anodyne	OXTR	44	35
COC[C@H](NC(=O)N1CC[C@@]2(CCc3ccccc32)C1)c1ccco1	ZINC000875336541	EG	On-Demand	Anodyne	GHRHR	43	44
COC[C@@H](NC(=O)N1CC[C@@]2(CCc3ccccc32)C1)c1ccco1	ZINC000875336542	EG	On-Demand	Anodyne	OXTR	44	35
COC[C@@H](NC(=O)N1CC[C@@]2(CCc3ccccc32)C1)c1ccco1	ZINC000875336542	EG	On-Demand	Anodyne	GHRHR	43	44
COC[C@@H](NC(=O)N1CC[C@]2(CCc3ccccc32)C1)c1ccco1	ZINC000875336543	EG	On-Demand	Anodyne	OXTR	44	35
COC[C@@H](NC(=O)N1CC[C@]2(CCc3ccccc32)C1)c1ccco1	ZINC000875336543	EG	On-Demand	Anodyne	GHRHR	43	44
CC[C@@H](NC(=O)NCCOCc1ccccc1)[C@@H](O)c1ccccc1	ZINC000875336559	EG	On-Demand	Anodyne	PAPA1_CARPA	41	31
CC[C@@H](NC(=O)NCCOCc1ccccc1)[C@@H](O)c1ccccc1	ZINC000875336559	EG	On-Demand	Anodyne	CAPN1	49	39
CC[C@@H](NC(=O)NCCOCc1ccccc1)[C@@H](O)c1ccccc1	ZINC000875336559	EG	On-Demand	Anodyne	CAPN2	98	39
CC[C@@H](NC(=O)NCCOCc1ccccc1)[C@H](O)c1ccccc1	ZINC000875336562	EG	On-Demand	Anodyne	PAPA1_CARPA	41	31
CC[C@@H](NC(=O)NCCOCc1ccccc1)[C@H](O)c1ccccc1	ZINC000875336562	EG	On-Demand	Anodyne	CAPN1	49	39
CC[C@@H](NC(=O)NCCOCc1ccccc1)[C@H](O)c1ccccc1	ZINC000875336562	EG	On-Demand	Anodyne	CAPN2	98	39
NC(=O)C1CCC(NC(=O)NCc2cc(Cl)cc(Cl)c2F)CC1	ZINC000875336579	FF	On-Demand	Anodyne	EPHX2	19	47
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)[C@@H](C)c1ccccc1	ZINC000875336654	CG	On-Demand	Anodyne	MME	31	44
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)[C@@H](C)c1ccccc1	ZINC000875336655	CG	On-Demand	Anodyne	MME	31	44
COC[C@H](Cc1ccccc1)NC(=O)N1CC[C@]2(C(=O)OC)CCC[C@H]12	ZINC000875336673	FE	On-Demand	Anodyne	MME	44	37
COC[C@H](Cc1ccccc1)NC(=O)N1CC[C@]2(C(=O)OC)CCC[C@H]12	ZINC000875336673	FE	On-Demand	Anodyne	TIMP3	71	36
COC[C@H](Cc1ccccc1)NC(=O)N1CC[C@]2(C(=O)OC)CCC[C@H]12	ZINC000875336673	FE	On-Demand	Anodyne	PIN1	19	43
COC[C@H](Cc1ccccc1)NC(=O)N1CC[C@]2(C(=O)OC)CCC[C@H]12	ZINC000875336673	FE	On-Demand	Anodyne	BRCA1	62	35
COC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@]2(C(=O)OC)CCC[C@H]12	ZINC000875336674	FE	On-Demand	Anodyne	MME	44	37
COC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@]2(C(=O)OC)CCC[C@H]12	ZINC000875336674	FE	On-Demand	Anodyne	TIMP3	71	36
COC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@]2(C(=O)OC)CCC[C@H]12	ZINC000875336674	FE	On-Demand	Anodyne	PIN1	19	43
COC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@]2(C(=O)OC)CCC[C@H]12	ZINC000875336674	FE	On-Demand	Anodyne	BRCA1	62	35
COC[C@@H](NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1)c1ccco1	ZINC000875336681	GF	On-Demand	Anodyne	DRD4	15	42
COC[C@H](NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1)c1ccco1	ZINC000875336682	GF	On-Demand	Anodyne	DRD4	15	42
COC[C@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875336688	DE	On-Demand	Anodyne	GHRHR	47	31
COC[C@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875336688	DE	On-Demand	Anodyne	MME	52	38
COC[C@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875336688	DE	On-Demand	Anodyne	AMY2	44	31
COC[C@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875336688	DE	On-Demand	Anodyne	REN	43	45
COC[C@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875336688	DE	On-Demand	Anodyne	PIN1	19	40
COC[C@H](Cc1ccccc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875336689	DE	On-Demand	Anodyne	GHRHR	47	31
COC[C@H](Cc1ccccc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875336689	DE	On-Demand	Anodyne	MME	52	38
COC[C@H](Cc1ccccc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875336689	DE	On-Demand	Anodyne	AMY2	44	31
COC[C@H](Cc1ccccc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875336689	DE	On-Demand	Anodyne	REN	43	45
COC[C@H](Cc1ccccc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875336689	DE	On-Demand	Anodyne	PIN1	19	40
COC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875336690	DE	On-Demand	Anodyne	GHRHR	47	31
COC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875336690	DE	On-Demand	Anodyne	MME	52	38
COC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875336690	DE	On-Demand	Anodyne	AMY2	44	31
COC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875336690	DE	On-Demand	Anodyne	REN	43	45
COC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875336690	DE	On-Demand	Anodyne	PIN1	19	40
COC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875336691	DE	On-Demand	Anodyne	GHRHR	47	31
COC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875336691	DE	On-Demand	Anodyne	MME	52	38
COC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875336691	DE	On-Demand	Anodyne	AMY2	44	31
COC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875336691	DE	On-Demand	Anodyne	REN	43	45
COC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875336691	DE	On-Demand	Anodyne	PIN1	19	40
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875336692	GD	On-Demand	Anodyne	SIGMAR1	38	51
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875336692	GD	On-Demand	Anodyne	CCR5	44	37
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875336692	GD	On-Demand	Anodyne	BIRC2	24	43
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875336693	GD	On-Demand	Anodyne	SIGMAR1	38	51
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875336693	GD	On-Demand	Anodyne	CCR5	44	37
CC(=O)C1CCN(C(=O)C(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875336693	GD	On-Demand	Anodyne	BIRC2	24	43
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875336694	GD	On-Demand	Anodyne	SIGMAR1	38	51
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875336694	GD	On-Demand	Anodyne	CCR5	44	37
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875336694	GD	On-Demand	Anodyne	BIRC2	24	43
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875336695	GD	On-Demand	Anodyne	SIGMAR1	38	51
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875336695	GD	On-Demand	Anodyne	CCR5	44	37
CC(=O)C1CCN(C(=O)C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875336695	GD	On-Demand	Anodyne	BIRC2	24	43
COC[C@@H](Cc1ccccc1)NC(=O)NNc1nnc(C)n1C	ZINC000875336698	DD	On-Demand	Reactive	MME	21	40
COC[C@@H](Cc1ccccc1)NC(=O)NNc1nnc(C)n1C	ZINC000875336698	DD	On-Demand	Reactive	CAPN2	46	33
COC[C@H](Cc1ccccc1)NC(=O)NNc1nnc(C)n1C	ZINC000875336699	DD	On-Demand	Reactive	MME	21	40
COC[C@H](Cc1ccccc1)NC(=O)NNc1nnc(C)n1C	ZINC000875336699	DD	On-Demand	Reactive	CAPN2	46	33
COC[C@H](NC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1)c1ccco1	ZINC000875336743	FG	On-Demand	Anodyne	CPT1A	56	34
COC[C@H](NC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1)c1ccco1	ZINC000875336744	FG	On-Demand	Anodyne	CPT1A	56	34
COC[C@H](NC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1)c1ccco1	ZINC000875336745	FG	On-Demand	Anodyne	CPT1A	56	34
COC[C@H](NC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1)c1ccco1	ZINC000875336746	FG	On-Demand	Anodyne	CPT1A	56	34
CC(=O)N1CCC[C@@H]1C(=O)Oc1cc(Cl)ccc1F	ZINC000875336753	CE	On-Demand	Anodyne	F2	15	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)[C@H](C)c1ccccc1	ZINC000875336756	CG	On-Demand	Anodyne	MME	31	44
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)[C@H](C)c1ccccc1	ZINC000875336757	CG	On-Demand	Anodyne	MME	31	44
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)N[C@@H]2CCn3ccnc3C2)c1	ZINC000875336764	FD	On-Demand	Anodyne	SSTR5	27	40
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)N[C@H]2CCn3ccnc3C2)c1	ZINC000875336765	FD	On-Demand	Anodyne	SSTR5	27	40
Cc1cncc([C@H]2CCCN2C(=O)C(=O)N[C@@H]2CCn3ccnc3C2)c1	ZINC000875336766	FD	On-Demand	Anodyne	SSTR5	27	40
Cc1cncc([C@H]2CCCN2C(=O)C(=O)N[C@H]2CCn3ccnc3C2)c1	ZINC000875336767	FD	On-Demand	Anodyne	SSTR5	27	40
O=C(NCCO)C1CCN(C(=O)NCCOCc2ccccc2)CC1	ZINC000875336772	EC	On-Demand	Anodyne	EPHX2	21	45
CCOC(=O)[C@H](C)C1CN(C(=O)NCCOCc2ccccc2)C1	ZINC000875336774	EE	On-Demand	Anodyne	ACE	32	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCCOCc2ccccc2)C1	ZINC000875336774	EE	On-Demand	Anodyne	CAPN1	53	37
CCOC(=O)[C@H](C)C1CN(C(=O)NCCOCc2ccccc2)C1	ZINC000875336774	EE	On-Demand	Anodyne	CAPN2	86	37
CCOC(=O)[C@H](C)C1CN(C(=O)NCCOCc2ccccc2)C1	ZINC000875336774	EE	On-Demand	Anodyne	NPR	51	37
CCOC(=O)[C@H](C)C1CN(C(=O)NCCOCc2ccccc2)C1	ZINC000875336774	EE	On-Demand	Anodyne	Q6PRC7_IXORI	42	36
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)[C@H](C)c1ccccc1	ZINC000875336805	CE	On-Demand	Anodyne	MME	15	42
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)[C@@H](C)c1ccccc1	ZINC000875336806	CE	On-Demand	Anodyne	MME	15	42
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)[C@H](C)c1ccccc1	ZINC000875336808	CE	On-Demand	Anodyne	MME	15	42
NC(=O)C1CCC(NC(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)CC1	ZINC000875336830	EE	On-Demand	Anodyne	EPHX2	46	49
NC(=O)C1CCC(NC(=O)N2C[C@@H]3[C@@H](C[C@H]3c3ccccc3)C2)CC1	ZINC000875336837	EE	On-Demand	Anodyne	SMO	23	45
NC(=O)C1CCC(NC(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000875336838	EE	On-Demand	Anodyne	OXTR	54	39
NC(=O)C1CCC(NC(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000875336839	EE	On-Demand	Anodyne	OXTR	54	39
O=C(NCCOCc1ccccc1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875336841	FD	On-Demand	Anodyne	GBA2	40	30
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875336911	GD	On-Demand	Mild	DRD4	33	43
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875336911	GD	On-Demand	Mild	ACHE	28	40
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875336911	GD	On-Demand	Mild	SIGMAR1	34	45
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875336911	GD	On-Demand	Mild	BIRC2	18	41
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875336912	GD	On-Demand	Mild	DRD4	33	43
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875336912	GD	On-Demand	Mild	ACHE	28	40
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875336912	GD	On-Demand	Mild	SIGMAR1	34	45
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875336912	GD	On-Demand	Mild	BIRC2	18	41
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875336913	GD	On-Demand	Mild	DRD4	33	43
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875336913	GD	On-Demand	Mild	ACHE	28	40
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875336913	GD	On-Demand	Mild	SIGMAR1	34	45
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875336913	GD	On-Demand	Mild	BIRC2	18	41
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875336914	GD	On-Demand	Mild	DRD4	33	43
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875336914	GD	On-Demand	Mild	ACHE	28	40
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875336914	GD	On-Demand	Mild	SIGMAR1	34	45
C#CC[C@H](CCOC)NC(=O)C(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875336914	GD	On-Demand	Mild	BIRC2	18	41
COC[C@@H](Cc1ccccc1)NC(=O)N1CCCCCCNC(=O)CC1	ZINC000875336930	FE	On-Demand	Anodyne	MME	22	42
COC[C@@H](Cc1ccccc1)NC(=O)N1CCCCCCNC(=O)CC1	ZINC000875336930	FE	On-Demand	Anodyne	Q9N6S8_PLAFA	15	41
COC[C@H](Cc1ccccc1)NC(=O)N1CCCCCCNC(=O)CC1	ZINC000875336931	FE	On-Demand	Anodyne	MME	22	42
COC[C@H](Cc1ccccc1)NC(=O)N1CCCCCCNC(=O)CC1	ZINC000875336931	FE	On-Demand	Anodyne	Q9N6S8_PLAFA	15	41
COC[C@H](NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1)c1ccco1	ZINC000875336934	FG	On-Demand	Anodyne	SMO	42	44
COC[C@H](NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1)c1ccco1	ZINC000875336934	FG	On-Demand	Anodyne	ETHR	62	43
COC[C@@H](NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1)c1ccco1	ZINC000875336935	FG	On-Demand	Anodyne	SMO	42	44
COC[C@@H](NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1)c1ccco1	ZINC000875336935	FG	On-Demand	Anodyne	ETHR	62	43
CC[C@H](C[C@H](C)O)NC(=O)NCCOCc1ccccc1	ZINC000875336966	CE	On-Demand	Anodyne	MME	49	43
CC[C@H](C[C@H](C)O)NC(=O)NCCOCc1ccccc1	ZINC000875336966	CE	On-Demand	Anodyne	CTSB	56	39
CC[C@H](C[C@H](C)O)NC(=O)NCCOCc1ccccc1	ZINC000875336966	CE	On-Demand	Anodyne	PAPA1_CARPA	70	36
CC[C@H](C[C@H](C)O)NC(=O)NCCOCc1ccccc1	ZINC000875336966	CE	On-Demand	Anodyne	CTSK	29	41
CC[C@H](C[C@H](C)O)NC(=O)NCCOCc1ccccc1	ZINC000875336966	CE	On-Demand	Anodyne	CAPNS1	59	36
CC[C@H](C[C@H](C)O)NC(=O)NCCOCc1ccccc1	ZINC000875336966	CE	On-Demand	Anodyne	CAPN1	82	43
CC[C@H](C[C@H](C)O)NC(=O)NCCOCc1ccccc1	ZINC000875336966	CE	On-Demand	Anodyne	CAPN2	123	43
CC[C@H](C[C@H](C)O)NC(=O)NCCOCc1ccccc1	ZINC000875336966	CE	On-Demand	Anodyne	NPR	79	36
CC[C@H](C[C@H](C)O)NC(=O)NCCOCc1ccccc1	ZINC000875336966	CE	On-Demand	Anodyne	PDS	48	34
NC(=O)C1CCC(NC(=O)N2CCC[C@](F)(c3ccccc3)C2)CC1	ZINC000875336970	EF	On-Demand	Anodyne	EPHX2	22	44
NC(=O)C1CCC(NC(=O)N2CCC[C@@](F)(c3ccccc3)C2)CC1	ZINC000875336971	EF	On-Demand	Anodyne	EPHX2	22	44
NC(=O)C1CCC(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875336984	GF	On-Demand	Anodyne	CHRM2	16	45
NC(=O)C1CCC(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875336984	GF	On-Demand	Anodyne	DRD2	25	54
NC(=O)C1CCC(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875336984	GF	On-Demand	Anodyne	DRD4	45	54
NC(=O)C1CCC(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875336984	GF	On-Demand	Anodyne	ACHE	63	62
NC(=O)C1CCC(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875336984	GF	On-Demand	Anodyne	HRH2	25	48
NC(=O)C1CCC(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875336984	GF	On-Demand	Anodyne	DRD3	23	54
NC(=O)C1CCC(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875336984	GF	On-Demand	Anodyne	CHRM3	20	45
NC(=O)C1CCC(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875336984	GF	On-Demand	Anodyne	LTA4H	21	40
NC(=O)C1CCC(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875336984	GF	On-Demand	Anodyne	SIGMAR1	59	52
NC(=O)C1CCC(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875336984	GF	On-Demand	Anodyne	SSTR5	45	36
NC(=O)C1CCC(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875336984	GF	On-Demand	Anodyne	BCHE	18	49
NC(=O)C1CCC(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875336984	GF	On-Demand	Anodyne	CCR3	50	42
NC(=O)C1CCC(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875336984	GF	On-Demand	Anodyne	SLC6A5	20	44
NC(=O)C1CCC(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875336984	GF	On-Demand	Anodyne	EPHX2	22	48
NC(=O)C1CCC(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875336984	GF	On-Demand	Anodyne	MCHR1	42	45
NC(=O)C1CCC(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875336984	GF	On-Demand	Anodyne	CACNA1G	32	42
NC(=O)C1CCC(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875336984	GF	On-Demand	Anodyne	SIRT3	41	32
NC(=O)C1CCC(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875336984	GF	On-Demand	Anodyne	SIRT2	46	32
NC(=O)C1CCC(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875336984	GF	On-Demand	Anodyne	SIRT1	42	35
NC(=O)C1CCC(NC(=O)NCCC2CCN(Cc3ccccc3)CC2)CC1	ZINC000875336984	GF	On-Demand	Anodyne	NPFFR1	44	40
NC(=O)C1CCC(NC(=O)NCCCCCCc2ccccc2)CC1	ZINC000875336999	EG	On-Demand	Anodyne	FKBP1A	24	43
NC(=O)C1CCC(NC(=O)NCCCCCCc2ccccc2)CC1	ZINC000875336999	EG	On-Demand	Anodyne	SCNN1A	43	40
NC(=O)C1CCC(NC(=O)NCCCCCCc2ccccc2)CC1	ZINC000875336999	EG	On-Demand	Anodyne	SIGMAR1	21	41
NC(=O)C1CCC(NC(=O)NCCCCCCc2ccccc2)CC1	ZINC000875336999	EG	On-Demand	Anodyne	SCN2A	17	41
NC(=O)C1CCC(NC(=O)NCCCCCCc2ccccc2)CC1	ZINC000875336999	EG	On-Demand	Anodyne	MTNR1A	25	41
NC(=O)C1CCC(NC(=O)NCCCCCCc2ccccc2)CC1	ZINC000875336999	EG	On-Demand	Anodyne	MTNR1B	25	41
NC(=O)C1CCC(NC(=O)NCCCCCCc2ccccc2)CC1	ZINC000875336999	EG	On-Demand	Anodyne	FAAH	40	40
NC(=O)C1CCC(NC(=O)NCCCCCCc2ccccc2)CC1	ZINC000875336999	EG	On-Demand	Anodyne	CES1	48	35
NC(=O)C1CCC(NC(=O)NCCCCCCc2ccccc2)CC1	ZINC000875336999	EG	On-Demand	Anodyne	EPHX2	27	57
NC(=O)C1CCC(NC(=O)NCCCCCCc2ccccc2)CC1	ZINC000875336999	EG	On-Demand	Anodyne	AMP1_PLAFQ	21	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2cc(F)ccc2F)C1	ZINC000875337012	EE	On-Demand	Anodyne	DPP4	19	44
C[C@@H](NC(=O)NCCOCc1ccccc1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875337024	GF	On-Demand	Anodyne	CTSK	24	41
C[C@@H](NC(=O)NCCOCc1ccccc1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875337024	GF	On-Demand	Anodyne	FPR1	45	35
C[C@@H](NC(=O)NCCOCc1ccccc1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875337024	GF	On-Demand	Anodyne	GPR119	19	40
COC[C@@H](Cc1ccccc1)NC(=O)N1CC(O)(C(=O)OC)C1	ZINC000875337041	DC	On-Demand	Anodyne	MME	46	37
COC[C@H](Cc1ccccc1)NC(=O)N1CC(O)(C(=O)OC)C1	ZINC000875337043	DC	On-Demand	Anodyne	MME	46	37
CN1CCN(C(=O)NCCOCc2ccccc2)CCC1(C)C	ZINC000875337050	DE	On-Demand	Anodyne	SLC12A5	63	35
COC[C@H](Cc1ccccc1)NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875337053	FF	On-Demand	Anodyne	GHRHR	58	38
COC[C@H](Cc1ccccc1)NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875337053	FF	On-Demand	Anodyne	MME	41	39
COC[C@H](Cc1ccccc1)NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875337053	FF	On-Demand	Anodyne	TIMP3	62	35
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875337055	FF	On-Demand	Anodyne	GHRHR	58	38
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875337055	FF	On-Demand	Anodyne	MME	41	39
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875337055	FF	On-Demand	Anodyne	TIMP3	62	35
COC[C@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)[C@H]1CCCO1	ZINC000875337057	GB	On-Demand	Anodyne	L3MBTL3	40	38
COC[C@@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)[C@H]1CCCO1	ZINC000875337061	GB	On-Demand	Anodyne	L3MBTL3	40	38
COC[C@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)[C@@H]1CCCO1	ZINC000875337063	GB	On-Demand	Anodyne	L3MBTL3	40	38
COC[C@@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)[C@@H]1CCCO1	ZINC000875337065	GB	On-Demand	Anodyne	L3MBTL3	40	38
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875337085	GD	On-Demand	Anodyne	SLC6A1	67	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875337085	GD	On-Demand	Anodyne	SIGMAR1	31	46
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875337085	GD	On-Demand	Anodyne	CCR5	44	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875337085	GD	On-Demand	Anodyne	BIRC2	28	45
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875337086	GD	On-Demand	Anodyne	SLC6A1	67	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875337086	GD	On-Demand	Anodyne	SIGMAR1	31	46
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875337086	GD	On-Demand	Anodyne	CCR5	44	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875337086	GD	On-Demand	Anodyne	BIRC2	28	45
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875337087	GD	On-Demand	Anodyne	SLC6A1	67	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875337087	GD	On-Demand	Anodyne	SIGMAR1	31	46
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875337087	GD	On-Demand	Anodyne	CCR5	44	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875337087	GD	On-Demand	Anodyne	BIRC2	28	45
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875337088	GD	On-Demand	Anodyne	SLC6A1	67	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875337088	GD	On-Demand	Anodyne	SIGMAR1	31	46
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875337088	GD	On-Demand	Anodyne	CCR5	44	37
CC(=O)[C@@H]1CCCN(C(=O)C(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875337088	GD	On-Demand	Anodyne	BIRC2	28	45
NS(=O)(=O)c1cc(C(=O)NNC(=O)CCCOc2ccc(F)cc2)ccc1Cl	ZINC000875337103	ID	On-Demand	Reactive	CA2	25	49
NS(=O)(=O)c1cc(C(=O)NNC(=O)CCCOc2ccc(F)cc2)ccc1Cl	ZINC000875337103	ID	On-Demand	Reactive	CA1	25	49
NS(=O)(=O)c1cc(C(=O)NNC(=O)CCCOc2ccc(F)cc2)ccc1Cl	ZINC000875337103	ID	On-Demand	Reactive	CA4	23	49
NS(=O)(=O)c1cc(C(=O)NNC(=O)CCCOc2ccc(F)cc2)ccc1Cl	ZINC000875337103	ID	On-Demand	Reactive	CA12	15	42
NS(=O)(=O)c1cc(C(=O)NNC(=O)CCCOc2ccc(F)cc2)ccc1Cl	ZINC000875337103	ID	On-Demand	Reactive	CA9	16	42
CCCCCCCNC(=O)C(=O)N[C@@H]1CCn2ccnc2C1	ZINC000875337127	DD	On-Demand	Mild	ASAH1	69	34
CCCCCCCNC(=O)C(=O)N[C@H]1CCn2ccnc2C1	ZINC000875337128	DD	On-Demand	Mild	ASAH1	69	34
CN1CCC(CNC(=O)NC2CCC(C(N)=O)CC2)(c2ccccc2)CC1	ZINC000875337135	FD	On-Demand	Anodyne	KCNA3	53	45
CN1CCC(CNC(=O)NC2CCC(C(N)=O)CC2)(c2ccccc2)CC1	ZINC000875337135	FD	On-Demand	Anodyne	SOAT1	16	43
CN1CCC(CNC(=O)NC2CCC(C(N)=O)CC2)(c2ccccc2)CC1	ZINC000875337135	FD	On-Demand	Anodyne	EPHX2	24	41
CN1CCC(CNC(=O)NC2CCC(C(N)=O)CC2)(c2ccccc2)CC1	ZINC000875337135	FD	On-Demand	Anodyne	NPFFR1	19	43
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NC1CCC(C(N)=O)CC1)CC2	ZINC000875337137	GE	On-Demand	Anodyne	SLC18A2	46	34
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NC1CCC(C(N)=O)CC1)CC2	ZINC000875337137	GE	On-Demand	Anodyne	MTNR1B	16	46
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NC1CCC(C(N)=O)CC1)CC2	ZINC000875337138	GE	On-Demand	Anodyne	SLC18A2	46	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NC1CCC(C(N)=O)CC1)CC2	ZINC000875337138	GE	On-Demand	Anodyne	MTNR1B	16	46
C[C@@H](O)C1CCN(C(=O)N[C@H](C)[C@H](C)c2ccccc2)CC1	ZINC000875337141	DF	On-Demand	Anodyne	BIRC8	44	32
O=CN1CCCN(C(=O)NCCCc2ccc(Cl)cc2Cl)CC1	ZINC000875337182	FF	On-Demand	Anodyne	CNR1	17	45
O=CN1CCCN(C(=O)NCCCc2ccc(Cl)cc2Cl)CC1	ZINC000875337182	FF	On-Demand	Anodyne	MC4R	45	39
O=CN1CCCN(C(=O)NCCCc2ccc(Cl)cc2Cl)CC1	ZINC000875337182	FF	On-Demand	Anodyne	EPHX2	20	48
O=CN1CCCN(C(=O)NCCCc2ccc(Cl)cc2Cl)CC1	ZINC000875337182	FF	On-Demand	Anodyne	CXCR3	15	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)[C@H](C)c1ccccc1	ZINC000875337190	EF	On-Demand	Anodyne	SLC6A4	29	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)[C@H](C)c1ccccc1	ZINC000875337190	EF	On-Demand	Anodyne	SLC6A3	70	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)[C@@H](C)c1ccccc1	ZINC000875337191	EF	On-Demand	Anodyne	SLC6A4	29	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)[C@@H](C)c1ccccc1	ZINC000875337191	EF	On-Demand	Anodyne	SLC6A3	70	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)[C@@H](C)c1ccccc1	ZINC000875337192	EF	On-Demand	Anodyne	SLC6A4	29	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)[C@@H](C)c1ccccc1	ZINC000875337192	EF	On-Demand	Anodyne	SLC6A3	70	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)[C@H](C)c1ccccc1	ZINC000875337193	EF	On-Demand	Anodyne	SLC6A4	29	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)[C@H](C)c1ccccc1	ZINC000875337193	EF	On-Demand	Anodyne	SLC6A3	70	46
COCCN(CC1CCN(C)CC1)C(=O)NCCc1cc(F)ccc1F	ZINC000875337196	FF	On-Demand	Anodyne	CACNA1I	45	32
COCCN(CC1CCN(C)CC1)C(=O)NCCc1cc(F)ccc1F	ZINC000875337196	FF	On-Demand	Anodyne	ACKR3	69	36
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)[C@H](C)c1ccccc1	ZINC000875337213	ED	On-Demand	Anodyne	CCR5	20	40
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)[C@H](C)c1ccccc1	ZINC000875337213	ED	On-Demand	Anodyne	EPHX2	17	42
O=C(NCCc1cc(F)ccc1F)N1CCC(CO)(CO)CC1	ZINC000875337222	ED	On-Demand	Anodyne	CACNA1H	43	32
Cc1cccc(CN2CCO[C@@H](CNC(=O)NC3CCC(C(N)=O)CC3)C2)c1	ZINC000875337277	GD	On-Demand	Anodyne	DRD4	31	43
Cc1cccc(CN2CCO[C@@H](CNC(=O)NC3CCC(C(N)=O)CC3)C2)c1	ZINC000875337277	GD	On-Demand	Anodyne	HRH2	15	42
Cc1cccc(CN2CCO[C@@H](CNC(=O)NC3CCC(C(N)=O)CC3)C2)c1	ZINC000875337277	GD	On-Demand	Anodyne	CCR3	15	49
Cc1cccc(CN2CCO[C@H](CNC(=O)NC3CCC(C(N)=O)CC3)C2)c1	ZINC000875337278	GD	On-Demand	Anodyne	DRD4	31	43
Cc1cccc(CN2CCO[C@H](CNC(=O)NC3CCC(C(N)=O)CC3)C2)c1	ZINC000875337278	GD	On-Demand	Anodyne	HRH2	15	42
Cc1cccc(CN2CCO[C@H](CNC(=O)NC3CCC(C(N)=O)CC3)C2)c1	ZINC000875337278	GD	On-Demand	Anodyne	CCR3	15	49
COC(=O)N(C)NC(=O)NCCc1cc(F)ccc1F	ZINC000875337282	CD	On-Demand	Reactive	MTNR1A	42	40
COC(=O)N(C)NC(=O)NCCc1cc(F)ccc1F	ZINC000875337282	CD	On-Demand	Reactive	MTNR1B	19	40
O=C(NCCc1cc(F)ccc1F)N1CCC[C@H](OC2CCC2)CC1	ZINC000875337283	FH	On-Demand	Anodyne	EPHX2	21	48
O=C(NCCc1cc(F)ccc1F)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875337284	FH	On-Demand	Anodyne	EPHX2	21	48
C[C@@H](NC(=O)N(C)CCN1CC2(CCOCC2)C1)[C@H](C)c1ccccc1	ZINC000875337298	FF	On-Demand	Anodyne	CASR	50	38
COC(=O)[C@@]12C[C@@H](NC(=O)NCCOCc3ccccc3)C[C@@H]1C2	ZINC000875337360	ED	On-Demand	Anodyne	EPHX2	19	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cc(F)ccc1F	ZINC000875337370	EE	On-Demand	Anodyne	SLC6A3	45	39
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCn2ccnc2C1	ZINC000875337402	FE	On-Demand	Anodyne	DRD4	18	42
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCn2ccnc2C1	ZINC000875337402	FE	On-Demand	Anodyne	HTR2A	17	42
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCn2ccnc2C1	ZINC000875337402	FE	On-Demand	Anodyne	DRD3	42	38
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCn2ccnc2C1	ZINC000875337402	FE	On-Demand	Anodyne	SIGMAR1	26	40
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCn2ccnc2C1	ZINC000875337402	FE	On-Demand	Anodyne	FAAH	42	37
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CCn2ccnc2C1	ZINC000875337402	FE	On-Demand	Anodyne	CES1	52	33
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCn2ccnc2C1	ZINC000875337403	FE	On-Demand	Anodyne	DRD4	18	42
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCn2ccnc2C1	ZINC000875337403	FE	On-Demand	Anodyne	HTR2A	17	42
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCn2ccnc2C1	ZINC000875337403	FE	On-Demand	Anodyne	DRD3	42	38
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCn2ccnc2C1	ZINC000875337403	FE	On-Demand	Anodyne	SIGMAR1	26	40
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCn2ccnc2C1	ZINC000875337403	FE	On-Demand	Anodyne	FAAH	42	37
O=C(NCCCCCCc1ccccc1)C(=O)N[C@H]1CCn2ccnc2C1	ZINC000875337403	FE	On-Demand	Anodyne	CES1	52	33
O=C(NCCO)C1CCN(C(=O)NCCc2cc(F)ccc2F)CC1	ZINC000875337428	FD	On-Demand	Anodyne	EPHX2	21	47
O=C(NCCO)C1CCN(C(=O)NCCc2cc(F)ccc2F)CC1	ZINC000875337428	FD	On-Demand	Anodyne	CACNA1G	36	40
NC(=O)C1CCC(NC(=O)N[C@@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875337439	FF	On-Demand	Anodyne	C3AR1	44	43
NC(=O)C1CCC(NC(=O)N[C@@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875337439	FF	On-Demand	Anodyne	NAMPT	26	40
NC(=O)C1CCC(NC(=O)N[C@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875337440	FF	On-Demand	Anodyne	C3AR1	44	43
NC(=O)C1CCC(NC(=O)N[C@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875337440	FF	On-Demand	Anodyne	NAMPT	26	40
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCC(C(N)=O)CC2)CC1	ZINC000875337457	FG	On-Demand	Anodyne	EPHX2	22	42
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCC(C(N)=O)CC2)CC1	ZINC000875337457	FG	On-Demand	Anodyne	RBP4	31	42
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCC(C(N)=O)CC2)CC1	ZINC000875337458	FG	On-Demand	Anodyne	EPHX2	22	42
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCC(C(N)=O)CC2)CC1	ZINC000875337458	FG	On-Demand	Anodyne	RBP4	31	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCOCc1ccccc1	ZINC000875337475	ED	On-Demand	Anodyne	SLC6A4	27	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCOCc1ccccc1	ZINC000875337475	ED	On-Demand	Anodyne	SLC6A3	55	44
NC(=O)C1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875337489	ED	On-Demand	Anodyne	EPHX2	25	45
COC(=O)C1(O)CN(C(=O)NCCOCc2ccccc2)C1	ZINC000875337513	DC	On-Demand	Anodyne	SLC12A5	64	38
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NC1CCC(C(N)=O)CC1	ZINC000875337524	GF	On-Demand	Anodyne	LTA4H	17	43
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NC1CCC(C(N)=O)CC1	ZINC000875337524	GF	On-Demand	Anodyne	SIGMAR1	26	47
NC(=O)C1CCC(NC(=O)N2CCC[C@](O)(c3ccccc3)C2)CC1	ZINC000875337544	ED	On-Demand	Anodyne	EPHX2	20	44
NC(=O)C1CCC(NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)CC1	ZINC000875337545	ED	On-Demand	Anodyne	EPHX2	20	44
O=C(NCCOCc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875337568	DC	On-Demand	Anodyne	SLC12A5	58	35
COc1ccc(N2CCN(C(=O)NC3CCC(C(N)=O)CC3)CC2)c(OC)c1	ZINC000875337569	GD	On-Demand	Clean	HTR1A	24	43
COc1ccc(N2CCN(C(=O)NC3CCC(C(N)=O)CC3)CC2)c(OC)c1	ZINC000875337569	GD	On-Demand	Clean	DRD2	21	45
COc1ccc(N2CCN(C(=O)NC3CCC(C(N)=O)CC3)CC2)c(OC)c1	ZINC000875337569	GD	On-Demand	Clean	ADRA1D	22	45
COc1ccc(N2CCN(C(=O)NC3CCC(C(N)=O)CC3)CC2)c(OC)c1	ZINC000875337569	GD	On-Demand	Clean	HTR1B	15	43
COc1ccc(N2CCN(C(=O)NC3CCC(C(N)=O)CC3)CC2)c(OC)c1	ZINC000875337569	GD	On-Demand	Clean	ADRA1A	19	45
COc1ccc(N2CCN(C(=O)NC3CCC(C(N)=O)CC3)CC2)c(OC)c1	ZINC000875337569	GD	On-Demand	Clean	ADRA1B	17	45
COc1ccc(N2CCN(C(=O)NC3CCC(C(N)=O)CC3)CC2)c(OC)c1	ZINC000875337569	GD	On-Demand	Clean	PDGFRB	36	40
COc1ccc(N2CCN(C(=O)NC3CCC(C(N)=O)CC3)CC2)c(OC)c1	ZINC000875337569	GD	On-Demand	Clean	HTR7	15	40
COc1ccc(N2CCN(C(=O)NC3CCC(C(N)=O)CC3)CC2)c(OC)c1	ZINC000875337569	GD	On-Demand	Clean	MTNR1B	17	47
COc1ccc(N2CCN(C(=O)NC3CCC(C(N)=O)CC3)CC2)c(OC)c1	ZINC000875337569	GD	On-Demand	Clean	NPBWR1	46	31
NC(=O)C1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875337576	FD	On-Demand	Anodyne	DRD4	23	44
NC(=O)C1CCC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)CC1	ZINC000875337576	FD	On-Demand	Anodyne	SIGMAR1	30	46
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H]1CCn2ccnc2C1	ZINC000875337607	GD	On-Demand	Anodyne	CHRNA7	43	35
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H]1CCn2ccnc2C1	ZINC000875337607	GD	On-Demand	Anodyne	C3AR1	47	43
O=C(N[C@@H]1CCn2ccnc2C1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875337608	GD	On-Demand	Anodyne	CHRNA7	43	35
O=C(N[C@@H]1CCn2ccnc2C1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875337608	GD	On-Demand	Anodyne	C3AR1	47	43
O=C(N[C@H]1CCn2ccnc2C1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875337609	GD	On-Demand	Anodyne	CHRNA7	43	35
O=C(N[C@H]1CCn2ccnc2C1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875337609	GD	On-Demand	Anodyne	C3AR1	47	43
O=C(N[C@H]1CCn2ccnc2C1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875337610	GD	On-Demand	Anodyne	CHRNA7	43	35
O=C(N[C@H]1CCn2ccnc2C1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875337610	GD	On-Demand	Anodyne	C3AR1	47	43
CN1CCN(C(=O)NCCc2cc(F)ccc2F)CCC1(C)C	ZINC000875337614	EF	On-Demand	Anodyne	CACNA1H	41	34
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)[C@H](C)c1ccccc1	ZINC000875337664	DD	On-Demand	Anodyne	MME	17	42
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)[C@H](C)c1ccccc1	ZINC000875337679	EH	On-Demand	Anodyne	BIRC8	52	31
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)[C@@H](C)c1ccccc1	ZINC000875337681	EH	On-Demand	Anodyne	BIRC8	52	31
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)[C@H](C)c1ccccc1	ZINC000875337682	EH	On-Demand	Anodyne	BIRC8	52	31
O=C(NCCCc1ccc(Cl)cc1Cl)N1CCC(CO)(CO)CC1	ZINC000875337684	GF	On-Demand	Anodyne	CNR1	16	45
O=C(NCCCc1ccc(Cl)cc1Cl)N1CCC(CO)(CO)CC1	ZINC000875337684	GF	On-Demand	Anodyne	UGCG	26	40
O=C(NCCCc1ccc(Cl)cc1Cl)N1CCC(CO)(CO)CC1	ZINC000875337684	GF	On-Demand	Anodyne	EPHX2	22	57
O=C(NCCOCc1ccccc1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875337721	EF	On-Demand	Anodyne	SLC12A5	56	35
O=C(NCCOCc1ccccc1)NC1([C@H]2CCCCO2)CCC1	ZINC000875337722	EF	On-Demand	Anodyne	SLC12A5	56	35
O=C(NCCOCc1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875337724	EG	On-Demand	Anodyne	PREP	48	40
O=C(NCCOCc1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875337724	EG	On-Demand	Anodyne	EPHX2	29	40
O=C(NCCOCc1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875337725	EG	On-Demand	Anodyne	PREP	48	40
O=C(NCCOCc1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875337725	EG	On-Demand	Anodyne	EPHX2	29	40
C[C@H](NC(=O)NC1CCN(C2CCCCC2)CC1)c1ccccc1O	ZINC000875337844	EH	On-Demand	Clean	SIGMAR1	20	44
C[C@H](NC(=O)NC1CCN(C2CCCCC2)CC1)c1ccccc1O	ZINC000875337844	EH	On-Demand	Clean	EPHX2	39	42
C[C@H](NC(=O)NC1CCN(C2CCCCC2)CC1)c1ccccc1O	ZINC000875337844	EH	On-Demand	Clean	L3MBTL3	53	36
C[C@@H](NC(=O)NC1CCN(C2CCCCC2)CC1)c1ccccc1O	ZINC000875337845	EH	On-Demand	Clean	SIGMAR1	20	44
C[C@@H](NC(=O)NC1CCN(C2CCCCC2)CC1)c1ccccc1O	ZINC000875337845	EH	On-Demand	Clean	EPHX2	39	42
C[C@@H](NC(=O)NC1CCN(C2CCCCC2)CC1)c1ccccc1O	ZINC000875337845	EH	On-Demand	Clean	L3MBTL3	53	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(-c2cccnc2)cc1	ZINC000875337898	GH	On-Demand	Anodyne	SLC6A4	18	55
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(-c2cccnc2)cc1	ZINC000875337898	GH	On-Demand	Anodyne	SLC6A3	37	55
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(-c2cccnc2)cc1	ZINC000875337899	GH	On-Demand	Anodyne	SLC6A4	18	55
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(-c2cccnc2)cc1	ZINC000875337899	GH	On-Demand	Anodyne	SLC6A3	37	55
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(-c2cccnc2)cc1	ZINC000875337900	GH	On-Demand	Anodyne	SLC6A4	18	55
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(-c2cccnc2)cc1	ZINC000875337900	GH	On-Demand	Anodyne	SLC6A3	37	55
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(-c2cccnc2)cc1	ZINC000875337901	GH	On-Demand	Anodyne	SLC6A4	18	55
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(-c2cccnc2)cc1	ZINC000875337901	GH	On-Demand	Anodyne	SLC6A3	37	55
CONC(=O)C1CCN(C(=O)NC2CCN(C3CCCCC3)CC2)CC1	ZINC000875337906	FD	On-Demand	Anodyne	EPHX2	20	40
CCO[C@@H](C(=O)Nc1ccnc(Oc2ccccc2Cl)c1)[C@@H]1CCOC1	ZINC000875337918	GH	On-Demand	Anodyne	TYK2	59	36
CCO[C@@H](C(=O)Nc1ccnc(Oc2ccccc2Cl)c1)[C@H]1CCOC1	ZINC000875337919	GH	On-Demand	Anodyne	TYK2	59	36
COc1ccc(-c2csc(CNC(=O)N3CCCN(C=O)CC3)c2)cc1	ZINC000875337935	FF	On-Demand	Anodyne	NPBWR1	42	29
O=C(NC1CCN(C2CCCCC2)CC1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875337966	FH	On-Demand	Anodyne	EPHX2	21	40
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(-c2cccnc2)cc1	ZINC000875338009	EF	On-Demand	Anodyne	KCNA5	18	45
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(-c2cccnc2)cc1	ZINC000875338010	EF	On-Demand	Anodyne	KCNA5	18	45
COC[C@H](NC(=O)c1c(Cl)nn(C)c1Cl)c1cccc(C(F)(F)F)c1	ZINC000875338045	GH	On-Demand	Anodyne	PDS	48	36
COC[C@@H](NC(=O)c1c(Cl)nn(C)c1Cl)c1cccc(C(F)(F)F)c1	ZINC000875338046	GH	On-Demand	Anodyne	PDS	48	36
CC[C@@H](NC(=O)NC1CCN(CCOC(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000875338150	GF	On-Demand	Anodyne	SLC6A3	34	42
CC[C@@H](NC(=O)NC1CCN(CCOC(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000875338150	GF	On-Demand	Anodyne	CCR5	39	42
CC[C@@H](NC(=O)NC1CCN(CCOC(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000875338150	GF	On-Demand	Anodyne	MCHR1	15	43
CC[C@@H](NC(=O)NC1CCN(CCOC(C)C)CC1)[C@H](O)c1ccccc1	ZINC000875338152	GF	On-Demand	Anodyne	SLC6A3	34	42
CC[C@@H](NC(=O)NC1CCN(CCOC(C)C)CC1)[C@H](O)c1ccccc1	ZINC000875338152	GF	On-Demand	Anodyne	CCR5	39	42
CC[C@@H](NC(=O)NC1CCN(CCOC(C)C)CC1)[C@H](O)c1ccccc1	ZINC000875338152	GF	On-Demand	Anodyne	MCHR1	15	43
COC(=O)C1(O)CN(C(=O)N[C@H](C)c2ccc(-c3cccnc3)cc2)C1	ZINC000875338172	FD	On-Demand	Anodyne	CYP11B2	26	41
COC(=O)C1(O)CN(C(=O)N[C@@H](C)c2ccc(-c3cccnc3)cc2)C1	ZINC000875338173	FD	On-Demand	Anodyne	CYP11B2	26	41
CC(=O)C1CCN(C(=O)N[C@@H](C)c2ccc(-c3cccnc3)cc2)CC1	ZINC000875338178	FH	On-Demand	Anodyne	PTAFR	17	42
CC(=O)C1CCN(C(=O)N[C@H](C)c2ccc(-c3cccnc3)cc2)CC1	ZINC000875338179	FH	On-Demand	Anodyne	PTAFR	17	42
O=C(NC1CCN(C2CCCCC2)CC1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875338184	GD	On-Demand	Anodyne	L3MBTL3	46	33
O=C(NC1CCN(C2CCCCC2)CC1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875338185	GD	On-Demand	Anodyne	L3MBTL3	46	33
O=C(NC1CCN(C2CCCCC2)CC1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875338186	GD	On-Demand	Anodyne	L3MBTL3	46	33
O=C(NC1CCN(C2CCCCC2)CC1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875338187	GD	On-Demand	Anodyne	L3MBTL3	46	33
CC(=O)C1CCN(C(=O)NC2CCN(C3CCCCC3)CC2)CC1	ZINC000875338221	EF	On-Demand	Anodyne	EPHX2	18	49
CC(=O)C1CCN(C(=O)NC2CCN(C3CCCCC3)CC2)CC1	ZINC000875338221	EF	On-Demand	Anodyne	L3MBTL3	58	37
COC(=O)N(C)NC(=O)NCc1ccc(-c2ccc(OC)cc2)s1	ZINC000875338226	EF	On-Demand	Reactive	HSD17B2	37	48
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccc(-c2cccnc2)cc1	ZINC000875338243	FI	On-Demand	Anodyne	PRCP	16	40
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccc(-c2cccnc2)cc1	ZINC000875338244	FI	On-Demand	Anodyne	PRCP	16	40
CONC(=O)C1CCN(C(=O)N[C@@H](C)c2ccc(-c3cccnc3)cc2)CC1	ZINC000875338247	GF	On-Demand	Anodyne	ACACA	20	40
CONC(=O)C1CCN(C(=O)N[C@@H](C)c2ccc(-c3cccnc3)cc2)CC1	ZINC000875338247	GF	On-Demand	Anodyne	ACACB	20	40
CONC(=O)C1CCN(C(=O)N[C@H](C)c2ccc(-c3cccnc3)cc2)CC1	ZINC000875338248	GF	On-Demand	Anodyne	ACACA	20	40
CONC(=O)C1CCN(C(=O)N[C@H](C)c2ccc(-c3cccnc3)cc2)CC1	ZINC000875338248	GF	On-Demand	Anodyne	ACACB	20	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)[C@@H](C)c2ccccc2)C1	ZINC000875338255	EG	On-Demand	Anodyne	ACE	26	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)[C@@H](C)c2ccccc2)C1	ZINC000875338256	EG	On-Demand	Anodyne	ACE	26	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)[C@H](C)c2ccccc2)C1	ZINC000875338257	EG	On-Demand	Anodyne	ACE	26	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)[C@H](C)c2ccccc2)C1	ZINC000875338258	EG	On-Demand	Anodyne	ACE	26	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2ccc(-c3cccnc3)cc2)C1	ZINC000875338265	GH	On-Demand	Anodyne	ACACB	23	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2ccc(-c3cccnc3)cc2)C1	ZINC000875338267	GH	On-Demand	Anodyne	ACACB	23	41
C[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1ccc(-c2cccnc2)cc1	ZINC000875338372	GG	On-Demand	Anodyne	CACNA1H	31	45
CC(=O)N(C)c1ccc(CNC(=O)NC2CCN(C3CCCCC3)CC2)cc1	ZINC000875338374	GG	On-Demand	Anodyne	EPHX2	26	47
CC(C)(C)OC(=O)N1CC[C@H]([C@@H](F)C(=O)Nc2cccnn2)C1	ZINC000875338408	DE	On-Demand	Anodyne	GPR119	58	49
CC(C)(C)OC(=O)N1CC[C@H]([C@H](F)C(=O)Nc2cccnn2)C1	ZINC000875338409	DE	On-Demand	Anodyne	GPR119	58	49
CC(C)(C)OC(=O)N1CC[C@@H]([C@H](F)C(=O)Nc2cccnn2)C1	ZINC000875338410	DE	On-Demand	Anodyne	GPR119	58	49
CC(C)(C)OC(=O)N1CC[C@@H]([C@@H](F)C(=O)Nc2cccnn2)C1	ZINC000875338411	DE	On-Demand	Anodyne	GPR119	58	49
O=C(NC1(C(=O)Nc2cccnn2)CC1)OCc1ccccc1	ZINC000875338414	DD	On-Demand	Anodyne	SLC12A5	51	33
O=C(NCCCCCCCN1CCCC1)N1CCC2(CCNC2=O)CC1	ZINC000875338432	FE	On-Demand	Anodyne	HNMT	41	35
O=C(NCCCCCCCN1CCCC1)N[C@H]1CCCn2nccc21	ZINC000875338436	EG	On-Demand	Anodyne	CCR3	25	42
O=C(NCCCCCCCN1CCCC1)N[C@H]1CCCn2nccc21	ZINC000875338436	EG	On-Demand	Anodyne	HNMT	41	35
O=C(NCCCCCCCN1CCCC1)N[C@@H]1CCCn2nccc21	ZINC000875338437	EG	On-Demand	Anodyne	CCR3	25	42
O=C(NCCCCCCCN1CCCC1)N[C@@H]1CCCn2nccc21	ZINC000875338437	EG	On-Demand	Anodyne	HNMT	41	35
O=C(NCCCCCCCN1CCCC1)NC1CN(c2ccncn2)C1	ZINC000875338465	FE	On-Demand	Anodyne	HTR1A	23	40
O=C(NCCCCCCCN1CCCC1)NC1CN(c2ccncn2)C1	ZINC000875338465	FE	On-Demand	Anodyne	HRH2	22	40
O=C(NCCCCCCCN1CCCC1)NC1CN(c2ccncn2)C1	ZINC000875338465	FE	On-Demand	Anodyne	DRD3	52	38
O=C(NCCCCCCCN1CCCC1)NC1CN(c2ccncn2)C1	ZINC000875338465	FE	On-Demand	Anodyne	CCR3	20	43
O=C(NCCCCCCCN1CCCC1)NC1CN(c2ccncn2)C1	ZINC000875338465	FE	On-Demand	Anodyne	HNMT	45	36
N#Cc1ccc(N2CCN(C(=O)NCCCCCCCN3CCCC3)CC2)cn1	ZINC000875338480	GF	On-Demand	Mild	HTR1A	33	40
N#Cc1ccc(N2CCN(C(=O)NCCCCCCCN3CCCC3)CC2)cn1	ZINC000875338480	GF	On-Demand	Mild	DRD2	31	41
N#Cc1ccc(N2CCN(C(=O)NCCCCCCCN3CCCC3)CC2)cn1	ZINC000875338480	GF	On-Demand	Mild	HTR2A	23	40
N#Cc1ccc(N2CCN(C(=O)NCCCCCCCN3CCCC3)CC2)cn1	ZINC000875338480	GF	On-Demand	Mild	HTR2C	16	40
N#Cc1ccc(N2CCN(C(=O)NCCCCCCCN3CCCC3)CC2)cn1	ZINC000875338480	GF	On-Demand	Mild	DRD3	54	41
Cc1cncc([C@@H]2CCCN2C(=O)NC2CCN(CCOC(C)C)CC2)c1	ZINC000875338506	FG	On-Demand	Anodyne	SSTR5	41	43
Cc1cncc([C@H]2CCCN2C(=O)NC2CCN(CCOC(C)C)CC2)c1	ZINC000875338507	FG	On-Demand	Anodyne	SSTR5	41	43
O=C(NC1CCN(C2CCCCC2)CC1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875338551	FG	On-Demand	Anodyne	L3MBTL3	48	34
O=C(NC1CCN(C2CCCCC2)CC1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875338552	FG	On-Demand	Anodyne	L3MBTL3	48	34
O=C(NC1CCN(C2CCCCC2)CC1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875338553	FG	On-Demand	Anodyne	L3MBTL3	48	34
O=C(NC1CCN(C2CCCCC2)CC1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875338554	FG	On-Demand	Anodyne	L3MBTL3	48	34
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccc(-c2cccnc2)cc1	ZINC000875338556	FF	On-Demand	Anodyne	PTAFR	21	43
CCOC(=O)c1cc(CNC(=O)NC2CCN(C3CCCCC3)CC2)on1	ZINC000875338557	GE	On-Demand	Anodyne	EPHX2	15	44
CO[C@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)Nc2cccnn2)C1	ZINC000875338678	FE	On-Demand	Anodyne	SLC12A5	42	35
CO[C@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)Nc2cccnn2)C1	ZINC000875338680	FE	On-Demand	Anodyne	SLC12A5	42	35
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)Nc2cccnn2)C1	ZINC000875338682	FE	On-Demand	Anodyne	SLC12A5	42	35
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)Nc2cccnn2)C1	ZINC000875338684	FE	On-Demand	Anodyne	SLC12A5	42	35
CO[C@@H]1C[C@@H](NC(=O)NCCCCCCCN2CCCC2)C1	ZINC000875338687	DF	On-Demand	Anodyne	EPHX2	23	48
CCC1(N(C)C)CCN(C(=O)NCCCCCCCN2CCCC2)CC1	ZINC000875338750	FH	On-Demand	Anodyne	ASAH1	49	32
O=C(NCC1(C(=O)Nc2cccnn2)CCCC1)OCc1ccccc1	ZINC000875338777	FF	On-Demand	Anodyne	CAPNS1	42	31
O=C(NCC1(C(=O)Nc2cccnn2)CCCC1)OCc1ccccc1	ZINC000875338777	FF	On-Demand	Anodyne	CAPN2	68	34
O=C(NCC1(C(=O)Nc2cccnn2)CCCC1)OCc1ccccc1	ZINC000875338777	FF	On-Demand	Anodyne	NPR	56	32
O=C(NCC1(C(=O)Nc2cccnn2)CCCC1)OCc1ccccc1	ZINC000875338777	FF	On-Demand	Anodyne	SLC12A5	46	33
O=C(NCCCCCCCN1CCCC1)N1Cc2cccc(O)c2C1	ZINC000875338788	EG	On-Demand	Clean	HTR1A	31	40
O=C(NCCCCCCCN1CCCC1)N1Cc2cccc(O)c2C1	ZINC000875338788	EG	On-Demand	Clean	DRD2	33	41
O=C(NCCCCCCCN1CCCC1)N1Cc2cccc(O)c2C1	ZINC000875338788	EG	On-Demand	Clean	DRD3	63	41
O=C(NCCCCCCCN1CCCC1)N1Cc2cccc(O)c2C1	ZINC000875338788	EG	On-Demand	Clean	HRH3	18	40
O=C(NCCCCCCCN1CCCC1)N1Cc2cccc(O)c2C1	ZINC000875338788	EG	On-Demand	Clean	HNMT	43	34
O=C(NCCCCCCCN1CCCC1)NCc1cccnc1O	ZINC000875338789	EF	On-Demand	Anodyne	HTR1A	29	43
O=C(NCCCCCCCN1CCCC1)NCc1cccnc1O	ZINC000875338789	EF	On-Demand	Anodyne	HRH2	24	41
O=C(NCCCCCCCN1CCCC1)NCc1cccnc1O	ZINC000875338789	EF	On-Demand	Anodyne	HTR2A	20	42
O=C(NCCCCCCCN1CCCC1)NCc1cccnc1O	ZINC000875338789	EF	On-Demand	Anodyne	DRD3	50	39
O=C(NCCCCCCCN1CCCC1)NCc1cccnc1O	ZINC000875338789	EF	On-Demand	Anodyne	HRH3	21	41
O=C(NCCCCCCCN1CCCC1)NCc1cccnc1O	ZINC000875338789	EF	On-Demand	Anodyne	CCR3	17	41
O=C(NCCCCCCCN1CCCC1)NCc1cccnc1O	ZINC000875338789	EF	On-Demand	Anodyne	CHRNA7	20	51
O=C(NCCCCCCCN1CCCC1)NCc1cccnc1O	ZINC000875338789	EF	On-Demand	Anodyne	HNMT	80	41
CC(=O)Nc1ccc2c(c1)CN(C(=O)NC1CCN(C3CCCCC3)CC1)CC2	ZINC000875338805	GH	On-Demand	Anodyne	L3MBTL3	29	41
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(C3CCCCC3)CC2)C1	ZINC000875338806	EF	On-Demand	Anodyne	L3MBTL3	52	40
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(C3CCCCC3)CC2)C1	ZINC000875338807	EF	On-Demand	Anodyne	L3MBTL3	52	40
C[C@@H](NC(=O)N1C[C@H]2CC=CC[C@H]2C1)c1ccc(-c2cccnc2)cc1	ZINC000875338835	EI	On-Demand	Anodyne	CYP11B2	23	40
C[C@H](NC(=O)N1C[C@H]2CC=CC[C@H]2C1)c1ccc(-c2cccnc2)cc1	ZINC000875338836	EI	On-Demand	Anodyne	CYP11B2	23	40
CN1CCN(C2CCN(C(=O)NC3CCN(C4CCCCC4)CC3)CC2)CC1	ZINC000875338837	GE	On-Demand	Anodyne	L3MBTL3	65	44
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(C4CCCCC4)CC3)C[C@@H]1C2	ZINC000875338851	FE	On-Demand	Anodyne	EPHX2	15	43
CC(=O)N(C)c1ccc(CNC(=O)NC2CCN(CCOC(C)C)CC2)cc1	ZINC000875338881	GE	On-Demand	Anodyne	MCHR1	21	47
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(C2CCCCC2)CC1	ZINC000875338890	EF	On-Demand	Anodyne	EPHX2	15	47
O=C(NCCCCCCCN1CCCC1)N[C@@H]1C[C@H]1C(F)(F)F	ZINC000875338986	EG	On-Demand	Anodyne	CCR3	15	40
O=C(NCCCCCCCN1CCCC1)N[C@@H]1CCO[C@H]1c1cc[nH]n1	ZINC000875339053	FF	On-Demand	Anodyne	CCR3	42	41
O=C(NCCCCCCCN1CCCC1)N[C@@H]1CCO[C@H]1c1cc[nH]n1	ZINC000875339053	FF	On-Demand	Anodyne	CHRNA7	15	41
O=C(NCCCCCCCN1CCCC1)N[C@@H]1CCO[C@H]1c1ccncc1	ZINC000875339056	FG	On-Demand	Anodyne	DRD3	45	37
O=C(NCCCCCCCN1CCCC1)N[C@@H]1CCO[C@H]1c1ccncc1	ZINC000875339056	FG	On-Demand	Anodyne	CHRNA7	20	45
O=C(NCCCCCCCN1CCCC1)N[C@@H]1CCO[C@H]1c1ccncc1	ZINC000875339056	FG	On-Demand	Anodyne	HNMT	41	35
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1cccnn1	ZINC000875339075	CE	On-Demand	Anodyne	MTNR1A	24	41
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1cccnn1	ZINC000875339075	CE	On-Demand	Anodyne	MTNR1B	26	41
O=C(NC1CCN(C2CCCCC2)CC1)N1Cc2cccc(O)c2C1	ZINC000875339102	EG	On-Demand	Clean	HRH3	15	55
O=C(NC1CCN(C2CCCCC2)CC1)N1Cc2cccc(O)c2C1	ZINC000875339102	EG	On-Demand	Clean	L3MBTL3	69	38
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(-c2cccnc2)cc1	ZINC000875339160	FF	On-Demand	Anodyne	PTAFR	20	42
CCC1(CC)CCCN1C(=O)NCc1ccc(C(N)=O)o1	ZINC000875339220	CE	On-Demand	Anodyne	SLC12A5	45	33
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)NCc1ccc(C(N)=O)o1	ZINC000875339233	GH	On-Demand	Anodyne	MDM2	45	31
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccn(C)c2)CC1	ZINC000875339298	EH	On-Demand	Anodyne	HTR1A	19	41
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccn(C)c2)CC1	ZINC000875339298	EH	On-Demand	Anodyne	DRD2	19	44
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccn(C)c2)CC1	ZINC000875339299	EH	On-Demand	Anodyne	HTR1A	19	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccn(C)c2)CC1	ZINC000875339299	EH	On-Demand	Anodyne	DRD2	19	44
CN(Cc1ncc[nH]1)C(=O)NCCCCCCCN1CCCC1	ZINC000875339305	DF	On-Demand	Anodyne	HNMT	57	35
O=C(NCCCCCCCN1CCCC1)N1CC(Cc2ccco2)C1	ZINC000875339308	EH	On-Demand	Anodyne	DRD3	41	38
O=C(NCCCCCCCN1CCCC1)N1CC(Cc2ccco2)C1	ZINC000875339308	EH	On-Demand	Anodyne	HNMT	40	35
C[C@H](NC(=O)NCCCCCCCN1CCCC1)c1ccns1	ZINC000875339309	EH	On-Demand	Anodyne	HRH2	17	40
C[C@H](NC(=O)NCCCCCCCN1CCCC1)c1ccns1	ZINC000875339309	EH	On-Demand	Anodyne	HNMT	48	35
C[C@@H](NC(=O)NCCCCCCCN1CCCC1)c1ccns1	ZINC000875339310	EH	On-Demand	Anodyne	HRH2	17	40
C[C@@H](NC(=O)NCCCCCCCN1CCCC1)c1ccns1	ZINC000875339310	EH	On-Demand	Anodyne	HNMT	48	35
C[C@H]1CCC[C@H](C)C1NC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875339326	EH	On-Demand	Anodyne	ROCK1	25	44
C[C@H]1CCC[C@H](C)C1NC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875339326	EH	On-Demand	Anodyne	ROCK2	18	44
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccon2)CC1	ZINC000875339343	EG	On-Demand	Anodyne	EPHX2	15	42
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccon2)CC1	ZINC000875339343	EG	On-Demand	Anodyne	SMO	33	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccon2)CC1	ZINC000875339345	EG	On-Demand	Anodyne	EPHX2	15	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccon2)CC1	ZINC000875339345	EG	On-Demand	Anodyne	SMO	33	41
CC(=O)c1ccc(NC(=O)N2CCN(c3c(F)c(F)c(F)c(F)c3F)CC2)cc1	ZINC000875339351	HH	On-Demand	Anodyne	PDGFRB	51	40
CC(=O)c1ccc(NC(=O)N2CCN(c3c(F)c(F)c(F)c(F)c3F)CC2)cc1	ZINC000875339351	HH	On-Demand	Anodyne	TRPV1	15	45
CC(=O)c1ccc(NC(=O)N2CCN(c3c(F)c(F)c(F)c(F)c3F)CC2)cc1	ZINC000875339351	HH	On-Demand	Anodyne	PRNP	47	38
CC(=O)c1ccc(NC(=O)N2CCN(c3c(F)c(F)c(F)c(F)c3F)CC2)cc1	ZINC000875339351	HH	On-Demand	Anodyne	TRPM8	31	41
COC(=O)CN(CCN1CCOCC1)C(=O)c1c(Cl)nn(C)c1Cl	ZINC000875339372	GC	On-Demand	Anodyne	CASR	49	36
O=C(NCCCCCCCN1CCCC1)N1CCN(c2nccnn2)CC1	ZINC000875339380	GD	On-Demand	Anodyne	HTR1A	25	47
O=C(NCCCCCCCN1CCCC1)N1CCN(c2nccnn2)CC1	ZINC000875339380	GD	On-Demand	Anodyne	DRD3	43	38
O=C(NCCCCCCCN1CCCC1)N1CCN(c2nccnn2)CC1	ZINC000875339380	GD	On-Demand	Anodyne	HNMT	44	35
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1ccc(-c2cccnc2)cc1	ZINC000875339416	FH	On-Demand	Anodyne	ACACA	24	40
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1ccc(-c2cccnc2)cc1	ZINC000875339416	FH	On-Demand	Anodyne	ACACB	23	40
CN1CC[C@H]2CN(C(=O)NC3CCN(C4CCCCC4)CC3)CC[C@@H]21	ZINC000875339419	EF	On-Demand	Anodyne	L3MBTL3	62	35
CN1CC[C@H]2CN(C(=O)NC3CCN(C4CCCCC4)CC3)CC[C@H]21	ZINC000875339420	EF	On-Demand	Anodyne	L3MBTL3	62	35
O=C(NCc1ccon1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875339480	DE	On-Demand	Anodyne	CPT1A	77	33
O=C(NCc1ccon1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875339481	DE	On-Demand	Anodyne	CPT1A	77	33
O=C(NCc1ccon1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875339482	DE	On-Demand	Anodyne	CPT1A	77	33
O=C(NCc1ccon1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875339483	DE	On-Demand	Anodyne	CPT1A	77	33
C[C@@H]1SCCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@H]1C	ZINC000875339487	EF	On-Demand	Anodyne	CTSB	25	42
C[C@@H]1SCCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@H]1C	ZINC000875339487	EF	On-Demand	Anodyne	CTSK	23	44
C[C@@H]1SCCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@H]1C	ZINC000875339487	EF	On-Demand	Anodyne	PREP	23	41
C[C@@H]1SCCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@H]1C	ZINC000875339487	EF	On-Demand	Anodyne	CAPN2	43	32
C[C@@H]1SCCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@H]1C	ZINC000875339487	EF	On-Demand	Anodyne	NAAA	46	35
C[C@@H]1SCCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@H]1C	ZINC000875339487	EF	On-Demand	Anodyne	SLC12A5	69	37
C[C@@H]1SCCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@@H]1C	ZINC000875339488	EF	On-Demand	Anodyne	CTSB	25	42
C[C@@H]1SCCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@@H]1C	ZINC000875339488	EF	On-Demand	Anodyne	CTSK	23	44
C[C@@H]1SCCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@@H]1C	ZINC000875339488	EF	On-Demand	Anodyne	PREP	23	41
C[C@@H]1SCCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@@H]1C	ZINC000875339488	EF	On-Demand	Anodyne	CAPN2	43	32
C[C@@H]1SCCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@@H]1C	ZINC000875339488	EF	On-Demand	Anodyne	NAAA	46	35
C[C@@H]1SCCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@@H]1C	ZINC000875339488	EF	On-Demand	Anodyne	SLC12A5	69	37
O=C(N[C@H]1CCN(C2CCOCC2)C1=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875339517	GD	On-Demand	Anodyne	EPHX2	17	40
O=C(N[C@@H]1CCN(C2CCOCC2)C1=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875339518	GD	On-Demand	Anodyne	EPHX2	17	40
O=C(N[C@H]1CCN(C2CCOCC2)C1=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875339519	GD	On-Demand	Anodyne	EPHX2	17	40
O=C(N[C@@H]1CCN(C2CCOCC2)C1=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875339521	GD	On-Demand	Anodyne	EPHX2	17	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	ACE	48	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	OPRM1	40	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	OPRD1	39	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	MME	112	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	ANPEP	81	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	CTRA_BOVIN	24	51
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	FCER2	103	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	CASP3	15	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	BMP1	16	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	KLK3	82	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	CTSB	85	48
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	PAPA1_CARPA	93	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	CYSP_TRYCR	73	49
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	CCKAR	42	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	CTSK	46	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	CTSL	72	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	CPA1	20	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	NPFFR2	42	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	TIMP3	93	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	CAPNS1	77	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	MMP3	37	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	GRIA1	44	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	HLA-DRB1	116	52
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	REN	59	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	MMP11	44	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	CTSS	32	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	CAPN1	111	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	MMP9	27	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	CAPN2	140	48
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	ACE2	73	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	MC1R	41	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	PLAU	24	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	LAP3	45	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	CTSV	36	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	MMP1	36	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	FPR1	76	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	CTRB_BOVIN	50	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	NPR	54	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	BLA1_STEMA	41	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	NPFFR1	57	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cccnn1	ZINC000875339570	DD	On-Demand	Anodyne	GPR142	86	43
O=C(NCCCCCCCN1CCCC1)N[C@H]1CCC[C@@H]1O	ZINC000875339579	DE	On-Demand	Anodyne	CCR3	18	41
O=C(NCc1ccon1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875339592	CE	On-Demand	Anodyne	EPHX2	20	40
O=C(NCc1ccon1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875339593	CE	On-Demand	Anodyne	EPHX2	20	40
CN(Cc1ccns1)C(=O)NCCCCCCCN1CCCC1	ZINC000875339642	EG	On-Demand	Anodyne	DRD3	40	39
CN(Cc1ccns1)C(=O)NCCCCCCCN1CCCC1	ZINC000875339642	EG	On-Demand	Anodyne	HNMT	50	35
O=C1[C@H](NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CCN1C1CCOCC1	ZINC000875339680	GD	On-Demand	Anodyne	BIRC3	43	33
O=C1[C@H](NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CCN1C1CCOCC1	ZINC000875339680	GD	On-Demand	Anodyne	BIRC8	44	33
O=C1[C@H](NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CCN1C1CCOCC1	ZINC000875339681	GD	On-Demand	Anodyne	BIRC3	43	33
O=C1[C@H](NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CCN1C1CCOCC1	ZINC000875339681	GD	On-Demand	Anodyne	BIRC8	44	33
O=C1[C@H](NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CCN1C1CCOCC1	ZINC000875339682	GD	On-Demand	Anodyne	BIRC3	43	33
O=C1[C@H](NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CCN1C1CCOCC1	ZINC000875339682	GD	On-Demand	Anodyne	BIRC8	44	33
O=C1[C@H](NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CCN1C1CCOCC1	ZINC000875339683	GD	On-Demand	Anodyne	BIRC3	43	33
O=C1[C@H](NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CCN1C1CCOCC1	ZINC000875339683	GD	On-Demand	Anodyne	BIRC8	44	33
C[C@H]1CCC[C@H](C)C1NC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875339697	EE	On-Demand	Anodyne	L3MBTL3	65	44
CC(=O)[C@@H]1CCCN(C(=O)NCCCCCCCN2CCCC2)C1	ZINC000875339711	EG	On-Demand	Anodyne	SLC6A1	46	37
CC(=O)[C@@H]1CCCN(C(=O)NCCCCCCCN2CCCC2)C1	ZINC000875339711	EG	On-Demand	Anodyne	DRD3	21	44
CC(=O)[C@@H]1CCCN(C(=O)NCCCCCCCN2CCCC2)C1	ZINC000875339711	EG	On-Demand	Anodyne	HRH3	15	42
CC(=O)[C@H]1CCCN(C(=O)NCCCCCCCN2CCCC2)C1	ZINC000875339712	EG	On-Demand	Anodyne	SLC6A1	46	37
CC(=O)[C@H]1CCCN(C(=O)NCCCCCCCN2CCCC2)C1	ZINC000875339712	EG	On-Demand	Anodyne	DRD3	21	44
CC(=O)[C@H]1CCCN(C(=O)NCCCCCCCN2CCCC2)C1	ZINC000875339712	EG	On-Demand	Anodyne	HRH3	15	42
C[C@H](NC(=O)NCCCCCCCN1CCCC1)c1ccnn1C	ZINC000875339715	EF	On-Demand	Anodyne	DRD2	22	40
C[C@H](NC(=O)NCCCCCCCN1CCCC1)c1ccnn1C	ZINC000875339715	EF	On-Demand	Anodyne	HRH2	18	40
C[C@H](NC(=O)NCCCCCCCN1CCCC1)c1ccnn1C	ZINC000875339715	EF	On-Demand	Anodyne	DRD3	45	40
C[C@H](NC(=O)NCCCCCCCN1CCCC1)c1ccnn1C	ZINC000875339715	EF	On-Demand	Anodyne	CHRNA7	21	46
C[C@H](NC(=O)NCCCCCCCN1CCCC1)c1ccnn1C	ZINC000875339715	EF	On-Demand	Anodyne	HNMT	48	35
C[C@@H](NC(=O)NCCCCCCCN1CCCC1)c1ccnn1C	ZINC000875339716	EF	On-Demand	Anodyne	DRD2	22	40
C[C@@H](NC(=O)NCCCCCCCN1CCCC1)c1ccnn1C	ZINC000875339716	EF	On-Demand	Anodyne	HRH2	18	40
C[C@@H](NC(=O)NCCCCCCCN1CCCC1)c1ccnn1C	ZINC000875339716	EF	On-Demand	Anodyne	DRD3	45	40
C[C@@H](NC(=O)NCCCCCCCN1CCCC1)c1ccnn1C	ZINC000875339716	EF	On-Demand	Anodyne	CHRNA7	21	46
C[C@@H](NC(=O)NCCCCCCCN1CCCC1)c1ccnn1C	ZINC000875339716	EF	On-Demand	Anodyne	HNMT	48	35
CC(C)(C)OC(=O)N[C@@H](C(=O)Nc1cccnn1)c1ccc(C(F)(F)F)cc1	ZINC000875339798	GH	On-Demand	Anodyne	AMP1_PLAFQ	31	48
CCC1(CC)CCCN1C(=O)NCc1ccn(C)c1	ZINC000875339829	CF	On-Demand	Anodyne	SLC12A5	63	37
O=C(NCc1ccon1)N1CCCC(F)(F)CC1	ZINC000875339944	CE	On-Demand	Anodyne	SMO	18	40
Cn1c(=O)oc2ccc(CNC(=O)NCCCCCCCN3CCCC3)cc21	ZINC000875339973	GF	On-Demand	Anodyne	HRH2	25	42
Cn1c(=O)oc2ccc(CNC(=O)NCCCCCCCN3CCCC3)cc21	ZINC000875339973	GF	On-Demand	Anodyne	DRD3	29	40
Cn1c(=O)oc2ccc(CNC(=O)NCCCCCCCN3CCCC3)cc21	ZINC000875339973	GF	On-Demand	Anodyne	CCR3	21	40
O=C(NCCCCCCCN1CCCC1)NCc1ccnc(F)c1	ZINC000875339997	EG	On-Demand	Anodyne	DRD2	26	42
O=C(NCCCCCCCN1CCCC1)NCc1ccnc(F)c1	ZINC000875339997	EG	On-Demand	Anodyne	HRH2	26	44
O=C(NCCCCCCCN1CCCC1)NCc1ccnc(F)c1	ZINC000875339997	EG	On-Demand	Anodyne	DRD3	44	42
O=C(NCCCCCCCN1CCCC1)NCc1ccnc(F)c1	ZINC000875339997	EG	On-Demand	Anodyne	HRH3	25	42
O=C(NCCCCCCCN1CCCC1)NCc1ccnc(F)c1	ZINC000875339997	EG	On-Demand	Anodyne	CCR3	28	45
O=C(NCCCCCCCN1CCCC1)NCc1ccnc(F)c1	ZINC000875339997	EG	On-Demand	Anodyne	CHRNA7	20	50
O=C(NCCCCCCCN1CCCC1)NCc1ccnc(F)c1	ZINC000875339997	EG	On-Demand	Anodyne	HNMT	90	42
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1c(F)cccc1Cl	ZINC000875340000	FE	On-Demand	Anodyne	EPHX2	21	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccn(C)c1	ZINC000875340007	CD	On-Demand	Anodyne	SLC6A4	33	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccn(C)c1	ZINC000875340007	CD	On-Demand	Anodyne	SLC6A3	65	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccn(C)c1	ZINC000875340008	CD	On-Demand	Anodyne	SLC6A4	33	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccn(C)c1	ZINC000875340008	CD	On-Demand	Anodyne	SLC6A3	65	40
O=C(NCCCCCCCN1CCCC1)NCc1nc(O)c2c(n1)CCOC2	ZINC000875340009	GE	On-Demand	Anodyne	WNT3A	51	34
NC(=O)[C@@H]1C[C@@H](NC(=O)NCCCCCCCN2CCCC2)C1	ZINC000875340017	DD	On-Demand	Anodyne	EPHX2	17	44
NC(=O)C1CC(NC(=O)NCCCCCCCN2CCCC2)C1	ZINC000875340018	DD	On-Demand	Anodyne	EPHX2	17	44
COC(=O)CN(CCN1CCOCC1)C(=O)c1sccc1CC#N	ZINC000875340030	FC	On-Demand	Mild	CASR	46	46
O=C(CCc1ccc(N2CCCS2(=O)=O)cc1)Nc1cccnn1	ZINC000875340052	ED	On-Demand	Anodyne	CDK1	19	43
O=C(N[C@H]1CCN(C2CCOCC2)C1=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875340144	GD	On-Demand	Anodyne	EPHX2	20	44
O=C(N[C@@H]1CCN(C2CCOCC2)C1=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875340145	GD	On-Demand	Anodyne	EPHX2	20	44
CN1CCN(C2CCN(C(=O)NCCCCCCCN3CCCC3)CC2)CC1	ZINC000875340176	GE	On-Demand	Anodyne	L3MBTL3	94	53
O=C(NCCCCCCCN1CCCC1)N1CCc2nc(C3CC3)ncc2C1	ZINC000875340177	GG	On-Demand	Anodyne	TBK1	46	35
O=C(Nc1nccs1)N1CCN(c2c(F)c(F)c(F)c(F)c2F)CC1	ZINC000875340239	GG	On-Demand	Anodyne	MAP1	104	39
CC(=O)N1CCC[C@@H]1C(=O)Oc1c(C)cccc1Cl	ZINC000875340249	CF	On-Demand	Anodyne	FKBP1A	45	34
CC(=O)N1CCC[C@@H]1C(=O)Oc1c(C)cccc1Cl	ZINC000875340249	CF	On-Demand	Anodyne	PREP	58	41
CC(C)(C)OC(=O)N[C@@H](C(=O)Nc1cccnn1)c1cccc(C(F)(F)F)c1	ZINC000875340330	GH	On-Demand	Anodyne	AMP1_PLAFQ	19	42
Cc1nccnc1[C@H](C)NC(=O)NCCCCCCCN1CCCC1	ZINC000875340341	EG	On-Demand	Anodyne	HRH2	18	41
Cc1nccnc1[C@H](C)NC(=O)NCCCCCCCN1CCCC1	ZINC000875340341	EG	On-Demand	Anodyne	HNMT	49	37
Cc1nccnc1[C@@H](C)NC(=O)NCCCCCCCN1CCCC1	ZINC000875340346	EG	On-Demand	Anodyne	HRH2	18	41
Cc1nccnc1[C@@H](C)NC(=O)NCCCCCCCN1CCCC1	ZINC000875340346	EG	On-Demand	Anodyne	HNMT	49	37
O=C(NC1[C@@H]2[C@H]3CC[C@@H](C3)[C@@H]12)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875340409	GE	On-Demand	Anodyne	ETHR	54	48
O=C(N[C@@H]1[C@H]2[C@H]3CC[C@@H](C3)[C@H]21)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875340410	GE	On-Demand	Anodyne	ETHR	54	48
O=C(NC1[C@H]2[C@H]3CC[C@@H](C3)[C@H]12)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875340411	GE	On-Demand	Anodyne	ETHR	54	48
O=C(N[C@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H]1[C@H]2[C@H]3CC[C@@H](C3)[C@H]21	ZINC000875340494	FE	On-Demand	Anodyne	CHRNA7	46	38
O=C(N[C@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H]1[C@H]2[C@H]3CC[C@@H](C3)[C@H]21	ZINC000875340494	FE	On-Demand	Anodyne	C3AR1	40	41
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H]1[C@H]2[C@H]3CC[C@@H](C3)[C@H]21	ZINC000875340495	FE	On-Demand	Anodyne	CHRNA7	46	38
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H]1[C@H]2[C@H]3CC[C@@H](C3)[C@H]21	ZINC000875340495	FE	On-Demand	Anodyne	C3AR1	40	41
O=C(NC1[C@@H]2[C@H]3CC[C@@H](C3)[C@@H]12)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875340496	FE	On-Demand	Anodyne	CHRNA7	46	38
O=C(NC1[C@@H]2[C@H]3CC[C@@H](C3)[C@@H]12)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875340496	FE	On-Demand	Anodyne	C3AR1	40	41
O=C(NC1[C@H]2[C@H]3CC[C@@H](C3)[C@H]12)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875340497	FE	On-Demand	Anodyne	CHRNA7	46	38
O=C(NC1[C@H]2[C@H]3CC[C@@H](C3)[C@H]12)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875340497	FE	On-Demand	Anodyne	C3AR1	40	41
COC(=O)N(C)NC(=O)NCc1ccc(OC)cc1OC1CCCC1	ZINC000875340574	FE	On-Demand	Reactive	MTNR1A	58	39
COC(=O)N(C)NC(=O)NCc1ccc(OC)cc1OC1CCCC1	ZINC000875340574	FE	On-Demand	Reactive	MTNR1B	41	39
O=C(N[C@H]1CCN(C2CCOCC2)C1=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875340610	GD	On-Demand	Anodyne	CHRM2	15	43
O=C(N[C@H]1CCN(C2CCOCC2)C1=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875340610	GD	On-Demand	Anodyne	CHRM3	16	43
O=C(N[C@H]1CCN(C2CCOCC2)C1=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875340610	GD	On-Demand	Anodyne	SIGMAR1	33	40
O=C(N[C@@H]1CCN(C2CCOCC2)C1=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875340611	GD	On-Demand	Anodyne	CHRM2	15	43
O=C(N[C@@H]1CCN(C2CCOCC2)C1=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875340611	GD	On-Demand	Anodyne	CHRM3	16	43
O=C(N[C@@H]1CCN(C2CCOCC2)C1=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875340611	GD	On-Demand	Anodyne	SIGMAR1	33	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccon1	ZINC000875340653	CC	On-Demand	Anodyne	SLC6A3	53	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccon1	ZINC000875340654	CC	On-Demand	Anodyne	SLC6A3	53	37
COc1ccccc1C[C@H](NC(=O)N1CC[C@@H]2[C@H](CCN2C)C1)C(C)C	ZINC000875340873	FF	On-Demand	Anodyne	BIRC2	33	43
COc1ccccc1C[C@H](NC(=O)N1CC[C@H]2[C@@H](CCN2C)C1)C(C)C	ZINC000875340876	FF	On-Demand	Anodyne	BIRC2	33	43
COc1ccccc1C[C@H](NC(=O)N1CC[C@@H]2[C@@H](CCN2C)C1)C(C)C	ZINC000875340877	FF	On-Demand	Anodyne	BIRC2	33	43
COc1ccccc1C[C@H](NC(=O)N1CC[C@H]2[C@H](CCN2C)C1)C(C)C	ZINC000875340878	FF	On-Demand	Anodyne	BIRC2	33	43
O=C(NCc1ccon1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875340956	CD	On-Demand	Anodyne	ETHR	46	32
O=C(NCc1ccon1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875340958	CD	On-Demand	Anodyne	ETHR	46	32
Cc1cccc(C(C)(C)NC(=O)c2c(Cl)nn(C)c2Cl)c1	ZINC000875341082	EH	On-Demand	Anodyne	IMDH_CRYPV	46	35
NC(=O)c1ccc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)o1	ZINC000875341107	FD	On-Demand	Anodyne	NPFFR1	41	38
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)NCc1ccon1	ZINC000875341128	EH	On-Demand	Anodyne	MDM2	65	31
O=C(NCc1ccon1)N(Cc1cccc(O)c1)[C@@H]1CC[C@@H](O)CC1	ZINC000875341189	EE	On-Demand	Anodyne	HSD17B2	17	41
O=C(N[C@@H]1CCN(C2CCOCC2)C1=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875341210	GE	On-Demand	Anodyne	OXTR	43	38
O=C(N[C@@H]1CCN(C2CCOCC2)C1=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875341211	GE	On-Demand	Anodyne	OXTR	43	38
O=C(N[C@H]1CCN(C2CCOCC2)C1=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875341212	GE	On-Demand	Anodyne	OXTR	43	38
O=C(N[C@H]1CCN(C2CCOCC2)C1=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875341213	GE	On-Demand	Anodyne	OXTR	43	38
COc1cccc(C(NC(=O)NC[C@H]2C[C@H](O)C2)c2cccc(OC)c2)c1	ZINC000875341226	FF	On-Demand	Anodyne	DRD4	41	32
COc1cccc(C(NC(=O)NC[C@H]2C[C@H](O)C2)c2cccc(OC)c2)c1	ZINC000875341226	FF	On-Demand	Anodyne	MTNR1A	43	40
COc1cccc(C(NC(=O)NC[C@H]2C[C@H](O)C2)c2cccc(OC)c2)c1	ZINC000875341226	FF	On-Demand	Anodyne	MTNR1B	41	40
COc1cccc(C(NC(=O)N2CC[C@@H](C(C)(C)O)C2)c2cccc(OC)c2)c1	ZINC000875341313	GH	On-Demand	Anodyne	DRD4	41	31
COc1cccc(C(NC(=O)N2CC[C@H](C(C)(C)O)C2)c2cccc(OC)c2)c1	ZINC000875341314	GH	On-Demand	Anodyne	DRD4	41	31
COc1ccccc1C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)C(C)C	ZINC000875341340	GD	On-Demand	Anodyne	TACR1	17	40
COc1ccccc1C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)C(C)C	ZINC000875341340	GD	On-Demand	Anodyne	CACNA1G	28	42
COc1ccccc1C[C@H](NC(=O)N1CCC(C(=O)NCCO)CC1)C(C)C	ZINC000875341341	GD	On-Demand	Anodyne	TACR1	17	40
COc1ccccc1C[C@H](NC(=O)N1CCC(C(=O)NCCO)CC1)C(C)C	ZINC000875341341	GD	On-Demand	Anodyne	CACNA1G	28	42
COC(=O)[C@@](C)(NC(=O)c1sccc1CC#N)C1CC1	ZINC000875341393	CD	On-Demand	Mild	AMY2	43	29
COc1ccccc1C[C@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)C(C)C	ZINC000875341476	EG	On-Demand	Anodyne	TACR1	28	43
COc1ccccc1C[C@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)C(C)C	ZINC000875341476	EG	On-Demand	Anodyne	BIRC2	39	45
COc1ccccc1C[C@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)C(C)C	ZINC000875341476	EG	On-Demand	Anodyne	Q9N6S8_PLAFA	18	43
COc1ccccc1C[C@@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)C(C)C	ZINC000875341477	EG	On-Demand	Anodyne	TACR1	28	43
COc1ccccc1C[C@@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)C(C)C	ZINC000875341477	EG	On-Demand	Anodyne	BIRC2	39	45
COc1ccccc1C[C@@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)C(C)C	ZINC000875341477	EG	On-Demand	Anodyne	Q9N6S8_PLAFA	18	43
COc1ccccc1C[C@H](NC(=O)N1CCC[C@H](C(C)=O)C1)C(C)C	ZINC000875341478	EG	On-Demand	Anodyne	TACR1	28	43
COc1ccccc1C[C@H](NC(=O)N1CCC[C@H](C(C)=O)C1)C(C)C	ZINC000875341478	EG	On-Demand	Anodyne	BIRC2	39	45
COc1ccccc1C[C@H](NC(=O)N1CCC[C@H](C(C)=O)C1)C(C)C	ZINC000875341478	EG	On-Demand	Anodyne	Q9N6S8_PLAFA	18	43
COc1ccccc1C[C@@H](NC(=O)N1CCC[C@H](C(C)=O)C1)C(C)C	ZINC000875341479	EG	On-Demand	Anodyne	TACR1	28	43
COc1ccccc1C[C@@H](NC(=O)N1CCC[C@H](C(C)=O)C1)C(C)C	ZINC000875341479	EG	On-Demand	Anodyne	BIRC2	39	45
COc1ccccc1C[C@@H](NC(=O)N1CCC[C@H](C(C)=O)C1)C(C)C	ZINC000875341479	EG	On-Demand	Anodyne	Q9N6S8_PLAFA	18	43
COC(=O)N(C)NC(=O)N[C@@H]1CCN(c2cc(OC)cc(OC)c2)C1	ZINC000875341565	FD	On-Demand	Reactive	MTNR1A	16	49
COC(=O)N(C)NC(=O)N[C@@H]1CCN(c2cc(OC)cc(OC)c2)C1	ZINC000875341565	FD	On-Demand	Reactive	MTNR1B	15	49
COC(=O)N(C)NC(=O)N[C@H]1CCN(c2cc(OC)cc(OC)c2)C1	ZINC000875341566	FD	On-Demand	Reactive	MTNR1A	16	49
COC(=O)N(C)NC(=O)N[C@H]1CCN(c2cc(OC)cc(OC)c2)C1	ZINC000875341566	FD	On-Demand	Reactive	MTNR1B	15	49
COC(=O)N(C)NC(=O)NC(c1cccc(OC)c1)c1cccc(OC)c1	ZINC000875341602	FF	On-Demand	Reactive	MTNR1A	35	40
COC(=O)N(C)NC(=O)NC(c1cccc(OC)c1)c1cccc(OC)c1	ZINC000875341602	FF	On-Demand	Reactive	MTNR1B	35	40
COc1cccc(C(NC(=O)N2CCC(C(C)=O)CC2)c2cccc(OC)c2)c1	ZINC000875341668	GH	On-Demand	Anodyne	DRD4	41	32
COc1cccc(C(NC(=O)N2CCC(C(C)=O)CC2)c2cccc(OC)c2)c1	ZINC000875341668	GH	On-Demand	Anodyne	MTNR1A	33	40
COc1cccc(C(NC(=O)N2CCC(C(C)=O)CC2)c2cccc(OC)c2)c1	ZINC000875341668	GH	On-Demand	Anodyne	MTNR1B	41	40
COc1ccccc1C[C@H](NC(=O)N1CCC(c2nnnn2C)CC1)C(C)C	ZINC000875341699	GE	On-Demand	Anodyne	IL2RA	51	32
COc1ccccc1C[C@@H](NC(=O)N1CCC(c2nnnn2C)CC1)C(C)C	ZINC000875341700	GE	On-Demand	Anodyne	IL2RA	51	32
COc1ccccc1C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)C(C)C	ZINC000875341705	DE	On-Demand	Anodyne	MBTPS1	41	35
COc1ccccc1C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)C(C)C	ZINC000875341706	DE	On-Demand	Anodyne	MBTPS1	41	35
CN1CCC[C@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1=O	ZINC000875341707	ED	On-Demand	Anodyne	ACE	38	43
CN1CCC[C@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1=O	ZINC000875341707	ED	On-Demand	Anodyne	MME	24	43
CN1CCC[C@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1=O	ZINC000875341707	ED	On-Demand	Anodyne	SIGMAR1	39	40
CN1CCC[C@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1=O	ZINC000875341707	ED	On-Demand	Anodyne	PREP	44	36
CN1CCC[C@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1=O	ZINC000875341707	ED	On-Demand	Anodyne	BIRC2	53	39
COc1ccccc1C[C@H](NC(=O)N1CCCN(C=O)CC1)C(C)C	ZINC000875341709	EE	On-Demand	Anodyne	Q6PRC7_IXORI	43	32
COc1ccccc1C[C@@H](NC(=O)N1CCCN(C=O)CC1)C(C)C	ZINC000875341710	EE	On-Demand	Anodyne	Q6PRC7_IXORI	43	32
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1c(F)cccc1Cl	ZINC000875341827	EE	On-Demand	Anodyne	CACNA1H	66	42
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1c(F)cccc1Cl	ZINC000875341827	EE	On-Demand	Anodyne	CCR1	45	38
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1c(F)cccc1Cl	ZINC000875341865	EH	On-Demand	Anodyne	REN	17	44
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1c(F)cccc1Cl	ZINC000875341868	EH	On-Demand	Anodyne	REN	17	44
COc1ccccc1C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)C(C)C	ZINC000875341888	EG	On-Demand	Anodyne	BIRC2	25	47
COc1ccccc1C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)C(C)C	ZINC000875341888	EG	On-Demand	Anodyne	MBTPS1	43	31
COc1ccccc1C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)C(C)C	ZINC000875341889	EG	On-Demand	Anodyne	BIRC2	25	47
COc1ccccc1C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)C(C)C	ZINC000875341889	EG	On-Demand	Anodyne	MBTPS1	43	31
COc1ccccc1C[C@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)C(C)C	ZINC000875341890	EG	On-Demand	Anodyne	BIRC2	25	47
COc1ccccc1C[C@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)C(C)C	ZINC000875341890	EG	On-Demand	Anodyne	MBTPS1	43	31
COc1ccccc1C[C@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)C(C)C	ZINC000875341891	EG	On-Demand	Anodyne	BIRC2	25	47
COc1ccccc1C[C@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)C(C)C	ZINC000875341891	EG	On-Demand	Anodyne	MBTPS1	43	31
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1c(F)cccc1Cl	ZINC000875341902	EG	On-Demand	Anodyne	CCR1	42	38
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1c(F)cccc1Cl	ZINC000875341903	EG	On-Demand	Anodyne	CCR1	42	38
CN1CCC[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1=O	ZINC000875341936	DB	On-Demand	Anodyne	BIRC2	41	33
COC(=O)CN(C(=O)[C@]1(C2CCCC2)CCNC1=O)c1ccccc1	ZINC000875341968	ED	On-Demand	Anodyne	AMY2	42	29
COC(=O)CN(C(=O)[C@@]1(C2CCCC2)CCNC1=O)c1ccccc1	ZINC000875341969	ED	On-Demand	Anodyne	AMY2	42	29
CN1CCC[C@H](NC(=O)N2CCC[C@](O)(c3ccccc3)C2)C1=O	ZINC000875342010	ED	On-Demand	Anodyne	EPHX2	18	46
CN1CCC[C@H](NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)C1=O	ZINC000875342012	ED	On-Demand	Anodyne	EPHX2	18	46
CN1CCC[C@H](NC(=O)N2C[C@@H]3C[C@H]2CN3c2ccccc2)C1=O	ZINC000875342094	ED	On-Demand	Anodyne	BIRC3	44	33
CN1CCC[C@H](NC(=O)N2C[C@@H]3C[C@H]2CN3c2ccccc2)C1=O	ZINC000875342094	ED	On-Demand	Anodyne	BIRC2	55	38
COc1ccccc1[C@H]1CCCN(C(=O)N[C@@H]2CCCN(C)C2=O)CC1	ZINC000875342107	FF	On-Demand	Anodyne	RBP4	32	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(C)C2=O)CC1	ZINC000875342108	FF	On-Demand	Anodyne	RBP4	32	41
COc1ccccc1[C@H]1CCCN(C(=O)N[C@H]2CCCN(C)C2=O)CC1	ZINC000875342109	FF	On-Demand	Anodyne	RBP4	32	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2CCCN(C)C2=O)CC1	ZINC000875342110	FF	On-Demand	Anodyne	RBP4	32	41
O=C(OCc1cnccn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875342135	CE	On-Demand	Anodyne	ACHE	34	41
O=C(OCc1cnccn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875342135	CE	On-Demand	Anodyne	LTA4H	23	41
O=C(OCc1cnccn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875342135	CE	On-Demand	Anodyne	SIGMAR1	41	44
O=C(OCc1cnccn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875342135	CE	On-Demand	Anodyne	SLC18A3	23	42
O=C(OCc1cnccn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875342135	CE	On-Demand	Anodyne	FAAH	16	41
O=C(OCc1cnccn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875342136	CE	On-Demand	Anodyne	ACHE	34	41
O=C(OCc1cnccn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875342136	CE	On-Demand	Anodyne	LTA4H	23	41
O=C(OCc1cnccn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875342136	CE	On-Demand	Anodyne	SIGMAR1	41	44
O=C(OCc1cnccn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875342136	CE	On-Demand	Anodyne	SLC18A3	23	42
O=C(OCc1cnccn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875342136	CE	On-Demand	Anodyne	FAAH	16	41
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(OC)c(C#N)c1	ZINC000875342218	GF	On-Demand	Mild	PDS	43	36
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCc1ccc(OC)c(C#N)c1	ZINC000875342219	GF	On-Demand	Mild	PDS	43	36
CN1CCC[C@H](NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)C1=O	ZINC000875342226	ED	On-Demand	Anodyne	ACE	19	41
CN1CCC[C@H](NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)C1=O	ZINC000875342226	ED	On-Demand	Anodyne	MME	16	41
CN1CCC[C@H](NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)C1=O	ZINC000875342226	ED	On-Demand	Anodyne	PTGER4	17	40
CN1CCC[C@H](NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)C1=O	ZINC000875342227	ED	On-Demand	Anodyne	ACE	19	41
CN1CCC[C@H](NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)C1=O	ZINC000875342227	ED	On-Demand	Anodyne	MME	16	41
CN1CCC[C@H](NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)C1=O	ZINC000875342227	ED	On-Demand	Anodyne	PTGER4	17	40
CN1CCC[C@H](NC(=O)NC2CC(Nc3ccccc3)C2)C1=O	ZINC000875342230	DD	On-Demand	Anodyne	ACE	21	42
CN1CCC[C@H](NC(=O)NC2CC(Nc3ccccc3)C2)C1=O	ZINC000875342230	DD	On-Demand	Anodyne	MME	16	42
CN1CCC[C@H](NC(=O)NC2CC(Nc3ccccc3)C2)C1=O	ZINC000875342230	DD	On-Demand	Anodyne	BIRC2	44	36
CN1CCC[C@H](NC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)C1=O	ZINC000875342245	ED	On-Demand	Anodyne	ACE	36	40
CN1CCC[C@H](NC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)C1=O	ZINC000875342245	ED	On-Demand	Anodyne	MME	20	40
CN1CCC[C@H](NC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)C1=O	ZINC000875342245	ED	On-Demand	Anodyne	XIAP	46	40
CN1CCC[C@H](NC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)C1=O	ZINC000875342245	ED	On-Demand	Anodyne	BIRC3	41	37
CN1CCC[C@H](NC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)C1=O	ZINC000875342245	ED	On-Demand	Anodyne	BIRC2	45	37
CN1CCC[C@H](NC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)C1=O	ZINC000875342246	ED	On-Demand	Anodyne	ACE	36	40
CN1CCC[C@H](NC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)C1=O	ZINC000875342246	ED	On-Demand	Anodyne	MME	20	40
CN1CCC[C@H](NC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)C1=O	ZINC000875342246	ED	On-Demand	Anodyne	XIAP	46	40
CN1CCC[C@H](NC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)C1=O	ZINC000875342246	ED	On-Demand	Anodyne	BIRC3	41	37
CN1CCC[C@H](NC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)C1=O	ZINC000875342246	ED	On-Demand	Anodyne	BIRC2	45	37
CN1CCC[C@H](NC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)C1=O	ZINC000875342247	ED	On-Demand	Anodyne	ACE	36	40
CN1CCC[C@H](NC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)C1=O	ZINC000875342247	ED	On-Demand	Anodyne	MME	20	40
CN1CCC[C@H](NC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)C1=O	ZINC000875342247	ED	On-Demand	Anodyne	XIAP	46	40
CN1CCC[C@H](NC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)C1=O	ZINC000875342247	ED	On-Demand	Anodyne	BIRC3	41	37
CN1CCC[C@H](NC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)C1=O	ZINC000875342247	ED	On-Demand	Anodyne	BIRC2	45	37
CN1CCC[C@H](NC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)C1=O	ZINC000875342248	ED	On-Demand	Anodyne	ACE	36	40
CN1CCC[C@H](NC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)C1=O	ZINC000875342248	ED	On-Demand	Anodyne	MME	20	40
CN1CCC[C@H](NC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)C1=O	ZINC000875342248	ED	On-Demand	Anodyne	XIAP	46	40
CN1CCC[C@H](NC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)C1=O	ZINC000875342248	ED	On-Demand	Anodyne	BIRC3	41	37
CN1CCC[C@H](NC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)C1=O	ZINC000875342248	ED	On-Demand	Anodyne	BIRC2	45	37
CN1CCC[C@H](NC(=O)N2CCC(c3nccc(-c4cccnc4)n3)CC2)C1=O	ZINC000875342292	GE	On-Demand	Anodyne	CALCRL	42	40
CS(=O)(=O)CC1(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875342533	GE	On-Demand	Anodyne	FKBP1A	17	43
CS(=O)(=O)CC1(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875342534	GE	On-Demand	Anodyne	FKBP1A	17	43
CS(=O)(=O)CC1(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875342535	GE	On-Demand	Anodyne	FKBP1A	17	43
CS(=O)(=O)CC1(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875342536	GE	On-Demand	Anodyne	FKBP1A	17	43
CS(=O)(=O)CC1(CNC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875342626	GE	On-Demand	Mild	CTSF	65	36
CS(=O)(=O)CC1(CNC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875342626	GE	On-Demand	Mild	CTSL	21	46
CS(=O)(=O)CC1(CNC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875342627	GE	On-Demand	Mild	CTSF	65	36
CS(=O)(=O)CC1(CNC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875342627	GE	On-Demand	Mild	CTSL	21	46
O=C(NC1CCN(C2CCCC2)CC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875342684	GH	On-Demand	Anodyne	OPRL1	22	45
O=C(NC1CCN(C2CCCC2)CC1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875342684	GH	On-Demand	Anodyne	SIGMAR1	17	41
CC[C@@H](CNC(=O)NN(C)C(=O)OC)Oc1ccccc1Cl	ZINC000875342695	EE	On-Demand	Reactive	PDS	38	42
CC(C)(CNC(=O)OC(C)(C)C)NC(=O)c1sccc1CC#N	ZINC000875342837	EF	On-Demand	Mild	PAPA1_CARPA	33	42
CN1CCC[C@H](NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)C1=O	ZINC000875342857	ED	On-Demand	Anodyne	ACE	42	42
CN1CCC[C@H](NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)C1=O	ZINC000875342857	ED	On-Demand	Anodyne	MME	23	42
CN1CCC[C@H](NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)C1=O	ZINC000875342857	ED	On-Demand	Anodyne	XIAP	50	38
CN1CCC[C@H](NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)C1=O	ZINC000875342857	ED	On-Demand	Anodyne	BIRC3	41	36
CN1CCC[C@H](NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)C1=O	ZINC000875342857	ED	On-Demand	Anodyne	BIRC2	46	36
CN1CCC[C@H](NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)C1=O	ZINC000875342857	ED	On-Demand	Anodyne	BIRC8	47	36
CN1CCC[C@H](NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)C1=O	ZINC000875342858	ED	On-Demand	Anodyne	ACE	42	42
CN1CCC[C@H](NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)C1=O	ZINC000875342858	ED	On-Demand	Anodyne	MME	23	42
CN1CCC[C@H](NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)C1=O	ZINC000875342858	ED	On-Demand	Anodyne	XIAP	50	38
CN1CCC[C@H](NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)C1=O	ZINC000875342858	ED	On-Demand	Anodyne	BIRC3	41	36
CN1CCC[C@H](NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)C1=O	ZINC000875342858	ED	On-Demand	Anodyne	BIRC2	46	36
CN1CCC[C@H](NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)C1=O	ZINC000875342858	ED	On-Demand	Anodyne	BIRC8	47	36
CN1CCC[C@H](NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)C1=O	ZINC000875342859	ED	On-Demand	Anodyne	ACE	42	42
CN1CCC[C@H](NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)C1=O	ZINC000875342859	ED	On-Demand	Anodyne	MME	23	42
CN1CCC[C@H](NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)C1=O	ZINC000875342859	ED	On-Demand	Anodyne	XIAP	50	38
CN1CCC[C@H](NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)C1=O	ZINC000875342859	ED	On-Demand	Anodyne	BIRC3	41	36
CN1CCC[C@H](NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)C1=O	ZINC000875342859	ED	On-Demand	Anodyne	BIRC2	46	36
CN1CCC[C@H](NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)C1=O	ZINC000875342859	ED	On-Demand	Anodyne	BIRC8	47	36
CN1CCC[C@H](NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)C1=O	ZINC000875342860	ED	On-Demand	Anodyne	ACE	42	42
CN1CCC[C@H](NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)C1=O	ZINC000875342860	ED	On-Demand	Anodyne	MME	23	42
CN1CCC[C@H](NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)C1=O	ZINC000875342860	ED	On-Demand	Anodyne	XIAP	50	38
CN1CCC[C@H](NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)C1=O	ZINC000875342860	ED	On-Demand	Anodyne	BIRC3	41	36
CN1CCC[C@H](NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)C1=O	ZINC000875342860	ED	On-Demand	Anodyne	BIRC2	46	36
CN1CCC[C@H](NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)C1=O	ZINC000875342860	ED	On-Demand	Anodyne	BIRC8	47	36
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCN(C4CCCC4)CC3)C[C@@H]1C2	ZINC000875342953	EE	On-Demand	Anodyne	EPHX2	15	40
CC[C@@H](CNC(=O)NC[C@@H]1CCO[C@@H]1C(=O)OC)Oc1ccccc1Cl	ZINC000875342965	GE	On-Demand	Anodyne	PDS	23	40
Cc1noc(C)c1[C@H](C)CNC(=O)C(=O)NCCCCC1CC1	ZINC000875343002	DE	On-Demand	Anodyne	BMP1	49	33
Cc1noc(C)c1[C@@H](C)CNC(=O)C(=O)NCCCCC1CC1	ZINC000875343003	DE	On-Demand	Anodyne	BMP1	49	33
CC[C@@H](NC(=O)NC1CCN(C2CCCC2)CC1)[C@@H](O)c1ccccc1	ZINC000875343009	FG	On-Demand	Anodyne	SIGMAR1	18	44
CC[C@@H](NC(=O)NC1CCN(C2CCCC2)CC1)[C@@H](O)c1ccccc1	ZINC000875343009	FG	On-Demand	Anodyne	TACR3	15	42
CC[C@@H](NC(=O)NC1CCN(C2CCCC2)CC1)[C@@H](O)c1ccccc1	ZINC000875343009	FG	On-Demand	Anodyne	EPHX2	32	41
CC[C@@H](NC(=O)NC1CCN(C2CCCC2)CC1)[C@@H](O)c1ccccc1	ZINC000875343009	FG	On-Demand	Anodyne	XIAP	53	38
CC[C@@H](NC(=O)NC1CCN(C2CCCC2)CC1)[C@H](O)c1ccccc1	ZINC000875343011	FG	On-Demand	Anodyne	SIGMAR1	18	44
CC[C@@H](NC(=O)NC1CCN(C2CCCC2)CC1)[C@H](O)c1ccccc1	ZINC000875343011	FG	On-Demand	Anodyne	TACR3	15	42
CC[C@@H](NC(=O)NC1CCN(C2CCCC2)CC1)[C@H](O)c1ccccc1	ZINC000875343011	FG	On-Demand	Anodyne	EPHX2	32	41
CC[C@@H](NC(=O)NC1CCN(C2CCCC2)CC1)[C@H](O)c1ccccc1	ZINC000875343011	FG	On-Demand	Anodyne	XIAP	53	38
CS(=O)(=O)CC1(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875343051	FD	On-Demand	Anodyne	ADRB3	15	40
CS(=O)(=O)CC1(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875343052	FD	On-Demand	Anodyne	ADRB3	15	40
COc1ccccc1[C@H]1CCCN(C(=O)NCC2(CS(C)(=O)=O)CC2)CC1	ZINC000875343062	GF	On-Demand	Anodyne	DRD2	16	42
COc1ccccc1[C@H]1CCCN(C(=O)NCC2(CS(C)(=O)=O)CC2)CC1	ZINC000875343062	GF	On-Demand	Anodyne	HCN1	53	38
COc1ccccc1[C@H]1CCCN(C(=O)NCC2(CS(C)(=O)=O)CC2)CC1	ZINC000875343062	GF	On-Demand	Anodyne	HCN4	50	34
COc1ccccc1[C@@H]1CCCN(C(=O)NCC2(CS(C)(=O)=O)CC2)CC1	ZINC000875343063	GF	On-Demand	Anodyne	DRD2	16	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCC2(CS(C)(=O)=O)CC2)CC1	ZINC000875343063	GF	On-Demand	Anodyne	HCN1	53	38
COc1ccccc1[C@@H]1CCCN(C(=O)NCC2(CS(C)(=O)=O)CC2)CC1	ZINC000875343063	GF	On-Demand	Anodyne	HCN4	50	34
CS(=O)(=O)CC1(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875343084	FD	On-Demand	Anodyne	TMPRSS11D	41	34
CS(=O)(=O)CC1(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875343085	FD	On-Demand	Anodyne	TMPRSS11D	41	34
CS(=O)(=O)CC1(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875343086	FD	On-Demand	Anodyne	TMPRSS11D	41	34
CS(=O)(=O)CC1(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875343087	FD	On-Demand	Anodyne	TMPRSS11D	41	34
CN1CCN(C2CCN(C(=O)C(=O)NCC(C)(C)C3CCCC3)CC2)CC1	ZINC000875343168	GD	On-Demand	Anodyne	L3MBTL3	41	39
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(C2CCCC2)CC1	ZINC000875343170	GF	On-Demand	Anodyne	SIGMAR1	17	46
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(C2CCCC2)CC1	ZINC000875343170	GF	On-Demand	Anodyne	CCR3	18	41
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCN(C2CCCC2)CC1	ZINC000875343170	GF	On-Demand	Anodyne	EPHX2	27	48
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(C2CCCC2)CC1	ZINC000875343171	GF	On-Demand	Anodyne	SIGMAR1	17	46
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(C2CCCC2)CC1	ZINC000875343171	GF	On-Demand	Anodyne	CCR3	18	41
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN(C2CCCC2)CC1	ZINC000875343171	GF	On-Demand	Anodyne	EPHX2	27	48
O=C(Nc1nccs1)N1CCN(S(=O)(=O)c2ccccc2C(F)(F)F)CC1	ZINC000875343275	HF	On-Demand	Anodyne	MAP1	82	35
O=C(Nc1nccs1)N1CCN(S(=O)(=O)c2ccccc2C(F)(F)F)CC1	ZINC000875343275	HF	On-Demand	Anodyne	RBP4	86	42
O=C(Nc1nccs1)N1CCN(S(=O)(=O)c2ccccc2C(F)(F)F)CC1	ZINC000875343275	HF	On-Demand	Anodyne	F13A1	25	40
CS(=O)(=O)CC1(CNC(=O)N2Cc3cccc(O)c3C2)CC1	ZINC000875343284	DD	On-Demand	Clean	NAMPT	15	40
CC[C@@H](CNC(=O)N1CCC(C(=O)NCCO)CC1)Oc1ccccc1Cl	ZINC000875343316	GE	On-Demand	Anodyne	EPHX2	18	44
O=C(NC1CCN(C2CCCC2)CC1)N1Cc2cccc(O)c2C1	ZINC000875343360	EF	On-Demand	Clean	HRH3	15	56
O=C(NC1CCN(C2CCCC2)CC1)N1Cc2cccc(O)c2C1	ZINC000875343360	EF	On-Demand	Clean	L3MBTL3	72	38
O=C(NC1CCN(C2CCCC2)CC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875343395	FG	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NC1CCN(C2CCCC2)CC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875343396	FG	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NC1CCN(C2CCCC2)CC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875343397	FG	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NC1CCN(C2CCCC2)CC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875343398	FG	On-Demand	Anodyne	SIGMAR1	15	40
CCC(F)(F)C(C)(C)CNC(=O)C(=O)NCc1ccc(OC)c(C#N)c1	ZINC000875343491	FE	On-Demand	Mild	MT-ND1	23	41
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(C2CCCC2)CC1	ZINC000875343521	DE	On-Demand	Anodyne	EPHX2	15	45
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCCSC3)cn2)cc1	ZINC000875343661	EF	On-Demand	Mild	ITK	18	48
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCCSC3)cn2)cc1	ZINC000875343661	EF	On-Demand	Mild	PANC	41	35
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCCSC3)cn2)cc1	ZINC000875343662	EF	On-Demand	Mild	ITK	18	48
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCCSC3)cn2)cc1	ZINC000875343662	EF	On-Demand	Mild	PANC	41	35
O=C(N[C@H]1CCCSC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875343666	DF	On-Demand	Anodyne	EPHX2	18	44
O=C(N[C@@H]1CCCSC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875343667	DF	On-Demand	Anodyne	EPHX2	18	44
O=C(N[C@H]1CCCSC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875343668	DF	On-Demand	Anodyne	EPHX2	18	44
O=C(N[C@@H]1CCCSC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875343669	DF	On-Demand	Anodyne	EPHX2	18	44
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCCN(C)C1=O	ZINC000875343684	CC	On-Demand	Anodyne	RIR1_HHV11	17	44
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCCN(C)C1=O	ZINC000875343686	CC	On-Demand	Anodyne	RIR1_HHV11	17	44
CCCCCCCNC(=O)C(=O)NCc1ccc(OC)c(C#N)c1	ZINC000875343709	EE	On-Demand	Mild	INHA	84	38
CCCCCCCNC(=O)C(=O)NCc1ccc(OC)c(C#N)c1	ZINC000875343709	EE	On-Demand	Mild	LPAR2	47	41
CCCCCCCNC(=O)C(=O)NCc1ccc(OC)c(C#N)c1	ZINC000875343709	EE	On-Demand	Mild	S1PR3	19	41
CCCCCCCNC(=O)C(=O)NCc1ccc(OC)c(C#N)c1	ZINC000875343709	EE	On-Demand	Mild	S1PR2	52	41
CCCCCCCNC(=O)C(=O)NCc1ccc(OC)c(C#N)c1	ZINC000875343709	EE	On-Demand	Mild	S1PR1	20	41
CCCCCCCNC(=O)C(=O)NCc1ccc(OC)c(C#N)c1	ZINC000875343709	EE	On-Demand	Mild	ASAH1	63	32
O=C(NC1CCN(C2CCCC2)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875343799	FG	On-Demand	Anodyne	EPHX2	23	44
O=C(NC1CCN(C2CCCC2)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875343800	FG	On-Demand	Anodyne	EPHX2	23	44
N#Cc1cccc([C@@H](NC(=O)NC2CCN(C3CCCC3)CC2)C(F)(F)F)c1	ZINC000875343801	GH	On-Demand	Mild	MCHR1	23	45
N#Cc1cccc([C@H](NC(=O)NC2CCN(C3CCCC3)CC2)C(F)(F)F)c1	ZINC000875343802	GH	On-Demand	Mild	MCHR1	23	45
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)c1sccc1CC#N	ZINC000875343837	FF	On-Demand	Mild	MAPK11	23	49
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)c1sccc1CC#N	ZINC000875343837	FF	On-Demand	Mild	MAPK14	18	49
C[C@@H](NC(=O)NCCC1CCN(CC(F)(F)F)CC1)c1cc2cnccc2o1	ZINC000875343838	GH	On-Demand	Anodyne	CACNA1I	48	31
C[C@H](NC(=O)NCCC1CCN(CC(F)(F)F)CC1)c1cc2cnccc2o1	ZINC000875343839	GH	On-Demand	Anodyne	CACNA1I	48	31
CC[C@@H](CNC(=O)N1CCC(CO)(CO)CC1)Oc1ccccc1F	ZINC000875343840	FD	On-Demand	Anodyne	HCN1	46	31
Cn1nc(Cl)c(C(=O)NC(C)(C)c2cccc(F)c2)c1Cl	ZINC000875343845	EH	On-Demand	Anodyne	IMDH_CRYPV	43	34
O=C(N[C@H]1CCCSC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875343870	FG	On-Demand	Anodyne	SMO	36	46
O=C(N[C@H]1CCCSC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875343870	FG	On-Demand	Anodyne	ETHR	63	50
O=C(N[C@@H]1CCCSC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875343871	FG	On-Demand	Anodyne	SMO	36	46
O=C(N[C@@H]1CCCSC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875343871	FG	On-Demand	Anodyne	ETHR	63	50
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)[C@@H](NC=O)C(C)C	ZINC000875343880	ED	On-Demand	Anodyne	MAPK14	16	46
CC[C@@H](CNC(=O)N1CCC(CO)(CO)CC1)Oc1ccccc1Cl	ZINC000875343961	FE	On-Demand	Anodyne	HCN1	46	31
CC[C@@H](CNC(=O)N1CCC(CO)(CO)CC1)Oc1ccccc1Cl	ZINC000875343961	FE	On-Demand	Anodyne	PDS	24	42
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1ccncc1CC	ZINC000875343981	DF	On-Demand	Mild	ASAH1	63	35
CCCCCCCNC(=O)C(=O)N[C@H](C)c1ccncc1CC	ZINC000875343982	DF	On-Demand	Mild	ASAH1	63	35
CC[C@]1(C(=O)Nc2cc(C(=O)N3CCOCC3)ccc2C)CCNC1=O	ZINC000875344044	FD	On-Demand	Anodyne	BTK	35	42
O=C(NC1CCN(C(=O)N[C@H]2CCCSC2)CC1)OCc1ccccc1	ZINC000875344047	GF	On-Demand	Anodyne	GRIN2B	25	43
O=C(NC1CCN(C(=O)N[C@H]2CCCSC2)CC1)OCc1ccccc1	ZINC000875344047	GF	On-Demand	Anodyne	CTSK	23	52
O=C(NC1CCN(C(=O)N[C@H]2CCCSC2)CC1)OCc1ccccc1	ZINC000875344047	GF	On-Demand	Anodyne	CTSL	31	52
O=C(NC1CCN(C(=O)N[C@H]2CCCSC2)CC1)OCc1ccccc1	ZINC000875344047	GF	On-Demand	Anodyne	PREP	30	41
O=C(NC1CCN(C(=O)N[C@H]2CCCSC2)CC1)OCc1ccccc1	ZINC000875344047	GF	On-Demand	Anodyne	EPHX2	43	41
O=C(NC1CCN(C(=O)N[C@H]2CCCSC2)CC1)OCc1ccccc1	ZINC000875344047	GF	On-Demand	Anodyne	TGM2	29	44
O=C(NC1CCN(C(=O)N[C@H]2CCCSC2)CC1)OCc1ccccc1	ZINC000875344047	GF	On-Demand	Anodyne	F13A1	26	44
O=C(NC1CCN(C(=O)N[C@H]2CCCSC2)CC1)OCc1ccccc1	ZINC000875344047	GF	On-Demand	Anodyne	BIRC2	15	40
O=C(NC1CCN(C(=O)N[C@H]2CCCSC2)CC1)OCc1ccccc1	ZINC000875344047	GF	On-Demand	Anodyne	SLC12A5	46	34
O=C(NC1CCN(C(=O)N[C@@H]2CCCSC2)CC1)OCc1ccccc1	ZINC000875344048	GF	On-Demand	Anodyne	GRIN2B	25	43
O=C(NC1CCN(C(=O)N[C@@H]2CCCSC2)CC1)OCc1ccccc1	ZINC000875344048	GF	On-Demand	Anodyne	CTSK	23	52
O=C(NC1CCN(C(=O)N[C@@H]2CCCSC2)CC1)OCc1ccccc1	ZINC000875344048	GF	On-Demand	Anodyne	CTSL	31	52
O=C(NC1CCN(C(=O)N[C@@H]2CCCSC2)CC1)OCc1ccccc1	ZINC000875344048	GF	On-Demand	Anodyne	PREP	30	41
O=C(NC1CCN(C(=O)N[C@@H]2CCCSC2)CC1)OCc1ccccc1	ZINC000875344048	GF	On-Demand	Anodyne	EPHX2	43	41
O=C(NC1CCN(C(=O)N[C@@H]2CCCSC2)CC1)OCc1ccccc1	ZINC000875344048	GF	On-Demand	Anodyne	TGM2	29	44
O=C(NC1CCN(C(=O)N[C@@H]2CCCSC2)CC1)OCc1ccccc1	ZINC000875344048	GF	On-Demand	Anodyne	F13A1	26	44
O=C(NC1CCN(C(=O)N[C@@H]2CCCSC2)CC1)OCc1ccccc1	ZINC000875344048	GF	On-Demand	Anodyne	BIRC2	15	40
O=C(NC1CCN(C(=O)N[C@@H]2CCCSC2)CC1)OCc1ccccc1	ZINC000875344048	GF	On-Demand	Anodyne	SLC12A5	46	34
COCC(C)(C)CCNC(=O)NCCC1CCN(CC(F)(F)F)CC1	ZINC000875344061	FG	On-Demand	Anodyne	CACNA1I	43	34
CC[C@@H](NC(=O)C(=O)NCC1(COC)CCC1)c1cccc(OC)c1OC	ZINC000875344066	GE	On-Demand	Anodyne	HCN1	50	32
CC[C@@H](NC(=O)C(=O)NCC1(COC)CCC1)c1cccc(OC)c1OC	ZINC000875344066	GE	On-Demand	Anodyne	HCN4	47	32
O=C(NCCCOC1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875344098	GE	On-Demand	Anodyne	DRD4	35	43
O=C(NCCCOC1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875344098	GE	On-Demand	Anodyne	ACHE	47	48
O=C(NCCCOC1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875344098	GE	On-Demand	Anodyne	HRH2	34	45
O=C(NCCCOC1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875344098	GE	On-Demand	Anodyne	HTR4	34	43
O=C(NCCCOC1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875344098	GE	On-Demand	Anodyne	SIGMAR1	47	54
O=C(NCCCOC1CCN(Cc2ccccc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875344098	GE	On-Demand	Anodyne	CCR3	43	42
CC[C@@H](NC(=O)N1CC[C@]2(CCc3ccccc32)C1)c1nnc2n1CCCCC2	ZINC000875344178	GH	On-Demand	Anodyne	OXTR	43	35
CC[C@@H](NC(=O)N1CC[C@@]2(CCc3ccccc32)C1)c1nnc2n1CCCCC2	ZINC000875344181	GH	On-Demand	Anodyne	OXTR	43	35
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C1(F)CCOCC1	ZINC000875344241	FD	On-Demand	Anodyne	CNR2	15	40
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C1(F)CCOCC1	ZINC000875344241	FD	On-Demand	Anodyne	BTK	34	43
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C1(F)CCOCC1	ZINC000875344241	FD	On-Demand	Anodyne	LRRK2	17	41
CN1CCN(C(=O)NCCC2CCN(CC(F)(F)F)CC2)Cc2cccnc21	ZINC000875344246	GF	On-Demand	Anodyne	SIRT3	41	33
CN1CCN(C(=O)NCCC2CCN(CC(F)(F)F)CC2)Cc2cccnc21	ZINC000875344246	GF	On-Demand	Anodyne	SIRT2	45	33
CN1CCN(C(=O)NCCC2CCN(CC(F)(F)F)CC2)Cc2cccnc21	ZINC000875344246	GF	On-Demand	Anodyne	SIRT1	41	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)C1	ZINC000875344255	GE	On-Demand	Anodyne	ACHE	20	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC[C@H]2C[C@H](C)N(Cc3ccccc3)C2)C1	ZINC000875344256	GE	On-Demand	Anodyne	ACHE	20	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)C1	ZINC000875344257	GE	On-Demand	Anodyne	ACHE	20	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)C1	ZINC000875344258	GE	On-Demand	Anodyne	ACHE	20	42
CN(CCNC(=O)N[C@H]1CCN(CC(C)(C)O)C1)Cc1ccc(F)cc1	ZINC000875344320	FD	On-Demand	Anodyne	CCR3	81	45
CN(CCNC(=O)N[C@H]1CCN(CC(C)(C)O)C1)Cc1ccc(F)cc1	ZINC000875344320	FD	On-Demand	Anodyne	MCHR1	24	45
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875344397	FF	On-Demand	Anodyne	CHRM2	23	43
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875344397	FF	On-Demand	Anodyne	DRD2	15	50
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875344397	FF	On-Demand	Anodyne	DRD4	47	50
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875344397	FF	On-Demand	Anodyne	ACHE	40	41
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875344397	FF	On-Demand	Anodyne	CHRM3	29	43
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875344397	FF	On-Demand	Anodyne	SIGMAR1	45	44
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875344397	FF	On-Demand	Anodyne	MLNR	50	35
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875344397	FF	On-Demand	Anodyne	MCHR1	15	46
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875344397	FF	On-Demand	Anodyne	CYP2J2	47	34
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875344402	FF	On-Demand	Anodyne	CHRM2	23	43
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875344402	FF	On-Demand	Anodyne	DRD2	15	50
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875344402	FF	On-Demand	Anodyne	DRD4	47	50
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875344402	FF	On-Demand	Anodyne	ACHE	40	41
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875344402	FF	On-Demand	Anodyne	CHRM3	29	43
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875344402	FF	On-Demand	Anodyne	SIGMAR1	45	44
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875344402	FF	On-Demand	Anodyne	MLNR	50	35
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875344402	FF	On-Demand	Anodyne	MCHR1	15	46
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875344402	FF	On-Demand	Anodyne	CYP2J2	47	34
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875344403	FF	On-Demand	Anodyne	CHRM2	23	43
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875344403	FF	On-Demand	Anodyne	DRD2	15	50
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875344403	FF	On-Demand	Anodyne	DRD4	47	50
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875344403	FF	On-Demand	Anodyne	ACHE	40	41
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875344403	FF	On-Demand	Anodyne	CHRM3	29	43
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875344403	FF	On-Demand	Anodyne	SIGMAR1	45	44
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875344403	FF	On-Demand	Anodyne	MLNR	50	35
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875344403	FF	On-Demand	Anodyne	MCHR1	15	46
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875344403	FF	On-Demand	Anodyne	CYP2J2	47	34
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875344404	FF	On-Demand	Anodyne	CHRM2	23	43
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875344404	FF	On-Demand	Anodyne	DRD2	15	50
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875344404	FF	On-Demand	Anodyne	DRD4	47	50
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875344404	FF	On-Demand	Anodyne	ACHE	40	41
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875344404	FF	On-Demand	Anodyne	CHRM3	29	43
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875344404	FF	On-Demand	Anodyne	SIGMAR1	45	44
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875344404	FF	On-Demand	Anodyne	MLNR	50	35
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875344404	FF	On-Demand	Anodyne	MCHR1	15	46
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875344404	FF	On-Demand	Anodyne	CYP2J2	47	34
CN(CCNC(=O)N1CCC(C(=O)NCCO)CC1)Cc1ccc(F)cc1	ZINC000875344438	GC	On-Demand	Anodyne	CACNA1G	41	42
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875344477	GG	On-Demand	Anodyne	CHRM2	15	46
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875344477	GG	On-Demand	Anodyne	DRD2	15	49
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875344477	GG	On-Demand	Anodyne	DRD4	44	49
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875344477	GG	On-Demand	Anodyne	ACHE	35	40
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875344477	GG	On-Demand	Anodyne	CHRM3	15	46
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875344477	GG	On-Demand	Anodyne	SIGMAR1	56	42
O=C(NCCC1CCN(CC(F)(F)F)CC1)NCc1ccnc(F)c1	ZINC000875344478	FF	On-Demand	Anodyne	CCR3	22	42
O=C(NCCC1CCN(CC(F)(F)F)CC1)NCc1ccnc(F)c1	ZINC000875344478	FF	On-Demand	Anodyne	HPGDS	36	40
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875344479	GG	On-Demand	Anodyne	CHRM2	15	46
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875344479	GG	On-Demand	Anodyne	DRD2	15	49
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875344479	GG	On-Demand	Anodyne	DRD4	44	49
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875344479	GG	On-Demand	Anodyne	ACHE	35	40
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875344479	GG	On-Demand	Anodyne	CHRM3	15	46
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875344479	GG	On-Demand	Anodyne	SIGMAR1	56	42
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875344480	GG	On-Demand	Anodyne	CHRM2	15	46
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875344480	GG	On-Demand	Anodyne	DRD2	15	49
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875344480	GG	On-Demand	Anodyne	DRD4	44	49
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875344480	GG	On-Demand	Anodyne	ACHE	35	40
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875344480	GG	On-Demand	Anodyne	CHRM3	15	46
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875344480	GG	On-Demand	Anodyne	SIGMAR1	56	42
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875344485	GG	On-Demand	Anodyne	CHRM2	15	46
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875344485	GG	On-Demand	Anodyne	DRD2	15	49
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875344485	GG	On-Demand	Anodyne	DRD4	44	49
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875344485	GG	On-Demand	Anodyne	ACHE	35	40
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875344485	GG	On-Demand	Anodyne	CHRM3	15	46
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875344485	GG	On-Demand	Anodyne	SIGMAR1	56	42
COc1cccc(C(C)(C)C(=O)Nc2cc(C(=O)N3CCOCC3)ccc2C)c1	ZINC000875344495	GG	On-Demand	Anodyne	DRD4	42	33
COc1cccc(C(C)(C)C(=O)Nc2cc(C(=O)N3CCOCC3)ccc2C)c1	ZINC000875344495	GG	On-Demand	Anodyne	BTK	38	40
CN(CCNC(=O)NC[C@H]1C[C@H](O)C1)Cc1ccc(F)cc1	ZINC000875344497	DD	On-Demand	Anodyne	CCR3	23	40
CN(CCNC(=O)N1CC[C@H](C(C)(C)O)C1)Cc1ccc(F)cc1	ZINC000875344594	EE	On-Demand	Anodyne	CCR3	43	35
CN(CCNC(=O)N1CC[C@H](C(C)(C)O)C1)Cc1ccc(F)cc1	ZINC000875344594	EE	On-Demand	Anodyne	MLNR	47	36
CN(CCNC(=O)N1CC[C@@H](C(C)(C)O)C1)Cc1ccc(F)cc1	ZINC000875344595	EE	On-Demand	Anodyne	CCR3	43	35
CN(CCNC(=O)N1CC[C@@H](C(C)(C)O)C1)Cc1ccc(F)cc1	ZINC000875344595	EE	On-Demand	Anodyne	MLNR	47	36
N#Cc1ccc2c(c1)C[C@H](NC(=O)NCCC1CCN(CC(F)(F)F)CC1)C2	ZINC000875344603	GF	On-Demand	Mild	CCR3	19	42
N#Cc1ccc2c(c1)C[C@@H](NC(=O)NCCC1CCN(CC(F)(F)F)CC1)C2	ZINC000875344604	GF	On-Demand	Mild	CCR3	19	42
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NCC(C)(C)S(C)(=O)=O	ZINC000875344619	GF	On-Demand	Anodyne	FKBP1A	37	41
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NCC(C)(C)S(C)(=O)=O	ZINC000875344619	GF	On-Demand	Anodyne	SIGMAR1	18	46
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NCC(C)(C)S(C)(=O)=O	ZINC000875344619	GF	On-Demand	Anodyne	CACNA1G	20	41
Cn1nc(Cl)c(C(=O)NC(C)(C)c2cccc(Cl)c2)c1Cl	ZINC000875344791	EI	On-Demand	Anodyne	IMDH_CRYPV	49	35
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C1(C)CC(F)(F)C1	ZINC000875344823	FF	On-Demand	Anodyne	LRRK2	16	40
CN1CCN(C2CCN(C(=O)N[C@H]3CCCSC3)CC2)CC1	ZINC000875344860	ED	On-Demand	Anodyne	L3MBTL3	47	40
CN1CCN(C2CCN(C(=O)N[C@@H]3CCCSC3)CC2)CC1	ZINC000875344861	ED	On-Demand	Anodyne	L3MBTL3	47	40
CC(=O)C1CCN(C(=O)C(=O)NCC[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)CC1	ZINC000875344898	GE	On-Demand	Anodyne	ACHE	22	42
CC(=O)C1CCN(C(=O)C(=O)NCC[C@H]2C[C@H](C)N(Cc3ccccc3)C2)CC1	ZINC000875344899	GE	On-Demand	Anodyne	ACHE	22	42
CC(=O)C1CCN(C(=O)C(=O)NCC[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)CC1	ZINC000875344900	GE	On-Demand	Anodyne	ACHE	22	42
CC(=O)C1CCN(C(=O)C(=O)NCC[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)CC1	ZINC000875344901	GE	On-Demand	Anodyne	ACHE	22	42
O=C(N[C@H]1CCCSC1)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875344914	EG	On-Demand	Anodyne	C3AR1	40	41
O=C(N[C@@H]1CCCSC1)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875344915	EG	On-Demand	Anodyne	C3AR1	40	41
O=C(N[C@H]1CCCSC1)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875344916	EG	On-Demand	Anodyne	C3AR1	40	41
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)N[C@@H]1CCCSC1	ZINC000875344917	EG	On-Demand	Anodyne	C3AR1	40	41
Cc1noc(C)c1[C@H](C)CNC(=O)C(=O)NCc1cccc2ncccc12	ZINC000875344964	FE	On-Demand	Anodyne	P2RX7	15	43
Cc1noc(C)c1[C@@H](C)CNC(=O)C(=O)NCc1cccc2ncccc12	ZINC000875344965	FE	On-Demand	Anodyne	P2RX7	15	43
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875345059	ED	On-Demand	Reactive	CHRM2	17	40
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875345059	ED	On-Demand	Reactive	DRD2	18	55
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875345059	ED	On-Demand	Reactive	DRD4	52	55
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875345059	ED	On-Demand	Reactive	ACHE	40	42
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875345059	ED	On-Demand	Reactive	DRD3	16	55
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875345059	ED	On-Demand	Reactive	LTA4H	20	41
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875345059	ED	On-Demand	Reactive	SIGMAR1	52	45
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875345059	ED	On-Demand	Reactive	CCR5	27	42
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875345059	ED	On-Demand	Reactive	SLC18A3	18	41
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875345059	ED	On-Demand	Reactive	MLNR	43	34
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875345059	ED	On-Demand	Reactive	MCHR1	24	52
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875345062	ED	On-Demand	Reactive	CHRM2	17	40
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875345062	ED	On-Demand	Reactive	DRD2	18	55
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875345062	ED	On-Demand	Reactive	DRD4	52	55
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875345062	ED	On-Demand	Reactive	ACHE	40	42
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875345062	ED	On-Demand	Reactive	DRD3	16	55
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875345062	ED	On-Demand	Reactive	LTA4H	20	41
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875345062	ED	On-Demand	Reactive	SIGMAR1	52	45
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875345062	ED	On-Demand	Reactive	CCR5	27	42
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875345062	ED	On-Demand	Reactive	SLC18A3	18	41
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875345062	ED	On-Demand	Reactive	MLNR	43	34
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875345062	ED	On-Demand	Reactive	MCHR1	24	52
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875345064	ED	On-Demand	Reactive	CHRM2	17	40
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875345064	ED	On-Demand	Reactive	DRD2	18	55
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875345064	ED	On-Demand	Reactive	DRD4	52	55
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875345064	ED	On-Demand	Reactive	ACHE	40	42
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875345064	ED	On-Demand	Reactive	DRD3	16	55
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875345064	ED	On-Demand	Reactive	LTA4H	20	41
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875345064	ED	On-Demand	Reactive	SIGMAR1	52	45
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875345064	ED	On-Demand	Reactive	CCR5	27	42
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875345064	ED	On-Demand	Reactive	SLC18A3	18	41
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875345064	ED	On-Demand	Reactive	MLNR	43	34
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875345064	ED	On-Demand	Reactive	MCHR1	24	52
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)c1scnc1C(F)F	ZINC000875345065	GG	On-Demand	Anodyne	MAPK11	22	48
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)c1scnc1C(F)F	ZINC000875345065	GG	On-Demand	Anodyne	MAPK14	29	48
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)c1scnc1C(F)F	ZINC000875345065	GG	On-Demand	Anodyne	BTK	36	42
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)c1scnc1C(F)F	ZINC000875345065	GG	On-Demand	Anodyne	LRRK2	18	41
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875345066	ED	On-Demand	Reactive	CHRM2	17	40
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875345066	ED	On-Demand	Reactive	DRD2	18	55
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875345066	ED	On-Demand	Reactive	DRD4	52	55
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875345066	ED	On-Demand	Reactive	ACHE	40	42
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875345066	ED	On-Demand	Reactive	DRD3	16	55
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875345066	ED	On-Demand	Reactive	LTA4H	20	41
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875345066	ED	On-Demand	Reactive	SIGMAR1	52	45
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875345066	ED	On-Demand	Reactive	CCR5	27	42
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875345066	ED	On-Demand	Reactive	SLC18A3	18	41
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875345066	ED	On-Demand	Reactive	MLNR	43	34
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875345066	ED	On-Demand	Reactive	MCHR1	24	52
C[C@@H](NC(=O)NCCC1CCN(CC(F)(F)F)CC1)c1ccccc1O	ZINC000875345069	FG	On-Demand	Clean	ACHE	19	44
C[C@@H](NC(=O)NCCC1CCN(CC(F)(F)F)CC1)c1ccccc1O	ZINC000875345069	FG	On-Demand	Clean	HPGDS	35	40
C[C@H](NC(=O)NCCC1CCN(CC(F)(F)F)CC1)c1ccccc1O	ZINC000875345070	FG	On-Demand	Clean	ACHE	19	44
C[C@H](NC(=O)NCCC1CCN(CC(F)(F)F)CC1)c1ccccc1O	ZINC000875345070	FG	On-Demand	Clean	HPGDS	35	40
COc1ccc([C@@H]2CN(C(=O)N[C@H]3CCCSC3)CCO2)cc1	ZINC000875345096	EF	On-Demand	Anodyne	MMP13	15	40
COc1ccc([C@@H]2CN(C(=O)N[C@H]3CCCSC3)CCO2)cc1	ZINC000875345096	EF	On-Demand	Anodyne	MMP3	18	40
COc1ccc([C@@H]2CN(C(=O)N[C@H]3CCCSC3)CCO2)cc1	ZINC000875345096	EF	On-Demand	Anodyne	MMP1	19	40
COc1ccc([C@@H]2CN(C(=O)N[C@@H]3CCCSC3)CCO2)cc1	ZINC000875345097	EF	On-Demand	Anodyne	MMP13	15	40
COc1ccc([C@@H]2CN(C(=O)N[C@@H]3CCCSC3)CCO2)cc1	ZINC000875345097	EF	On-Demand	Anodyne	MMP3	18	40
COc1ccc([C@@H]2CN(C(=O)N[C@@H]3CCCSC3)CCO2)cc1	ZINC000875345097	EF	On-Demand	Anodyne	MMP1	19	40
CN1CCC(CNC(=O)N[C@H]2CCCSC2)(c2ccccc2)CC1	ZINC000875345115	EF	On-Demand	Anodyne	KCNA3	49	42
CN1CCC(CNC(=O)N[C@H]2CCCSC2)(c2ccccc2)CC1	ZINC000875345115	EF	On-Demand	Anodyne	SOAT1	15	44
CN1CCC(CNC(=O)N[C@@H]2CCCSC2)(c2ccccc2)CC1	ZINC000875345117	EF	On-Demand	Anodyne	KCNA3	49	42
CN1CCC(CNC(=O)N[C@@H]2CCCSC2)(c2ccccc2)CC1	ZINC000875345117	EF	On-Demand	Anodyne	SOAT1	15	44
O=C(N[C@@H]1CCCSC1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875345119	EG	On-Demand	Anodyne	CPT1A	40	33
O=C(N[C@@H]1CCCSC1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875345121	EG	On-Demand	Anodyne	CPT1A	40	33
O=C(N[C@@H]1CCCSC1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875345123	EG	On-Demand	Anodyne	CPT1A	40	33
O=C(N[C@@H]1CCCSC1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875345125	EG	On-Demand	Anodyne	CPT1A	40	33
O=C(NC1CC(Nc2ccccc2)C1)N[C@H]1CCCSC1	ZINC000875345127	DF	On-Demand	Anodyne	EPHX2	15	47
O=C(NC1CC(Nc2ccccc2)C1)N[C@@H]1CCCSC1	ZINC000875345129	DF	On-Demand	Anodyne	EPHX2	15	47
COc1cccc(C(C)(C)C(=O)N2CCc3c2cccc3[N+](=O)[O-])c1	ZINC000875345183	EG	On-Demand	Bother	DRD4	43	34
COc1cccc(C(C)(C)C(=O)N2CCc3c2cccc3[N+](=O)[O-])c1	ZINC000875345183	EG	On-Demand	Bother	TAAR1	23	43
COc1cccc(C(C)(C)C(=O)N2CCc3c2cccc3[N+](=O)[O-])c1	ZINC000875345183	EG	On-Demand	Bother	AKR1C3	17	41
CC[C@@H](CNC(=O)NC[C@H]1C[C@H](O)C1)Oc1ccccc1Cl	ZINC000875345288	EF	On-Demand	Anodyne	PDS	26	41
CN(C)[C@@H]1CCC[C@H](NC(=O)N2CC(c3ccccc3)C2)C1	ZINC000875345367	DF	On-Demand	Anodyne	EPHX2	26	46
CN(C)[C@@H]1CCC[C@@H](NC(=O)N2CC(c3ccccc3)C2)C1	ZINC000875345368	DF	On-Demand	Anodyne	EPHX2	26	46
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)[C@]1(C)CCC(=O)N1	ZINC000875345408	ED	On-Demand	Anodyne	ACACA	58	35
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)[C@]1(C)CCC(=O)N1	ZINC000875345408	ED	On-Demand	Anodyne	BTK	35	40
O=C(NCCC1CCN(CC(F)(F)F)CC1)NCc1ncc(Cl)s1	ZINC000875345432	GG	On-Demand	Anodyne	SIRT3	49	30
O=C(NCCC1CCN(CC(F)(F)F)CC1)NCc1ncc(Cl)s1	ZINC000875345432	GG	On-Demand	Anodyne	SIRT2	51	32
O=C(NCCC1CCN(CC(F)(F)F)CC1)NCc1ncc(Cl)s1	ZINC000875345432	GG	On-Demand	Anodyne	SIRT1	50	33
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875345479	GF	On-Demand	Anodyne	MAPK11	24	48
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875345479	GF	On-Demand	Anodyne	MAPK14	29	48
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875345479	GF	On-Demand	Anodyne	BTK	37	42
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875345479	GF	On-Demand	Anodyne	LRRK2	20	44
N#Cc1ccc(Cn2cc(NC(=O)NC3CCN(C4CCCC4)CC3)cn2)cc1	ZINC000875345541	GG	On-Demand	Mild	ITK	17	48
N#Cc1ccc(Cn2cc(NC(=O)NC3CCN(C4CCCC4)CC3)cn2)cc1	ZINC000875345541	GG	On-Demand	Mild	PANC	41	36
Cc1nnc(NNC(=O)N[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)n1C	ZINC000875345634	FD	On-Demand	Reactive	DRD4	35	46
Cc1nnc(NNC(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)n1C	ZINC000875345635	FD	On-Demand	Reactive	DRD4	35	46
Cc1nnc(NNC(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)n1C	ZINC000875345636	FD	On-Demand	Reactive	DRD4	35	46
Cc1nnc(NNC(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)n1C	ZINC000875345637	FD	On-Demand	Reactive	DRD4	35	46
O=C(N[C@@H]1CCCSC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875345731	ED	On-Demand	Anodyne	SMO	28	41
O=C(N[C@@H]1CCCSC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875345731	ED	On-Demand	Anodyne	ETHR	53	38
O=C(N[C@H]1CCCSC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875345733	ED	On-Demand	Anodyne	SMO	28	41
O=C(N[C@H]1CCCSC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875345733	ED	On-Demand	Anodyne	ETHR	53	38
O=C(N[C@H]1CCCSC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875345735	ED	On-Demand	Anodyne	SMO	28	41
O=C(N[C@H]1CCCSC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875345735	ED	On-Demand	Anodyne	ETHR	53	38
O=C(N[C@@H]1CCCSC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875345737	ED	On-Demand	Anodyne	SMO	28	41
O=C(N[C@@H]1CCCSC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875345737	ED	On-Demand	Anodyne	ETHR	53	38
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875345801	GH	On-Demand	Anodyne	MAPK11	22	49
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875345801	GH	On-Demand	Anodyne	MAPK14	21	49
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875345801	GH	On-Demand	Anodyne	BTK	33	41
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875345801	GH	On-Demand	Anodyne	LRRK2	32	42
COC(=O)N(C)NC(=O)NCCCOC1CCN(Cc2ccccc2)CC1	ZINC000875345802	GD	On-Demand	Reactive	DRD2	21	42
COC(=O)N(C)NC(=O)NCCCOC1CCN(Cc2ccccc2)CC1	ZINC000875345802	GD	On-Demand	Reactive	DRD4	42	42
COC(=O)N(C)NC(=O)NCCCOC1CCN(Cc2ccccc2)CC1	ZINC000875345802	GD	On-Demand	Reactive	ACHE	49	43
COC(=O)N(C)NC(=O)NCCCOC1CCN(Cc2ccccc2)CC1	ZINC000875345802	GD	On-Demand	Reactive	HRH2	36	42
COC(=O)N(C)NC(=O)NCCCOC1CCN(Cc2ccccc2)CC1	ZINC000875345802	GD	On-Demand	Reactive	DRD3	22	40
COC(=O)N(C)NC(=O)NCCCOC1CCN(Cc2ccccc2)CC1	ZINC000875345802	GD	On-Demand	Reactive	LTA4H	17	40
COC(=O)N(C)NC(=O)NCCCOC1CCN(Cc2ccccc2)CC1	ZINC000875345802	GD	On-Demand	Reactive	SIGMAR1	49	53
COC(=O)N(C)NC(=O)NCCCOC1CCN(Cc2ccccc2)CC1	ZINC000875345802	GD	On-Demand	Reactive	CCR3	39	42
COC(=O)N(C)NC(=O)NCCCOC1CCN(Cc2ccccc2)CC1	ZINC000875345802	GD	On-Demand	Reactive	MCHR1	30	42
CCCCCCCNC(=O)C(=O)NCc1ccncc1CC	ZINC000875345811	DE	On-Demand	Mild	ASAH1	87	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875345843	GF	On-Demand	Anodyne	DRD4	40	50
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875345843	GF	On-Demand	Anodyne	SLC6A3	48	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875345843	GF	On-Demand	Anodyne	SIGMAR1	40	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875345844	GF	On-Demand	Anodyne	DRD4	40	50
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875345844	GF	On-Demand	Anodyne	SLC6A3	48	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875345844	GF	On-Demand	Anodyne	SIGMAR1	40	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875345845	GF	On-Demand	Anodyne	DRD4	40	50
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875345845	GF	On-Demand	Anodyne	SLC6A3	48	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875345845	GF	On-Demand	Anodyne	SIGMAR1	40	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875345846	GF	On-Demand	Anodyne	DRD4	40	50
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875345846	GF	On-Demand	Anodyne	SLC6A3	48	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875345846	GF	On-Demand	Anodyne	SIGMAR1	40	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875345875	GF	On-Demand	Anodyne	DRD4	38	51
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875345875	GF	On-Demand	Anodyne	CHRM3	17	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875345875	GF	On-Demand	Anodyne	SIGMAR1	35	44
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875345875	GF	On-Demand	Anodyne	BIRC2	25	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875345876	GF	On-Demand	Anodyne	DRD4	38	51
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875345876	GF	On-Demand	Anodyne	CHRM3	17	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875345876	GF	On-Demand	Anodyne	SIGMAR1	35	44
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875345876	GF	On-Demand	Anodyne	BIRC2	25	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875345877	GF	On-Demand	Anodyne	DRD4	38	51
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875345877	GF	On-Demand	Anodyne	CHRM3	17	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875345877	GF	On-Demand	Anodyne	SIGMAR1	35	44
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875345877	GF	On-Demand	Anodyne	BIRC2	25	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875345878	GF	On-Demand	Anodyne	DRD4	38	51
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875345878	GF	On-Demand	Anodyne	CHRM3	17	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875345878	GF	On-Demand	Anodyne	SIGMAR1	35	44
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875345878	GF	On-Demand	Anodyne	BIRC2	25	41
CN1CCCN(C(=O)c2c(Cl)nn(C)c2Cl)c2ccccc21	ZINC000875345904	EG	On-Demand	Anodyne	AVPR2	27	45
CN1CCCN(C(=O)c2c(Cl)nn(C)c2Cl)c2ccccc21	ZINC000875345904	EG	On-Demand	Anodyne	GPBAR1	20	40
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C1([C@@H]2CCCCO2)CCC1	ZINC000875345945	GG	On-Demand	Anodyne	MAPK11	19	48
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C1([C@H]2CCCCO2)CCC1	ZINC000875345946	GG	On-Demand	Anodyne	MAPK11	19	48
O=C(NCCC1CCN(CC(F)(F)F)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875345963	ED	On-Demand	Anodyne	CACNA1I	40	34
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)[C@]12CCCC[C@H]1C2	ZINC000875345976	EF	On-Demand	Anodyne	L3MBTL3	41	32
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)[C@@]12CCCC[C@H]1C2	ZINC000875345977	EF	On-Demand	Anodyne	L3MBTL3	41	32
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)[C@@]12CCCC[C@@H]1C2	ZINC000875345978	EF	On-Demand	Anodyne	L3MBTL3	41	32
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)[C@]12CCCC[C@@H]1C2	ZINC000875345979	EF	On-Demand	Anodyne	L3MBTL3	41	32
COc1ccccc1[C@H]1CCCN(C(=O)NCC(C)(C)S(C)(=O)=O)CC1	ZINC000875346027	GF	On-Demand	Anodyne	RBP4	46	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCC(C)(C)S(C)(=O)=O)CC1	ZINC000875346035	GF	On-Demand	Anodyne	RBP4	46	42
CC(=O)C1CCN(C(=O)C(=O)NC[C@H](c2ccccc2)C(C)(C)CO)CC1	ZINC000875346041	FD	On-Demand	Anodyne	SFRP1	90	35
CC(=O)C1CCN(C(=O)C(=O)NC[C@H](c2ccccc2)C(C)(C)CO)CC1	ZINC000875346041	FD	On-Demand	Anodyne	WNT3	61	35
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H](c2ccccc2)C(C)(C)CO)CC1	ZINC000875346043	FD	On-Demand	Anodyne	SFRP1	90	35
CC(=O)C1CCN(C(=O)C(=O)NC[C@@H](c2ccccc2)C(C)(C)CO)CC1	ZINC000875346043	FD	On-Demand	Anodyne	WNT3	61	35
N#CCc1ccsc1C(=O)N1CCCC[C@@H]1c1ncon1	ZINC000875346095	DF	On-Demand	Mild	CPT1A	65	39
N#CCc1ccsc1C(=O)N1CCCC[C@H]1c1ncon1	ZINC000875346097	DF	On-Demand	Mild	CPT1A	65	39
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875346121	FC	On-Demand	Anodyne	DRD4	42	52
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875346121	FC	On-Demand	Anodyne	SIGMAR1	46	46
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875346122	FC	On-Demand	Anodyne	DRD4	42	52
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875346122	FC	On-Demand	Anodyne	SIGMAR1	46	46
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875346123	FC	On-Demand	Anodyne	DRD4	42	52
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875346123	FC	On-Demand	Anodyne	SIGMAR1	46	46
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875346124	FC	On-Demand	Anodyne	DRD4	42	52
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875346124	FC	On-Demand	Anodyne	SIGMAR1	46	46
CCC[C@@H](CC)C(=O)N1C[C@@H](C)C(=O)Nc2ccccc21	ZINC000875346223	CG	On-Demand	Anodyne	TPP2	44	31
CCC[C@H](CC)C(=O)N1C[C@@H](C)C(=O)Nc2ccccc21	ZINC000875346224	CG	On-Demand	Anodyne	TPP2	44	31
CCC[C@@H](CC)C(=O)N1C[C@H](C)C(=O)Nc2ccccc21	ZINC000875346225	CG	On-Demand	Anodyne	TPP2	44	31
CCC[C@H](CC)C(=O)N1C[C@H](C)C(=O)Nc2ccccc21	ZINC000875346226	CG	On-Demand	Anodyne	TPP2	44	31
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875346227	ED	On-Demand	Anodyne	DRD2	16	49
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875346227	ED	On-Demand	Anodyne	DRD4	42	49
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875346227	ED	On-Demand	Anodyne	ACHE	37	43
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875346227	ED	On-Demand	Anodyne	DRD3	15	49
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875346227	ED	On-Demand	Anodyne	HTR4	22	40
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875346227	ED	On-Demand	Anodyne	SIGMAR1	44	43
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875346228	ED	On-Demand	Anodyne	DRD2	16	49
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875346228	ED	On-Demand	Anodyne	DRD4	42	49
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875346228	ED	On-Demand	Anodyne	ACHE	37	43
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875346228	ED	On-Demand	Anodyne	DRD3	15	49
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875346228	ED	On-Demand	Anodyne	HTR4	22	40
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875346228	ED	On-Demand	Anodyne	SIGMAR1	44	43
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875346229	ED	On-Demand	Anodyne	DRD2	16	49
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875346229	ED	On-Demand	Anodyne	DRD4	42	49
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875346229	ED	On-Demand	Anodyne	ACHE	37	43
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875346229	ED	On-Demand	Anodyne	DRD3	15	49
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875346229	ED	On-Demand	Anodyne	HTR4	22	40
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875346229	ED	On-Demand	Anodyne	SIGMAR1	44	43
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875346230	ED	On-Demand	Anodyne	DRD2	16	49
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875346230	ED	On-Demand	Anodyne	DRD4	42	49
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875346230	ED	On-Demand	Anodyne	ACHE	37	43
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875346230	ED	On-Demand	Anodyne	DRD3	15	49
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875346230	ED	On-Demand	Anodyne	HTR4	22	40
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875346230	ED	On-Demand	Anodyne	SIGMAR1	44	43
Cn1nc(Cl)c(C(=O)N2CCCC[C@@H]2c2ncon2)c1Cl	ZINC000875346260	EE	On-Demand	Anodyne	CPT1A	52	38
Cn1nc(Cl)c(C(=O)N2CCCC[C@H]2c2ncon2)c1Cl	ZINC000875346261	EE	On-Demand	Anodyne	CPT1A	52	38
N#CCc1ccsc1C(=O)N1CCCC[C@@H]1c1noc(C2CC2)n1	ZINC000875346289	EG	On-Demand	Mild	CPT1A	68	49
N#CCc1ccsc1C(=O)N1CCCC[C@@H]1c1noc(C2CC2)n1	ZINC000875346289	EG	On-Demand	Mild	ETHR	64	39
N#CCc1ccsc1C(=O)N1CCCC[C@H]1c1noc(C2CC2)n1	ZINC000875346290	EG	On-Demand	Mild	CPT1A	68	49
N#CCc1ccsc1C(=O)N1CCCC[C@H]1c1noc(C2CC2)n1	ZINC000875346290	EG	On-Demand	Mild	ETHR	64	39
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875346301	GG	On-Demand	Anodyne	DRD4	39	47
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875346301	GG	On-Demand	Anodyne	SIGMAR1	30	40
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875346301	GG	On-Demand	Anodyne	MCHR1	17	41
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875346302	GG	On-Demand	Anodyne	DRD4	39	47
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875346302	GG	On-Demand	Anodyne	SIGMAR1	30	40
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875346302	GG	On-Demand	Anodyne	MCHR1	17	41
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875346303	GG	On-Demand	Anodyne	DRD4	39	47
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875346303	GG	On-Demand	Anodyne	SIGMAR1	30	40
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875346303	GG	On-Demand	Anodyne	MCHR1	17	41
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875346304	GG	On-Demand	Anodyne	DRD4	39	47
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875346304	GG	On-Demand	Anodyne	SIGMAR1	30	40
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875346304	GG	On-Demand	Anodyne	MCHR1	17	41
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCCN(C=O)CC1	ZINC000875346334	FD	On-Demand	Anodyne	DRD4	38	49
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCCN(C=O)CC1	ZINC000875346334	FD	On-Demand	Anodyne	ACHE	27	40
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCCN(C=O)CC1	ZINC000875346334	FD	On-Demand	Anodyne	SIGMAR1	40	42
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCCN(C=O)CC1	ZINC000875346334	FD	On-Demand	Anodyne	CCR3	25	47
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCCN(C=O)CC1	ZINC000875346334	FD	On-Demand	Anodyne	MLNR	43	35
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCCN(C=O)CC1	ZINC000875346335	FD	On-Demand	Anodyne	DRD4	38	49
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCCN(C=O)CC1	ZINC000875346335	FD	On-Demand	Anodyne	ACHE	27	40
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCCN(C=O)CC1	ZINC000875346335	FD	On-Demand	Anodyne	SIGMAR1	40	42
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCCN(C=O)CC1	ZINC000875346335	FD	On-Demand	Anodyne	CCR3	25	47
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCCN(C=O)CC1	ZINC000875346335	FD	On-Demand	Anodyne	MLNR	43	35
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCCN(C=O)CC1	ZINC000875346336	FD	On-Demand	Anodyne	DRD4	38	49
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCCN(C=O)CC1	ZINC000875346336	FD	On-Demand	Anodyne	ACHE	27	40
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCCN(C=O)CC1	ZINC000875346336	FD	On-Demand	Anodyne	SIGMAR1	40	42
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCCN(C=O)CC1	ZINC000875346336	FD	On-Demand	Anodyne	CCR3	25	47
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCCN(C=O)CC1	ZINC000875346336	FD	On-Demand	Anodyne	MLNR	43	35
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCCN(C=O)CC1	ZINC000875346337	FD	On-Demand	Anodyne	DRD4	38	49
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCCN(C=O)CC1	ZINC000875346337	FD	On-Demand	Anodyne	ACHE	27	40
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCCN(C=O)CC1	ZINC000875346337	FD	On-Demand	Anodyne	SIGMAR1	40	42
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCCN(C=O)CC1	ZINC000875346337	FD	On-Demand	Anodyne	CCR3	25	47
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCCN(C=O)CC1	ZINC000875346337	FD	On-Demand	Anodyne	MLNR	43	35
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875346361	FG	On-Demand	Anodyne	DRD4	37	49
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875346361	FG	On-Demand	Anodyne	ACHE	36	41
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875346361	FG	On-Demand	Anodyne	LTA4H	20	45
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875346361	FG	On-Demand	Anodyne	SIGMAR1	41	44
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875346361	FG	On-Demand	Anodyne	MLNR	48	36
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875346361	FG	On-Demand	Anodyne	CCR2	18	41
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875346361	FG	On-Demand	Anodyne	SLC6A5	23	40
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875346361	FG	On-Demand	Anodyne	MCHR1	26	45
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875346362	FG	On-Demand	Anodyne	DRD4	37	49
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875346362	FG	On-Demand	Anodyne	ACHE	36	41
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875346362	FG	On-Demand	Anodyne	LTA4H	20	45
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875346362	FG	On-Demand	Anodyne	SIGMAR1	41	44
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875346362	FG	On-Demand	Anodyne	MLNR	48	36
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875346362	FG	On-Demand	Anodyne	CCR2	18	41
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875346362	FG	On-Demand	Anodyne	SLC6A5	23	40
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875346362	FG	On-Demand	Anodyne	MCHR1	26	45
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875346363	FG	On-Demand	Anodyne	DRD4	37	49
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875346363	FG	On-Demand	Anodyne	ACHE	36	41
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875346363	FG	On-Demand	Anodyne	LTA4H	20	45
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875346363	FG	On-Demand	Anodyne	SIGMAR1	41	44
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875346363	FG	On-Demand	Anodyne	MLNR	48	36
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875346363	FG	On-Demand	Anodyne	CCR2	18	41
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875346363	FG	On-Demand	Anodyne	SLC6A5	23	40
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875346363	FG	On-Demand	Anodyne	MCHR1	26	45
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875346364	FG	On-Demand	Anodyne	DRD4	37	49
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875346364	FG	On-Demand	Anodyne	ACHE	36	41
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875346364	FG	On-Demand	Anodyne	LTA4H	20	45
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875346364	FG	On-Demand	Anodyne	SIGMAR1	41	44
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875346364	FG	On-Demand	Anodyne	MLNR	48	36
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875346364	FG	On-Demand	Anodyne	CCR2	18	41
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875346364	FG	On-Demand	Anodyne	SLC6A5	23	40
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875346364	FG	On-Demand	Anodyne	MCHR1	26	45
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccccc2CN2CCC(O)CC2)C1	ZINC000875346390	FE	On-Demand	Anodyne	SLC6A1	43	32
CC(=O)[C@H]1CCCN(C(=O)NCc2ccccc2CN2CCC(O)CC2)C1	ZINC000875346391	FE	On-Demand	Anodyne	SLC6A1	43	32
CCOC(=O)c1csc(N(C(=O)c2ccc(-c3cnn(C)c3)cc2)C2CC2)n1	ZINC000875346392	GH	On-Demand	Anodyne	SLC12A5	17	41
CC1(C)CCC[C@](O)(CNC(=O)NC2CCC(C)(O)CC2)CC1	ZINC000875346398	EF	On-Demand	Anodyne	EPHX2	17	47
CC1(C)CCC[C@@](O)(CNC(=O)NC2CCC(C)(O)CC2)CC1	ZINC000875346399	EF	On-Demand	Anodyne	EPHX2	17	47
CN(C)[C@@H]1CCC[C@@H](NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C1	ZINC000875346494	FF	On-Demand	Mild	ITK	22	47
CN(C)[C@@H]1CCC[C@@H](NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C1	ZINC000875346494	FF	On-Demand	Mild	PANC	53	35
CN(C)[C@@H]1CCC[C@H](NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C1	ZINC000875346496	FF	On-Demand	Mild	ITK	22	47
CN(C)[C@@H]1CCC[C@H](NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C1	ZINC000875346496	FF	On-Demand	Mild	PANC	53	35
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C)C[C@@H]1C2	ZINC000875346553	GF	On-Demand	Anodyne	DRD4	37	50
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C)C[C@@H]1C2	ZINC000875346553	GF	On-Demand	Anodyne	SIGMAR1	41	44
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(Cc4ccccc4)C[C@H]3C)C[C@@H]1C2	ZINC000875346554	GF	On-Demand	Anodyne	DRD4	37	50
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(Cc4ccccc4)C[C@H]3C)C[C@@H]1C2	ZINC000875346554	GF	On-Demand	Anodyne	SIGMAR1	41	44
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(Cc4ccccc4)C[C@@H]3C)C[C@@H]1C2	ZINC000875346555	GF	On-Demand	Anodyne	DRD4	37	50
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(Cc4ccccc4)C[C@@H]3C)C[C@@H]1C2	ZINC000875346555	GF	On-Demand	Anodyne	SIGMAR1	41	44
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(Cc4ccccc4)C[C@H]3C)C[C@@H]1C2	ZINC000875346556	GF	On-Demand	Anodyne	DRD4	37	50
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(Cc4ccccc4)C[C@H]3C)C[C@@H]1C2	ZINC000875346556	GF	On-Demand	Anodyne	SIGMAR1	41	44
C[C@H](NC(=O)NC1CCC(C)(O)CC1)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000875346580	GH	On-Demand	Anodyne	PRCP	33	47
C[C@@H](NC(=O)NC1CCC(C)(O)CC1)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000875346581	GH	On-Demand	Anodyne	PRCP	33	47
CCOC(=O)c1csc(N(C(=O)[C@H](C)Cn2ccc(C)n2)C2CC2)n1	ZINC000875346642	FF	On-Demand	Anodyne	SLC12A5	20	43
CCOC(=O)c1csc(N(C(=O)[C@@H](C)Cn2ccc(C)n2)C2CC2)n1	ZINC000875346643	FF	On-Demand	Anodyne	SLC12A5	20	43
O=C(NCCC[C@H]1CCOC1=O)NCc1ccccc1CN1CCC(O)CC1	ZINC000875346651	GD	On-Demand	Anodyne	CCR3	15	40
O=C(NCCC[C@@H]1CCOC1=O)NCc1ccccc1CN1CCC(O)CC1	ZINC000875346652	GD	On-Demand	Anodyne	CCR3	15	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1CS(C)(=O)=O	ZINC000875346681	GD	On-Demand	Anodyne	SLC6A3	49	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1CS(C)(=O)=O	ZINC000875346682	GD	On-Demand	Anodyne	SLC6A3	49	40
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1CS(C)(=O)=O	ZINC000875346715	ED	On-Demand	Anodyne	ANPEP	21	43
O=C(NCCCCC1CC1)NCc1ccccc1CN1CCC(O)CC1	ZINC000875346859	FG	On-Demand	Anodyne	ACHE	30	46
O=C(NCCCCC1CC1)NCc1ccccc1CN1CCC(O)CC1	ZINC000875346859	FG	On-Demand	Anodyne	CCR3	29	45
O=C(NCc1ccccc1CN1CCC(O)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875346862	ED	On-Demand	Anodyne	CCR3	23	41
CCCCCCCNC(=O)C(=O)NC[C@H]1CCCN1S(C)(=O)=O	ZINC000875346884	EC	On-Demand	Mild	TPP2	18	41
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346900	GE	On-Demand	Anodyne	CHRM2	18	44
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346900	GE	On-Demand	Anodyne	CHRM1	15	44
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346900	GE	On-Demand	Anodyne	DRD2	15	51
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346900	GE	On-Demand	Anodyne	DRD4	43	51
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346900	GE	On-Demand	Anodyne	ACHE	37	40
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346900	GE	On-Demand	Anodyne	CHRM3	25	44
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346900	GE	On-Demand	Anodyne	SIGMAR1	39	47
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346900	GE	On-Demand	Anodyne	CCR3	32	45
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346900	GE	On-Demand	Anodyne	CCR2	15	44
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346900	GE	On-Demand	Anodyne	MCHR1	26	48
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346900	GE	On-Demand	Anodyne	BIRC2	34	41
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346901	GE	On-Demand	Anodyne	CHRM2	18	44
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346901	GE	On-Demand	Anodyne	CHRM1	15	44
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346901	GE	On-Demand	Anodyne	DRD2	15	51
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346901	GE	On-Demand	Anodyne	DRD4	43	51
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346901	GE	On-Demand	Anodyne	ACHE	37	40
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346901	GE	On-Demand	Anodyne	CHRM3	25	44
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346901	GE	On-Demand	Anodyne	SIGMAR1	39	47
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346901	GE	On-Demand	Anodyne	CCR3	32	45
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346901	GE	On-Demand	Anodyne	CCR2	15	44
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346901	GE	On-Demand	Anodyne	MCHR1	26	48
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346901	GE	On-Demand	Anodyne	BIRC2	34	41
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346902	GE	On-Demand	Anodyne	CHRM2	18	44
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346902	GE	On-Demand	Anodyne	CHRM1	15	44
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346902	GE	On-Demand	Anodyne	DRD2	15	51
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346902	GE	On-Demand	Anodyne	DRD4	43	51
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346902	GE	On-Demand	Anodyne	ACHE	37	40
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346902	GE	On-Demand	Anodyne	CHRM3	25	44
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346902	GE	On-Demand	Anodyne	SIGMAR1	39	47
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346902	GE	On-Demand	Anodyne	CCR3	32	45
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346902	GE	On-Demand	Anodyne	CCR2	15	44
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346902	GE	On-Demand	Anodyne	MCHR1	26	48
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346902	GE	On-Demand	Anodyne	BIRC2	34	41
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346903	GE	On-Demand	Anodyne	CHRM2	18	44
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346903	GE	On-Demand	Anodyne	CHRM1	15	44
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346903	GE	On-Demand	Anodyne	DRD2	15	51
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346903	GE	On-Demand	Anodyne	DRD4	43	51
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346903	GE	On-Demand	Anodyne	ACHE	37	40
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346903	GE	On-Demand	Anodyne	CHRM3	25	44
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346903	GE	On-Demand	Anodyne	SIGMAR1	39	47
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346903	GE	On-Demand	Anodyne	CCR3	32	45
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346903	GE	On-Demand	Anodyne	CCR2	15	44
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346903	GE	On-Demand	Anodyne	MCHR1	26	48
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875346903	GE	On-Demand	Anodyne	BIRC2	34	41
Cn1nc(Cl)c(C(=O)N2CCCC[C@@H]2c2noc(C3CC3)n2)c1Cl	ZINC000875346912	FG	On-Demand	Anodyne	CPT1A	53	47
Cn1nc(Cl)c(C(=O)N2CCCC[C@H]2c2noc(C3CC3)n2)c1Cl	ZINC000875346913	FG	On-Demand	Anodyne	CPT1A	53	47
C[C@H]1CN(S(C)(=O)=O)CC[C@@H]1NC(=O)NC1CC(Nc2ccccc2)C1	ZINC000875346958	GD	On-Demand	Anodyne	EPHX2	18	40
C[C@H]1CN(S(C)(=O)=O)CC[C@H]1NC(=O)NC1CC(Nc2ccccc2)C1	ZINC000875346960	GD	On-Demand	Anodyne	EPHX2	18	40
CCN(C(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1)C1CCC1	ZINC000875346965	EI	On-Demand	Anodyne	ACE	32	40
CCN(C(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1)C1CCC1	ZINC000875346965	EI	On-Demand	Anodyne	AMY2	43	30
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875346966	GF	On-Demand	Anodyne	DRD4	26	43
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875346966	GF	On-Demand	Anodyne	SIGMAR1	23	43
O=C(NCc1ncc(Cl)s1)NCc1ccccc1CN1CCC(O)CC1	ZINC000875347000	GF	On-Demand	Anodyne	SIGMAR1	26	41
O=C(NCc1ncc(Cl)s1)NCc1ccccc1CN1CCC(O)CC1	ZINC000875347000	GF	On-Demand	Anodyne	MGEA5	33	41
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875347004	GF	On-Demand	Anodyne	DRD4	26	43
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875347004	GF	On-Demand	Anodyne	SIGMAR1	23	43
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875347005	GF	On-Demand	Anodyne	DRD4	26	43
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875347005	GF	On-Demand	Anodyne	SIGMAR1	23	43
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875347006	GF	On-Demand	Anodyne	DRD4	26	43
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875347006	GF	On-Demand	Anodyne	SIGMAR1	23	43
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875347074	GD	On-Demand	Anodyne	CHRM2	16	40
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875347074	GD	On-Demand	Anodyne	DRD2	15	50
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875347074	GD	On-Demand	Anodyne	DRD4	46	50
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875347074	GD	On-Demand	Anodyne	ACHE	34	41
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875347074	GD	On-Demand	Anodyne	CHRM3	17	40
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875347074	GD	On-Demand	Anodyne	SIGMAR1	54	44
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875347074	GD	On-Demand	Anodyne	CCR3	24	42
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875347074	GD	On-Demand	Anodyne	MLNR	46	35
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875347076	GD	On-Demand	Anodyne	CHRM2	16	40
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875347076	GD	On-Demand	Anodyne	DRD2	15	50
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875347076	GD	On-Demand	Anodyne	DRD4	46	50
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875347076	GD	On-Demand	Anodyne	ACHE	34	41
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875347076	GD	On-Demand	Anodyne	CHRM3	17	40
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875347076	GD	On-Demand	Anodyne	SIGMAR1	54	44
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875347076	GD	On-Demand	Anodyne	CCR3	24	42
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875347076	GD	On-Demand	Anodyne	MLNR	46	35
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875347078	GD	On-Demand	Anodyne	CHRM2	16	40
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875347078	GD	On-Demand	Anodyne	DRD2	15	50
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875347078	GD	On-Demand	Anodyne	DRD4	46	50
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875347078	GD	On-Demand	Anodyne	ACHE	34	41
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875347078	GD	On-Demand	Anodyne	CHRM3	17	40
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875347078	GD	On-Demand	Anodyne	SIGMAR1	54	44
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875347078	GD	On-Demand	Anodyne	CCR3	24	42
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875347078	GD	On-Demand	Anodyne	MLNR	46	35
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875347080	GD	On-Demand	Anodyne	CHRM2	16	40
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875347080	GD	On-Demand	Anodyne	DRD2	15	50
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875347080	GD	On-Demand	Anodyne	DRD4	46	50
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875347080	GD	On-Demand	Anodyne	ACHE	34	41
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875347080	GD	On-Demand	Anodyne	CHRM3	17	40
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875347080	GD	On-Demand	Anodyne	SIGMAR1	54	44
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875347080	GD	On-Demand	Anodyne	CCR3	24	42
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875347080	GD	On-Demand	Anodyne	MLNR	46	35
COC(=O)N(C)NC(=O)NC[C@H](Cc1ccccc1)c1ccccc1	ZINC000875347099	EF	On-Demand	Reactive	MME	50	36
COC(=O)N(C)NC(=O)NC[C@H](Cc1ccccc1)c1ccccc1	ZINC000875347099	EF	On-Demand	Reactive	SOAT1	17	41
COC(=O)N(C)NC(=O)NC[C@@H](Cc1ccccc1)c1ccccc1	ZINC000875347101	EF	On-Demand	Reactive	MME	50	36
COC(=O)N(C)NC(=O)NC[C@@H](Cc1ccccc1)c1ccccc1	ZINC000875347101	EF	On-Demand	Reactive	SOAT1	17	41
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NC1(C)CC(F)(F)C1	ZINC000875347128	FG	On-Demand	Anodyne	DRD4	39	49
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NC1(C)CC(F)(F)C1	ZINC000875347128	FG	On-Demand	Anodyne	ACHE	26	40
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NC1(C)CC(F)(F)C1	ZINC000875347128	FG	On-Demand	Anodyne	SIGMAR1	43	42
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NC1(C)CC(F)(F)C1	ZINC000875347130	FG	On-Demand	Anodyne	DRD4	39	49
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NC1(C)CC(F)(F)C1	ZINC000875347130	FG	On-Demand	Anodyne	ACHE	26	40
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NC1(C)CC(F)(F)C1	ZINC000875347130	FG	On-Demand	Anodyne	SIGMAR1	43	42
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NC1(C)CC(F)(F)C1	ZINC000875347132	FG	On-Demand	Anodyne	DRD4	39	49
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NC1(C)CC(F)(F)C1	ZINC000875347132	FG	On-Demand	Anodyne	ACHE	26	40
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NC1(C)CC(F)(F)C1	ZINC000875347132	FG	On-Demand	Anodyne	SIGMAR1	43	42
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NC1(C)CC(F)(F)C1	ZINC000875347138	FG	On-Demand	Anodyne	DRD4	39	49
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NC1(C)CC(F)(F)C1	ZINC000875347138	FG	On-Demand	Anodyne	ACHE	26	40
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NC1(C)CC(F)(F)C1	ZINC000875347138	FG	On-Demand	Anodyne	SIGMAR1	43	42
CCc1nc([C@H]2CCCCN2C(=O)c2sccc2CC#N)no1	ZINC000875347156	EG	On-Demand	Mild	CPT1A	56	39
C[C@@H](O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875347162	FF	On-Demand	Anodyne	DRD2	16	49
C[C@@H](O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875347162	FF	On-Demand	Anodyne	DRD4	45	49
C[C@@H](O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875347162	FF	On-Demand	Anodyne	ACHE	31	40
C[C@@H](O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875347162	FF	On-Demand	Anodyne	SIGMAR1	41	47
C[C@@H](O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875347162	FF	On-Demand	Anodyne	MLNR	49	36
C[C@@H](O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875347162	FF	On-Demand	Anodyne	MCHR1	15	45
C[C@@H](O)C1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875347162	FF	On-Demand	Anodyne	BIRC2	30	43
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875347163	FF	On-Demand	Anodyne	DRD2	16	49
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875347163	FF	On-Demand	Anodyne	DRD4	45	49
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875347163	FF	On-Demand	Anodyne	ACHE	31	40
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875347163	FF	On-Demand	Anodyne	SIGMAR1	41	47
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875347163	FF	On-Demand	Anodyne	MLNR	49	36
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875347163	FF	On-Demand	Anodyne	MCHR1	15	45
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875347163	FF	On-Demand	Anodyne	BIRC2	30	43
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC([C@@H](C)O)CC1	ZINC000875347164	FF	On-Demand	Anodyne	DRD2	16	49
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC([C@@H](C)O)CC1	ZINC000875347164	FF	On-Demand	Anodyne	DRD4	45	49
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC([C@@H](C)O)CC1	ZINC000875347164	FF	On-Demand	Anodyne	ACHE	31	40
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC([C@@H](C)O)CC1	ZINC000875347164	FF	On-Demand	Anodyne	SIGMAR1	41	47
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC([C@@H](C)O)CC1	ZINC000875347164	FF	On-Demand	Anodyne	MLNR	49	36
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC([C@@H](C)O)CC1	ZINC000875347164	FF	On-Demand	Anodyne	MCHR1	15	45
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1CCC([C@@H](C)O)CC1	ZINC000875347164	FF	On-Demand	Anodyne	BIRC2	30	43
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC([C@@H](C)O)CC1	ZINC000875347165	FF	On-Demand	Anodyne	DRD2	16	49
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC([C@@H](C)O)CC1	ZINC000875347165	FF	On-Demand	Anodyne	DRD4	45	49
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC([C@@H](C)O)CC1	ZINC000875347165	FF	On-Demand	Anodyne	ACHE	31	40
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC([C@@H](C)O)CC1	ZINC000875347165	FF	On-Demand	Anodyne	SIGMAR1	41	47
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC([C@@H](C)O)CC1	ZINC000875347165	FF	On-Demand	Anodyne	MLNR	49	36
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC([C@@H](C)O)CC1	ZINC000875347165	FF	On-Demand	Anodyne	MCHR1	15	45
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1CCC([C@@H](C)O)CC1	ZINC000875347165	FF	On-Demand	Anodyne	BIRC2	30	43
CS[C@@H]1C[C@@H](NC(=O)NCc2ccccc2CN2CCC(O)CC2)C1	ZINC000875347174	FE	On-Demand	Anodyne	SIGMAR1	18	41
COC(=O)c1cc(C(=O)N2C[C@@H](C)C(=O)Nc3ccccc32)ccc1C	ZINC000875347220	FG	On-Demand	Anodyne	AVPR2	66	44
COC(=O)c1cc(C(=O)N2C[C@@H](C)C(=O)Nc3ccccc32)ccc1C	ZINC000875347220	FG	On-Demand	Anodyne	AVPR1A	32	44
COC(=O)c1cc(C(=O)N2C[C@H](C)C(=O)Nc3ccccc32)ccc1C	ZINC000875347221	FG	On-Demand	Anodyne	AVPR2	66	44
COC(=O)c1cc(C(=O)N2C[C@H](C)C(=O)Nc3ccccc32)ccc1C	ZINC000875347221	FG	On-Demand	Anodyne	AVPR1A	32	44
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1Cc2cccc(O)c2C1	ZINC000875347223	FG	On-Demand	Clean	DRD2	17	47
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1Cc2cccc(O)c2C1	ZINC000875347223	FG	On-Demand	Clean	DRD4	45	47
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1Cc2cccc(O)c2C1	ZINC000875347223	FG	On-Demand	Clean	SIGMAR1	42	43
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1Cc2cccc(O)c2C1	ZINC000875347224	FG	On-Demand	Clean	DRD2	17	47
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1Cc2cccc(O)c2C1	ZINC000875347224	FG	On-Demand	Clean	DRD4	45	47
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1Cc2cccc(O)c2C1	ZINC000875347224	FG	On-Demand	Clean	SIGMAR1	42	43
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1Cc2cccc(O)c2C1	ZINC000875347225	FG	On-Demand	Clean	DRD2	17	47
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1Cc2cccc(O)c2C1	ZINC000875347225	FG	On-Demand	Clean	DRD4	45	47
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1Cc2cccc(O)c2C1	ZINC000875347225	FG	On-Demand	Clean	SIGMAR1	42	43
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1Cc2cccc(O)c2C1	ZINC000875347226	FG	On-Demand	Clean	DRD2	17	47
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1Cc2cccc(O)c2C1	ZINC000875347226	FG	On-Demand	Clean	DRD4	45	47
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1Cc2cccc(O)c2C1	ZINC000875347226	FG	On-Demand	Clean	SIGMAR1	42	43
O=C(NCc1ccnc(F)c1)NCc1ccccc1CN1CCC(O)CC1	ZINC000875347227	FE	On-Demand	Anodyne	SIGMAR1	24	41
O=C(NCc1ccnc(F)c1)NCc1ccccc1CN1CCC(O)CC1	ZINC000875347227	FE	On-Demand	Anodyne	CCR3	39	40
O=C(NCc1ccnc(F)c1)NCc1ccccc1CN1CCC(O)CC1	ZINC000875347227	FE	On-Demand	Anodyne	MCHR1	22	45
O=C(N1CCCC[C@@H]1c1ncon1)C(F)(F)c1cc(F)cc(F)c1	ZINC000875347320	EG	On-Demand	Anodyne	CPT1A	52	36
O=C(N1CCCC[C@H]1c1ncon1)C(F)(F)c1cc(F)cc(F)c1	ZINC000875347324	EG	On-Demand	Anodyne	CPT1A	52	36
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875347355	EF	On-Demand	Anodyne	DRD4	33	47
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875347355	EF	On-Demand	Anodyne	SIGMAR1	33	45
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875347355	EF	On-Demand	Anodyne	BIRC2	23	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875347357	EF	On-Demand	Anodyne	DRD4	33	47
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875347357	EF	On-Demand	Anodyne	SIGMAR1	33	45
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875347357	EF	On-Demand	Anodyne	BIRC2	23	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875347358	EF	On-Demand	Anodyne	DRD4	33	47
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875347358	EF	On-Demand	Anodyne	SIGMAR1	33	45
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000875347358	EF	On-Demand	Anodyne	BIRC2	23	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875347359	EF	On-Demand	Anodyne	DRD4	33	47
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875347359	EF	On-Demand	Anodyne	SIGMAR1	33	45
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000875347359	EF	On-Demand	Anodyne	BIRC2	23	40
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875347370	ED	On-Demand	Anodyne	DRD2	15	50
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875347370	ED	On-Demand	Anodyne	DRD4	51	50
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875347370	ED	On-Demand	Anodyne	ACHE	33	41
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875347370	ED	On-Demand	Anodyne	SIGMAR1	47	44
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875347370	ED	On-Demand	Anodyne	MCHR1	19	46
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875347371	ED	On-Demand	Anodyne	DRD2	15	50
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875347371	ED	On-Demand	Anodyne	DRD4	51	50
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875347371	ED	On-Demand	Anodyne	ACHE	33	41
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875347371	ED	On-Demand	Anodyne	SIGMAR1	47	44
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875347371	ED	On-Demand	Anodyne	MCHR1	19	46
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875347372	ED	On-Demand	Anodyne	DRD2	15	50
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875347372	ED	On-Demand	Anodyne	DRD4	51	50
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875347372	ED	On-Demand	Anodyne	ACHE	33	41
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875347372	ED	On-Demand	Anodyne	SIGMAR1	47	44
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875347372	ED	On-Demand	Anodyne	MCHR1	19	46
O=C(NCc1ccccc1CN1CCC(O)CC1)N1Cc2cccc(O)c2C1	ZINC000875347390	GF	On-Demand	Clean	SIGMAR1	18	40
CN1CCCN(C(=O)c2sccc2CC#N)c2ccccc21	ZINC000875347441	DG	On-Demand	Mild	AVPR2	17	41
CCc1nc([C@H]2CCCCN2C(=O)c2c(Cl)nn(C)c2Cl)no1	ZINC000875347496	FG	On-Demand	Anodyne	CPT1A	42	40
CCC1(CC)CCCN1C(=O)NCc1ccccc1CN1CCC(O)CC1	ZINC000875347505	FH	On-Demand	Anodyne	SLC12A5	60	36
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875347515	GG	On-Demand	Anodyne	DRD4	40	49
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875347515	GG	On-Demand	Anodyne	ACHE	39	41
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875347515	GG	On-Demand	Anodyne	SIGMAR1	40	41
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875347515	GG	On-Demand	Anodyne	BIRC2	19	40
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875347516	GG	On-Demand	Anodyne	DRD4	40	49
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875347516	GG	On-Demand	Anodyne	ACHE	39	41
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875347516	GG	On-Demand	Anodyne	SIGMAR1	40	41
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875347516	GG	On-Demand	Anodyne	BIRC2	19	40
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875347517	GG	On-Demand	Anodyne	DRD4	40	49
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875347517	GG	On-Demand	Anodyne	ACHE	39	41
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875347517	GG	On-Demand	Anodyne	SIGMAR1	40	41
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875347517	GG	On-Demand	Anodyne	BIRC2	19	40
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875347518	GG	On-Demand	Anodyne	DRD4	40	49
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875347518	GG	On-Demand	Anodyne	ACHE	39	41
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875347518	GG	On-Demand	Anodyne	SIGMAR1	40	41
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875347518	GG	On-Demand	Anodyne	BIRC2	19	40
O=C(NCc1ccccc1CN1CCC(O)CC1)N1CCC(CO)(CO)CC1	ZINC000875347537	GC	On-Demand	Anodyne	SIGMAR1	23	40
O=C(NCc1ccccc1CN1CCC(O)CC1)N1CCC(CO)(CO)CC1	ZINC000875347537	GC	On-Demand	Anodyne	EPHX2	17	42
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCC(C)(O)CC2)CC1	ZINC000875347568	FH	On-Demand	Anodyne	EPHX2	29	40
COc1ccccc1[C@H]1CCCN(C(=O)NC2CCC(C)(O)CC2)CC1	ZINC000875347568	FH	On-Demand	Anodyne	RBP4	29	40
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCC(C)(O)CC2)CC1	ZINC000875347570	FH	On-Demand	Anodyne	EPHX2	29	40
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CCC(C)(O)CC2)CC1	ZINC000875347570	FH	On-Demand	Anodyne	RBP4	29	40
O=C(NCc1ccccc1CN1CCC(O)CC1)N[C@@H]1CCCC[C@@H]1F	ZINC000875347586	FF	On-Demand	Anodyne	SIGMAR1	20	41
CCOC(=O)c1csc(N(C(=O)C[C@@H]2Cc3ccccc3O2)C2CC2)n1	ZINC000875347632	FG	On-Demand	Anodyne	SLC12A5	15	41
CCOC(=O)c1csc(N(C(=O)C[C@H]2Cc3ccccc3O2)C2CC2)n1	ZINC000875347633	FG	On-Demand	Anodyne	SLC12A5	15	41
COCC1CC(NC(=O)NCc2ccccc2CN2CCC(O)CC2)C1	ZINC000875347719	FD	On-Demand	Anodyne	SIGMAR1	26	44
COCC1CC(NC(=O)NCc2ccccc2CN2CCC(O)CC2)C1	ZINC000875347719	FD	On-Demand	Anodyne	EPHX2	15	47
COCC1CC(NC(=O)NCc2ccccc2CN2CCC(O)CC2)C1	ZINC000875347719	FD	On-Demand	Anodyne	MCHR1	19	48
NC(=O)c1cccc(NC(=O)[C@@H](Cc2cccnc2)C2CCCC2)n1	ZINC000875347776	EF	On-Demand	Anodyne	C3AR1	42	43
NC(=O)c1cccc(NC(=O)[C@H](Cc2cccnc2)C2CCCC2)n1	ZINC000875347777	EF	On-Demand	Anodyne	C3AR1	42	43
COCC(C)(C)CCNC(=O)NCc1ccccc1CN1CCC(O)CC1	ZINC000875347794	GF	On-Demand	Anodyne	ACHE	19	40
COCC(C)(C)CCNC(=O)NCc1ccccc1CN1CCC(O)CC1	ZINC000875347794	GF	On-Demand	Anodyne	SIGMAR1	20	40
CCOC(=O)c1csc(N(C(=O)Cc2ccc(Cl)cn2)C2CC2)n1	ZINC000875347798	FG	On-Demand	Anodyne	SLC12A5	15	41
C#C[C@@H]1CC[C@@H](NC(=O)NCc2ccccc2CN2CCC(O)CC2)CC1	ZINC000875347851	FF	On-Demand	Mild	SIGMAR1	18	45
C#C[C@@H]1CC[C@@H](NC(=O)NCc2ccccc2CN2CCC(O)CC2)CC1	ZINC000875347851	FF	On-Demand	Mild	EPHX2	15	50
C#C[C@@H]1CC[C@@H](NC(=O)NCc2ccccc2CN2CCC(O)CC2)CC1	ZINC000875347851	FF	On-Demand	Mild	MCHR1	17	44
COC(=O)N(C)NC(=O)NCc1ccccc1CN1CCC(O)CC1	ZINC000875347852	FD	On-Demand	Reactive	SIGMAR1	24	40
COC(=O)N(C)NC(=O)NCc1ccccc1CN1CCC(O)CC1	ZINC000875347852	FD	On-Demand	Reactive	CCR3	22	40
COC(=O)N(C)NC(=O)NCc1ccccc1CN1CCC(O)CC1	ZINC000875347852	FD	On-Demand	Reactive	MCHR1	15	43
CN(C)[C@@H]1CCC[C@@H](NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)C1	ZINC000875347913	EF	On-Demand	Anodyne	EPHX2	27	47
CN(C)[C@@H]1CCC[C@H](NC(=O)N2CCC[C@](O)(c3ccccc3)C2)C1	ZINC000875347914	EF	On-Demand	Anodyne	EPHX2	27	47
CN(C)[C@@H]1CCC[C@H](NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)C1	ZINC000875347915	EF	On-Demand	Anodyne	EPHX2	27	47
CN(C)[C@@H]1CCC[C@@H](NC(=O)N2CCC[C@](O)(c3ccccc3)C2)C1	ZINC000875347916	EF	On-Demand	Anodyne	EPHX2	27	47
CC(=O)C1CCN(C(=O)NCc2ccccc2CN2CCC(O)CC2)CC1	ZINC000875347919	FE	On-Demand	Anodyne	SIGMAR1	22	43
CC(=O)C1CCN(C(=O)NCc2ccccc2CN2CCC(O)CC2)CC1	ZINC000875347919	FE	On-Demand	Anodyne	EPHX2	27	43
CCC[C@H](CC)C(=O)N(c1nc(C(=O)OCC)cs1)C1CC1	ZINC000875347950	DH	On-Demand	Anodyne	SLC12A5	15	42
CC[C@@H](NC(=O)N(CCOC)C1CCOCC1)c1cccc([N+](=O)[O-])c1	ZINC000875348042	FF	On-Demand	Bother	CACNA1C	54	39
CC[C@@H](NC(=O)N(CCOC)C1CCOCC1)c1cccc([N+](=O)[O-])c1	ZINC000875348042	FF	On-Demand	Bother	CACNA1D	81	36
CONC(=O)C1CCN(C(=O)N[C@@H](c2cccc(C)c2)C(C)(C)C)CC1	ZINC000875348049	FG	On-Demand	Anodyne	AMY2	45	31
CONC(=O)C1CCN(C(=O)N[C@@H](c2cccc(C)c2)C(C)(C)C)CC1	ZINC000875348049	FG	On-Demand	Anodyne	EPHX2	20	41
CONC(=O)C1CCN(C(=O)N[C@H](c2cccc(C)c2)C(C)(C)C)CC1	ZINC000875348050	FG	On-Demand	Anodyne	AMY2	45	31
CONC(=O)C1CCN(C(=O)N[C@H](c2cccc(C)c2)C(C)(C)C)CC1	ZINC000875348050	FG	On-Demand	Anodyne	EPHX2	20	41
CC[C@@H](CNC(=O)NN(C)C(=O)OC)Oc1cccc(C)c1	ZINC000875348056	DE	On-Demand	Reactive	PDS	67	43
C[C@@H](CNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)c1ccncc1	ZINC000875348113	FG	On-Demand	Anodyne	OPRL1	15	45
CC[C@@H](NC(=O)N(CCOC)CC1CCN(C)CC1)c1cccc([N+](=O)[O-])c1	ZINC000875348145	GG	On-Demand	Bother	CACNA1C	54	37
CC[C@@H](NC(=O)N(CCOC)CC1CCN(C)CC1)c1cccc([N+](=O)[O-])c1	ZINC000875348145	GG	On-Demand	Bother	CACNA1D	79	35
C[C@@H](Cc1ccncc1)NC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875348152	EG	On-Demand	Anodyne	PDE4A	24	48
C[C@@H](Cc1ccncc1)NC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875348154	EG	On-Demand	Anodyne	PDE4A	24	48
CC[C@@H](NC(=O)N1CCN(C)C(C)(C)CC1)c1cccc([N+](=O)[O-])c1	ZINC000875348177	EG	On-Demand	Bother	CACNA1H	27	41
CC[C@@H](NC(=O)N1CCN(C)C(C)(C)CC1)c1cccc([N+](=O)[O-])c1	ZINC000875348177	EG	On-Demand	Bother	CACNA1D	43	32
CC[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1cccc([N+](=O)[O-])c1	ZINC000875348181	GE	On-Demand	Bother	CACNA1C	41	34
CC[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1cccc([N+](=O)[O-])c1	ZINC000875348181	GE	On-Demand	Bother	CACNA1D	63	33
CC[C@@H](CNC(=O)NC[C@H]1C[C@H](O)C1)Oc1cccc(C)c1	ZINC000875348260	DE	On-Demand	Anodyne	PDS	53	42
C#CC[C@@H](COC)NC(=O)C(=O)NCC1(CC)CCN(Cc2ccccc2)CC1	ZINC000875348285	GD	On-Demand	Mild	NPFFR2	35	44
C#CC[C@@H](COC)NC(=O)C(=O)NCC1(CC)CCN(Cc2ccccc2)CC1	ZINC000875348285	GD	On-Demand	Mild	NPFFR1	47	44
C#CC[C@H](COC)NC(=O)C(=O)NCC1(CC)CCN(Cc2ccccc2)CC1	ZINC000875348286	GD	On-Demand	Mild	NPFFR2	35	44
C#CC[C@H](COC)NC(=O)C(=O)NCC1(CC)CCN(Cc2ccccc2)CC1	ZINC000875348286	GD	On-Demand	Mild	NPFFR1	47	44
CC[C@@H](NC(=O)N1CCC[C@H]1c1cncc(C)c1)c1cccc([N+](=O)[O-])c1	ZINC000875348308	FI	On-Demand	Bother	CACNA1C	43	37
CC[C@@H](NC(=O)N1CCC[C@H]1c1cncc(C)c1)c1cccc([N+](=O)[O-])c1	ZINC000875348308	FI	On-Demand	Bother	CACNA1D	56	33
CC[C@@H](NC(=O)N1CCC[C@@H]1c1cncc(C)c1)c1cccc([N+](=O)[O-])c1	ZINC000875348311	FI	On-Demand	Bother	CACNA1C	43	37
CC[C@@H](NC(=O)N1CCC[C@@H]1c1cncc(C)c1)c1cccc([N+](=O)[O-])c1	ZINC000875348311	FI	On-Demand	Bother	CACNA1D	56	33
C[C@@H](Cc1ccncc1)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875348323	FG	On-Demand	Anodyne	OPRL1	17	44
CC[C@@H](CNC(=O)N1CC(O)(C(=O)OC)C1)Oc1cccc(C)c1	ZINC000875348332	ED	On-Demand	Anodyne	PDS	34	40
COc1ccccc1[C@H]1CCCN(C(=O)N[C@@H](C)Cc2ccncc2)CC1	ZINC000875348408	FI	On-Demand	Anodyne	PDE4A	23	46
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H](C)Cc2ccncc2)CC1	ZINC000875348409	FI	On-Demand	Anodyne	PDE4A	23	46
COc1ccccc1[C@H]1CCCN(C(=O)N[C@H](C)Cc2ccncc2)CC1	ZINC000875348410	FI	On-Demand	Anodyne	PDE4A	23	46
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H](C)Cc2ccncc2)CC1	ZINC000875348411	FI	On-Demand	Anodyne	PDE4A	23	46
CC[C@@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)c1cccc([N+](=O)[O-])c1	ZINC000875348415	EG	On-Demand	Bother	CACNA1D	49	33
CC[C@@H](NC(=O)N1CCC[C@H](C(C)=O)C1)c1cccc([N+](=O)[O-])c1	ZINC000875348416	EG	On-Demand	Bother	CACNA1D	49	33
C[C@@H](CNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccncc1	ZINC000875348430	EG	On-Demand	Anodyne	EPHX2	17	42
C[C@@H](CNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccncc1	ZINC000875348432	EG	On-Demand	Anodyne	EPHX2	17	42
C[C@@H](Cc1ccncc1)NC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875348464	FG	On-Demand	Mild	CTSB	17	42
C[C@@H](Cc1ccncc1)NC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875348464	FG	On-Demand	Mild	CYSP_TRYCR	34	42
C[C@@H](Cc1ccncc1)NC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875348464	FG	On-Demand	Mild	CTSF	72	42
C[C@@H](Cc1ccncc1)NC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875348464	FG	On-Demand	Mild	CTSL	18	42
C[C@@H](Cc1ccncc1)NC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875348465	FG	On-Demand	Mild	CTSB	17	42
C[C@@H](Cc1ccncc1)NC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875348465	FG	On-Demand	Mild	CYSP_TRYCR	34	42
C[C@@H](Cc1ccncc1)NC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875348465	FG	On-Demand	Mild	CTSF	72	42
C[C@@H](Cc1ccncc1)NC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875348465	FG	On-Demand	Mild	CTSL	18	42
C[C@@H](Cc1ccncc1)NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875348503	FF	On-Demand	Anodyne	FAAH	16	44
CC[C@@H](CNC(=O)N1CCC(C(=O)NCCO)CC1)Oc1cccc(C)c1	ZINC000875348513	GD	On-Demand	Anodyne	EPHX2	22	40
CC[C@@H](NC(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21)c1cccc([N+](=O)[O-])c1	ZINC000875348517	FG	On-Demand	Bother	CACNA1D	57	34
C[C@@H](Cc1ccncc1)NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875348530	DD	On-Demand	Anodyne	BIRC2	32	45
C[C@@H](CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F)c1ccncc1	ZINC000875348563	FH	On-Demand	Mild	CTSF	43	36
C[C@@H](CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F)c1ccncc1	ZINC000875348563	FH	On-Demand	Mild	CTSK	22	41
C[C@@H](CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F)c1ccncc1	ZINC000875348563	FH	On-Demand	Mild	CTSL	16	41
C[C@@H](Cc1ccncc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875348648	DE	On-Demand	Anodyne	PDE4A	20	41
C[C@@H](Cc1ccncc1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875348648	DE	On-Demand	Anodyne	BIRC2	22	43
C[C@@H](Cc1ccncc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875348651	DE	On-Demand	Anodyne	PDE4A	20	41
C[C@@H](Cc1ccncc1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875348651	DE	On-Demand	Anodyne	BIRC2	22	43
CC[C@@H](NC(=O)NC1(C)CC(F)(F)C1)c1cccc([N+](=O)[O-])c1	ZINC000875348665	EH	On-Demand	Bother	CACNA1C	45	34
CC[C@@H](NC(=O)NC1(C)CC(F)(F)C1)c1cccc([N+](=O)[O-])c1	ZINC000875348665	EH	On-Demand	Bother	CACNA1D	75	34
C[C@@H](Cc1ccncc1)NC(=O)N1C[C@@H]2CN(C(=O)OC(C)(C)C)C[C@]2(C)C1	ZINC000875348682	GF	On-Demand	Anodyne	GPR119	22	41
CC[C@@H](NC(=O)N1CCC[C@H](OC2CCC2)CC1)c1cccc([N+](=O)[O-])c1	ZINC000875348693	GI	On-Demand	Bother	CACNA1C	40	36
CC[C@@H](NC(=O)N1CCC[C@H](OC2CCC2)CC1)c1cccc([N+](=O)[O-])c1	ZINC000875348693	GI	On-Demand	Bother	CACNA1D	60	33
CC[C@@H](NC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1cccc([N+](=O)[O-])c1	ZINC000875348694	GI	On-Demand	Bother	CACNA1C	40	36
CC[C@@H](NC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1cccc([N+](=O)[O-])c1	ZINC000875348694	GI	On-Demand	Bother	CACNA1D	60	33
CC[C@@H](CNC(=O)NC[C@@H]1CCO[C@@H]1C(=O)OC)Oc1cccc(C)c1	ZINC000875348759	FE	On-Demand	Anodyne	PDS	48	41
CC[C@@H](CNC(=O)N1CCCN(C=O)CC1)Oc1cccc(C)c1	ZINC000875348779	EE	On-Demand	Anodyne	PDS	45	41
C[C@@H](Cc1ccncc1)NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875348809	EF	On-Demand	Anodyne	CCR1	17	40
CC[C@@H](NC(=O)N1CCC(C(C)=O)CC1)c1cccc([N+](=O)[O-])c1	ZINC000875348840	EG	On-Demand	Bother	CACNA1C	42	36
CC[C@@H](NC(=O)N1CCC(C(C)=O)CC1)c1cccc([N+](=O)[O-])c1	ZINC000875348840	EG	On-Demand	Bother	CACNA1D	64	34
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)c1ccncc1	ZINC000875348851	DD	On-Demand	Anodyne	SLC6A3	49	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)c1ccncc1	ZINC000875348852	DD	On-Demand	Anodyne	SLC6A3	49	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)c1ccncc1	ZINC000875348853	DD	On-Demand	Anodyne	SLC6A3	49	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)c1ccncc1	ZINC000875348854	DD	On-Demand	Anodyne	SLC6A3	49	38
C[C@@H](Cc1ccncc1)NC(=O)N1CCN(C)C(C)(C)CC1	ZINC000875348857	DE	On-Demand	Anodyne	CCR1	20	40
CC[C@@H](NC(=O)N1C[C@H]2CC=CC[C@H]2C1)c1cccc([N+](=O)[O-])c1	ZINC000875348925	EH	On-Demand	Bother	CACNA1C	40	35
CC[C@@H](NC(=O)N1C[C@H]2CC=CC[C@H]2C1)c1cccc([N+](=O)[O-])c1	ZINC000875348925	EH	On-Demand	Bother	CACNA1D	63	35
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1ccncc1	ZINC000875349004	DD	On-Demand	Anodyne	SLC6A3	49	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1ccncc1	ZINC000875349005	DD	On-Demand	Anodyne	SLC6A3	49	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cc1ccncc1	ZINC000875349006	DD	On-Demand	Anodyne	SLC6A3	49	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cc1ccncc1	ZINC000875349007	DD	On-Demand	Anodyne	SLC6A3	49	38
CC[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1cccc([N+](=O)[O-])c1	ZINC000875349023	EF	On-Demand	Bother	CACNA1D	58	34
CC[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1cccc([N+](=O)[O-])c1	ZINC000875349025	EF	On-Demand	Bother	CACNA1D	58	34
COc1cccc(C(C)(C)C(=O)Nc2cc(CN3CCOCC3)ccc2C)c1	ZINC000875349043	GH	On-Demand	Anodyne	DRD4	43	35
COc1cccc(C(C)(C)C(=O)Nc2cc(CN3CCOCC3)ccc2C)c1	ZINC000875349043	GH	On-Demand	Anodyne	MCHR1	21	41
CC[C@@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1cccc([N+](=O)[O-])c1	ZINC000875349103	GE	On-Demand	Bother	CACNA1D	55	34
O=CN1CCCN(C(=O)N[C@@H]2CCN(CCCc3ccccc3)C2=O)CC1	ZINC000875349108	FD	On-Demand	Anodyne	ACE	43	40
O=CN1CCCN(C(=O)N[C@@H]2CCN(CCCc3ccccc3)C2=O)CC1	ZINC000875349108	FD	On-Demand	Anodyne	SIGMAR1	18	43
O=CN1CCCN(C(=O)N[C@@H]2CCN(CCCc3ccccc3)C2=O)CC1	ZINC000875349108	FD	On-Demand	Anodyne	PREP	55	39
O=CN1CCCN(C(=O)N[C@H]2CCN(CCCc3ccccc3)C2=O)CC1	ZINC000875349110	FD	On-Demand	Anodyne	ACE	43	40
O=CN1CCCN(C(=O)N[C@H]2CCN(CCCc3ccccc3)C2=O)CC1	ZINC000875349110	FD	On-Demand	Anodyne	SIGMAR1	18	43
O=CN1CCCN(C(=O)N[C@H]2CCN(CCCc3ccccc3)C2=O)CC1	ZINC000875349110	FD	On-Demand	Anodyne	PREP	55	39
CC[C@@H](NC(=O)N(C)OCC(F)(F)F)c1cccc([N+](=O)[O-])c1	ZINC000875349233	EG	On-Demand	Bother	CACNA1C	35	40
CC[C@@H](NC(=O)N(C)OCC(F)(F)F)c1cccc([N+](=O)[O-])c1	ZINC000875349233	EG	On-Demand	Bother	CACNA1D	53	40
CC[C@@H](CNC(=O)N1CCC(CO)(CO)CC1)Oc1cccc(C)c1	ZINC000875349258	FD	On-Demand	Anodyne	S1PR2	26	45
CC[C@@H](CNC(=O)N1CCC(CO)(CO)CC1)Oc1cccc(C)c1	ZINC000875349258	FD	On-Demand	Anodyne	PDS	54	42
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@]2(C)CCN(Cc3ccccc3)C2)C1	ZINC000875349274	GE	On-Demand	Anodyne	FKBP1A	15	41
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC[C@@]2(C)CCN(Cc3ccccc3)C2)C1	ZINC000875349280	GE	On-Demand	Anodyne	FKBP1A	15	41
CC[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1cccc([N+](=O)[O-])c1	ZINC000875349399	FH	On-Demand	Bother	CACNA1H	29	42
CC[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1cccc([N+](=O)[O-])c1	ZINC000875349399	FH	On-Demand	Bother	CACNA1D	54	32
C[C@@H](Cc1ccncc1)NC(=O)N[C@@H](C)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875349407	FF	On-Demand	Anodyne	GPR119	24	41
C[C@@H](Cc1ccncc1)NC(=O)N[C@H](C)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875349409	FF	On-Demand	Anodyne	GPR119	24	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@@]2(C)CCN(Cc3ccccc3)C2)C1	ZINC000875349414	GD	On-Demand	Anodyne	NPFFR1	40	36
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC[C@]2(C)CCN(Cc3ccccc3)C2)C1	ZINC000875349416	GD	On-Demand	Anodyne	NPFFR1	40	36
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@@]2(C)CCN(Cc3ccccc3)C2)C1	ZINC000875349418	GD	On-Demand	Anodyne	NPFFR1	40	36
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC[C@]2(C)CCN(Cc3ccccc3)C2)C1	ZINC000875349420	GD	On-Demand	Anodyne	NPFFR1	40	36
COc1ncccc1N(C)C(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875349452	FH	On-Demand	Anodyne	HSD17B2	15	42
C[C@@H](CNC(=O)N1CC2(CCN(C(=O)OC(C)(C)C)CC2)C1)c1ccncc1	ZINC000875349464	GG	On-Demand	Anodyne	GPR119	30	42
C[C@H](CNC(=O)N1CC2(CCN(C(=O)OC(C)(C)C)CC2)C1)c1ccncc1	ZINC000875349466	GG	On-Demand	Anodyne	GPR119	30	42
CCCCCCCNC(=O)C(=O)N[C@H]1CCC(=O)N[C@@H]1C	ZINC000875349543	CC	On-Demand	Mild	ASAH1	95	37
CCCCCCCNC(=O)C(=O)N[C@H]1CCC(=O)N[C@@H]1C	ZINC000875349543	CC	On-Demand	Mild	LASR	46	33
CCCCCCCNC(=O)C(=O)N[C@@H]1CCC(=O)N[C@H]1C	ZINC000875349544	CC	On-Demand	Mild	ASAH1	95	37
CCCCCCCNC(=O)C(=O)N[C@@H]1CCC(=O)N[C@H]1C	ZINC000875349544	CC	On-Demand	Mild	LASR	46	33
CCCCCCCNC(=O)C(=O)N[C@H]1CCC(=O)N[C@H]1C	ZINC000875349545	CC	On-Demand	Mild	ASAH1	95	37
CCCCCCCNC(=O)C(=O)N[C@H]1CCC(=O)N[C@H]1C	ZINC000875349545	CC	On-Demand	Mild	LASR	46	33
CCCCCCCNC(=O)C(=O)N[C@@H]1CCC(=O)N[C@@H]1C	ZINC000875349546	CC	On-Demand	Mild	ASAH1	95	37
CCCCCCCNC(=O)C(=O)N[C@@H]1CCC(=O)N[C@@H]1C	ZINC000875349546	CC	On-Demand	Mild	LASR	46	33
CN1C[C@@H](NC(=O)N2CCC(c3nccc(-c4cccnc4)n3)CC2)CC1=O	ZINC000875349596	GD	On-Demand	Anodyne	CALCRL	37	40
CN1C[C@H](NC(=O)N2CCC(c3nccc(-c4cccnc4)n3)CC2)CC1=O	ZINC000875349597	GD	On-Demand	Anodyne	CALCRL	37	40
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H]1CCC(=O)N[C@H]1C)CC2	ZINC000875349675	GC	On-Demand	Anodyne	SLC18A2	47	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H]1CCC(=O)N[C@H]1C)CC2	ZINC000875349676	GC	On-Demand	Anodyne	SLC18A2	47	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H]1CCC(=O)N[C@@H]1C)CC2	ZINC000875349677	GC	On-Demand	Anodyne	SLC18A2	47	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H]1CCC(=O)N[C@@H]1C)CC2	ZINC000875349678	GC	On-Demand	Anodyne	SLC18A2	47	35
COc1ccccc1[C@H]1CN(C(=O)NCC2CCC(OC)CC2)CCO1	ZINC000875349679	FF	On-Demand	Anodyne	MBTPS1	42	30
COc1ccccc1[C@@H]1CN(C(=O)NCC2CCC(OC)CC2)CCO1	ZINC000875349680	FF	On-Demand	Anodyne	MBTPS1	42	30
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(CCCc2ccccc2)C1=O	ZINC000875349693	FE	On-Demand	Anodyne	ACE	42	36
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(CCCc2ccccc2)C1=O	ZINC000875349694	FE	On-Demand	Anodyne	ACE	42	36
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(CCCc4ccccc4)C3=O)C[C@@H]1C2	ZINC000875349885	GD	On-Demand	Anodyne	NAAA	40	33
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(CCCc4ccccc4)C3=O)C[C@@H]1C2	ZINC000875349886	GD	On-Demand	Anodyne	NAAA	40	33
O=C(CCCOc1ccc(F)cc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000875349992	IE	On-Demand	Reactive	HRH3	18	45
O=C(CCCOc1ccc(F)cc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000875349992	IE	On-Demand	Reactive	MMP13	57	39
O=C(CCCOc1ccc(F)cc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000875349992	IE	On-Demand	Reactive	ADAM17	42	42
O=C(CCCOc1ccc(F)cc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000875349992	IE	On-Demand	Reactive	MMP3	36	40
O=C(CCCOc1ccc(F)cc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000875349992	IE	On-Demand	Reactive	MMP8	19	40
O=C(CCCOc1ccc(F)cc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000875349992	IE	On-Demand	Reactive	TGM2	72	41
O=C(CCCOc1ccc(F)cc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000875349992	IE	On-Demand	Reactive	MMP1	46	42
O=C(CCCOc1ccc(F)cc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000875349992	IE	On-Demand	Reactive	F13A1	68	41
O=C(N[C@@H]1CCC[C@@H]1CCO)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875350014	FD	On-Demand	Anodyne	OXTR	55	38
O=C(N[C@@H]1CCC[C@H]1CCO)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875350015	FD	On-Demand	Anodyne	OXTR	55	38
O=C(N[C@@H]1CCC[C@@H]1CCO)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875350016	FD	On-Demand	Anodyne	OXTR	55	38
O=C(N[C@@H]1CCC[C@H]1CCO)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875350017	FD	On-Demand	Anodyne	OXTR	55	38
Cc1scc(CNC(=O)C(=O)NC[C@@]2(C)CCN(Cc3ccccc3)C2)c1C	ZINC000875350043	GG	On-Demand	Anodyne	NPFFR1	41	36
Cc1scc(CNC(=O)C(=O)NC[C@]2(C)CCN(Cc3ccccc3)C2)c1C	ZINC000875350047	GG	On-Demand	Anodyne	NPFFR1	41	36
C[C@H](NC(=O)C(=O)NC[C@@]1(C)CCN(Cc2ccccc2)C1)c1ccnn1C	ZINC000875350077	GD	On-Demand	Anodyne	NPFFR1	44	36
C[C@H](NC(=O)C(=O)NC[C@]1(C)CCN(Cc2ccccc2)C1)c1ccnn1C	ZINC000875350080	GD	On-Demand	Anodyne	NPFFR1	44	36
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCCc4[nH]ccc43)cn2)cc1	ZINC000875350198	FG	On-Demand	Mild	ITK	16	47
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCCc4[nH]ccc43)cn2)cc1	ZINC000875350198	FG	On-Demand	Mild	PANC	44	36
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCCc4[nH]ccc43)cn2)cc1	ZINC000875350199	FG	On-Demand	Mild	ITK	16	47
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCCc4[nH]ccc43)cn2)cc1	ZINC000875350199	FG	On-Demand	Mild	PANC	44	36
CN1C[C@H](NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)CC1=O	ZINC000875350208	DC	On-Demand	Anodyne	EPHX2	17	45
CN1C[C@H](NC(=O)N2CCC[C@](O)(c3ccccc3)C2)CC1=O	ZINC000875350210	DC	On-Demand	Anodyne	EPHX2	17	45
CN1C[C@@H](NC(=O)N2CCC[C@](O)(c3ccccc3)C2)CC1=O	ZINC000875350212	DC	On-Demand	Anodyne	EPHX2	17	45
CN1C[C@@H](NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)CC1=O	ZINC000875350213	DC	On-Demand	Anodyne	EPHX2	17	45
O=C(N[C@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H]1CCC[C@@H]1CCO	ZINC000875350304	FD	On-Demand	Anodyne	C3AR1	44	42
O=C(N[C@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H]1CCC[C@H]1CCO	ZINC000875350305	FD	On-Demand	Anodyne	C3AR1	44	42
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H]1CCC[C@H]1CCO	ZINC000875350306	FD	On-Demand	Anodyne	C3AR1	44	42
CC(=O)C1CCN(C(=O)C(=O)NC[C@@]2(C)CCN(Cc3ccccc3)C2)CC1	ZINC000875350359	GD	On-Demand	Anodyne	SIGMAR1	41	39
CC(=O)C1CCN(C(=O)C(=O)NC[C@@]2(C)CCN(Cc3ccccc3)C2)CC1	ZINC000875350359	GD	On-Demand	Anodyne	CACNA1G	21	40
CC(=O)C1CCN(C(=O)C(=O)NC[C@@]2(C)CCN(Cc3ccccc3)C2)CC1	ZINC000875350359	GD	On-Demand	Anodyne	NPFFR1	41	36
CC(=O)C1CCN(C(=O)C(=O)NC[C@]2(C)CCN(Cc3ccccc3)C2)CC1	ZINC000875350360	GD	On-Demand	Anodyne	SIGMAR1	41	39
CC(=O)C1CCN(C(=O)C(=O)NC[C@]2(C)CCN(Cc3ccccc3)C2)CC1	ZINC000875350360	GD	On-Demand	Anodyne	CACNA1G	21	40
CC(=O)C1CCN(C(=O)C(=O)NC[C@]2(C)CCN(Cc3ccccc3)C2)CC1	ZINC000875350360	GD	On-Demand	Anodyne	NPFFR1	41	36
O=C(N[C@H]1CCN(CCCc2ccccc2)C1=O)N[C@@H]1CCOC[C@H]1O	ZINC000875350409	FC	On-Demand	Anodyne	NAAA	42	35
COC(=O)N(C)NC(=O)N[C@H]1CCN(CCCc2ccccc2)C1=O	ZINC000875350416	ED	On-Demand	Reactive	FKBP1A	42	37
COC(=O)N(C)NC(=O)N[C@H]1CCN(CCCc2ccccc2)C1=O	ZINC000875350416	ED	On-Demand	Reactive	PREP	42	35
COC(=O)N(C)NC(=O)N[C@@H]1CCN(CCCc2ccccc2)C1=O	ZINC000875350417	ED	On-Demand	Reactive	FKBP1A	42	37
COC(=O)N(C)NC(=O)N[C@@H]1CCN(CCCc2ccccc2)C1=O	ZINC000875350417	ED	On-Demand	Reactive	PREP	42	35
CC(=O)C1CCN(C(=O)NC2CCN(c3cc(C)nc(C)n3)CC2)CC1	ZINC000875350491	FE	On-Demand	Anodyne	EPHX2	15	40
CN1C[C@H](NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1=O	ZINC000875350492	EC	On-Demand	Anodyne	PTGER4	23	43
CN1C[C@H](NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1=O	ZINC000875350493	EC	On-Demand	Anodyne	PTGER4	23	43
CN1C[C@@H](NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1=O	ZINC000875350494	EC	On-Demand	Anodyne	PTGER4	23	43
CN1C[C@@H](NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1=O	ZINC000875350495	EC	On-Demand	Anodyne	PTGER4	23	43
CC[C@@H](CNC(=O)N1CCC(CO)(CO)CC1)Oc1ccccc1C	ZINC000875350509	FD	On-Demand	Anodyne	S1PR2	25	40
CC[C@@H](CNC(=O)N1CCC(CO)(CO)CC1)Oc1ccccc1C	ZINC000875350509	FD	On-Demand	Anodyne	HCN1	51	31
C[C@@H]1NC(=O)CC[C@H]1NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875350554	FC	On-Demand	Anodyne	OXTR	54	35
C[C@@H]1NC(=O)CC[C@H]1NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875350555	FC	On-Demand	Anodyne	OXTR	54	35
C[C@@H]1NC(=O)CC[C@@H]1NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875350556	FC	On-Demand	Anodyne	OXTR	54	35
C[C@@H]1NC(=O)CC[C@@H]1NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875350557	FC	On-Demand	Anodyne	OXTR	54	35
C[C@@H]1NC(=O)CC[C@H]1NC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875350567	FD	On-Demand	Anodyne	AMP1_PLAFQ	21	42
C[C@@H]1NC(=O)CC[C@H]1NC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875350567	FD	On-Demand	Anodyne	NAAA	40	39
C[C@@H]1NC(=O)CC[C@@H]1NC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875350569	FD	On-Demand	Anodyne	AMP1_PLAFQ	21	42
C[C@@H]1NC(=O)CC[C@@H]1NC(=O)C(=O)NCCCCCCc1ccccc1	ZINC000875350569	FD	On-Demand	Anodyne	NAAA	40	39
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(CCCc3ccccc3)C2=O)C1	ZINC000875350645	GC	On-Demand	Anodyne	FKBP1A	45	38
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(CCCc3ccccc3)C2=O)C1	ZINC000875350645	GC	On-Demand	Anodyne	PREP	44	38
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(CCCc3ccccc3)C2=O)C1	ZINC000875350646	GC	On-Demand	Anodyne	FKBP1A	45	38
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(CCCc3ccccc3)C2=O)C1	ZINC000875350646	GC	On-Demand	Anodyne	PREP	44	38
COc1ccc(N2CCN(C(=O)NCC3CCC(OC)CC3)CC2)c(OC)c1	ZINC000875350814	GF	On-Demand	Clean	HTR1A	45	45
COc1ccc(N2CCN(C(=O)NCC3CCC(OC)CC3)CC2)c(OC)c1	ZINC000875350814	GF	On-Demand	Clean	DRD2	39	41
COc1ccc(N2CCN(C(=O)NCC3CCC(OC)CC3)CC2)c(OC)c1	ZINC000875350814	GF	On-Demand	Clean	DRD4	42	33
COc1ccc(N2CCN(C(=O)NCC3CCC(OC)CC3)CC2)c(OC)c1	ZINC000875350814	GF	On-Demand	Clean	HTR1D	15	45
COc1ccc(N2CCN(C(=O)NCC3CCC(OC)CC3)CC2)c(OC)c1	ZINC000875350814	GF	On-Demand	Clean	HTR1B	18	45
COc1ccc(N2CCN(C(=O)NCC3CCC(OC)CC3)CC2)c(OC)c1	ZINC000875350814	GF	On-Demand	Clean	DRD3	50	40
COc1ccc(N2CCN(C(=O)NCC3CCC(OC)CC3)CC2)c(OC)c1	ZINC000875350814	GF	On-Demand	Clean	PDGFRB	45	38
COc1ccc(N2CCN(C(=O)NCC3CCC(OC)CC3)CC2)c(OC)c1	ZINC000875350814	GF	On-Demand	Clean	HTR7	36	40
COc1ccc(N2CCN(C(=O)NCC3CCC(OC)CC3)CC2)c(OC)c1	ZINC000875350814	GF	On-Demand	Clean	MTNR1A	33	42
COc1ccc(N2CCN(C(=O)NCC3CCC(OC)CC3)CC2)c(OC)c1	ZINC000875350814	GF	On-Demand	Clean	MTNR1B	31	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(CCCc2ccccc2)C1=O	ZINC000875350815	GD	On-Demand	Anodyne	FKBP1A	51	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(CCCc2ccccc2)C1=O	ZINC000875350815	GD	On-Demand	Anodyne	SLC6A4	24	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(CCCc2ccccc2)C1=O	ZINC000875350815	GD	On-Demand	Anodyne	SLC6A3	51	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(CCCc2ccccc2)C1=O	ZINC000875350815	GD	On-Demand	Anodyne	BIRC2	40	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(CCCc2ccccc2)C1=O	ZINC000875350816	GD	On-Demand	Anodyne	FKBP1A	51	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(CCCc2ccccc2)C1=O	ZINC000875350816	GD	On-Demand	Anodyne	SLC6A4	24	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(CCCc2ccccc2)C1=O	ZINC000875350816	GD	On-Demand	Anodyne	SLC6A3	51	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(CCCc2ccccc2)C1=O	ZINC000875350816	GD	On-Demand	Anodyne	BIRC2	40	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(CCCc2ccccc2)C1=O	ZINC000875350817	GD	On-Demand	Anodyne	FKBP1A	51	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(CCCc2ccccc2)C1=O	ZINC000875350817	GD	On-Demand	Anodyne	SLC6A4	24	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(CCCc2ccccc2)C1=O	ZINC000875350817	GD	On-Demand	Anodyne	SLC6A3	51	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(CCCc2ccccc2)C1=O	ZINC000875350817	GD	On-Demand	Anodyne	BIRC2	40	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(CCCc2ccccc2)C1=O	ZINC000875350818	GD	On-Demand	Anodyne	FKBP1A	51	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(CCCc2ccccc2)C1=O	ZINC000875350818	GD	On-Demand	Anodyne	SLC6A4	24	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(CCCc2ccccc2)C1=O	ZINC000875350818	GD	On-Demand	Anodyne	SLC6A3	51	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(CCCc2ccccc2)C1=O	ZINC000875350818	GD	On-Demand	Anodyne	BIRC2	40	37
Cn1nc(C(=O)NNC(=O)c2ccccc2NC(=O)c2cccs2)c2ccccc2c1=O	ZINC000875350855	IE	On-Demand	Reactive	STK33	33	43
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2CC(=O)N(C)C2)CC1	ZINC000875350857	EE	On-Demand	Anodyne	HTR1A	23	40
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2CC(=O)N(C)C2)CC1	ZINC000875350857	EE	On-Demand	Anodyne	RBP4	31	40
COc1ccccc1[C@H]1CCCN(C(=O)N[C@H]2CC(=O)N(C)C2)CC1	ZINC000875350858	EE	On-Demand	Anodyne	HTR1A	23	40
COc1ccccc1[C@H]1CCCN(C(=O)N[C@H]2CC(=O)N(C)C2)CC1	ZINC000875350858	EE	On-Demand	Anodyne	RBP4	31	40
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CC(=O)N(C)C2)CC1	ZINC000875350859	EE	On-Demand	Anodyne	HTR1A	23	40
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CC(=O)N(C)C2)CC1	ZINC000875350859	EE	On-Demand	Anodyne	RBP4	31	40
COc1ccccc1[C@H]1CCCN(C(=O)N[C@@H]2CC(=O)N(C)C2)CC1	ZINC000875350860	EE	On-Demand	Anodyne	HTR1A	23	40
COc1ccccc1[C@H]1CCCN(C(=O)N[C@@H]2CC(=O)N(C)C2)CC1	ZINC000875350860	EE	On-Demand	Anodyne	RBP4	31	40
C[C@@H]1CSCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875350864	EE	On-Demand	Anodyne	CTSB	24	43
C[C@@H]1CSCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875350864	EE	On-Demand	Anodyne	CTSK	25	45
C[C@@H]1CSCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875350864	EE	On-Demand	Anodyne	PREP	26	41
C[C@@H]1CSCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875350864	EE	On-Demand	Anodyne	CAPN2	48	34
C[C@@H]1CSCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875350864	EE	On-Demand	Anodyne	NAAA	50	36
C[C@@H]1CSCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875350864	EE	On-Demand	Anodyne	SLC12A5	69	38
O=C(N[C@@H]1CCN(CCCc2ccccc2)C1=O)N1CCC(CO)(CO)CC1	ZINC000875351037	GC	On-Demand	Anodyne	ACE	43	39
O=C(N[C@@H]1CCN(CCCc2ccccc2)C1=O)N1CCC(CO)(CO)CC1	ZINC000875351037	GC	On-Demand	Anodyne	GHRHR	42	33
O=C(N[C@@H]1CCN(CCCc2ccccc2)C1=O)N1CCC(CO)(CO)CC1	ZINC000875351037	GC	On-Demand	Anodyne	SIGMAR1	31	40
O=C(N[C@@H]1CCN(CCCc2ccccc2)C1=O)N1CCC(CO)(CO)CC1	ZINC000875351037	GC	On-Demand	Anodyne	PREP	40	36
O=C(N[C@H]1CCN(CCCc2ccccc2)C1=O)N1CCC(CO)(CO)CC1	ZINC000875351038	GC	On-Demand	Anodyne	ACE	43	39
O=C(N[C@H]1CCN(CCCc2ccccc2)C1=O)N1CCC(CO)(CO)CC1	ZINC000875351038	GC	On-Demand	Anodyne	GHRHR	42	33
O=C(N[C@H]1CCN(CCCc2ccccc2)C1=O)N1CCC(CO)(CO)CC1	ZINC000875351038	GC	On-Demand	Anodyne	SIGMAR1	31	40
O=C(N[C@H]1CCN(CCCc2ccccc2)C1=O)N1CCC(CO)(CO)CC1	ZINC000875351038	GC	On-Demand	Anodyne	PREP	40	36
O=C(N[C@H]1CCN(CCCc2ccccc2)C1=O)N1Cc2cccc(O)c2C1	ZINC000875351055	GF	On-Demand	Clean	PREP	54	40
O=C(N[C@@H]1CCN(CCCc2ccccc2)C1=O)N1Cc2cccc(O)c2C1	ZINC000875351056	GF	On-Demand	Clean	PREP	54	40
Cc1ccc(CNC(=O)C(=O)NC[C@]2(C)CCN(Cc3ccccc3)C2)o1	ZINC000875351075	FE	On-Demand	Anodyne	NPFFR1	42	39
Cc1ccc(CNC(=O)C(=O)NC[C@@]2(C)CCN(Cc3ccccc3)C2)o1	ZINC000875351077	FE	On-Demand	Anodyne	NPFFR1	42	39
CN(C[C@@H]1C[C@H](O)C1)C(=O)C(=O)NC[C@@]1(C)CCN(Cc2ccccc2)C1	ZINC000875351087	FD	On-Demand	Anodyne	NPFFR1	40	37
CN(C[C@@H]1C[C@H](O)C1)C(=O)C(=O)NC[C@]1(C)CCN(Cc2ccccc2)C1	ZINC000875351089	FD	On-Demand	Anodyne	NPFFR1	40	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CC(=O)N(C)C1	ZINC000875351090	CB	On-Demand	Anodyne	SLC6A3	40	35
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CC(=O)N(C)C1	ZINC000875351092	CB	On-Demand	Anodyne	SLC6A3	40	35
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CC(=O)N(C)C1	ZINC000875351094	CB	On-Demand	Anodyne	SLC6A3	40	35
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CC(=O)N(C)C1	ZINC000875351096	CB	On-Demand	Anodyne	SLC6A3	40	35
O=C(NC1CC(Nc2ccccc2)C1)N[C@H]1CC(=O)N(C2CC2)C1	ZINC000875351101	ED	On-Demand	Anodyne	INHA	18	42
O=C(NC1CC(Nc2ccccc2)C1)N[C@@H]1CC(=O)N(C2CC2)C1	ZINC000875351103	ED	On-Demand	Anodyne	INHA	18	42
COCC(C)(C)CCNC(=O)C(=O)NC[C@@]1(C)CCN(Cc2ccccc2)C1	ZINC000875351143	GE	On-Demand	Anodyne	NPFFR1	44	38
COCC(C)(C)CCNC(=O)C(=O)NC[C@]1(C)CCN(Cc2ccccc2)C1	ZINC000875351145	GE	On-Demand	Anodyne	NPFFR1	44	38
O=C(NC[C@H](O)Cc1cccc(Cl)c1)N[C@H]1CC(=O)N(C2CC2)C1	ZINC000875351156	FD	On-Demand	Anodyne	PTGER4	15	42
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)N[C@@H]1CC(=O)N(C2CC2)C1	ZINC000875351158	FD	On-Demand	Anodyne	PTGER4	15	42
O=C(NC[C@H](O)Cc1cccc(Cl)c1)N[C@@H]1CC(=O)N(C2CC2)C1	ZINC000875351160	FD	On-Demand	Anodyne	PTGER4	15	42
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)N[C@H]1CC(=O)N(C2CC2)C1	ZINC000875351162	FD	On-Demand	Anodyne	PTGER4	15	42
CCn1nncc1CNC(=O)C(=O)NC[C@]1(C)CCN(Cc2ccccc2)C1	ZINC000875351318	GC	On-Demand	Anodyne	NPFFR1	41	38
CCn1nncc1CNC(=O)C(=O)NC[C@@]1(C)CCN(Cc2ccccc2)C1	ZINC000875351319	GC	On-Demand	Anodyne	NPFFR1	41	38
COc1cccc([C@H](O)C2CCN(C(=O)NCC3CCC(OC)CC3)CC2)c1	ZINC000875351356	GG	On-Demand	Anodyne	DRD4	42	32
COc1cccc([C@H](O)C2CCN(C(=O)NCC3CCC(OC)CC3)CC2)c1	ZINC000875351356	GG	On-Demand	Anodyne	OPRD1	15	45
COc1cccc(C(C)(C)C(=O)N2CCSC[C@H]2C)c1	ZINC000875351413	CF	On-Demand	Anodyne	DRD4	40	31
COc1cccc(C(C)(C)C(=O)N2CCSC[C@@H]2C)c1	ZINC000875351414	CF	On-Demand	Anodyne	DRD4	40	31
CCC1(CNC(=O)N[C@@H](C)[C@@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875351521	EF	On-Demand	Anodyne	MTNR1A	43	37
CCC1(CNC(=O)N[C@@H](C)[C@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875351523	EF	On-Demand	Anodyne	MTNR1A	43	37
CCC1(CNC(=O)N[C@H](C)[C@@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875351525	EF	On-Demand	Anodyne	MTNR1A	43	37
CCC1(CNC(=O)N[C@H](C)[C@H](O)c2cc(OC)ccc2OC)CC1	ZINC000875351527	EF	On-Demand	Anodyne	MTNR1A	43	37
O=C(NNC(=O)c1ccc(-n2cccn2)nc1)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000875351575	ID	On-Demand	Reactive	TGM2	43	36
O=C(NNC(=O)c1ccc(-n2cccn2)nc1)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000875351575	ID	On-Demand	Reactive	NAMPT	48	44
C[C@H]1CCc2c(F)cccc2[C@H]1NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875351728	FF	On-Demand	Anodyne	CACNA1H	43	33
C[C@H]1CCc2c(F)cccc2[C@@H]1NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875351729	FF	On-Demand	Anodyne	CACNA1H	43	33
O=C(N[C@H]1CC(=O)N(c2cccc(C(F)(F)F)c2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875351742	GD	On-Demand	Anodyne	CCR2	52	43
CSc1nnc(CNC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)s1	ZINC000875351782	GD	On-Demand	Anodyne	TRY1_BOVIN	52	34
CSc1nnc(CNC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)s1	ZINC000875351783	GD	On-Demand	Anodyne	TRY1_BOVIN	52	34
CSc1nnc(CNC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)s1	ZINC000875351784	GD	On-Demand	Anodyne	TRY1_BOVIN	52	34
CSc1nnc(CNC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)s1	ZINC000875351785	GD	On-Demand	Anodyne	TRY1_BOVIN	52	34
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1nc(Cc2ccccc2)no1	ZINC000875351828	GE	On-Demand	Anodyne	SLC6A3	33	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1nc(Cc2ccccc2)no1	ZINC000875351828	GE	On-Demand	Anodyne	BMP1	17	40
O=C(NC[C@H]1CCCCN1Cc1ccccc1)C(=O)N[C@H]1CCC[C@@H]1CCO	ZINC000875351829	GD	On-Demand	Anodyne	DRD2	24	44
O=C(NC[C@H]1CCCCN1Cc1ccccc1)C(=O)N[C@H]1CCC[C@@H]1CCO	ZINC000875351829	GD	On-Demand	Anodyne	SIGMAR1	20	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1nc(Cc2ccccc2)no1	ZINC000875351830	GE	On-Demand	Anodyne	SLC6A3	33	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1nc(Cc2ccccc2)no1	ZINC000875351830	GE	On-Demand	Anodyne	BMP1	17	40
O=C(NC[C@H]1CCCCN1Cc1ccccc1)C(=O)N[C@@H]1CCC[C@@H]1CCO	ZINC000875351831	GD	On-Demand	Anodyne	DRD2	24	44
O=C(NC[C@H]1CCCCN1Cc1ccccc1)C(=O)N[C@@H]1CCC[C@@H]1CCO	ZINC000875351831	GD	On-Demand	Anodyne	SIGMAR1	20	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1nc(Cc2ccccc2)no1	ZINC000875351832	GE	On-Demand	Anodyne	SLC6A3	33	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1nc(Cc2ccccc2)no1	ZINC000875351832	GE	On-Demand	Anodyne	BMP1	17	40
O=C(NC[C@H]1CCCCN1Cc1ccccc1)C(=O)N[C@@H]1CCC[C@H]1CCO	ZINC000875351833	GD	On-Demand	Anodyne	DRD2	24	44
O=C(NC[C@H]1CCCCN1Cc1ccccc1)C(=O)N[C@@H]1CCC[C@H]1CCO	ZINC000875351833	GD	On-Demand	Anodyne	SIGMAR1	20	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1nc(Cc2ccccc2)no1	ZINC000875351834	GE	On-Demand	Anodyne	SLC6A3	33	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1nc(Cc2ccccc2)no1	ZINC000875351834	GE	On-Demand	Anodyne	BMP1	17	40
O=C(NC[C@H]1CCCCN1Cc1ccccc1)C(=O)N[C@H]1CCC[C@H]1CCO	ZINC000875351835	GD	On-Demand	Anodyne	DRD2	24	44
O=C(NC[C@H]1CCCCN1Cc1ccccc1)C(=O)N[C@H]1CCC[C@H]1CCO	ZINC000875351835	GD	On-Demand	Anodyne	SIGMAR1	20	45
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H]1CCC[C@H]1CCO)CC2	ZINC000875351854	GD	On-Demand	Anodyne	SLC18A2	48	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H]1CCC[C@@H]1CCO)CC2	ZINC000875351856	GD	On-Demand	Anodyne	SLC18A2	48	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H]1CCC[C@@H]1CCO)CC2	ZINC000875351858	GD	On-Demand	Anodyne	SLC18A2	48	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H]1CCC[C@H]1CCO)CC2	ZINC000875351861	GD	On-Demand	Anodyne	SLC18A2	48	35
C[C@H]1C[C@H](NC(=O)N[C@@H]2CCOC[C@H]2O)CCN1Cc1ccccc1	ZINC000875351920	ED	On-Demand	Anodyne	DRD4	17	43
C[C@H]1C[C@H](NC(=O)N[C@@H]2CCOC[C@H]2O)CCN1Cc1ccccc1	ZINC000875351920	ED	On-Demand	Anodyne	SIGMAR1	20	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000875351944	EF	On-Demand	Anodyne	SIGMAR1	20	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000875351945	EF	On-Demand	Anodyne	SIGMAR1	20	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000875351946	EF	On-Demand	Anodyne	SIGMAR1	20	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000875351947	EF	On-Demand	Anodyne	SIGMAR1	20	41
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc([S@](C)=O)cc2)C1	ZINC000875351956	DD	On-Demand	Anodyne	DPP7	53	35
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc([S@@](C)=O)cc2)C1	ZINC000875351957	DD	On-Demand	Anodyne	DPP7	53	35
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc([S@](C)=O)cc2)C1	ZINC000875351958	DD	On-Demand	Anodyne	DPP7	53	35
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc([S@@](C)=O)cc2)C1	ZINC000875351959	DD	On-Demand	Anodyne	DPP7	53	35
O=C(N[C@@H]1CC(=O)N(C2CC2)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875351984	ED	On-Demand	Anodyne	EPHX2	15	42
O=C(N[C@@H]1CC(=O)N(C2CC2)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875351985	ED	On-Demand	Anodyne	EPHX2	15	42
O=C(N[C@H]1CC(=O)N(C2CC2)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875351986	ED	On-Demand	Anodyne	EPHX2	15	42
O=C(N[C@H]1CC(=O)N(C2CC2)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875351987	ED	On-Demand	Anodyne	EPHX2	15	42
O=C(NCCOc1c(Cl)cc(Cl)cc1Cl)NC[C@H]1C[C@H](O)C1	ZINC000875351990	FG	On-Demand	Anodyne	CACNA1I	45	32
CCC1(CNC(=O)NNc2cccc(C)n2)CC1	ZINC000875352090	BE	On-Demand	Reactive	GRM5	18	40
COCCN(CC1CCN(C)CC1)C(=O)NCCn1c(O)nc2ccccc21	ZINC000875352112	GD	On-Demand	Anodyne	HRH1	25	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCn1c(O)nc2ccccc21	ZINC000875352136	FD	On-Demand	Anodyne	SLC6A3	42	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCn1c(O)nc2ccccc21	ZINC000875352137	FD	On-Demand	Anodyne	SLC6A3	42	39
CC(=O)C1CCN(C(=O)N[C@H](C)c2nc(Cc3ccccc3)no2)CC1	ZINC000875352143	FF	On-Demand	Anodyne	BMP1	30	40
CC(=O)C1CCN(C(=O)N[C@@H](C)c2nc(Cc3ccccc3)no2)CC1	ZINC000875352144	FF	On-Demand	Anodyne	BMP1	30	40
C[C@H]1CCc2c(F)cccc2[C@@H]1NC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875352199	GF	On-Demand	Anodyne	L3MBTL3	64	40
C[C@H]1CCc2c(F)cccc2[C@H]1NC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875352203	GF	On-Demand	Anodyne	L3MBTL3	64	40
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)C1	ZINC000875352210	FC	On-Demand	Anodyne	SIGMAR1	27	40
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)C1	ZINC000875352212	FC	On-Demand	Anodyne	SIGMAR1	27	40
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)C1	ZINC000875352264	FC	On-Demand	Anodyne	SIGMAR1	27	40
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)C1	ZINC000875352265	FC	On-Demand	Anodyne	SIGMAR1	27	40
CC(=O)C1CCN(C(=O)NCCn2c(O)nc3ccccc32)CC1	ZINC000875352266	ED	On-Demand	Anodyne	HTR4	39	41
CC(=O)C1CCN(C(=O)NCCn2c(O)nc3ccccc32)CC1	ZINC000875352266	ED	On-Demand	Anodyne	PDE6D	61	39
CC(=O)C1CCN(C(=O)NCCn2c(O)nc3ccccc32)CC1	ZINC000875352266	ED	On-Demand	Anodyne	SMO	36	41
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCN(c3cccc(Cl)c3)C2)CC1	ZINC000875352295	GD	On-Demand	Anodyne	EPHX2	26	44
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCN(c3cccc(Cl)c3)C2)CC1	ZINC000875352296	GD	On-Demand	Anodyne	EPHX2	26	44
CO[C@@H]1CC[C@@H](C)N(C(=O)NCCn2c(O)nc3ccccc32)C1	ZINC000875352477	ED	On-Demand	Anodyne	PLD1	43	35
COc1ccc([C@@H]2CN(C(=O)NCc3ccc([S@](C)=O)cc3)CCO2)cc1	ZINC000875352499	GF	On-Demand	Anodyne	MMP13	15	42
COc1ccc([C@@H]2CN(C(=O)NCc3ccc([S@](C)=O)cc3)CCO2)cc1	ZINC000875352499	GF	On-Demand	Anodyne	MMP7	16	42
COc1ccc([C@@H]2CN(C(=O)NCc3ccc([S@](C)=O)cc3)CCO2)cc1	ZINC000875352499	GF	On-Demand	Anodyne	PROKR1	43	31
COc1ccc([C@@H]2CN(C(=O)NCc3ccc([S@@](C)=O)cc3)CCO2)cc1	ZINC000875352500	GF	On-Demand	Anodyne	MMP13	15	42
COc1ccc([C@@H]2CN(C(=O)NCc3ccc([S@@](C)=O)cc3)CCO2)cc1	ZINC000875352500	GF	On-Demand	Anodyne	MMP7	16	42
COc1ccc([C@@H]2CN(C(=O)NCc3ccc([S@@](C)=O)cc3)CCO2)cc1	ZINC000875352500	GF	On-Demand	Anodyne	PROKR1	43	31
C[C@@H](NC(=O)NCC[C@@H]1CCCS1)c1nc(Cc2ccccc2)no1	ZINC000875352506	FG	On-Demand	Anodyne	BMP1	38	40
C[C@@H](NC(=O)NCC[C@H]1CCCS1)c1nc(Cc2ccccc2)no1	ZINC000875352507	FG	On-Demand	Anodyne	BMP1	38	40
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@H](C)c2nc(Cc3ccccc3)no2)C1	ZINC000875352515	FF	On-Demand	Anodyne	BMP1	28	40
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@@H](C)c2nc(Cc3ccccc3)no2)C1	ZINC000875352516	FF	On-Demand	Anodyne	BMP1	28	40
C[C@H]1C[C@H](NC(=O)NC[C@H]2C[C@H](O)C2)CCN1Cc1ccccc1	ZINC000875352533	EE	On-Demand	Anodyne	DRD4	22	44
C[C@H]1C[C@H](NC(=O)NC[C@H]2C[C@H](O)C2)CCN1Cc1ccccc1	ZINC000875352533	EE	On-Demand	Anodyne	SIGMAR1	27	41
C[C@H]1C[C@H](NC(=O)NC[C@H]2C[C@H](O)C2)CCN1Cc1ccccc1	ZINC000875352533	EE	On-Demand	Anodyne	EPHX2	18	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc([S@](C)=O)cc1	ZINC000875352559	FD	On-Demand	Anodyne	SLC6A4	31	49
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc([S@](C)=O)cc1	ZINC000875352559	FD	On-Demand	Anodyne	SLC6A3	53	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc([S@@](C)=O)cc1	ZINC000875352560	FD	On-Demand	Anodyne	SLC6A4	31	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc([S@@](C)=O)cc1	ZINC000875352560	FD	On-Demand	Anodyne	SLC6A3	53	49
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc([S@@](C)=O)cc1	ZINC000875352561	FD	On-Demand	Anodyne	SLC6A4	31	49
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc([S@@](C)=O)cc1	ZINC000875352561	FD	On-Demand	Anodyne	SLC6A3	53	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc([S@](C)=O)cc1	ZINC000875352562	FD	On-Demand	Anodyne	SLC6A4	31	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc([S@](C)=O)cc1	ZINC000875352562	FD	On-Demand	Anodyne	SLC6A3	53	49
C[S@](=O)c1ccc(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875352725	GE	On-Demand	Anodyne	PDS	60	39
C[S@@](=O)c1ccc(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875352726	GE	On-Demand	Anodyne	PDS	60	39
C[S@](=O)c1ccc(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875352727	GE	On-Demand	Anodyne	PDS	60	39
C[S@@](=O)c1ccc(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000875352728	GE	On-Demand	Anodyne	PDS	60	39
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(c2cccc(Cl)c2)C1	ZINC000875352735	DD	On-Demand	Anodyne	DRD3	15	45
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(c2cccc(Cl)c2)C1	ZINC000875352735	DD	On-Demand	Anodyne	CACNA1I	45	39
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(c2cccc(Cl)c2)C1	ZINC000875352736	DD	On-Demand	Anodyne	DRD3	15	45
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(c2cccc(Cl)c2)C1	ZINC000875352736	DD	On-Demand	Anodyne	CACNA1I	45	39
C[S@@](=O)c1ccc(CNC(=O)N2CCN(c3ccc(F)cc3F)CC2)cc1	ZINC000875352743	GF	On-Demand	Anodyne	NPY2R	54	37
C[S@](=O)c1ccc(CNC(=O)N2CCN(c3ccc(F)cc3F)CC2)cc1	ZINC000875352744	GF	On-Demand	Anodyne	NPY2R	54	37
O=C(NCCn1c(O)nc2ccccc21)N1CCC2(CCNC2=O)CC1	ZINC000875352749	FD	On-Demand	Anodyne	PLD2	43	35
CCC1(CC)CCCN1C(=O)NCc1ccc([S@@](C)=O)cc1	ZINC000875352759	DG	On-Demand	Anodyne	SLC12A5	42	32
CCC1(CC)CCCN1C(=O)NCc1ccc([S@](C)=O)cc1	ZINC000875352760	DG	On-Demand	Anodyne	SLC12A5	42	32
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000875352763	GF	On-Demand	Anodyne	SLC6A4	17	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000875352763	GF	On-Demand	Anodyne	SLC6A3	45	41
CCC1(CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875352764	DG	On-Demand	Mild	ITK	17	52
CCC1(CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875352764	DG	On-Demand	Mild	PANC	41	35
O=C(N[C@H]1CCN(c2cccc(Cl)c2)C1=O)N1CCC2(CCNC2=O)CC1	ZINC000875352817	GD	On-Demand	Anodyne	CACNA1H	57	43
O=C(N[C@@H]1CCN(c2cccc(Cl)c2)C1=O)N1CCC2(CCNC2=O)CC1	ZINC000875352818	GD	On-Demand	Anodyne	CACNA1H	57	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000875352864	GF	On-Demand	Anodyne	SLC6A4	17	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000875352864	GF	On-Demand	Anodyne	SLC6A3	45	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000875352865	GF	On-Demand	Anodyne	SLC6A4	17	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000875352865	GF	On-Demand	Anodyne	SLC6A3	45	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000875352866	GF	On-Demand	Anodyne	SLC6A4	17	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000875352866	GF	On-Demand	Anodyne	SLC6A3	45	41
C[S@@](=O)c1ccc(CNC(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000875352910	GF	On-Demand	Anodyne	CCR3	40	42
C[S@@](=O)c1ccc(CNC(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000875352910	GF	On-Demand	Anodyne	MLNR	28	45
C[S@@](=O)c1ccc(CNC(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000875352910	GF	On-Demand	Anodyne	EPHX2	26	52
C[S@](=O)c1ccc(CNC(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000875352911	GF	On-Demand	Anodyne	CCR3	40	42
C[S@](=O)c1ccc(CNC(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000875352911	GF	On-Demand	Anodyne	MLNR	28	45
C[S@](=O)c1ccc(CNC(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000875352911	GF	On-Demand	Anodyne	EPHX2	26	52
CCOC(=O)[C@H](C)C1CN(C(=O)NCCn2c(O)nc3ccccc32)C1	ZINC000875352946	FD	On-Demand	Anodyne	PDE6D	56	36
CC(=O)[C@@H]1CCCN(C(=O)NCCn2c(O)nc3ccccc32)C1	ZINC000875352948	ED	On-Demand	Anodyne	HRH1	29	42
CC(=O)[C@@H]1CCCN(C(=O)NCCn2c(O)nc3ccccc32)C1	ZINC000875352948	ED	On-Demand	Anodyne	HDAC8	16	40
CC(=O)[C@@H]1CCCN(C(=O)NCCn2c(O)nc3ccccc32)C1	ZINC000875352948	ED	On-Demand	Anodyne	SMO	30	40
CC(=O)[C@H]1CCCN(C(=O)NCCn2c(O)nc3ccccc32)C1	ZINC000875352949	ED	On-Demand	Anodyne	HRH1	29	42
CC(=O)[C@H]1CCCN(C(=O)NCCn2c(O)nc3ccccc32)C1	ZINC000875352949	ED	On-Demand	Anodyne	HDAC8	16	40
CC(=O)[C@H]1CCCN(C(=O)NCCn2c(O)nc3ccccc32)C1	ZINC000875352949	ED	On-Demand	Anodyne	SMO	30	40
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000875352954	ED	On-Demand	Reactive	DRD4	23	43
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000875352954	ED	On-Demand	Reactive	SIGMAR1	29	42
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000875352955	ED	On-Demand	Reactive	DRD4	23	43
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000875352955	ED	On-Demand	Reactive	SIGMAR1	29	42
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000875352956	ED	On-Demand	Reactive	DRD4	23	43
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000875352956	ED	On-Demand	Reactive	SIGMAR1	29	42
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000875352957	ED	On-Demand	Reactive	DRD4	23	43
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000875352957	ED	On-Demand	Reactive	SIGMAR1	29	42
CCC1(CNC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)CC1	ZINC000875352990	EG	On-Demand	Anodyne	OPRL1	17	44
C[C@@H](NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)C(=O)N(C)C	ZINC000875353021	DD	On-Demand	Anodyne	ACE	39	43
C[C@@H](NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)C(=O)N(C)C	ZINC000875353021	DD	On-Demand	Anodyne	PREP	24	42
C[C@@H](NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)C(=O)N(C)C	ZINC000875353021	DD	On-Demand	Anodyne	XIAP	43	40
C[C@@H](NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)C(=O)N(C)C	ZINC000875353022	DD	On-Demand	Anodyne	ACE	39	43
C[C@@H](NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)C(=O)N(C)C	ZINC000875353022	DD	On-Demand	Anodyne	PREP	24	42
C[C@@H](NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)C(=O)N(C)C	ZINC000875353022	DD	On-Demand	Anodyne	XIAP	43	40
C[C@@H](NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)C(=O)N(C)C	ZINC000875353023	DD	On-Demand	Anodyne	ACE	39	43
C[C@@H](NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)C(=O)N(C)C	ZINC000875353023	DD	On-Demand	Anodyne	PREP	24	42
C[C@@H](NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)C(=O)N(C)C	ZINC000875353023	DD	On-Demand	Anodyne	XIAP	43	40
C[C@@H](NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)C(=O)N(C)C	ZINC000875353024	DD	On-Demand	Anodyne	ACE	39	43
C[C@@H](NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)C(=O)N(C)C	ZINC000875353024	DD	On-Demand	Anodyne	PREP	24	42
C[C@@H](NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)C(=O)N(C)C	ZINC000875353024	DD	On-Demand	Anodyne	XIAP	43	40
CCC1(CNC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875353034	EH	On-Demand	Mild	CTSF	60	34
CCC1(CNC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875353034	EH	On-Demand	Mild	CTSL	25	40
CCC1(CNC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875353035	EH	On-Demand	Mild	CTSF	60	34
CCC1(CNC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)CC1	ZINC000875353035	EH	On-Demand	Mild	CTSL	25	40
CCCCCCCNC(=O)C(=O)NCc1nnc(SC)s1	ZINC000875353075	ED	On-Demand	Mild	ASAH1	64	36
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1nc(Cc2ccccc2)no1	ZINC000875353114	FD	On-Demand	Anodyne	Q6PRC7_IXORI	46	33
CN1CCN(C2CCN(C(=O)NCCn3c(O)nc4ccccc43)CC2)CC1	ZINC000875353115	GD	On-Demand	Anodyne	HRH1	31	42
CN1CCN(C2CCN(C(=O)NCCn3c(O)nc4ccccc43)CC2)CC1	ZINC000875353115	GD	On-Demand	Anodyne	HTR4	19	46
CN1CCN(C2CCN(C(=O)NCCn3c(O)nc4ccccc43)CC2)CC1	ZINC000875353115	GD	On-Demand	Anodyne	PLD1	40	37
CN1CCN(C2CCN(C(=O)NCCn3c(O)nc4ccccc43)CC2)CC1	ZINC000875353115	GD	On-Demand	Anodyne	SMO	37	40
CN1CCN(C2CCN(C(=O)NCCn3c(O)nc4ccccc43)CC2)CC1	ZINC000875353115	GD	On-Demand	Anodyne	L3MBTL3	58	39
C[S@@](=O)c1ccc(CNC(=O)N[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000875353117	GG	On-Demand	Anodyne	NAMPT	54	41
C[S@](=O)c1ccc(CNC(=O)N[C@@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000875353118	GG	On-Demand	Anodyne	NAMPT	54	41
C[S@](=O)c1ccc(CNC(=O)N[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000875353119	GG	On-Demand	Anodyne	NAMPT	54	41
C[S@@](=O)c1ccc(CNC(=O)N[C@H](Cc2cccnc2)C2CCCC2)cc1	ZINC000875353120	GG	On-Demand	Anodyne	NAMPT	54	41
CC(C)n1nc(C(=O)NNC(=O)c2ccccc2NC(=O)c2cccs2)c2ccccc2c1=O	ZINC000875353129	JG	On-Demand	Reactive	STK33	32	41
C[C@@H](NC(=O)N1CCC[C@H](OC2CCC2)CC1)c1nc(Cc2ccccc2)no1	ZINC000875353152	GH	On-Demand	Anodyne	BMP1	37	40
C[C@@H](NC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1nc(Cc2ccccc2)no1	ZINC000875353155	GH	On-Demand	Anodyne	BMP1	37	40
O=C(N[C@H]1CCN(c2cccc(Cl)c2)C1=O)N1CCC(CO)(CO)CC1	ZINC000875353232	GD	On-Demand	Anodyne	CACNA1H	47	36
O=C(N[C@@H]1CCN(c2cccc(Cl)c2)C1=O)N1CCC(CO)(CO)CC1	ZINC000875353233	GD	On-Demand	Anodyne	CACNA1H	47	36
O=C(N[C@H]1CCN(c2cccc(Cl)c2)C1)N1CCC(CO)(CO)CC1	ZINC000875353264	FD	On-Demand	Anodyne	CACNA1H	54	35
O=C(N[C@@H]1CCN(c2cccc(Cl)c2)C1)N1CCC(CO)(CO)CC1	ZINC000875353265	FD	On-Demand	Anodyne	CACNA1H	54	35
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1nc(Cc2ccccc2)no1	ZINC000875353283	FF	On-Demand	Anodyne	BMP1	49	42
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1nc(Cc2ccccc2)no1	ZINC000875353283	FF	On-Demand	Anodyne	BIRC2	49	39
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1nc(Cc2ccccc2)no1	ZINC000875353286	FF	On-Demand	Anodyne	BMP1	49	42
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1nc(Cc2ccccc2)no1	ZINC000875353286	FF	On-Demand	Anodyne	BIRC2	49	39
Cc1cncc([C@@H]2CCCN2C(=O)N[C@H](C)c2nc(Cc3ccccc3)no2)c1	ZINC000875353309	GH	On-Demand	Anodyne	ADAM17	18	41
Cc1cncc([C@@H]2CCCN2C(=O)N[C@H](C)c2nc(Cc3ccccc3)no2)c1	ZINC000875353309	GH	On-Demand	Anodyne	CPT1A	41	36
Cc1cncc([C@@H]2CCCN2C(=O)N[C@@H](C)c2nc(Cc3ccccc3)no2)c1	ZINC000875353310	GH	On-Demand	Anodyne	ADAM17	18	41
Cc1cncc([C@@H]2CCCN2C(=O)N[C@@H](C)c2nc(Cc3ccccc3)no2)c1	ZINC000875353310	GH	On-Demand	Anodyne	CPT1A	41	36
Cc1cncc([C@H]2CCCN2C(=O)N[C@@H](C)c2nc(Cc3ccccc3)no2)c1	ZINC000875353311	GH	On-Demand	Anodyne	ADAM17	18	41
Cc1cncc([C@H]2CCCN2C(=O)N[C@@H](C)c2nc(Cc3ccccc3)no2)c1	ZINC000875353311	GH	On-Demand	Anodyne	CPT1A	41	36
Cc1cncc([C@H]2CCCN2C(=O)N[C@H](C)c2nc(Cc3ccccc3)no2)c1	ZINC000875353312	GH	On-Demand	Anodyne	ADAM17	18	41
Cc1cncc([C@H]2CCCN2C(=O)N[C@H](C)c2nc(Cc3ccccc3)no2)c1	ZINC000875353312	GH	On-Demand	Anodyne	CPT1A	41	36
O=C(NCCn1c(O)nc2ccccc21)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875353314	EE	On-Demand	Anodyne	PDE6D	42	32
O=C(NCCn1c(O)nc2ccccc21)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875353315	EE	On-Demand	Anodyne	PDE6D	42	32
O=C(NCCn1c(O)nc2ccccc21)N1CC[C@H]2CSC[C@H]2C1	ZINC000875353316	EE	On-Demand	Anodyne	PDE6D	42	32
O=C(NCCn1c(O)nc2ccccc21)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875353317	EE	On-Demand	Anodyne	PDE6D	42	32
CC(=O)Nc1cccc2c1CN(C(=O)NCCn1c(O)nc3ccccc31)CC2	ZINC000875353318	GE	On-Demand	Anodyne	FABI	41	30
C[S@@](=O)c1ccc(CNC(=O)N2CCN([S@@](C)(=N)=O)CC2)cc1	ZINC000875353324	FC	On-Demand	Anodyne	NAMPT	27	41
C[S@](=O)c1ccc(CNC(=O)N2CCN([S@](C)(=N)=O)CC2)cc1	ZINC000875353325	FC	On-Demand	Anodyne	NAMPT	27	41
C[S@@](=O)c1ccc(CNC(=O)N2CCN([S@](C)(=N)=O)CC2)cc1	ZINC000875353326	FC	On-Demand	Anodyne	NAMPT	27	41
C[S@](=O)c1ccc(CNC(=O)N2CCN([S@@](C)(=N)=O)CC2)cc1	ZINC000875353327	FC	On-Demand	Anodyne	NAMPT	27	41
C[C@H]1C[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CCN1Cc1ccccc1	ZINC000875353331	GE	On-Demand	Anodyne	CHRM1	15	42
C[C@H]1C[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CCN1Cc1ccccc1	ZINC000875353331	GE	On-Demand	Anodyne	DRD4	34	47
C[C@H]1C[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CCN1Cc1ccccc1	ZINC000875353331	GE	On-Demand	Anodyne	CHRM3	22	42
C[C@H]1C[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CCN1Cc1ccccc1	ZINC000875353331	GE	On-Demand	Anodyne	SIGMAR1	34	45
C[C@H]1C[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CCN1Cc1ccccc1	ZINC000875353331	GE	On-Demand	Anodyne	CCR3	25	41
C[C@H]1C[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CCN1Cc1ccccc1	ZINC000875353331	GE	On-Demand	Anodyne	SLC6A5	29	43
C[C@H]1C[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CCN1Cc1ccccc1	ZINC000875353331	GE	On-Demand	Anodyne	MCHR1	17	44
C[S@@](=O)c1ccc(CNC(=O)N2CCO[C@H](c3noc(C4CC4)n3)C2)cc1	ZINC000875353333	GD	On-Demand	Anodyne	ETHR	52	34
C[S@](=O)c1ccc(CNC(=O)N2CCO[C@H](c3noc(C4CC4)n3)C2)cc1	ZINC000875353334	GD	On-Demand	Anodyne	ETHR	52	34
C[S@](=O)c1ccc(CNC(=O)N2CCO[C@@H](c3noc(C4CC4)n3)C2)cc1	ZINC000875353335	GD	On-Demand	Anodyne	ETHR	52	34
C[S@@](=O)c1ccc(CNC(=O)N2CCO[C@@H](c3noc(C4CC4)n3)C2)cc1	ZINC000875353336	GD	On-Demand	Anodyne	ETHR	52	34
CSc1nnc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)s1	ZINC000875353367	GD	On-Demand	Anodyne	SIRT3	51	31
CSc1nnc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)s1	ZINC000875353367	GD	On-Demand	Anodyne	SIRT2	53	34
CSc1nnc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)s1	ZINC000875353367	GD	On-Demand	Anodyne	SIRT1	51	34
CCC1(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875353397	DG	On-Demand	Anodyne	FKBP1A	19	42
CCC1(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875353397	DG	On-Demand	Anodyne	HCN1	51	33
CCC1(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875353397	DG	On-Demand	Anodyne	HCN4	50	33
CCC1(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875353398	DG	On-Demand	Anodyne	FKBP1A	19	42
CCC1(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875353398	DG	On-Demand	Anodyne	HCN1	51	33
CCC1(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875353398	DG	On-Demand	Anodyne	HCN4	50	33
CCC1(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875353399	DG	On-Demand	Anodyne	FKBP1A	19	42
CCC1(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875353399	DG	On-Demand	Anodyne	HCN1	51	33
CCC1(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875353399	DG	On-Demand	Anodyne	HCN4	50	33
CCC1(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875353400	DG	On-Demand	Anodyne	FKBP1A	19	42
CCC1(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875353400	DG	On-Demand	Anodyne	HCN1	51	33
CCC1(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875353400	DG	On-Demand	Anodyne	HCN4	50	33
CCC1(CNC(=O)N2CCC[C@](O)(c3ccccc3)C2)CC1	ZINC000875353418	DF	On-Demand	Anodyne	HCN1	48	30
CCC1(CNC(=O)N2CCC[C@](O)(c3ccccc3)C2)CC1	ZINC000875353418	DF	On-Demand	Anodyne	HCN4	46	30
CCC1(CNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)CC1	ZINC000875353419	DF	On-Demand	Anodyne	HCN1	48	30
CCC1(CNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)CC1	ZINC000875353419	DF	On-Demand	Anodyne	HCN4	46	30
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CC(=O)N(c2cccc(C(F)(F)F)c2)C1	ZINC000875353420	FD	On-Demand	Anodyne	CCR2	48	35
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CC(=O)N(c2cccc(C(F)(F)F)c2)C1	ZINC000875353421	FD	On-Demand	Anodyne	CCR2	48	35
C[C@H](NC(=O)N1C[C@H]2CC=CC[C@H]2C1)c1nc(Cc2ccccc2)no1	ZINC000875353483	FG	On-Demand	Anodyne	BMP1	30	41
C[C@@H](NC(=O)N1C[C@H]2CC=CC[C@H]2C1)c1nc(Cc2ccccc2)no1	ZINC000875353484	FG	On-Demand	Anodyne	BMP1	30	41
CN1CCC(CNC(=O)NCc2ccc([S@@](C)=O)cc2)(c2ccccc2)CC1	ZINC000875353517	GF	On-Demand	Anodyne	KCNA3	44	39
CN1CCC(CNC(=O)NCc2ccc([S@@](C)=O)cc2)(c2ccccc2)CC1	ZINC000875353517	GF	On-Demand	Anodyne	SOAT1	15	42
CN1CCC(CNC(=O)NCc2ccc([S@@](C)=O)cc2)(c2ccccc2)CC1	ZINC000875353517	GF	On-Demand	Anodyne	NPFFR1	32	44
CN1CCC(CNC(=O)NCc2ccc([S@](C)=O)cc2)(c2ccccc2)CC1	ZINC000875353518	GF	On-Demand	Anodyne	KCNA3	44	39
CN1CCC(CNC(=O)NCc2ccc([S@](C)=O)cc2)(c2ccccc2)CC1	ZINC000875353518	GF	On-Demand	Anodyne	SOAT1	15	42
CN1CCC(CNC(=O)NCc2ccc([S@](C)=O)cc2)(c2ccccc2)CC1	ZINC000875353518	GF	On-Demand	Anodyne	NPFFR1	32	44
C[C@H](NC(=O)NCCCCC1CC1)c1nc(Cc2ccccc2)no1	ZINC000875353519	EH	On-Demand	Anodyne	BMP1	68	44
C[C@@H](NC(=O)NCCCCC1CC1)c1nc(Cc2ccccc2)no1	ZINC000875353520	EH	On-Demand	Anodyne	BMP1	68	44
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc([S@@](C)=O)cc1	ZINC000875353580	DD	On-Demand	Anodyne	ANPEP	15	42
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NCCC[C@H]2CCOC2=O)CC1	ZINC000875353618	GD	On-Demand	Anodyne	CACNA1H	17	40
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NCCC[C@H]2CCOC2=O)CC1	ZINC000875353618	GD	On-Demand	Anodyne	CACNA1I	50	48
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NCCC[C@@H]2CCOC2=O)CC1	ZINC000875353620	GD	On-Demand	Anodyne	CACNA1H	17	40
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NCCC[C@@H]2CCOC2=O)CC1	ZINC000875353620	GD	On-Demand	Anodyne	CACNA1I	50	48
O=C(NC1CCC(N2CCCCC2)CC1)N[C@@H]1C[C@H](CO)C1	ZINC000875353630	DD	On-Demand	Anodyne	L3MBTL3	47	35
CS(=O)(=O)NC1CN(C(=O)NC2CCC(N3CCCCC3)CC2)C1	ZINC000875353655	FC	On-Demand	Anodyne	L3MBTL3	49	35
C[C@@H](NC(=O)N1Cc2cccc(O)c2C1)c1noc(Cc2ccccc2)n1	ZINC000875353668	FG	On-Demand	Clean	TPSAB1	52	34
C[C@H](NC(=O)N1Cc2cccc(O)c2C1)c1noc(Cc2ccccc2)n1	ZINC000875353670	FG	On-Demand	Clean	TPSAB1	52	34
CN1CCN(C2CCN(C(=O)NC3CCC(N4CCCCC4)CC3)CC2)CC1	ZINC000875353673	GE	On-Demand	Anodyne	L3MBTL3	99	50
CN1CCN(C(=O)NCC2CCN(CC(=O)NC(C)(C)C)CC2)CCC1(C)C	ZINC000875353685	GD	On-Demand	Anodyne	CACNA1I	54	49
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@@H](C)c1noc(Cc2ccccc2)n1	ZINC000875353690	FF	On-Demand	Anodyne	TIMP3	73	35
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@H](C)c1noc(Cc2ccccc2)n1	ZINC000875353692	FF	On-Demand	Anodyne	TIMP3	73	35
CC(C)(C)NC(=O)CN1CCC(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)CC1	ZINC000875353703	GD	On-Demand	Anodyne	CACNA1I	62	54
CC(C)(C)NC(=O)CN1CCC(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)CC1	ZINC000875353705	GD	On-Demand	Anodyne	CACNA1I	62	54
CCn1ncc(CNC(=O)N[C@@H](c2ccccc2C)C(C)(C)C)n1	ZINC000875353710	EG	On-Demand	Anodyne	CTSA	54	34
CCn1ncc(CNC(=O)N[C@H](c2ccccc2C)C(C)(C)C)n1	ZINC000875353711	EG	On-Demand	Anodyne	CTSA	54	34
CC(=O)[C@@H]1CCCN(C(=O)NCC2CCN(CCC(C)C)CC2)C1	ZINC000875353712	EF	On-Demand	Anodyne	HTR4	40	39
CC(=O)[C@@H]1CCCN(C(=O)NCC2CCN(CCC(C)C)CC2)C1	ZINC000875353712	EF	On-Demand	Anodyne	CACNA1I	57	35
CC(=O)[C@H]1CCCN(C(=O)NCC2CCN(CCC(C)C)CC2)C1	ZINC000875353713	EF	On-Demand	Anodyne	HTR4	40	39
CC(=O)[C@H]1CCCN(C(=O)NCC2CCN(CCC(C)C)CC2)C1	ZINC000875353713	EF	On-Demand	Anodyne	CACNA1I	57	35
C[S@](=O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875353715	GG	On-Demand	Anodyne	CCR5	18	41
C[S@](=O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875353715	GG	On-Demand	Anodyne	PREP	27	42
C[S@](=O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875353715	GG	On-Demand	Anodyne	TMPRSS11D	65	36
C[S@](=O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875353716	GG	On-Demand	Anodyne	CCR5	18	41
C[S@](=O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875353716	GG	On-Demand	Anodyne	PREP	27	42
C[S@](=O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875353716	GG	On-Demand	Anodyne	TMPRSS11D	65	36
C[S@](=O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875353717	GG	On-Demand	Anodyne	CCR5	18	41
C[S@](=O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875353717	GG	On-Demand	Anodyne	PREP	27	42
C[S@](=O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875353717	GG	On-Demand	Anodyne	TMPRSS11D	65	36
C[S@](=O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875353718	GG	On-Demand	Anodyne	CCR5	18	41
C[S@](=O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875353718	GG	On-Demand	Anodyne	PREP	27	42
C[S@](=O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875353718	GG	On-Demand	Anodyne	TMPRSS11D	65	36
CCOC1CC2(C1)C[C@@H]2NC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1	ZINC000875353719	GD	On-Demand	Anodyne	CACNA1I	47	48
CCOC1CC2(C1)C[C@H]2NC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1	ZINC000875353720	GD	On-Demand	Anodyne	CACNA1I	47	48
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@H](O)[C@@H]2CCCC[C@@H]21	ZINC000875353752	FG	On-Demand	Anodyne	L3MBTL3	74	38
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@H](O)[C@H]2CCCC[C@@H]21	ZINC000875353753	FG	On-Demand	Anodyne	L3MBTL3	74	38
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@H](O)[C@H]2CCCC[C@H]21	ZINC000875353754	FG	On-Demand	Anodyne	L3MBTL3	74	38
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@H](O)[C@@H]2CCCC[C@H]21	ZINC000875353755	FG	On-Demand	Anodyne	L3MBTL3	74	38
C[S@](=O)c1ccc(CNC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)cc1	ZINC000875353757	GG	On-Demand	Anodyne	OPRL1	15	43
C[S@@](=O)c1ccc(CNC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)cc1	ZINC000875353758	GG	On-Demand	Anodyne	OPRL1	15	43
COCC(C)(C)CCNC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1	ZINC000875353759	GD	On-Demand	Anodyne	CACNA1H	26	46
COCC(C)(C)CCNC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1	ZINC000875353759	GD	On-Demand	Anodyne	CACNA1I	69	53
O=C(NC1CCC(N2CCCCC2)CC1)N1CCC(CO)(CO)CC1	ZINC000875353762	FD	On-Demand	Anodyne	L3MBTL3	60	35
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc([S@](C)=O)cc1	ZINC000875353789	DD	On-Demand	Anodyne	ANPEP	15	42
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(Cc4ccccc4)[C@@H](C)C3)C[C@@H]1C2	ZINC000875353811	GF	On-Demand	Anodyne	DRD4	18	40
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(Cc4ccccc4)[C@@H](C)C3)C[C@@H]1C2	ZINC000875353811	GF	On-Demand	Anodyne	SIGMAR1	29	40
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(Cc4ccccc4)[C@@H](C)C3)C[C@@H]1C2	ZINC000875353811	GF	On-Demand	Anodyne	EPHX2	15	44
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(Cc4ccccc4)[C@H](C)C3)C[C@@H]1C2	ZINC000875353812	GF	On-Demand	Anodyne	DRD4	18	40
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(Cc4ccccc4)[C@H](C)C3)C[C@@H]1C2	ZINC000875353812	GF	On-Demand	Anodyne	SIGMAR1	29	40
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(Cc4ccccc4)[C@H](C)C3)C[C@@H]1C2	ZINC000875353812	GF	On-Demand	Anodyne	EPHX2	15	44
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(Cc4ccccc4)[C@@H](C)C3)C[C@@H]1C2	ZINC000875353813	GF	On-Demand	Anodyne	DRD4	18	40
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(Cc4ccccc4)[C@@H](C)C3)C[C@@H]1C2	ZINC000875353813	GF	On-Demand	Anodyne	SIGMAR1	29	40
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(Cc4ccccc4)[C@@H](C)C3)C[C@@H]1C2	ZINC000875353813	GF	On-Demand	Anodyne	EPHX2	15	44
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(Cc4ccccc4)[C@H](C)C3)C[C@@H]1C2	ZINC000875353814	GF	On-Demand	Anodyne	DRD4	18	40
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(Cc4ccccc4)[C@H](C)C3)C[C@@H]1C2	ZINC000875353814	GF	On-Demand	Anodyne	SIGMAR1	29	40
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(Cc4ccccc4)[C@H](C)C3)C[C@@H]1C2	ZINC000875353814	GF	On-Demand	Anodyne	EPHX2	15	44
CC[C@@H](CNC(=O)N[C@@H]1CCOC[C@H]1O)Oc1cccc(C(F)(F)F)c1	ZINC000875353825	GE	On-Demand	Anodyne	CCR2	43	39
CC[C@@H](CNC(=O)N[C@@H]1CCOC[C@H]1O)Oc1cccc(C(F)(F)F)c1	ZINC000875353825	GE	On-Demand	Anodyne	PDS	51	42
CC[C@@H](CNC(=O)N1CCCN(C=O)CC1)Oc1cccc(C(F)(F)F)c1	ZINC000875353845	GF	On-Demand	Anodyne	PDS	68	44
O=C(NCCn1c(O)nc2ccccc21)N1CCC[C@H](OC2CCC2)CC1	ZINC000875353855	FF	On-Demand	Anodyne	SMO	37	41
O=C(NCCn1c(O)nc2ccccc21)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875353856	FF	On-Demand	Anodyne	SMO	37	41
C[C@@H]1CN(C(=O)NCc2ccc([S@@](C)=O)cc2)Cc2ccccc21	ZINC000875353861	EG	On-Demand	Anodyne	NAMPT	23	46
C[C@@H]1CN(C(=O)NCc2ccc([S@](C)=O)cc2)Cc2ccccc21	ZINC000875353863	EG	On-Demand	Anodyne	NAMPT	23	46
CN1CCN(C(=O)NCCn2c(O)nc3ccccc32)CCC1(C)C	ZINC000875353885	ED	On-Demand	Anodyne	SMO	34	40
Cc1ccccc1[C@H](NC(=O)N[C@H](C)c1ccnn1C)C(C)(C)C	ZINC000875353886	EH	On-Demand	Anodyne	CTSA	54	33
Cc1ccccc1[C@@H](NC(=O)N[C@H](C)c1ccnn1C)C(C)(C)C	ZINC000875353889	EH	On-Demand	Anodyne	CTSA	54	33
Cc1ccccc1[C@@H](NC(=O)N[C@@H](C)c1ccnn1C)C(C)(C)C	ZINC000875353891	EH	On-Demand	Anodyne	CTSA	54	33
Cc1ccccc1[C@H](NC(=O)N[C@@H](C)c1ccnn1C)C(C)(C)C	ZINC000875353892	EH	On-Demand	Anodyne	CTSA	54	33
CN(C(=O)NC1CCC(N2CCCCC2)CC1)[C@@H]1CCCC[C@H]1O	ZINC000875353895	EF	On-Demand	Anodyne	L3MBTL3	47	36
CC(C)(C)NC(=O)CN1CCC(CNC(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875353899	GD	On-Demand	Anodyne	CACNA1H	20	41
CC(C)(C)NC(=O)CN1CCC(CNC(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875353899	GD	On-Demand	Anodyne	CACNA1I	69	56
CC(C)(C)NC(=O)CN1CCC(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875353900	GD	On-Demand	Anodyne	CACNA1H	20	41
CC(C)(C)NC(=O)CN1CCC(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875353900	GD	On-Demand	Anodyne	CACNA1I	69	56
N#CCCN1CCN(C(=O)NC2CCC(N3CCCCC3)CC2)CC1	ZINC000875353905	EE	On-Demand	Mild	L3MBTL3	49	33
CC(C)(C)NC(=O)CN1CCC(CNC(=O)N2Cc3cccc(O)c3C2)CC1	ZINC000875353908	GE	On-Demand	Clean	CACNA1I	70	53
O=C(NC1CCC(N2CCCCC2)CC1)N1CCO[C@@H](CCF)C1	ZINC000875353911	EF	On-Demand	Anodyne	L3MBTL3	44	34
O=C(NC1CCC(N2CCCCC2)CC1)N1CCO[C@H](CCF)C1	ZINC000875353912	EF	On-Demand	Anodyne	L3MBTL3	44	34
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@H]2CC[C@@H](C1)S2(=O)=O	ZINC000875353913	GE	On-Demand	Anodyne	L3MBTL3	82	40
O=C(NC1CCC(N2CCCCC2)CC1)N1CC2(CCCO2)C1	ZINC000875353914	DE	On-Demand	Anodyne	L3MBTL3	45	34
C[C@H](NC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1)c1ccccc1O	ZINC000875353920	GE	On-Demand	Clean	CACNA1H	15	40
C[C@H](NC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1)c1ccccc1O	ZINC000875353920	GE	On-Demand	Clean	HTR4	50	38
C[C@H](NC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1)c1ccccc1O	ZINC000875353920	GE	On-Demand	Clean	CACNA1I	68	53
C[C@@H](NC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1)c1ccccc1O	ZINC000875353921	GE	On-Demand	Clean	CACNA1H	15	40
C[C@@H](NC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1)c1ccccc1O	ZINC000875353921	GE	On-Demand	Clean	HTR4	50	38
C[C@@H](NC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1)c1ccccc1O	ZINC000875353921	GE	On-Demand	Clean	CACNA1I	68	53
O=C(NC[C@@H](O)[C@@H]1CCCO1)NC1CCC(N2CCCCC2)CC1	ZINC000875353943	ED	On-Demand	Anodyne	L3MBTL3	41	34
O=C(NC[C@@H](O)[C@H]1CCCO1)NC1CCC(N2CCCCC2)CC1	ZINC000875353944	ED	On-Demand	Anodyne	L3MBTL3	41	34
O=C(NC[C@H](O)[C@@H]1CCCO1)NC1CCC(N2CCCCC2)CC1	ZINC000875353945	ED	On-Demand	Anodyne	L3MBTL3	41	34
O=C(NC[C@H](O)[C@H]1CCCO1)NC1CCC(N2CCCCC2)CC1	ZINC000875353946	ED	On-Demand	Anodyne	L3MBTL3	41	34
C#C[C@@H]1CC[C@@H](NC(=O)NCC2CCN(CC(=O)NC(C)(C)C)CC2)CC1	ZINC000875353947	GE	On-Demand	Mild	CACNA1I	51	50
CC(=O)[C@H]1CCCN(C(=O)NCC2CCN(CC(=O)NC(C)(C)C)CC2)C1	ZINC000875353948	GD	On-Demand	Anodyne	CACNA1I	60	53
CC(=O)[C@@H]1CCCN(C(=O)NCC2CCN(CC(=O)NC(C)(C)C)CC2)C1	ZINC000875353949	GD	On-Demand	Anodyne	CACNA1I	60	53
C#C[C@@H]1CC[C@@H](NC(=O)N[C@H](C)c2noc(Cc3ccccc3)n2)CC1	ZINC000875353961	FG	On-Demand	Mild	TPSAB1	54	38
C#C[C@@H]1CC[C@@H](NC(=O)N[C@@H](C)c2noc(Cc3ccccc3)n2)CC1	ZINC000875353962	FG	On-Demand	Mild	TPSAB1	54	38
O=C(NC1CCC(N2CCCCC2)CC1)N1CCN(c2nccnn2)CC1	ZINC000875353963	FD	On-Demand	Anodyne	L3MBTL3	54	35
O=C(NC1CCC(N2CCCCC2)CC1)N[C@@H]1COCC[C@H]1O	ZINC000875353971	ED	On-Demand	Anodyne	L3MBTL3	46	35
Cc1nccnc1[C@H](C)NC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1	ZINC000875353980	GD	On-Demand	Anodyne	CACNA1I	69	52
Cc1nccnc1[C@@H](C)NC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1	ZINC000875353981	GD	On-Demand	Anodyne	CACNA1I	69	52
Cc1ccccc1[C@H](NC(=O)NC(c1ccnn1C)c1ccnn1C)C(C)(C)C	ZINC000875353982	GH	On-Demand	Anodyne	CTSA	58	36
Cc1ccccc1[C@@H](NC(=O)NC(c1ccnn1C)c1ccnn1C)C(C)(C)C	ZINC000875353983	GH	On-Demand	Anodyne	CTSA	58	36
CCOC1CC2(C1)C[C@H]2NC(=O)N[C@@H](C)c1nc(Cc2ccccc2)no1	ZINC000875354004	FF	On-Demand	Anodyne	TIMP3	73	35
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@@H](C)c1nc(Cc2ccccc2)no1	ZINC000875354005	FF	On-Demand	Anodyne	TIMP3	73	35
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@H](C)c1nc(Cc2ccccc2)no1	ZINC000875354006	FF	On-Demand	Anodyne	TIMP3	73	35
Cc1cncc([C@@H]2CCCN2C(=O)NCc2ccc([S@@](C)=O)cc2)c1	ZINC000875354019	FG	On-Demand	Anodyne	PREP	17	40
Cc1cncc([C@@H]2CCCN2C(=O)NCc2ccc([S@](C)=O)cc2)c1	ZINC000875354020	FG	On-Demand	Anodyne	PREP	17	40
Cc1cncc([C@H]2CCCN2C(=O)NCc2ccc([S@](C)=O)cc2)c1	ZINC000875354021	FG	On-Demand	Anodyne	PREP	17	40
Cc1cncc([C@H]2CCCN2C(=O)NCc2ccc([S@@](C)=O)cc2)c1	ZINC000875354022	FG	On-Demand	Anodyne	PREP	17	40
CC(=O)C1CCN(C(=O)NCc2ccc([S@@](C)=O)cc2)CC1	ZINC000875354031	DD	On-Demand	Anodyne	EPHX2	15	41
CC(=O)C1CCN(C(=O)NCc2ccc([S@@](C)=O)cc2)CC1	ZINC000875354031	DD	On-Demand	Anodyne	NAMPT	26	40
CC(=O)C1CCN(C(=O)NCc2ccc([S@](C)=O)cc2)CC1	ZINC000875354032	DD	On-Demand	Anodyne	EPHX2	15	41
CC(=O)C1CCN(C(=O)NCc2ccc([S@](C)=O)cc2)CC1	ZINC000875354032	DD	On-Demand	Anodyne	NAMPT	26	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)C1	ZINC000875354062	GF	On-Demand	Anodyne	ACE	34	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)C1	ZINC000875354063	GF	On-Demand	Anodyne	ACE	34	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)C1	ZINC000875354064	GF	On-Demand	Anodyne	ACE	34	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)C1	ZINC000875354065	GF	On-Demand	Anodyne	ACE	34	40
C[S@@](=O)c1ccc(CNC(=O)N2CC[C@@]3(CCc4ccccc43)C2)cc1	ZINC000875354066	FG	On-Demand	Anodyne	OXTR	44	35
C[S@](=O)c1ccc(CNC(=O)N2CC[C@@]3(CCc4ccccc43)C2)cc1	ZINC000875354067	FG	On-Demand	Anodyne	OXTR	44	35
C[S@@](=O)c1ccc(CNC(=O)N2CC[C@]3(CCc4ccccc43)C2)cc1	ZINC000875354068	FG	On-Demand	Anodyne	OXTR	44	35
C[S@](=O)c1ccc(CNC(=O)N2CC[C@]3(CCc4ccccc43)C2)cc1	ZINC000875354069	FG	On-Demand	Anodyne	OXTR	44	35
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1nc(Cc2ccccc2)no1	ZINC000875354075	FF	On-Demand	Anodyne	BMP1	40	41
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1nc(Cc2ccccc2)no1	ZINC000875354075	FF	On-Demand	Anodyne	BIRC2	44	36
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1nc(Cc2ccccc2)no1	ZINC000875354076	FF	On-Demand	Anodyne	BMP1	40	41
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1nc(Cc2ccccc2)no1	ZINC000875354076	FF	On-Demand	Anodyne	BIRC2	44	36
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@H]2CC[C@@H](C1)S2	ZINC000875354101	FG	On-Demand	Anodyne	L3MBTL3	85	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2noc(Cc3ccccc3)n2)C1	ZINC000875354106	GF	On-Demand	Anodyne	P2RY12	45	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2noc(Cc3ccccc3)n2)C1	ZINC000875354106	GF	On-Demand	Anodyne	TPSAB1	65	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2noc(Cc3ccccc3)n2)C1	ZINC000875354108	GF	On-Demand	Anodyne	P2RY12	45	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2noc(Cc3ccccc3)n2)C1	ZINC000875354108	GF	On-Demand	Anodyne	TPSAB1	65	40
O=C(NC1CCC(N2CCCCC2)CC1)N[C@H]1COC[C@H]1O	ZINC000875354117	DC	On-Demand	Anodyne	L3MBTL3	58	36
Cn1nnnc1C1CCN(C(=O)NC2CCC(N3CCCCC3)CC2)CC1	ZINC000875354121	GD	On-Demand	Anodyne	L3MBTL3	59	35
C[C@@H](NC(=O)NCC(C)(C)C(C)(F)F)c1noc(Cc2ccccc2)n1	ZINC000875354126	FH	On-Demand	Anodyne	TPSAB1	47	34
C[C@H](NC(=O)NCC(C)(C)C(C)(F)F)c1noc(Cc2ccccc2)n1	ZINC000875354127	FH	On-Demand	Anodyne	TPSAB1	47	34
COC(=O)N(C)NC(=O)NCC1CCN(CCC(C)C)CC1	ZINC000875354133	DD	On-Demand	Reactive	CACNA1I	56	37
COC(=O)[C@@]1(OC)CCN(C(=O)NC2CCC(N3CCCCC3)CC2)C1	ZINC000875354138	FD	On-Demand	Anodyne	L3MBTL3	44	35
Cc1nnc(NNC(=O)NCC2CCN(CCC(C)C)CC2)n1C	ZINC000875354145	ED	On-Demand	Reactive	CACNA1I	55	35
Cc1ccccc1[C@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)C(C)(C)C	ZINC000875354146	GH	On-Demand	Anodyne	L3MBTL3	67	40
Cc1ccccc1[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)C(C)(C)C	ZINC000875354147	GH	On-Demand	Anodyne	L3MBTL3	67	40
Cc1ccccc1[C@H](NC(=O)N1CCC(CO)(CO)CC1)C(C)(C)C	ZINC000875354168	EF	On-Demand	Anodyne	GHRHR	57	34
Cc1ccccc1[C@@H](NC(=O)N1CCC(CO)(CO)CC1)C(C)(C)C	ZINC000875354169	EF	On-Demand	Anodyne	GHRHR	57	34
O=C(NC1CCC(N2CCCCC2)CC1)N1O[C@H]2C=C[C@H]1CC2	ZINC000875354170	DF	On-Demand	Anodyne	L3MBTL3	53	36
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)c2noc(Cc3ccccc3)n2)C1	ZINC000875354171	FF	On-Demand	Anodyne	CCR5	26	47
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)c2noc(Cc3ccccc3)n2)C1	ZINC000875354171	FF	On-Demand	Anodyne	TPSAB1	52	37
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)c2noc(Cc3ccccc3)n2)C1	ZINC000875354171	FF	On-Demand	Anodyne	BIRC2	39	40
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)c2noc(Cc3ccccc3)n2)C1	ZINC000875354172	FF	On-Demand	Anodyne	CCR5	26	47
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)c2noc(Cc3ccccc3)n2)C1	ZINC000875354172	FF	On-Demand	Anodyne	TPSAB1	52	37
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)c2noc(Cc3ccccc3)n2)C1	ZINC000875354172	FF	On-Demand	Anodyne	BIRC2	39	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)c2noc(Cc3ccccc3)n2)C1	ZINC000875354173	FF	On-Demand	Anodyne	CCR5	26	47
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)c2noc(Cc3ccccc3)n2)C1	ZINC000875354173	FF	On-Demand	Anodyne	TPSAB1	52	37
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)c2noc(Cc3ccccc3)n2)C1	ZINC000875354173	FF	On-Demand	Anodyne	BIRC2	39	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)c2noc(Cc3ccccc3)n2)C1	ZINC000875354174	FF	On-Demand	Anodyne	CCR5	26	47
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)c2noc(Cc3ccccc3)n2)C1	ZINC000875354174	FF	On-Demand	Anodyne	TPSAB1	52	37
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)c2noc(Cc3ccccc3)n2)C1	ZINC000875354174	FF	On-Demand	Anodyne	BIRC2	39	40
O=C(NC1CCC(N2CCCCC2)CC1)N1[C@H]2CC[C@H]1CC(F)(F)C2	ZINC000875354175	FH	On-Demand	Anodyne	L3MBTL3	42	36
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875354176	EE	On-Demand	Anodyne	L3MBTL3	63	35
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@H](C)c2noc(Cc3ccccc3)n2)C1	ZINC000875354177	FF	On-Demand	Anodyne	TPSAB1	53	36
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@@H](C)c2noc(Cc3ccccc3)n2)C1	ZINC000875354178	FF	On-Demand	Anodyne	TPSAB1	53	36
C[C@@H](NC(=O)N1CCC[C@H](OC2CCC2)CC1)c1noc(Cc2ccccc2)n1	ZINC000875354183	GH	On-Demand	Anodyne	TPSAB1	52	35
C[C@@H](NC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1noc(Cc2ccccc2)n1	ZINC000875354186	GH	On-Demand	Anodyne	TPSAB1	52	35
C[C@H](NC(=O)NC1CCC(N2CCCCC2)CC1)c1ccccc1O	ZINC000875354187	EH	On-Demand	Clean	ADRA1D	20	43
C[C@H](NC(=O)NC1CCC(N2CCCCC2)CC1)c1ccccc1O	ZINC000875354187	EH	On-Demand	Clean	ADRA1B	16	43
C[C@H](NC(=O)NC1CCC(N2CCCCC2)CC1)c1ccccc1O	ZINC000875354187	EH	On-Demand	Clean	L3MBTL3	87	41
C[C@@H](NC(=O)NC1CCC(N2CCCCC2)CC1)c1ccccc1O	ZINC000875354188	EH	On-Demand	Clean	ADRA1D	20	43
C[C@@H](NC(=O)NC1CCC(N2CCCCC2)CC1)c1ccccc1O	ZINC000875354188	EH	On-Demand	Clean	ADRA1B	16	43
C[C@@H](NC(=O)NC1CCC(N2CCCCC2)CC1)c1ccccc1O	ZINC000875354188	EH	On-Demand	Clean	L3MBTL3	87	41
CN1CCN(C(=O)NCc2ccc([S@@](C)=O)cc2)Cc2cccnc21	ZINC000875354195	FD	On-Demand	Anodyne	NAMPT	28	47
CN1CCN(C(=O)NCc2ccc([S@](C)=O)cc2)Cc2cccnc21	ZINC000875354196	FD	On-Demand	Anodyne	NAMPT	28	47
CC[C@@H](CNC(=O)NC[C@H]1C[C@H](O)C1)Oc1cccc(C(F)(F)F)c1	ZINC000875354214	FF	On-Demand	Anodyne	PDS	66	45
CN1CC[C@H]2CN(C(=O)NCCn3c(O)nc4ccccc43)CC[C@H]21	ZINC000875354215	ED	On-Demand	Anodyne	PLD1	53	36
CN1CC[C@H]2CN(C(=O)NCCn3c(O)nc4ccccc43)CC[C@@H]21	ZINC000875354218	ED	On-Demand	Anodyne	PLD1	53	36
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCCn1c(O)nc3ccccc31)CC2	ZINC000875354249	GE	On-Demand	Anodyne	MCHR1	18	41
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)c2nc(Cc3ccccc3)no2)C1	ZINC000875354276	FF	On-Demand	Anodyne	BMP1	67	44
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)c2nc(Cc3ccccc3)no2)C1	ZINC000875354276	FF	On-Demand	Anodyne	BIRC2	48	41
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)c2nc(Cc3ccccc3)no2)C1	ZINC000875354277	FF	On-Demand	Anodyne	BMP1	67	44
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)c2nc(Cc3ccccc3)no2)C1	ZINC000875354277	FF	On-Demand	Anodyne	BIRC2	48	41
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)c2nc(Cc3ccccc3)no2)C1	ZINC000875354278	FF	On-Demand	Anodyne	BMP1	67	44
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)c2nc(Cc3ccccc3)no2)C1	ZINC000875354278	FF	On-Demand	Anodyne	BIRC2	48	41
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)c2nc(Cc3ccccc3)no2)C1	ZINC000875354279	FF	On-Demand	Anodyne	BMP1	67	44
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)c2nc(Cc3ccccc3)no2)C1	ZINC000875354279	FF	On-Demand	Anodyne	BIRC2	48	41
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1nc(Cc2ccccc2)no1	ZINC000875354298	GG	On-Demand	Anodyne	BMP1	44	43
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1nc(Cc2ccccc2)no1	ZINC000875354299	GG	On-Demand	Anodyne	BMP1	44	43
CC(C)(C)NC(=O)CN1CCC(CNC(=O)N[C@H]2CC23CCC3)CC1	ZINC000875354305	FD	On-Demand	Anodyne	CACNA1H	17	42
CC(C)(C)NC(=O)CN1CCC(CNC(=O)N[C@H]2CC23CCC3)CC1	ZINC000875354305	FD	On-Demand	Anodyne	CACNA1I	51	50
CC(C)(C)NC(=O)CN1CCC(CNC(=O)N[C@@H]2CC23CCC3)CC1	ZINC000875354306	FD	On-Demand	Anodyne	CACNA1H	17	42
CC(C)(C)NC(=O)CN1CCC(CNC(=O)N[C@@H]2CC23CCC3)CC1	ZINC000875354306	FD	On-Demand	Anodyne	CACNA1I	51	50
O=C(NC1CCC(N2CCCCC2)CC1)N[C@@H]1Cc2ccccc2NC1=O	ZINC000875354307	FF	On-Demand	Anodyne	L3MBTL3	51	36
O=C(NC1CCC(N2CCCCC2)CC1)N[C@H]1Cc2ccccc2NC1=O	ZINC000875354308	FF	On-Demand	Anodyne	L3MBTL3	51	36
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NC2(C)CC(F)(F)C2)CC1	ZINC000875354331	FE	On-Demand	Anodyne	CACNA1H	15	43
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NC2(C)CC(F)(F)C2)CC1	ZINC000875354331	FE	On-Demand	Anodyne	CACNA1I	73	53
O=C(NC1CCC(N2CCCCC2)CC1)N1CCO[C@H](C(F)F)CC1	ZINC000875354332	FF	On-Demand	Anodyne	L3MBTL3	65	38
O=C(NC1CCC(N2CCCCC2)CC1)N1CCO[C@@H](C(F)F)CC1	ZINC000875354333	FF	On-Demand	Anodyne	L3MBTL3	65	38
COCC1CC(NC(=O)NCC2CCN(CC(=O)NC(C)(C)C)CC2)C1	ZINC000875354336	FD	On-Demand	Anodyne	CACNA1H	17	41
COCC1CC(NC(=O)NCC2CCN(CC(=O)NC(C)(C)C)CC2)C1	ZINC000875354336	FD	On-Demand	Anodyne	CACNA1I	52	52
O=C(NC1CCC(N2CCCCC2)CC1)N1CC=CC1	ZINC000875354341	CE	On-Demand	Anodyne	L3MBTL3	95	43
C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000875354343	EF	On-Demand	Anodyne	L3MBTL3	49	34
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000875354344	EF	On-Demand	Anodyne	L3MBTL3	49	34
C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000875354346	EF	On-Demand	Anodyne	L3MBTL3	49	34
O=C(NC1CCC(N2CCCCC2)CC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875354348	GG	On-Demand	Anodyne	L3MBTL3	44	35
O=C(NC1CCC(N2CCCCC2)CC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875354349	GG	On-Demand	Anodyne	L3MBTL3	44	35
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NCC[C@H]2CCSC2)CC1	ZINC000875354355	GE	On-Demand	Anodyne	CACNA1H	15	40
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NCC[C@H]2CCSC2)CC1	ZINC000875354355	GE	On-Demand	Anodyne	CACNA1I	50	49
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NCC[C@@H]2CCSC2)CC1	ZINC000875354356	GE	On-Demand	Anodyne	CACNA1H	15	40
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NCC[C@@H]2CCSC2)CC1	ZINC000875354356	GE	On-Demand	Anodyne	CACNA1I	50	49
O=C(NCCO)C1CCN(C(=O)NC2CCC(N3CCCCC3)CC2)CC1	ZINC000875354357	GD	On-Demand	Anodyne	L3MBTL3	57	36
O=C(NC1CCC(N2CCCCC2)CC1)N[C@H]1CCOC[C@@H]1O	ZINC000875354360	ED	On-Demand	Anodyne	L3MBTL3	43	34
O=C(NC1CCC(N2CCCCC2)CC1)N[C@@H]1CCOC[C@@H]1O	ZINC000875354361	ED	On-Demand	Anodyne	L3MBTL3	43	34
O=C(NC1CCC(N2CCCCC2)CC1)N[C@@H]1CCOC[C@H]1O	ZINC000875354362	ED	On-Demand	Anodyne	L3MBTL3	43	34
O=C(NC1CCC(N2CCCCC2)CC1)N[C@H]1CCOC[C@H]1O	ZINC000875354363	ED	On-Demand	Anodyne	L3MBTL3	43	34
O=C(NC1CCC(N2CCCCC2)CC1)N1CCN(S(=O)(=O)C2CC2)CC1	ZINC000875354364	GD	On-Demand	Anodyne	L3MBTL3	55	35
CC(=O)N(C)c1ccc(CNC(=O)NC2CCC(N3CCCCC3)CC2)cc1	ZINC000875354369	GG	On-Demand	Anodyne	EPHX2	19	44
CC(=O)N(C)c1ccc(CNC(=O)NC2CCC(N3CCCCC3)CC2)cc1	ZINC000875354369	GG	On-Demand	Anodyne	L3MBTL3	65	35
O=C1CCN(C(=O)NC2CCC(N3CCCCC3)CC2)CCCCCCN1	ZINC000875354370	GF	On-Demand	Anodyne	L3MBTL3	51	35
O=C(NC1CCC(N2CCCCC2)CC1)N1CCC(CCO)(CCO)CC1	ZINC000875354372	GE	On-Demand	Anodyne	L3MBTL3	45	34
O=C(NC1CCC(N2CCCCC2)CC1)N1CC(Cc2ccco2)C1	ZINC000875354376	EG	On-Demand	Anodyne	L3MBTL3	88	37
CONC(=O)C1CCN(C(=O)NC2CCC(N3CCCCC3)CC2)CC1	ZINC000875354377	FD	On-Demand	Anodyne	L3MBTL3	62	37
CC(C)(C)NC(=O)CN1CCC(CNC(=O)N[C@@H]2[C@@H]3C[C@H]4[C@H](CO[C@H]42)C3)CC1	ZINC000875354380	GD	On-Demand	Anodyne	CACNA1I	45	46
CC(C)(C)NC(=O)CN1CCC(CNC(=O)N[C@@H]2[C@H]3C[C@@H]4CO[C@H]2[C@H]4C3)CC1	ZINC000875354381	GD	On-Demand	Anodyne	CACNA1I	45	46
CC(C)(C)NC(=O)CN1CCC(CNC(=O)N[C@@H]2[C@@H]3C[C@@H]4[C@@H]2OC[C@@H]4C3)CC1	ZINC000875354382	GD	On-Demand	Anodyne	CACNA1I	45	46
CC(C)(C)NC(=O)CN1CCC(CNC(=O)N[C@@H]2[C@H]3C[C@@H]4CO[C@@H]2[C@H]4C3)CC1	ZINC000875354383	GD	On-Demand	Anodyne	CACNA1I	45	46
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1noc(Cc2ccccc2)n1	ZINC000875354385	FD	On-Demand	Anodyne	TPSAB1	41	35
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1noc(Cc2ccccc2)n1	ZINC000875354385	FD	On-Demand	Anodyne	Q6PRC7_IXORI	44	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1noc(Cc2ccccc2)n1	ZINC000875354386	GE	On-Demand	Anodyne	SLC6A4	16	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1noc(Cc2ccccc2)n1	ZINC000875354386	GE	On-Demand	Anodyne	SLC6A3	38	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1noc(Cc2ccccc2)n1	ZINC000875354387	GE	On-Demand	Anodyne	SLC6A4	16	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1noc(Cc2ccccc2)n1	ZINC000875354387	GE	On-Demand	Anodyne	SLC6A3	38	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1noc(Cc2ccccc2)n1	ZINC000875354388	GE	On-Demand	Anodyne	SLC6A4	16	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1noc(Cc2ccccc2)n1	ZINC000875354388	GE	On-Demand	Anodyne	SLC6A3	38	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1noc(Cc2ccccc2)n1	ZINC000875354389	GE	On-Demand	Anodyne	SLC6A4	16	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1noc(Cc2ccccc2)n1	ZINC000875354389	GE	On-Demand	Anodyne	SLC6A3	38	41
O=C(NC1CCC(N2CCCCC2)CC1)N[C@@H]1Cc2cncn2C1	ZINC000875354401	ED	On-Demand	Anodyne	L3MBTL3	44	34
O=C(NC1CCC(N2CCCCC2)CC1)N[C@H]1Cc2cncn2C1	ZINC000875354402	ED	On-Demand	Anodyne	L3MBTL3	44	34
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NC[C@H]2C[C@H](O)C2)CC1	ZINC000875354403	FC	On-Demand	Anodyne	CACNA1H	16	45
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NC[C@H]2C[C@H](O)C2)CC1	ZINC000875354403	FC	On-Demand	Anodyne	CACNA1I	64	57
O=C(NC1CCC(N2CCCCC2)CC1)N1CCC(CCF)CC1	ZINC000875354405	EH	On-Demand	Anodyne	L3MBTL3	68	39
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1noc(Cc2ccccc2)n1	ZINC000875354425	FF	On-Demand	Anodyne	TPSAB1	41	33
C#CC[C@H](CCOC)NC(=O)N[C@H](C)c1noc(Cc2ccccc2)n1	ZINC000875354426	FE	On-Demand	Mild	TPSAB1	58	35
C#CC[C@H](CCOC)NC(=O)N[C@@H](C)c1noc(Cc2ccccc2)n1	ZINC000875354427	FE	On-Demand	Mild	TPSAB1	58	35
C#CC[C@@H](CCOC)NC(=O)N[C@@H](C)c1noc(Cc2ccccc2)n1	ZINC000875354428	FE	On-Demand	Mild	TPSAB1	58	35
C#CC[C@@H](CCOC)NC(=O)N[C@H](C)c1noc(Cc2ccccc2)n1	ZINC000875354429	FE	On-Demand	Mild	TPSAB1	58	35
C[S@@](=O)c1ccc(CNC(=O)N2Cc3cccnc3N3CCC[C@H]3C2)cc1	ZINC000875354430	GF	On-Demand	Anodyne	NAMPT	28	42
C[S@](=O)c1ccc(CNC(=O)N2Cc3cccnc3N3CCC[C@H]3C2)cc1	ZINC000875354431	GF	On-Demand	Anodyne	NAMPT	28	42
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NC[C@@H]2C[C@@H]3CCC[C@@H]3O2)CC1	ZINC000875354433	GD	On-Demand	Anodyne	CACNA1I	47	48
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NC[C@@H]2C[C@H]3CCC[C@H]3O2)CC1	ZINC000875354434	GD	On-Demand	Anodyne	CACNA1I	47	48
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NC[C@@H]2C[C@@H]3CCC[C@H]3O2)CC1	ZINC000875354435	GD	On-Demand	Anodyne	CACNA1I	47	48
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NC[C@@H]2C[C@H]3CCC[C@@H]3O2)CC1	ZINC000875354436	GD	On-Demand	Anodyne	CACNA1I	47	48
NC(=O)Cc1cccc2c1CCN(C(=O)NC1CCC(N3CCCCC3)CC1)C2	ZINC000875354441	GF	On-Demand	Anodyne	L3MBTL3	80	37
C[C@@H](NC(=O)NC1(C)CC(F)(F)C1)c1noc(Cc2ccccc2)n1	ZINC000875354446	FG	On-Demand	Anodyne	TPSAB1	45	34
C[C@H](NC(=O)NC1(C)CC(F)(F)C1)c1noc(Cc2ccccc2)n1	ZINC000875354447	FG	On-Demand	Anodyne	TPSAB1	45	34
N#Cc1ccc(N2CCN(C(=O)NC3CCC(N4CCCCC4)CC3)CC2)cn1	ZINC000875354448	GF	On-Demand	Mild	L3MBTL3	77	38
CN1CC[C@H]2CN(C(=O)NC3CCC(N4CCCCC4)CC3)CC[C@H]21	ZINC000875354454	EF	On-Demand	Anodyne	L3MBTL3	98	41
CN1CC[C@H]2CN(C(=O)NC3CCC(N4CCCCC4)CC3)CC[C@@H]21	ZINC000875354455	EF	On-Demand	Anodyne	L3MBTL3	98	41
O=C(NC1CCC(N2CCCCC2)CC1)N[C@@H]1CCO[C@H]1c1cc[nH]n1	ZINC000875354458	FE	On-Demand	Anodyne	L3MBTL3	49	33
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1noc(Cc2ccccc2)n1	ZINC000875354463	FF	On-Demand	Anodyne	TPSAB1	56	34
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1noc(Cc2ccccc2)n1	ZINC000875354463	FF	On-Demand	Anodyne	BIRC2	47	38
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1noc(Cc2ccccc2)n1	ZINC000875354466	FF	On-Demand	Anodyne	TPSAB1	56	34
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1noc(Cc2ccccc2)n1	ZINC000875354466	FF	On-Demand	Anodyne	BIRC2	47	38
C=CC[C@H]1CCN(C(=O)NC2CCC(N3CCCCC3)CC2)C1	ZINC000875354475	DG	On-Demand	Mild	L3MBTL3	75	38
C=CC[C@@H]1CCN(C(=O)NC2CCC(N3CCCCC3)CC2)C1	ZINC000875354476	DG	On-Demand	Mild	L3MBTL3	75	38
C[C@@]1(CO)CN(C(=O)NC2CCC(N3CCCCC3)CC2)C[C@]1(C)CO	ZINC000875354498	FD	On-Demand	Anodyne	L3MBTL3	86	38
O=C(NC1CCC(N2CCCCC2)CC1)N1OC2CCC1CC2	ZINC000875354501	DG	On-Demand	Anodyne	L3MBTL3	57	36
O=C(NC1CCC(N2CCCCC2)CC1)N(C1CC1)C1CC1	ZINC000875354508	DG	On-Demand	Anodyne	L3MBTL3	58	37
CC(C)(C)NC(=O)CN1CCC(CNC(=O)N[C@@H]2C[C@H]2C2CCOCC2)CC1	ZINC000875354517	GD	On-Demand	Anodyne	CACNA1I	47	48
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NCc2ccnc(F)c2)CC1	ZINC000875354518	GD	On-Demand	Anodyne	CACNA1I	79	52
O=C(NC1CCC(N2CCCCC2)CC1)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875354524	EG	On-Demand	Anodyne	L3MBTL3	77	39
C#CC[C@@H](COC)NC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1	ZINC000875354525	FC	On-Demand	Mild	CACNA1I	46	47
C#CC[C@H](COC)NC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1	ZINC000875354526	FC	On-Demand	Mild	CACNA1I	46	47
CN1CCN(C(=O)NC2CCC(N3CCCCC3)CC2)Cc2cccnc21	ZINC000875354527	FF	On-Demand	Anodyne	L3MBTL3	69	38
CN1CC[C@H]2CN(C(=O)NCC3CCN(CC(=O)NC(C)(C)C)CC3)CC[C@@H]21	ZINC000875354531	GD	On-Demand	Anodyne	CACNA1H	19	40
CN1CC[C@H]2CN(C(=O)NCC3CCN(CC(=O)NC(C)(C)C)CC3)CC[C@@H]21	ZINC000875354531	GD	On-Demand	Anodyne	CACNA1I	70	53
CN1CC[C@H]2CN(C(=O)NCC3CCN(CC(=O)NC(C)(C)C)CC3)CC[C@H]21	ZINC000875354532	GD	On-Demand	Anodyne	CACNA1H	19	40
CN1CC[C@H]2CN(C(=O)NCC3CCN(CC(=O)NC(C)(C)C)CC3)CC[C@H]21	ZINC000875354532	GD	On-Demand	Anodyne	CACNA1I	70	53
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1	ZINC000875354544	FD	On-Demand	Anodyne	CACNA1I	58	49
O=C(NC1CCC(N2CCCCC2)CC1)N[C@H]1CCC[C@@H]1O	ZINC000875354558	DD	On-Demand	Anodyne	L3MBTL3	75	38
O=C(NC1CCC(N2CCCCC2)CC1)N1CCCC(F)(F)CC1	ZINC000875354564	EH	On-Demand	Anodyne	L3MBTL3	51	36
C[S@](=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875354586	FF	On-Demand	Anodyne	F2	40	42
C[S@](=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875354586	FF	On-Demand	Anodyne	TRY1_BOVIN	36	42
C[S@](=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875354586	FF	On-Demand	Anodyne	PREP	33	45
C[S@](=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875354586	FF	On-Demand	Anodyne	TMPRSS11D	69	38
C[S@](=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875354587	FF	On-Demand	Anodyne	F2	40	42
C[S@](=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875354587	FF	On-Demand	Anodyne	TRY1_BOVIN	36	42
C[S@](=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875354587	FF	On-Demand	Anodyne	PREP	33	45
C[S@](=O)c1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875354587	FF	On-Demand	Anodyne	TMPRSS11D	69	38
C[S@](=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875354588	FF	On-Demand	Anodyne	F2	40	42
C[S@](=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875354588	FF	On-Demand	Anodyne	TRY1_BOVIN	36	42
C[S@](=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875354588	FF	On-Demand	Anodyne	PREP	33	45
C[S@](=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875354588	FF	On-Demand	Anodyne	TMPRSS11D	69	38
C[S@](=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875354589	FF	On-Demand	Anodyne	F2	40	42
C[S@](=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875354589	FF	On-Demand	Anodyne	TRY1_BOVIN	36	42
C[S@](=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875354589	FF	On-Demand	Anodyne	PREP	33	45
C[S@](=O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875354589	FF	On-Demand	Anodyne	TMPRSS11D	69	38
Cc1cncc([C@@H]2CCCN2C(=O)N[C@H](C)c2noc(Cc3ccccc3)n2)c1	ZINC000875354590	GH	On-Demand	Anodyne	ELANE	30	42
Cc1cncc([C@@H]2CCCN2C(=O)N[C@H](C)c2noc(Cc3ccccc3)n2)c1	ZINC000875354590	GH	On-Demand	Anodyne	CMA1	40	34
Cc1cncc([C@@H]2CCCN2C(=O)N[C@H](C)c2noc(Cc3ccccc3)n2)c1	ZINC000875354590	GH	On-Demand	Anodyne	CPT1A	47	38
Cc1cncc([C@@H]2CCCN2C(=O)N[C@H](C)c2noc(Cc3ccccc3)n2)c1	ZINC000875354590	GH	On-Demand	Anodyne	PREP	49	37
Cc1cncc([C@@H]2CCCN2C(=O)N[C@H](C)c2noc(Cc3ccccc3)n2)c1	ZINC000875354590	GH	On-Demand	Anodyne	BRCA1	42	30
Cc1cncc([C@@H]2CCCN2C(=O)N[C@@H](C)c2noc(Cc3ccccc3)n2)c1	ZINC000875354591	GH	On-Demand	Anodyne	ELANE	30	42
Cc1cncc([C@@H]2CCCN2C(=O)N[C@@H](C)c2noc(Cc3ccccc3)n2)c1	ZINC000875354591	GH	On-Demand	Anodyne	CMA1	40	34
Cc1cncc([C@@H]2CCCN2C(=O)N[C@@H](C)c2noc(Cc3ccccc3)n2)c1	ZINC000875354591	GH	On-Demand	Anodyne	CPT1A	47	38
Cc1cncc([C@@H]2CCCN2C(=O)N[C@@H](C)c2noc(Cc3ccccc3)n2)c1	ZINC000875354591	GH	On-Demand	Anodyne	PREP	49	37
Cc1cncc([C@@H]2CCCN2C(=O)N[C@@H](C)c2noc(Cc3ccccc3)n2)c1	ZINC000875354591	GH	On-Demand	Anodyne	BRCA1	42	30
Cc1cncc([C@H]2CCCN2C(=O)N[C@@H](C)c2noc(Cc3ccccc3)n2)c1	ZINC000875354592	GH	On-Demand	Anodyne	ELANE	30	42
Cc1cncc([C@H]2CCCN2C(=O)N[C@@H](C)c2noc(Cc3ccccc3)n2)c1	ZINC000875354592	GH	On-Demand	Anodyne	CMA1	40	34
Cc1cncc([C@H]2CCCN2C(=O)N[C@@H](C)c2noc(Cc3ccccc3)n2)c1	ZINC000875354592	GH	On-Demand	Anodyne	CPT1A	47	38
Cc1cncc([C@H]2CCCN2C(=O)N[C@@H](C)c2noc(Cc3ccccc3)n2)c1	ZINC000875354592	GH	On-Demand	Anodyne	PREP	49	37
Cc1cncc([C@H]2CCCN2C(=O)N[C@@H](C)c2noc(Cc3ccccc3)n2)c1	ZINC000875354592	GH	On-Demand	Anodyne	BRCA1	42	30
Cc1cncc([C@H]2CCCN2C(=O)N[C@H](C)c2noc(Cc3ccccc3)n2)c1	ZINC000875354593	GH	On-Demand	Anodyne	ELANE	30	42
Cc1cncc([C@H]2CCCN2C(=O)N[C@H](C)c2noc(Cc3ccccc3)n2)c1	ZINC000875354593	GH	On-Demand	Anodyne	CMA1	40	34
Cc1cncc([C@H]2CCCN2C(=O)N[C@H](C)c2noc(Cc3ccccc3)n2)c1	ZINC000875354593	GH	On-Demand	Anodyne	CPT1A	47	38
Cc1cncc([C@H]2CCCN2C(=O)N[C@H](C)c2noc(Cc3ccccc3)n2)c1	ZINC000875354593	GH	On-Demand	Anodyne	PREP	49	37
Cc1cncc([C@H]2CCCN2C(=O)N[C@H](C)c2noc(Cc3ccccc3)n2)c1	ZINC000875354593	GH	On-Demand	Anodyne	BRCA1	42	30
O=C(NC1CCC(N2CCCCC2)CC1)N1C[C@@H]2CCC[C@]2(CO)C1	ZINC000875354594	EF	On-Demand	Anodyne	L3MBTL3	43	33
CC(C)(C)NC(=O)CN1CCC(CNC(=O)N2C[C@H]3C(=O)OC[C@H]3C2)CC1	ZINC000875354602	GC	On-Demand	Anodyne	CACNA1I	49	48
CC(C)(C)NC(=O)CN1CCC(CNC(=O)N[C@@H]2CCCC[C@@H]2F)CC1	ZINC000875354605	FE	On-Demand	Anodyne	CACNA1I	60	51
C[S@@](=O)c1ccc(CNC(=O)N2CCc3c(CC(N)=O)cccc3C2)cc1	ZINC000875354618	GD	On-Demand	Anodyne	NAMPT	22	40
C[S@](=O)c1ccc(CNC(=O)N2CCc3c(CC(N)=O)cccc3C2)cc1	ZINC000875354619	GD	On-Demand	Anodyne	NAMPT	22	40
CN(C)C[C@@H]1CN(C(=O)NC2CCC(N3CCCCC3)CC2)C[C@H]1CN(C)C	ZINC000875354622	GE	On-Demand	Anodyne	L3MBTL3	70	38
O=C(NC1CCC(N2CCCCC2)CC1)N1CCC2(CCNC2=O)CC1	ZINC000875354623	FE	On-Demand	Anodyne	L3MBTL3	44	35
CC(=O)Nc1ccc2c(c1)CN(C(=O)NC1CCC(N3CCCCC3)CC1)CC2	ZINC000875354625	GH	On-Demand	Anodyne	L3MBTL3	76	46
O=C(NC1CCC(N2CCCCC2)CC1)N1CCO[C@@H]2CCC[C@@H]21	ZINC000875354626	EF	On-Demand	Anodyne	L3MBTL3	40	34
CC(C)(C)NC(=O)CN1CCC(CNC(=O)N2CCCN(C=O)CC2)CC1	ZINC000875354631	GC	On-Demand	Anodyne	CACNA1I	53	50
C[C@H](NC(=O)NCCCCC1CC1)c1noc(Cc2ccccc2)n1	ZINC000875354632	EH	On-Demand	Anodyne	TPSAB1	50	36
C[C@@H](NC(=O)NCCCCC1CC1)c1noc(Cc2ccccc2)n1	ZINC000875354633	EH	On-Demand	Anodyne	TPSAB1	50	36
O=C(NC1CCC(N2CCCCC2)CC1)N1CC(c2ccccc2)C1	ZINC000875354640	EH	On-Demand	Anodyne	SIGMAR1	20	49
O=C(NC1CCC(N2CCCCC2)CC1)N1CC(c2ccccc2)C1	ZINC000875354640	EH	On-Demand	Anodyne	SLC18A3	46	48
O=C(NC1CCC(N2CCCCC2)CC1)N1CC(c2ccccc2)C1	ZINC000875354640	EH	On-Demand	Anodyne	EPHX2	35	49
O=C(NC1CCC(N2CCCCC2)CC1)N1CC(c2ccccc2)C1	ZINC000875354640	EH	On-Demand	Anodyne	L3MBTL3	107	45
COCC(C)(C)CCNC(=O)N[C@@H](C)c1noc(Cc2ccccc2)n1	ZINC000875354641	FG	On-Demand	Anodyne	TPSAB1	53	35
COCC(C)(C)CCNC(=O)N[C@H](C)c1noc(Cc2ccccc2)n1	ZINC000875354642	FG	On-Demand	Anodyne	TPSAB1	53	35
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NCC(C)(C)C(C)(F)F)CC1	ZINC000875354647	GF	On-Demand	Anodyne	CACNA1H	15	43
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NCC(C)(C)C(C)(F)F)CC1	ZINC000875354647	GF	On-Demand	Anodyne	CACNA1I	72	54
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NC(C)(C)[C@@H]2CCCCO2)CC1	ZINC000875354648	GE	On-Demand	Anodyne	CACNA1H	19	40
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NC(C)(C)[C@@H]2CCCCO2)CC1	ZINC000875354648	GE	On-Demand	Anodyne	CACNA1I	59	52
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NC(C)(C)[C@H]2CCCCO2)CC1	ZINC000875354649	GE	On-Demand	Anodyne	CACNA1H	19	40
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NC(C)(C)[C@H]2CCCCO2)CC1	ZINC000875354649	GE	On-Demand	Anodyne	CACNA1I	59	52
O=C(NC1CCC(N2CCCCC2)CC1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875354652	GG	On-Demand	Anodyne	L3MBTL3	51	35
CCC1(N(C)C)CCN(C(=O)NC2CCC(N3CCCCC3)CC2)CC1	ZINC000875354655	FG	On-Demand	Anodyne	L3MBTL3	53	36
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875354656	GD	On-Demand	Anodyne	L3MBTL3	83	40
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875354657	GD	On-Demand	Anodyne	L3MBTL3	83	40
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875354658	GD	On-Demand	Anodyne	L3MBTL3	83	40
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875354659	GD	On-Demand	Anodyne	L3MBTL3	83	40
CO[C@@H]1CC[C@@H](C)N(C(=O)NCC2CCN(CCC(C)C)CC2)C1	ZINC000875354662	EF	On-Demand	Anodyne	CACNA1I	43	33
CCOC(=O)c1cc(CNC(=O)NCC2CCN(CCC(C)C)CC2)on1	ZINC000875354666	GE	On-Demand	Anodyne	HTR4	63	36
CCOC(=O)c1cc(CNC(=O)NCC2CCN(CCC(C)C)CC2)on1	ZINC000875354666	GE	On-Demand	Anodyne	CACNA1I	64	37
O=C(NCC1CC(O)C1)NC1CCC(N2CCCCC2)CC1	ZINC000875354668	DD	On-Demand	Anodyne	L3MBTL3	41	33
O=C(NC[C@H]1C[C@H](O)C1)NC1CCC(N2CCCCC2)CC1	ZINC000875354669	DD	On-Demand	Anodyne	L3MBTL3	41	33
O=C(NC[C@@H]1C[C@H](O)C1)NC1CCC(N2CCCCC2)CC1	ZINC000875354670	DD	On-Demand	Anodyne	L3MBTL3	41	33
O=C(NC1CCC(N2CCCCC2)CC1)N1[C@H]2CC[C@H]1CC1(CC1)C2	ZINC000875354676	EH	On-Demand	Anodyne	L3MBTL3	44	35
CS[C@@H]1C[C@@H](NC(=O)NCC2CCN(CC(=O)NC(C)(C)C)CC2)C1	ZINC000875354681	FD	On-Demand	Anodyne	CACNA1H	17	40
CS[C@@H]1C[C@@H](NC(=O)NCC2CCN(CC(=O)NC(C)(C)C)CC2)C1	ZINC000875354681	FD	On-Demand	Anodyne	CACNA1I	51	51
CC(=O)N(C)c1ccc(CNC(=O)NCC2CCN(CCC(C)C)CC2)cc1	ZINC000875354686	GG	On-Demand	Anodyne	HTR4	46	39
CC(=O)N(C)c1ccc(CNC(=O)NCC2CCN(CCC(C)C)CC2)cc1	ZINC000875354686	GG	On-Demand	Anodyne	CCR3	26	41
CC(=O)N(C)c1ccc(CNC(=O)NCC2CCN(CCC(C)C)CC2)cc1	ZINC000875354686	GG	On-Demand	Anodyne	CCR5	29	43
CC(=O)N(C)c1ccc(CNC(=O)NCC2CCN(CCC(C)C)CC2)cc1	ZINC000875354686	GG	On-Demand	Anodyne	CACNA1I	64	42
CO[C@@H]1CC[C@@H](C)N(C(=O)NCC2CCN(CC(=O)NC(C)(C)C)CC2)C1	ZINC000875354690	GD	On-Demand	Anodyne	CACNA1I	49	49
C[C@H](NC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1)c1ccnn1C	ZINC000875354693	GD	On-Demand	Anodyne	HTR4	42	36
C[C@H](NC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1)c1ccnn1C	ZINC000875354693	GD	On-Demand	Anodyne	CACNA1I	69	50
C[C@@H](NC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1)c1ccnn1C	ZINC000875354694	GD	On-Demand	Anodyne	HTR4	42	36
C[C@@H](NC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1)c1ccnn1C	ZINC000875354694	GD	On-Demand	Anodyne	CACNA1I	69	50
CC(C)(C)NC(=O)CN1CCC(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)CC1	ZINC000875354695	GD	On-Demand	Anodyne	CACNA1I	50	49
CC(C)(C)NC(=O)CN1CCC(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)CC1	ZINC000875354696	GD	On-Demand	Anodyne	CACNA1I	50	49
CC(C)(C)NC(=O)CN1CCC(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)CC1	ZINC000875354697	GD	On-Demand	Anodyne	CACNA1I	50	49
CC(C)(C)NC(=O)CN1CCC(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)CC1	ZINC000875354698	GD	On-Demand	Anodyne	CACNA1I	50	49
C#CC[C@H](COC)NC(=O)N[C@@H](C)c1noc(Cc2ccccc2)n1	ZINC000875354703	EE	On-Demand	Mild	TPSAB1	44	34
C#CC[C@@H](COC)NC(=O)N[C@H](C)c1noc(Cc2ccccc2)n1	ZINC000875354704	EE	On-Demand	Mild	TPSAB1	44	34
C#CC[C@H](COC)NC(=O)N[C@H](C)c1noc(Cc2ccccc2)n1	ZINC000875354705	EE	On-Demand	Mild	TPSAB1	44	34
C#CC[C@@H](COC)NC(=O)N[C@@H](C)c1noc(Cc2ccccc2)n1	ZINC000875354706	EE	On-Demand	Mild	TPSAB1	44	34
O=C(NC1CCC(N2CCCCC2)CC1)N1CCc2c(O)cccc2C1	ZINC000875354728	FG	On-Demand	Anodyne	L3MBTL3	91	41
O=CN1CCCN(C(=O)NC2CCC(N3CCCCC3)CC2)CC1	ZINC000875354733	ED	On-Demand	Anodyne	L3MBTL3	49	35
C[S@@](=O)c1ccc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)cc1	ZINC000875354734	GE	On-Demand	Anodyne	SIGMAR1	15	45
C[S@](=O)c1ccc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)cc1	ZINC000875354735	GE	On-Demand	Anodyne	SIGMAR1	15	45
O=C(NC1CCC(N2CCCCC2)CC1)N1C[C@@H](CO)[C@H](C(F)(F)F)C1	ZINC000875354736	GF	On-Demand	Anodyne	L3MBTL3	48	34
CC(=O)C1CCN(C(=O)NC2CCC(N3CCCCC3)CC2)CC1	ZINC000875354737	EF	On-Demand	Anodyne	L3MBTL3	81	41
CC(C)(C)NC(=O)CN1CCC(CNC(=O)N2CC[C@H]3CSC[C@H]3C2)CC1	ZINC000875354740	GE	On-Demand	Anodyne	CACNA1I	59	52
CC(C)(C)NC(=O)CN1CCC(CNC(=O)N2CC[C@@H]3CSC[C@H]3C2)CC1	ZINC000875354741	GE	On-Demand	Anodyne	CACNA1I	59	52
CC(C)(C)NC(=O)CN1CCC(CNC(=O)N2CC[C@H]3CSC[C@@H]3C2)CC1	ZINC000875354742	GE	On-Demand	Anodyne	CACNA1I	59	52
CC(C)(C)NC(=O)CN1CCC(CNC(=O)N2CC[C@@H]3CSC[C@@H]3C2)CC1	ZINC000875354743	GE	On-Demand	Anodyne	CACNA1I	59	52
O=C(NC1CCC(N2CCCCC2)CC1)N1C[C@H]2COC[C@H]2C1	ZINC000875354744	DE	On-Demand	Anodyne	L3MBTL3	63	37
C[C@@H](NC(=O)N(C)CCc1cccc(C#N)c1)c1noc(Cc2ccccc2)n1	ZINC000875354748	GG	On-Demand	Mild	TPSAB1	50	33
CC(=O)Nc1cccc2c1CN(C(=O)NC1CCC(N3CCCCC3)CC1)CC2	ZINC000875354752	GH	On-Demand	Anodyne	L3MBTL3	79	37
CONC(=O)C1CCN(C(=O)NCC2CCN(CCC(C)C)CC2)CC1	ZINC000875354757	FD	On-Demand	Anodyne	CACNA1I	42	33
COC(=O)C1(O)CN(C(=O)NCC2CCN(CCC(C)C)CC2)C1	ZINC000875354760	EC	On-Demand	Anodyne	CACNA1I	47	33
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NCC[C@@H]2CCCS2)CC1	ZINC000875354761	GE	On-Demand	Anodyne	CACNA1H	18	40
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NCC[C@@H]2CCCS2)CC1	ZINC000875354761	GE	On-Demand	Anodyne	CACNA1I	50	49
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NCC[C@H]2CCCS2)CC1	ZINC000875354762	GE	On-Demand	Anodyne	CACNA1H	18	40
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NCC[C@H]2CCCS2)CC1	ZINC000875354762	GE	On-Demand	Anodyne	CACNA1I	50	49
O=C(NC1CCC(N2CCCCC2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875354763	GH	On-Demand	Anodyne	L3MBTL3	67	39
O=C(NC1CCC(N2CCCCC2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875354764	GH	On-Demand	Anodyne	L3MBTL3	67	39
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875354765	FG	On-Demand	Anodyne	L3MBTL3	83	40
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875354766	FG	On-Demand	Anodyne	L3MBTL3	83	40
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875354767	FG	On-Demand	Anodyne	L3MBTL3	83	40
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875354768	FG	On-Demand	Anodyne	L3MBTL3	83	40
Cc1ccccc1[C@H](NC(=O)NNC(=O)c1cn[nH]c1)C(C)(C)C	ZINC000875354769	EE	On-Demand	Reactive	CTSA	53	35
Cc1ccccc1[C@@H](NC(=O)NNC(=O)c1cn[nH]c1)C(C)(C)C	ZINC000875354770	EE	On-Demand	Reactive	CTSA	53	35
CC(=O)C1CCN(C(=O)NCC2CCN(CC(=O)NC(C)(C)C)CC2)CC1	ZINC000875354772	GD	On-Demand	Anodyne	CACNA1I	59	54
Cc1ccccc1[C@H](NC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)C(C)(C)C	ZINC000875354808	GI	On-Demand	Anodyne	SMO	36	40
Cc1ccccc1[C@H](NC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)C(C)(C)C	ZINC000875354808	GI	On-Demand	Anodyne	ETHR	47	33
Cc1ccccc1[C@@H](NC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)C(C)(C)C	ZINC000875354809	GI	On-Demand	Anodyne	SMO	36	40
Cc1ccccc1[C@@H](NC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)C(C)(C)C	ZINC000875354809	GI	On-Demand	Anodyne	ETHR	47	33
Cc1ccccc1[C@H](NC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)C(C)(C)C	ZINC000875354810	GI	On-Demand	Anodyne	SMO	36	40
Cc1ccccc1[C@H](NC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)C(C)(C)C	ZINC000875354810	GI	On-Demand	Anodyne	ETHR	47	33
Cc1ccccc1[C@@H](NC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)C(C)(C)C	ZINC000875354811	GI	On-Demand	Anodyne	SMO	36	40
Cc1ccccc1[C@@H](NC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)C(C)(C)C	ZINC000875354811	GI	On-Demand	Anodyne	ETHR	47	33
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NCC[C@@H](O)C2CCCC2)CC1	ZINC000875354812	GD	On-Demand	Anodyne	CACNA1H	20	40
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NCC[C@@H](O)C2CCCC2)CC1	ZINC000875354812	GD	On-Demand	Anodyne	CACNA1I	57	49
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NCC[C@H](O)C2CCCC2)CC1	ZINC000875354813	GD	On-Demand	Anodyne	CACNA1H	20	40
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NCC[C@H](O)C2CCCC2)CC1	ZINC000875354813	GD	On-Demand	Anodyne	CACNA1I	57	49
C[S@](=N)(=O)N1CCN(C(=O)NC2CCC(N3CCCCC3)CC2)CC1	ZINC000875354824	FD	On-Demand	Anodyne	L3MBTL3	53	35
C[C@@H](NC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1)c1ccns1	ZINC000875354825	GE	On-Demand	Anodyne	CACNA1I	65	51
C[C@H](NC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1)c1ccns1	ZINC000875354826	GE	On-Demand	Anodyne	CACNA1I	65	51
CN(Cc1ccns1)C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000875354827	EG	On-Demand	Anodyne	L3MBTL3	56	35
O=C(NC1CCC(N2CCCCC2)CC1)N1Cc2cccc(O)c2C1	ZINC000875354837	EG	On-Demand	Clean	L3MBTL3	98	42
C#CC[C@@H](CCOC)NC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1	ZINC000875354839	GD	On-Demand	Mild	CACNA1I	57	48
C#CC[C@H](CCOC)NC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1	ZINC000875354840	GD	On-Demand	Mild	CACNA1I	57	48
C[S@@](=O)c1ccc(CNC(=O)N2CC3(CC(=O)N3Cc3ccccc3)C2)cc1	ZINC000875354842	GE	On-Demand	Anodyne	NAMPT	22	40
C[S@](=O)c1ccc(CNC(=O)N2CC3(CC(=O)N3Cc3ccccc3)C2)cc1	ZINC000875354843	GE	On-Demand	Anodyne	NAMPT	22	40
CC(=O)C1CCN(C(=O)NCC2CCN(CCC(C)C)CC2)CC1	ZINC000875354848	EF	On-Demand	Anodyne	CACNA1I	55	35
COCCN(CC1CCN(C)CC1)C(=O)NCC1CCN(CCC(C)C)CC1	ZINC000875354849	GF	On-Demand	Anodyne	CACNA1I	56	36
COCC1CC(NC(=O)N[C@@H](C)c2noc(Cc3ccccc3)n2)C1	ZINC000875354854	EE	On-Demand	Anodyne	TPSAB1	42	36
COCC1CC(NC(=O)N[C@H](C)c2noc(Cc3ccccc3)n2)C1	ZINC000875354855	EE	On-Demand	Anodyne	TPSAB1	42	36
O=C(NC1CCC(N2CCCCC2)CC1)NC1CN(c2ccncn2)C1	ZINC000875354856	FD	On-Demand	Anodyne	L3MBTL3	71	35
CC[C@H](C[C@H](C)O)NC(=O)NCC1CCN(CCC(C)C)CC1	ZINC000875354858	EF	On-Demand	Anodyne	CACNA1I	49	38
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875354868	FE	On-Demand	Anodyne	L3MBTL3	96	43
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875354869	FE	On-Demand	Anodyne	L3MBTL3	96	43
O=C1OC[C@H]2CN(C(=O)NC3CCC(N4CCCCC4)CC3)C[C@@H]12	ZINC000875354874	ED	On-Demand	Anodyne	L3MBTL3	48	34
CC(=O)[C@H]1CCCN(C(=O)NC2CCC(N3CCCCC3)CC2)C1	ZINC000875354875	EF	On-Demand	Anodyne	L3MBTL3	79	40
CC(=O)[C@@H]1CCCN(C(=O)NC2CCC(N3CCCCC3)CC2)C1	ZINC000875354876	EF	On-Demand	Anodyne	L3MBTL3	79	40
COC(=O)C1(O)CN(C(=O)NC2CCC(N3CCCCC3)CC2)C1	ZINC000875354877	EC	On-Demand	Anodyne	L3MBTL3	44	35
Cc1ccccc1[C@H](NC(=O)N1CCC2(CCNC2=O)CC1)C(C)(C)C	ZINC000875354880	FG	On-Demand	Anodyne	GHRHR	59	32
Cc1ccccc1[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)C(C)(C)C	ZINC000875354881	FG	On-Demand	Anodyne	GHRHR	59	32
CC(C)(C)OC(=O)N1CC(NC(=O)NCc2ccnc(F)c2)C1	ZINC000875354984	DD	On-Demand	Anodyne	GPR119	40	38
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2CCN(CCC(C)C)CC2)C1	ZINC000875355078	FF	On-Demand	Anodyne	CACNA1I	46	34
COC(=O)N(C)NC(=O)NC[C@@H](c1cccnc1)C(C)C	ZINC000875355249	CD	On-Demand	Reactive	KCNA5	28	48
COC(=O)N(C)NC(=O)NC[C@H](c1cccnc1)C(C)C	ZINC000875355250	CD	On-Demand	Reactive	KCNA5	28	48
COc1ccc(CN(C(=O)c2cccn(C(C)(C)C)c2=O)c2ccncc2)cc1	ZINC000875355268	GH	On-Demand	Anodyne	PROKR1	54	32
CC(C)(C)OC(=O)N1CC(NC(=O)NCCN2CC[C@@H](O)C2)C1	ZINC000875355332	EB	On-Demand	Anodyne	CACNA1H	17	41
CC(C)(C)OC(=O)N1CC(NC(=O)NCCN2CC[C@H](O)C2)C1	ZINC000875355333	EB	On-Demand	Anodyne	CACNA1H	17	41
CCO[C@@H](C(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1F)C1CCOCC1	ZINC000875355339	GD	On-Demand	Anodyne	LEF	15	41
COC(=O)[C@@]12C[C@@H](NC(=O)NC[C@H](c3cccnc3)C(C)C)C[C@@H]1C2	ZINC000875355400	EE	On-Demand	Anodyne	KCNA5	23	45
COC(=O)[C@@]12C[C@@H](NC(=O)NC[C@@H](c3cccnc3)C(C)C)C[C@@H]1C2	ZINC000875355401	EE	On-Demand	Anodyne	KCNA5	23	45
COC(=O)C1(O)CN(C(=O)NC[C@@H](c2cccnc2)C(C)C)C1	ZINC000875355423	DC	On-Demand	Anodyne	KCNA5	21	41
COC(=O)C1(O)CN(C(=O)NC[C@H](c2cccnc2)C(C)C)C1	ZINC000875355424	DC	On-Demand	Anodyne	KCNA5	21	41
O=C(NCc1nc(O)c2c(n1)CCOC2)NCc1c(F)c(F)cc(F)c1F	ZINC000875355436	GD	On-Demand	Anodyne	WNT3A	50	34
COc1ccc(CN(C(=O)Cc2csc(C3CC3)n2)c2ccncc2)cc1	ZINC000875355458	GI	On-Demand	Anodyne	AVPR1B	15	40
CN1CCN(C2CCN(C(=O)NCc3c(F)c(F)cc(F)c3F)CC2)CC1	ZINC000875355473	GE	On-Demand	Anodyne	L3MBTL3	70	42
CC(C)(C)OC(=O)N1CC(NC(=O)N2CCN(CCc3cnccn3)CC2)C1	ZINC000875355519	GC	On-Demand	Anodyne	GPR119	26	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cnc(N(C)C)n1C	ZINC000875355541	EC	On-Demand	Anodyne	SLC6A3	42	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cnc(N(C)C)n1C	ZINC000875355542	EC	On-Demand	Anodyne	SLC6A3	42	37
CC(C)(C)OC(=O)N1CC(NC(=O)N2CC[C@@H]3CS(=O)(=O)C[C@@H]3C2)C1	ZINC000875355562	FC	On-Demand	Anodyne	GPR119	26	41
CC(C)(C)OC(=O)N1CC(NC(=O)N2CC[C@H]3CS(=O)(=O)C[C@H]3C2)C1	ZINC000875355563	FC	On-Demand	Anodyne	GPR119	26	41
CC(C)(C)OC(=O)N1CC(NC(=O)N2CC[C@H]3CS(=O)(=O)C[C@@H]3C2)C1	ZINC000875355564	FC	On-Demand	Anodyne	GPR119	26	41
CC(C)(C)OC(=O)N1CC(NC(=O)N2CC[C@@H]3CS(=O)(=O)C[C@H]3C2)C1	ZINC000875355565	FC	On-Demand	Anodyne	GPR119	26	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1c(F)c(F)cc(F)c1F	ZINC000875355668	FE	On-Demand	Anodyne	SLC6A3	49	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1c(F)c(F)cc(F)c1F	ZINC000875355672	FE	On-Demand	Anodyne	SLC6A3	49	39
CCOC(=O)[C@@H]1CC[C@H](C(=O)N(Cc2ccc(OC)cc2)c2ccncc2)C1	ZINC000875355720	GH	On-Demand	Anodyne	NR1H4	20	40
CC(C)(C)OC(=O)N1CC(NC(=O)N2CC[C@@H]3CC[C@@H](O)[C@@H]32)C1	ZINC000875355722	ED	On-Demand	Anodyne	GPR119	18	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nccn1CCc1ccccc1	ZINC000875355746	GE	On-Demand	Anodyne	SLC6A4	30	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nccn1CCc1ccccc1	ZINC000875355746	GE	On-Demand	Anodyne	SLC6A3	66	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nccn1CCc1ccccc1	ZINC000875355747	GE	On-Demand	Anodyne	SLC6A4	30	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nccn1CCc1ccccc1	ZINC000875355747	GE	On-Demand	Anodyne	SLC6A3	66	46
NC(=O)COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875355787	FD	On-Demand	Anodyne	DRD4	38	40
NC(=O)COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875355787	FD	On-Demand	Anodyne	SLC6A1	48	34
NC(=O)COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875355787	FD	On-Demand	Anodyne	LTA4H	56	52
NC(=O)COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875355787	FD	On-Demand	Anodyne	HRH3	30	46
NC(=O)COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875355787	FD	On-Demand	Anodyne	SIGMAR1	54	46
NC(=O)COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875355787	FD	On-Demand	Anodyne	CHEK2	29	41
NC(=O)COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875355787	FD	On-Demand	Anodyne	CCR3	18	41
NC(=O)COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875355787	FD	On-Demand	Anodyne	PLA2G2A	46	36
NC(=O)COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875355787	FD	On-Demand	Anodyne	CPT1A	62	37
NC(=O)COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875355787	FD	On-Demand	Anodyne	SLC18A3	19	45
NC(=O)COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875355787	FD	On-Demand	Anodyne	S1PR5	17	40
NC(=O)COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875355788	FD	On-Demand	Anodyne	DRD4	38	40
NC(=O)COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875355788	FD	On-Demand	Anodyne	SLC6A1	48	34
NC(=O)COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875355788	FD	On-Demand	Anodyne	LTA4H	56	52
NC(=O)COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875355788	FD	On-Demand	Anodyne	HRH3	30	46
NC(=O)COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875355788	FD	On-Demand	Anodyne	SIGMAR1	54	46
NC(=O)COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875355788	FD	On-Demand	Anodyne	CHEK2	29	41
NC(=O)COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875355788	FD	On-Demand	Anodyne	CCR3	18	41
NC(=O)COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875355788	FD	On-Demand	Anodyne	PLA2G2A	46	36
NC(=O)COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875355788	FD	On-Demand	Anodyne	CPT1A	62	37
NC(=O)COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875355788	FD	On-Demand	Anodyne	SLC18A3	19	45
NC(=O)COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000875355788	FD	On-Demand	Anodyne	S1PR5	17	40
CC(C)(C)OC(=O)N1CC(NC(=O)N2CCN(S(=O)(=O)C3CC3)CC2)C1	ZINC000875355827	GC	On-Demand	Anodyne	GPR119	24	40
CC(C)(C)OC(=O)N1CC(NC(=O)N2CC[C@@H]3CSC[C@@H]3C2)C1	ZINC000875355838	EE	On-Demand	Anodyne	GPR119	25	42
CC(C)(C)OC(=O)N1CC(NC(=O)N2CC[C@H]3CSC[C@H]3C2)C1	ZINC000875355839	EE	On-Demand	Anodyne	GPR119	25	42
CC(C)(C)OC(=O)N1CC(NC(=O)N2CC[C@H]3CSC[C@@H]3C2)C1	ZINC000875355840	EE	On-Demand	Anodyne	GPR119	25	42
CC(C)(C)OC(=O)N1CC(NC(=O)N2CC[C@@H]3CSC[C@H]3C2)C1	ZINC000875355841	EE	On-Demand	Anodyne	GPR119	25	42
CC(C)(C)OC(=O)N1CC(NC(=O)NC2CN(c3ccncn3)C2)C1	ZINC000875355879	EC	On-Demand	Anodyne	GPR119	37	61
Cc1nnc(NNC(=O)NC[C@@H](c2cccnc2)C(C)C)n1C	ZINC000875355897	DD	On-Demand	Reactive	KCNA5	20	42
Cc1nnc(NNC(=O)NC[C@H](c2cccnc2)C(C)C)n1C	ZINC000875355899	DD	On-Demand	Reactive	KCNA5	20	42
CC(=O)C1CCN(C(=O)NCc2c(F)c(F)cc(F)c2F)CC1	ZINC000875355954	EF	On-Demand	Anodyne	EPHX2	16	44
CN1CC[C@H]2CN(C(=O)NC3CN(C(=O)OC(C)(C)C)C3)CC[C@H]21	ZINC000875355997	ED	On-Demand	Anodyne	GPR119	23	41
CN1CC[C@H]2CN(C(=O)NC3CN(C(=O)OC(C)(C)C)C3)CC[C@@H]21	ZINC000875355998	ED	On-Demand	Anodyne	GPR119	23	41
CC(C)(C)OC(=O)N1CC(NC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875356011	ED	On-Demand	Anodyne	GPR119	31	40
CC(C)(C)OC(=O)N1CC(NC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875356012	ED	On-Demand	Anodyne	GPR119	31	40
CC(C)(C)OC(=O)N1CC(NC(=O)NCc2cccc3[nH]ccc23)C1	ZINC000875356072	EF	On-Demand	Anodyne	SSTR2	61	36
CC(C)(C)OC(=O)N1CC(NC(=O)NCc2cccc3[nH]ccc23)C1	ZINC000875356072	EF	On-Demand	Anodyne	CCKAR	56	38
CC(C)(C)OC(=O)N1CC(NC(=O)NCc2cccc3[nH]ccc23)C1	ZINC000875356072	EF	On-Demand	Anodyne	NMBR	76	32
CC(C)(C)OC(=O)N1CC(NC(=O)NCc2cccc3[nH]ccc23)C1	ZINC000875356072	EF	On-Demand	Anodyne	GRPR	40	30
CC(C)(C)OC(=O)N1CC(NC(=O)NCc2cccc3[nH]ccc23)C1	ZINC000875356072	EF	On-Demand	Anodyne	CCKBR	49	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(F)c(C)c1	ZINC000875356151	EF	On-Demand	Anodyne	SLC6A4	26	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(F)c(C)c1	ZINC000875356151	EF	On-Demand	Anodyne	SLC6A3	51	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(F)c(C)c1	ZINC000875356152	EF	On-Demand	Anodyne	SLC6A4	26	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(F)c(C)c1	ZINC000875356152	EF	On-Demand	Anodyne	SLC6A3	51	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(F)c(C)c1	ZINC000875356153	EF	On-Demand	Anodyne	SLC6A4	26	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(F)c(C)c1	ZINC000875356153	EF	On-Demand	Anodyne	SLC6A3	51	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(F)c(C)c1	ZINC000875356154	EF	On-Demand	Anodyne	SLC6A4	26	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(F)c(C)c1	ZINC000875356154	EF	On-Demand	Anodyne	SLC6A3	51	48
O=C(NCCO)C1CCN(C(=O)NCc2nccn2CCc2ccccc2)CC1	ZINC000875356181	GD	On-Demand	Anodyne	EPHX2	22	40
CC(C)(C)OC(=O)N1CC(NC(=O)N[C@@H]2CCO[C@H]2c2ccncc2)C1	ZINC000875356202	FD	On-Demand	Anodyne	GPR119	22	40
CC(C)(C)OC(=O)N1CC(NC(=O)NCC2CC=CC2)C1	ZINC000875356220	CD	On-Demand	Anodyne	CACNA1I	42	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1cccnc1)C(C)C	ZINC000875356315	EF	On-Demand	Anodyne	SLC6A4	20	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1cccnc1)C(C)C	ZINC000875356315	EF	On-Demand	Anodyne	SLC6A3	43	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1cccnc1)C(C)C	ZINC000875356316	EF	On-Demand	Anodyne	SLC6A4	20	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1cccnc1)C(C)C	ZINC000875356316	EF	On-Demand	Anodyne	SLC6A3	43	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1cccnc1)C(C)C	ZINC000875356317	EF	On-Demand	Anodyne	SLC6A4	20	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1cccnc1)C(C)C	ZINC000875356317	EF	On-Demand	Anodyne	SLC6A3	43	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1cccnc1)C(C)C	ZINC000875356318	EF	On-Demand	Anodyne	SLC6A4	20	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1cccnc1)C(C)C	ZINC000875356318	EF	On-Demand	Anodyne	SLC6A3	43	42
COCCN(CC1CCN(C)CC1)C(=O)NCc1c(F)c(F)cc(F)c1F	ZINC000875356339	GF	On-Demand	Anodyne	CACNA1I	49	33
O=C(NCc1nccn1CCc1ccccc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875356366	GH	On-Demand	Anodyne	EPHX2	28	41
O=C(NCc1nccn1CCc1ccccc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875356367	GH	On-Demand	Anodyne	EPHX2	28	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nccn1CCCc1ccccc1	ZINC000875356391	GF	On-Demand	Anodyne	SLC6A4	28	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nccn1CCCc1ccccc1	ZINC000875356391	GF	On-Demand	Anodyne	SLC6A3	61	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nccn1CCCc1ccccc1	ZINC000875356392	GF	On-Demand	Anodyne	SLC6A4	28	47
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nccn1CCCc1ccccc1	ZINC000875356392	GF	On-Demand	Anodyne	SLC6A3	61	44
CC[C@@H]1COCCN1CCNC(=O)NC[C@H](c1cccnc1)C(C)C	ZINC000875356439	EE	On-Demand	Anodyne	KCNA5	21	44
CC[C@@H]1COCCN1CCNC(=O)NC[C@@H](c1cccnc1)C(C)C	ZINC000875356440	EE	On-Demand	Anodyne	KCNA5	21	44
O=C(NCCO)C1CCN(C(=O)NCc2c(F)c(F)cc(F)c2F)CC1	ZINC000875356546	GD	On-Demand	Anodyne	EPHX2	20	48
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](c1cccnc1)C(C)C	ZINC000875356614	DF	On-Demand	Anodyne	KCNA5	23	50
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](c1cccnc1)C(C)C	ZINC000875356615	DF	On-Demand	Anodyne	KCNA5	23	50
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2nccn2CCc2ccccc2)C1	ZINC000875356670	GE	On-Demand	Anodyne	ACE	30	40
CONC(=O)C1CCN(C(=O)NCc2c(F)c(F)cc(F)c2F)CC1	ZINC000875356682	FD	On-Demand	Anodyne	EPHX2	20	46
O=C(NCc1nccn1CCCc1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875356697	GD	On-Demand	Anodyne	GHRHR	42	33
CC[C@@H](CNC(=O)NC[C@H]1C[C@H](O)C1)Oc1cccc(F)c1	ZINC000875356779	DE	On-Demand	Anodyne	PDS	53	43
CC[C@@H](CNC(=O)NC[C@@H]1CCO[C@@H]1C(=O)OC)Oc1cccc(F)c1	ZINC000875356796	FD	On-Demand	Anodyne	PDS	45	41
CC[C@@H](CNC(=O)NNc1nnc(C)n1C)Oc1cccc(F)c1	ZINC000875356835	ED	On-Demand	Reactive	PDS	27	40
Cc1noc(C2CCC(NC(=O)N3CCC[C@H]3[C@@H](O)c3ccccc3)CC2)n1	ZINC000875356844	GG	On-Demand	Anodyne	SMO	39	43
Cc1noc(C2CCC(NC(=O)N3CCC[C@@H]3[C@H](O)c3ccccc3)CC2)n1	ZINC000875356845	GG	On-Demand	Anodyne	SMO	39	43
Cc1noc(C2CCC(NC(=O)N3CCC[C@@H]3[C@@H](O)c3ccccc3)CC2)n1	ZINC000875356846	GG	On-Demand	Anodyne	SMO	39	43
Cc1noc(C2CCC(NC(=O)N3CCC[C@H]3[C@H](O)c3ccccc3)CC2)n1	ZINC000875356847	GG	On-Demand	Anodyne	SMO	39	43
O=C(Nc1ccc(F)cc1OCC1CC1)c1scnc1C(F)F	ZINC000875356888	EI	On-Demand	Anodyne	PDE4D	15	40
N#CCc1ccsc1C(=O)Nc1ccc(Cl)cc1C(=O)NCC1CC1	ZINC000875356890	FH	On-Demand	Mild	F10	40	42
CC[C@@H](CNC(=O)NN(C)C(=O)OC)Oc1cccc(F)c1	ZINC000875357002	DD	On-Demand	Reactive	PDS	67	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1csc([C@@H](C)OC)n1	ZINC000875357025	FE	On-Demand	Anodyne	SLC6A3	51	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1csc([C@@H](C)OC)n1	ZINC000875357026	FE	On-Demand	Anodyne	SLC6A3	51	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1csc([C@H](C)OC)n1	ZINC000875357027	FE	On-Demand	Anodyne	SLC6A3	51	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1csc([C@H](C)OC)n1	ZINC000875357028	FE	On-Demand	Anodyne	SLC6A3	51	37
CC[C@@H](CNC(=O)N1CC[C@@H](C(C)(C)O)C1)Oc1cccc(F)c1	ZINC000875357113	EF	On-Demand	Anodyne	CCR5	50	32
CC[C@@H](CNC(=O)N1CC[C@@H](C(C)(C)O)C1)Oc1cccc(F)c1	ZINC000875357113	EF	On-Demand	Anodyne	PDS	40	40
CC[C@@H](CNC(=O)N1CC[C@H](C(C)(C)O)C1)Oc1cccc(F)c1	ZINC000875357115	EF	On-Demand	Anodyne	CCR5	50	32
CC[C@@H](CNC(=O)N1CC[C@H](C(C)(C)O)C1)Oc1cccc(F)c1	ZINC000875357115	EF	On-Demand	Anodyne	PDS	40	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1csc(CCc2ccccc2)n1	ZINC000875357209	GG	On-Demand	Anodyne	SLC6A4	22	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1csc(CCc2ccccc2)n1	ZINC000875357209	GG	On-Demand	Anodyne	SLC6A3	45	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1csc(CCc2ccccc2)n1	ZINC000875357210	GG	On-Demand	Anodyne	SLC6A4	22	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1csc(CCc2ccccc2)n1	ZINC000875357210	GG	On-Demand	Anodyne	SLC6A3	45	44
COc1ccccc1[C@H]1CCCN(C(=O)NCC2(C)CCOCC2)CC1	ZINC000875357317	FH	On-Demand	Anodyne	SMO	26	40
COc1ccccc1[C@H]1CCCN(C(=O)NCC2(C)CCOCC2)CC1	ZINC000875357317	FH	On-Demand	Anodyne	HCN1	64	38
COc1ccccc1[C@H]1CCCN(C(=O)NCC2(C)CCOCC2)CC1	ZINC000875357317	FH	On-Demand	Anodyne	HCN4	50	35
COc1ccccc1[C@H]1CCCN(C(=O)NCC2(C)CCOCC2)CC1	ZINC000875357317	FH	On-Demand	Anodyne	ACKR3	50	31
COc1ccccc1[C@@H]1CCCN(C(=O)NCC2(C)CCOCC2)CC1	ZINC000875357318	FH	On-Demand	Anodyne	SMO	26	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCC2(C)CCOCC2)CC1	ZINC000875357318	FH	On-Demand	Anodyne	HCN1	64	38
COc1ccccc1[C@@H]1CCCN(C(=O)NCC2(C)CCOCC2)CC1	ZINC000875357318	FH	On-Demand	Anodyne	HCN4	50	35
COc1ccccc1[C@@H]1CCCN(C(=O)NCC2(C)CCOCC2)CC1	ZINC000875357318	FH	On-Demand	Anodyne	ACKR3	50	31
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)[C@]1(C)CCC(=O)N1	ZINC000875357344	ED	On-Demand	Anodyne	SIGMAR1	32	40
C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)[C@]1(C)CCC(=O)N1	ZINC000875357345	ED	On-Demand	Anodyne	SIGMAR1	32	40
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)[C@]12CCCC[C@H]1C2	ZINC000875357346	EH	On-Demand	Anodyne	FKBP1A	29	40
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)[C@]12CCCC[C@H]1C2	ZINC000875357346	EH	On-Demand	Anodyne	SIGMAR1	54	44
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)[C@]12CCCC[C@@H]1C2	ZINC000875357347	EH	On-Demand	Anodyne	FKBP1A	29	40
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)[C@]12CCCC[C@@H]1C2	ZINC000875357347	EH	On-Demand	Anodyne	SIGMAR1	54	44
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)[C@@]12CCCC[C@H]1C2	ZINC000875357348	EH	On-Demand	Anodyne	FKBP1A	29	40
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)[C@@]12CCCC[C@H]1C2	ZINC000875357348	EH	On-Demand	Anodyne	SIGMAR1	54	44
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)[C@@]12CCCC[C@@H]1C2	ZINC000875357349	EH	On-Demand	Anodyne	FKBP1A	29	40
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)[C@@]12CCCC[C@@H]1C2	ZINC000875357349	EH	On-Demand	Anodyne	SIGMAR1	54	44
CC[C@@H](NC(=O)N1CCC[C@H](CCC(=O)OC)C1)C(=O)N1CCOCC1	ZINC000875357353	FC	On-Demand	Anodyne	CTSS	24	40
CC[C@@H](NC(=O)N1CCC[C@@H](CCC(=O)OC)C1)C(=O)N1CCOCC1	ZINC000875357354	FC	On-Demand	Anodyne	CTSS	24	40
CC[C@@H](NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)C(=O)N1CCOCC1	ZINC000875357390	GD	On-Demand	Anodyne	GHRHR	56	33
CC[C@@H](NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)C(=O)N1CCOCC1	ZINC000875357390	GD	On-Demand	Anodyne	CCR1	15	43
CC[C@@H](NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)C(=O)N1CCOCC1	ZINC000875357390	GD	On-Demand	Anodyne	CTSS	31	42
Cc1noc(C2CCC(NC(=O)N3CCC[C@@](O)(c4ccccc4)C3)CC2)n1	ZINC000875357469	GG	On-Demand	Anodyne	EPHX2	19	54
Cc1noc(C2CCC(NC(=O)N3CCC[C@@](O)(c4ccccc4)C3)CC2)n1	ZINC000875357469	GG	On-Demand	Anodyne	SMO	44	47
Cc1noc(C2CCC(NC(=O)N3CCC[C@](O)(c4ccccc4)C3)CC2)n1	ZINC000875357470	GG	On-Demand	Anodyne	EPHX2	19	54
Cc1noc(C2CCC(NC(=O)N3CCC[C@](O)(c4ccccc4)C3)CC2)n1	ZINC000875357470	GG	On-Demand	Anodyne	SMO	44	47
Cc1noc(C2CCC(NC(=O)N3CCCN(C=O)CC3)CC2)n1	ZINC000875357481	ED	On-Demand	Anodyne	SMO	37	47
CC[C@@H](NC(=O)N1CCC[C@@](O)(c2ccccc2)C1)C(=O)N1CCOCC1	ZINC000875357535	GD	On-Demand	Anodyne	CCR1	17	42
CC[C@@H](NC(=O)N1CCC[C@](O)(c2ccccc2)C1)C(=O)N1CCOCC1	ZINC000875357536	GD	On-Demand	Anodyne	CCR1	17	42
CC[C@@H](NC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F)C(=O)N1CCOCC1	ZINC000875357741	GE	On-Demand	Mild	CTSF	48	39
CC[C@@H](NC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F)C(=O)N1CCOCC1	ZINC000875357743	GE	On-Demand	Mild	CTSF	48	39
C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)C1(C)CC(F)(F)C1	ZINC000875357751	EH	On-Demand	Anodyne	SIGMAR1	42	45
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)C1(C)CC(F)(F)C1	ZINC000875357752	EH	On-Demand	Anodyne	SIGMAR1	42	45
Cc1noc(C2CCC(NC(=O)N3CCO[C@H]([C@@H]4COC(C)(C)O4)C3)CC2)n1	ZINC000875357860	GD	On-Demand	Anodyne	SMO	23	40
CC[C@@H](CNC(=O)N1CC(O)(C(=O)OC)C1)Oc1cccc(F)c1	ZINC000875357874	EC	On-Demand	Anodyne	PDS	42	41
Cc1noc(C2CCC(NC(=O)N3CCCC[C@H]3[C@H](O)c3ccccc3)CC2)n1	ZINC000875357879	GH	On-Demand	Anodyne	CPT1A	58	41
Cc1noc(C2CCC(NC(=O)N3CCCC[C@H]3[C@H](O)c3ccccc3)CC2)n1	ZINC000875357879	GH	On-Demand	Anodyne	SMO	39	44
Cc1noc(C2CCC(NC(=O)N3CCCC[C@H]3[C@@H](O)c3ccccc3)CC2)n1	ZINC000875357881	GH	On-Demand	Anodyne	CPT1A	58	41
Cc1noc(C2CCC(NC(=O)N3CCCC[C@H]3[C@@H](O)c3ccccc3)CC2)n1	ZINC000875357881	GH	On-Demand	Anodyne	SMO	39	44
Cc1noc(C2CCC(NC(=O)N3CCCC[C@@H]3[C@H](O)c3ccccc3)CC2)n1	ZINC000875357882	GH	On-Demand	Anodyne	CPT1A	58	41
Cc1noc(C2CCC(NC(=O)N3CCCC[C@@H]3[C@H](O)c3ccccc3)CC2)n1	ZINC000875357882	GH	On-Demand	Anodyne	SMO	39	44
Cc1noc(C2CCC(NC(=O)N3CCCC[C@@H]3[C@@H](O)c3ccccc3)CC2)n1	ZINC000875357885	GH	On-Demand	Anodyne	CPT1A	58	41
Cc1noc(C2CCC(NC(=O)N3CCCC[C@@H]3[C@@H](O)c3ccccc3)CC2)n1	ZINC000875357885	GH	On-Demand	Anodyne	SMO	39	44
CC[C@@H](CNC(=O)N1Cc2cccc(O)c2C1)Oc1cccc(F)c1	ZINC000875357925	EG	On-Demand	Clean	PDS	35	40
Cc1cccc(C(NC(=O)N2CCC3(CCNC3=O)CC2)c2cccc(C)c2)c1	ZINC000875357936	GH	On-Demand	Anodyne	CACNA1H	45	38
CC[C@@H](CNC(=O)N1CCC(CO)(CO)CC1)Oc1cccc(F)c1	ZINC000875357940	FD	On-Demand	Anodyne	CACNA1H	47	41
CC[C@@H](CNC(=O)N1CCC(CO)(CO)CC1)Oc1cccc(F)c1	ZINC000875357940	FD	On-Demand	Anodyne	S1PR2	29	40
CC[C@@H](CNC(=O)N1CCC(CO)(CO)CC1)Oc1cccc(F)c1	ZINC000875357940	FD	On-Demand	Anodyne	PDS	59	43
CC[C@@H](CNC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)Oc1cccc(F)c1	ZINC000875357988	GE	On-Demand	Anodyne	PDS	38	40
O=C(Nc1ccccc1C(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1)c1cccs1	ZINC000875358022	JJ	On-Demand	Reactive	STK33	26	41
COc1ccccc1[C@@H]1CSCCCN1C(=O)NCC1(C)CCOCC1	ZINC000875358058	GH	On-Demand	Anodyne	HCN1	59	37
COc1ccccc1[C@@H]1CSCCCN1C(=O)NCC1(C)CCOCC1	ZINC000875358058	GH	On-Demand	Anodyne	HCN4	50	35
CC[C@@H](CNC(=O)NC1(C)CC(F)(F)C1)Oc1cccc(F)c1	ZINC000875358067	EG	On-Demand	Anodyne	PDS	53	42
C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)C1(F)CCOCC1	ZINC000875358119	EF	On-Demand	Anodyne	SIGMAR1	50	41
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)C1(F)CCOCC1	ZINC000875358120	EF	On-Demand	Anodyne	SIGMAR1	50	41
CONC(=O)C1CCN(C(=O)NC(c2cccc(C)c2)c2cccc(C)c2)CC1	ZINC000875358182	GG	On-Demand	Anodyne	EPHX2	24	43
CCOC(=O)[C@@H]1CN(C(=O)N[C@H](CC)C(=O)N2CCOCC2)CCC1(F)F	ZINC000875358205	GC	On-Demand	Anodyne	GHRHR	42	34
CCOC(=O)[C@@H]1CN(C(=O)N[C@@H](CC)C(=O)N2CCOCC2)CCC1(F)F	ZINC000875358206	GC	On-Demand	Anodyne	GHRHR	42	34
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCCn2ncnc21	ZINC000875358207	GG	On-Demand	Reactive	LTA4H	26	40
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCCn2ncnc21	ZINC000875358207	GG	On-Demand	Reactive	ADAM17	27	43
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCCn2ncnc21	ZINC000875358208	GG	On-Demand	Reactive	LTA4H	26	40
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCCn2ncnc21	ZINC000875358208	GG	On-Demand	Reactive	ADAM17	27	43
CC[C@@H](CNC(=O)N1CCCN(C=O)CC1)Oc1cccc(F)c1	ZINC000875358317	ED	On-Demand	Anodyne	PDS	50	42
CC[C@@H](NC(=O)N[C@](C)(CO)Cc1ccc(Cl)cc1)C(=O)N1CCOCC1	ZINC000875358392	GD	On-Demand	Anodyne	MC4R	47	35
CC[C@@H](NC(=O)N[C@](C)(CO)Cc1ccc(Cl)cc1)C(=O)N1CCOCC1	ZINC000875358392	GD	On-Demand	Anodyne	CCR1	25	43
CC[C@@H](NC(=O)N[C@@](C)(CO)Cc1ccc(Cl)cc1)C(=O)N1CCOCC1	ZINC000875358395	GD	On-Demand	Anodyne	MC4R	47	35
CC[C@@H](NC(=O)N[C@@](C)(CO)Cc1ccc(Cl)cc1)C(=O)N1CCOCC1	ZINC000875358395	GD	On-Demand	Anodyne	CCR1	25	43
CCOC1CC2(C1)C[C@H]2NC(=O)NCc1csc(CCc2ccccc2)n1	ZINC000875358416	GH	On-Demand	Anodyne	TIMP3	44	34
CCOC1CC2(C1)C[C@@H]2NC(=O)NCc1csc(CCc2ccccc2)n1	ZINC000875358417	GH	On-Demand	Anodyne	TIMP3	44	34
CC[C@@H](NC(=O)NC1CC(Nc2ccccc2)C1)C(=O)N1CCOCC1	ZINC000875358438	FD	On-Demand	Anodyne	P2RY12	48	40
CC[C@@H](NC(=O)NC1CC(Nc2ccccc2)C1)C(=O)N1CCOCC1	ZINC000875358438	FD	On-Demand	Anodyne	ITGAL	41	33
CC[C@@H](NC(=O)NNc1cccc(C)n1)C(=O)N1CCOCC1	ZINC000875358480	DC	On-Demand	Reactive	P2RY12	50	38
CC[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)C(=O)N1CCOCC1	ZINC000875358537	EC	On-Demand	Anodyne	CTSS	25	43
CC[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)C(=O)N1CCOCC1	ZINC000875358538	EC	On-Demand	Anodyne	CTSS	25	43
O=C(NCc1csc(CCc2ccccc2)n1)N1CCC2(CCNC2=O)CC1	ZINC000875358571	GF	On-Demand	Anodyne	GHRHR	45	35
O=C(N[C@H]1CCCn2ncnc21)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875358572	FD	On-Demand	Anodyne	SIGMAR1	30	40
O=C(N[C@H]1CCCn2ncnc21)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875358572	FD	On-Demand	Anodyne	PREP	42	33
O=C(N[C@@H]1CCCn2ncnc21)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875358573	FD	On-Demand	Anodyne	SIGMAR1	30	40
O=C(N[C@@H]1CCCn2ncnc21)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875358573	FD	On-Demand	Anodyne	PREP	42	33
O=C(NCCn1cccc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875358576	EF	On-Demand	Anodyne	FKBP1A	20	41
O=C(NCCn1cccc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875358577	EF	On-Demand	Anodyne	FKBP1A	20	41
O=C(NCCn1cccc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875358578	EF	On-Demand	Anodyne	FKBP1A	20	41
CCO[C@@H](CCN(C)C)CNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875358583	GE	On-Demand	Mild	ITK	16	45
COCC(C)(C)CCNC(=O)C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000875358611	GC	On-Demand	Anodyne	STAT6	49	33
O=C(NCCn1cccc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875358646	EF	On-Demand	Anodyne	FKBP1A	20	41
C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C(=O)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1F	ZINC000875358700	GE	On-Demand	Anodyne	PKM	45	37
C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C(=O)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1F	ZINC000875358700	GE	On-Demand	Anodyne	TGM2	41	33
C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C(=O)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1F	ZINC000875358700	GE	On-Demand	Anodyne	F13A1	46	34
C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C(=O)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1F	ZINC000875358704	GE	On-Demand	Anodyne	PKM	45	37
C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C(=O)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1F	ZINC000875358704	GE	On-Demand	Anodyne	TGM2	41	33
C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C(=O)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1F	ZINC000875358704	GE	On-Demand	Anodyne	F13A1	46	34
C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C(=O)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1F	ZINC000875358706	GE	On-Demand	Anodyne	PKM	45	37
C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C(=O)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1F	ZINC000875358706	GE	On-Demand	Anodyne	TGM2	41	33
C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C(=O)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1F	ZINC000875358706	GE	On-Demand	Anodyne	F13A1	46	34
N#CCc1ccsc1C(=O)N1CCCC[C@H]1C(=O)Nc1ccc2c(c1)CCO2	ZINC000875358759	GG	On-Demand	Mild	LGMN	58	31
N#CCc1ccsc1C(=O)N1CCCC[C@@H]1C(=O)Nc1ccc2c(c1)CCO2	ZINC000875358760	GG	On-Demand	Mild	LGMN	58	31
O=C(NCCCCC1CC1)C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000875358799	GD	On-Demand	Anodyne	STAT6	44	33
CC[C@@H](NC(=O)NC[C@H](O)Cc1cccc(Cl)c1)C(=O)N1CCOCC1	ZINC000875358822	GD	On-Demand	Anodyne	MC4R	75	37
CC[C@@H](NC(=O)NC[C@H](O)Cc1cccc(Cl)c1)C(=O)N1CCOCC1	ZINC000875358822	GD	On-Demand	Anodyne	TRY2_BOVIN	68	39
CC[C@@H](NC(=O)NC[C@H](O)Cc1cccc(Cl)c1)C(=O)N1CCOCC1	ZINC000875358822	GD	On-Demand	Anodyne	CCR1	15	43
CC[C@@H](NC(=O)NC[C@@H](O)Cc1cccc(Cl)c1)C(=O)N1CCOCC1	ZINC000875358823	GD	On-Demand	Anodyne	MC4R	75	37
CC[C@@H](NC(=O)NC[C@@H](O)Cc1cccc(Cl)c1)C(=O)N1CCOCC1	ZINC000875358823	GD	On-Demand	Anodyne	TRY2_BOVIN	68	39
CC[C@@H](NC(=O)NC[C@@H](O)Cc1cccc(Cl)c1)C(=O)N1CCOCC1	ZINC000875358823	GD	On-Demand	Anodyne	CCR1	15	43
O=C(N[C@@H]1CCCn2ncnc21)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875358828	ED	On-Demand	Anodyne	EPHX2	15	41
O=C(N[C@H]1CCCn2ncnc21)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875358829	ED	On-Demand	Anodyne	EPHX2	15	41
O=C(N[C@@H]1CCCn2ncnc21)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875358831	ED	On-Demand	Anodyne	EPHX2	15	41
O=C(N[C@H]1CCCn2ncnc21)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875358832	ED	On-Demand	Anodyne	EPHX2	15	41
CCCCCCCNC(=O)C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000875358852	GD	On-Demand	Mild	ASAH1	78	42
CCCCCCCNC(=O)C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000875358852	GD	On-Demand	Mild	STAT6	49	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCn1cccc1	ZINC000875358881	CD	On-Demand	Anodyne	SLC6A3	40	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCn1cccc1	ZINC000875358883	CD	On-Demand	Anodyne	SLC6A3	40	38
O=C(NCc1cnc(N2CCOCC2)c(F)c1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875358908	GD	On-Demand	Anodyne	STAT6	43	33
CC[C@@H](NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1)C(=O)N1CCOCC1	ZINC000875358916	FD	On-Demand	Anodyne	P2RY12	67	38
CC(=O)[C@H]1CCCN(C(=O)NCc2csc(CCc3ccccc3)n2)C1	ZINC000875358919	FG	On-Demand	Anodyne	PREP	49	37
CC(=O)[C@H]1CCCN(C(=O)NCc2csc(CCc3ccccc3)n2)C1	ZINC000875358919	FG	On-Demand	Anodyne	DPP7	52	38
CC(=O)[C@@H]1CCCN(C(=O)NCc2csc(CCc3ccccc3)n2)C1	ZINC000875358921	FG	On-Demand	Anodyne	PREP	49	37
CC(=O)[C@@H]1CCCN(C(=O)NCc2csc(CCc3ccccc3)n2)C1	ZINC000875358921	FG	On-Demand	Anodyne	DPP7	52	38
NC(=O)c1ccc(CNC(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)cn1	ZINC000875359023	FD	On-Demand	Anodyne	PRSS2	45	30
NC(=O)c1ccc(CNC(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)cn1	ZINC000875359023	FD	On-Demand	Anodyne	MLNR	35	43
NC(=O)c1ccc(CNC(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)cn1	ZINC000875359023	FD	On-Demand	Anodyne	EPHX2	22	49
NC(=O)c1ccc(CNC(=O)N2CC[C@H](Oc3ccc(F)cc3)C2)cn1	ZINC000875359023	FD	On-Demand	Anodyne	SCD1	16	44
Cc1noc(C)c1CCCNC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875359060	EF	On-Demand	Anodyne	ADAMTS4	25	40
C#CC[C@@H](COC)NC(=O)C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000875359080	GB	On-Demand	Mild	STAT6	43	31
C#CC[C@H](COC)NC(=O)C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000875359081	GB	On-Demand	Mild	STAT6	43	31
C=CC(C)(C)CCCNC(=O)C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000875359084	GD	On-Demand	Mild	STAT6	51	34
O=C(Nc1cc(S(=O)(=O)N2CCOCC2)ccc1F)C1(F)CCOCC1	ZINC000875359109	GD	On-Demand	Anodyne	LPL	37	40
O=C(Nc1cc(S(=O)(=O)N2CCOCC2)ccc1F)C1(F)CCOCC1	ZINC000875359109	GD	On-Demand	Anodyne	MMP13	24	41
O=C(Nc1cc(S(=O)(=O)N2CCOCC2)ccc1F)C1(F)CCOCC1	ZINC000875359109	GD	On-Demand	Anodyne	PKM	43	38
O=C(Nc1cc(S(=O)(=O)N2CCOCC2)ccc1F)C1(F)CCOCC1	ZINC000875359109	GD	On-Demand	Anodyne	LIPG	15	40
O=C(Nc1cc(S(=O)(=O)N2CCOCC2)ccc1F)C1(F)CCOCC1	ZINC000875359109	GD	On-Demand	Anodyne	NAMPT	19	40
Cc1ccnn1CC(=O)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1F	ZINC000875359147	GC	On-Demand	Anodyne	F13A1	40	34
Cc1ccnn1CC(=O)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1F	ZINC000875359147	GC	On-Demand	Anodyne	NAMPT	19	42
CCCCNC(=O)CN1CCN(C(=O)Nc2nccs2)CC1	ZINC000875359188	ED	On-Demand	Anodyne	MAP1	99	47
CCCCCCCNC(=O)C(=O)NC1CCN(c2cc(C)[nH]n2)CC1	ZINC000875359275	ED	On-Demand	Mild	ASAH1	70	33
COCCN(CC1CCN(C)CC1)C(=O)NCCCc1c(C)noc1C	ZINC000875359297	FE	On-Demand	Anodyne	ADAMTS4	25	40
CCO[C@@H](CCN(C)C)CNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875359306	GF	On-Demand	Mild	UTS2	64	33
CCO[C@@H](CCN(C)C)CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875359308	GF	On-Demand	Mild	UTS2	64	33
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NCc1ccc(C(N)=O)nc1	ZINC000875359354	GE	On-Demand	Anodyne	F2	16	40
C[C@@H]1CN(C(=O)NCc2ccc(C(N)=O)nc2)Cc2ccccc21	ZINC000875359363	DE	On-Demand	Anodyne	NAMPT	25	40
Cn1nc(Cl)c(C(=O)Nc2ccccc2OCC2CC2)c1Cl	ZINC000875359369	EH	On-Demand	Anodyne	G2YM83_BOTF4	58	34
CCC1(CC)CCCN1C(=O)NCc1ccc(C(N)=O)nc1	ZINC000875359378	DE	On-Demand	Anodyne	SLC12A5	49	34
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCc2c(C)noc2C)CC1	ZINC000875359452	GI	On-Demand	Anodyne	DRD2	17	41
COc1ccccc1[C@H]1CCCN(C(=O)NCCCc2c(C)noc2C)CC1	ZINC000875359453	GI	On-Demand	Anodyne	DRD2	17	41
O=C(NCc1cnc(N2CCOCC2)c(F)c1)C(=O)N[C@H]1CC12CCC2	ZINC000875359618	FC	On-Demand	Anodyne	STAT6	45	33
O=C(NCc1cnc(N2CCOCC2)c(F)c1)C(=O)N[C@@H]1CC12CCC2	ZINC000875359619	FC	On-Demand	Anodyne	STAT6	45	33
C[C@H]1C[C@H](NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CN1C1CC1	ZINC000875359654	FF	On-Demand	Mild	ITK	15	46
C[C@H]1C[C@H](NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CN1C1CC1	ZINC000875359654	FF	On-Demand	Mild	PANC	48	35
NC(=O)c1ccc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)cn1	ZINC000875359694	FD	On-Demand	Anodyne	NPFFR1	40	36
O=C(NC1CCN(S(=O)(=O)C2CC2)CC1)N[C@H]1CCc2ccc(Cl)cc21	ZINC000875359761	GF	On-Demand	Anodyne	EPHX2	20	45
O=C(NC1CCN(S(=O)(=O)C2CC2)CC1)N[C@@H]1CCc2ccc(Cl)cc21	ZINC000875359762	GF	On-Demand	Anodyne	EPHX2	20	45
Cc1ccccc1[C@H](C)NC(=O)/C=C\c1ccc2ccccc2n1	ZINC000875359804	DI	On-Demand	Anodyne	UL26	89	40
Cc1ccccc1[C@H](C)NC(=O)/C=C\c1ccc2ccccc2n1	ZINC000875359804	DI	On-Demand	Anodyne	SCAF_EBVB9	74	37
Cc1ccccc1[C@@H](C)NC(=O)/C=C\c1ccc2ccccc2n1	ZINC000875359805	DI	On-Demand	Anodyne	UL26	89	40
Cc1ccccc1[C@@H](C)NC(=O)/C=C\c1ccc2ccccc2n1	ZINC000875359805	DI	On-Demand	Anodyne	SCAF_EBVB9	74	37
C[C@H]1[C@H](C)CCCN1C(=O)c1c(C(F)F)nc2n1CCCC2	ZINC000875359963	DG	On-Demand	Anodyne	TRPC6	51	36
COc1cccc([C@H](O)C2CCN(C(=O)NCCc3nnc4n3CCC4)CC2)c1	ZINC000875360018	GD	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@H](O)C2CCN(C(=O)NCCc3nnc4n3CCC4)CC2)c1	ZINC000875360018	GD	On-Demand	Anodyne	MTNR1A	34	40
COc1cccc([C@H](O)C2CCN(C(=O)NCCc3nnc4n3CCC4)CC2)c1	ZINC000875360018	GD	On-Demand	Anodyne	MTNR1B	32	40
O=C(NCc1cc(O)nc2ccccc12)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875360038	GG	On-Demand	Anodyne	EPHX2	15	48
O=C(NCc1cc(O)nc2ccccc12)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875360039	GG	On-Demand	Anodyne	EPHX2	15	48
CC[C@H](NC(=O)c1c(Cl)nn(C)c1Cl)c1ccncc1	ZINC000875360114	DG	On-Demand	Anodyne	TACR3	50	42
O=C(NCCc1csc(-c2ccccc2)n1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875360126	GH	On-Demand	Anodyne	ETHR	52	36
O=C(NCCc1csc(-c2ccccc2)n1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875360127	GH	On-Demand	Anodyne	ETHR	52	36
COC(=O)N(C)NC(=O)NCCCOc1cc(OC)cc(OC)c1	ZINC000875360160	ED	On-Demand	Reactive	MTNR1A	48	44
COC(=O)N(C)NC(=O)NCCCOc1cc(OC)cc(OC)c1	ZINC000875360160	ED	On-Demand	Reactive	MTNR1B	39	44
O=C(NCCc1nnc2n1CCC2)NNc1ccc(OCc2ccccc2)cc1	ZINC000875360212	GF	On-Demand	Reactive	LTA4H	22	41
CN1CC[C@H]2CN(C(=O)NC3CCN(S(=O)(=O)C4CC4)CC3)CC[C@@H]21	ZINC000875360369	FC	On-Demand	Anodyne	EPHX2	15	42
CN1CC[C@H]2CN(C(=O)NC3CCN(S(=O)(=O)C4CC4)CC3)CC[C@H]21	ZINC000875360372	FC	On-Demand	Anodyne	EPHX2	15	42
C[C@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)C(C)(C)CN(C)C	ZINC000875360443	FF	On-Demand	Mild	PANC	41	35
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(S(=O)(=O)C3CC3)CC2)C1	ZINC000875360509	FC	On-Demand	Anodyne	EPHX2	23	52
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(S(=O)(=O)C3CC3)CC2)C1	ZINC000875360510	FC	On-Demand	Anodyne	EPHX2	23	52
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(S(=O)(=O)C2CC2)CC1	ZINC000875360518	EC	On-Demand	Anodyne	EPHX2	17	41
CCCCCCCNC(=O)C(=O)NCC1(OC)CCC1	ZINC000875360544	CD	On-Demand	Mild	ASAH1	62	32
CC[C@H](NC(=O)c1c(Cl)nn(C)c1Cl)C(C)(C)c1ccccc1	ZINC000875360576	FI	On-Demand	Anodyne	CTRB1	35	42
CC[C@H](NC(=O)c1c(Cl)nn(C)c1Cl)C(C)(C)c1ccccc1	ZINC000875360576	FI	On-Demand	Anodyne	CELA2A	22	42
C[C@@H](NC(=O)N(C)C[C@@H]1CN(C)CCO1)c1cccc(OC(F)(F)F)c1	ZINC000875360604	GF	On-Demand	Anodyne	CASR	25	44
C[C@@H](NC(=O)N(C)C[C@H]1CN(C)CCO1)c1cccc(OC(F)(F)F)c1	ZINC000875360605	GF	On-Demand	Anodyne	CASR	25	44
O=C(NC1CCN(S(=O)(=O)C2CC2)CC1)N1Cc2cccc(O)c2C1	ZINC000875360747	FD	On-Demand	Clean	EPHX2	24	42
O=C(NC1CCN(S(=O)(=O)C2CC2)CC1)N1Cc2cccc(O)c2C1	ZINC000875360747	FD	On-Demand	Clean	TGM2	18	42
C[C@H](NC(=O)NCCN1CC[C@H](O)C1)c1cccc(OC(F)(F)F)c1	ZINC000875360752	FE	On-Demand	Anodyne	DRD4	42	32
C[C@H](NC(=O)NCCN1CC[C@H](O)C1)c1cccc(OC(F)(F)F)c1	ZINC000875360752	FE	On-Demand	Anodyne	OPRK1	19	41
C[C@@H](NC(=O)NCCN1CC[C@@H](O)C1)c1cccc(OC(F)(F)F)c1	ZINC000875360753	FE	On-Demand	Anodyne	DRD4	42	32
C[C@@H](NC(=O)NCCN1CC[C@@H](O)C1)c1cccc(OC(F)(F)F)c1	ZINC000875360753	FE	On-Demand	Anodyne	OPRK1	19	41
C[C@H](NC(=O)NCCN1CC[C@@H](O)C1)c1cccc(OC(F)(F)F)c1	ZINC000875360754	FE	On-Demand	Anodyne	DRD4	42	32
C[C@H](NC(=O)NCCN1CC[C@@H](O)C1)c1cccc(OC(F)(F)F)c1	ZINC000875360754	FE	On-Demand	Anodyne	OPRK1	19	41
C[C@@H](NC(=O)NCCN1CC[C@H](O)C1)c1cccc(OC(F)(F)F)c1	ZINC000875360755	FE	On-Demand	Anodyne	DRD4	42	32
C[C@@H](NC(=O)NCCN1CC[C@H](O)C1)c1cccc(OC(F)(F)F)c1	ZINC000875360755	FE	On-Demand	Anodyne	OPRK1	19	41
CSCCSc1nnc(CCC(N)=O)n1C[C@@H]1CCCO1	ZINC000875360762	ED	On-Demand	Anodyne	PDE8B	50	38
CSCCSc1nnc(CCC(N)=O)n1C[C@H]1CCCO1	ZINC000875360763	ED	On-Demand	Anodyne	PDE8B	50	38
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCOc3cc(OC)cc(OC)c3)C[C@@H]1C2	ZINC000875360764	GE	On-Demand	Anodyne	HRH2	18	40
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCOc3cc(OC)cc(OC)c3)C[C@@H]1C2	ZINC000875360764	GE	On-Demand	Anodyne	EPHX2	15	42
CC[C@H](NC(=O)c1c(C(F)(F)F)coc1C)c1ccncc1	ZINC000875360766	DH	On-Demand	Anodyne	TACR3	50	40
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1cccc(OC(F)(F)F)c1	ZINC000875360767	GE	On-Demand	Anodyne	CACNA1H	34	42
COC(=O)[C@@]1(OC)CCN(C(=O)N[C@H](C)c2cccc(OC(F)(F)F)c2)C1	ZINC000875360785	GF	On-Demand	Anodyne	EPHX2	32	40
COC(=O)[C@@]1(OC)CCN(C(=O)N[C@@H](C)c2cccc(OC(F)(F)F)c2)C1	ZINC000875360787	GF	On-Demand	Anodyne	EPHX2	32	40
CC[C@@H](NC(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)c1ccncc1	ZINC000875360801	GG	On-Demand	Anodyne	ACE	17	40
CC[C@@H](NC(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)c1ccncc1	ZINC000875360801	GG	On-Demand	Anodyne	CTRA_BOVIN	47	30
CC[C@@H](NC(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)c1ccncc1	ZINC000875360801	GG	On-Demand	Anodyne	CYSP_TRYCR	44	32
CC[C@@H](NC(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)c1ccncc1	ZINC000875360801	GG	On-Demand	Anodyne	CELA2A	40	30
CC[C@@H](NC(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)c1ccncc1	ZINC000875360801	GG	On-Demand	Anodyne	LGMN	70	39
CC[C@@H](NC(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)c1ccncc1	ZINC000875360801	GG	On-Demand	Anodyne	CAPN2	44	36
CC[C@@H](NC(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)c1ccncc1	ZINC000875360801	GG	On-Demand	Anodyne	Q9NAW4_PLAFA	41	47
O=C(NCCCCCCc1ccccc1)NCCc1nnc2n1CCC2	ZINC000875360884	FF	On-Demand	Anodyne	FKBP1A	22	42
O=C(NCCCCCCc1ccccc1)NCCc1nnc2n1CCC2	ZINC000875360884	FF	On-Demand	Anodyne	PREP	47	34
O=C(NCCCCCCc1ccccc1)NCCc1nnc2n1CCC2	ZINC000875360884	FF	On-Demand	Anodyne	FAAH	51	37
O=C(NCCCCCCc1ccccc1)NCCc1nnc2n1CCC2	ZINC000875360884	FF	On-Demand	Anodyne	CES1	54	35
CC[C@@H](NC(=O)NC1CCN(S(=O)(=O)C2CC2)CC1)[C@@H](O)c1ccccc1	ZINC000875360909	GD	On-Demand	Anodyne	CCR5	20	41
CC[C@@H](NC(=O)NC1CCN(S(=O)(=O)C2CC2)CC1)[C@@H](O)c1ccccc1	ZINC000875360909	GD	On-Demand	Anodyne	EPHX2	33	44
CC[C@@H](NC(=O)NC1CCN(S(=O)(=O)C2CC2)CC1)[C@@H](O)c1ccccc1	ZINC000875360909	GD	On-Demand	Anodyne	XIAP	44	36
CC[C@@H](NC(=O)NC1CCN(S(=O)(=O)C2CC2)CC1)[C@H](O)c1ccccc1	ZINC000875360910	GD	On-Demand	Anodyne	CCR5	20	41
CC[C@@H](NC(=O)NC1CCN(S(=O)(=O)C2CC2)CC1)[C@H](O)c1ccccc1	ZINC000875360910	GD	On-Demand	Anodyne	EPHX2	33	44
CC[C@@H](NC(=O)NC1CCN(S(=O)(=O)C2CC2)CC1)[C@H](O)c1ccccc1	ZINC000875360910	GD	On-Demand	Anodyne	XIAP	44	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCC1(OC)CCC1)CC2	ZINC000875360913	GD	On-Demand	Anodyne	SLC18A2	47	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCC1(OC)CCC1)CC2	ZINC000875360914	GD	On-Demand	Anodyne	SLC18A2	47	36
CC[C@@H](NC(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1)c1ccncc1	ZINC000875360925	FI	On-Demand	Anodyne	UTS2	56	36
O=C(NCCCOCCOCc1ccccc1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875360951	GE	On-Demand	Anodyne	GBA2	40	39
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2csc(-c3ccccc3)n2)C1	ZINC000875360957	GG	On-Demand	Anodyne	P2RY12	47	36
O=C(NNc1cccc(F)c1Cl)NC1CCN(S(=O)(=O)C2CC2)CC1	ZINC000875360982	GE	On-Demand	Reactive	EPHX2	19	47
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)c1cccc(OC(F)(F)F)c1	ZINC000875361163	EG	On-Demand	Anodyne	PDS	52	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)c1cccc(OC(F)(F)F)c1	ZINC000875361164	EG	On-Demand	Anodyne	PDS	52	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1csc(-c2ccccc2)n1	ZINC000875361311	GG	On-Demand	Anodyne	SLC6A4	24	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1csc(-c2ccccc2)n1	ZINC000875361311	GG	On-Demand	Anodyne	SLC6A3	45	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1csc(-c2ccccc2)n1	ZINC000875361312	GG	On-Demand	Anodyne	SLC6A4	24	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1csc(-c2ccccc2)n1	ZINC000875361312	GG	On-Demand	Anodyne	SLC6A3	45	40
C[C@@H](NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)C(C)(C)CN(C)C	ZINC000875361361	FE	On-Demand	Anodyne	GHRHR	43	31
CCCCCCCNC(=O)C(=O)N[C@@H](C)C1=CCN(C)CC1	ZINC000875361444	DD	On-Demand	Mild	ASAH1	84	37
CCCCCCCNC(=O)C(=O)N[C@H](C)C1=CCN(C)CC1	ZINC000875361445	DD	On-Demand	Mild	ASAH1	84	37
O=C(NCc1cc(O)nc2ccccc12)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875361456	GG	On-Demand	Anodyne	TRY1_BOVIN	40	34
O=C(NCc1cc(O)nc2ccccc12)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875361457	GG	On-Demand	Anodyne	TRY1_BOVIN	40	34
O=C(NCc1cc(O)nc2ccccc12)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875361458	GG	On-Demand	Anodyne	TRY1_BOVIN	40	34
O=C(NCc1cc(O)nc2ccccc12)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875361459	GG	On-Demand	Anodyne	TRY1_BOVIN	40	34
C[C@H]1[C@H](C)CCCN1C(=O)c1scnc1C(F)F	ZINC000875361462	CG	On-Demand	Anodyne	TRPC6	60	44
C[C@H]1[C@H](C)CCCN1C(=O)c1scnc1C(F)F	ZINC000875361462	CG	On-Demand	Anodyne	TRPC3	46	44
C#CC[C@@H](CCOC)NC(=O)NCc1cc(O)nc2ccccc12	ZINC000875361468	EE	On-Demand	Mild	TACR3	54	37
C#CC[C@H](CCOC)NC(=O)NCc1cc(O)nc2ccccc12	ZINC000875361469	EE	On-Demand	Mild	TACR3	54	37
C[C@@H]1CCCN(C(=O)C2(F)CCOCC2)[C@@H]1C	ZINC000875361491	BE	On-Demand	Anodyne	TRPC6	44	31
C[C@H]1[C@H](C)CCCN1C(=O)C1(F)CCOCC1	ZINC000875361492	BE	On-Demand	Anodyne	TRPC6	44	31
C[C@@H]1CCCN(C(=O)[C@@H]2CNC(=O)C[C@@H]2C(F)(F)F)[C@@H]1C	ZINC000875361495	DD	On-Demand	Anodyne	TRPC6	45	31
C[C@@H]1CCCN(C(=O)[C@@H]2CNC(=O)C[C@H]2C(F)(F)F)[C@@H]1C	ZINC000875361496	DD	On-Demand	Anodyne	TRPC6	45	31
C[C@H]1[C@H](C)CCCN1C(=O)[C@@H]1CNC(=O)C[C@H]1C(F)(F)F	ZINC000875361497	DD	On-Demand	Anodyne	TRPC6	45	31
C[C@H]1[C@H](C)CCCN1C(=O)[C@@H]1CNC(=O)C[C@@H]1C(F)(F)F	ZINC000875361498	DD	On-Demand	Anodyne	TRPC6	45	31
COc1ccc(N2CCN(C(=O)C(=O)NCC3(OC)CCC3)CC2)c(OC)c1	ZINC000875361512	GD	On-Demand	Clean	DRD2	26	40
COc1ccc(N2CCN(C(=O)C(=O)NCC3(OC)CCC3)CC2)c(OC)c1	ZINC000875361512	GD	On-Demand	Clean	DRD4	41	32
COc1ccc(N2CCN(C(=O)C(=O)NCC3(OC)CCC3)CC2)c(OC)c1	ZINC000875361512	GD	On-Demand	Clean	DRD3	40	37
O=C(NC1CCN(S(=O)(=O)C2CC2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875361523	GD	On-Demand	Anodyne	PTPN2	42	34
O=C(NC1CCN(S(=O)(=O)C2CC2)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875361523	GD	On-Demand	Anodyne	EPHX2	46	53
O=C(NC[C@@H]1CSCCS1)NNC(=O)c1nc2ccccc2s1	ZINC000875361559	FE	On-Demand	Reactive	ST14	40	31
O=C(NC[C@@H]1CSCCS1)NNC(=O)c1nc2ccccc2s1	ZINC000875361559	FE	On-Demand	Reactive	TMPRSS6	52	30
O=C(NC[C@H]1CSCCS1)NNC(=O)c1nc2ccccc2s1	ZINC000875361563	FE	On-Demand	Reactive	ST14	40	31
O=C(NC[C@H]1CSCCS1)NNC(=O)c1nc2ccccc2s1	ZINC000875361563	FE	On-Demand	Reactive	TMPRSS6	52	30
O=C(NCC[C@H](O)C1CCCC1)NC1CCN(S(=O)(=O)C2CC2)CC1	ZINC000875361634	FD	On-Demand	Anodyne	EPHX2	17	48
O=C(NCC[C@@H](O)C1CCCC1)NC1CCN(S(=O)(=O)C2CC2)CC1	ZINC000875361636	FD	On-Demand	Anodyne	EPHX2	17	48
COc1ccc(-n2cc(CNC(=O)NC3(C)CC(F)(F)C3)nn2)cc1	ZINC000875361645	FE	On-Demand	Anodyne	FIMH	21	42
C#CC[C@H](COC)NC(=O)NCc1cc(O)nc2ccccc12	ZINC000875361728	DD	On-Demand	Mild	TACR3	40	38
C#CC[C@@H](COC)NC(=O)NCc1cc(O)nc2ccccc12	ZINC000875361729	DD	On-Demand	Mild	TACR3	40	38
C[C@H]1[C@H](C)CCCN1C(=O)[C@]1(C)CCC(=O)N1	ZINC000875361756	BD	On-Demand	Anodyne	TRPC6	44	31
C[C@H]1[C@H](C)CCCN1C(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875361778	EI	On-Demand	Anodyne	PREP	30	40
C[C@H]1[C@H](C)CCCN1C(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875361778	EI	On-Demand	Anodyne	TRPC6	49	35
C[C@H]1[C@H](C)CCCN1C(=O)c1c(Cl)nn(C)c1Cl	ZINC000875361800	CF	On-Demand	Anodyne	TRPC6	53	38
COc1ccc(-n2cc(CNC(=O)N3CCC[C@H](OC4CCC4)CC3)nn2)cc1	ZINC000875361824	GF	On-Demand	Anodyne	EPHX2	16	41
COc1ccc(-n2cc(CNC(=O)N3CCC[C@@H](OC4CCC4)CC3)nn2)cc1	ZINC000875361825	GF	On-Demand	Anodyne	EPHX2	16	41
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN(S(=O)(=O)C2CC2)CC1	ZINC000875361863	GD	On-Demand	Anodyne	EPHX2	37	45
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN(S(=O)(=O)C2CC2)CC1	ZINC000875361863	GD	On-Demand	Anodyne	NCE103	15	41
Cc1ccccc1[C@H](C)NC(=O)/C=C\c1nc2ccccc2s1	ZINC000875361895	DI	On-Demand	Anodyne	UL26	105	40
Cc1ccccc1[C@H](C)NC(=O)/C=C\c1nc2ccccc2s1	ZINC000875361895	DI	On-Demand	Anodyne	SCAF_EBVB9	90	40
Cc1ccccc1[C@@H](C)NC(=O)/C=C\c1nc2ccccc2s1	ZINC000875361905	DI	On-Demand	Anodyne	UL26	105	40
Cc1ccccc1[C@@H](C)NC(=O)/C=C\c1nc2ccccc2s1	ZINC000875361905	DI	On-Demand	Anodyne	SCAF_EBVB9	90	40
COC(=O)N(C)NC(=O)NCCc1ccc(F)cc1C	ZINC000875361911	CD	On-Demand	Reactive	MTNR1A	42	40
COC(=O)N(C)NC(=O)NCCc1ccc(F)cc1C	ZINC000875361911	CD	On-Demand	Reactive	MTNR1B	18	40
Cc1cc(F)ccc1CCNC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875361934	EH	On-Demand	Anodyne	EPHX2	18	45
Cc1cc(F)ccc1CCNC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875361936	EH	On-Demand	Anodyne	EPHX2	18	45
CC(=O)C1CCN(C(=O)NC2CCN(S(=O)(=O)C3CC3)CC2)CC1	ZINC000875361941	FC	On-Demand	Anodyne	EPHX2	24	53
C[C@@H](NC(=O)NC1CCN(S(=O)(=O)C2CC2)CC1)c1ccccc1O	ZINC000875362022	FD	On-Demand	Clean	EPHX2	38	47
C[C@H](NC(=O)NC1CCN(S(=O)(=O)C2CC2)CC1)c1ccccc1O	ZINC000875362023	FD	On-Demand	Clean	EPHX2	38	47
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)C1=CCN(C)CC1	ZINC000875362036	FF	On-Demand	Anodyne	AMP1_PLAFQ	22	42
C[C@H]1[C@H](C)CCCN1C(=O)c1sccc1CC#N	ZINC000875362105	CG	On-Demand	Mild	TRPC6	57	41
C[C@H]1[C@H](C)CCCN1C(=O)c1sccc1CC#N	ZINC000875362105	CG	On-Demand	Mild	TRPC3	39	41
O=C(NCc1cc(O)nc2ccccc12)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875362108	GH	On-Demand	Anodyne	CPT1A	53	34
O=C(NCc1cc(O)nc2ccccc12)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875362109	GH	On-Demand	Anodyne	CPT1A	53	34
O=C(NCc1cc(O)nc2ccccc12)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875362110	GH	On-Demand	Anodyne	CPT1A	53	34
O=C(NCc1cc(O)nc2ccccc12)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875362111	GH	On-Demand	Anodyne	CPT1A	53	34
O=C(NCCN1CC[C@H](O)C1)NCc1cn(-c2ccccc2)nn1	ZINC000875362154	EC	On-Demand	Anodyne	PLD2	43	32
O=C(NCCN1CC[C@@H](O)C1)NCc1cn(-c2ccccc2)nn1	ZINC000875362155	EC	On-Demand	Anodyne	PLD2	43	32
O=C(NCc1cn(-c2ccccc2)nn1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875362202	GF	On-Demand	Anodyne	TRY1_BOVIN	40	36
O=C(NCc1cn(-c2ccccc2)nn1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875362203	GF	On-Demand	Anodyne	TRY1_BOVIN	40	36
O=C(NCc1cn(-c2ccccc2)nn1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875362204	GF	On-Demand	Anodyne	TRY1_BOVIN	40	36
O=C(NCc1cn(-c2ccccc2)nn1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875362205	GF	On-Demand	Anodyne	TRY1_BOVIN	40	36
O=C(NC[C@H]1CSCCS1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875362211	GG	On-Demand	Anodyne	SMO	34	44
O=C(NC[C@H]1CSCCS1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875362211	GG	On-Demand	Anodyne	ETHR	57	47
O=C(NC[C@@H]1CSCCS1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875362212	GG	On-Demand	Anodyne	SMO	34	44
O=C(NC[C@@H]1CSCCS1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875362212	GG	On-Demand	Anodyne	ETHR	57	47
COC(=O)CCN(C(=O)[C@@H]1CCC(=O)N1C(C)C)c1cccc(F)c1	ZINC000875362255	FE	On-Demand	Anodyne	P2RX7	15	46
C[C@H]1[C@H](C)CCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875362278	EG	On-Demand	Anodyne	ACE	37	45
C[C@H]1[C@H](C)CCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875362278	EG	On-Demand	Anodyne	FKBP1A	46	44
C[C@H]1[C@H](C)CCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875362278	EG	On-Demand	Anodyne	CELA1	30	41
C[C@H]1[C@H](C)CCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875362278	EG	On-Demand	Anodyne	ELANE	26	43
C[C@H]1[C@H](C)CCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875362278	EG	On-Demand	Anodyne	CTRA_BOVIN	65	35
C[C@H]1[C@H](C)CCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875362278	EG	On-Demand	Anodyne	CTSB	27	45
C[C@H]1[C@H](C)CCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875362278	EG	On-Demand	Anodyne	TRY1_BOVIN	54	35
C[C@H]1[C@H](C)CCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875362278	EG	On-Demand	Anodyne	CTSG	45	35
C[C@H]1[C@H](C)CCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875362278	EG	On-Demand	Anodyne	CTSK	30	48
C[C@H]1[C@H](C)CCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875362278	EG	On-Demand	Anodyne	PREP	56	46
C[C@H]1[C@H](C)CCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875362278	EG	On-Demand	Anodyne	CELA2A	53	35
C[C@H]1[C@H](C)CCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875362278	EG	On-Demand	Anodyne	LGMN	64	39
C[C@H]1[C@H](C)CCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875362278	EG	On-Demand	Anodyne	CAPN2	50	33
C[C@H]1[C@H](C)CCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875362278	EG	On-Demand	Anodyne	KLK5	40	39
C[C@H]1[C@H](C)CCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875362278	EG	On-Demand	Anodyne	NAAA	50	36
C[C@H]1[C@H](C)CCCN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875362278	EG	On-Demand	Anodyne	SLC12A5	76	40
C[C@@H]1CCCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@@H]1C	ZINC000875362280	EG	On-Demand	Anodyne	ACE	37	45
C[C@@H]1CCCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@@H]1C	ZINC000875362280	EG	On-Demand	Anodyne	FKBP1A	46	44
C[C@@H]1CCCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@@H]1C	ZINC000875362280	EG	On-Demand	Anodyne	CELA1	30	41
C[C@@H]1CCCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@@H]1C	ZINC000875362280	EG	On-Demand	Anodyne	ELANE	26	43
C[C@@H]1CCCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@@H]1C	ZINC000875362280	EG	On-Demand	Anodyne	CTRA_BOVIN	65	35
C[C@@H]1CCCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@@H]1C	ZINC000875362280	EG	On-Demand	Anodyne	CTSB	27	45
C[C@@H]1CCCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@@H]1C	ZINC000875362280	EG	On-Demand	Anodyne	TRY1_BOVIN	54	35
C[C@@H]1CCCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@@H]1C	ZINC000875362280	EG	On-Demand	Anodyne	CTSG	45	35
C[C@@H]1CCCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@@H]1C	ZINC000875362280	EG	On-Demand	Anodyne	CTSK	30	48
C[C@@H]1CCCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@@H]1C	ZINC000875362280	EG	On-Demand	Anodyne	PREP	56	46
C[C@@H]1CCCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@@H]1C	ZINC000875362280	EG	On-Demand	Anodyne	CELA2A	53	35
C[C@@H]1CCCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@@H]1C	ZINC000875362280	EG	On-Demand	Anodyne	LGMN	64	39
C[C@@H]1CCCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@@H]1C	ZINC000875362280	EG	On-Demand	Anodyne	CAPN2	50	33
C[C@@H]1CCCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@@H]1C	ZINC000875362280	EG	On-Demand	Anodyne	KLK5	40	39
C[C@@H]1CCCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@@H]1C	ZINC000875362280	EG	On-Demand	Anodyne	NAAA	50	36
C[C@@H]1CCCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@@H]1C	ZINC000875362280	EG	On-Demand	Anodyne	SLC12A5	76	40
C[C@@H]1CCCN(C(=O)C2(C)CC(F)(F)C2)[C@@H]1C	ZINC000875362286	BG	On-Demand	Anodyne	TRPC6	44	32
C[C@H]1[C@H](C)CCCN1C(=O)C1(C)CC(F)(F)C1	ZINC000875362289	BG	On-Demand	Anodyne	TRPC6	44	32
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(F)cc1CSC	ZINC000875362355	FF	On-Demand	Anodyne	SLC6A3	41	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(F)cc1CSC	ZINC000875362356	FF	On-Demand	Anodyne	SLC6A3	41	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cn(-c2ccc(OC)cc2)nn1	ZINC000875362511	GD	On-Demand	Anodyne	SLC6A4	20	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cn(-c2ccc(OC)cc2)nn1	ZINC000875362511	GD	On-Demand	Anodyne	SLC6A3	37	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cn(-c2ccc(OC)cc2)nn1	ZINC000875362511	GD	On-Demand	Anodyne	FIMH	21	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cn(-c2ccc(OC)cc2)nn1	ZINC000875362512	GD	On-Demand	Anodyne	SLC6A4	20	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cn(-c2ccc(OC)cc2)nn1	ZINC000875362512	GD	On-Demand	Anodyne	SLC6A3	37	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cn(-c2ccc(OC)cc2)nn1	ZINC000875362512	GD	On-Demand	Anodyne	FIMH	21	41
Cc1ccccc1[C@H](C)NC(=O)/C=C\c1ccccc1F	ZINC000875362529	CI	On-Demand	Anodyne	KCNQ2	68	52
Cc1ccccc1[C@H](C)NC(=O)/C=C\c1ccccc1F	ZINC000875362529	CI	On-Demand	Anodyne	UL26	83	40
Cc1ccccc1[C@H](C)NC(=O)/C=C\c1ccccc1F	ZINC000875362529	CI	On-Demand	Anodyne	SCAF_EBVB9	75	40
Cc1ccccc1[C@H](C)NC(=O)/C=C\c1ccccc1F	ZINC000875362529	CI	On-Demand	Anodyne	CTSA	59	38
Cc1ccccc1[C@@H](C)NC(=O)/C=C\c1ccccc1F	ZINC000875362530	CI	On-Demand	Anodyne	KCNQ2	68	52
Cc1ccccc1[C@@H](C)NC(=O)/C=C\c1ccccc1F	ZINC000875362530	CI	On-Demand	Anodyne	UL26	83	40
Cc1ccccc1[C@@H](C)NC(=O)/C=C\c1ccccc1F	ZINC000875362530	CI	On-Demand	Anodyne	SCAF_EBVB9	75	40
Cc1ccccc1[C@@H](C)NC(=O)/C=C\c1ccccc1F	ZINC000875362530	CI	On-Demand	Anodyne	CTSA	59	38
CCCCCCCNC(=O)C(=O)NCC1C[C@H](C)O[C@@H](C)C1	ZINC000875362628	DE	On-Demand	Mild	ASAH1	53	33
CCCCCCCNC(=O)C(=O)NC[C@H]1C[C@H](C)O[C@H](C)C1	ZINC000875362629	DE	On-Demand	Mild	ASAH1	53	33
CCCCCCCNC(=O)C(=O)NCC1C[C@@H](C)O[C@H](C)C1	ZINC000875362630	DE	On-Demand	Mild	ASAH1	53	33
O=C(NCc1cn(-c2ccccc2)nn1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875362723	FF	On-Demand	Anodyne	EPHX2	22	42
O=C(NCc1cn(-c2ccccc2)nn1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875362724	FF	On-Demand	Anodyne	EPHX2	22	42
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(F)cc1CSC	ZINC000875362868	GG	On-Demand	Anodyne	ACKR3	58	33
COc1ccc(-n2cc(CNC(=O)N3[C@H]4CC[C@H]3CC(CCO)C4)nn2)cc1	ZINC000875362899	GE	On-Demand	Anodyne	FIMH	21	41
Cc1cc(F)ccc1CCNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875362942	ED	On-Demand	Anodyne	CCR3	44	43
Cc1cc(F)ccc1CCNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875362942	ED	On-Demand	Anodyne	MCHR1	15	41
C[C@H]1C[C@H](CNC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C[C@@H](C)O1	ZINC000875363005	FE	On-Demand	Anodyne	OXTR	64	40
C[C@@H]1CC(CNC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C[C@@H](C)O1	ZINC000875363006	FE	On-Demand	Anodyne	OXTR	64	40
C[C@H]1C[C@H](CNC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C[C@@H](C)O1	ZINC000875363007	FE	On-Demand	Anodyne	OXTR	64	40
C[C@@H]1CC(CNC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C[C@@H](C)O1	ZINC000875363008	FE	On-Demand	Anodyne	OXTR	64	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cn(-c2ccccc2)nn1	ZINC000875363074	FD	On-Demand	Anodyne	SLC6A3	49	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cn(-c2ccccc2)nn1	ZINC000875363075	FD	On-Demand	Anodyne	SLC6A3	49	39
O=C(NCc1cn(-c2ccccc2)nn1)N(C1CC1)C1CC1	ZINC000875363095	CE	On-Demand	Anodyne	AROQ	27	41
O=C(NC[C@@H]1CSCCS1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875363152	FD	On-Demand	Anodyne	ETHR	48	34
O=C(NC[C@H]1CSCCS1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875363153	FD	On-Demand	Anodyne	ETHR	48	34
O=C(NC[C@H]1CSCCS1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875363154	FD	On-Demand	Anodyne	ETHR	48	34
O=C(NC[C@@H]1CSCCS1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875363155	FD	On-Demand	Anodyne	ETHR	48	34
CCCCCCCNC(=O)C(=O)NC1CC(N2CCC(C(F)(F)F)CC2)C1	ZINC000875363186	GF	On-Demand	Mild	ASAH1	59	32
COc1ccc(-n2cc(CNC(=O)N3CC[C@@H](C(C)(C)O)C3)nn2)cc1	ZINC000875363347	FD	On-Demand	Anodyne	FIMH	25	41
COc1ccc(-n2cc(CNC(=O)N3CC[C@H](C(C)(C)O)C3)nn2)cc1	ZINC000875363348	FD	On-Demand	Anodyne	FIMH	25	41
CCc1noc(CC)c1CNC(=O)N(CC)[C@H](C)[C@@H](O)c1ccccc1	ZINC000875363456	FG	On-Demand	Anodyne	NPY5R	20	40
CCc1noc(CC)c1CNC(=O)N(CC)[C@@H](C)[C@@H](O)c1ccccc1	ZINC000875363457	FG	On-Demand	Anodyne	NPY5R	20	40
CCc1noc(CC)c1CNC(=O)N(CC)[C@H](C)[C@H](O)c1ccccc1	ZINC000875363458	FG	On-Demand	Anodyne	NPY5R	20	40
CCc1noc(CC)c1CNC(=O)N(CC)[C@@H](C)[C@H](O)c1ccccc1	ZINC000875363459	FG	On-Demand	Anodyne	NPY5R	20	40
O=C(NCc1cn(-c2ccccc2)nn1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875363479	DE	On-Demand	Anodyne	AROQ	28	41
O=C(NCc1cn(-c2ccccc2)nn1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875363480	DE	On-Demand	Anodyne	AROQ	28	41
O=C(NCc1cn(-c2ccccc2)nn1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875363481	DE	On-Demand	Anodyne	AROQ	28	41
O=C(NCc1cn(-c2ccccc2)nn1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875363482	DE	On-Demand	Anodyne	AROQ	28	41
O=C(NCc1nc(-c2ccncc2)cs1)NC[C@@H]1CSCCS1	ZINC000875363495	FF	On-Demand	Anodyne	ROCK1	22	43
O=C(NCc1nc(-c2ccncc2)cs1)NC[C@@H]1CSCCS1	ZINC000875363495	FF	On-Demand	Anodyne	ROCK2	15	43
O=C(NCc1nc(-c2ccncc2)cs1)NC[C@H]1CSCCS1	ZINC000875363496	FF	On-Demand	Anodyne	ROCK1	22	43
O=C(NCc1nc(-c2ccncc2)cs1)NC[C@H]1CSCCS1	ZINC000875363496	FF	On-Demand	Anodyne	ROCK2	15	43
COCCN(CC1CCN(C)CC1)C(=O)NCCc1ccc(F)cc1C	ZINC000875363503	FF	On-Demand	Anodyne	ACKR3	59	34
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccc(F)cc1C	ZINC000875363568	EE	On-Demand	Anodyne	SLC6A4	19	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccc(F)cc1C	ZINC000875363568	EE	On-Demand	Anodyne	SLC6A3	38	40
C[C@@]1(CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CCCO1	ZINC000875363611	EE	On-Demand	Mild	ITK	17	48
C[C@@]1(CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CCCO1	ZINC000875363611	EE	On-Demand	Mild	PANC	41	35
C[C@H]1CC(CNC(=O)C(=O)N2CCN(c3ccc(F)cc3F)CC2)C[C@H](C)O1	ZINC000875363621	GD	On-Demand	Anodyne	NPY2R	42	34
C[C@H]1C[C@H](CNC(=O)C(=O)N2CCN(c3ccc(F)cc3F)CC2)C[C@@H](C)O1	ZINC000875363622	GD	On-Demand	Anodyne	NPY2R	42	34
C[C@@H]1CC(CNC(=O)C(=O)N2CCN(c3ccc(F)cc3F)CC2)C[C@@H](C)O1	ZINC000875363623	GD	On-Demand	Anodyne	NPY2R	42	34
N#Cc1ccc(Cn2cc(NC(=O)NC[C@H]3CSCCS3)cn2)cc1	ZINC000875363683	FF	On-Demand	Mild	PANC	41	35
N#Cc1ccc(Cn2cc(NC(=O)NC[C@@H]3CSCCS3)cn2)cc1	ZINC000875363684	FF	On-Demand	Mild	PANC	41	35
Cc1cc(F)ccc1CCNC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875363737	FD	On-Demand	Anodyne	EPHX2	28	45
O=C(NCc1cn(-c2ccccc2)nn1)NCC1CC(O)C1	ZINC000875363749	DC	On-Demand	Anodyne	AROQ	28	42
O=C(NCc1cn(-c2ccccc2)nn1)NC[C@@H]1C[C@H](O)C1	ZINC000875363750	DC	On-Demand	Anodyne	AROQ	28	42
O=C(NCc1cn(-c2ccccc2)nn1)NC[C@H]1C[C@H](O)C1	ZINC000875363751	DC	On-Demand	Anodyne	AROQ	28	42
COc1c(CNC(=O)C(=O)N2CCC[C@H]2c2cncc(C)c2)oc2ccccc12	ZINC000875363785	GG	On-Demand	Anodyne	SSTR5	19	40
COc1c(CNC(=O)C(=O)N2CCC[C@@H]2c2cncc(C)c2)oc2ccccc12	ZINC000875363786	GG	On-Demand	Anodyne	SSTR5	19	40
c1ccc2c(c1)C[C@H](CNc1nc3ccccc3[nH]1)CO2	ZINC000875363902	CG	On-Demand	Anodyne	KCNN3	40	44
c1ccc2c(c1)C[C@H](CNc1nc3ccccc3[nH]1)CO2	ZINC000875363902	CG	On-Demand	Anodyne	ROCK2	15	44
c1ccc2c(c1)C[C@@H](CNc1nc3ccccc3[nH]1)CO2	ZINC000875363903	CG	On-Demand	Anodyne	KCNN3	40	44
c1ccc2c(c1)C[C@@H](CNc1nc3ccccc3[nH]1)CO2	ZINC000875363903	CG	On-Demand	Anodyne	ROCK2	15	44
COc1cc(CN2CC[C@@H](NC(=O)N3CC[C@H](C(C)(C)O)C3)C2)cc(OC)c1	ZINC000875364041	GE	On-Demand	Anodyne	DRD4	26	45
COc1cc(CN2CC[C@@H](NC(=O)N3CC[C@H](C(C)(C)O)C3)C2)cc(OC)c1	ZINC000875364041	GE	On-Demand	Anodyne	SIGMAR1	17	45
COc1cc(CN2CC[C@@H](NC(=O)N3CC[C@H](C(C)(C)O)C3)C2)cc(OC)c1	ZINC000875364041	GE	On-Demand	Anodyne	SSTR5	57	34
COc1cc(CN2CC[C@@H](NC(=O)N3CC[C@H](C(C)(C)O)C3)C2)cc(OC)c1	ZINC000875364041	GE	On-Demand	Anodyne	CCR3	32	44
COc1cc(CN2CC[C@@H](NC(=O)N3CC[C@H](C(C)(C)O)C3)C2)cc(OC)c1	ZINC000875364041	GE	On-Demand	Anodyne	UTS2R	20	41
COc1cc(CN2CC[C@@H](NC(=O)N3CC[C@H](C(C)(C)O)C3)C2)cc(OC)c1	ZINC000875364041	GE	On-Demand	Anodyne	CCR2	16	43
COc1cc(CN2CC[C@@H](NC(=O)N3CC[C@H](C(C)(C)O)C3)C2)cc(OC)c1	ZINC000875364041	GE	On-Demand	Anodyne	MCHR1	28	52
COc1cc(CN2CC[C@@H](NC(=O)N3CC[C@@H](C(C)(C)O)C3)C2)cc(OC)c1	ZINC000875364042	GE	On-Demand	Anodyne	DRD4	26	45
COc1cc(CN2CC[C@@H](NC(=O)N3CC[C@@H](C(C)(C)O)C3)C2)cc(OC)c1	ZINC000875364042	GE	On-Demand	Anodyne	SIGMAR1	17	45
COc1cc(CN2CC[C@@H](NC(=O)N3CC[C@@H](C(C)(C)O)C3)C2)cc(OC)c1	ZINC000875364042	GE	On-Demand	Anodyne	SSTR5	57	34
COc1cc(CN2CC[C@@H](NC(=O)N3CC[C@@H](C(C)(C)O)C3)C2)cc(OC)c1	ZINC000875364042	GE	On-Demand	Anodyne	CCR3	32	44
COc1cc(CN2CC[C@@H](NC(=O)N3CC[C@@H](C(C)(C)O)C3)C2)cc(OC)c1	ZINC000875364042	GE	On-Demand	Anodyne	UTS2R	20	41
COc1cc(CN2CC[C@@H](NC(=O)N3CC[C@@H](C(C)(C)O)C3)C2)cc(OC)c1	ZINC000875364042	GE	On-Demand	Anodyne	CCR2	16	43
COc1cc(CN2CC[C@@H](NC(=O)N3CC[C@@H](C(C)(C)O)C3)C2)cc(OC)c1	ZINC000875364042	GE	On-Demand	Anodyne	MCHR1	28	52
COc1cc(CN2CC[C@H](NC(=O)N3CC[C@H](C(C)(C)O)C3)C2)cc(OC)c1	ZINC000875364043	GE	On-Demand	Anodyne	DRD4	26	45
COc1cc(CN2CC[C@H](NC(=O)N3CC[C@H](C(C)(C)O)C3)C2)cc(OC)c1	ZINC000875364043	GE	On-Demand	Anodyne	SIGMAR1	17	45
COc1cc(CN2CC[C@H](NC(=O)N3CC[C@H](C(C)(C)O)C3)C2)cc(OC)c1	ZINC000875364043	GE	On-Demand	Anodyne	SSTR5	57	34
COc1cc(CN2CC[C@H](NC(=O)N3CC[C@H](C(C)(C)O)C3)C2)cc(OC)c1	ZINC000875364043	GE	On-Demand	Anodyne	CCR3	32	44
COc1cc(CN2CC[C@H](NC(=O)N3CC[C@H](C(C)(C)O)C3)C2)cc(OC)c1	ZINC000875364043	GE	On-Demand	Anodyne	UTS2R	20	41
COc1cc(CN2CC[C@H](NC(=O)N3CC[C@H](C(C)(C)O)C3)C2)cc(OC)c1	ZINC000875364043	GE	On-Demand	Anodyne	CCR2	16	43
COc1cc(CN2CC[C@H](NC(=O)N3CC[C@H](C(C)(C)O)C3)C2)cc(OC)c1	ZINC000875364043	GE	On-Demand	Anodyne	MCHR1	28	52
COc1cc(CN2CC[C@H](NC(=O)N3CC[C@@H](C(C)(C)O)C3)C2)cc(OC)c1	ZINC000875364044	GE	On-Demand	Anodyne	DRD4	26	45
COc1cc(CN2CC[C@H](NC(=O)N3CC[C@@H](C(C)(C)O)C3)C2)cc(OC)c1	ZINC000875364044	GE	On-Demand	Anodyne	SIGMAR1	17	45
COc1cc(CN2CC[C@H](NC(=O)N3CC[C@@H](C(C)(C)O)C3)C2)cc(OC)c1	ZINC000875364044	GE	On-Demand	Anodyne	SSTR5	57	34
COc1cc(CN2CC[C@H](NC(=O)N3CC[C@@H](C(C)(C)O)C3)C2)cc(OC)c1	ZINC000875364044	GE	On-Demand	Anodyne	CCR3	32	44
COc1cc(CN2CC[C@H](NC(=O)N3CC[C@@H](C(C)(C)O)C3)C2)cc(OC)c1	ZINC000875364044	GE	On-Demand	Anodyne	UTS2R	20	41
COc1cc(CN2CC[C@H](NC(=O)N3CC[C@@H](C(C)(C)O)C3)C2)cc(OC)c1	ZINC000875364044	GE	On-Demand	Anodyne	CCR2	16	43
COc1cc(CN2CC[C@H](NC(=O)N3CC[C@@H](C(C)(C)O)C3)C2)cc(OC)c1	ZINC000875364044	GE	On-Demand	Anodyne	MCHR1	28	52
COc1cc(CN2CC[C@H](NC(=O)NNc3cccc(C)n3)C2)cc(OC)c1	ZINC000875364062	GE	On-Demand	Reactive	DRD4	33	46
COc1cc(CN2CC[C@H](NC(=O)NNc3cccc(C)n3)C2)cc(OC)c1	ZINC000875364062	GE	On-Demand	Reactive	SIGMAR1	21	46
COc1cc(CN2CC[C@H](NC(=O)NNc3cccc(C)n3)C2)cc(OC)c1	ZINC000875364062	GE	On-Demand	Reactive	SSTR5	65	35
COc1cc(CN2CC[C@H](NC(=O)NNc3cccc(C)n3)C2)cc(OC)c1	ZINC000875364062	GE	On-Demand	Reactive	CCR3	42	46
COc1cc(CN2CC[C@H](NC(=O)NNc3cccc(C)n3)C2)cc(OC)c1	ZINC000875364062	GE	On-Demand	Reactive	UTS2R	21	42
COc1cc(CN2CC[C@H](NC(=O)NNc3cccc(C)n3)C2)cc(OC)c1	ZINC000875364062	GE	On-Demand	Reactive	CCR2	17	44
COc1cc(CN2CC[C@H](NC(=O)NNc3cccc(C)n3)C2)cc(OC)c1	ZINC000875364062	GE	On-Demand	Reactive	PDK1	42	36
COc1cc(CN2CC[C@H](NC(=O)NNc3cccc(C)n3)C2)cc(OC)c1	ZINC000875364062	GE	On-Demand	Reactive	MCHR1	33	53
COc1cc(CN2CC[C@H](NC(=O)NNc3cccc(C)n3)C2)cc(OC)c1	ZINC000875364062	GE	On-Demand	Reactive	CCR8	16	41
COc1cc(CN2CC[C@@H](NC(=O)NNc3cccc(C)n3)C2)cc(OC)c1	ZINC000875364063	GE	On-Demand	Reactive	DRD4	33	46
COc1cc(CN2CC[C@@H](NC(=O)NNc3cccc(C)n3)C2)cc(OC)c1	ZINC000875364063	GE	On-Demand	Reactive	SIGMAR1	21	46
COc1cc(CN2CC[C@@H](NC(=O)NNc3cccc(C)n3)C2)cc(OC)c1	ZINC000875364063	GE	On-Demand	Reactive	SSTR5	65	35
COc1cc(CN2CC[C@@H](NC(=O)NNc3cccc(C)n3)C2)cc(OC)c1	ZINC000875364063	GE	On-Demand	Reactive	CCR3	42	46
COc1cc(CN2CC[C@@H](NC(=O)NNc3cccc(C)n3)C2)cc(OC)c1	ZINC000875364063	GE	On-Demand	Reactive	UTS2R	21	42
COc1cc(CN2CC[C@@H](NC(=O)NNc3cccc(C)n3)C2)cc(OC)c1	ZINC000875364063	GE	On-Demand	Reactive	CCR2	17	44
COc1cc(CN2CC[C@@H](NC(=O)NNc3cccc(C)n3)C2)cc(OC)c1	ZINC000875364063	GE	On-Demand	Reactive	PDK1	42	36
COc1cc(CN2CC[C@@H](NC(=O)NNc3cccc(C)n3)C2)cc(OC)c1	ZINC000875364063	GE	On-Demand	Reactive	MCHR1	33	53
COc1cc(CN2CC[C@@H](NC(=O)NNc3cccc(C)n3)C2)cc(OC)c1	ZINC000875364063	GE	On-Demand	Reactive	CCR8	16	41
O=C(NCCC1CCC1)NCC[C@@H](O)COCc1ccccc1	ZINC000875364064	DE	On-Demand	Anodyne	CTSS	23	40
CC(=O)C1CCN(C(=O)N[C@H]2CCN(c3c(F)cccc3F)C2)CC1	ZINC000875364067	FF	On-Demand	Anodyne	EPHX2	22	40
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(c3c(F)cccc3F)C2)CC1	ZINC000875364068	FF	On-Demand	Anodyne	EPHX2	22	40
O=C(NCCC1CCC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875364116	DF	On-Demand	Anodyne	EPHX2	20	47
O=C(NCCC1CCC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875364117	DF	On-Demand	Anodyne	EPHX2	20	47
C[C@@]1(CNC(=O)NNC(=O)COc2ccccc2Br)CCCO1	ZINC000875364132	GD	On-Demand	Reactive	HCN1	52	33
C[C@@]1(CNC(=O)NNC(=O)COc2ccccc2Br)CCCO1	ZINC000875364132	GD	On-Demand	Reactive	HCN4	48	33
CCOC(=O)c1cc(F)c(F)cc1NC(=O)CN1CCCCC(=O)C1=O	ZINC000875364254	FD	On-Demand	Anodyne	Q9FYV8_MAIZE	32	42
COCCOc1cc(C)ccc1CNC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875364256	GE	On-Demand	Anodyne	SLC6A3	43	38
COCCOc1cc(C)ccc1CNC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875364257	GE	On-Demand	Anodyne	SLC6A3	43	38
CCCCCCCCCCNC(=O)N1CCCN(C=O)CC1	ZINC000875364283	DG	On-Demand	Mild	ASAH1	98	37
O=C([C@@H](Cc1cccnc1)C1CCCC1)N1CCSc2ncccc21	ZINC000875364305	FH	On-Demand	Anodyne	C3AR1	44	43
O=C([C@H](Cc1cccnc1)C1CCCC1)N1CCSc2ncccc21	ZINC000875364306	FH	On-Demand	Anodyne	C3AR1	44	43
CCOC(=O)c1cc(F)c(F)cc1NC(=O)[C@@H]1CCC(=O)N1C(C)C	ZINC000875364313	FE	On-Demand	Anodyne	P2RX7	21	49
COc1cc(CN2CC[C@H](NC(=O)N3CCCN(C=O)CC3)C2)cc(OC)c1	ZINC000875364324	GD	On-Demand	Anodyne	DRD4	25	43
COc1cc(CN2CC[C@H](NC(=O)N3CCCN(C=O)CC3)C2)cc(OC)c1	ZINC000875364324	GD	On-Demand	Anodyne	SIGMAR1	20	45
COc1cc(CN2CC[C@H](NC(=O)N3CCCN(C=O)CC3)C2)cc(OC)c1	ZINC000875364324	GD	On-Demand	Anodyne	SSTR5	47	34
COc1cc(CN2CC[C@H](NC(=O)N3CCCN(C=O)CC3)C2)cc(OC)c1	ZINC000875364324	GD	On-Demand	Anodyne	CCR3	33	46
COc1cc(CN2CC[C@H](NC(=O)N3CCCN(C=O)CC3)C2)cc(OC)c1	ZINC000875364324	GD	On-Demand	Anodyne	CCR2	15	40
COc1cc(CN2CC[C@H](NC(=O)N3CCCN(C=O)CC3)C2)cc(OC)c1	ZINC000875364324	GD	On-Demand	Anodyne	PDK1	40	35
COc1cc(CN2CC[C@H](NC(=O)N3CCCN(C=O)CC3)C2)cc(OC)c1	ZINC000875364324	GD	On-Demand	Anodyne	MCHR1	23	52
COc1cc(CN2CC[C@@H](NC(=O)N3CCCN(C=O)CC3)C2)cc(OC)c1	ZINC000875364325	GD	On-Demand	Anodyne	DRD4	25	43
COc1cc(CN2CC[C@@H](NC(=O)N3CCCN(C=O)CC3)C2)cc(OC)c1	ZINC000875364325	GD	On-Demand	Anodyne	SIGMAR1	20	45
COc1cc(CN2CC[C@@H](NC(=O)N3CCCN(C=O)CC3)C2)cc(OC)c1	ZINC000875364325	GD	On-Demand	Anodyne	SSTR5	47	34
COc1cc(CN2CC[C@@H](NC(=O)N3CCCN(C=O)CC3)C2)cc(OC)c1	ZINC000875364325	GD	On-Demand	Anodyne	CCR3	33	46
COc1cc(CN2CC[C@@H](NC(=O)N3CCCN(C=O)CC3)C2)cc(OC)c1	ZINC000875364325	GD	On-Demand	Anodyne	CCR2	15	40
COc1cc(CN2CC[C@@H](NC(=O)N3CCCN(C=O)CC3)C2)cc(OC)c1	ZINC000875364325	GD	On-Demand	Anodyne	PDK1	40	35
COc1cc(CN2CC[C@@H](NC(=O)N3CCCN(C=O)CC3)C2)cc(OC)c1	ZINC000875364325	GD	On-Demand	Anodyne	MCHR1	23	52
COC(=O)c1cnc(C2CCN(C(=O)NCCC3CCC3)CC2)s1	ZINC000875364329	FG	On-Demand	Anodyne	SIRT3	55	36
COC(=O)c1cnc(C2CCN(C(=O)NCCC3CCC3)CC2)s1	ZINC000875364329	FG	On-Demand	Anodyne	SIRT2	54	36
COC(=O)c1cnc(C2CCN(C(=O)NCCC3CCC3)CC2)s1	ZINC000875364329	FG	On-Demand	Anodyne	SIRT1	53	36
COc1cc(CN2CC[C@H](NC(=O)NN=c3cc[nH]c(C)c3)C2)cc(OC)c1	ZINC000875364354	GD	On-Demand	Reactive	DRD4	24	48
COc1cc(CN2CC[C@H](NC(=O)NN=c3cc[nH]c(C)c3)C2)cc(OC)c1	ZINC000875364354	GD	On-Demand	Reactive	CCR3	32	41
COc1cc(CN2CC[C@H](NC(=O)NN=c3cc[nH]c(C)c3)C2)cc(OC)c1	ZINC000875364354	GD	On-Demand	Reactive	MCHR1	21	49
COc1cc(CN2CC[C@@H](NC(=O)NN=c3cc[nH]c(C)c3)C2)cc(OC)c1	ZINC000875364355	GD	On-Demand	Reactive	DRD4	24	48
COc1cc(CN2CC[C@@H](NC(=O)NN=c3cc[nH]c(C)c3)C2)cc(OC)c1	ZINC000875364355	GD	On-Demand	Reactive	CCR3	32	41
COc1cc(CN2CC[C@@H](NC(=O)NN=c3cc[nH]c(C)c3)C2)cc(OC)c1	ZINC000875364355	GD	On-Demand	Reactive	MCHR1	21	49
CCCCCCCCCCNC(=O)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875364383	DH	On-Demand	Mild	GBA	17	40
CCCCCCCCCCNC(=O)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875364383	DH	On-Demand	Mild	EPHX2	20	44
CCCCCCCCCCNC(=O)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875364383	DH	On-Demand	Mild	ASAH1	104	42
CCCCCCCCCCNC(=O)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875364384	DH	On-Demand	Mild	GBA	17	40
CCCCCCCCCCNC(=O)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875364384	DH	On-Demand	Mild	EPHX2	20	44
CCCCCCCCCCNC(=O)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875364384	DH	On-Demand	Mild	ASAH1	104	42
CCCCCCCCCCNC(=O)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875364389	EH	On-Demand	Mild	ASAH1	109	45
CCCCCCCCCCNC(=O)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875364390	EH	On-Demand	Mild	ASAH1	109	45
COC[C@H](NC(=O)C(C)(C)c1cccc(OC)c1)C(C)C	ZINC000875364407	CF	On-Demand	Anodyne	MTNR1A	34	44
COC[C@H](NC(=O)C(C)(C)c1cccc(OC)c1)C(C)C	ZINC000875364407	CF	On-Demand	Anodyne	MTNR1B	34	44
COC[C@H](NC(=O)C(C)(C)c1cccc(OC)c1)C(C)C	ZINC000875364407	CF	On-Demand	Anodyne	PDS	40	34
COC[C@@H](NC(=O)C(C)(C)c1cccc(OC)c1)C(C)C	ZINC000875364408	CF	On-Demand	Anodyne	MTNR1A	34	44
COC[C@@H](NC(=O)C(C)(C)c1cccc(OC)c1)C(C)C	ZINC000875364408	CF	On-Demand	Anodyne	MTNR1B	34	44
COC[C@@H](NC(=O)C(C)(C)c1cccc(OC)c1)C(C)C	ZINC000875364408	CF	On-Demand	Anodyne	PDS	40	34
COCCOc1cc(C)ccc1CNC(=O)NNc1cccc(C)n1	ZINC000875364464	EF	On-Demand	Reactive	GRM5	15	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCSc2ncccc21	ZINC000875364466	FF	On-Demand	Anodyne	GHRHR	40	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCSc2ncccc21	ZINC000875364466	FF	On-Demand	Anodyne	MME	41	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCSc2ncccc21	ZINC000875364466	FF	On-Demand	Anodyne	CTSB	40	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCSc2ncccc21	ZINC000875364466	FF	On-Demand	Anodyne	TRY2_BOVIN	53	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCSc2ncccc21	ZINC000875364466	FF	On-Demand	Anodyne	PAPA1_CARPA	47	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCSc2ncccc21	ZINC000875364466	FF	On-Demand	Anodyne	CYSP_TRYCR	63	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCSc2ncccc21	ZINC000875364466	FF	On-Demand	Anodyne	TIMP3	71	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCSc2ncccc21	ZINC000875364466	FF	On-Demand	Anodyne	CAPNS1	75	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCSc2ncccc21	ZINC000875364466	FF	On-Demand	Anodyne	HLA-DRB1	70	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCSc2ncccc21	ZINC000875364466	FF	On-Demand	Anodyne	CELA2A	51	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCSc2ncccc21	ZINC000875364466	FF	On-Demand	Anodyne	CAPN1	76	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCSc2ncccc21	ZINC000875364466	FF	On-Demand	Anodyne	CAPN2	93	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCSc2ncccc21	ZINC000875364466	FF	On-Demand	Anodyne	ACE2	63	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCSc2ncccc21	ZINC000875364466	FF	On-Demand	Anodyne	TGM2	20	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCSc2ncccc21	ZINC000875364466	FF	On-Demand	Anodyne	CTRB_BOVIN	47	38
CC(C)(C)OC(=O)N1CC[C@H]([C@@H](F)C(=O)N2CCSc3ncccc32)C1	ZINC000875364474	GG	On-Demand	Anodyne	GPR119	43	41
CC(C)(C)OC(=O)N1CC[C@H]([C@H](F)C(=O)N2CCSc3ncccc32)C1	ZINC000875364475	GG	On-Demand	Anodyne	GPR119	43	41
CC(C)(C)OC(=O)N1CC[C@@H]([C@H](F)C(=O)N2CCSc3ncccc32)C1	ZINC000875364476	GG	On-Demand	Anodyne	GPR119	43	41
CC(C)(C)OC(=O)N1CC[C@@H]([C@@H](F)C(=O)N2CCSc3ncccc32)C1	ZINC000875364477	GG	On-Demand	Anodyne	GPR119	43	41
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2cc(OC)cc(OC)c2)C1	ZINC000875364499	FD	On-Demand	Reactive	DRD4	28	45
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2cc(OC)cc(OC)c2)C1	ZINC000875364499	FD	On-Demand	Reactive	SIGMAR1	20	48
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2cc(OC)cc(OC)c2)C1	ZINC000875364499	FD	On-Demand	Reactive	SSTR5	42	33
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2cc(OC)cc(OC)c2)C1	ZINC000875364499	FD	On-Demand	Reactive	CCR3	33	44
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2cc(OC)cc(OC)c2)C1	ZINC000875364499	FD	On-Demand	Reactive	UTS2R	21	43
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2cc(OC)cc(OC)c2)C1	ZINC000875364499	FD	On-Demand	Reactive	MCHR1	31	55
COC(=O)N(C)NC(=O)N[C@@H]1CCN(Cc2cc(OC)cc(OC)c2)C1	ZINC000875364499	FD	On-Demand	Reactive	CCR8	19	41
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2cc(OC)cc(OC)c2)C1	ZINC000875364500	FD	On-Demand	Reactive	DRD4	28	45
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2cc(OC)cc(OC)c2)C1	ZINC000875364500	FD	On-Demand	Reactive	SIGMAR1	20	48
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2cc(OC)cc(OC)c2)C1	ZINC000875364500	FD	On-Demand	Reactive	SSTR5	42	33
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2cc(OC)cc(OC)c2)C1	ZINC000875364500	FD	On-Demand	Reactive	CCR3	33	44
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2cc(OC)cc(OC)c2)C1	ZINC000875364500	FD	On-Demand	Reactive	UTS2R	21	43
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2cc(OC)cc(OC)c2)C1	ZINC000875364500	FD	On-Demand	Reactive	MCHR1	31	55
COC(=O)N(C)NC(=O)N[C@H]1CCN(Cc2cc(OC)cc(OC)c2)C1	ZINC000875364500	FD	On-Demand	Reactive	CCR8	19	41
COc1cc(CN2CC[C@@H](NC(=O)N3CCC(C(C)=O)CC3)C2)cc(OC)c1	ZINC000875364517	GE	On-Demand	Anodyne	DRD4	26	48
COc1cc(CN2CC[C@@H](NC(=O)N3CCC(C(C)=O)CC3)C2)cc(OC)c1	ZINC000875364517	GE	On-Demand	Anodyne	SIGMAR1	21	46
COc1cc(CN2CC[C@@H](NC(=O)N3CCC(C(C)=O)CC3)C2)cc(OC)c1	ZINC000875364517	GE	On-Demand	Anodyne	SSTR5	42	33
COc1cc(CN2CC[C@@H](NC(=O)N3CCC(C(C)=O)CC3)C2)cc(OC)c1	ZINC000875364517	GE	On-Demand	Anodyne	CCR3	35	45
COc1cc(CN2CC[C@@H](NC(=O)N3CCC(C(C)=O)CC3)C2)cc(OC)c1	ZINC000875364517	GE	On-Demand	Anodyne	UTS2R	19	42
COc1cc(CN2CC[C@@H](NC(=O)N3CCC(C(C)=O)CC3)C2)cc(OC)c1	ZINC000875364517	GE	On-Demand	Anodyne	CCR2	15	42
COc1cc(CN2CC[C@@H](NC(=O)N3CCC(C(C)=O)CC3)C2)cc(OC)c1	ZINC000875364517	GE	On-Demand	Anodyne	PDK1	40	35
COc1cc(CN2CC[C@@H](NC(=O)N3CCC(C(C)=O)CC3)C2)cc(OC)c1	ZINC000875364517	GE	On-Demand	Anodyne	MCHR1	25	53
COc1cc(CN2CC[C@H](NC(=O)N3CCC(C(C)=O)CC3)C2)cc(OC)c1	ZINC000875364518	GE	On-Demand	Anodyne	DRD4	26	48
COc1cc(CN2CC[C@H](NC(=O)N3CCC(C(C)=O)CC3)C2)cc(OC)c1	ZINC000875364518	GE	On-Demand	Anodyne	SIGMAR1	21	46
COc1cc(CN2CC[C@H](NC(=O)N3CCC(C(C)=O)CC3)C2)cc(OC)c1	ZINC000875364518	GE	On-Demand	Anodyne	SSTR5	42	33
COc1cc(CN2CC[C@H](NC(=O)N3CCC(C(C)=O)CC3)C2)cc(OC)c1	ZINC000875364518	GE	On-Demand	Anodyne	CCR3	35	45
COc1cc(CN2CC[C@H](NC(=O)N3CCC(C(C)=O)CC3)C2)cc(OC)c1	ZINC000875364518	GE	On-Demand	Anodyne	UTS2R	19	42
COc1cc(CN2CC[C@H](NC(=O)N3CCC(C(C)=O)CC3)C2)cc(OC)c1	ZINC000875364518	GE	On-Demand	Anodyne	CCR2	15	42
COc1cc(CN2CC[C@H](NC(=O)N3CCC(C(C)=O)CC3)C2)cc(OC)c1	ZINC000875364518	GE	On-Demand	Anodyne	PDK1	40	35
COc1cc(CN2CC[C@H](NC(=O)N3CCC(C(C)=O)CC3)C2)cc(OC)c1	ZINC000875364518	GE	On-Demand	Anodyne	MCHR1	25	53
CONC(=O)C1CCN(C(=O)N[C@@H]2CCN(c3c(F)cccc3F)C2)CC1	ZINC000875364526	GD	On-Demand	Anodyne	EPHX2	19	40
CONC(=O)C1CCN(C(=O)N[C@H]2CCN(c3c(F)cccc3F)C2)CC1	ZINC000875364527	GD	On-Demand	Anodyne	EPHX2	19	40
COc1cc(CN2CC[C@@H](NC(=O)N[C@@H]3CCOC[C@H]3O)C2)cc(OC)c1	ZINC000875364571	GC	On-Demand	Anodyne	DRD4	26	45
COc1cc(CN2CC[C@@H](NC(=O)N[C@@H]3CCOC[C@H]3O)C2)cc(OC)c1	ZINC000875364571	GC	On-Demand	Anodyne	SIGMAR1	17	45
COc1cc(CN2CC[C@@H](NC(=O)N[C@@H]3CCOC[C@H]3O)C2)cc(OC)c1	ZINC000875364571	GC	On-Demand	Anodyne	CCR3	28	43
COc1cc(CN2CC[C@@H](NC(=O)N[C@@H]3CCOC[C@H]3O)C2)cc(OC)c1	ZINC000875364571	GC	On-Demand	Anodyne	MCHR1	25	49
COCCOc1cc(C)ccc1CNC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875364580	GH	On-Demand	Anodyne	EPHX2	19	44
COCCOc1cc(C)ccc1CNC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875364581	GH	On-Demand	Anodyne	EPHX2	19	44
O=C(NCCC1CCC1)NCCC1(O)CCN(c2ccccc2)CC1	ZINC000875364601	EF	On-Demand	Anodyne	ADAM10	32	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(Cc2cc(OC)cc(OC)c2)C1	ZINC000875364639	GE	On-Demand	Anodyne	DRD4	20	42
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(Cc2cc(OC)cc(OC)c2)C1	ZINC000875364639	GE	On-Demand	Anodyne	CCR3	24	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(Cc2cc(OC)cc(OC)c2)C1	ZINC000875364639	GE	On-Demand	Anodyne	MCHR1	22	49
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(Cc2cc(OC)cc(OC)c2)C1	ZINC000875364640	GE	On-Demand	Anodyne	DRD4	20	42
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(Cc2cc(OC)cc(OC)c2)C1	ZINC000875364640	GE	On-Demand	Anodyne	CCR3	24	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(Cc2cc(OC)cc(OC)c2)C1	ZINC000875364640	GE	On-Demand	Anodyne	MCHR1	22	49
COc1cc(CN2CC[C@H](NC(=O)N3Cc4cccc(O)c4C3)C2)cc(OC)c1	ZINC000875364666	GF	On-Demand	Clean	DRD2	15	45
COc1cc(CN2CC[C@H](NC(=O)N3Cc4cccc(O)c4C3)C2)cc(OC)c1	ZINC000875364666	GF	On-Demand	Clean	DRD4	40	49
COc1cc(CN2CC[C@H](NC(=O)N3Cc4cccc(O)c4C3)C2)cc(OC)c1	ZINC000875364666	GF	On-Demand	Clean	SIGMAR1	23	48
COc1cc(CN2CC[C@H](NC(=O)N3Cc4cccc(O)c4C3)C2)cc(OC)c1	ZINC000875364666	GF	On-Demand	Clean	SSTR5	51	35
COc1cc(CN2CC[C@H](NC(=O)N3Cc4cccc(O)c4C3)C2)cc(OC)c1	ZINC000875364666	GF	On-Demand	Clean	CCR3	41	44
COc1cc(CN2CC[C@H](NC(=O)N3Cc4cccc(O)c4C3)C2)cc(OC)c1	ZINC000875364666	GF	On-Demand	Clean	UTS2R	22	42
COc1cc(CN2CC[C@H](NC(=O)N3Cc4cccc(O)c4C3)C2)cc(OC)c1	ZINC000875364666	GF	On-Demand	Clean	CCR2	22	47
COc1cc(CN2CC[C@H](NC(=O)N3Cc4cccc(O)c4C3)C2)cc(OC)c1	ZINC000875364666	GF	On-Demand	Clean	PDK1	41	36
COc1cc(CN2CC[C@H](NC(=O)N3Cc4cccc(O)c4C3)C2)cc(OC)c1	ZINC000875364666	GF	On-Demand	Clean	MCHR1	32	55
COc1cc(CN2CC[C@H](NC(=O)N3Cc4cccc(O)c4C3)C2)cc(OC)c1	ZINC000875364666	GF	On-Demand	Clean	CCR8	19	42
COc1cc(CN2CC[C@@H](NC(=O)N3Cc4cccc(O)c4C3)C2)cc(OC)c1	ZINC000875364667	GF	On-Demand	Clean	DRD2	15	45
COc1cc(CN2CC[C@@H](NC(=O)N3Cc4cccc(O)c4C3)C2)cc(OC)c1	ZINC000875364667	GF	On-Demand	Clean	DRD4	40	49
COc1cc(CN2CC[C@@H](NC(=O)N3Cc4cccc(O)c4C3)C2)cc(OC)c1	ZINC000875364667	GF	On-Demand	Clean	SIGMAR1	23	48
COc1cc(CN2CC[C@@H](NC(=O)N3Cc4cccc(O)c4C3)C2)cc(OC)c1	ZINC000875364667	GF	On-Demand	Clean	SSTR5	51	35
COc1cc(CN2CC[C@@H](NC(=O)N3Cc4cccc(O)c4C3)C2)cc(OC)c1	ZINC000875364667	GF	On-Demand	Clean	CCR3	41	44
COc1cc(CN2CC[C@@H](NC(=O)N3Cc4cccc(O)c4C3)C2)cc(OC)c1	ZINC000875364667	GF	On-Demand	Clean	UTS2R	22	42
COc1cc(CN2CC[C@@H](NC(=O)N3Cc4cccc(O)c4C3)C2)cc(OC)c1	ZINC000875364667	GF	On-Demand	Clean	CCR2	22	47
COc1cc(CN2CC[C@@H](NC(=O)N3Cc4cccc(O)c4C3)C2)cc(OC)c1	ZINC000875364667	GF	On-Demand	Clean	PDK1	41	36
COc1cc(CN2CC[C@@H](NC(=O)N3Cc4cccc(O)c4C3)C2)cc(OC)c1	ZINC000875364667	GF	On-Demand	Clean	MCHR1	32	55
COc1cc(CN2CC[C@@H](NC(=O)N3Cc4cccc(O)c4C3)C2)cc(OC)c1	ZINC000875364667	GF	On-Demand	Clean	CCR8	19	42
COc1cc(CN2CC[C@H](NC(=O)NC3(C)CC(F)(F)C3)C2)cc(OC)c1	ZINC000875364671	GF	On-Demand	Anodyne	DRD4	23	43
COc1cc(CN2CC[C@H](NC(=O)NC3(C)CC(F)(F)C3)C2)cc(OC)c1	ZINC000875364671	GF	On-Demand	Anodyne	SIGMAR1	15	43
COc1cc(CN2CC[C@H](NC(=O)NC3(C)CC(F)(F)C3)C2)cc(OC)c1	ZINC000875364671	GF	On-Demand	Anodyne	CCR3	31	44
COc1cc(CN2CC[C@H](NC(=O)NC3(C)CC(F)(F)C3)C2)cc(OC)c1	ZINC000875364671	GF	On-Demand	Anodyne	CCR2	15	43
COc1cc(CN2CC[C@H](NC(=O)NC3(C)CC(F)(F)C3)C2)cc(OC)c1	ZINC000875364671	GF	On-Demand	Anodyne	MCHR1	26	50
COc1cc(CN2CC[C@@H](NC(=O)NC3(C)CC(F)(F)C3)C2)cc(OC)c1	ZINC000875364672	GF	On-Demand	Anodyne	DRD4	23	43
COc1cc(CN2CC[C@@H](NC(=O)NC3(C)CC(F)(F)C3)C2)cc(OC)c1	ZINC000875364672	GF	On-Demand	Anodyne	SIGMAR1	15	43
COc1cc(CN2CC[C@@H](NC(=O)NC3(C)CC(F)(F)C3)C2)cc(OC)c1	ZINC000875364672	GF	On-Demand	Anodyne	CCR3	31	44
COc1cc(CN2CC[C@@H](NC(=O)NC3(C)CC(F)(F)C3)C2)cc(OC)c1	ZINC000875364672	GF	On-Demand	Anodyne	CCR2	15	43
COc1cc(CN2CC[C@@H](NC(=O)NC3(C)CC(F)(F)C3)C2)cc(OC)c1	ZINC000875364672	GF	On-Demand	Anodyne	MCHR1	26	50
COc1cc(CN2CC[C@H](NC(=O)NN=c3cc[nH]cc3C)C2)cc(OC)c1	ZINC000875364708	GD	On-Demand	Reactive	DRD4	24	45
COc1cc(CN2CC[C@H](NC(=O)NN=c3cc[nH]cc3C)C2)cc(OC)c1	ZINC000875364708	GD	On-Demand	Reactive	CCR3	29	40
COc1cc(CN2CC[C@H](NC(=O)NN=c3cc[nH]cc3C)C2)cc(OC)c1	ZINC000875364708	GD	On-Demand	Reactive	MCHR1	21	50
COc1cc(CN2CC[C@@H](NC(=O)NN=c3cc[nH]cc3C)C2)cc(OC)c1	ZINC000875364709	GD	On-Demand	Reactive	DRD4	24	45
COc1cc(CN2CC[C@@H](NC(=O)NN=c3cc[nH]cc3C)C2)cc(OC)c1	ZINC000875364709	GD	On-Demand	Reactive	CCR3	29	40
COc1cc(CN2CC[C@@H](NC(=O)NN=c3cc[nH]cc3C)C2)cc(OC)c1	ZINC000875364709	GD	On-Demand	Reactive	MCHR1	21	50
COc1cc(CN2CC[C@@H](NC(=O)N3C[C@H]4C(=O)OC[C@H]4C3)C2)cc(OC)c1	ZINC000875364766	GD	On-Demand	Anodyne	DRD4	21	42
COc1cc(CN2CC[C@@H](NC(=O)N3C[C@H]4C(=O)OC[C@H]4C3)C2)cc(OC)c1	ZINC000875364766	GD	On-Demand	Anodyne	CCR3	24	41
COc1cc(CN2CC[C@@H](NC(=O)N3C[C@H]4C(=O)OC[C@H]4C3)C2)cc(OC)c1	ZINC000875364766	GD	On-Demand	Anodyne	MCHR1	24	48
COc1cc(CN2CC[C@H](NC(=O)N3C[C@H]4C(=O)OC[C@H]4C3)C2)cc(OC)c1	ZINC000875364767	GD	On-Demand	Anodyne	DRD4	21	42
COc1cc(CN2CC[C@H](NC(=O)N3C[C@H]4C(=O)OC[C@H]4C3)C2)cc(OC)c1	ZINC000875364767	GD	On-Demand	Anodyne	CCR3	24	41
COc1cc(CN2CC[C@H](NC(=O)N3C[C@H]4C(=O)OC[C@H]4C3)C2)cc(OC)c1	ZINC000875364767	GD	On-Demand	Anodyne	MCHR1	24	48
COc1cc(CN2CC[C@H](NC(=O)N3CCC[C@@H](C(C)=O)C3)C2)cc(OC)c1	ZINC000875364768	GE	On-Demand	Anodyne	DRD4	25	46
COc1cc(CN2CC[C@H](NC(=O)N3CCC[C@@H](C(C)=O)C3)C2)cc(OC)c1	ZINC000875364768	GE	On-Demand	Anodyne	SIGMAR1	19	44
COc1cc(CN2CC[C@H](NC(=O)N3CCC[C@@H](C(C)=O)C3)C2)cc(OC)c1	ZINC000875364768	GE	On-Demand	Anodyne	CCR3	38	43
COc1cc(CN2CC[C@H](NC(=O)N3CCC[C@@H](C(C)=O)C3)C2)cc(OC)c1	ZINC000875364768	GE	On-Demand	Anodyne	MCHR1	25	52
COc1cc(CN2CC[C@@H](NC(=O)N3CCC[C@@H](C(C)=O)C3)C2)cc(OC)c1	ZINC000875364769	GE	On-Demand	Anodyne	DRD4	25	46
COc1cc(CN2CC[C@@H](NC(=O)N3CCC[C@@H](C(C)=O)C3)C2)cc(OC)c1	ZINC000875364769	GE	On-Demand	Anodyne	SIGMAR1	19	44
COc1cc(CN2CC[C@@H](NC(=O)N3CCC[C@@H](C(C)=O)C3)C2)cc(OC)c1	ZINC000875364769	GE	On-Demand	Anodyne	CCR3	38	43
COc1cc(CN2CC[C@@H](NC(=O)N3CCC[C@@H](C(C)=O)C3)C2)cc(OC)c1	ZINC000875364769	GE	On-Demand	Anodyne	MCHR1	25	52
COc1cc(CN2CC[C@H](NC(=O)N3CCC[C@H](C(C)=O)C3)C2)cc(OC)c1	ZINC000875364770	GE	On-Demand	Anodyne	DRD4	25	46
COc1cc(CN2CC[C@H](NC(=O)N3CCC[C@H](C(C)=O)C3)C2)cc(OC)c1	ZINC000875364770	GE	On-Demand	Anodyne	SIGMAR1	19	44
COc1cc(CN2CC[C@H](NC(=O)N3CCC[C@H](C(C)=O)C3)C2)cc(OC)c1	ZINC000875364770	GE	On-Demand	Anodyne	CCR3	38	43
COc1cc(CN2CC[C@H](NC(=O)N3CCC[C@H](C(C)=O)C3)C2)cc(OC)c1	ZINC000875364770	GE	On-Demand	Anodyne	MCHR1	25	52
COc1cc(CN2CC[C@@H](NC(=O)N3CCC[C@H](C(C)=O)C3)C2)cc(OC)c1	ZINC000875364771	GE	On-Demand	Anodyne	DRD4	25	46
COc1cc(CN2CC[C@@H](NC(=O)N3CCC[C@H](C(C)=O)C3)C2)cc(OC)c1	ZINC000875364771	GE	On-Demand	Anodyne	SIGMAR1	19	44
COc1cc(CN2CC[C@@H](NC(=O)N3CCC[C@H](C(C)=O)C3)C2)cc(OC)c1	ZINC000875364771	GE	On-Demand	Anodyne	CCR3	38	43
COc1cc(CN2CC[C@@H](NC(=O)N3CCC[C@H](C(C)=O)C3)C2)cc(OC)c1	ZINC000875364771	GE	On-Demand	Anodyne	MCHR1	25	52
COc1cc(CN2CC[C@H](NC(=O)NC[C@H]3C[C@H](O)C3)C2)cc(OC)c1	ZINC000875364784	FD	On-Demand	Anodyne	DRD4	24	44
COc1cc(CN2CC[C@H](NC(=O)NC[C@H]3C[C@H](O)C3)C2)cc(OC)c1	ZINC000875364784	FD	On-Demand	Anodyne	SIGMAR1	16	44
COc1cc(CN2CC[C@H](NC(=O)NC[C@H]3C[C@H](O)C3)C2)cc(OC)c1	ZINC000875364784	FD	On-Demand	Anodyne	SSTR5	40	32
COc1cc(CN2CC[C@H](NC(=O)NC[C@H]3C[C@H](O)C3)C2)cc(OC)c1	ZINC000875364784	FD	On-Demand	Anodyne	CCR3	36	42
COc1cc(CN2CC[C@H](NC(=O)NC[C@H]3C[C@H](O)C3)C2)cc(OC)c1	ZINC000875364784	FD	On-Demand	Anodyne	CCR2	15	42
COc1cc(CN2CC[C@H](NC(=O)NC[C@H]3C[C@H](O)C3)C2)cc(OC)c1	ZINC000875364784	FD	On-Demand	Anodyne	MCHR1	25	51
COc1cc(CN2CC[C@H](NC(=O)NC[C@H]3C[C@H](O)C3)C2)cc(OC)c1	ZINC000875364784	FD	On-Demand	Anodyne	CACNA1I	53	35
COc1cc(CN2CC[C@@H](NC(=O)NC[C@H]3C[C@H](O)C3)C2)cc(OC)c1	ZINC000875364785	FD	On-Demand	Anodyne	DRD4	24	44
COc1cc(CN2CC[C@@H](NC(=O)NC[C@H]3C[C@H](O)C3)C2)cc(OC)c1	ZINC000875364785	FD	On-Demand	Anodyne	SIGMAR1	16	44
COc1cc(CN2CC[C@@H](NC(=O)NC[C@H]3C[C@H](O)C3)C2)cc(OC)c1	ZINC000875364785	FD	On-Demand	Anodyne	SSTR5	40	32
COc1cc(CN2CC[C@@H](NC(=O)NC[C@H]3C[C@H](O)C3)C2)cc(OC)c1	ZINC000875364785	FD	On-Demand	Anodyne	CCR3	36	42
COc1cc(CN2CC[C@@H](NC(=O)NC[C@H]3C[C@H](O)C3)C2)cc(OC)c1	ZINC000875364785	FD	On-Demand	Anodyne	CCR2	15	42
COc1cc(CN2CC[C@@H](NC(=O)NC[C@H]3C[C@H](O)C3)C2)cc(OC)c1	ZINC000875364785	FD	On-Demand	Anodyne	MCHR1	25	51
COc1cc(CN2CC[C@@H](NC(=O)NC[C@H]3C[C@H](O)C3)C2)cc(OC)c1	ZINC000875364785	FD	On-Demand	Anodyne	CACNA1I	53	35
COc1cc(CN2CC[C@@H](NC(=O)N(C)OCC(F)(F)F)C2)cc(OC)c1	ZINC000875364807	GE	On-Demand	Anodyne	DRD4	22	43
COc1cc(CN2CC[C@@H](NC(=O)N(C)OCC(F)(F)F)C2)cc(OC)c1	ZINC000875364807	GE	On-Demand	Anodyne	CCR3	25	42
COc1cc(CN2CC[C@@H](NC(=O)N(C)OCC(F)(F)F)C2)cc(OC)c1	ZINC000875364807	GE	On-Demand	Anodyne	UTS2R	18	41
COc1cc(CN2CC[C@@H](NC(=O)N(C)OCC(F)(F)F)C2)cc(OC)c1	ZINC000875364807	GE	On-Demand	Anodyne	CCR2	19	47
COc1cc(CN2CC[C@@H](NC(=O)N(C)OCC(F)(F)F)C2)cc(OC)c1	ZINC000875364807	GE	On-Demand	Anodyne	MCHR1	32	49
COc1cc(CN2CC[C@H](NC(=O)N(C)OCC(F)(F)F)C2)cc(OC)c1	ZINC000875364808	GE	On-Demand	Anodyne	DRD4	22	43
COc1cc(CN2CC[C@H](NC(=O)N(C)OCC(F)(F)F)C2)cc(OC)c1	ZINC000875364808	GE	On-Demand	Anodyne	CCR3	25	42
COc1cc(CN2CC[C@H](NC(=O)N(C)OCC(F)(F)F)C2)cc(OC)c1	ZINC000875364808	GE	On-Demand	Anodyne	UTS2R	18	41
COc1cc(CN2CC[C@H](NC(=O)N(C)OCC(F)(F)F)C2)cc(OC)c1	ZINC000875364808	GE	On-Demand	Anodyne	CCR2	19	47
COc1cc(CN2CC[C@H](NC(=O)N(C)OCC(F)(F)F)C2)cc(OC)c1	ZINC000875364808	GE	On-Demand	Anodyne	MCHR1	32	49
O=C(NC1(C(=O)N2CCSc3ncccc32)CC1)OCc1ccccc1	ZINC000875364816	FF	On-Demand	Anodyne	SLC12A5	54	33
CCO[C@@H](C(=O)N(CCOC)c1ccc(C#N)cc1)C1CCCC1	ZINC000875364821	EG	On-Demand	Mild	AMY2	44	31
CCO[C@H](C(=O)N(CCOC)c1ccc(C#N)cc1)C1CCCC1	ZINC000875364822	EG	On-Demand	Mild	AMY2	44	31
COC[C@H](NC(=O)c1cnn(-c2cccc(F)c2)c1C(F)(F)F)C(C)C	ZINC000875364842	FG	On-Demand	Anodyne	MST1R	40	39
COC[C@@H](NC(=O)c1cnn(-c2cccc(F)c2)c1C(F)(F)F)C(C)C	ZINC000875364843	FG	On-Demand	Anodyne	MST1R	40	39
CCCCCCCCCCNC(=O)N1CCn2nnc(CO)c2C1	ZINC000875364871	EE	On-Demand	Mild	ASAH1	92	37
O=C(NCCC1CCC1)N1CC(c2ccccc2)C1	ZINC000875364872	CF	On-Demand	Anodyne	EPHX2	24	42
O=C(NCCC1CCC1)N1CC(c2ccccc2)C1	ZINC000875364872	CF	On-Demand	Anodyne	RBP4	46	39
COCCOc1cc(C)ccc1CNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875364873	GD	On-Demand	Anodyne	CCR2	18	40
O=C(N[C@@H]1CCN(c2c(F)cccc2F)C1)N1CCC2(CCNC2=O)CC1	ZINC000875364917	GD	On-Demand	Anodyne	CACNA1H	44	34
O=C(N[C@H]1CCN(c2c(F)cccc2F)C1)N1CCC2(CCNC2=O)CC1	ZINC000875364918	GD	On-Demand	Anodyne	CACNA1H	44	34
COC[C@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364928	EE	On-Demand	Anodyne	ACE	19	41
COC[C@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364928	EE	On-Demand	Anodyne	OPRD1	18	40
COC[C@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364928	EE	On-Demand	Anodyne	MME	34	43
COC[C@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364928	EE	On-Demand	Anodyne	CASP3	16	40
COC[C@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364928	EE	On-Demand	Anodyne	KLK3	73	36
COC[C@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364928	EE	On-Demand	Anodyne	CTSB	60	43
COC[C@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364928	EE	On-Demand	Anodyne	PAPA1_CARPA	76	40
COC[C@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364928	EE	On-Demand	Anodyne	CYSP_TRYCR	44	40
COC[C@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364928	EE	On-Demand	Anodyne	CTSK	44	55
COC[C@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364928	EE	On-Demand	Anodyne	CTSL	43	42
COC[C@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364928	EE	On-Demand	Anodyne	PGA	31	41
COC[C@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364928	EE	On-Demand	Anodyne	CAPNS1	68	40
COC[C@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364928	EE	On-Demand	Anodyne	ECE1	35	42
COC[C@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364928	EE	On-Demand	Anodyne	CTSS	20	47
COC[C@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364928	EE	On-Demand	Anodyne	CAPN1	84	42
COC[C@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364928	EE	On-Demand	Anodyne	CASP1	23	40
COC[C@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364928	EE	On-Demand	Anodyne	CAPN2	127	41
COC[C@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364928	EE	On-Demand	Anodyne	CASP9	29	40
COC[C@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364928	EE	On-Demand	Anodyne	NPR	76	37
COC[C@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364928	EE	On-Demand	Anodyne	SLC12A5	66	37
COC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364929	EE	On-Demand	Anodyne	ACE	19	41
COC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364929	EE	On-Demand	Anodyne	OPRD1	18	40
COC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364929	EE	On-Demand	Anodyne	MME	34	43
COC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364929	EE	On-Demand	Anodyne	CASP3	16	40
COC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364929	EE	On-Demand	Anodyne	KLK3	73	36
COC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364929	EE	On-Demand	Anodyne	CTSB	60	43
COC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364929	EE	On-Demand	Anodyne	PAPA1_CARPA	76	40
COC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364929	EE	On-Demand	Anodyne	CYSP_TRYCR	44	40
COC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364929	EE	On-Demand	Anodyne	CTSK	44	55
COC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364929	EE	On-Demand	Anodyne	CTSL	43	42
COC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364929	EE	On-Demand	Anodyne	PGA	31	41
COC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364929	EE	On-Demand	Anodyne	CAPNS1	68	40
COC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364929	EE	On-Demand	Anodyne	ECE1	35	42
COC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364929	EE	On-Demand	Anodyne	CTSS	20	47
COC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364929	EE	On-Demand	Anodyne	CAPN1	84	42
COC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364929	EE	On-Demand	Anodyne	CASP1	23	40
COC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364929	EE	On-Demand	Anodyne	CAPN2	127	41
COC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364929	EE	On-Demand	Anodyne	CASP9	29	40
COC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364929	EE	On-Demand	Anodyne	NPR	76	37
COC[C@@H](NC(=O)C1(NC(=O)OCc2ccccc2)CC1)C(C)C	ZINC000875364929	EE	On-Demand	Anodyne	SLC12A5	66	37
Cc1cccc(CN2CCO[C@@H](CNC(=O)N[C@H](C)CCCO)C2)c1	ZINC000875364968	ED	On-Demand	Anodyne	HRH2	16	40
Cc1cccc(CN2CCO[C@H](CNC(=O)N[C@@H](C)CCCO)C2)c1	ZINC000875364969	ED	On-Demand	Anodyne	HRH2	16	40
Cc1cccc(CN2CCO[C@H](CNC(=O)N[C@H](C)CCCO)C2)c1	ZINC000875364970	ED	On-Demand	Anodyne	HRH2	16	40
Cc1cccc(CN2CCO[C@@H](CNC(=O)N[C@@H](C)CCCO)C2)c1	ZINC000875364971	ED	On-Demand	Anodyne	HRH2	16	40
Cc1ccc(CN2CCO[C@H](CNC(=O)N[C@@H](C)CCCO)C2)cc1	ZINC000875365014	ED	On-Demand	Anodyne	DRD4	15	42
Cc1ccc(CN2CCO[C@H](CNC(=O)N[C@H](C)CCCO)C2)cc1	ZINC000875365015	ED	On-Demand	Anodyne	DRD4	15	42
C[C@@H](CCCO)NC(=O)N[C@@H](c1nc2ccccc2[nH]1)C1CCCCC1	ZINC000875365058	FH	On-Demand	Anodyne	MMP7	15	41
C[C@@H](CCCO)NC(=O)N[C@H](c1nc2ccccc2[nH]1)C1CCCCC1	ZINC000875365060	FH	On-Demand	Anodyne	MMP7	15	41
C[C@@H](CCCO)NC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875365068	DE	On-Demand	Anodyne	ROCK1	26	47
C[C@@H](CCCO)NC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875365068	DE	On-Demand	Anodyne	ROCK2	19	47
COC(=O)N(C)NC(=O)N[C@H](C)c1cccc(N2CCCC2)c1	ZINC000875365073	DE	On-Demand	Reactive	KCNQ2	49	44
COC(=O)N(C)NC(=O)N[C@@H](C)c1cccc(N2CCCC2)c1	ZINC000875365074	DE	On-Demand	Reactive	KCNQ2	49	44
O=C(N[C@@H](c1ccccc1F)C1CCCC1)N1CCC2(CCNC2=O)CC1	ZINC000875365075	FG	On-Demand	Anodyne	CACNA1H	52	36
O=C(N[C@H](c1ccccc1F)C1CCCC1)N1CCC2(CCNC2=O)CC1	ZINC000875365076	FG	On-Demand	Anodyne	CACNA1H	52	36
C[C@@H](CCCO)NC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875365085	EF	On-Demand	Mild	CTSF	47	34
C[C@@H](CCCO)NC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875365086	EF	On-Demand	Mild	CTSF	47	34
C[C@@H](NC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1cccc(N2CCCC2)c1	ZINC000875365101	GH	On-Demand	Anodyne	KCNQ2	27	43
C[C@@H](NC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1cccc(N2CCCC2)c1	ZINC000875365102	GH	On-Demand	Anodyne	KCNQ2	27	43
C[C@@H](CCCO)NC(=O)NCC1(c2ccccc2)CCN(C)CC1	ZINC000875365130	EE	On-Demand	Anodyne	KCNA3	47	38
C[C@@H](CCCO)NC(=O)NCC1(c2ccccc2)CCN(C)CC1	ZINC000875365130	EE	On-Demand	Anodyne	SOAT1	18	47
C[C@@H](CCCO)NC(=O)NCc1ccccc1C(=O)OC(C)(C)C	ZINC000875365151	EF	On-Demand	Anodyne	ANPEP	15	40
C[C@@H](CCCO)NC(=O)N[C@@H](C)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875365173	FE	On-Demand	Anodyne	GPR119	27	42
C[C@@H](CCCO)NC(=O)N[C@H](C)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875365175	FE	On-Demand	Anodyne	GPR119	27	42
C[C@@H](NC(=O)N1CCCCCCNC(=O)CC1)c1cccc(N2CCCC2)c1	ZINC000875365177	GG	On-Demand	Anodyne	KCNQ2	17	41
C[C@H](NC(=O)N1Cc2cccc(O)c2C1)c1cccc(N2CCCC2)c1	ZINC000875365197	FH	On-Demand	Clean	KCNQ2	30	42
C[C@@H](NC(=O)N1Cc2cccc(O)c2C1)c1cccc(N2CCCC2)c1	ZINC000875365198	FH	On-Demand	Clean	KCNQ2	30	42
CCCCCOc1cc(C)ccc1CNC(=O)N1CCC(CO)(CO)CC1	ZINC000875365210	GF	On-Demand	Anodyne	PLA2G4B	52	30
Oc1cccc(N2CCN(c3nc4ccccc4[nH]3)CC2)c1	ZINC000875365224	CF	On-Demand	Anodyne	HTR7	17	49
Oc1cccc(N2CCN(c3nc4ccccc4[nH]3)CC2)c1	ZINC000875365224	CF	On-Demand	Anodyne	KCNN3	27	43
C[C@@H](CCCO)NC(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875365233	DF	On-Demand	Anodyne	PTAFR	20	41
C[C@@H](CCCO)NC(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875365234	DF	On-Demand	Anodyne	PTAFR	20	41
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1cccc(N2CCCC2)c1	ZINC000875365249	EE	On-Demand	Anodyne	KCNQ2	54	50
O=C(N[C@H]1CCN(c2c(F)cccc2F)C1=O)N1CCC2(CCNC2=O)CC1	ZINC000875365261	GD	On-Demand	Anodyne	CACNA1H	46	34
O=C(N[C@H]1CCN(c2c(F)cccc2F)C1=O)N1CCC2(CCNC2=O)CC1	ZINC000875365261	GD	On-Demand	Anodyne	CALCRL	37	41
O=C(N[C@@H]1CCN(c2c(F)cccc2F)C1=O)N1CCC2(CCNC2=O)CC1	ZINC000875365262	GD	On-Demand	Anodyne	CACNA1H	46	34
O=C(N[C@@H]1CCN(c2c(F)cccc2F)C1=O)N1CCC2(CCNC2=O)CC1	ZINC000875365262	GD	On-Demand	Anodyne	CALCRL	37	41
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN(c2cccs2)CC1	ZINC000875365273	FH	On-Demand	Anodyne	EPHX2	16	40
Cc1nnc(NNC(=O)N[C@H](C)c2cccc(N3CCCC3)c2)n1C	ZINC000875365294	EE	On-Demand	Reactive	KCNQ2	17	43
Cc1nnc(NNC(=O)N[C@@H](C)c2cccc(N3CCCC3)c2)n1C	ZINC000875365295	EE	On-Demand	Reactive	KCNQ2	17	43
Cc1ccc([C@H](C)NC(=O)NC2(C)CC(F)(F)C2)cc1F	ZINC000875365333	DH	On-Demand	Anodyne	KCNQ2	42	29
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)c1cccc(N2CCCC2)c1	ZINC000875365339	EG	On-Demand	Anodyne	KCNQ2	61	44
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)c1cccc(N2CCCC2)c1	ZINC000875365340	EG	On-Demand	Anodyne	KCNQ2	61	44
COC(=O)C1(O)CN(C(=O)N[C@H](C)c2cccc(N3CCCC3)c2)C1	ZINC000875365346	ED	On-Demand	Anodyne	KCNQ2	38	43
COC(=O)C1(O)CN(C(=O)N[C@@H](C)c2cccc(N3CCCC3)c2)C1	ZINC000875365347	ED	On-Demand	Anodyne	KCNQ2	38	43
C[C@@H](CCCO)NC(=O)NCc1cccc(OC(C)(C)C)c1	ZINC000875365368	DF	On-Demand	Anodyne	ANPEP	18	48
C[C@@H](CCCO)NC(=O)NCc1cccc(OC(C)(C)C)c1	ZINC000875365368	DF	On-Demand	Anodyne	PDS	49	34
Cc1cc(NC(=O)[C@@H](C)CCc2ccc(F)cc2)ncn1	ZINC000875365380	CG	On-Demand	Anodyne	LEF	49	37
CC(=O)N(C)c1ccc(CNC(=O)NC2CCN(c3cccs3)CC2)cc1	ZINC000875365390	GG	On-Demand	Anodyne	EPHX2	18	40
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1cccc(N2CCCC2)c1	ZINC000875365397	FE	On-Demand	Anodyne	CACNA1H	32	44
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1cccc(N2CCCC2)c1	ZINC000875365397	FE	On-Demand	Anodyne	KCNQ2	40	45
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1cccc(N2CCCC2)c1	ZINC000875365463	EG	On-Demand	Anodyne	KCNQ2	51	41
C[C@@H](NC(=O)NC1(C)CC(F)(F)C1)c1cccc(N2CCCC2)c1	ZINC000875365469	EH	On-Demand	Anodyne	KCNQ2	52	46
C[C@H](NC(=O)NC1(C)CC(F)(F)C1)c1cccc(N2CCCC2)c1	ZINC000875365470	EH	On-Demand	Anodyne	KCNQ2	52	46
O=C(N[C@@H](c1ccccc1F)C1CCCC1)N1CCC(CO)(CO)CC1	ZINC000875365510	FF	On-Demand	Anodyne	CTSS	16	40
O=C(N[C@H](c1ccccc1F)C1CCCC1)N1CCC(CO)(CO)CC1	ZINC000875365511	FF	On-Demand	Anodyne	CTSS	16	40
C[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1cccc(N2CCCC2)c1	ZINC000875365532	GD	On-Demand	Anodyne	KCNQ2	32	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(C)ccc1OC(F)F	ZINC000875365537	FF	On-Demand	Anodyne	SLC6A4	28	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(C)ccc1OC(F)F	ZINC000875365537	FF	On-Demand	Anodyne	SLC6A3	65	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(C)ccc1OC(F)F	ZINC000875365538	FF	On-Demand	Anodyne	SLC6A4	28	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(C)ccc1OC(F)F	ZINC000875365538	FF	On-Demand	Anodyne	SLC6A3	65	41
C[C@@H](CCCO)NC(=O)NCc1ccc(O)c(Cl)c1	ZINC000875365558	CE	On-Demand	Anodyne	NCE103	16	46
C[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1cccc(N2CCCC2)c1	ZINC000875365597	EG	On-Demand	Anodyne	KCNQ2	35	42
C[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1cccc(N2CCCC2)c1	ZINC000875365599	EG	On-Demand	Anodyne	KCNQ2	35	42
C[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1cccc(N2CCCC2)c1	ZINC000875365602	FH	On-Demand	Anodyne	KCNQ2	27	42
C[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1cccc(N2CCCC2)c1	ZINC000875365604	FH	On-Demand	Anodyne	KCNQ2	27	42
O=C(N[C@H]1CCN(c2c(F)cccc2F)C1=O)N1CCC(CO)(CO)CC1	ZINC000875365615	GC	On-Demand	Anodyne	CALCRL	37	42
O=C(N[C@@H]1CCN(c2c(F)cccc2F)C1=O)N1CCC(CO)(CO)CC1	ZINC000875365616	GC	On-Demand	Anodyne	CALCRL	37	42
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1cc(C)ncn1	ZINC000875365627	CE	On-Demand	Anodyne	PPARD	37	40
COc1ccc(-c2nc(CN3CCC(C(=O)Nc4ccc5c(c4)OCO5)CC3)co2)cc1	ZINC000875365642	IH	On-Demand	Anodyne	EDNRB	67	42
COc1ccc(-c2nc(CN3CCC(C(=O)Nc4ccc5c(c4)OCO5)CC3)co2)cc1	ZINC000875365642	IH	On-Demand	Anodyne	EDNRA	65	42
COc1ccc(-c2nc(CN3CCC(C(=O)Nc4ccc5c(c4)OCO5)CC3)co2)cc1	ZINC000875365642	IH	On-Demand	Anodyne	ROCK2	24	41
COc1ccc(-c2nc(CN3CCC(C(=O)Nc4ccc5c(c4)OCO5)CC3)co2)cc1	ZINC000875365642	IH	On-Demand	Anodyne	MCHR1	39	51
C[C@@H](CCCO)NC(=O)NCc1cccc2ncccc12	ZINC000875365653	CE	On-Demand	Anodyne	ANPEP	16	45
Cc1ccc([C@H](C)NC(=O)N2CCC(C(=O)NCCO)CC2)cc1F	ZINC000875365683	FD	On-Demand	Anodyne	EPHX2	16	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2cccc(N3CCCC3)c2)C1	ZINC000875365696	FG	On-Demand	Anodyne	P2RY12	34	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2cccc(N3CCCC3)c2)C1	ZINC000875365696	FG	On-Demand	Anodyne	KCNQ2	36	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2cccc(N3CCCC3)c2)C1	ZINC000875365698	FG	On-Demand	Anodyne	P2RY12	34	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2cccc(N3CCCC3)c2)C1	ZINC000875365698	FG	On-Demand	Anodyne	KCNQ2	36	40
O=C(NCCCO[C@H]1CCOC1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875365773	FD	On-Demand	Anodyne	ADRB1	18	43
O=C(NCCCO[C@H]1CCOC1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875365773	FD	On-Demand	Anodyne	HRH2	22	41
O=C(NCCCO[C@H]1CCOC1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875365774	FD	On-Demand	Anodyne	ADRB1	18	43
O=C(NCCCO[C@H]1CCOC1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875365774	FD	On-Demand	Anodyne	HRH2	22	41
O=C(NCCCO[C@@H]1CCOC1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875365775	FD	On-Demand	Anodyne	ADRB1	18	43
O=C(NCCCO[C@@H]1CCOC1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875365775	FD	On-Demand	Anodyne	HRH2	22	41
O=C(NCCCO[C@@H]1CCOC1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875365776	FD	On-Demand	Anodyne	ADRB1	18	43
O=C(NCCCO[C@@H]1CCOC1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875365776	FD	On-Demand	Anodyne	HRH2	22	41
C[C@@H](CCCO)NC(=O)N[C@@H]1CC[C@@H](NC(=O)OC(C)(C)C)CC1	ZINC000875365817	EE	On-Demand	Anodyne	CTSK	18	42
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1cccc(N2CCCC2)c1	ZINC000875365980	FH	On-Demand	Anodyne	KCNQ2	34	40
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)c1cccc(N2CCCC2)c1	ZINC000875365983	FH	On-Demand	Anodyne	KCNQ2	34	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(C)c(F)c1	ZINC000875365997	EF	On-Demand	Anodyne	SLC6A4	20	49
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(C)c(F)c1	ZINC000875365997	EF	On-Demand	Anodyne	SLC6A3	45	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(C)c(F)c1	ZINC000875365999	EF	On-Demand	Anodyne	SLC6A4	20	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(C)c(F)c1	ZINC000875365999	EF	On-Demand	Anodyne	SLC6A3	45	49
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(C)c(F)c1	ZINC000875366001	EF	On-Demand	Anodyne	SLC6A4	20	49
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc(C)c(F)c1	ZINC000875366001	EF	On-Demand	Anodyne	SLC6A3	45	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(C)c(F)c1	ZINC000875366004	EF	On-Demand	Anodyne	SLC6A4	20	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc(C)c(F)c1	ZINC000875366004	EF	On-Demand	Anodyne	SLC6A3	45	49
O=C(NCCCCCCc1ccccc1)C(=O)NCc1nnc2n1CCOC2	ZINC000875366048	GD	On-Demand	Anodyne	FAAH	60	39
O=C(NCCCCCCc1ccccc1)C(=O)NCc1nnc2n1CCOC2	ZINC000875366048	GD	On-Demand	Anodyne	CES1	59	35
O=C(NCCCCCCc1ccccc1)C(=O)NCc1nnc2n1CCOC2	ZINC000875366048	GD	On-Demand	Anodyne	AMP1_PLAFQ	18	40
COc1ccccc1N1CC[C@H](NC(=O)NN=c2cc[nH]cc2C)C1	ZINC000875366066	ED	On-Demand	Reactive	HTR1A	56	39
COc1ccccc1N1CC[C@H](NC(=O)NN=c2cc[nH]cc2C)C1	ZINC000875366066	ED	On-Demand	Reactive	DRD2	44	39
COc1ccccc1N1CC[C@H](NC(=O)NN=c2cc[nH]cc2C)C1	ZINC000875366066	ED	On-Demand	Reactive	ADRA1D	48	39
COc1ccccc1N1CC[C@H](NC(=O)NN=c2cc[nH]cc2C)C1	ZINC000875366066	ED	On-Demand	Reactive	ADRA1A	42	39
COc1ccccc1N1CC[C@H](NC(=O)NN=c2cc[nH]cc2C)C1	ZINC000875366066	ED	On-Demand	Reactive	DRD3	52	39
COc1ccccc1N1CC[C@@H](NC(=O)NN=c2cc[nH]cc2C)C1	ZINC000875366070	ED	On-Demand	Reactive	HTR1A	56	39
COc1ccccc1N1CC[C@@H](NC(=O)NN=c2cc[nH]cc2C)C1	ZINC000875366070	ED	On-Demand	Reactive	DRD2	44	39
COc1ccccc1N1CC[C@@H](NC(=O)NN=c2cc[nH]cc2C)C1	ZINC000875366070	ED	On-Demand	Reactive	ADRA1D	48	39
COc1ccccc1N1CC[C@@H](NC(=O)NN=c2cc[nH]cc2C)C1	ZINC000875366070	ED	On-Demand	Reactive	ADRA1A	42	39
COc1ccccc1N1CC[C@@H](NC(=O)NN=c2cc[nH]cc2C)C1	ZINC000875366070	ED	On-Demand	Reactive	DRD3	52	39
Cc1ccc([C@H](C)NC(=O)N2CCO[C@H](C(F)(F)F)CC2)cc1F	ZINC000875366081	EH	On-Demand	Anodyne	MAPK1	21	40
Cc1ccc([C@H](C)NC(=O)N2CCO[C@@H](C(F)(F)F)CC2)cc1F	ZINC000875366091	EH	On-Demand	Anodyne	MAPK1	21	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(OC)ccc1OC(F)F	ZINC000875366096	GF	On-Demand	Anodyne	SLC6A4	28	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(OC)ccc1OC(F)F	ZINC000875366096	GF	On-Demand	Anodyne	SLC6A3	59	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(OC)ccc1OC(F)F	ZINC000875366102	GF	On-Demand	Anodyne	SLC6A4	28	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(OC)ccc1OC(F)F	ZINC000875366102	GF	On-Demand	Anodyne	SLC6A3	59	42
COc1ccccc1N1CC[C@@H](NC(=O)NC2(C)CC(F)(F)C2)C1	ZINC000875366124	EF	On-Demand	Anodyne	HTR1A	55	42
COc1ccccc1N1CC[C@@H](NC(=O)NC2(C)CC(F)(F)C2)C1	ZINC000875366124	EF	On-Demand	Anodyne	DRD2	49	44
COc1ccccc1N1CC[C@@H](NC(=O)NC2(C)CC(F)(F)C2)C1	ZINC000875366124	EF	On-Demand	Anodyne	ADRA1D	61	44
COc1ccccc1N1CC[C@@H](NC(=O)NC2(C)CC(F)(F)C2)C1	ZINC000875366124	EF	On-Demand	Anodyne	ADRA1A	51	44
COc1ccccc1N1CC[C@@H](NC(=O)NC2(C)CC(F)(F)C2)C1	ZINC000875366124	EF	On-Demand	Anodyne	ADRA1B	47	44
COc1ccccc1N1CC[C@@H](NC(=O)NC2(C)CC(F)(F)C2)C1	ZINC000875366124	EF	On-Demand	Anodyne	DRD3	53	39
COc1ccccc1N1CC[C@H](NC(=O)NC2(C)CC(F)(F)C2)C1	ZINC000875366125	EF	On-Demand	Anodyne	HTR1A	55	42
COc1ccccc1N1CC[C@H](NC(=O)NC2(C)CC(F)(F)C2)C1	ZINC000875366125	EF	On-Demand	Anodyne	DRD2	49	44
COc1ccccc1N1CC[C@H](NC(=O)NC2(C)CC(F)(F)C2)C1	ZINC000875366125	EF	On-Demand	Anodyne	ADRA1D	61	44
COc1ccccc1N1CC[C@H](NC(=O)NC2(C)CC(F)(F)C2)C1	ZINC000875366125	EF	On-Demand	Anodyne	ADRA1A	51	44
COc1ccccc1N1CC[C@H](NC(=O)NC2(C)CC(F)(F)C2)C1	ZINC000875366125	EF	On-Demand	Anodyne	ADRA1B	47	44
COc1ccccc1N1CC[C@H](NC(=O)NC2(C)CC(F)(F)C2)C1	ZINC000875366125	EF	On-Demand	Anodyne	DRD3	53	39
CSc1cc(C)ccc1CNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875366126	FE	On-Demand	Anodyne	CCR2	18	41
C[C@@H](CCCO)NC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875366139	EF	On-Demand	Anodyne	DRD2	23	44
C[C@@H](CCCO)NC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875366139	EF	On-Demand	Anodyne	DRD4	47	45
C[C@@H](CCCO)NC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875366139	EF	On-Demand	Anodyne	ACHE	65	61
C[C@@H](CCCO)NC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875366139	EF	On-Demand	Anodyne	HRH2	25	44
C[C@@H](CCCO)NC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875366139	EF	On-Demand	Anodyne	DRD3	17	45
C[C@@H](CCCO)NC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875366139	EF	On-Demand	Anodyne	SLC6A3	25	50
C[C@@H](CCCO)NC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875366139	EF	On-Demand	Anodyne	HTR4	41	46
C[C@@H](CCCO)NC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875366139	EF	On-Demand	Anodyne	SIGMAR1	59	44
C[C@@H](CCCO)NC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875366139	EF	On-Demand	Anodyne	BCHE	19	52
C[C@@H](CCCO)NC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875366139	EF	On-Demand	Anodyne	CCR3	62	44
C[C@@H](CCCO)NC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875366139	EF	On-Demand	Anodyne	MCHR1	34	45
C[C@@H](CCCO)NC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875366139	EF	On-Demand	Anodyne	CACNA1G	33	41
C[C@@H](CCCO)NC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875366139	EF	On-Demand	Anodyne	CACNA1I	55	38
C[C@@H](CCCO)NC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875366144	ED	On-Demand	Anodyne	KLK3	83	36
C[C@@H](CCCO)NC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875366144	ED	On-Demand	Anodyne	CTSB	47	39
C[C@@H](CCCO)NC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875366144	ED	On-Demand	Anodyne	PAPA1_CARPA	56	40
C[C@@H](CCCO)NC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875366144	ED	On-Demand	Anodyne	CTSK	41	40
C[C@@H](CCCO)NC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875366144	ED	On-Demand	Anodyne	CTSL	43	38
C[C@@H](CCCO)NC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875366144	ED	On-Demand	Anodyne	CAPNS1	60	37
C[C@@H](CCCO)NC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875366144	ED	On-Demand	Anodyne	CTSS	17	40
C[C@@H](CCCO)NC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875366144	ED	On-Demand	Anodyne	CAPN1	60	37
C[C@@H](CCCO)NC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875366144	ED	On-Demand	Anodyne	CAPN2	93	37
C[C@@H](CCCO)NC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875366144	ED	On-Demand	Anodyne	NPR	63	33
C[C@@H](CCCO)NC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875366144	ED	On-Demand	Anodyne	BIRC2	22	40
C[C@@H](CCCO)NC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875366144	ED	On-Demand	Anodyne	SLC12A5	47	31
COc1ccccc1N1CC[C@H](NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1=O	ZINC000875366152	GE	On-Demand	Anodyne	HTR1A	38	40
COc1ccccc1N1CC[C@@H](NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1=O	ZINC000875366153	GE	On-Demand	Anodyne	HTR1A	38	40
COc1ccccc1N1CC[C@H](NC(=O)NNc2cccc(C)n2)C1	ZINC000875366157	EE	On-Demand	Reactive	HTR1A	57	38
COc1ccccc1N1CC[C@H](NC(=O)NNc2cccc(C)n2)C1	ZINC000875366157	EE	On-Demand	Reactive	DRD2	46	40
COc1ccccc1N1CC[C@H](NC(=O)NNc2cccc(C)n2)C1	ZINC000875366157	EE	On-Demand	Reactive	ADRA1D	53	40
COc1ccccc1N1CC[C@H](NC(=O)NNc2cccc(C)n2)C1	ZINC000875366157	EE	On-Demand	Reactive	ADRA1A	45	40
COc1ccccc1N1CC[C@H](NC(=O)NNc2cccc(C)n2)C1	ZINC000875366157	EE	On-Demand	Reactive	ADRA1B	43	40
COc1ccccc1N1CC[C@H](NC(=O)NNc2cccc(C)n2)C1	ZINC000875366157	EE	On-Demand	Reactive	DRD3	50	37
COc1ccccc1N1CC[C@H](NC(=O)NNc2cccc(C)n2)C1	ZINC000875366157	EE	On-Demand	Reactive	HTR7	42	36
COc1ccccc1N1CC[C@@H](NC(=O)NNc2cccc(C)n2)C1	ZINC000875366179	EE	On-Demand	Reactive	HTR1A	57	38
COc1ccccc1N1CC[C@@H](NC(=O)NNc2cccc(C)n2)C1	ZINC000875366179	EE	On-Demand	Reactive	DRD2	46	40
COc1ccccc1N1CC[C@@H](NC(=O)NNc2cccc(C)n2)C1	ZINC000875366179	EE	On-Demand	Reactive	ADRA1D	53	40
COc1ccccc1N1CC[C@@H](NC(=O)NNc2cccc(C)n2)C1	ZINC000875366179	EE	On-Demand	Reactive	ADRA1A	45	40
COc1ccccc1N1CC[C@@H](NC(=O)NNc2cccc(C)n2)C1	ZINC000875366179	EE	On-Demand	Reactive	ADRA1B	43	40
COc1ccccc1N1CC[C@@H](NC(=O)NNc2cccc(C)n2)C1	ZINC000875366179	EE	On-Demand	Reactive	DRD3	50	37
COc1ccccc1N1CC[C@@H](NC(=O)NNc2cccc(C)n2)C1	ZINC000875366179	EE	On-Demand	Reactive	HTR7	42	36
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1cccc(N2CCCC2)c1	ZINC000875366182	GH	On-Demand	Anodyne	CACNA1H	27	42
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1cccc(N2CCCC2)c1	ZINC000875366182	GH	On-Demand	Anodyne	KCNQ2	35	43
CN1CCN(C2CCN(C(=O)C(=O)NCC(C)(C)C3=CCCCC3)CC2)CC1	ZINC000875366195	GD	On-Demand	Anodyne	L3MBTL3	46	38
CSc1cc(C)ccc1CNC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875366209	FD	On-Demand	Anodyne	EPHX2	38	52
Cc1ccc([C@H](C)NC(=O)N2CCC(CO)(CO)CC2)cc1F	ZINC000875366220	DD	On-Demand	Anodyne	CACNA1H	50	41
Cc1ccc([C@H](C)NC(=O)N2CCC(CO)(CO)CC2)cc1F	ZINC000875366220	DD	On-Demand	Anodyne	MAPK1	37	40
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@H]2c2cncc(C)c2)C1=O	ZINC000875366237	GG	On-Demand	Anodyne	HTR1A	50	42
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@H]2c2cncc(C)c2)C1=O	ZINC000875366237	GG	On-Demand	Anodyne	DRD2	35	42
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@H]2c2cncc(C)c2)C1=O	ZINC000875366237	GG	On-Demand	Anodyne	SSTR5	25	40
C[C@@H](NC(=O)N1CCC[C@H](OC2CCC2)CC1)c1cccc(N2CCCC2)c1	ZINC000875366240	GI	On-Demand	Anodyne	KCNQ2	38	41
C[C@@H](NC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1cccc(N2CCCC2)c1	ZINC000875366242	GI	On-Demand	Anodyne	KCNQ2	38	41
Cc1ccc([C@H](C)NC(=O)N2CCC3(CCN(C)CC3)CC2)cc1F	ZINC000875366282	EH	On-Demand	Anodyne	CACNA1H	47	41
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1cccc(N2CCCC2)c1	ZINC000875366284	DE	On-Demand	Anodyne	KCNQ2	36	42
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1cccc(N2CCCC2)c1	ZINC000875366285	DE	On-Demand	Anodyne	KCNQ2	36	42
O=C(Nc1cccc2nccn12)C1CCC=CCC1	ZINC000875366301	CG	On-Demand	Anodyne	TYK2	47	37
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCC2(CCOCc3ccccc3)CC2)C1	ZINC000875366321	GF	On-Demand	Anodyne	TIMP3	43	32
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@@H]2c2cncc(C)c2)C1=O	ZINC000875366329	GG	On-Demand	Anodyne	HTR1A	50	42
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@@H]2c2cncc(C)c2)C1=O	ZINC000875366329	GG	On-Demand	Anodyne	DRD2	35	42
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@@H]2c2cncc(C)c2)C1=O	ZINC000875366329	GG	On-Demand	Anodyne	SSTR5	25	40
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@H]2c2cncc(C)c2)C1=O	ZINC000875366331	GG	On-Demand	Anodyne	HTR1A	50	42
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@H]2c2cncc(C)c2)C1=O	ZINC000875366331	GG	On-Demand	Anodyne	DRD2	35	42
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@H]2c2cncc(C)c2)C1=O	ZINC000875366331	GG	On-Demand	Anodyne	SSTR5	25	40
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@@H]2c2cncc(C)c2)C1=O	ZINC000875366333	GG	On-Demand	Anodyne	HTR1A	50	42
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@@H]2c2cncc(C)c2)C1=O	ZINC000875366333	GG	On-Demand	Anodyne	DRD2	35	42
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@@H]2c2cncc(C)c2)C1=O	ZINC000875366333	GG	On-Demand	Anodyne	SSTR5	25	40
CC(C)n1ncc(C(=O)Nc2cccc(Cl)c2S(C)(=O)=O)c1Cl	ZINC000875366346	GG	On-Demand	Anodyne	EPHB3	57	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875366374	EE	On-Demand	Anodyne	HTR1A	62	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875366374	EE	On-Demand	Anodyne	DRD2	54	44
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875366374	EE	On-Demand	Anodyne	ADRA1D	65	44
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875366374	EE	On-Demand	Anodyne	ADRA1A	57	44
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875366374	EE	On-Demand	Anodyne	ADRA1B	50	44
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875366374	EE	On-Demand	Anodyne	DRD3	54	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875366374	EE	On-Demand	Anodyne	HTR7	42	36
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875366374	EE	On-Demand	Anodyne	KCNQ2	42	35
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875366375	EE	On-Demand	Anodyne	HTR1A	62	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875366375	EE	On-Demand	Anodyne	DRD2	54	44
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875366375	EE	On-Demand	Anodyne	ADRA1D	65	44
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875366375	EE	On-Demand	Anodyne	ADRA1A	57	44
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875366375	EE	On-Demand	Anodyne	ADRA1B	50	44
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875366375	EE	On-Demand	Anodyne	DRD3	54	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875366375	EE	On-Demand	Anodyne	HTR7	42	36
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875366375	EE	On-Demand	Anodyne	KCNQ2	42	35
O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875366377	FE	On-Demand	Bother	EPHX2	16	43
O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875366379	FE	On-Demand	Bother	EPHX2	16	43
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875366381	FE	On-Demand	Anodyne	HTR1A	62	40
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875366381	FE	On-Demand	Anodyne	DRD2	55	40
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875366381	FE	On-Demand	Anodyne	ADRA1D	58	39
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875366381	FE	On-Demand	Anodyne	ADRA1A	49	39
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875366381	FE	On-Demand	Anodyne	ADRA1B	47	39
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875366381	FE	On-Demand	Anodyne	DRD3	56	39
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875366381	FE	On-Demand	Anodyne	HTR7	41	39
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875366381	FE	On-Demand	Anodyne	BIRC2	15	41
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875366383	FE	On-Demand	Anodyne	HTR1A	62	40
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875366383	FE	On-Demand	Anodyne	DRD2	55	40
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875366383	FE	On-Demand	Anodyne	ADRA1D	58	39
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875366383	FE	On-Demand	Anodyne	ADRA1A	49	39
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875366383	FE	On-Demand	Anodyne	ADRA1B	47	39
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875366383	FE	On-Demand	Anodyne	DRD3	56	39
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875366383	FE	On-Demand	Anodyne	HTR7	41	39
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875366383	FE	On-Demand	Anodyne	BIRC2	15	41
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875366385	FE	On-Demand	Anodyne	HTR1A	62	40
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875366385	FE	On-Demand	Anodyne	DRD2	55	40
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875366385	FE	On-Demand	Anodyne	ADRA1D	58	39
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875366385	FE	On-Demand	Anodyne	ADRA1A	49	39
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875366385	FE	On-Demand	Anodyne	ADRA1B	47	39
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875366385	FE	On-Demand	Anodyne	DRD3	56	39
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875366385	FE	On-Demand	Anodyne	HTR7	41	39
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875366385	FE	On-Demand	Anodyne	BIRC2	15	41
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875366387	FE	On-Demand	Anodyne	HTR1A	62	40
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875366387	FE	On-Demand	Anodyne	DRD2	55	40
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875366387	FE	On-Demand	Anodyne	ADRA1D	58	39
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875366387	FE	On-Demand	Anodyne	ADRA1A	49	39
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875366387	FE	On-Demand	Anodyne	ADRA1B	47	39
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875366387	FE	On-Demand	Anodyne	DRD3	56	39
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875366387	FE	On-Demand	Anodyne	HTR7	41	39
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875366387	FE	On-Demand	Anodyne	BIRC2	15	41
CSc1cc(C)ccc1CNC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875366389	DG	On-Demand	Anodyne	EPHX2	17	41
N#Cc1ccc(Cn2cc(NC(=O)NC[C@@H]3CCCS3)cn2)cc1	ZINC000875366390	EF	On-Demand	Mild	ITK	17	49
N#Cc1ccc(Cn2cc(NC(=O)NC[C@@H]3CCCS3)cn2)cc1	ZINC000875366390	EF	On-Demand	Mild	PANC	54	37
CSc1cc(C)ccc1CNC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875366391	DG	On-Demand	Anodyne	EPHX2	17	41
N#Cc1ccc(Cn2cc(NC(=O)NC[C@H]3CCCS3)cn2)cc1	ZINC000875366392	EF	On-Demand	Mild	ITK	17	49
N#Cc1ccc(Cn2cc(NC(=O)NC[C@H]3CCCS3)cn2)cc1	ZINC000875366392	EF	On-Demand	Mild	PANC	54	37
COc1ccccc1N1CC[C@H](NC(=O)NN=c2cc[nH]c(C)c2)C1	ZINC000875366404	ED	On-Demand	Reactive	HTR1A	42	38
COc1ccccc1N1CC[C@H](NC(=O)NN=c2cc[nH]c(C)c2)C1	ZINC000875366404	ED	On-Demand	Reactive	DRD3	44	38
COc1ccccc1N1CC[C@@H](NC(=O)NN=c2cc[nH]c(C)c2)C1	ZINC000875366406	ED	On-Demand	Reactive	HTR1A	42	38
COc1ccccc1N1CC[C@@H](NC(=O)NN=c2cc[nH]c(C)c2)C1	ZINC000875366406	ED	On-Demand	Reactive	DRD3	44	38
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@@H]3CSC[C@@H]3C2)C1=O	ZINC000875366425	GE	On-Demand	Anodyne	HTR1A	28	40
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@@H]3CSC[C@H]3C2)C1=O	ZINC000875366427	GE	On-Demand	Anodyne	HTR1A	28	40
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@H]3CSC[C@@H]3C2)C1=O	ZINC000875366431	GE	On-Demand	Anodyne	HTR1A	28	40
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@H]3CSC[C@H]3C2)C1=O	ZINC000875366435	GE	On-Demand	Anodyne	HTR1A	28	40
COc1ccccc1N1CC[C@H](NC(=O)N2CCCN(C=O)CC2)C1=O	ZINC000875366442	FC	On-Demand	Anodyne	HTR1A	33	41
COc1ccccc1N1CC[C@H](NC(=O)N2CCCN(C=O)CC2)C1=O	ZINC000875366442	FC	On-Demand	Anodyne	DRD2	22	41
COc1ccccc1N1CC[C@@H](NC(=O)N2CCCN(C=O)CC2)C1=O	ZINC000875366443	FC	On-Demand	Anodyne	HTR1A	33	41
COc1ccccc1N1CC[C@@H](NC(=O)N2CCCN(C=O)CC2)C1=O	ZINC000875366443	FC	On-Demand	Anodyne	DRD2	22	41
COc1ccccc1N1CC[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1=O	ZINC000875366446	GC	On-Demand	Anodyne	HTR1A	48	41
COc1ccccc1N1CC[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1=O	ZINC000875366446	GC	On-Demand	Anodyne	DRD2	43	41
COc1ccccc1N1CC[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1=O	ZINC000875366446	GC	On-Demand	Anodyne	DRD4	37	41
COc1ccccc1N1CC[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1=O	ZINC000875366446	GC	On-Demand	Anodyne	DRD3	44	41
COc1ccccc1N1CC[C@@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1=O	ZINC000875366447	GC	On-Demand	Anodyne	HTR1A	48	41
COc1ccccc1N1CC[C@@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1=O	ZINC000875366447	GC	On-Demand	Anodyne	DRD2	43	41
COc1ccccc1N1CC[C@@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1=O	ZINC000875366447	GC	On-Demand	Anodyne	DRD4	37	41
COc1ccccc1N1CC[C@@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1=O	ZINC000875366447	GC	On-Demand	Anodyne	DRD3	44	41
O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N1CCCC(F)(F)CC1	ZINC000875366449	EH	On-Demand	Bother	EPHX2	15	43
O=C(N[C@H]1CCN(C(=O)CCc2ccccc2)C1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875366452	GG	On-Demand	Anodyne	C3AR1	40	41
O=C(N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875366453	GG	On-Demand	Anodyne	C3AR1	40	41
O=C(N[C@H]1CCN(C(=O)CCc2ccccc2)C1)NC1([C@H]2CCCCO2)CCC1	ZINC000875366454	GG	On-Demand	Anodyne	C3AR1	40	41
O=C(N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)NC1([C@H]2CCCCO2)CCC1	ZINC000875366455	GG	On-Demand	Anodyne	C3AR1	40	41
O=C(N[C@H]1CCN(C(=O)CCc2ccccc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875366482	FC	On-Demand	Anodyne	GRIN2B	15	42
O=C(N[C@H]1CCN(C(=O)CCc2ccccc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875366482	FC	On-Demand	Anodyne	C3AR1	42	43
O=C(N[C@H]1CCN(C(=O)CCc2ccccc2)C1)N[C@@H]1CCOC[C@H]1O	ZINC000875366482	FC	On-Demand	Anodyne	EPHX2	22	42
COc1ccccc1N1CC[C@@H](NC(=O)NC2(C)CC(F)(F)C2)C1=O	ZINC000875366611	FE	On-Demand	Anodyne	HTR1A	32	41
COc1ccccc1N1CC[C@@H](NC(=O)NC2(C)CC(F)(F)C2)C1=O	ZINC000875366611	FE	On-Demand	Anodyne	DRD2	22	41
COc1ccccc1N1CC[C@H](NC(=O)NC2(C)CC(F)(F)C2)C1=O	ZINC000875366612	FE	On-Demand	Anodyne	HTR1A	32	41
COc1ccccc1N1CC[C@H](NC(=O)NC2(C)CC(F)(F)C2)C1=O	ZINC000875366612	FE	On-Demand	Anodyne	DRD2	22	41
COc1ccccc1N1CC[C@@H](NC(=O)N2C[C@H]3C(=O)N(C)C(=O)[C@H]3C2)C1=O	ZINC000875366621	GC	On-Demand	Anodyne	HTR1A	52	43
COc1ccccc1N1CC[C@@H](NC(=O)N2C[C@H]3C(=O)N(C)C(=O)[C@H]3C2)C1=O	ZINC000875366621	GC	On-Demand	Anodyne	DRD2	36	42
COc1ccccc1N1CC[C@@H](NC(=O)N2C[C@H]3C(=O)N(C)C(=O)[C@H]3C2)C1=O	ZINC000875366621	GC	On-Demand	Anodyne	DRD3	47	36
COc1ccccc1N1CC[C@H](NC(=O)N2C[C@H]3C(=O)N(C)C(=O)[C@H]3C2)C1=O	ZINC000875366622	GC	On-Demand	Anodyne	HTR1A	52	43
COc1ccccc1N1CC[C@H](NC(=O)N2C[C@H]3C(=O)N(C)C(=O)[C@H]3C2)C1=O	ZINC000875366622	GC	On-Demand	Anodyne	DRD2	36	42
COc1ccccc1N1CC[C@H](NC(=O)N2C[C@H]3C(=O)N(C)C(=O)[C@H]3C2)C1=O	ZINC000875366622	GC	On-Demand	Anodyne	DRD3	47	36
Cc1ccccc1[C@H](C)NC(=O)/C=C\c1ccc(Br)o1	ZINC000875366628	EI	On-Demand	Anodyne	UL26	101	54
Cc1ccccc1[C@H](C)NC(=O)/C=C\c1ccc(Br)o1	ZINC000875366628	EI	On-Demand	Anodyne	SCAF_EBVB9	88	54
Cc1ccccc1[C@@H](C)NC(=O)/C=C\c1ccc(Br)o1	ZINC000875366629	EI	On-Demand	Anodyne	UL26	101	54
Cc1ccccc1[C@@H](C)NC(=O)/C=C\c1ccc(Br)o1	ZINC000875366629	EI	On-Demand	Anodyne	SCAF_EBVB9	88	54
O=C1c2ccccc2S(=O)(=O)N1Cc1cc(=O)c(O)co1	ZINC000875366634	DC	On-Demand	Anodyne	DAO	22	46
O=C(CCc1ccccc1)N1CC[C@@H](NC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875366640	GC	On-Demand	Anodyne	GHRHR	42	33
O=C(CCc1ccccc1)N1CC[C@@H](NC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875366640	GC	On-Demand	Anodyne	GRIN2B	18	44
O=C(CCc1ccccc1)N1CC[C@@H](NC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875366640	GC	On-Demand	Anodyne	SIGMAR1	15	43
O=C(CCc1ccccc1)N1CC[C@@H](NC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875366640	GC	On-Demand	Anodyne	C3AR1	43	45
O=C(CCc1ccccc1)N1CC[C@@H](NC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875366640	GC	On-Demand	Anodyne	EPHX2	29	42
O=C(CCc1ccccc1)N1CC[C@@H](NC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875366640	GC	On-Demand	Anodyne	BIRC2	18	40
O=C(CCc1ccccc1)N1CC[C@H](NC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875366641	GC	On-Demand	Anodyne	GHRHR	42	33
O=C(CCc1ccccc1)N1CC[C@H](NC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875366641	GC	On-Demand	Anodyne	GRIN2B	18	44
O=C(CCc1ccccc1)N1CC[C@H](NC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875366641	GC	On-Demand	Anodyne	SIGMAR1	15	43
O=C(CCc1ccccc1)N1CC[C@H](NC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875366641	GC	On-Demand	Anodyne	C3AR1	43	45
O=C(CCc1ccccc1)N1CC[C@H](NC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875366641	GC	On-Demand	Anodyne	EPHX2	29	42
O=C(CCc1ccccc1)N1CC[C@H](NC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875366641	GC	On-Demand	Anodyne	BIRC2	18	40
COc1ccccc1N1CC[C@H](NC(=O)N2CCCN(C=O)CC2)C1	ZINC000875366656	ED	On-Demand	Anodyne	HTR1A	56	43
COc1ccccc1N1CC[C@H](NC(=O)N2CCCN(C=O)CC2)C1	ZINC000875366656	ED	On-Demand	Anodyne	DRD2	49	40
COc1ccccc1N1CC[C@H](NC(=O)N2CCCN(C=O)CC2)C1	ZINC000875366656	ED	On-Demand	Anodyne	ADRA1D	46	38
COc1ccccc1N1CC[C@H](NC(=O)N2CCCN(C=O)CC2)C1	ZINC000875366656	ED	On-Demand	Anodyne	ADRA1A	41	38
COc1ccccc1N1CC[C@H](NC(=O)N2CCCN(C=O)CC2)C1	ZINC000875366656	ED	On-Demand	Anodyne	DRD3	54	37
COc1ccccc1N1CC[C@H](NC(=O)N2CCCN(C=O)CC2)C1	ZINC000875366656	ED	On-Demand	Anodyne	HTR7	42	39
COc1ccccc1N1CC[C@@H](NC(=O)N2CCCN(C=O)CC2)C1	ZINC000875366657	ED	On-Demand	Anodyne	HTR1A	56	43
COc1ccccc1N1CC[C@@H](NC(=O)N2CCCN(C=O)CC2)C1	ZINC000875366657	ED	On-Demand	Anodyne	DRD2	49	40
COc1ccccc1N1CC[C@@H](NC(=O)N2CCCN(C=O)CC2)C1	ZINC000875366657	ED	On-Demand	Anodyne	ADRA1D	46	38
COc1ccccc1N1CC[C@@H](NC(=O)N2CCCN(C=O)CC2)C1	ZINC000875366657	ED	On-Demand	Anodyne	ADRA1A	41	38
COc1ccccc1N1CC[C@@H](NC(=O)N2CCCN(C=O)CC2)C1	ZINC000875366657	ED	On-Demand	Anodyne	DRD3	54	37
COc1ccccc1N1CC[C@@H](NC(=O)N2CCCN(C=O)CC2)C1	ZINC000875366657	ED	On-Demand	Anodyne	HTR7	42	39
COc1ccccc1N1CC[C@H](NC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875366663	FD	On-Demand	Anodyne	HTR1A	74	45
COc1ccccc1N1CC[C@H](NC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875366663	FD	On-Demand	Anodyne	DRD2	61	41
COc1ccccc1N1CC[C@H](NC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875366663	FD	On-Demand	Anodyne	DRD4	39	41
COc1ccccc1N1CC[C@H](NC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875366663	FD	On-Demand	Anodyne	ADRA1D	68	45
COc1ccccc1N1CC[C@H](NC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875366663	FD	On-Demand	Anodyne	ADRA1A	59	45
COc1ccccc1N1CC[C@H](NC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875366663	FD	On-Demand	Anodyne	ADRA1B	56	45
COc1ccccc1N1CC[C@H](NC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875366663	FD	On-Demand	Anodyne	DRD3	60	39
COc1ccccc1N1CC[C@H](NC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875366663	FD	On-Demand	Anodyne	HTR7	51	38
COc1ccccc1N1CC[C@H](NC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875366663	FD	On-Demand	Anodyne	KCNA3	41	37
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875366664	FD	On-Demand	Anodyne	HTR1A	74	45
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875366664	FD	On-Demand	Anodyne	DRD2	61	41
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875366664	FD	On-Demand	Anodyne	DRD4	39	41
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875366664	FD	On-Demand	Anodyne	ADRA1D	68	45
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875366664	FD	On-Demand	Anodyne	ADRA1A	59	45
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875366664	FD	On-Demand	Anodyne	ADRA1B	56	45
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875366664	FD	On-Demand	Anodyne	DRD3	60	39
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875366664	FD	On-Demand	Anodyne	HTR7	51	38
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC(CO)(CO)CC2)C1	ZINC000875366664	FD	On-Demand	Anodyne	KCNA3	41	37
O=C(Nc1cccc2nccn12)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875366686	DF	On-Demand	Anodyne	DRD4	39	44
O=C(Nc1cccc2nccn12)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875366686	DF	On-Demand	Anodyne	ACHE	38	42
O=C(Nc1cccc2nccn12)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875366686	DF	On-Demand	Anodyne	LTA4H	18	40
O=C(Nc1cccc2nccn12)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875366686	DF	On-Demand	Anodyne	SIGMAR1	39	51
O=C(Nc1cccc2nccn12)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875366686	DF	On-Demand	Anodyne	SLC18A3	18	40
O=C(Nc1cccc2nccn12)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875366687	DF	On-Demand	Anodyne	DRD4	39	44
O=C(Nc1cccc2nccn12)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875366687	DF	On-Demand	Anodyne	ACHE	38	42
O=C(Nc1cccc2nccn12)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875366687	DF	On-Demand	Anodyne	LTA4H	18	40
O=C(Nc1cccc2nccn12)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875366687	DF	On-Demand	Anodyne	SIGMAR1	39	51
O=C(Nc1cccc2nccn12)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875366687	DF	On-Demand	Anodyne	SLC18A3	18	40
CN1CCCN(C(=O)c2c(C(F)F)nc3n2CCCC3)c2cc(Cl)ccc21	ZINC000875366730	GI	On-Demand	Anodyne	CNR1	50	31
COc1ccccc1N1CC[C@H](NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1	ZINC000875366746	FF	On-Demand	Anodyne	HTR1A	62	40
COc1ccccc1N1CC[C@H](NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1	ZINC000875366746	FF	On-Demand	Anodyne	DRD2	57	43
COc1ccccc1N1CC[C@H](NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1	ZINC000875366746	FF	On-Demand	Anodyne	ADRA1D	69	40
COc1ccccc1N1CC[C@H](NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1	ZINC000875366746	FF	On-Demand	Anodyne	ADRA1A	58	40
COc1ccccc1N1CC[C@H](NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1	ZINC000875366746	FF	On-Demand	Anodyne	ADRA1B	55	40
COc1ccccc1N1CC[C@H](NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1	ZINC000875366746	FF	On-Demand	Anodyne	DRD3	57	43
COc1ccccc1N1CC[C@H](NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1	ZINC000875366746	FF	On-Demand	Anodyne	HTR7	42	38
COc1ccccc1N1CC[C@@H](NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1	ZINC000875366747	FF	On-Demand	Anodyne	HTR1A	62	40
COc1ccccc1N1CC[C@@H](NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1	ZINC000875366747	FF	On-Demand	Anodyne	DRD2	57	43
COc1ccccc1N1CC[C@@H](NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1	ZINC000875366747	FF	On-Demand	Anodyne	ADRA1D	69	40
COc1ccccc1N1CC[C@@H](NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1	ZINC000875366747	FF	On-Demand	Anodyne	ADRA1A	58	40
COc1ccccc1N1CC[C@@H](NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1	ZINC000875366747	FF	On-Demand	Anodyne	ADRA1B	55	40
COc1ccccc1N1CC[C@@H](NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1	ZINC000875366747	FF	On-Demand	Anodyne	DRD3	57	43
COc1ccccc1N1CC[C@@H](NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1	ZINC000875366747	FF	On-Demand	Anodyne	HTR7	42	38
COc1ccccc1N1CC[C@H](NC(=O)N2CCCCCCNC(=O)CC2)C1	ZINC000875366750	GE	On-Demand	Anodyne	HTR1A	53	42
COc1ccccc1N1CC[C@H](NC(=O)N2CCCCCCNC(=O)CC2)C1	ZINC000875366750	GE	On-Demand	Anodyne	DRD2	42	42
COc1ccccc1N1CC[C@H](NC(=O)N2CCCCCCNC(=O)CC2)C1	ZINC000875366750	GE	On-Demand	Anodyne	ADRA1D	40	36
COc1ccccc1N1CC[C@H](NC(=O)N2CCCCCCNC(=O)CC2)C1	ZINC000875366750	GE	On-Demand	Anodyne	DRD3	42	36
COc1ccccc1N1CC[C@@H](NC(=O)N2CCCCCCNC(=O)CC2)C1	ZINC000875366751	GE	On-Demand	Anodyne	HTR1A	53	42
COc1ccccc1N1CC[C@@H](NC(=O)N2CCCCCCNC(=O)CC2)C1	ZINC000875366751	GE	On-Demand	Anodyne	DRD2	42	42
COc1ccccc1N1CC[C@@H](NC(=O)N2CCCCCCNC(=O)CC2)C1	ZINC000875366751	GE	On-Demand	Anodyne	ADRA1D	40	36
COc1ccccc1N1CC[C@@H](NC(=O)N2CCCCCCNC(=O)CC2)C1	ZINC000875366751	GE	On-Demand	Anodyne	DRD3	42	36
Cc1ccccc1[C@H](C)NC(=O)/C=C\c1ccccc1	ZINC000875366778	CH	On-Demand	Anodyne	KCNQ2	48	37
Cc1ccccc1[C@H](C)NC(=O)/C=C\c1ccccc1	ZINC000875366778	CH	On-Demand	Anodyne	HDAC8	45	39
Cc1ccccc1[C@H](C)NC(=O)/C=C\c1ccccc1	ZINC000875366778	CH	On-Demand	Anodyne	F3	19	47
Cc1ccccc1[C@H](C)NC(=O)/C=C\c1ccccc1	ZINC000875366778	CH	On-Demand	Anodyne	MMP2	16	56
Cc1ccccc1[C@H](C)NC(=O)/C=C\c1ccccc1	ZINC000875366778	CH	On-Demand	Anodyne	HDAC6	27	51
Cc1ccccc1[C@H](C)NC(=O)/C=C\c1ccccc1	ZINC000875366778	CH	On-Demand	Anodyne	MMP9	15	56
Cc1ccccc1[C@H](C)NC(=O)/C=C\c1ccccc1	ZINC000875366778	CH	On-Demand	Anodyne	UL26	94	50
Cc1ccccc1[C@H](C)NC(=O)/C=C\c1ccccc1	ZINC000875366778	CH	On-Demand	Anodyne	SCAF_EBVB9	80	50
Cc1ccccc1[C@H](C)NC(=O)/C=C\c1ccccc1	ZINC000875366778	CH	On-Demand	Anodyne	CTSA	40	34
Cc1ccccc1[C@@H](C)NC(=O)/C=C\c1ccccc1	ZINC000875366780	CH	On-Demand	Anodyne	KCNQ2	48	37
Cc1ccccc1[C@@H](C)NC(=O)/C=C\c1ccccc1	ZINC000875366780	CH	On-Demand	Anodyne	HDAC8	45	39
Cc1ccccc1[C@@H](C)NC(=O)/C=C\c1ccccc1	ZINC000875366780	CH	On-Demand	Anodyne	F3	19	47
Cc1ccccc1[C@@H](C)NC(=O)/C=C\c1ccccc1	ZINC000875366780	CH	On-Demand	Anodyne	MMP2	16	56
Cc1ccccc1[C@@H](C)NC(=O)/C=C\c1ccccc1	ZINC000875366780	CH	On-Demand	Anodyne	HDAC6	27	51
Cc1ccccc1[C@@H](C)NC(=O)/C=C\c1ccccc1	ZINC000875366780	CH	On-Demand	Anodyne	MMP9	15	56
Cc1ccccc1[C@@H](C)NC(=O)/C=C\c1ccccc1	ZINC000875366780	CH	On-Demand	Anodyne	UL26	94	50
Cc1ccccc1[C@@H](C)NC(=O)/C=C\c1ccccc1	ZINC000875366780	CH	On-Demand	Anodyne	SCAF_EBVB9	80	50
Cc1ccccc1[C@@H](C)NC(=O)/C=C\c1ccccc1	ZINC000875366780	CH	On-Demand	Anodyne	CTSA	40	34
CN1CCN(C(=O)N[C@H]2CCN(C(=O)CCc3ccccc3)C2)CCC1(C)C	ZINC000875366792	GE	On-Demand	Anodyne	GHRHR	41	32
CN1CCN(C(=O)N[C@H]2CCN(C(=O)CCc3ccccc3)C2)CCC1(C)C	ZINC000875366792	GE	On-Demand	Anodyne	SIGMAR1	16	42
CN1CCN(C(=O)N[C@H]2CCN(C(=O)CCc3ccccc3)C2)CCC1(C)C	ZINC000875366792	GE	On-Demand	Anodyne	C3AR1	41	45
CC(=O)C1CCN(C(=O)C(=O)NCC2(CCOCc3ccccc3)CC2)CC1	ZINC000875366793	GE	On-Demand	Anodyne	SLC12A5	51	33
CC(=O)C1CCN(C(=O)C(=O)NCC2(CCOCc3ccccc3)CC2)CC1	ZINC000875366793	GE	On-Demand	Anodyne	HCN1	40	31
CC(=O)C1CCN(C(=O)C(=O)NCC2(CCOCc3ccccc3)CC2)CC1	ZINC000875366793	GE	On-Demand	Anodyne	HCN4	40	31
CN1CCN(C(=O)N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)CCC1(C)C	ZINC000875366794	GE	On-Demand	Anodyne	GHRHR	41	32
CN1CCN(C(=O)N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)CCC1(C)C	ZINC000875366794	GE	On-Demand	Anodyne	SIGMAR1	16	42
CN1CCN(C(=O)N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)CCC1(C)C	ZINC000875366794	GE	On-Demand	Anodyne	C3AR1	41	45
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@@H](C(C)=O)C2)C1=O	ZINC000875366880	FD	On-Demand	Anodyne	HTR1A	36	48
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@@H](C(C)=O)C2)C1=O	ZINC000875366880	FD	On-Demand	Anodyne	DRD2	26	46
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@H](C(C)=O)C2)C1=O	ZINC000875366881	FD	On-Demand	Anodyne	HTR1A	36	48
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@H](C(C)=O)C2)C1=O	ZINC000875366881	FD	On-Demand	Anodyne	DRD2	26	46
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@@H](C(C)=O)C2)C1=O	ZINC000875366882	FD	On-Demand	Anodyne	HTR1A	36	48
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@@H](C(C)=O)C2)C1=O	ZINC000875366882	FD	On-Demand	Anodyne	DRD2	26	46
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@H](C(C)=O)C2)C1=O	ZINC000875366883	FD	On-Demand	Anodyne	HTR1A	36	48
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@H](C(C)=O)C2)C1=O	ZINC000875366883	FD	On-Demand	Anodyne	DRD2	26	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875366941	FE	On-Demand	Anodyne	HTR1A	53	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875366941	FE	On-Demand	Anodyne	DRD2	48	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875366941	FE	On-Demand	Anodyne	ADRA1D	62	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875366941	FE	On-Demand	Anodyne	ADRA1A	51	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875366941	FE	On-Demand	Anodyne	ADRA1B	50	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875366941	FE	On-Demand	Anodyne	DRD3	49	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875366941	FE	On-Demand	Anodyne	SLC6A3	45	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875366942	FE	On-Demand	Anodyne	HTR1A	53	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875366942	FE	On-Demand	Anodyne	DRD2	48	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875366942	FE	On-Demand	Anodyne	ADRA1D	62	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875366942	FE	On-Demand	Anodyne	ADRA1A	51	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875366942	FE	On-Demand	Anodyne	ADRA1B	50	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875366942	FE	On-Demand	Anodyne	DRD3	49	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875366942	FE	On-Demand	Anodyne	SLC6A3	45	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875366944	FE	On-Demand	Anodyne	HTR1A	53	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875366944	FE	On-Demand	Anodyne	DRD2	48	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875366944	FE	On-Demand	Anodyne	ADRA1D	62	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875366944	FE	On-Demand	Anodyne	ADRA1A	51	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875366944	FE	On-Demand	Anodyne	ADRA1B	50	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875366944	FE	On-Demand	Anodyne	DRD3	49	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875366944	FE	On-Demand	Anodyne	SLC6A3	45	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875366946	FE	On-Demand	Anodyne	HTR1A	53	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875366946	FE	On-Demand	Anodyne	DRD2	48	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875366946	FE	On-Demand	Anodyne	ADRA1D	62	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875366946	FE	On-Demand	Anodyne	ADRA1A	51	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875366946	FE	On-Demand	Anodyne	ADRA1B	50	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875366946	FE	On-Demand	Anodyne	DRD3	49	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875366946	FE	On-Demand	Anodyne	SLC6A3	45	39
COC(=O)N(C)NC(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875366948	DD	On-Demand	Reactive	HTR1A	66	41
COC(=O)N(C)NC(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875366948	DD	On-Demand	Reactive	DRD2	56	43
COC(=O)N(C)NC(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875366948	DD	On-Demand	Reactive	DRD4	35	41
COC(=O)N(C)NC(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875366948	DD	On-Demand	Reactive	ADRA1D	63	43
COC(=O)N(C)NC(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875366948	DD	On-Demand	Reactive	ADRA1A	54	43
COC(=O)N(C)NC(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875366948	DD	On-Demand	Reactive	ADRA1B	50	43
COC(=O)N(C)NC(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875366948	DD	On-Demand	Reactive	DRD3	61	41
COC(=O)N(C)NC(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875366948	DD	On-Demand	Reactive	HTR7	49	38
COC(=O)N(C)NC(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000875366948	DD	On-Demand	Reactive	MTNR1B	15	44
COC(=O)N(C)NC(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875366950	DD	On-Demand	Reactive	HTR1A	66	41
COC(=O)N(C)NC(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875366950	DD	On-Demand	Reactive	DRD2	56	43
COC(=O)N(C)NC(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875366950	DD	On-Demand	Reactive	DRD4	35	41
COC(=O)N(C)NC(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875366950	DD	On-Demand	Reactive	ADRA1D	63	43
COC(=O)N(C)NC(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875366950	DD	On-Demand	Reactive	ADRA1A	54	43
COC(=O)N(C)NC(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875366950	DD	On-Demand	Reactive	ADRA1B	50	43
COC(=O)N(C)NC(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875366950	DD	On-Demand	Reactive	DRD3	61	41
COC(=O)N(C)NC(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875366950	DD	On-Demand	Reactive	HTR7	49	38
COC(=O)N(C)NC(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000875366950	DD	On-Demand	Reactive	MTNR1B	15	44
COc1ccccc1N1CC[C@@H](NC(=O)N[C@@H]2CCOC[C@H]2O)C1	ZINC000875366967	EC	On-Demand	Anodyne	HTR1A	53	40
COc1ccccc1N1CC[C@@H](NC(=O)N[C@@H]2CCOC[C@H]2O)C1	ZINC000875366967	EC	On-Demand	Anodyne	DRD2	46	41
COc1ccccc1N1CC[C@@H](NC(=O)N[C@@H]2CCOC[C@H]2O)C1	ZINC000875366967	EC	On-Demand	Anodyne	ADRA1D	56	41
COc1ccccc1N1CC[C@@H](NC(=O)N[C@@H]2CCOC[C@H]2O)C1	ZINC000875366967	EC	On-Demand	Anodyne	ADRA1A	46	41
COc1ccccc1N1CC[C@@H](NC(=O)N[C@@H]2CCOC[C@H]2O)C1	ZINC000875366967	EC	On-Demand	Anodyne	ADRA1B	45	41
COc1ccccc1N1CC[C@@H](NC(=O)N[C@@H]2CCOC[C@H]2O)C1	ZINC000875366967	EC	On-Demand	Anodyne	DRD3	53	38
O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N1CCC[C@H](OC2CCC2)CC1	ZINC000875366975	GH	On-Demand	Bother	EPHX2	22	48
O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875366979	GH	On-Demand	Bother	EPHX2	22	48
COc1ccccc1N1CC[C@@H](NC(=O)NNc2nnc(C)n2C)C1	ZINC000875366981	ED	On-Demand	Reactive	HTR1A	61	39
COc1ccccc1N1CC[C@@H](NC(=O)NNc2nnc(C)n2C)C1	ZINC000875366981	ED	On-Demand	Reactive	DRD2	47	39
COc1ccccc1N1CC[C@@H](NC(=O)NNc2nnc(C)n2C)C1	ZINC000875366981	ED	On-Demand	Reactive	ADRA1D	51	39
COc1ccccc1N1CC[C@@H](NC(=O)NNc2nnc(C)n2C)C1	ZINC000875366981	ED	On-Demand	Reactive	ADRA1A	44	39
COc1ccccc1N1CC[C@@H](NC(=O)NNc2nnc(C)n2C)C1	ZINC000875366981	ED	On-Demand	Reactive	ADRA1B	40	39
COc1ccccc1N1CC[C@@H](NC(=O)NNc2nnc(C)n2C)C1	ZINC000875366981	ED	On-Demand	Reactive	DRD3	54	37
COc1ccccc1N1CC[C@@H](NC(=O)NNc2nnc(C)n2C)C1	ZINC000875366981	ED	On-Demand	Reactive	HTR7	40	36
COc1ccccc1N1CC[C@H](NC(=O)NNc2nnc(C)n2C)C1	ZINC000875366983	ED	On-Demand	Reactive	HTR1A	61	39
COc1ccccc1N1CC[C@H](NC(=O)NNc2nnc(C)n2C)C1	ZINC000875366983	ED	On-Demand	Reactive	DRD2	47	39
COc1ccccc1N1CC[C@H](NC(=O)NNc2nnc(C)n2C)C1	ZINC000875366983	ED	On-Demand	Reactive	ADRA1D	51	39
COc1ccccc1N1CC[C@H](NC(=O)NNc2nnc(C)n2C)C1	ZINC000875366983	ED	On-Demand	Reactive	ADRA1A	44	39
COc1ccccc1N1CC[C@H](NC(=O)NNc2nnc(C)n2C)C1	ZINC000875366983	ED	On-Demand	Reactive	ADRA1B	40	39
COc1ccccc1N1CC[C@H](NC(=O)NNc2nnc(C)n2C)C1	ZINC000875366983	ED	On-Demand	Reactive	DRD3	54	37
COc1ccccc1N1CC[C@H](NC(=O)NNc2nnc(C)n2C)C1	ZINC000875366983	ED	On-Demand	Reactive	HTR7	40	36
C[C@H](NC(=O)C(=O)NCC1(CCOCc2ccccc2)CC1)c1ccnn1C	ZINC000875367015	GE	On-Demand	Anodyne	CAPN2	73	32
C[C@H](NC(=O)C(=O)NCC1(CCOCc2ccccc2)CC1)c1ccnn1C	ZINC000875367015	GE	On-Demand	Anodyne	HCN1	47	32
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@H](C(C)(C)O)C2)C1=O	ZINC000875367037	FD	On-Demand	Anodyne	HTR1A	35	40
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@@H](C(C)(C)O)C2)C1=O	ZINC000875367039	FD	On-Demand	Anodyne	HTR1A	35	40
COc1ccccc1N1CC[C@@H](NC(=O)N2CC[C@H](C(C)(C)O)C2)C1=O	ZINC000875367041	FD	On-Demand	Anodyne	HTR1A	35	40
COc1ccccc1N1CC[C@@H](NC(=O)N2CC[C@@H](C(C)(C)O)C2)C1=O	ZINC000875367042	FD	On-Demand	Anodyne	HTR1A	35	40
CC[C@@H]1CCC[C@@H]1NC(=O)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875367055	GI	On-Demand	Anodyne	EPHX2	15	45
CC[C@H]1CCC[C@@H]1NC(=O)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875367056	GI	On-Demand	Anodyne	EPHX2	15	45
CC[C@H]1CCC[C@H]1NC(=O)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875367058	GI	On-Demand	Anodyne	EPHX2	15	45
CC[C@@H]1CCC[C@H]1NC(=O)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875367060	GI	On-Demand	Anodyne	EPHX2	15	45
COc1ccc(OC(F)F)c(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875367109	GH	On-Demand	Anodyne	EPHX2	21	45
COc1ccc(OC(F)F)c(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875367110	GH	On-Demand	Anodyne	EPHX2	21	45
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C)cc1SC	ZINC000875367117	EF	On-Demand	Anodyne	SLC6A4	29	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C)cc1SC	ZINC000875367117	EF	On-Demand	Anodyne	SLC6A3	62	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C)cc1SC	ZINC000875367119	EF	On-Demand	Anodyne	SLC6A4	29	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C)cc1SC	ZINC000875367119	EF	On-Demand	Anodyne	SLC6A3	62	41
O=C(CN1C(=O)c2ccccc2S1(=O)=O)NC[C@H](c1ccccc1Cl)N1CCCC1	ZINC000875367126	IE	On-Demand	Anodyne	ELANE	20	44
O=C(CN1C(=O)c2ccccc2S1(=O)=O)NC[C@@H](c1ccccc1Cl)N1CCCC1	ZINC000875367128	IE	On-Demand	Anodyne	ELANE	20	44
O=C(NCC[C@H](O)C1CCCC1)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875367139	GE	On-Demand	Anodyne	GRIN2B	21	42
O=C(NCC[C@H](O)C1CCCC1)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875367139	GE	On-Demand	Anodyne	C3AR1	49	49
O=C(NCC[C@H](O)C1CCCC1)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875367139	GE	On-Demand	Anodyne	EPHX2	32	51
O=C(NCC[C@H](O)C1CCCC1)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875367139	GE	On-Demand	Anodyne	BIRC2	27	46
O=C(NCC[C@H](O)C1CCCC1)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875367141	GE	On-Demand	Anodyne	GRIN2B	21	42
O=C(NCC[C@H](O)C1CCCC1)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875367141	GE	On-Demand	Anodyne	C3AR1	49	49
O=C(NCC[C@H](O)C1CCCC1)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875367141	GE	On-Demand	Anodyne	EPHX2	32	51
O=C(NCC[C@H](O)C1CCCC1)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875367141	GE	On-Demand	Anodyne	BIRC2	27	46
O=C(NCC[C@@H](O)C1CCCC1)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875367144	GE	On-Demand	Anodyne	GRIN2B	21	42
O=C(NCC[C@@H](O)C1CCCC1)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875367144	GE	On-Demand	Anodyne	C3AR1	49	49
O=C(NCC[C@@H](O)C1CCCC1)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875367144	GE	On-Demand	Anodyne	EPHX2	32	51
O=C(NCC[C@@H](O)C1CCCC1)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875367144	GE	On-Demand	Anodyne	BIRC2	27	46
O=C(NCC[C@@H](O)C1CCCC1)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875367145	GE	On-Demand	Anodyne	GRIN2B	21	42
O=C(NCC[C@@H](O)C1CCCC1)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875367145	GE	On-Demand	Anodyne	C3AR1	49	49
O=C(NCC[C@@H](O)C1CCCC1)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875367145	GE	On-Demand	Anodyne	EPHX2	32	51
O=C(NCC[C@@H](O)C1CCCC1)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875367145	GE	On-Demand	Anodyne	BIRC2	27	46
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(c4ccccc4OC)C3)C[C@@H]1C2	ZINC000875367148	FD	On-Demand	Anodyne	HTR1A	49	45
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(c4ccccc4OC)C3)C[C@@H]1C2	ZINC000875367148	FD	On-Demand	Anodyne	DRD2	42	41
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(c4ccccc4OC)C3)C[C@@H]1C2	ZINC000875367148	FD	On-Demand	Anodyne	ADRA1D	46	41
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(c4ccccc4OC)C3)C[C@@H]1C2	ZINC000875367148	FD	On-Demand	Anodyne	ADRA1A	38	41
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(c4ccccc4OC)C3)C[C@@H]1C2	ZINC000875367148	FD	On-Demand	Anodyne	ADRA1B	37	41
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(c4ccccc4OC)C3)C[C@@H]1C2	ZINC000875367148	FD	On-Demand	Anodyne	DRD3	48	38
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(c4ccccc4OC)C3)C[C@@H]1C2	ZINC000875367149	FD	On-Demand	Anodyne	HTR1A	49	45
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(c4ccccc4OC)C3)C[C@@H]1C2	ZINC000875367149	FD	On-Demand	Anodyne	DRD2	42	41
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(c4ccccc4OC)C3)C[C@@H]1C2	ZINC000875367149	FD	On-Demand	Anodyne	ADRA1D	46	41
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(c4ccccc4OC)C3)C[C@@H]1C2	ZINC000875367149	FD	On-Demand	Anodyne	ADRA1A	38	41
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(c4ccccc4OC)C3)C[C@@H]1C2	ZINC000875367149	FD	On-Demand	Anodyne	ADRA1B	37	41
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(c4ccccc4OC)C3)C[C@@H]1C2	ZINC000875367149	FD	On-Demand	Anodyne	DRD3	48	38
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(C(=O)CCc4ccccc4)C3)C[C@@H]1C2	ZINC000875367153	GD	On-Demand	Anodyne	GRIN2B	16	42
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(C(=O)CCc4ccccc4)C3)C[C@@H]1C2	ZINC000875367153	GD	On-Demand	Anodyne	C3AR1	40	40
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(C(=O)CCc4ccccc4)C3)C[C@@H]1C2	ZINC000875367153	GD	On-Demand	Anodyne	EPHX2	34	40
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(C(=O)CCc4ccccc4)C3)C[C@@H]1C2	ZINC000875367155	GD	On-Demand	Anodyne	GRIN2B	16	42
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(C(=O)CCc4ccccc4)C3)C[C@@H]1C2	ZINC000875367155	GD	On-Demand	Anodyne	C3AR1	40	40
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(C(=O)CCc4ccccc4)C3)C[C@@H]1C2	ZINC000875367155	GD	On-Demand	Anodyne	EPHX2	34	40
COc1ccccc1N1CC[C@H](NC(=O)N2CCC(C(=O)NCCO)CC2)C1	ZINC000875367180	GC	On-Demand	Anodyne	HTR1A	63	53
COc1ccccc1N1CC[C@H](NC(=O)N2CCC(C(=O)NCCO)CC2)C1	ZINC000875367180	GC	On-Demand	Anodyne	DRD2	57	52
COc1ccccc1N1CC[C@H](NC(=O)N2CCC(C(=O)NCCO)CC2)C1	ZINC000875367180	GC	On-Demand	Anodyne	DRD4	35	44
COc1ccccc1N1CC[C@H](NC(=O)N2CCC(C(=O)NCCO)CC2)C1	ZINC000875367180	GC	On-Demand	Anodyne	ADRA1D	49	37
COc1ccccc1N1CC[C@H](NC(=O)N2CCC(C(=O)NCCO)CC2)C1	ZINC000875367180	GC	On-Demand	Anodyne	HTR2A	15	41
COc1ccccc1N1CC[C@H](NC(=O)N2CCC(C(=O)NCCO)CC2)C1	ZINC000875367180	GC	On-Demand	Anodyne	ADRA1A	44	37
COc1ccccc1N1CC[C@H](NC(=O)N2CCC(C(=O)NCCO)CC2)C1	ZINC000875367180	GC	On-Demand	Anodyne	DRD3	64	48
COc1ccccc1N1CC[C@H](NC(=O)N2CCC(C(=O)NCCO)CC2)C1	ZINC000875367180	GC	On-Demand	Anodyne	HTR7	44	37
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC(C(=O)NCCO)CC2)C1	ZINC000875367182	GC	On-Demand	Anodyne	HTR1A	63	53
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC(C(=O)NCCO)CC2)C1	ZINC000875367182	GC	On-Demand	Anodyne	DRD2	57	52
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC(C(=O)NCCO)CC2)C1	ZINC000875367182	GC	On-Demand	Anodyne	DRD4	35	44
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC(C(=O)NCCO)CC2)C1	ZINC000875367182	GC	On-Demand	Anodyne	ADRA1D	49	37
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC(C(=O)NCCO)CC2)C1	ZINC000875367182	GC	On-Demand	Anodyne	HTR2A	15	41
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC(C(=O)NCCO)CC2)C1	ZINC000875367182	GC	On-Demand	Anodyne	ADRA1A	44	37
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC(C(=O)NCCO)CC2)C1	ZINC000875367182	GC	On-Demand	Anodyne	DRD3	64	48
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC(C(=O)NCCO)CC2)C1	ZINC000875367182	GC	On-Demand	Anodyne	HTR7	44	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(c3ccccc3OC)C2=O)C1	ZINC000875367185	GD	On-Demand	Anodyne	ACE	29	47
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(c3ccccc3OC)C2=O)C1	ZINC000875367185	GD	On-Demand	Anodyne	XIAP	44	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(c3ccccc3OC)C2=O)C1	ZINC000875367186	GD	On-Demand	Anodyne	ACE	29	47
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(c3ccccc3OC)C2=O)C1	ZINC000875367186	GD	On-Demand	Anodyne	XIAP	44	36
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCO[C@H]2CCOC2)CC1	ZINC000875367199	GG	On-Demand	Anodyne	HTR1A	19	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCO[C@H]2CCOC2)CC1	ZINC000875367199	GG	On-Demand	Anodyne	DRD2	16	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCO[C@@H]2CCOC2)CC1	ZINC000875367201	GG	On-Demand	Anodyne	HTR1A	19	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCO[C@@H]2CCOC2)CC1	ZINC000875367201	GG	On-Demand	Anodyne	DRD2	16	40
COc1ccccc1[C@H]1CCCN(C(=O)NCCCO[C@H]2CCOC2)CC1	ZINC000875367203	GG	On-Demand	Anodyne	HTR1A	19	40
COc1ccccc1[C@H]1CCCN(C(=O)NCCCO[C@H]2CCOC2)CC1	ZINC000875367203	GG	On-Demand	Anodyne	DRD2	16	40
COc1ccccc1[C@H]1CCCN(C(=O)NCCCO[C@@H]2CCOC2)CC1	ZINC000875367205	GG	On-Demand	Anodyne	HTR1A	19	40
COc1ccccc1[C@H]1CCCN(C(=O)NCCCO[C@@H]2CCOC2)CC1	ZINC000875367205	GG	On-Demand	Anodyne	DRD2	16	40
O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875367244	GG	On-Demand	Bother	EPHX2	15	42
O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875367246	GG	On-Demand	Bother	EPHX2	15	42
CSc1cc(C)ccc1CNC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875367272	EG	On-Demand	Anodyne	EPHX2	16	44
CSc1cc(C)ccc1CNC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875367274	EG	On-Demand	Anodyne	EPHX2	16	44
O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N(C1CC1)C1CC1	ZINC000875367276	DG	On-Demand	Bother	SLC27A4	47	31
COc1ccccc1N1CC[C@H](NC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875367277	DD	On-Demand	Anodyne	HTR1A	69	44
COc1ccccc1N1CC[C@H](NC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875367277	DD	On-Demand	Anodyne	DRD2	70	44
COc1ccccc1N1CC[C@H](NC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875367277	DD	On-Demand	Anodyne	DRD4	37	41
COc1ccccc1N1CC[C@H](NC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875367277	DD	On-Demand	Anodyne	ADRA1D	66	44
COc1ccccc1N1CC[C@H](NC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875367277	DD	On-Demand	Anodyne	ADRA1A	59	44
COc1ccccc1N1CC[C@H](NC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875367277	DD	On-Demand	Anodyne	ADRA1B	52	44
COc1ccccc1N1CC[C@H](NC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875367277	DD	On-Demand	Anodyne	DRD3	68	43
COc1ccccc1N1CC[C@H](NC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875367277	DD	On-Demand	Anodyne	HTR7	49	38
COc1ccccc1N1CC[C@@H](NC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875367279	DD	On-Demand	Anodyne	HTR1A	69	44
COc1ccccc1N1CC[C@@H](NC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875367279	DD	On-Demand	Anodyne	DRD2	70	44
COc1ccccc1N1CC[C@@H](NC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875367279	DD	On-Demand	Anodyne	DRD4	37	41
COc1ccccc1N1CC[C@@H](NC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875367279	DD	On-Demand	Anodyne	ADRA1D	66	44
COc1ccccc1N1CC[C@@H](NC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875367279	DD	On-Demand	Anodyne	ADRA1A	59	44
COc1ccccc1N1CC[C@@H](NC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875367279	DD	On-Demand	Anodyne	ADRA1B	52	44
COc1ccccc1N1CC[C@@H](NC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875367279	DD	On-Demand	Anodyne	DRD3	68	43
COc1ccccc1N1CC[C@@H](NC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875367279	DD	On-Demand	Anodyne	HTR7	49	38
COc1ccccc1N1CC[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875367281	GD	On-Demand	Anodyne	HTR1A	87	43
COc1ccccc1N1CC[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875367281	GD	On-Demand	Anodyne	DRD2	79	44
COc1ccccc1N1CC[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875367281	GD	On-Demand	Anodyne	DRD4	57	43
COc1ccccc1N1CC[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875367281	GD	On-Demand	Anodyne	ADRA1D	79	42
COc1ccccc1N1CC[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875367281	GD	On-Demand	Anodyne	ADRA1A	70	42
COc1ccccc1N1CC[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875367281	GD	On-Demand	Anodyne	ADRA1B	64	42
COc1ccccc1N1CC[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875367281	GD	On-Demand	Anodyne	DRD3	75	43
COc1ccccc1N1CC[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875367281	GD	On-Demand	Anodyne	HTR7	60	39
COc1ccccc1N1CC[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875367281	GD	On-Demand	Anodyne	SIGMAR1	18	44
COc1ccccc1N1CC[C@@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875367284	GD	On-Demand	Anodyne	HTR1A	87	43
COc1ccccc1N1CC[C@@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875367284	GD	On-Demand	Anodyne	DRD2	79	44
COc1ccccc1N1CC[C@@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875367284	GD	On-Demand	Anodyne	DRD4	57	43
COc1ccccc1N1CC[C@@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875367284	GD	On-Demand	Anodyne	ADRA1D	79	42
COc1ccccc1N1CC[C@@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875367284	GD	On-Demand	Anodyne	ADRA1A	70	42
COc1ccccc1N1CC[C@@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875367284	GD	On-Demand	Anodyne	ADRA1B	64	42
COc1ccccc1N1CC[C@@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875367284	GD	On-Demand	Anodyne	DRD3	75	43
COc1ccccc1N1CC[C@@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875367284	GD	On-Demand	Anodyne	HTR7	60	39
COc1ccccc1N1CC[C@@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875367284	GD	On-Demand	Anodyne	SIGMAR1	18	44
O=C(NC1CCN(S(=O)(=O)C(F)(F)F)CC1)N1CC(Cc2ccco2)C1	ZINC000875367311	GD	On-Demand	Anodyne	SFRP1	46	31
O=C(NC1CCN(S(=O)(=O)C(F)(F)F)CC1)N1CC(Cc2ccco2)C1	ZINC000875367311	GD	On-Demand	Anodyne	WNT3	42	31
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1=O	ZINC000875367459	GD	On-Demand	Anodyne	HTR1A	31	42
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1=O	ZINC000875367459	GD	On-Demand	Anodyne	DRD2	20	42
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@H](C(C)(C)O)C2)C1=O	ZINC000875367461	GD	On-Demand	Anodyne	HTR1A	31	42
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@H](C(C)(C)O)C2)C1=O	ZINC000875367461	GD	On-Demand	Anodyne	DRD2	20	42
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1=O	ZINC000875367463	GD	On-Demand	Anodyne	HTR1A	31	42
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1=O	ZINC000875367463	GD	On-Demand	Anodyne	DRD2	20	42
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@H](C(C)(C)O)C2)C1=O	ZINC000875367465	GD	On-Demand	Anodyne	HTR1A	31	42
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@H](C(C)(C)O)C2)C1=O	ZINC000875367465	GD	On-Demand	Anodyne	DRD2	20	42
CCCCCCCNC(=O)C(=O)NCc1nnc2n1CCOC2	ZINC000875367474	DC	On-Demand	Mild	ASAH1	61	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875367505	GE	On-Demand	Anodyne	HTR1A	69	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875367505	GE	On-Demand	Anodyne	DRD2	61	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875367505	GE	On-Demand	Anodyne	DRD4	32	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875367505	GE	On-Demand	Anodyne	ADRA1D	68	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875367505	GE	On-Demand	Anodyne	ADRA1A	60	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875367505	GE	On-Demand	Anodyne	ADRA1B	54	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875367505	GE	On-Demand	Anodyne	DRD3	56	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875367505	GE	On-Demand	Anodyne	HTR7	44	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875367509	GE	On-Demand	Anodyne	HTR1A	69	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875367509	GE	On-Demand	Anodyne	DRD2	61	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875367509	GE	On-Demand	Anodyne	DRD4	32	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875367509	GE	On-Demand	Anodyne	ADRA1D	68	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875367509	GE	On-Demand	Anodyne	ADRA1A	60	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875367509	GE	On-Demand	Anodyne	ADRA1B	54	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875367509	GE	On-Demand	Anodyne	DRD3	56	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875367509	GE	On-Demand	Anodyne	HTR7	44	39
COC(=O)N(C)NC(=O)NC[C@H]1CCN(c2cc(OC)cc(OC)c2)C1	ZINC000875367516	FD	On-Demand	Reactive	CACNA1I	44	31
COC(=O)N(C)NC(=O)NC[C@@H]1CCN(c2cc(OC)cc(OC)c2)C1	ZINC000875367517	FD	On-Demand	Reactive	CACNA1I	44	31
O=C(CCc1ccccc1)N1CC[C@@H](NC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875367540	GF	On-Demand	Clean	DRD4	16	41
O=C(CCc1ccccc1)N1CC[C@@H](NC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875367540	GF	On-Demand	Clean	GRIN2B	18	42
O=C(CCc1ccccc1)N1CC[C@@H](NC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875367540	GF	On-Demand	Clean	C3AR1	40	40
O=C(CCc1ccccc1)N1CC[C@H](NC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875367541	GF	On-Demand	Clean	DRD4	16	41
O=C(CCc1ccccc1)N1CC[C@H](NC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875367541	GF	On-Demand	Clean	GRIN2B	18	42
O=C(CCc1ccccc1)N1CC[C@H](NC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875367541	GF	On-Demand	Clean	C3AR1	40	40
COc1ccccc1N1CC[C@H](NC(=O)NC[C@H]2C[C@H](O)C2)C1=O	ZINC000875367544	EC	On-Demand	Anodyne	HTR1A	43	41
COc1ccccc1N1CC[C@H](NC(=O)NC[C@H]2C[C@H](O)C2)C1=O	ZINC000875367544	EC	On-Demand	Anodyne	DRD2	40	41
COc1ccccc1N1CC[C@H](NC(=O)NC[C@H]2C[C@H](O)C2)C1=O	ZINC000875367544	EC	On-Demand	Anodyne	DRD3	45	37
COc1ccccc1N1CC[C@@H](NC(=O)NC[C@H]2C[C@H](O)C2)C1=O	ZINC000875367545	EC	On-Demand	Anodyne	HTR1A	43	41
COc1ccccc1N1CC[C@@H](NC(=O)NC[C@H]2C[C@H](O)C2)C1=O	ZINC000875367545	EC	On-Demand	Anodyne	DRD2	40	41
COc1ccccc1N1CC[C@@H](NC(=O)NC[C@H]2C[C@H](O)C2)C1=O	ZINC000875367545	EC	On-Demand	Anodyne	DRD3	45	37
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(C)cc1SC	ZINC000875367571	GG	On-Demand	Anodyne	CACNA1I	41	37
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@H](OC3CCC3)CC2)C1	ZINC000875367583	GG	On-Demand	Anodyne	HTR1A	56	42
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@H](OC3CCC3)CC2)C1	ZINC000875367583	GG	On-Demand	Anodyne	DRD2	48	39
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@H](OC3CCC3)CC2)C1	ZINC000875367583	GG	On-Demand	Anodyne	ADRA1D	43	38
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@H](OC3CCC3)CC2)C1	ZINC000875367583	GG	On-Demand	Anodyne	DRD3	53	37
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@H](OC3CCC3)CC2)C1	ZINC000875367583	GG	On-Demand	Anodyne	EPHX2	15	46
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@H](OC3CCC3)CC2)C1	ZINC000875367583	GG	On-Demand	Anodyne	SCD1	20	41
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@@H](OC3CCC3)CC2)C1	ZINC000875367584	GG	On-Demand	Anodyne	HTR1A	56	42
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@@H](OC3CCC3)CC2)C1	ZINC000875367584	GG	On-Demand	Anodyne	DRD2	48	39
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@@H](OC3CCC3)CC2)C1	ZINC000875367584	GG	On-Demand	Anodyne	ADRA1D	43	38
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@@H](OC3CCC3)CC2)C1	ZINC000875367584	GG	On-Demand	Anodyne	DRD3	53	37
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@@H](OC3CCC3)CC2)C1	ZINC000875367584	GG	On-Demand	Anodyne	EPHX2	15	46
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@@H](OC3CCC3)CC2)C1	ZINC000875367584	GG	On-Demand	Anodyne	SCD1	20	41
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@H](OC3CCC3)CC2)C1	ZINC000875367585	GG	On-Demand	Anodyne	HTR1A	56	42
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@H](OC3CCC3)CC2)C1	ZINC000875367585	GG	On-Demand	Anodyne	DRD2	48	39
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@H](OC3CCC3)CC2)C1	ZINC000875367585	GG	On-Demand	Anodyne	ADRA1D	43	38
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@H](OC3CCC3)CC2)C1	ZINC000875367585	GG	On-Demand	Anodyne	DRD3	53	37
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@H](OC3CCC3)CC2)C1	ZINC000875367585	GG	On-Demand	Anodyne	EPHX2	15	46
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@H](OC3CCC3)CC2)C1	ZINC000875367585	GG	On-Demand	Anodyne	SCD1	20	41
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@@H](OC3CCC3)CC2)C1	ZINC000875367586	GG	On-Demand	Anodyne	HTR1A	56	42
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@@H](OC3CCC3)CC2)C1	ZINC000875367586	GG	On-Demand	Anodyne	DRD2	48	39
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@@H](OC3CCC3)CC2)C1	ZINC000875367586	GG	On-Demand	Anodyne	ADRA1D	43	38
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@@H](OC3CCC3)CC2)C1	ZINC000875367586	GG	On-Demand	Anodyne	DRD3	53	37
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@@H](OC3CCC3)CC2)C1	ZINC000875367586	GG	On-Demand	Anodyne	EPHX2	15	46
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@@H](OC3CCC3)CC2)C1	ZINC000875367586	GG	On-Demand	Anodyne	SCD1	20	41
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(S(=O)(=O)C(F)(F)F)CC1	ZINC000875367604	FC	On-Demand	Anodyne	EPHX2	26	40
O=C(NCC1CC(O)C1)NC1CCN(S(=O)(=O)C(F)(F)F)CC1	ZINC000875367605	FC	On-Demand	Anodyne	EPHX2	26	40
O=C(NC[C@@H]1C[C@H](O)C1)NC1CCN(S(=O)(=O)C(F)(F)F)CC1	ZINC000875367606	FC	On-Demand	Anodyne	EPHX2	26	40
O=C(N[C@H]1CCN(c2ncccc2F)C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875367622	GF	On-Demand	Anodyne	EPHX2	16	43
O=C(N[C@@H]1CCN(c2ncccc2F)C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875367623	GF	On-Demand	Anodyne	EPHX2	16	43
O=C(N[C@H]1CCN(c2ncccc2F)C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875367624	GF	On-Demand	Anodyne	EPHX2	16	43
O=C(N[C@@H]1CCN(c2ncccc2F)C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875367625	GF	On-Demand	Anodyne	EPHX2	16	43
O=C(NC1CCN(S(=O)(=O)C(F)(F)F)CC1)N1CC(c2ccccc2)C1	ZINC000875367687	GE	On-Demand	Anodyne	EPHX2	57	44
O=C(NC1CCN(S(=O)(=O)C(F)(F)F)CC1)N1CC(c2ccccc2)C1	ZINC000875367687	GE	On-Demand	Anodyne	RBP4	83	38
O=C(NC1CCN(S(=O)(=O)C(F)(F)F)CC1)N1CC(c2ccccc2)C1	ZINC000875367687	GE	On-Demand	Anodyne	SFRP1	128	37
O=C(NC1CCN(S(=O)(=O)C(F)(F)F)CC1)N1CC(c2ccccc2)C1	ZINC000875367687	GE	On-Demand	Anodyne	WNT3	86	35
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875367727	FE	On-Demand	Anodyne	GRIN2B	15	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875367727	FE	On-Demand	Anodyne	C3AR1	41	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875367727	FE	On-Demand	Anodyne	EPHX2	24	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875367727	FE	On-Demand	Anodyne	CCR8	44	35
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875367727	FE	On-Demand	Anodyne	BIRC2	45	46
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875367728	FE	On-Demand	Anodyne	GRIN2B	15	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875367728	FE	On-Demand	Anodyne	C3AR1	41	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875367728	FE	On-Demand	Anodyne	EPHX2	24	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875367728	FE	On-Demand	Anodyne	CCR8	44	35
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875367728	FE	On-Demand	Anodyne	BIRC2	45	46
O=C(CCc1ccc(N2CCCS2(=O)=O)cc1)Nc1cccc2nccn12	ZINC000875367797	GE	On-Demand	Anodyne	CDK1	18	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2(CCOCc3ccccc3)CC2)C1	ZINC000875367798	GE	On-Demand	Anodyne	FKBP1A	24	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2(CCOCc3ccccc3)CC2)C1	ZINC000875367798	GE	On-Demand	Anodyne	SLC12A5	51	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2(CCOCc3ccccc3)CC2)C1	ZINC000875367798	GE	On-Demand	Anodyne	HCN1	52	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2(CCOCc3ccccc3)CC2)C1	ZINC000875367798	GE	On-Demand	Anodyne	HCN4	50	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2(CCOCc3ccccc3)CC2)C1	ZINC000875367799	GE	On-Demand	Anodyne	FKBP1A	24	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2(CCOCc3ccccc3)CC2)C1	ZINC000875367799	GE	On-Demand	Anodyne	SLC12A5	51	35
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2(CCOCc3ccccc3)CC2)C1	ZINC000875367799	GE	On-Demand	Anodyne	HCN1	52	33
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2(CCOCc3ccccc3)CC2)C1	ZINC000875367799	GE	On-Demand	Anodyne	HCN4	50	33
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O	ZINC000875367800	ED	On-Demand	Anodyne	HTR1A	34	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(c2ccccc2OC)C1=O	ZINC000875367804	ED	On-Demand	Anodyne	HTR1A	34	40
COC(=O)N(C)NC(=O)NCc1cc(OC)ccc1OC(F)F	ZINC000875367817	ED	On-Demand	Reactive	MTNR1A	54	37
COC(=O)N(C)NC(=O)NCc1cc(OC)ccc1OC(F)F	ZINC000875367817	ED	On-Demand	Reactive	MTNR1B	40	38
COC(=O)N(C)NC(=O)NCc1cc(OC)ccc1OC(F)F	ZINC000875367817	ED	On-Demand	Reactive	MT-ND1	17	43
O=CN1CCCN(C(=O)N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)CC1	ZINC000875367819	FD	On-Demand	Anodyne	GRIN2B	15	43
O=CN1CCCN(C(=O)N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)CC1	ZINC000875367819	FD	On-Demand	Anodyne	SIGMAR1	15	41
O=CN1CCCN(C(=O)N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)CC1	ZINC000875367819	FD	On-Demand	Anodyne	C3AR1	45	43
O=CN1CCCN(C(=O)N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)CC1	ZINC000875367819	FD	On-Demand	Anodyne	PREP	41	40
O=CN1CCCN(C(=O)N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)CC1	ZINC000875367819	FD	On-Demand	Anodyne	EPHX2	18	41
O=CN1CCCN(C(=O)N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)CC1	ZINC000875367819	FD	On-Demand	Anodyne	BIRC2	22	41
O=CN1CCCN(C(=O)N[C@H]2CCN(C(=O)CCc3ccccc3)C2)CC1	ZINC000875367820	FD	On-Demand	Anodyne	GRIN2B	15	43
O=CN1CCCN(C(=O)N[C@H]2CCN(C(=O)CCc3ccccc3)C2)CC1	ZINC000875367820	FD	On-Demand	Anodyne	SIGMAR1	15	41
O=CN1CCCN(C(=O)N[C@H]2CCN(C(=O)CCc3ccccc3)C2)CC1	ZINC000875367820	FD	On-Demand	Anodyne	C3AR1	45	43
O=CN1CCCN(C(=O)N[C@H]2CCN(C(=O)CCc3ccccc3)C2)CC1	ZINC000875367820	FD	On-Demand	Anodyne	PREP	41	40
O=CN1CCCN(C(=O)N[C@H]2CCN(C(=O)CCc3ccccc3)C2)CC1	ZINC000875367820	FD	On-Demand	Anodyne	EPHX2	18	41
O=CN1CCCN(C(=O)N[C@H]2CCN(C(=O)CCc3ccccc3)C2)CC1	ZINC000875367820	FD	On-Demand	Anodyne	BIRC2	22	41
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC3(CCN(C)CC3)CC2)C1	ZINC000875367842	GF	On-Demand	Anodyne	HTR1A	72	48
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC3(CCN(C)CC3)CC2)C1	ZINC000875367842	GF	On-Demand	Anodyne	DRD2	55	44
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC3(CCN(C)CC3)CC2)C1	ZINC000875367842	GF	On-Demand	Anodyne	DRD4	30	43
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC3(CCN(C)CC3)CC2)C1	ZINC000875367842	GF	On-Demand	Anodyne	ADRA1D	62	41
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC3(CCN(C)CC3)CC2)C1	ZINC000875367842	GF	On-Demand	Anodyne	HTR1B	15	48
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC3(CCN(C)CC3)CC2)C1	ZINC000875367842	GF	On-Demand	Anodyne	ADRA1A	54	41
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC3(CCN(C)CC3)CC2)C1	ZINC000875367842	GF	On-Demand	Anodyne	ADRA1B	51	41
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC3(CCN(C)CC3)CC2)C1	ZINC000875367842	GF	On-Demand	Anodyne	DRD3	58	39
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC3(CCN(C)CC3)CC2)C1	ZINC000875367842	GF	On-Demand	Anodyne	HTR7	46	41
COc1ccccc1N1CC[C@H](NC(=O)N2CCC3(CCN(C)CC3)CC2)C1	ZINC000875367844	GF	On-Demand	Anodyne	HTR1A	72	48
COc1ccccc1N1CC[C@H](NC(=O)N2CCC3(CCN(C)CC3)CC2)C1	ZINC000875367844	GF	On-Demand	Anodyne	DRD2	55	44
COc1ccccc1N1CC[C@H](NC(=O)N2CCC3(CCN(C)CC3)CC2)C1	ZINC000875367844	GF	On-Demand	Anodyne	DRD4	30	43
COc1ccccc1N1CC[C@H](NC(=O)N2CCC3(CCN(C)CC3)CC2)C1	ZINC000875367844	GF	On-Demand	Anodyne	ADRA1D	62	41
COc1ccccc1N1CC[C@H](NC(=O)N2CCC3(CCN(C)CC3)CC2)C1	ZINC000875367844	GF	On-Demand	Anodyne	HTR1B	15	48
COc1ccccc1N1CC[C@H](NC(=O)N2CCC3(CCN(C)CC3)CC2)C1	ZINC000875367844	GF	On-Demand	Anodyne	ADRA1A	54	41
COc1ccccc1N1CC[C@H](NC(=O)N2CCC3(CCN(C)CC3)CC2)C1	ZINC000875367844	GF	On-Demand	Anodyne	ADRA1B	51	41
COc1ccccc1N1CC[C@H](NC(=O)N2CCC3(CCN(C)CC3)CC2)C1	ZINC000875367844	GF	On-Demand	Anodyne	DRD3	58	39
COc1ccccc1N1CC[C@H](NC(=O)N2CCC3(CCN(C)CC3)CC2)C1	ZINC000875367844	GF	On-Demand	Anodyne	HTR7	46	41
COc1ccccc1N1CC[C@@H](NC(=O)NC[C@@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875367889	GE	On-Demand	Anodyne	HTR1A	65	41
COc1ccccc1N1CC[C@@H](NC(=O)NC[C@@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875367889	GE	On-Demand	Anodyne	DRD2	52	41
COc1ccccc1N1CC[C@@H](NC(=O)NC[C@@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875367889	GE	On-Demand	Anodyne	ADRA1D	61	39
COc1ccccc1N1CC[C@@H](NC(=O)NC[C@@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875367889	GE	On-Demand	Anodyne	ADRA1A	54	39
COc1ccccc1N1CC[C@@H](NC(=O)NC[C@@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875367889	GE	On-Demand	Anodyne	ADRA1B	46	39
COc1ccccc1N1CC[C@@H](NC(=O)NC[C@@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875367889	GE	On-Demand	Anodyne	DRD3	59	38
COc1ccccc1N1CC[C@@H](NC(=O)NC[C@@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875367889	GE	On-Demand	Anodyne	HTR7	41	38
CC[C@@H](NC(=O)NCCC1CCC1)[C@@H](O)c1ccccc1	ZINC000875367952	CF	On-Demand	Anodyne	XIAP	40	35
CC[C@@H](NC(=O)NCCC1CCC1)[C@H](O)c1ccccc1	ZINC000875367954	CF	On-Demand	Anodyne	XIAP	40	35
CC(C)[C@H]1CCc2ccccc2[C@@H]1NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875367957	GD	On-Demand	Anodyne	BIRC2	45	33
CC(C)[C@H]1CCc2ccccc2[C@H]1NC(=O)C(=O)N1CCC(CO)(CO)CC1	ZINC000875367958	GD	On-Demand	Anodyne	BIRC2	45	33
COc1ccc(OC(F)F)c(CNC(=O)N(C)OCC(F)(F)F)c1	ZINC000875368007	FF	On-Demand	Anodyne	MT-ND1	18	46
Cc1ccccc1[C@@H](C)NC(=O)C(O)(c1ccccc1)c1ccccc1	ZINC000875368039	EI	On-Demand	Anodyne	CTSA	64	38
Cc1ccccc1[C@H](C)NC(=O)C(O)(c1ccccc1)c1ccccc1	ZINC000875368040	EI	On-Demand	Anodyne	CTSA	64	38
COc1ccccc1N1CC[C@H](NC(=O)NC[C@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875368042	GE	On-Demand	Anodyne	HTR1A	65	41
COc1ccccc1N1CC[C@H](NC(=O)NC[C@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875368042	GE	On-Demand	Anodyne	DRD2	52	41
COc1ccccc1N1CC[C@H](NC(=O)NC[C@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875368042	GE	On-Demand	Anodyne	ADRA1D	61	39
COc1ccccc1N1CC[C@H](NC(=O)NC[C@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875368042	GE	On-Demand	Anodyne	ADRA1A	54	39
COc1ccccc1N1CC[C@H](NC(=O)NC[C@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875368042	GE	On-Demand	Anodyne	ADRA1B	46	39
COc1ccccc1N1CC[C@H](NC(=O)NC[C@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875368042	GE	On-Demand	Anodyne	DRD3	59	38
COc1ccccc1N1CC[C@H](NC(=O)NC[C@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875368042	GE	On-Demand	Anodyne	HTR7	41	38
COc1ccccc1N1CC[C@H](NC(=O)NC[C@@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875368045	GE	On-Demand	Anodyne	HTR1A	65	41
COc1ccccc1N1CC[C@H](NC(=O)NC[C@@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875368045	GE	On-Demand	Anodyne	DRD2	52	41
COc1ccccc1N1CC[C@H](NC(=O)NC[C@@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875368045	GE	On-Demand	Anodyne	ADRA1D	61	39
COc1ccccc1N1CC[C@H](NC(=O)NC[C@@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875368045	GE	On-Demand	Anodyne	ADRA1A	54	39
COc1ccccc1N1CC[C@H](NC(=O)NC[C@@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875368045	GE	On-Demand	Anodyne	ADRA1B	46	39
COc1ccccc1N1CC[C@H](NC(=O)NC[C@@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875368045	GE	On-Demand	Anodyne	DRD3	59	38
COc1ccccc1N1CC[C@H](NC(=O)NC[C@@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875368045	GE	On-Demand	Anodyne	HTR7	41	38
COc1ccccc1N1CC[C@@H](NC(=O)NC[C@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875368047	GE	On-Demand	Anodyne	HTR1A	65	41
COc1ccccc1N1CC[C@@H](NC(=O)NC[C@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875368047	GE	On-Demand	Anodyne	DRD2	52	41
COc1ccccc1N1CC[C@@H](NC(=O)NC[C@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875368047	GE	On-Demand	Anodyne	ADRA1D	61	39
COc1ccccc1N1CC[C@@H](NC(=O)NC[C@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875368047	GE	On-Demand	Anodyne	ADRA1A	54	39
COc1ccccc1N1CC[C@@H](NC(=O)NC[C@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875368047	GE	On-Demand	Anodyne	ADRA1B	46	39
COc1ccccc1N1CC[C@@H](NC(=O)NC[C@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875368047	GE	On-Demand	Anodyne	DRD3	59	38
COc1ccccc1N1CC[C@@H](NC(=O)NC[C@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875368047	GE	On-Demand	Anodyne	HTR7	41	38
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCN(c4ccccc4OC)C3=O)C[C@@H]1C2	ZINC000875368088	GD	On-Demand	Anodyne	HTR1A	22	41
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCN(c4ccccc4OC)C3=O)C[C@@H]1C2	ZINC000875368090	GD	On-Demand	Anodyne	HTR1A	22	41
COC(=O)N(C)NC(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368102	ED	On-Demand	Reactive	GRIN2B	28	45
COC(=O)N(C)NC(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368102	ED	On-Demand	Reactive	C3AR1	42	41
COC(=O)N(C)NC(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368102	ED	On-Demand	Reactive	PREP	47	38
COC(=O)N(C)NC(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368102	ED	On-Demand	Reactive	EPHX2	29	42
COC(=O)N(C)NC(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368102	ED	On-Demand	Reactive	MCHR1	15	43
COC(=O)N(C)NC(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368102	ED	On-Demand	Reactive	BIRC2	22	41
COC(=O)N(C)NC(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368103	ED	On-Demand	Reactive	GRIN2B	28	45
COC(=O)N(C)NC(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368103	ED	On-Demand	Reactive	C3AR1	42	41
COC(=O)N(C)NC(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368103	ED	On-Demand	Reactive	PREP	47	38
COC(=O)N(C)NC(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368103	ED	On-Demand	Reactive	EPHX2	29	42
COC(=O)N(C)NC(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368103	ED	On-Demand	Reactive	MCHR1	15	43
COC(=O)N(C)NC(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368103	ED	On-Demand	Reactive	BIRC2	22	41
Cc1ccccc1[C@@H](C)NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1	ZINC000875368119	DH	On-Demand	Bother	UL26	63	53
Cc1ccccc1[C@@H](C)NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1	ZINC000875368119	DH	On-Demand	Bother	SCAF_EBVB9	52	39
Cc1ccccc1[C@H](C)NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1	ZINC000875368120	DH	On-Demand	Bother	UL26	63	53
Cc1ccccc1[C@H](C)NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1	ZINC000875368120	DH	On-Demand	Bother	SCAF_EBVB9	52	39
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368121	ED	On-Demand	Anodyne	GRIN2B	23	48
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368121	ED	On-Demand	Anodyne	C3AR1	41	41
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368121	ED	On-Demand	Anodyne	EPHX2	35	42
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368122	ED	On-Demand	Anodyne	GRIN2B	23	48
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368122	ED	On-Demand	Anodyne	C3AR1	41	41
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368122	ED	On-Demand	Anodyne	EPHX2	35	42
COc1ccccc1N1CC[C@H](NC(=O)N2Cc3cccc(O)c3C2)C1=O	ZINC000875368130	FE	On-Demand	Clean	DRD2	20	40
COc1ccccc1N1CC[C@H](NC(=O)N2Cc3cccc(O)c3C2)C1=O	ZINC000875368130	FE	On-Demand	Clean	DRD4	15	40
COc1ccccc1N1CC[C@H](NC(=O)N2Cc3cccc(O)c3C2)C1=O	ZINC000875368130	FE	On-Demand	Clean	SSTR1	40	35
COc1ccccc1N1CC[C@@H](NC(=O)N2Cc3cccc(O)c3C2)C1=O	ZINC000875368131	FE	On-Demand	Clean	DRD2	20	40
COc1ccccc1N1CC[C@@H](NC(=O)N2Cc3cccc(O)c3C2)C1=O	ZINC000875368131	FE	On-Demand	Clean	DRD4	15	40
COc1ccccc1N1CC[C@@H](NC(=O)N2Cc3cccc(O)c3C2)C1=O	ZINC000875368131	FE	On-Demand	Clean	SSTR1	40	35
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368151	GD	On-Demand	Anodyne	SLC6A4	17	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368151	GD	On-Demand	Anodyne	SLC6A3	38	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368151	GD	On-Demand	Anodyne	C3AR1	41	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368151	GD	On-Demand	Anodyne	CCR8	52	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368152	GD	On-Demand	Anodyne	SLC6A4	17	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368152	GD	On-Demand	Anodyne	SLC6A3	38	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368152	GD	On-Demand	Anodyne	C3AR1	41	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368152	GD	On-Demand	Anodyne	CCR8	52	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368153	GD	On-Demand	Anodyne	SLC6A4	17	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368153	GD	On-Demand	Anodyne	SLC6A3	38	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368153	GD	On-Demand	Anodyne	C3AR1	41	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368153	GD	On-Demand	Anodyne	CCR8	52	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368154	GD	On-Demand	Anodyne	SLC6A4	17	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368154	GD	On-Demand	Anodyne	SLC6A3	38	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368154	GD	On-Demand	Anodyne	C3AR1	41	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000875368154	GD	On-Demand	Anodyne	CCR8	52	37
N#Cc1cccc([C@H](NC(=O)NCCC2CCC2)C(F)(F)F)c1	ZINC000875368195	EH	On-Demand	Mild	CCR3	16	41
N#Cc1cccc([C@@H](NC(=O)NCCC2CCC2)C(F)(F)F)c1	ZINC000875368196	EH	On-Demand	Mild	CCR3	16	41
O=C(NC1CCN(S(=O)(=O)C(F)(F)F)CC1)N[C@]12CCCC[C@H]1C2	ZINC000875368209	FD	On-Demand	Anodyne	EPHX2	19	42
O=C(NC1CCN(S(=O)(=O)C(F)(F)F)CC1)N[C@@]12CCCC[C@H]1C2	ZINC000875368210	FD	On-Demand	Anodyne	EPHX2	19	42
O=C(NC1CCN(S(=O)(=O)C(F)(F)F)CC1)N[C@]12CCCC[C@@H]1C2	ZINC000875368211	FD	On-Demand	Anodyne	EPHX2	19	42
O=C(NC1CCN(S(=O)(=O)C(F)(F)F)CC1)N[C@@]12CCCC[C@@H]1C2	ZINC000875368212	FD	On-Demand	Anodyne	EPHX2	19	42
CCOc1ccc([C@@H](C)NC(=O)CCCNC(=O)NC2(C)CC(F)(F)C2)cc1	ZINC000875368229	GH	On-Demand	Anodyne	ACACB	17	43
O=C(NC1CCN(S(=O)(=O)C(F)(F)F)CC1)N[C@@H]1C[C@H](CO)C1	ZINC000875368234	FC	On-Demand	Anodyne	EPHX2	27	40
CC(C)(C)OC(=O)N1CC=C(CNC(=O)C(=O)N2CCC(CCF)CC2)CC1	ZINC000875368240	GE	On-Demand	Anodyne	GPR119	30	40
CCC[C@H](CC)C(=O)Nc1cccc(Cl)c1S(C)(=O)=O	ZINC000875368286	DH	On-Demand	Anodyne	CXCL8	43	34
CCC[C@H](CC)C(=O)Nc1cccc(Cl)c1S(C)(=O)=O	ZINC000875368286	DH	On-Demand	Anodyne	KCNQ2	41	35
CCC[C@@H](CC)C(=O)Nc1cccc(Cl)c1S(C)(=O)=O	ZINC000875368287	DH	On-Demand	Anodyne	CXCL8	43	34
CCC[C@@H](CC)C(=O)Nc1cccc(Cl)c1S(C)(=O)=O	ZINC000875368287	DH	On-Demand	Anodyne	KCNQ2	41	35
O=C(CCc1ccccc1)N1CC[C@H](NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1	ZINC000875368292	GF	On-Demand	Anodyne	GRIN2B	17	43
O=C(CCc1ccccc1)N1CC[C@H](NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1	ZINC000875368292	GF	On-Demand	Anodyne	C3AR1	40	40
O=C(CCc1ccccc1)N1CC[C@H](NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1	ZINC000875368292	GF	On-Demand	Anodyne	BIRC2	25	41
O=C(CCc1ccccc1)N1CC[C@@H](NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1	ZINC000875368293	GF	On-Demand	Anodyne	GRIN2B	17	43
O=C(CCc1ccccc1)N1CC[C@@H](NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1	ZINC000875368293	GF	On-Demand	Anodyne	C3AR1	40	40
O=C(CCc1ccccc1)N1CC[C@@H](NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)C1	ZINC000875368293	GF	On-Demand	Anodyne	BIRC2	25	41
COc1ccccc1N1CC[C@@H](NC(=O)N(C)OCC(F)(F)F)C1	ZINC000875368294	EE	On-Demand	Anodyne	HTR1A	64	41
COc1ccccc1N1CC[C@@H](NC(=O)N(C)OCC(F)(F)F)C1	ZINC000875368294	EE	On-Demand	Anodyne	DRD2	56	41
COc1ccccc1N1CC[C@@H](NC(=O)N(C)OCC(F)(F)F)C1	ZINC000875368294	EE	On-Demand	Anodyne	DRD4	31	40
COc1ccccc1N1CC[C@@H](NC(=O)N(C)OCC(F)(F)F)C1	ZINC000875368294	EE	On-Demand	Anodyne	ADRA1D	65	40
COc1ccccc1N1CC[C@@H](NC(=O)N(C)OCC(F)(F)F)C1	ZINC000875368294	EE	On-Demand	Anodyne	ADRA1A	57	40
COc1ccccc1N1CC[C@@H](NC(=O)N(C)OCC(F)(F)F)C1	ZINC000875368294	EE	On-Demand	Anodyne	ADRA1B	48	39
COc1ccccc1N1CC[C@@H](NC(=O)N(C)OCC(F)(F)F)C1	ZINC000875368294	EE	On-Demand	Anodyne	DRD3	61	40
COc1ccccc1N1CC[C@@H](NC(=O)N(C)OCC(F)(F)F)C1	ZINC000875368294	EE	On-Demand	Anodyne	HTR7	43	37
COc1ccccc1N1CC[C@H](NC(=O)N(C)OCC(F)(F)F)C1	ZINC000875368295	EE	On-Demand	Anodyne	HTR1A	64	41
COc1ccccc1N1CC[C@H](NC(=O)N(C)OCC(F)(F)F)C1	ZINC000875368295	EE	On-Demand	Anodyne	DRD2	56	41
COc1ccccc1N1CC[C@H](NC(=O)N(C)OCC(F)(F)F)C1	ZINC000875368295	EE	On-Demand	Anodyne	DRD4	31	40
COc1ccccc1N1CC[C@H](NC(=O)N(C)OCC(F)(F)F)C1	ZINC000875368295	EE	On-Demand	Anodyne	ADRA1D	65	40
COc1ccccc1N1CC[C@H](NC(=O)N(C)OCC(F)(F)F)C1	ZINC000875368295	EE	On-Demand	Anodyne	ADRA1A	57	40
COc1ccccc1N1CC[C@H](NC(=O)N(C)OCC(F)(F)F)C1	ZINC000875368295	EE	On-Demand	Anodyne	ADRA1B	48	39
COc1ccccc1N1CC[C@H](NC(=O)N(C)OCC(F)(F)F)C1	ZINC000875368295	EE	On-Demand	Anodyne	DRD3	61	40
COc1ccccc1N1CC[C@H](NC(=O)N(C)OCC(F)(F)F)C1	ZINC000875368295	EE	On-Demand	Anodyne	HTR7	43	37
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875368300	EC	On-Demand	Anodyne	HTR1A	59	40
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875368300	EC	On-Demand	Anodyne	DRD2	50	39
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875368300	EC	On-Demand	Anodyne	ADRA1D	56	38
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875368300	EC	On-Demand	Anodyne	ADRA1A	48	38
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875368300	EC	On-Demand	Anodyne	ADRA1B	44	38
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875368300	EC	On-Demand	Anodyne	DRD3	55	38
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875368300	EC	On-Demand	Anodyne	HTR7	41	37
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875368301	EC	On-Demand	Anodyne	HTR1A	59	40
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875368301	EC	On-Demand	Anodyne	DRD2	50	39
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875368301	EC	On-Demand	Anodyne	ADRA1D	56	38
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875368301	EC	On-Demand	Anodyne	ADRA1A	48	38
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875368301	EC	On-Demand	Anodyne	ADRA1B	44	38
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875368301	EC	On-Demand	Anodyne	DRD3	55	38
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(c3ccccc3OC)C2)C1	ZINC000875368301	EC	On-Demand	Anodyne	HTR7	41	37
COc1ccccc1N1CC[C@H](NC(=O)N2CCC(C(C)=O)CC2)C1=O	ZINC000875368331	FD	On-Demand	Anodyne	HTR1A	40	43
COc1ccccc1N1CC[C@H](NC(=O)N2CCC(C(C)=O)CC2)C1=O	ZINC000875368331	FD	On-Demand	Anodyne	DRD2	28	42
COc1ccccc1N1CC[C@H](NC(=O)N2CCC(C(C)=O)CC2)C1=O	ZINC000875368331	FD	On-Demand	Anodyne	EPHX2	15	42
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC(C(C)=O)CC2)C1=O	ZINC000875368332	FD	On-Demand	Anodyne	HTR1A	40	43
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC(C(C)=O)CC2)C1=O	ZINC000875368332	FD	On-Demand	Anodyne	DRD2	28	42
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC(C(C)=O)CC2)C1=O	ZINC000875368332	FD	On-Demand	Anodyne	EPHX2	15	42
COc1ccccc1N1CC[C@@H](NC(=O)N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)C1=O	ZINC000875368341	GD	On-Demand	Anodyne	HTR1A	26	41
COc1ccccc1N1CC[C@H](NC(=O)N2CCC[C@@H]3[C@H](O)C(C)(C)[C@@H]32)C1=O	ZINC000875368342	GD	On-Demand	Anodyne	HTR1A	26	41
COc1ccccc1N1CC[C@H](NC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875368348	FF	On-Demand	Clean	HTR1A	60	42
COc1ccccc1N1CC[C@H](NC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875368348	FF	On-Demand	Clean	DRD2	49	46
COc1ccccc1N1CC[C@H](NC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875368348	FF	On-Demand	Clean	ADRA1D	45	37
COc1ccccc1N1CC[C@H](NC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875368348	FF	On-Demand	Clean	ADRA1A	40	37
COc1ccccc1N1CC[C@H](NC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875368348	FF	On-Demand	Clean	DRD3	52	42
COc1ccccc1N1CC[C@H](NC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875368348	FF	On-Demand	Clean	HTR7	39	42
COc1ccccc1N1CC[C@H](NC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875368348	FF	On-Demand	Clean	SSTR1	53	40
COc1ccccc1N1CC[C@@H](NC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875368349	FF	On-Demand	Clean	HTR1A	60	42
COc1ccccc1N1CC[C@@H](NC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875368349	FF	On-Demand	Clean	DRD2	49	46
COc1ccccc1N1CC[C@@H](NC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875368349	FF	On-Demand	Clean	ADRA1D	45	37
COc1ccccc1N1CC[C@@H](NC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875368349	FF	On-Demand	Clean	ADRA1A	40	37
COc1ccccc1N1CC[C@@H](NC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875368349	FF	On-Demand	Clean	DRD3	52	42
COc1ccccc1N1CC[C@@H](NC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875368349	FF	On-Demand	Clean	HTR7	39	42
COc1ccccc1N1CC[C@@H](NC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875368349	FF	On-Demand	Clean	SSTR1	53	40
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875368354	EE	On-Demand	Anodyne	HTR1A	64	42
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875368354	EE	On-Demand	Anodyne	DRD2	56	44
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875368354	EE	On-Demand	Anodyne	DRD4	32	40
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875368354	EE	On-Demand	Anodyne	ADRA1D	61	40
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875368354	EE	On-Demand	Anodyne	ADRA1A	53	40
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875368354	EE	On-Demand	Anodyne	ADRA1B	49	40
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875368354	EE	On-Demand	Anodyne	DRD3	59	40
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875368354	EE	On-Demand	Anodyne	HTR7	44	37
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875368355	EE	On-Demand	Anodyne	HTR1A	64	42
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875368355	EE	On-Demand	Anodyne	DRD2	56	44
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875368355	EE	On-Demand	Anodyne	DRD4	32	40
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875368355	EE	On-Demand	Anodyne	ADRA1D	61	40
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875368355	EE	On-Demand	Anodyne	ADRA1A	53	40
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875368355	EE	On-Demand	Anodyne	ADRA1B	49	40
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875368355	EE	On-Demand	Anodyne	DRD3	59	40
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875368355	EE	On-Demand	Anodyne	HTR7	44	37
COc1ccccc1N1CC[C@@H](NC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875368356	EE	On-Demand	Anodyne	HTR1A	64	42
COc1ccccc1N1CC[C@@H](NC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875368356	EE	On-Demand	Anodyne	DRD2	56	44
COc1ccccc1N1CC[C@@H](NC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875368356	EE	On-Demand	Anodyne	DRD4	32	40
COc1ccccc1N1CC[C@@H](NC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875368356	EE	On-Demand	Anodyne	ADRA1D	61	40
COc1ccccc1N1CC[C@@H](NC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875368356	EE	On-Demand	Anodyne	ADRA1A	53	40
COc1ccccc1N1CC[C@@H](NC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875368356	EE	On-Demand	Anodyne	ADRA1B	49	40
COc1ccccc1N1CC[C@@H](NC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875368356	EE	On-Demand	Anodyne	DRD3	59	40
COc1ccccc1N1CC[C@@H](NC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875368356	EE	On-Demand	Anodyne	HTR7	44	37
COc1ccccc1N1CC[C@@H](NC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875368357	EE	On-Demand	Anodyne	HTR1A	64	42
COc1ccccc1N1CC[C@@H](NC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875368357	EE	On-Demand	Anodyne	DRD2	56	44
COc1ccccc1N1CC[C@@H](NC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875368357	EE	On-Demand	Anodyne	DRD4	32	40
COc1ccccc1N1CC[C@@H](NC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875368357	EE	On-Demand	Anodyne	ADRA1D	61	40
COc1ccccc1N1CC[C@@H](NC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875368357	EE	On-Demand	Anodyne	ADRA1A	53	40
COc1ccccc1N1CC[C@@H](NC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875368357	EE	On-Demand	Anodyne	ADRA1B	49	40
COc1ccccc1N1CC[C@@H](NC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875368357	EE	On-Demand	Anodyne	DRD3	59	40
COc1ccccc1N1CC[C@@H](NC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875368357	EE	On-Demand	Anodyne	HTR7	44	37
O=C(NC1CCN(S(=O)(=O)C(F)(F)F)CC1)N1Cc2cccc(O)c2C1	ZINC000875368459	GD	On-Demand	Clean	SFRP1	54	34
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(C(=O)CCc3ccccc3)C2)C1	ZINC000875368480	GC	On-Demand	Anodyne	GRIN2B	16	44
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(C(=O)CCc3ccccc3)C2)C1	ZINC000875368480	GC	On-Demand	Anodyne	SIGMAR1	18	40
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(C(=O)CCc3ccccc3)C2)C1	ZINC000875368480	GC	On-Demand	Anodyne	C3AR1	46	45
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(C(=O)CCc3ccccc3)C2)C1	ZINC000875368480	GC	On-Demand	Anodyne	EPHX2	21	40
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(C(=O)CCc3ccccc3)C2)C1	ZINC000875368480	GC	On-Demand	Anodyne	BIRC2	22	40
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)C1	ZINC000875368481	GC	On-Demand	Anodyne	GRIN2B	16	44
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)C1	ZINC000875368481	GC	On-Demand	Anodyne	SIGMAR1	18	40
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)C1	ZINC000875368481	GC	On-Demand	Anodyne	C3AR1	46	45
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)C1	ZINC000875368481	GC	On-Demand	Anodyne	EPHX2	21	40
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)C1	ZINC000875368481	GC	On-Demand	Anodyne	BIRC2	22	40
COc1ccccc1N1CC[C@H](NC(=O)N2CCO[C@H](C(F)(F)F)CC2)C1	ZINC000875368503	GF	On-Demand	Anodyne	HTR1A	42	38
COc1ccccc1N1CC[C@H](NC(=O)N2CCO[C@H](C(F)(F)F)CC2)C1	ZINC000875368503	GF	On-Demand	Anodyne	ADRA1D	40	37
COc1ccccc1N1CC[C@H](NC(=O)N2CCO[C@H](C(F)(F)F)CC2)C1	ZINC000875368503	GF	On-Demand	Anodyne	DRD3	48	38
COc1ccccc1N1CC[C@@H](NC(=O)N2CCO[C@H](C(F)(F)F)CC2)C1	ZINC000875368504	GF	On-Demand	Anodyne	HTR1A	42	38
COc1ccccc1N1CC[C@@H](NC(=O)N2CCO[C@H](C(F)(F)F)CC2)C1	ZINC000875368504	GF	On-Demand	Anodyne	ADRA1D	40	37
COc1ccccc1N1CC[C@@H](NC(=O)N2CCO[C@H](C(F)(F)F)CC2)C1	ZINC000875368504	GF	On-Demand	Anodyne	DRD3	48	38
COc1ccccc1N1CC[C@@H](NC(=O)N2CCO[C@@H](C(F)(F)F)CC2)C1	ZINC000875368505	GF	On-Demand	Anodyne	HTR1A	42	38
COc1ccccc1N1CC[C@@H](NC(=O)N2CCO[C@@H](C(F)(F)F)CC2)C1	ZINC000875368505	GF	On-Demand	Anodyne	ADRA1D	40	37
COc1ccccc1N1CC[C@@H](NC(=O)N2CCO[C@@H](C(F)(F)F)CC2)C1	ZINC000875368505	GF	On-Demand	Anodyne	DRD3	48	38
COc1ccccc1N1CC[C@H](NC(=O)N2CCO[C@@H](C(F)(F)F)CC2)C1	ZINC000875368506	GF	On-Demand	Anodyne	HTR1A	42	38
COc1ccccc1N1CC[C@H](NC(=O)N2CCO[C@@H](C(F)(F)F)CC2)C1	ZINC000875368506	GF	On-Demand	Anodyne	ADRA1D	40	37
COc1ccccc1N1CC[C@H](NC(=O)N2CCO[C@@H](C(F)(F)F)CC2)C1	ZINC000875368506	GF	On-Demand	Anodyne	DRD3	48	38
COc1ccccc1N1CC[C@H](NC(=O)N(C)OCC(F)(F)F)C1=O	ZINC000875368523	FD	On-Demand	Anodyne	HTR1A	40	40
COc1ccccc1N1CC[C@@H](NC(=O)N(C)OCC(F)(F)F)C1=O	ZINC000875368524	FD	On-Demand	Anodyne	HTR1A	40	40
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@@H]3[C@@H](CCN3C)C2)C1=O	ZINC000875368541	FD	On-Demand	Anodyne	HTR1A	42	41
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@@H]3[C@@H](CCN3C)C2)C1=O	ZINC000875368541	FD	On-Demand	Anodyne	DRD2	32	40
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@@H]3[C@@H](CCN3C)C2)C1=O	ZINC000875368541	FD	On-Demand	Anodyne	DRD3	41	39
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@H]3[C@@H](CCN3C)C2)C1=O	ZINC000875368542	FD	On-Demand	Anodyne	HTR1A	42	41
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@H]3[C@@H](CCN3C)C2)C1=O	ZINC000875368542	FD	On-Demand	Anodyne	DRD2	32	40
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@H]3[C@@H](CCN3C)C2)C1=O	ZINC000875368542	FD	On-Demand	Anodyne	DRD3	41	39
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@@H]3[C@H](CCN3C)C2)C1=O	ZINC000875368543	FD	On-Demand	Anodyne	HTR1A	42	41
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@@H]3[C@H](CCN3C)C2)C1=O	ZINC000875368543	FD	On-Demand	Anodyne	DRD2	32	40
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@@H]3[C@H](CCN3C)C2)C1=O	ZINC000875368543	FD	On-Demand	Anodyne	DRD3	41	39
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@H]3[C@H](CCN3C)C2)C1=O	ZINC000875368544	FD	On-Demand	Anodyne	HTR1A	42	41
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@H]3[C@H](CCN3C)C2)C1=O	ZINC000875368544	FD	On-Demand	Anodyne	DRD2	32	40
COc1ccccc1N1CC[C@H](NC(=O)N2CC[C@H]3[C@H](CCN3C)C2)C1=O	ZINC000875368544	FD	On-Demand	Anodyne	DRD3	41	39
CCC[C@@H](CCO)NC(=O)NC1CCN(S(=O)(=O)C(F)(F)F)CC1	ZINC000875368605	GD	On-Demand	Anodyne	EPHX2	25	43
CCC[C@H](CCO)NC(=O)NC1CCN(S(=O)(=O)C(F)(F)F)CC1	ZINC000875368606	GD	On-Demand	Anodyne	EPHX2	25	43
O=C(NC1CCN(S(=O)(=O)C(F)(F)F)CC1)N1CCCC(F)(F)CC1	ZINC000875368730	GE	On-Demand	Anodyne	EPHX2	16	42
N#Cc1ccc(Cn2cc(NC(=O)NCCC3CCC3)cn2)cc1	ZINC000875368759	DG	On-Demand	Mild	CCR3	40	46
N#Cc1ccc(Cn2cc(NC(=O)NCCC3CCC3)cn2)cc1	ZINC000875368759	DG	On-Demand	Mild	ITK	19	51
N#Cc1ccc(Cn2cc(NC(=O)NCCC3CCC3)cn2)cc1	ZINC000875368759	DG	On-Demand	Mild	PANC	57	38
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(S(=O)(=O)C(F)(F)F)CC1	ZINC000875368792	GD	On-Demand	Anodyne	EPHX2	24	40
Cn1nc(Cl)c(C(=O)N[C@H](CC2CC2)c2ccccc2)c1Cl	ZINC000875368846	EH	On-Demand	Anodyne	TACR3	63	39
Cn1nc(Cl)c(C(=O)N[C@@H](CC2CC2)c2ccccc2)c1Cl	ZINC000875368847	EH	On-Demand	Anodyne	TACR3	63	39
COCCN(CC1CCN(C)CC1)C(=O)NC[C@@H]1CCN(CC(C)C)C1	ZINC000875368848	FD	On-Demand	Anodyne	CACNA1I	53	35
COCCN(CC1CCN(C)CC1)C(=O)NC[C@H]1CCN(CC(C)C)C1	ZINC000875368849	FD	On-Demand	Anodyne	CACNA1I	53	35
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@]1(C#N)CCCOC1)c1ccccc1	ZINC000875368866	GF	On-Demand	Mild	MME	40	40
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@]1(C#N)CCCOC1)c1ccccc1	ZINC000875368866	GF	On-Demand	Mild	CTSB	34	40
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@]1(C#N)CCCOC1)c1ccccc1	ZINC000875368866	GF	On-Demand	Mild	PAPA1_CARPA	36	40
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@]1(C#N)CCCOC1)c1ccccc1	ZINC000875368866	GF	On-Demand	Mild	CTSL	18	40
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@]1(C#N)CCCOC1)c1ccccc1	ZINC000875368866	GF	On-Demand	Mild	TIMP3	74	36
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@]1(C#N)CCCOC1)c1ccccc1	ZINC000875368866	GF	On-Demand	Mild	CTSS	15	40
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@]1(C#N)CCCOC1)c1ccccc1	ZINC000875368866	GF	On-Demand	Mild	PSMB8	58	35
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)[C@]1(C#N)CCCOC1)c1ccccc1	ZINC000875368867	GF	On-Demand	Mild	MME	40	40
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)[C@]1(C#N)CCCOC1)c1ccccc1	ZINC000875368867	GF	On-Demand	Mild	CTSB	34	40
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)[C@]1(C#N)CCCOC1)c1ccccc1	ZINC000875368867	GF	On-Demand	Mild	PAPA1_CARPA	36	40
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)[C@]1(C#N)CCCOC1)c1ccccc1	ZINC000875368867	GF	On-Demand	Mild	CTSL	18	40
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)[C@]1(C#N)CCCOC1)c1ccccc1	ZINC000875368867	GF	On-Demand	Mild	TIMP3	74	36
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)[C@]1(C#N)CCCOC1)c1ccccc1	ZINC000875368867	GF	On-Demand	Mild	CTSS	15	40
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)[C@]1(C#N)CCCOC1)c1ccccc1	ZINC000875368867	GF	On-Demand	Mild	PSMB8	58	35
C[S@](=O)c1ccc(NC(=O)C2(C)CC(F)(F)C2)cc1F	ZINC000875368881	DF	On-Demand	Anodyne	ENV	40	36
C[S@@](=O)c1ccc(NC(=O)C2(C)CC(F)(F)C2)cc1F	ZINC000875368882	DF	On-Demand	Anodyne	ENV	40	36
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(CCN(C)C)cc2)C1	ZINC000875368899	FD	On-Demand	Anodyne	DPP7	48	33
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(CCN(C)C)cc2)C1	ZINC000875368900	FD	On-Demand	Anodyne	DPP7	48	33
CCc1cc(NC(=O)Cc2ccc(Cl)cn2)nc(C)n1	ZINC000875368913	CF	On-Demand	Anodyne	F10	47	33
CC(C)(C)OC(=O)N1CC=C(CNC(=O)C(=O)NCCCCC2CC2)CC1	ZINC000875368928	GE	On-Demand	Anodyne	GPR119	25	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(C)cc1OC	ZINC000875368944	CE	On-Demand	Anodyne	ANPEP	15	46
NS(=O)(=O)c1ccc(OCCN2C(=O)c3ccccc3S2(=O)=O)cc1	ZINC000875368969	GC	On-Demand	Anodyne	CA2	25	48
NS(=O)(=O)c1ccc(OCCN2C(=O)c3ccccc3S2(=O)=O)cc1	ZINC000875368969	GC	On-Demand	Anodyne	CA1	24	48
NS(=O)(=O)c1ccc(OCCN2C(=O)c3ccccc3S2(=O)=O)cc1	ZINC000875368969	GC	On-Demand	Anodyne	CA7	32	48
NS(=O)(=O)c1ccc(OCCN2C(=O)c3ccccc3S2(=O)=O)cc1	ZINC000875368969	GC	On-Demand	Anodyne	CA12	31	42
NS(=O)(=O)c1ccc(OCCN2C(=O)c3ccccc3S2(=O)=O)cc1	ZINC000875368969	GC	On-Demand	Anodyne	CA9	30	48
C[S@@](=O)c1ccc(NC(=O)[C@@H](Cc2cccnc2)C2CCCC2)cc1F	ZINC000875369070	FH	On-Demand	Anodyne	C3AR1	41	43
C[S@](=O)c1ccc(NC(=O)[C@@H](Cc2cccnc2)C2CCCC2)cc1F	ZINC000875369071	FH	On-Demand	Anodyne	C3AR1	41	43
C[S@](=O)c1ccc(NC(=O)[C@H](Cc2cccnc2)C2CCCC2)cc1F	ZINC000875369072	FH	On-Demand	Anodyne	C3AR1	41	43
C[S@@](=O)c1ccc(NC(=O)[C@H](Cc2cccnc2)C2CCCC2)cc1F	ZINC000875369073	FH	On-Demand	Anodyne	C3AR1	41	43
COc1ccccc1N1CC[C@@H](NC(=O)NNc2cccc(C)n2)C1=O	ZINC000875369089	FD	On-Demand	Reactive	HTR1A	29	40
COc1ccccc1N1CC[C@H](NC(=O)NNc2cccc(C)n2)C1=O	ZINC000875369091	FD	On-Demand	Reactive	HTR1A	29	40
O=C(NCC1(Cc2ccccc2)CCC1)N1CCC(CO)(CO)CC1	ZINC000875369173	EE	On-Demand	Anodyne	NPFFR2	23	48
O=C(NCC1(Cc2ccccc2)CCC1)N1CCC(CO)(CO)CC1	ZINC000875369173	EE	On-Demand	Anodyne	SMO	15	43
O=C(NCC1(Cc2ccccc2)CCC1)N1CCC(CO)(CO)CC1	ZINC000875369173	EE	On-Demand	Anodyne	NPFFR1	30	48
O=C(NCC1(Cc2ccccc2)CCC1)N1CCC(CO)(CO)CC1	ZINC000875369173	EE	On-Demand	Anodyne	SLC12A5	47	36
O=C(NCC1(Cc2ccccc2)CCC1)N1CCC(CO)(CO)CC1	ZINC000875369173	EE	On-Demand	Anodyne	HCN1	43	33
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)[C@]1(C)CCC(=O)N1)c1ccccc1	ZINC000875369197	GE	On-Demand	Anodyne	MME	61	44
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)[C@]1(C)CCC(=O)N1)c1ccccc1	ZINC000875369197	GE	On-Demand	Anodyne	TIMP3	80	36
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)[C@]1(C)CCC(=O)N1)c1ccccc1	ZINC000875369197	GE	On-Demand	Anodyne	ACE2	47	34
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)[C@]1(C)CCC(=O)N1)c1ccccc1	ZINC000875369197	GE	On-Demand	Anodyne	FPR1	45	35
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)[C@]1(C)CCC(=O)N1)c1ccccc1	ZINC000875369197	GE	On-Demand	Anodyne	PSMB8	56	32
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C)cc1OC	ZINC000875369200	EE	On-Demand	Anodyne	SLC6A4	27	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C)cc1OC	ZINC000875369200	EE	On-Demand	Anodyne	SLC6A3	53	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C)cc1OC	ZINC000875369201	EE	On-Demand	Anodyne	SLC6A4	27	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C)cc1OC	ZINC000875369201	EE	On-Demand	Anodyne	SLC6A3	53	40
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)C1(C)CC(F)(F)C1)c1ccccc1	ZINC000875369208	GH	On-Demand	Anodyne	ACE	50	37
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)C1(C)CC(F)(F)C1)c1ccccc1	ZINC000875369208	GH	On-Demand	Anodyne	MME	106	40
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)C1(C)CC(F)(F)C1)c1ccccc1	ZINC000875369208	GH	On-Demand	Anodyne	ANPEP	49	35
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)C1(C)CC(F)(F)C1)c1ccccc1	ZINC000875369208	GH	On-Demand	Anodyne	CMA1	40	33
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)C1(C)CC(F)(F)C1)c1ccccc1	ZINC000875369208	GH	On-Demand	Anodyne	FCER2	58	34
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)C1(C)CC(F)(F)C1)c1ccccc1	ZINC000875369208	GH	On-Demand	Anodyne	PAPA1_CARPA	49	39
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)C1(C)CC(F)(F)C1)c1ccccc1	ZINC000875369208	GH	On-Demand	Anodyne	CACNA1B	41	35
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)C1(C)CC(F)(F)C1)c1ccccc1	ZINC000875369208	GH	On-Demand	Anodyne	TIMP3	80	36
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)C1(C)CC(F)(F)C1)c1ccccc1	ZINC000875369208	GH	On-Demand	Anodyne	CAPNS1	66	36
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)C1(C)CC(F)(F)C1)c1ccccc1	ZINC000875369208	GH	On-Demand	Anodyne	CAPN1	57	38
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)C1(C)CC(F)(F)C1)c1ccccc1	ZINC000875369208	GH	On-Demand	Anodyne	CAPN2	55	37
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)C1(C)CC(F)(F)C1)c1ccccc1	ZINC000875369208	GH	On-Demand	Anodyne	ACE2	74	37
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)C1(C)CC(F)(F)C1)c1ccccc1	ZINC000875369208	GH	On-Demand	Anodyne	FPR1	72	37
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)C1(C)CC(F)(F)C1)c1ccccc1	ZINC000875369208	GH	On-Demand	Anodyne	PSMB8	66	37
CCc1cc(NC(=O)C2(c3ccnc4ccccc34)CC2)nc(C)n1	ZINC000875369209	EH	On-Demand	Anodyne	ADAM17	56	37
C[S@@](=O)c1ccc(NC(=O)CC[C@@H]2CC[C@H](C(N)=O)O2)cc1F	ZINC000875369210	ED	On-Demand	Anodyne	PTPRF	40	31
C[S@](=O)c1ccc(NC(=O)CC[C@@H]2CC[C@H](C(N)=O)O2)cc1F	ZINC000875369211	ED	On-Demand	Anodyne	PTPRF	40	31
COC(=O)N(C)NC(=O)NC[C@H]1CCN(CC(C)C)C1	ZINC000875369248	CC	On-Demand	Reactive	CACNA1I	49	35
COC(=O)N(C)NC(=O)NC[C@@H]1CCN(CC(C)C)C1	ZINC000875369249	CC	On-Demand	Reactive	CACNA1I	49	35
C[C@@](CO)(Cc1ccc(F)cc1)NC(=O)NCCC1CCC1	ZINC000875369307	DF	On-Demand	Anodyne	CCR3	51	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(c3ncccc3F)C2)C1	ZINC000875369317	FD	On-Demand	Anodyne	PRKCQ	40	31
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(c3ncccc3F)C2)C1	ZINC000875369318	FD	On-Demand	Anodyne	PRKCQ	40	31
O=C(NC1CCN(S(=O)(=O)C(F)(F)F)CC1)N1CC=CC1	ZINC000875369344	EC	On-Demand	Anodyne	EPHX2	26	40
COC(=O)C1(O)CN(C(=O)NCC2(Cc3ccccc3)CCC2)C1	ZINC000875369391	ED	On-Demand	Anodyne	NPFFR2	18	40
COC(=O)C1(O)CN(C(=O)NCC2(Cc3ccccc3)CCC2)C1	ZINC000875369391	ED	On-Demand	Anodyne	NPFFR1	19	40
COC(=O)C1(O)CN(C(=O)NCC2(Cc3ccccc3)CCC2)C1	ZINC000875369391	ED	On-Demand	Anodyne	SLC12A5	74	42
COc1cc(C)ccc1CNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875369419	GH	On-Demand	Anodyne	KCNA3	42	38
CCO[C@@H](C(=O)Nc1ccc([S@](C)=O)c(F)c1)C1CCOCC1	ZINC000875369445	EE	On-Demand	Anodyne	NPY2R	45	42
CCO[C@@H](C(=O)Nc1ccc([S@@](C)=O)c(F)c1)C1CCOCC1	ZINC000875369446	EE	On-Demand	Anodyne	NPY2R	45	42
CCOc1ccc([C@@H](C)NC(=O)CCCNC(=O)NC[C@H]2C[C@H](O)C2)cc1	ZINC000875369537	GE	On-Demand	Anodyne	ACACA	16	40
CCOc1ccc([C@@H](C)NC(=O)CCCNC(=O)NC[C@H]2C[C@H](O)C2)cc1	ZINC000875369537	GE	On-Demand	Anodyne	ACACB	18	43
O=C(NCCO)C1CCN(C(=O)NCC2(Cc3ccccc3)CCC2)CC1	ZINC000875369578	FD	On-Demand	Anodyne	CACNA1G	33	43
O=C(NCCO)C1CCN(C(=O)NCC2(Cc3ccccc3)CCC2)CC1	ZINC000875369578	FD	On-Demand	Anodyne	SMO	17	41
COc1cccc(C(C)(C)C(=O)Nc2ccc([S@](C)=O)c(F)c2)c1	ZINC000875369581	EG	On-Demand	Anodyne	NPY2R	28	40
COc1cccc(C(C)(C)C(=O)Nc2ccc([S@](C)=O)c(F)c2)c1	ZINC000875369581	EG	On-Demand	Anodyne	TAAR1	25	41
COc1cccc(C(C)(C)C(=O)Nc2ccc([S@@](C)=O)c(F)c2)c1	ZINC000875369582	EG	On-Demand	Anodyne	NPY2R	28	40
COc1cccc(C(C)(C)C(=O)Nc2ccc([S@@](C)=O)c(F)c2)c1	ZINC000875369582	EG	On-Demand	Anodyne	TAAR1	25	41
CCc1cc(NC(=O)CCc2ccc(N3CCCS3(=O)=O)cc2)nc(C)n1	ZINC000875369589	GE	On-Demand	Anodyne	CDK1	19	46
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)c1ccccc1	ZINC000875369607	GF	On-Demand	Anodyne	ACE	25	40
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)c1ccccc1	ZINC000875369607	GF	On-Demand	Anodyne	MME	73	41
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)c1ccccc1	ZINC000875369607	GF	On-Demand	Anodyne	TIMP3	82	37
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)c1ccccc1	ZINC000875369607	GF	On-Demand	Anodyne	CAPNS1	60	37
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)c1ccccc1	ZINC000875369607	GF	On-Demand	Anodyne	CAPN1	54	36
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)c1ccccc1	ZINC000875369607	GF	On-Demand	Anodyne	ACE2	46	33
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)c1ccccc1	ZINC000875369607	GF	On-Demand	Anodyne	CTSC	22	41
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)c1ccccc1	ZINC000875369607	GF	On-Demand	Anodyne	FPR1	44	34
CN(C(=O)[C@H](Cc1ccccc1)NC(=O)C1(F)CCOCC1)c1ccccc1	ZINC000875369607	GF	On-Demand	Anodyne	PSMB8	60	38
O=C(N1CCC[C@H]2CCC[C@@H]21)C1(c2ccnc3ccccc23)CC1	ZINC000875369642	DI	On-Demand	Anodyne	PREP	22	40
O=C(N1CCC[C@H]2CCC[C@H]21)C1(c2ccnc3ccccc23)CC1	ZINC000875369643	DI	On-Demand	Anodyne	PREP	22	40
O=C(N1CCC[C@@H]2CCC[C@H]21)C1(c2ccnc3ccccc23)CC1	ZINC000875369644	DI	On-Demand	Anodyne	PREP	22	40
O=C(N1CCC[C@@H]2CCC[C@@H]21)C1(c2ccnc3ccccc23)CC1	ZINC000875369645	DI	On-Demand	Anodyne	PREP	22	40
COc1cc(C)ccc1CNC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875369654	ED	On-Demand	Anodyne	CCR2	17	41
C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1ccc(-n2cccn2)nc1	ZINC000875369716	IE	On-Demand	Reactive	AMP1_PLAFQ	41	32
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NCCC2CCC2)[C@@H](O)C1	ZINC000875369747	ED	On-Demand	Anodyne	GPR119	34	40
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCCC2CCC2)[C@@H](O)C1	ZINC000875369748	ED	On-Demand	Anodyne	GPR119	34	40
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NCCC2CCC2)[C@H](O)C1	ZINC000875369749	ED	On-Demand	Anodyne	GPR119	34	40
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCCC2CCC2)[C@H](O)C1	ZINC000875369750	ED	On-Demand	Anodyne	GPR119	34	40
COc1cc(C)ccc1CNC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875369764	ED	On-Demand	Anodyne	EPHX2	40	56
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	ZINC000875369773	GF	On-Demand	Anodyne	MME	73	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	ZINC000875369773	GF	On-Demand	Anodyne	ANPEP	48	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	ZINC000875369773	GF	On-Demand	Anodyne	CMA1	40	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	ZINC000875369773	GF	On-Demand	Anodyne	CTRA_BOVIN	34	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	ZINC000875369773	GF	On-Demand	Anodyne	FCER2	94	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	ZINC000875369773	GF	On-Demand	Anodyne	KLK3	76	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	ZINC000875369773	GF	On-Demand	Anodyne	CTSB	71	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	ZINC000875369773	GF	On-Demand	Anodyne	PAPA1_CARPA	80	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	ZINC000875369773	GF	On-Demand	Anodyne	CYSP_TRYCR	64	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	ZINC000875369773	GF	On-Demand	Anodyne	CTSK	33	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	ZINC000875369773	GF	On-Demand	Anodyne	CTSL	64	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	ZINC000875369773	GF	On-Demand	Anodyne	TIMP3	97	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	ZINC000875369773	GF	On-Demand	Anodyne	CAPNS1	71	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	ZINC000875369773	GF	On-Demand	Anodyne	MMP3	38	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	ZINC000875369773	GF	On-Demand	Anodyne	MMP8	21	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	ZINC000875369773	GF	On-Demand	Anodyne	GRIA1	41	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	ZINC000875369773	GF	On-Demand	Anodyne	HLA-DRB1	100	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	ZINC000875369773	GF	On-Demand	Anodyne	REN	29	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	ZINC000875369773	GF	On-Demand	Anodyne	CTSS	25	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	ZINC000875369773	GF	On-Demand	Anodyne	CAPN1	87	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	ZINC000875369773	GF	On-Demand	Anodyne	MMP9	22	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	ZINC000875369773	GF	On-Demand	Anodyne	CAPN2	115	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	ZINC000875369773	GF	On-Demand	Anodyne	ACE2	61	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	ZINC000875369773	GF	On-Demand	Anodyne	PLAU	40	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	ZINC000875369773	GF	On-Demand	Anodyne	FPR1	64	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	ZINC000875369773	GF	On-Demand	Anodyne	GPR142	52	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@](C)=O)c(F)c1	ZINC000875369774	GF	On-Demand	Anodyne	MME	73	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@](C)=O)c(F)c1	ZINC000875369774	GF	On-Demand	Anodyne	ANPEP	48	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@](C)=O)c(F)c1	ZINC000875369774	GF	On-Demand	Anodyne	CMA1	40	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@](C)=O)c(F)c1	ZINC000875369774	GF	On-Demand	Anodyne	CTRA_BOVIN	34	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@](C)=O)c(F)c1	ZINC000875369774	GF	On-Demand	Anodyne	FCER2	94	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@](C)=O)c(F)c1	ZINC000875369774	GF	On-Demand	Anodyne	KLK3	76	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@](C)=O)c(F)c1	ZINC000875369774	GF	On-Demand	Anodyne	CTSB	71	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@](C)=O)c(F)c1	ZINC000875369774	GF	On-Demand	Anodyne	PAPA1_CARPA	80	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@](C)=O)c(F)c1	ZINC000875369774	GF	On-Demand	Anodyne	CYSP_TRYCR	64	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@](C)=O)c(F)c1	ZINC000875369774	GF	On-Demand	Anodyne	CTSK	33	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@](C)=O)c(F)c1	ZINC000875369774	GF	On-Demand	Anodyne	CTSL	64	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@](C)=O)c(F)c1	ZINC000875369774	GF	On-Demand	Anodyne	TIMP3	97	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@](C)=O)c(F)c1	ZINC000875369774	GF	On-Demand	Anodyne	CAPNS1	71	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@](C)=O)c(F)c1	ZINC000875369774	GF	On-Demand	Anodyne	MMP3	38	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@](C)=O)c(F)c1	ZINC000875369774	GF	On-Demand	Anodyne	MMP8	21	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@](C)=O)c(F)c1	ZINC000875369774	GF	On-Demand	Anodyne	GRIA1	41	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@](C)=O)c(F)c1	ZINC000875369774	GF	On-Demand	Anodyne	HLA-DRB1	100	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@](C)=O)c(F)c1	ZINC000875369774	GF	On-Demand	Anodyne	REN	29	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@](C)=O)c(F)c1	ZINC000875369774	GF	On-Demand	Anodyne	CTSS	25	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@](C)=O)c(F)c1	ZINC000875369774	GF	On-Demand	Anodyne	CAPN1	87	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@](C)=O)c(F)c1	ZINC000875369774	GF	On-Demand	Anodyne	MMP9	22	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@](C)=O)c(F)c1	ZINC000875369774	GF	On-Demand	Anodyne	CAPN2	115	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@](C)=O)c(F)c1	ZINC000875369774	GF	On-Demand	Anodyne	ACE2	61	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@](C)=O)c(F)c1	ZINC000875369774	GF	On-Demand	Anodyne	PLAU	40	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@](C)=O)c(F)c1	ZINC000875369774	GF	On-Demand	Anodyne	FPR1	64	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc([S@](C)=O)c(F)c1	ZINC000875369774	GF	On-Demand	Anodyne	GPR142	52	39
C#CC[C@@H](COC)NC(=O)C(=O)NCCN1CCc2c(Cl)cccc2C1	ZINC000875369777	GC	On-Demand	Mild	DRD4	46	39
C#CC[C@H](COC)NC(=O)C(=O)NCCN1CCc2c(Cl)cccc2C1	ZINC000875369778	GC	On-Demand	Mild	DRD4	46	39
COC(=O)N(C)NC(=O)NCC1(Cc2ccccc2)CCC1	ZINC000875369815	DE	On-Demand	Reactive	SLC12A5	43	37
COC(=O)N(C)NC(=O)NCC1(Cc2ccccc2)CCC1	ZINC000875369815	DE	On-Demand	Reactive	HCN1	48	30
COC(=O)N(C)NC(=O)NCC1(Cc2ccccc2)CCC1	ZINC000875369815	DE	On-Demand	Reactive	HCN4	47	30
C[S@@](=O)c1ccc(NC(=O)c2cccn(C3CC3)c2=O)cc1F	ZINC000875369816	EE	On-Demand	Anodyne	HTR1F	20	41
C[S@@](=O)c1ccc(NC(=O)c2cccn(C3CC3)c2=O)cc1F	ZINC000875369816	EE	On-Demand	Anodyne	NPY2R	40	37
C[S@](=O)c1ccc(NC(=O)c2cccn(C3CC3)c2=O)cc1F	ZINC000875369817	EE	On-Demand	Anodyne	HTR1F	20	41
C[S@](=O)c1ccc(NC(=O)c2cccn(C3CC3)c2=O)cc1F	ZINC000875369817	EE	On-Demand	Anodyne	NPY2R	40	37
Cc1ccccc1[C@H](C)NC(=O)/C=C\c1ccc(I)o1	ZINC000875369826	GI	On-Demand	Anodyne	KCNQ2	46	35
Cc1ccccc1[C@H](C)NC(=O)/C=C\c1ccc(I)o1	ZINC000875369826	GI	On-Demand	Anodyne	UL26	99	41
Cc1ccccc1[C@H](C)NC(=O)/C=C\c1ccc(I)o1	ZINC000875369826	GI	On-Demand	Anodyne	SCAF_EBVB9	86	41
Cc1ccccc1[C@@H](C)NC(=O)/C=C\c1ccc(I)o1	ZINC000875369827	GI	On-Demand	Anodyne	KCNQ2	46	35
Cc1ccccc1[C@@H](C)NC(=O)/C=C\c1ccc(I)o1	ZINC000875369827	GI	On-Demand	Anodyne	UL26	99	41
Cc1ccccc1[C@@H](C)NC(=O)/C=C\c1ccc(I)o1	ZINC000875369827	GI	On-Demand	Anodyne	SCAF_EBVB9	86	41
COc1cc(C)ccc1CNC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875369835	DE	On-Demand	Anodyne	EPHX2	18	44
COc1cc(C)ccc1CNC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875369836	DE	On-Demand	Anodyne	EPHX2	18	44
O=C(NC[C@H]1C[C@H](O)C1)NCC1(Cc2ccccc2)CCC1	ZINC000875369842	DE	On-Demand	Anodyne	NPFFR2	18	40
O=C(NC[C@H]1C[C@H](O)C1)NCC1(Cc2ccccc2)CCC1	ZINC000875369842	DE	On-Demand	Anodyne	NPFFR1	15	40
COC(=O)[C@@H]1CO[C@H](CCC(=O)Nc2ccc([S@](C)=O)c(F)c2)C1	ZINC000875369850	FD	On-Demand	Anodyne	PTPRF	41	32
COC(=O)[C@@H]1CO[C@H](CCC(=O)Nc2ccc([S@@](C)=O)c(F)c2)C1	ZINC000875369851	FD	On-Demand	Anodyne	PTPRF	41	32
O=C(NC1(C(=O)N2CCC[C@@H]3CCC[C@H]32)CC1)OCc1ccccc1	ZINC000875369872	EG	On-Demand	Anodyne	ACE	40	45
O=C(NC1(C(=O)N2CCC[C@@H]3CCC[C@H]32)CC1)OCc1ccccc1	ZINC000875369872	EG	On-Demand	Anodyne	FKBP1A	38	42
O=C(NC1(C(=O)N2CCC[C@@H]3CCC[C@H]32)CC1)OCc1ccccc1	ZINC000875369872	EG	On-Demand	Anodyne	CELA1	25	42
O=C(NC1(C(=O)N2CCC[C@@H]3CCC[C@H]32)CC1)OCc1ccccc1	ZINC000875369872	EG	On-Demand	Anodyne	ELANE	24	42
O=C(NC1(C(=O)N2CCC[C@@H]3CCC[C@H]32)CC1)OCc1ccccc1	ZINC000875369872	EG	On-Demand	Anodyne	CTRA_BOVIN	63	34
O=C(NC1(C(=O)N2CCC[C@@H]3CCC[C@H]32)CC1)OCc1ccccc1	ZINC000875369872	EG	On-Demand	Anodyne	CTSB	23	46
O=C(NC1(C(=O)N2CCC[C@@H]3CCC[C@H]32)CC1)OCc1ccccc1	ZINC000875369872	EG	On-Demand	Anodyne	TRY1_BOVIN	45	34
O=C(NC1(C(=O)N2CCC[C@@H]3CCC[C@H]32)CC1)OCc1ccccc1	ZINC000875369872	EG	On-Demand	Anodyne	CTSG	43	34
O=C(NC1(C(=O)N2CCC[C@@H]3CCC[C@H]32)CC1)OCc1ccccc1	ZINC000875369872	EG	On-Demand	Anodyne	CTSK	26	46
O=C(NC1(C(=O)N2CCC[C@@H]3CCC[C@H]32)CC1)OCc1ccccc1	ZINC000875369872	EG	On-Demand	Anodyne	PREP	66	45
O=C(NC1(C(=O)N2CCC[C@@H]3CCC[C@H]32)CC1)OCc1ccccc1	ZINC000875369872	EG	On-Demand	Anodyne	CELA2A	51	34
O=C(NC1(C(=O)N2CCC[C@@H]3CCC[C@H]32)CC1)OCc1ccccc1	ZINC000875369872	EG	On-Demand	Anodyne	LGMN	59	39
O=C(NC1(C(=O)N2CCC[C@@H]3CCC[C@H]32)CC1)OCc1ccccc1	ZINC000875369872	EG	On-Demand	Anodyne	KLK5	31	40
O=C(NC1(C(=O)N2CCC[C@@H]3CCC[C@H]32)CC1)OCc1ccccc1	ZINC000875369872	EG	On-Demand	Anodyne	SLC12A5	77	40
O=C(NC1(C(=O)N2CCC[C@H]3CCC[C@H]32)CC1)OCc1ccccc1	ZINC000875369873	EG	On-Demand	Anodyne	ACE	40	45
O=C(NC1(C(=O)N2CCC[C@H]3CCC[C@H]32)CC1)OCc1ccccc1	ZINC000875369873	EG	On-Demand	Anodyne	FKBP1A	38	42
O=C(NC1(C(=O)N2CCC[C@H]3CCC[C@H]32)CC1)OCc1ccccc1	ZINC000875369873	EG	On-Demand	Anodyne	CELA1	25	42
O=C(NC1(C(=O)N2CCC[C@H]3CCC[C@H]32)CC1)OCc1ccccc1	ZINC000875369873	EG	On-Demand	Anodyne	ELANE	24	42
O=C(NC1(C(=O)N2CCC[C@H]3CCC[C@H]32)CC1)OCc1ccccc1	ZINC000875369873	EG	On-Demand	Anodyne	CTRA_BOVIN	63	34
O=C(NC1(C(=O)N2CCC[C@H]3CCC[C@H]32)CC1)OCc1ccccc1	ZINC000875369873	EG	On-Demand	Anodyne	CTSB	23	46
O=C(NC1(C(=O)N2CCC[C@H]3CCC[C@H]32)CC1)OCc1ccccc1	ZINC000875369873	EG	On-Demand	Anodyne	TRY1_BOVIN	45	34
O=C(NC1(C(=O)N2CCC[C@H]3CCC[C@H]32)CC1)OCc1ccccc1	ZINC000875369873	EG	On-Demand	Anodyne	CTSG	43	34
O=C(NC1(C(=O)N2CCC[C@H]3CCC[C@H]32)CC1)OCc1ccccc1	ZINC000875369873	EG	On-Demand	Anodyne	CTSK	26	46
O=C(NC1(C(=O)N2CCC[C@H]3CCC[C@H]32)CC1)OCc1ccccc1	ZINC000875369873	EG	On-Demand	Anodyne	PREP	66	45
O=C(NC1(C(=O)N2CCC[C@H]3CCC[C@H]32)CC1)OCc1ccccc1	ZINC000875369873	EG	On-Demand	Anodyne	CELA2A	51	34
O=C(NC1(C(=O)N2CCC[C@H]3CCC[C@H]32)CC1)OCc1ccccc1	ZINC000875369873	EG	On-Demand	Anodyne	LGMN	59	39
O=C(NC1(C(=O)N2CCC[C@H]3CCC[C@H]32)CC1)OCc1ccccc1	ZINC000875369873	EG	On-Demand	Anodyne	KLK5	31	40
O=C(NC1(C(=O)N2CCC[C@H]3CCC[C@H]32)CC1)OCc1ccccc1	ZINC000875369873	EG	On-Demand	Anodyne	SLC12A5	77	40
O=C(NC1(C(=O)N2CCC[C@@H]3CCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875369874	EG	On-Demand	Anodyne	ACE	40	45
O=C(NC1(C(=O)N2CCC[C@@H]3CCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875369874	EG	On-Demand	Anodyne	FKBP1A	38	42
O=C(NC1(C(=O)N2CCC[C@@H]3CCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875369874	EG	On-Demand	Anodyne	CELA1	25	42
O=C(NC1(C(=O)N2CCC[C@@H]3CCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875369874	EG	On-Demand	Anodyne	ELANE	24	42
O=C(NC1(C(=O)N2CCC[C@@H]3CCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875369874	EG	On-Demand	Anodyne	CTRA_BOVIN	63	34
O=C(NC1(C(=O)N2CCC[C@@H]3CCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875369874	EG	On-Demand	Anodyne	CTSB	23	46
O=C(NC1(C(=O)N2CCC[C@@H]3CCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875369874	EG	On-Demand	Anodyne	TRY1_BOVIN	45	34
O=C(NC1(C(=O)N2CCC[C@@H]3CCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875369874	EG	On-Demand	Anodyne	CTSG	43	34
O=C(NC1(C(=O)N2CCC[C@@H]3CCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875369874	EG	On-Demand	Anodyne	CTSK	26	46
O=C(NC1(C(=O)N2CCC[C@@H]3CCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875369874	EG	On-Demand	Anodyne	PREP	66	45
O=C(NC1(C(=O)N2CCC[C@@H]3CCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875369874	EG	On-Demand	Anodyne	CELA2A	51	34
O=C(NC1(C(=O)N2CCC[C@@H]3CCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875369874	EG	On-Demand	Anodyne	LGMN	59	39
O=C(NC1(C(=O)N2CCC[C@@H]3CCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875369874	EG	On-Demand	Anodyne	KLK5	31	40
O=C(NC1(C(=O)N2CCC[C@@H]3CCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875369874	EG	On-Demand	Anodyne	SLC12A5	77	40
O=C(NC1(C(=O)N2CCC[C@H]3CCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875369875	EG	On-Demand	Anodyne	ACE	40	45
O=C(NC1(C(=O)N2CCC[C@H]3CCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875369875	EG	On-Demand	Anodyne	FKBP1A	38	42
O=C(NC1(C(=O)N2CCC[C@H]3CCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875369875	EG	On-Demand	Anodyne	CELA1	25	42
O=C(NC1(C(=O)N2CCC[C@H]3CCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875369875	EG	On-Demand	Anodyne	ELANE	24	42
O=C(NC1(C(=O)N2CCC[C@H]3CCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875369875	EG	On-Demand	Anodyne	CTRA_BOVIN	63	34
O=C(NC1(C(=O)N2CCC[C@H]3CCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875369875	EG	On-Demand	Anodyne	CTSB	23	46
O=C(NC1(C(=O)N2CCC[C@H]3CCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875369875	EG	On-Demand	Anodyne	TRY1_BOVIN	45	34
O=C(NC1(C(=O)N2CCC[C@H]3CCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875369875	EG	On-Demand	Anodyne	CTSG	43	34
O=C(NC1(C(=O)N2CCC[C@H]3CCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875369875	EG	On-Demand	Anodyne	CTSK	26	46
O=C(NC1(C(=O)N2CCC[C@H]3CCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875369875	EG	On-Demand	Anodyne	PREP	66	45
O=C(NC1(C(=O)N2CCC[C@H]3CCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875369875	EG	On-Demand	Anodyne	CELA2A	51	34
O=C(NC1(C(=O)N2CCC[C@H]3CCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875369875	EG	On-Demand	Anodyne	LGMN	59	39
O=C(NC1(C(=O)N2CCC[C@H]3CCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875369875	EG	On-Demand	Anodyne	KLK5	31	40
O=C(NC1(C(=O)N2CCC[C@H]3CCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875369875	EG	On-Demand	Anodyne	SLC12A5	77	40
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCN1CCc2c(Cl)cccc2C1	ZINC000875369878	GD	On-Demand	Mild	DRD4	48	40
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCN1CCc2c(Cl)cccc2C1	ZINC000875369878	GD	On-Demand	Mild	DRD3	34	40
C#CC[C@H](CCOC)NC(=O)C(=O)NCCN1CCc2c(Cl)cccc2C1	ZINC000875369879	GD	On-Demand	Mild	DRD4	48	40
C#CC[C@H](CCOC)NC(=O)C(=O)NCCN1CCc2c(Cl)cccc2C1	ZINC000875369879	GD	On-Demand	Mild	DRD3	34	40
C[S@@](=O)c1ccc(NC(=O)C2(NC(=O)OCc3ccccc3)CC2)cc1F	ZINC000875369880	GF	On-Demand	Anodyne	CTSK	19	47
C[S@@](=O)c1ccc(NC(=O)C2(NC(=O)OCc3ccccc3)CC2)cc1F	ZINC000875369880	GF	On-Demand	Anodyne	SLC12A5	51	33
C[S@](=O)c1ccc(NC(=O)C2(NC(=O)OCc3ccccc3)CC2)cc1F	ZINC000875369881	GF	On-Demand	Anodyne	CTSK	19	47
C[S@](=O)c1ccc(NC(=O)C2(NC(=O)OCc3ccccc3)CC2)cc1F	ZINC000875369881	GF	On-Demand	Anodyne	SLC12A5	51	33
COc1cc(C)ccc1CNC(=O)NNc1cccc(C)n1	ZINC000875369927	DF	On-Demand	Reactive	GRM5	16	41
CCC[C@H](CC)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	ZINC000875369935	CG	On-Demand	Anodyne	NPY2R	43	41
CCC[C@@H](CC)C(=O)Nc1ccc([S@](C)=O)c(F)c1	ZINC000875369936	CG	On-Demand	Anodyne	NPY2R	43	41
CCC[C@@H](CC)C(=O)Nc1ccc([S@@](C)=O)c(F)c1	ZINC000875369937	CG	On-Demand	Anodyne	NPY2R	43	41
CCC[C@H](CC)C(=O)Nc1ccc([S@](C)=O)c(F)c1	ZINC000875369938	CG	On-Demand	Anodyne	NPY2R	43	41
C[S@](=O)c1ccc(NC(=O)c2cccc(OC(C)(C)C)c2)cc1F	ZINC000875369953	EH	On-Demand	Anodyne	TAAR1	50	43
C[S@](=O)c1ccc(NC(=O)c2cccc(OC(C)(C)C)c2)cc1F	ZINC000875369953	EH	On-Demand	Anodyne	KCNK3	109	44
C[S@](=O)c1ccc(NC(=O)c2cccc(OC(C)(C)C)c2)cc1F	ZINC000875369953	EH	On-Demand	Anodyne	KCNK9	68	39
C[S@@](=O)c1ccc(NC(=O)c2cccc(OC(C)(C)C)c2)cc1F	ZINC000875369954	EH	On-Demand	Anodyne	TAAR1	50	43
C[S@@](=O)c1ccc(NC(=O)c2cccc(OC(C)(C)C)c2)cc1F	ZINC000875369954	EH	On-Demand	Anodyne	KCNK3	109	44
C[S@@](=O)c1ccc(NC(=O)c2cccc(OC(C)(C)C)c2)cc1F	ZINC000875369954	EH	On-Demand	Anodyne	KCNK9	68	39
O=C(NCc1ccc2c(c1)CCS2(=O)=O)N1Cc2cccc(O)c2C1	ZINC000875369964	FD	On-Demand	Clean	NAMPT	21	42
COc1cc(C)ccc1CNC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875369967	DF	On-Demand	Anodyne	EPHX2	19	43
COc1cc(C)ccc1CNC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875369968	DF	On-Demand	Anodyne	EPHX2	19	43
O=CN1CCCN(C(=O)NCC2(Cc3ccccc3)CCC2)CC1	ZINC000875369980	EE	On-Demand	Anodyne	NPFFR2	18	44
O=CN1CCCN(C(=O)NCC2(Cc3ccccc3)CCC2)CC1	ZINC000875369980	EE	On-Demand	Anodyne	NPFFR1	25	44
O=CN1CCCN(C(=O)NCC2(Cc3ccccc3)CCC2)CC1	ZINC000875369980	EE	On-Demand	Anodyne	SLC12A5	43	34
CCc1cc(NC(=O)Cc2cn3cc(F)ccc3n2)nc(C)n1	ZINC000875370035	DE	On-Demand	Anodyne	MAP3K5	21	42
COc1cc(C)ccc1CNC(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875370068	EH	On-Demand	Anodyne	EPHX2	26	47
COc1cc(C)ccc1CNC(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875370069	EH	On-Demand	Anodyne	EPHX2	26	47
CCO[C@@H](C(=O)Nc1ccc([S@@](C)=O)c(F)c1)C1CCCC1	ZINC000875370118	EG	On-Demand	Anodyne	NPY2R	43	35
CCO[C@@H](C(=O)Nc1ccc([S@](C)=O)c(F)c1)C1CCCC1	ZINC000875370121	EG	On-Demand	Anodyne	NPY2R	43	35
O=C(NCc1ccc2c(c1)CCS2(=O)=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875370130	GF	On-Demand	Anodyne	EPHX2	15	42
O=C(NCc1ccc2c(c1)CCS2(=O)=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875370131	GF	On-Demand	Anodyne	EPHX2	15	42
Cc1nnc(NNC(=O)NCC2(Cc3ccccc3)CCC2)n1C	ZINC000875370144	EE	On-Demand	Reactive	NPFFR2	18	40
Cc1nnc(NNC(=O)NCC2(Cc3ccccc3)CCC2)n1C	ZINC000875370144	EE	On-Demand	Reactive	NPFFR1	27	40
C[S@](=O)c1ccc(NC(=O)c2noc3c2CC(C)(C)CC3)cc1F	ZINC000875370145	FG	On-Demand	Anodyne	PANC	55	40
C[S@@](=O)c1ccc(NC(=O)c2noc3c2CC(C)(C)CC3)cc1F	ZINC000875370146	FG	On-Demand	Anodyne	PANC	55	40
CCc1cc(NC(=O)Cc2csc(COc3ccccc3)n2)nc(C)n1	ZINC000875370169	FH	On-Demand	Anodyne	ADAM17	41	34
O=C(CN1C(=O)c2ccccc2S1(=O)=O)c1ccc(O)cc1	ZINC000875370178	DD	On-Demand	Anodyne	ELANE	16	53
O=C(CN1C(=O)c2ccccc2S1(=O)=O)c1ccc(O)cc1	ZINC000875370178	DD	On-Demand	Anodyne	CELA2A	17	43
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(C)cc1OC	ZINC000875370196	FF	On-Demand	Anodyne	ACKR3	62	32
COc1ccccc1N1CC[C@H](NC(=O)NCc2cc(C)ccc2O)C1=O	ZINC000875370198	FE	On-Demand	Clean	HTR1A	42	39
COc1ccccc1N1CC[C@@H](NC(=O)NCc2cc(C)ccc2O)C1=O	ZINC000875370199	FE	On-Demand	Clean	HTR1A	42	39
C[S@](=O)c1ccc(NC(=O)c2ccc3c(c2)OC(C)(C)C3)cc1F	ZINC000875370201	EH	On-Demand	Anodyne	RARA	25	43
C[S@@](=O)c1ccc(NC(=O)c2ccc3c(c2)OC(C)(C)C3)cc1F	ZINC000875370202	EH	On-Demand	Anodyne	RARA	25	43
COc1cc(C)ccc1CNC(=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875370203	EF	On-Demand	Anodyne	EPHX2	17	42
COc1cc(C)ccc1CNC(=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875370204	EF	On-Demand	Anodyne	EPHX2	17	42
CCCCCCCNC(=O)C(=O)N[C@@H]1CC(=O)N(C)[C@H]1c1cnn(C)c1C	ZINC000875370243	GD	On-Demand	Mild	ASAH1	61	33
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(c3ncccc3Cl)C2)C1	ZINC000875370278	GE	On-Demand	Anodyne	P2RY12	19	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(c3ncccc3Cl)C2)C1	ZINC000875370279	GE	On-Demand	Anodyne	P2RY12	19	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2ncccc2Cl)C1	ZINC000875370284	GE	On-Demand	Anodyne	SLC6A3	40	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2ncccc2Cl)C1	ZINC000875370285	GE	On-Demand	Anodyne	SLC6A3	40	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2ncccc2Cl)C1	ZINC000875370286	GE	On-Demand	Anodyne	SLC6A3	40	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2ncccc2Cl)C1	ZINC000875370287	GE	On-Demand	Anodyne	SLC6A3	40	37
O=C(NC[C@H]1CC(C(F)(F)F)=NO1)N[C@@H]1CCN(c2ncccc2Cl)C1	ZINC000875370373	GE	On-Demand	Anodyne	TRPV1	18	40
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)N[C@H]1CCN(c2ncccc2Cl)C1	ZINC000875370374	GE	On-Demand	Anodyne	TRPV1	18	40
O=C(NC[C@H]1CC(C(F)(F)F)=NO1)N[C@H]1CCN(c2ncccc2Cl)C1	ZINC000875370375	GE	On-Demand	Anodyne	TRPV1	18	40
O=C(NC[C@@H]1CC(C(F)(F)F)=NO1)N[C@@H]1CCN(c2ncccc2Cl)C1	ZINC000875370376	GE	On-Demand	Anodyne	TRPV1	18	40
COC(=O)c1ccc(CC(=O)N(Cc2ccc(F)cc2)CC(F)(F)F)cn1	ZINC000875370454	GG	On-Demand	Anodyne	PLA2G7	64	36
O=C(N[C@@H]1CCN(c2ncccc2Cl)C1)N1CCC2(CCNC2=O)CC1	ZINC000875370493	GD	On-Demand	Anodyne	CALCRL	16	41
O=C(N[C@H]1CCN(c2ncccc2Cl)C1)N1CCC2(CCNC2=O)CC1	ZINC000875370494	GD	On-Demand	Anodyne	CALCRL	16	41
O=C(N1C2CCCC1CCC2)C1(c2ccnc3ccccc23)CC1	ZINC000875370501	DI	On-Demand	Anodyne	HNMT	40	34
CC(=O)C1CCN(C(=O)N[C@H]2CCN(c3ncccc3Cl)C2)CC1	ZINC000875370527	FE	On-Demand	Anodyne	TRPV1	15	61
CC(=O)C1CCN(C(=O)N[C@@H]2CCN(c3ncccc3Cl)C2)CC1	ZINC000875370528	FE	On-Demand	Anodyne	TRPV1	15	61
CCCCCCCNC(=O)C(=O)N[C@H]1CCCN(c2ccnn2C)C1=O	ZINC000875370570	FD	On-Demand	Mild	ASAH1	60	35
CCCCCCCNC(=O)C(=O)N[C@@H]1CCCN(c2ccnn2C)C1=O	ZINC000875370571	FD	On-Demand	Mild	ASAH1	60	35
Cc1cncc([C@@H]2CCCN2C(=O)N[C@@H]2CCN(c3ncccc3Cl)C2)c1	ZINC000875370576	GH	On-Demand	Anodyne	SSTR5	27	40
Cc1cncc([C@H]2CCCN2C(=O)N[C@H]2CCN(c3ncccc3Cl)C2)c1	ZINC000875370577	GH	On-Demand	Anodyne	SSTR5	27	40
Cc1cncc([C@H]2CCCN2C(=O)N[C@@H]2CCN(c3ncccc3Cl)C2)c1	ZINC000875370578	GH	On-Demand	Anodyne	SSTR5	27	40
Cc1cncc([C@@H]2CCCN2C(=O)N[C@H]2CCN(c3ncccc3Cl)C2)c1	ZINC000875370579	GH	On-Demand	Anodyne	SSTR5	27	40
C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875370585	EE	On-Demand	Anodyne	EPHX2	21	48
C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875370586	EE	On-Demand	Anodyne	EPHX2	21	48
C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875370587	EE	On-Demand	Anodyne	EPHX2	21	48
C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875370588	EE	On-Demand	Anodyne	EPHX2	21	48
Cc1ccnn1CC(=O)N(Cc1ccc(F)cc1)CC(F)(F)F	ZINC000875370629	EF	On-Demand	Anodyne	PLA2G7	97	39
C[C@@H](O)C1CCN(C(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)CC1	ZINC000875370638	EE	On-Demand	Anodyne	SIGMAR1	25	40
C[C@@H](O)C1CCN(C(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)CC1	ZINC000875370639	EE	On-Demand	Anodyne	SIGMAR1	25	40
C[C@H]1C[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CN1Cc1ccccc1	ZINC000875370734	FD	On-Demand	Anodyne	CHRM1	15	42
C[C@H]1C[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CN1Cc1ccccc1	ZINC000875370734	FD	On-Demand	Anodyne	DRD4	35	47
C[C@H]1C[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CN1Cc1ccccc1	ZINC000875370734	FD	On-Demand	Anodyne	CHRM3	22	42
C[C@H]1C[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CN1Cc1ccccc1	ZINC000875370734	FD	On-Demand	Anodyne	SIGMAR1	34	45
C[C@H]1C[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CN1Cc1ccccc1	ZINC000875370734	FD	On-Demand	Anodyne	CCR3	26	41
C[C@H]1C[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CN1Cc1ccccc1	ZINC000875370734	FD	On-Demand	Anodyne	CCR2	15	42
C[C@H]1C[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CN1Cc1ccccc1	ZINC000875370734	FD	On-Demand	Anodyne	SLC6A5	29	43
C[C@H]1C[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CN1Cc1ccccc1	ZINC000875370734	FD	On-Demand	Anodyne	MCHR1	17	44
C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875370736	FE	On-Demand	Mild	ITK	16	49
C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875370736	FE	On-Demand	Mild	PANC	53	36
C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875370738	FE	On-Demand	Mild	ITK	16	49
C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875370738	FE	On-Demand	Mild	PANC	53	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	F2	44	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	ACE	132	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	TYR	32	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	OPRM1	64	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	OPRD1	59	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	P2RY12	75	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	CELA1	33	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	MME	151	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	ANPEP	62	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	TACR1	25	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	PGC	65	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	CMA1	70	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	CTRA_BOVIN	75	53
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	FCER2	71	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	KLK3	71	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	CTSB	84	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	PAPA1_CARPA	76	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	TRY1_BOVIN	58	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	CYSP_TRYCR	75	48
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	CCKAR	24	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	CTSG	47	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	CTSK	65	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	CTSL	72	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	PGA	42	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	NPFFR2	71	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	TIMP3	92	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	PREP	17	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	CAPNS1	96	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	HLA-DRB1	108	49
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	CELA2A	67	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	REN	99	49
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	REN1	42	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	CTSS	39	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	CAPN1	142	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	MMP9	21	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	CTRC	39	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	CAPN2	141	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	ACE2	100	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	TGM2	22	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	MMP1	25	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	FPR1	70	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	CTRB_BOVIN	51	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	NPR	47	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	XIAP	74	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	BLA1_STEMA	40	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	BRCA1	62	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C2CCCC1CCC2	ZINC000875370767	EG	On-Demand	Anodyne	NPFFR1	68	33
O=C1CCCCN(CC(=O)N(Cc2ccc(F)cc2)CC(F)(F)F)C1=O	ZINC000875370775	FE	On-Demand	Anodyne	PLA2G7	74	36
CCCCCCCNC(=O)C(=O)N[C@@H]1CC(=O)N(C)[C@H]1c1c(C)nn(C)c1C	ZINC000875370811	GD	On-Demand	Mild	ASAH1	43	31
CC[C@H](CN1CCCC1)NC(=O)NCc1ccc(O)c(Cl)c1	ZINC000875370812	EF	On-Demand	Anodyne	OPRK1	17	46
CC[C@@H](CN1CCCC1)NC(=O)NCc1ccc(O)c(Cl)c1	ZINC000875370813	EF	On-Demand	Anodyne	OPRK1	17	46
CC[C@H](CN1CCCC1)NC(=O)N(C)CCc1cccc(C#N)c1	ZINC000875370832	EF	On-Demand	Mild	MCHR1	23	40
CC[C@H](CN1CCCC1)NC(=O)N(C)CCc1cccc(C#N)c1	ZINC000875370832	EF	On-Demand	Mild	PTGES	21	41
CC[C@@H](CN1CCCC1)NC(=O)N(C)CCc1cccc(C#N)c1	ZINC000875370833	EF	On-Demand	Mild	MCHR1	23	40
CC[C@@H](CN1CCCC1)NC(=O)N(C)CCc1cccc(C#N)c1	ZINC000875370833	EF	On-Demand	Mild	PTGES	21	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](CC)CN1CCCC1	ZINC000875370848	CD	On-Demand	Anodyne	RIR1_HHV11	50	36
CC[C@@H](CN1CCCC1)NC(=O)N[C@H](CC)C[C@@H](C)O	ZINC000875370849	CD	On-Demand	Anodyne	RIR1_HHV11	50	36
CC[C@@H](CN1CCCC1)NC(=O)N[C@H](CC)C[C@H](C)O	ZINC000875370851	CD	On-Demand	Anodyne	RIR1_HHV11	50	36
O=C(NC1(C(=O)N2C3CCCC2CCC3)CC1)OCc1ccccc1	ZINC000875370894	EG	On-Demand	Anodyne	ACE	25	42
O=C(NC1(C(=O)N2C3CCCC2CCC3)CC1)OCc1ccccc1	ZINC000875370894	EG	On-Demand	Anodyne	CTSB	30	47
O=C(NC1(C(=O)N2C3CCCC2CCC3)CC1)OCc1ccccc1	ZINC000875370894	EG	On-Demand	Anodyne	CYSP_TRYCR	36	40
O=C(NC1(C(=O)N2C3CCCC2CCC3)CC1)OCc1ccccc1	ZINC000875370894	EG	On-Demand	Anodyne	CTSK	32	50
O=C(NC1(C(=O)N2C3CCCC2CCC3)CC1)OCc1ccccc1	ZINC000875370894	EG	On-Demand	Anodyne	PREP	30	41
O=C(NC1(C(=O)N2C3CCCC2CCC3)CC1)OCc1ccccc1	ZINC000875370894	EG	On-Demand	Anodyne	CAPNS1	52	36
O=C(NC1(C(=O)N2C3CCCC2CCC3)CC1)OCc1ccccc1	ZINC000875370894	EG	On-Demand	Anodyne	CAPN1	42	36
O=C(NC1(C(=O)N2C3CCCC2CCC3)CC1)OCc1ccccc1	ZINC000875370894	EG	On-Demand	Anodyne	CASP1	18	43
O=C(NC1(C(=O)N2C3CCCC2CCC3)CC1)OCc1ccccc1	ZINC000875370894	EG	On-Demand	Anodyne	CAPN2	69	36
O=C(NC1(C(=O)N2C3CCCC2CCC3)CC1)OCc1ccccc1	ZINC000875370894	EG	On-Demand	Anodyne	NPR	42	32
O=C(NC1(C(=O)N2C3CCCC2CCC3)CC1)OCc1ccccc1	ZINC000875370894	EG	On-Demand	Anodyne	SLC12A5	73	47
O=C(Cc1ccc(Cl)cn1)N(Cc1ccc(F)cc1)CC(F)(F)F	ZINC000875370951	FI	On-Demand	Anodyne	PLA2G7	97	37
CC[C@H](CN1CCCC1)NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875371043	FF	On-Demand	Mild	ITK	17	49
CC[C@@H](CN1CCCC1)NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875371044	FF	On-Demand	Mild	ITK	17	49
COC(=O)C1(O)CN(C(=O)NCc2ccc(OC)cc2F)C1	ZINC000875371048	DC	On-Demand	Anodyne	MTNR1A	40	34
COC(=O)C1(O)CN(C(=O)NCc2ccc(OC)cc2F)C1	ZINC000875371048	DC	On-Demand	Anodyne	MTNR1B	29	41
CC[C@@H](CN1CCCC1)NC(=O)NCCc1ccc(S(=O)(=O)NC)cc1	ZINC000875371073	GD	On-Demand	Anodyne	CA2	20	44
CC[C@@H](CN1CCCC1)NC(=O)NCCc1ccc(S(=O)(=O)NC)cc1	ZINC000875371073	GD	On-Demand	Anodyne	CA1	22	44
CC[C@@H](CN1CCCC1)NC(=O)NCCc1ccc(S(=O)(=O)NC)cc1	ZINC000875371073	GD	On-Demand	Anodyne	CA4	15	41
CC[C@@H](CN1CCCC1)NC(=O)NCCc1ccc(S(=O)(=O)NC)cc1	ZINC000875371073	GD	On-Demand	Anodyne	CA9	17	43
CC[C@H](CN1CCCC1)NC(=O)NCCc1ccc(S(=O)(=O)NC)cc1	ZINC000875371075	GD	On-Demand	Anodyne	CA2	20	44
CC[C@H](CN1CCCC1)NC(=O)NCCc1ccc(S(=O)(=O)NC)cc1	ZINC000875371075	GD	On-Demand	Anodyne	CA1	22	44
CC[C@H](CN1CCCC1)NC(=O)NCCc1ccc(S(=O)(=O)NC)cc1	ZINC000875371075	GD	On-Demand	Anodyne	CA4	15	41
CC[C@H](CN1CCCC1)NC(=O)NCCc1ccc(S(=O)(=O)NC)cc1	ZINC000875371075	GD	On-Demand	Anodyne	CA9	17	43
CC[C@H](CN1CCCC1)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875371155	EF	On-Demand	Anodyne	ACE	31	40
CC[C@H](CN1CCCC1)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875371155	EF	On-Demand	Anodyne	SLC6A1	45	40
CC[C@H](CN1CCCC1)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875371155	EF	On-Demand	Anodyne	OPRK1	21	40
CC[C@H](CN1CCCC1)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875371157	EF	On-Demand	Anodyne	ACE	31	40
CC[C@H](CN1CCCC1)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875371157	EF	On-Demand	Anodyne	SLC6A1	45	40
CC[C@H](CN1CCCC1)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875371157	EF	On-Demand	Anodyne	OPRK1	21	40
CC[C@H](CN1CCCC1)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875371159	EF	On-Demand	Anodyne	ACE	31	40
CC[C@H](CN1CCCC1)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875371159	EF	On-Demand	Anodyne	SLC6A1	45	40
CC[C@H](CN1CCCC1)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875371159	EF	On-Demand	Anodyne	OPRK1	21	40
CC[C@H](CN1CCCC1)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875371161	EF	On-Demand	Anodyne	ACE	31	40
CC[C@H](CN1CCCC1)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875371161	EF	On-Demand	Anodyne	SLC6A1	45	40
CC[C@H](CN1CCCC1)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875371161	EF	On-Demand	Anodyne	OPRK1	21	40
CC[C@@H]1COCCN1CCNC(=O)NCc1ccc(OC)cc1F	ZINC000875371210	ED	On-Demand	Anodyne	DRD4	40	31
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)C1	ZINC000875371292	EF	On-Demand	Anodyne	SLC6A1	53	32
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)C1	ZINC000875371292	EF	On-Demand	Anodyne	SIGMAR1	26	42
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)C1	ZINC000875371293	EF	On-Demand	Anodyne	SLC6A1	53	32
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)C1	ZINC000875371293	EF	On-Demand	Anodyne	SIGMAR1	26	42
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)C1	ZINC000875371294	EF	On-Demand	Anodyne	SLC6A1	53	32
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)C1	ZINC000875371294	EF	On-Demand	Anodyne	SIGMAR1	26	42
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)C1	ZINC000875371295	EF	On-Demand	Anodyne	SLC6A1	53	32
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)C1	ZINC000875371295	EF	On-Demand	Anodyne	SIGMAR1	26	42
CC(=O)C1CCN(C(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)CC1	ZINC000875371301	EF	On-Demand	Anodyne	DRD4	23	40
CC(=O)C1CCN(C(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)CC1	ZINC000875371301	EF	On-Demand	Anodyne	SIGMAR1	27	41
CC(=O)C1CCN(C(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)CC1	ZINC000875371302	EF	On-Demand	Anodyne	DRD4	23	40
CC(=O)C1CCN(C(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)CC1	ZINC000875371302	EF	On-Demand	Anodyne	SIGMAR1	27	41
CC(=O)C1CCN(C(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)CC1	ZINC000875371303	EF	On-Demand	Anodyne	DRD4	23	40
CC(=O)C1CCN(C(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)CC1	ZINC000875371303	EF	On-Demand	Anodyne	SIGMAR1	27	41
CC(=O)C1CCN(C(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)CC1	ZINC000875371304	EF	On-Demand	Anodyne	DRD4	23	40
CC(=O)C1CCN(C(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)CC1	ZINC000875371304	EF	On-Demand	Anodyne	SIGMAR1	27	41
COC(=O)N(C)NC(=O)NCc1ccc(OC)cc1F	ZINC000875371319	CD	On-Demand	Reactive	MTNR1A	73	39
COC(=O)N(C)NC(=O)NCc1ccc(OC)cc1F	ZINC000875371319	CD	On-Demand	Reactive	MTNR1B	56	38
CC[C@@H](CN1CCCC1)NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1	ZINC000875371347	GF	On-Demand	Anodyne	DRD4	26	46
CC[C@@H](CN1CCCC1)NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1	ZINC000875371347	GF	On-Demand	Anodyne	SSTR5	42	39
CC[C@@H](CN1CCCC1)NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1	ZINC000875371347	GF	On-Demand	Anodyne	CCR2	22	41
CC[C@@H](CN1CCCC1)NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1	ZINC000875371347	GF	On-Demand	Anodyne	EPHX2	18	47
CC[C@@H](CN1CCCC1)NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1	ZINC000875371347	GF	On-Demand	Anodyne	CCR8	30	41
CC[C@@H](CN1CCCC1)NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1	ZINC000875371347	GF	On-Demand	Anodyne	KCNK3	42	34
CC[C@H](CN1CCCC1)NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1	ZINC000875371349	GF	On-Demand	Anodyne	DRD4	26	46
CC[C@H](CN1CCCC1)NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1	ZINC000875371349	GF	On-Demand	Anodyne	SSTR5	42	39
CC[C@H](CN1CCCC1)NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1	ZINC000875371349	GF	On-Demand	Anodyne	CCR2	22	41
CC[C@H](CN1CCCC1)NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1	ZINC000875371349	GF	On-Demand	Anodyne	EPHX2	18	47
CC[C@H](CN1CCCC1)NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1	ZINC000875371349	GF	On-Demand	Anodyne	CCR8	30	41
CC[C@H](CN1CCCC1)NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1	ZINC000875371349	GF	On-Demand	Anodyne	KCNK3	42	34
CC[C@H](CN1CCCC1)NC(=O)N[C@H](CC)[C@@H](O)c1ccccc1	ZINC000875371508	EF	On-Demand	Anodyne	OPRK1	17	41
CC[C@H](CN1CCCC1)NC(=O)N[C@H](CC)[C@@H](O)c1ccccc1	ZINC000875371508	EF	On-Demand	Anodyne	KCNQ2	47	37
CC[C@H](CN1CCCC1)NC(=O)N[C@H](CC)[C@H](O)c1ccccc1	ZINC000875371509	EF	On-Demand	Anodyne	OPRK1	17	41
CC[C@H](CN1CCCC1)NC(=O)N[C@H](CC)[C@H](O)c1ccccc1	ZINC000875371509	EF	On-Demand	Anodyne	KCNQ2	47	37
C#CCCCCNC(=O)N[C@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875371639	EE	On-Demand	Mild	MTNR1A	41	42
C#CCCCCNC(=O)N[C@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875371639	EE	On-Demand	Mild	MTNR1B	37	42
C#CCCCCNC(=O)N[C@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875371640	EE	On-Demand	Mild	MTNR1A	41	42
C#CCCCCNC(=O)N[C@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875371640	EE	On-Demand	Mild	MTNR1B	37	42
C#CCCCCNC(=O)N[C@@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875371641	EE	On-Demand	Mild	MTNR1A	41	42
C#CCCCCNC(=O)N[C@@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875371641	EE	On-Demand	Mild	MTNR1B	37	42
C#CCCCCNC(=O)N[C@@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875371642	EE	On-Demand	Mild	MTNR1A	41	42
C#CCCCCNC(=O)N[C@@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875371642	EE	On-Demand	Mild	MTNR1B	37	42
CC[C@@H](CN1CCCC1)NC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875371679	FF	On-Demand	Anodyne	ROCK1	26	42
CC[C@@H](CN1CCCC1)NC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875371679	FF	On-Demand	Anodyne	ROCK2	18	42
CC[C@H](CN1CCCC1)NC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875371681	FF	On-Demand	Anodyne	ROCK1	26	42
CC[C@H](CN1CCCC1)NC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875371681	FF	On-Demand	Anodyne	ROCK2	18	42
CCCC[C@@H](CNC(=O)OC(C)(C)C)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875371683	EE	On-Demand	Anodyne	CTSK	15	41
CCCC[C@H](CNC(=O)OC(C)(C)C)NC(=O)NC[C@@H]1C[C@H](O)C1	ZINC000875371685	EE	On-Demand	Anodyne	CTSK	15	41
CCCC[C@@H](CNC(=O)OC(C)(C)C)NC(=O)NC[C@@H]1C[C@H](O)C1	ZINC000875371687	EE	On-Demand	Anodyne	CTSK	15	41
CCCC[C@H](CNC(=O)OC(C)(C)C)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875371689	EE	On-Demand	Anodyne	CTSK	15	41
CCCC[C@@H](CNC(=O)OC(C)(C)C)NC(=O)NCC1CC(O)C1	ZINC000875371691	EE	On-Demand	Anodyne	CTSK	15	41
CCCC[C@H](CNC(=O)OC(C)(C)C)NC(=O)NCC1CC(O)C1	ZINC000875371693	EE	On-Demand	Anodyne	CTSK	15	41
C#CCCCCNC(=O)NCCc1ccc(OC)c(O)c1	ZINC000875371699	CE	On-Demand	Mild	INHA	83	37
C#CCCCCNC(=O)NCCc1ccc(OC)c(O)c1	ZINC000875371699	CE	On-Demand	Mild	MTNR1A	15	47
C#CCCCCNC(=O)NCCc1ccc(OC)c(O)c1	ZINC000875371699	CE	On-Demand	Mild	MTNR1B	15	47
C#CCCCCNC(=O)N1CCCSC[C@H]1c1ccccc1OC	ZINC000875371715	EH	On-Demand	Mild	HTR1A	22	40
C#CCCCCNC(=O)N1CCCSC[C@@H]1c1ccccc1OC	ZINC000875371716	EH	On-Demand	Mild	HTR1A	22	40
C[C@@H](CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F)CC1(C)OCCO1	ZINC000875371722	GG	On-Demand	Mild	CTSF	65	34
CC[C@H](CN1CCCC1)NC(=O)N(CC)[C@H](C)[C@@H](O)c1ccccc1	ZINC000875371744	EG	On-Demand	Anodyne	OPRK1	18	41
CC[C@H](CN1CCCC1)NC(=O)N(CC)[C@H](C)[C@@H](O)c1ccccc1	ZINC000875371744	EG	On-Demand	Anodyne	KCNQ2	47	37
CC[C@H](CN1CCCC1)NC(=O)N(CC)[C@H](C)[C@@H](O)c1ccccc1	ZINC000875371744	EG	On-Demand	Anodyne	NPY5R	21	40
CC[C@H](CN1CCCC1)NC(=O)N(CC)[C@H](C)[C@H](O)c1ccccc1	ZINC000875371745	EG	On-Demand	Anodyne	OPRK1	18	41
CC[C@H](CN1CCCC1)NC(=O)N(CC)[C@H](C)[C@H](O)c1ccccc1	ZINC000875371745	EG	On-Demand	Anodyne	KCNQ2	47	37
CC[C@H](CN1CCCC1)NC(=O)N(CC)[C@H](C)[C@H](O)c1ccccc1	ZINC000875371745	EG	On-Demand	Anodyne	NPY5R	21	40
CC[C@H](CN1CCCC1)NC(=O)N(CC)[C@@H](C)[C@@H](O)c1ccccc1	ZINC000875371746	EG	On-Demand	Anodyne	OPRK1	18	41
CC[C@H](CN1CCCC1)NC(=O)N(CC)[C@@H](C)[C@@H](O)c1ccccc1	ZINC000875371746	EG	On-Demand	Anodyne	KCNQ2	47	37
CC[C@H](CN1CCCC1)NC(=O)N(CC)[C@@H](C)[C@@H](O)c1ccccc1	ZINC000875371746	EG	On-Demand	Anodyne	NPY5R	21	40
CC[C@H](CN1CCCC1)NC(=O)N(CC)[C@@H](C)[C@H](O)c1ccccc1	ZINC000875371747	EG	On-Demand	Anodyne	OPRK1	18	41
CC[C@H](CN1CCCC1)NC(=O)N(CC)[C@@H](C)[C@H](O)c1ccccc1	ZINC000875371747	EG	On-Demand	Anodyne	KCNQ2	47	37
CC[C@H](CN1CCCC1)NC(=O)N(CC)[C@@H](C)[C@H](O)c1ccccc1	ZINC000875371747	EG	On-Demand	Anodyne	NPY5R	21	40
CONC(=O)C1CCN(C(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)CC1	ZINC000875371849	FD	On-Demand	Anodyne	SIGMAR1	22	42
CONC(=O)C1CCN(C(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)CC1	ZINC000875371850	FD	On-Demand	Anodyne	SIGMAR1	22	42
CONC(=O)C1CCN(C(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)CC1	ZINC000875371851	FD	On-Demand	Anodyne	SIGMAR1	22	42
CONC(=O)C1CCN(C(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)CC1	ZINC000875371852	FD	On-Demand	Anodyne	SIGMAR1	22	42
Cc1ccc(NC(=O)c2ccc(-n3cccn3)nc2)cc1S(=O)(=O)Nc1cccc(Cl)c1	ZINC000875371855	JI	On-Demand	Anodyne	KIT	15	44
Cc1ccc(NC(=O)c2ccc(-n3cccn3)nc2)cc1S(=O)(=O)Nc1cccc(Cl)c1	ZINC000875371855	JI	On-Demand	Anodyne	CPT1A	55	34
Cc1ccc(NC(=O)c2ccc(-n3cccn3)nc2)cc1S(=O)(=O)Nc1cccc(Cl)c1	ZINC000875371855	JI	On-Demand	Anodyne	CSF1R	19	40
Cc1ccc(NC(=O)c2ccc(-n3cccn3)nc2)cc1S(=O)(=O)Nc1cccc(Cl)c1	ZINC000875371855	JI	On-Demand	Anodyne	DDR1	37	44
Cc1ccc(NC(=O)c2ccc(-n3cccn3)nc2)cc1S(=O)(=O)Nc1cccc(Cl)c1	ZINC000875371855	JI	On-Demand	Anodyne	KCNK3	41	38
O=C(N[C@H]1CCN(c2ncccc2Cl)C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875371877	GG	On-Demand	Anodyne	EPHX2	21	44
O=C(N[C@@H]1CCN(c2ncccc2Cl)C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875371878	GG	On-Demand	Anodyne	EPHX2	21	44
O=C(N[C@H]1CCN(c2ncccc2Cl)C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875371879	GG	On-Demand	Anodyne	EPHX2	21	44
O=C(N[C@@H]1CCN(c2ncccc2Cl)C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875371880	GG	On-Demand	Anodyne	EPHX2	21	44
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1	ZINC000875371889	EE	On-Demand	Anodyne	CAPN2	43	32
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1	ZINC000875371890	EE	On-Demand	Anodyne	CAPN2	43	32
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1	ZINC000875371891	EE	On-Demand	Anodyne	CAPN2	43	32
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1	ZINC000875371892	EE	On-Demand	Anodyne	CAPN2	43	32
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(OC)cc1F	ZINC000875372010	FE	On-Demand	Anodyne	ACKR3	50	31
CCCCCCCNC(=O)C(=O)NC[C@@H]1CCO[C@H]1c1ccnn1C	ZINC000875372020	FD	On-Demand	Mild	ASAH1	52	33
CC[C@H](CN1CCCC1)NC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875372108	FD	On-Demand	Anodyne	ETHR	41	36
CC[C@@H](CN1CCCC1)NC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875372109	FD	On-Demand	Anodyne	ETHR	41	36
CC[C@H](CN1CCCC1)NC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875372110	FD	On-Demand	Anodyne	ETHR	41	36
CC[C@@H](CN1CCCC1)NC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875372111	FD	On-Demand	Anodyne	ETHR	41	36
O=C(NCCO)C1CCN(C(=O)N[C@H]2COc3c(Cl)cccc32)CC1	ZINC000875372168	FD	On-Demand	Anodyne	EPHX2	21	42
O=C(NCCO)C1CCN(C(=O)N[C@@H]2COc3c(Cl)cccc32)CC1	ZINC000875372169	FD	On-Demand	Anodyne	EPHX2	21	42
O=C(Cc1csc(C2CC2)n1)N(Cc1ccc(F)cc1)CC(F)(F)F	ZINC000875372205	FI	On-Demand	Anodyne	PLA2G7	40	32
C[C@@]1(CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CCCS1	ZINC000875372254	FG	On-Demand	Mild	ITK	15	48
CC[C@@H](NC(=O)NCc1ccc(OC)cc1F)[C@@H](O)c1ccccc1	ZINC000875372306	EG	On-Demand	Anodyne	MTNR1A	43	36
CC[C@@H](NC(=O)NCc1ccc(OC)cc1F)[C@H](O)c1ccccc1	ZINC000875372307	EG	On-Demand	Anodyne	MTNR1A	43	36
CC[C@H](CN1CCCC1)NC(=O)NCc1nc(O)c2c(n1)CCOC2	ZINC000875372325	EC	On-Demand	Anodyne	WNT3A	41	33
CC[C@@H](CN1CCCC1)NC(=O)NCc1nc(O)c2c(n1)CCOC2	ZINC000875372326	EC	On-Demand	Anodyne	WNT3A	41	33
O=C(N[C@H]1CC2(CCC2)Oc2ccccc21)N1CCC(CO)(CO)CC1	ZINC000875372357	FE	On-Demand	Anodyne	GHRHR	57	33
O=C(N[C@@H]1CC2(CCC2)Oc2ccccc21)N1CCC(CO)(CO)CC1	ZINC000875372358	FE	On-Demand	Anodyne	GHRHR	57	33
CC[C@H](CN1CCCC1)NC(=O)NC1CCN(c2ccccc2C#N)CC1	ZINC000875372369	FF	On-Demand	Mild	KCNQ2	49	34
CC[C@@H](CN1CCCC1)NC(=O)NC1CCN(c2ccccc2C#N)CC1	ZINC000875372370	FF	On-Demand	Mild	KCNQ2	49	34
CCO[C@@H](C(=O)Nc1csnc1-c1ccccc1)C1CCCC1	ZINC000875372387	EI	On-Demand	Anodyne	TIMP3	66	33
C#CCCCCNC(=O)N[C@@]12CCCC[C@H]1C2	ZINC000875372433	BE	On-Demand	Mild	EPHX2	15	40
C#CCCCCNC(=O)N[C@]12CCCC[C@H]1C2	ZINC000875372434	BE	On-Demand	Mild	EPHX2	15	40
C#CCCCCNC(=O)N[C@]12CCCC[C@@H]1C2	ZINC000875372436	BE	On-Demand	Mild	EPHX2	15	40
C#CCCCCNC(=O)N[C@@]12CCCC[C@@H]1C2	ZINC000875372437	BE	On-Demand	Mild	EPHX2	15	40
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2CCN(c3ncccc3Cl)C2)CC1	ZINC000875372444	GD	On-Demand	Anodyne	TRPV1	15	59
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2CCN(c3ncccc3Cl)C2)CC1	ZINC000875372463	GD	On-Demand	Anodyne	TRPV1	15	59
C#CCCCCNC(=O)NC1CC(C(=O)OC)C1	ZINC000875372545	CD	On-Demand	Mild	EPHX2	16	44
CCCCCCCNC(=O)C(=O)NC[C@@H]1CC(=O)N(C)[C@H]1c1cnn(C)c1C	ZINC000875372590	GD	On-Demand	Mild	ASAH1	65	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1COc2c(Cl)cccc21	ZINC000875372605	FF	On-Demand	Anodyne	SLC6A3	43	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1COc2c(Cl)cccc21	ZINC000875372606	FF	On-Demand	Anodyne	SLC6A3	43	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1COc2c(Cl)cccc21	ZINC000875372607	FF	On-Demand	Anodyne	SLC6A3	43	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1COc2c(Cl)cccc21	ZINC000875372608	FF	On-Demand	Anodyne	SLC6A3	43	38
C#CCCCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875372765	EH	On-Demand	Mild	HTR1A	33	43
C#CCCCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875372765	EH	On-Demand	Mild	DRD2	32	43
C#CCCCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875372765	EH	On-Demand	Mild	DRD4	19	43
C#CCCCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875372765	EH	On-Demand	Mild	DRD3	39	41
C#CCCCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875372765	EH	On-Demand	Mild	RBP4	35	41
C#CCCCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875372766	EH	On-Demand	Mild	HTR1A	33	43
C#CCCCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875372766	EH	On-Demand	Mild	DRD2	32	43
C#CCCCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875372766	EH	On-Demand	Mild	DRD4	19	43
C#CCCCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875372766	EH	On-Demand	Mild	DRD3	39	41
C#CCCCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875372766	EH	On-Demand	Mild	RBP4	35	41
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCN(c3ncccc3Cl)C2)CC1	ZINC000875372885	GC	On-Demand	Anodyne	EPHX2	26	40
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCN(c3ncccc3Cl)C2)CC1	ZINC000875372886	GC	On-Demand	Anodyne	EPHX2	26	40
CN1CCN(C2CCN(C(=O)C(=O)NCc3ccc(C4CCC4)cc3)CC2)CC1	ZINC000875372905	GD	On-Demand	Anodyne	L3MBTL3	97	44
CN1CCN(C2CCN(C(=O)C(=O)NCc3ccc(C4CCC4)cc3)CC2)CC1	ZINC000875372905	GD	On-Demand	Anodyne	NAMPT	22	41
C#CCCCCNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875372925	DF	On-Demand	Mild	ITK	15	52
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCc2ccc(C3CCC3)cc2)C1	ZINC000875372933	EE	On-Demand	Anodyne	DPP7	40	34
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCc2ccc(C3CCC3)cc2)C1	ZINC000875372934	EE	On-Demand	Anodyne	DPP7	40	34
C#CCCCCNC(=O)N(CC)[C@@H](C)[C@@H](O)c1ccccc1	ZINC000875372992	DF	On-Demand	Mild	NPY5R	22	41
C#CCCCCNC(=O)N(CC)[C@H](C)[C@@H](O)c1ccccc1	ZINC000875372993	DF	On-Demand	Mild	NPY5R	22	41
C#CCCCCNC(=O)N(CC)[C@@H](C)[C@H](O)c1ccccc1	ZINC000875372994	DF	On-Demand	Mild	NPY5R	22	41
C#CCCCCNC(=O)N(CC)[C@H](C)[C@H](O)c1ccccc1	ZINC000875372995	DF	On-Demand	Mild	NPY5R	22	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)cc1F	ZINC000875373105	EE	On-Demand	Anodyne	SLC6A4	28	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)cc1F	ZINC000875373105	EE	On-Demand	Anodyne	SLC6A3	53	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)cc1F	ZINC000875373106	EE	On-Demand	Anodyne	SLC6A4	28	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)cc1F	ZINC000875373106	EE	On-Demand	Anodyne	SLC6A3	53	41
C#CCCCCNC(=O)NNc1ccc(OC)cc1Br	ZINC000875373161	EF	On-Demand	Reactive	MTNR1A	42	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CC3(CCC3)Oc3ccccc32)C1	ZINC000875373259	FG	On-Demand	Anodyne	GHRHR	63	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CC3(CCC3)Oc3ccccc32)C1	ZINC000875373260	FG	On-Demand	Anodyne	GHRHR	63	36
CC[C@H](CN1CCCC1)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875373273	FG	On-Demand	Anodyne	OPRL1	18	43
CC[C@@H](CN1CCCC1)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875373274	FG	On-Demand	Anodyne	OPRL1	18	43
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CC2(CCC2)Oc2ccccc21	ZINC000875373430	EG	On-Demand	Anodyne	BACE1	18	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CC2(CCC2)Oc2ccccc21	ZINC000875373431	EG	On-Demand	Anodyne	BACE1	18	40
CCCC[C@H](CNC(=O)OC(C)(C)C)NC(=O)N1CC=CC1	ZINC000875373435	DF	On-Demand	Anodyne	CTSK	26	43
CCCC[C@@H](CNC(=O)OC(C)(C)C)NC(=O)N1CC=CC1	ZINC000875373436	DF	On-Demand	Anodyne	CTSK	26	43
CC[C@H](CN1CCCC1)NC(=O)NNC(=O)c1nc2ccccc2s1	ZINC000875373444	FE	On-Demand	Reactive	TRY1_BOVIN	41	37
CC[C@H](CN1CCCC1)NC(=O)NNC(=O)c1nc2ccccc2s1	ZINC000875373444	FE	On-Demand	Reactive	ACOX1	44	33
CC[C@H](CN1CCCC1)NC(=O)NNC(=O)c1nc2ccccc2s1	ZINC000875373444	FE	On-Demand	Reactive	TACR3	47	42
CC[C@H](CN1CCCC1)NC(=O)NNC(=O)c1nc2ccccc2s1	ZINC000875373444	FE	On-Demand	Reactive	ST14	48	34
CC[C@H](CN1CCCC1)NC(=O)NNC(=O)c1nc2ccccc2s1	ZINC000875373444	FE	On-Demand	Reactive	TMPRSS6	70	34
CC[C@@H](CN1CCCC1)NC(=O)NNC(=O)c1nc2ccccc2s1	ZINC000875373445	FE	On-Demand	Reactive	TRY1_BOVIN	41	37
CC[C@@H](CN1CCCC1)NC(=O)NNC(=O)c1nc2ccccc2s1	ZINC000875373445	FE	On-Demand	Reactive	ACOX1	44	33
CC[C@@H](CN1CCCC1)NC(=O)NNC(=O)c1nc2ccccc2s1	ZINC000875373445	FE	On-Demand	Reactive	TACR3	47	42
CC[C@@H](CN1CCCC1)NC(=O)NNC(=O)c1nc2ccccc2s1	ZINC000875373445	FE	On-Demand	Reactive	ST14	48	34
CC[C@@H](CN1CCCC1)NC(=O)NNC(=O)c1nc2ccccc2s1	ZINC000875373445	FE	On-Demand	Reactive	TMPRSS6	70	34
CC[C@@H](CN1CCCC1)NC(=O)N1CCCN(C(=O)CC(C)C)CC1	ZINC000875373522	FE	On-Demand	Anodyne	RIR1_HHV11	63	39
CC[C@H](CN1CCCC1)NC(=O)N1CCCN(C(=O)CC(C)C)CC1	ZINC000875373523	FE	On-Demand	Anodyne	RIR1_HHV11	63	39
CC[C@@H](CN1CCCC1)NC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875373528	FD	On-Demand	Anodyne	L3MBTL3	68	42
CC[C@H](CN1CCCC1)NC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875373529	FD	On-Demand	Anodyne	L3MBTL3	68	42
CCOC1CC2(C1)C[C@H]2C(=O)Nc1csnc1-c1ccccc1	ZINC000875373530	EH	On-Demand	Anodyne	TIMP3	71	34
C[C@H](CC(=O)Nc1csnc1-c1ccccc1)NC(=O)OC(C)(C)C	ZINC000875373587	FI	On-Demand	Anodyne	PAPA1_CARPA	35	40
C[C@H](CC(=O)Nc1csnc1-c1ccccc1)NC(=O)OC(C)(C)C	ZINC000875373587	FI	On-Demand	Anodyne	FPR1	48	39
CC[C@H](CN1CCCC1)NC(=O)N1CCc2ccc(NC(C)=O)cc2C1	ZINC000875373593	FF	On-Demand	Anodyne	MAPK1	42	36
CC[C@@H](CN1CCCC1)NC(=O)N1CCc2ccc(NC(C)=O)cc2C1	ZINC000875373594	FF	On-Demand	Anodyne	MAPK1	42	36
CC[C@@H](CN1CCCC1)NC(=O)NCc1cccc2ncccc12	ZINC000875373597	EF	On-Demand	Anodyne	HNMT	47	35
CC[C@H](CN1CCCC1)NC(=O)NCc1cccc2ncccc12	ZINC000875373598	EF	On-Demand	Anodyne	HNMT	47	35
CC[C@@H](CN1CCCC1)NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875373649	GG	On-Demand	Anodyne	SMO	38	40
CC[C@@H](CN1CCCC1)NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875373649	GG	On-Demand	Anodyne	ETHR	55	48
CC[C@H](CN1CCCC1)NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875373650	GG	On-Demand	Anodyne	SMO	38	40
CC[C@H](CN1CCCC1)NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875373650	GG	On-Demand	Anodyne	ETHR	55	48
CCCC[C@@H](CNC(=O)OC(C)(C)C)NC(=O)N1CCCN(C=O)CC1	ZINC000875373653	FD	On-Demand	Anodyne	CTSK	28	49
CCCC[C@H](CNC(=O)OC(C)(C)C)NC(=O)N1CCCN(C=O)CC1	ZINC000875373654	FD	On-Demand	Anodyne	CTSK	28	49
CC[C@H](CN1CCCC1)NC(=O)N1CCC([C@H](O)c2cccc(OC)c2)CC1	ZINC000875373662	GG	On-Demand	Anodyne	DRD4	42	32
CC[C@H](CN1CCCC1)NC(=O)N1CCC([C@H](O)c2cccc(OC)c2)CC1	ZINC000875373662	GG	On-Demand	Anodyne	OPRK1	17	42
CC[C@H](CN1CCCC1)NC(=O)N1CCC([C@H](O)c2cccc(OC)c2)CC1	ZINC000875373662	GG	On-Demand	Anodyne	KCNQ2	16	42
CC[C@@H](CN1CCCC1)NC(=O)N1CCC([C@H](O)c2cccc(OC)c2)CC1	ZINC000875373663	GG	On-Demand	Anodyne	DRD4	42	32
CC[C@@H](CN1CCCC1)NC(=O)N1CCC([C@H](O)c2cccc(OC)c2)CC1	ZINC000875373663	GG	On-Demand	Anodyne	OPRK1	17	42
CC[C@@H](CN1CCCC1)NC(=O)N1CCC([C@H](O)c2cccc(OC)c2)CC1	ZINC000875373663	GG	On-Demand	Anodyne	KCNQ2	16	42
CC[C@@H](CN1CCCC1)NC(=O)N1CCC([C@@H](O)c2cccc(OC)c2)CC1	ZINC000875373664	GG	On-Demand	Anodyne	DRD4	42	32
CC[C@@H](CN1CCCC1)NC(=O)N1CCC([C@@H](O)c2cccc(OC)c2)CC1	ZINC000875373664	GG	On-Demand	Anodyne	OPRK1	17	42
CC[C@@H](CN1CCCC1)NC(=O)N1CCC([C@@H](O)c2cccc(OC)c2)CC1	ZINC000875373664	GG	On-Demand	Anodyne	KCNQ2	16	42
CC[C@H](CN1CCCC1)NC(=O)N1CCC([C@@H](O)c2cccc(OC)c2)CC1	ZINC000875373665	GG	On-Demand	Anodyne	DRD4	42	32
CC[C@H](CN1CCCC1)NC(=O)N1CCC([C@@H](O)c2cccc(OC)c2)CC1	ZINC000875373665	GG	On-Demand	Anodyne	OPRK1	17	42
CC[C@H](CN1CCCC1)NC(=O)N1CCC([C@@H](O)c2cccc(OC)c2)CC1	ZINC000875373665	GG	On-Demand	Anodyne	KCNQ2	16	42
CCO[C@H]1COCC[C@H]1CC(=O)Nc1csnc1-c1ccccc1	ZINC000875373708	EH	On-Demand	Anodyne	TIMP3	52	31
CCO[C@H]1COCC[C@@H]1CC(=O)Nc1csnc1-c1ccccc1	ZINC000875373709	EH	On-Demand	Anodyne	TIMP3	52	31
COC(=O)c1cnc(N(C(=O)Cc2ccc3cccnc3c2)C2CC2)s1	ZINC000875373746	FG	On-Demand	Anodyne	CDK5	15	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCc2ccc3c(c2)OCCO3)C1	ZINC000875373781	GE	On-Demand	Anodyne	NOS2	42	34
O=C(NCCCc1ccc2c(c1)OCCO2)N1CCC(CO)(CO)CC1	ZINC000875373814	FD	On-Demand	Anodyne	NOS2	47	32
Cn1nc(-c2ccncc2)cc1NC(=O)[C@]1(C)CCC(=O)N1	ZINC000875373909	CD	On-Demand	Anodyne	GPR142	26	42
COC(=O)c1ccc(CC(=O)Nc2onc(C)c2C)cn1	ZINC000875373924	CD	On-Demand	Anodyne	EDNRA	25	40
C[C@@H](NC(=O)NCCCSc1nccs1)c1ccccc1O	ZINC000875373976	EG	On-Demand	Clean	HPN	54	30
C[C@H](NC(=O)NCCCSc1nccs1)c1ccccc1O	ZINC000875373978	EG	On-Demand	Clean	HPN	54	30
Cn1nc(-c2ccncc2)cc1NC(=O)[C@]1(C#N)CCCOC1	ZINC000875374013	DD	On-Demand	Mild	GPR142	27	43
Cn1nc(-c2ccncc2)cc1NC(=O)[C@@]1(C#N)CCCOC1	ZINC000875374014	DD	On-Demand	Mild	GPR142	27	43
CC[C@]1(C(=O)Nc2cc(-c3ccncc3)nn2C)CCNC1=O	ZINC000875374016	DD	On-Demand	Anodyne	GPR142	30	45
CN1CCN(C2CCN(C(=O)C(=O)NC[C@@H]3CCCCN3C3CC3)CC2)CC1	ZINC000875374071	GC	On-Demand	Anodyne	L3MBTL3	49	40
CN1CCN(C2CCN(C(=O)C(=O)NC[C@H]3CCCCN3C3CC3)CC2)CC1	ZINC000875374073	GC	On-Demand	Anodyne	L3MBTL3	49	40
N#CCc1ccsc1C(=O)N1CCCCCc2ccccc21	ZINC000875374125	DI	On-Demand	Mild	AVPR2	63	47
COc1cccc(C(C)(C)C(=O)Nc2onc(C)c2C)c1	ZINC000875374143	CG	On-Demand	Anodyne	EDNRA	38	41
Cn1nc(-c2ccncc2)cc1NC(=O)[C@@]12CCCC[C@@H]1C2	ZINC000875374157	CG	On-Demand	Anodyne	GPR142	25	41
Cn1nc(-c2ccncc2)cc1NC(=O)[C@]12CCCC[C@@H]1C2	ZINC000875374158	CG	On-Demand	Anodyne	GPR142	25	41
Cn1nc(-c2ccncc2)cc1NC(=O)[C@]12CCCC[C@H]1C2	ZINC000875374159	CG	On-Demand	Anodyne	GPR142	25	41
Cn1nc(-c2ccncc2)cc1NC(=O)[C@@]12CCCC[C@H]1C2	ZINC000875374160	CG	On-Demand	Anodyne	GPR142	25	41
O=C(N[C@@H]1CCc2c[nH]nc2C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875374165	ED	On-Demand	Anodyne	EPHX2	17	41
O=C(N[C@H]1CCc2c[nH]nc2C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875374166	ED	On-Demand	Anodyne	EPHX2	17	41
O=C(N[C@H]1CCc2c[nH]nc2C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875374167	ED	On-Demand	Anodyne	EPHX2	17	41
O=C(N[C@@H]1CCc2c[nH]nc2C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875374168	ED	On-Demand	Anodyne	EPHX2	17	41
CC(=O)N[C@@H](C(=O)Nc1onc(C)c1C)c1cccc(Br)c1	ZINC000875374210	FF	On-Demand	Anodyne	EDNRA	21	41
Cn1nc(-c2ccncc2)cc1NC(=O)C1(C)CC(F)(F)C1	ZINC000875374223	DF	On-Demand	Anodyne	GPR142	28	44
O=C1CCN(C(=O)NCCCc2ccc3c(c2)OCCO3)CCCCCCN1	ZINC000875374248	GE	On-Demand	Anodyne	NOS2	51	33
C#CCCCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875374282	DF	On-Demand	Mild	TRY1_BOVIN	42	33
C#CCCCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875374283	DF	On-Demand	Mild	TRY1_BOVIN	42	33
C#CCCCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875374284	DF	On-Demand	Mild	TRY1_BOVIN	42	33
C#CCCCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875374285	DF	On-Demand	Mild	TRY1_BOVIN	42	33
O=C(NCCCSc1nccs1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875374410	GF	On-Demand	Clean	ETHR	46	40
O=C(NCCCSc1nccs1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875374411	GF	On-Demand	Clean	ETHR	46	40
C#CCCCCNC(=O)NCCC1(O)CCN(c2ccccc2)CC1	ZINC000875374450	EF	On-Demand	Mild	DRD3	16	41
CC[C@@H](C(=O)Nc1onc(C)c1C)c1ccc(Br)cc1	ZINC000875374533	EI	On-Demand	Anodyne	EDNRA	24	43
O=C(N[C@@H]1CCc2c[nH]nc2C1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875374589	FF	On-Demand	Anodyne	CPT1A	61	33
O=C(N[C@@H]1CCc2c[nH]nc2C1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875374590	FF	On-Demand	Anodyne	CPT1A	61	33
O=C(N[C@@H]1CCc2c[nH]nc2C1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875374591	FF	On-Demand	Anodyne	CPT1A	61	33
O=C(N[C@@H]1CCc2c[nH]nc2C1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875374592	FF	On-Demand	Anodyne	CPT1A	61	33
Cn1nnnc1C1CCN(C(=O)N[C@@H](c2ccc(F)cc2F)C(C)(C)C)CC1	ZINC000875374667	GG	On-Demand	Anodyne	PRCP	30	41
Cn1nnnc1C1CCN(C(=O)N[C@@H](c2ccc(F)cc2F)C(C)(C)C)CC1	ZINC000875374667	GG	On-Demand	Anodyne	CCR3	43	32
Cn1nnnc1C1CCN(C(=O)N[C@H](c2ccc(F)cc2F)C(C)(C)C)CC1	ZINC000875374668	GG	On-Demand	Anodyne	PRCP	30	41
Cn1nnnc1C1CCN(C(=O)N[C@H](c2ccc(F)cc2F)C(C)(C)C)CC1	ZINC000875374668	GG	On-Demand	Anodyne	CCR3	43	32
COC(=O)N(C)NC(=O)N[C@H](C)c1ccc(OCC(C)C)cc1	ZINC000875374689	DF	On-Demand	Reactive	ACACA	28	42
COC(=O)N(C)NC(=O)N[C@H](C)c1ccc(OCC(C)C)cc1	ZINC000875374689	DF	On-Demand	Reactive	ACACB	31	43
COC(=O)N(C)NC(=O)N[C@@H](C)c1ccc(OCC(C)C)cc1	ZINC000875374690	DF	On-Demand	Reactive	ACACA	28	42
COC(=O)N(C)NC(=O)N[C@@H](C)c1ccc(OCC(C)C)cc1	ZINC000875374690	DF	On-Demand	Reactive	ACACB	31	43
Cn1nc(-c2ccncc2)cc1NC(=O)C1(F)CCOCC1	ZINC000875374784	DD	On-Demand	Anodyne	GPR142	27	43
COc1cccc(C(C)(C)C(=O)Nc2cc(-c3ccncc3)nn2C)c1	ZINC000875374785	FG	On-Demand	Anodyne	ROCK1	27	47
COc1cccc(C(C)(C)C(=O)Nc2cc(-c3ccncc3)nn2C)c1	ZINC000875374785	FG	On-Demand	Anodyne	GPR142	26	43
C[C@H](NC(=O)NCCCSc1nccs1)c1ccnn1C	ZINC000875374880	EE	On-Demand	Clean	HPN	49	33
C[C@@H](NC(=O)NCCCSc1nccs1)c1ccnn1C	ZINC000875374882	EE	On-Demand	Clean	HPN	49	33
O=CN1CCCN(C(=O)NCCCc2ccc3c(c2)OCCO3)CC1	ZINC000875374902	ED	On-Demand	Anodyne	NOS2	66	34
COC(=O)C1(O)CN(C(=O)NCCCc2ccc3c(c2)OCCO3)C1	ZINC000875374910	FC	On-Demand	Anodyne	BMP1	40	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1onc(C)c1C	ZINC000875374952	EF	On-Demand	Anodyne	ACE	42	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1onc(C)c1C	ZINC000875374952	EF	On-Demand	Anodyne	MME	102	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1onc(C)c1C	ZINC000875374952	EF	On-Demand	Anodyne	ANPEP	72	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1onc(C)c1C	ZINC000875374952	EF	On-Demand	Anodyne	CTRA_BOVIN	34	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1onc(C)c1C	ZINC000875374952	EF	On-Demand	Anodyne	FCER2	96	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1onc(C)c1C	ZINC000875374952	EF	On-Demand	Anodyne	BMP1	18	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1onc(C)c1C	ZINC000875374952	EF	On-Demand	Anodyne	KLK3	74	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1onc(C)c1C	ZINC000875374952	EF	On-Demand	Anodyne	CTSB	82	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1onc(C)c1C	ZINC000875374952	EF	On-Demand	Anodyne	PAPA1_CARPA	88	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1onc(C)c1C	ZINC000875374952	EF	On-Demand	Anodyne	CYSP_TRYCR	71	48
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1onc(C)c1C	ZINC000875374952	EF	On-Demand	Anodyne	CTSK	42	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1onc(C)c1C	ZINC000875374952	EF	On-Demand	Anodyne	CTSL	67	48
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1onc(C)c1C	ZINC000875374952	EF	On-Demand	Anodyne	TIMP3	90	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1onc(C)c1C	ZINC000875374952	EF	On-Demand	Anodyne	CAPNS1	76	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1onc(C)c1C	ZINC000875374952	EF	On-Demand	Anodyne	MMP2	18	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1onc(C)c1C	ZINC000875374952	EF	On-Demand	Anodyne	MMP3	33	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1onc(C)c1C	ZINC000875374952	EF	On-Demand	Anodyne	HLA-DRB1	104	49
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1onc(C)c1C	ZINC000875374952	EF	On-Demand	Anodyne	REN	50	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1onc(C)c1C	ZINC000875374952	EF	On-Demand	Anodyne	CTSS	31	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1onc(C)c1C	ZINC000875374952	EF	On-Demand	Anodyne	CAPN1	109	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1onc(C)c1C	ZINC000875374952	EF	On-Demand	Anodyne	CAPN2	138	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1onc(C)c1C	ZINC000875374952	EF	On-Demand	Anodyne	ACE2	60	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1onc(C)c1C	ZINC000875374952	EF	On-Demand	Anodyne	TPSAB1	46	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1onc(C)c1C	ZINC000875374952	EF	On-Demand	Anodyne	FPR1	74	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1onc(C)c1C	ZINC000875374952	EF	On-Demand	Anodyne	CTRB_BOVIN	52	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1onc(C)c1C	ZINC000875374952	EF	On-Demand	Anodyne	NPR	51	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1onc(C)c1C	ZINC000875374952	EF	On-Demand	Anodyne	GPR142	62	40
COC(=O)c1cc(C(=O)Nc2onc(C)c2C)ccc1C	ZINC000875374964	CF	On-Demand	Anodyne	EDNRA	31	40
CCC[C@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(F)cc1F	ZINC000875374988	FF	On-Demand	Anodyne	CACNA1H	51	42
COC(=O)c1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cn1	ZINC000875375092	HC	On-Demand	Reactive	HTR1A	67	46
COC(=O)c1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cn1	ZINC000875375092	HC	On-Demand	Reactive	DRD2	50	45
COC(=O)c1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cn1	ZINC000875375092	HC	On-Demand	Reactive	DRD4	57	43
COC(=O)c1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cn1	ZINC000875375092	HC	On-Demand	Reactive	HTR2A	34	45
COC(=O)c1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cn1	ZINC000875375092	HC	On-Demand	Reactive	DRD3	64	45
COC(=O)c1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cn1	ZINC000875375092	HC	On-Demand	Reactive	HTR7	73	45
COC(=O)c1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cn1	ZINC000875375092	HC	On-Demand	Reactive	PRNP	45	39
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1onc(C)c1C	ZINC000875375109	CF	On-Demand	Anodyne	PPARG	24	40
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1onc(C)c1C	ZINC000875375109	CF	On-Demand	Anodyne	PPARD	26	40
C[C@@H]1C[C@]1(C(=O)Nc1cc(-c2ccncc2)nn1C)C(=O)OC(C)(C)C	ZINC000875375172	FF	On-Demand	Anodyne	GPR142	25	40
O=C(NCCCc1ccc2c(c1)OCCO2)N1CCC[C@H](OC2CCC2)CC1	ZINC000875375458	GH	On-Demand	Anodyne	NOS2	40	35
O=C(NCCCc1ccc2c(c1)OCCO2)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875375459	GH	On-Demand	Anodyne	NOS2	40	35
CONC(=O)C1CCN(C(=O)NCc2cccc(-c3ccc(C)cc3)c2)CC1	ZINC000875375491	GG	On-Demand	Anodyne	CHRM3	15	42
CONC(=O)C1CCN(C(=O)NCc2cccc(-c3ccc(C)cc3)c2)CC1	ZINC000875375491	GG	On-Demand	Anodyne	EPHX2	37	42
N#Cc1ccc(NC(=O)c2c(C(F)F)nc3n2CCCC3)cc1C(F)(F)F	ZINC000875375555	GI	On-Demand	Mild	AR	37	43
CN1CC[C@@H](C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)[C@H](c2cnn(C)c2)C1	ZINC000875375562	GF	On-Demand	Mild	ABL1	43	35
CN1CC[C@@H](C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)[C@H](c2cnn(C)c2)C1	ZINC000875375562	GF	On-Demand	Mild	AR	44	42
CN1CC[C@@H](C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)[C@H](c2cnn(C)c2)C1	ZINC000875375562	GF	On-Demand	Mild	ABL2	40	32
CN1CC[C@H](C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)[C@H](c2cnn(C)c2)C1	ZINC000875375563	GF	On-Demand	Mild	ABL1	43	35
CN1CC[C@H](C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)[C@H](c2cnn(C)c2)C1	ZINC000875375563	GF	On-Demand	Mild	AR	44	42
CN1CC[C@H](C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)[C@H](c2cnn(C)c2)C1	ZINC000875375563	GF	On-Demand	Mild	ABL2	40	32
CN1CC[C@@H](C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)[C@@H](c2cnn(C)c2)C1	ZINC000875375564	GF	On-Demand	Mild	ABL1	43	35
CN1CC[C@@H](C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)[C@@H](c2cnn(C)c2)C1	ZINC000875375564	GF	On-Demand	Mild	AR	44	42
CN1CC[C@@H](C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)[C@@H](c2cnn(C)c2)C1	ZINC000875375564	GF	On-Demand	Mild	ABL2	40	32
CN1CC[C@H](C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)[C@@H](c2cnn(C)c2)C1	ZINC000875375565	GF	On-Demand	Mild	ABL1	43	35
CN1CC[C@H](C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)[C@@H](c2cnn(C)c2)C1	ZINC000875375565	GF	On-Demand	Mild	AR	44	42
CN1CC[C@H](C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)[C@@H](c2cnn(C)c2)C1	ZINC000875375565	GF	On-Demand	Mild	ABL2	40	32
N#Cc1ccc(NC(=O)[C@@H]2[C@H]3CC[C@]4(COC(=O)[C@H]24)O3)cc1C(F)(F)F	ZINC000875375575	FE	On-Demand	Mild	AR	43	41
COc1ccccc1[C@H]1CCCN(C(=O)N[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000875375607	EG	On-Demand	Anodyne	EPHX2	18	45
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000875375608	EG	On-Demand	Anodyne	EPHX2	18	45
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000875375609	EG	On-Demand	Anodyne	EPHX2	18	45
COc1ccccc1[C@H]1CCCN(C(=O)N[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000875375610	EG	On-Demand	Anodyne	EPHX2	18	45
CCOC1CC2(C1)C[C@H]2C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000875375630	EH	On-Demand	Mild	AR	64	46
O=C(NCCCOC(F)F)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875375661	GD	On-Demand	Anodyne	ETHR	60	48
C[C@H](NC(=O)C(=O)NCC1(N2CCOCC2)CC1)c1ccnn1C	ZINC000875375676	EB	On-Demand	Anodyne	HCN1	76	41
C[C@H](NC(=O)C(=O)NCC1(N2CCOCC2)CC1)c1ccnn1C	ZINC000875375676	EB	On-Demand	Anodyne	HCN4	51	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCCOC(F)F)CC2	ZINC000875375687	GD	On-Demand	Anodyne	SLC18A2	51	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCCOC(F)F)CC2	ZINC000875375688	GD	On-Demand	Anodyne	SLC18A2	51	35
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2(N3CCOCC3)CC2)C1	ZINC000875375718	EB	On-Demand	Anodyne	HCN1	41	32
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2(N3CCOCC3)CC2)C1	ZINC000875375718	EB	On-Demand	Anodyne	HCN4	41	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2(N3CCOCC3)CC2)C1	ZINC000875375719	EB	On-Demand	Anodyne	HCN1	41	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2(N3CCOCC3)CC2)C1	ZINC000875375719	EB	On-Demand	Anodyne	HCN4	41	32
O=C(NCC1(N2CCOCC2)CC1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875375755	GC	On-Demand	Anodyne	HCN1	60	36
O=C(NCC1(N2CCOCC2)CC1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875375755	GC	On-Demand	Anodyne	HCN4	53	36
O=C(NCC1(N2CCOCC2)CC1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875375756	GC	On-Demand	Anodyne	HCN1	60	36
O=C(NCC1(N2CCOCC2)CC1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875375756	GC	On-Demand	Anodyne	HCN4	53	36
O=C(NCC1(N2CCOCC2)CC1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875375757	GC	On-Demand	Anodyne	HCN1	60	36
O=C(NCC1(N2CCOCC2)CC1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875375757	GC	On-Demand	Anodyne	HCN4	53	36
O=C(NCC1(N2CCOCC2)CC1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875375758	GC	On-Demand	Anodyne	HCN1	60	36
O=C(NCC1(N2CCOCC2)CC1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875375758	GC	On-Demand	Anodyne	HCN4	53	36
C[C@H]1CN(c2ccc(C(=O)Nc3cnc(Br)cn3)cc2)C[C@H](C)O1	ZINC000875375826	GG	On-Demand	Anodyne	PRNP	41	36
C[C@H]1CN(c2ccc(C(=O)Nc3cnc(Br)cn3)cc2)C[C@@H](C)O1	ZINC000875375827	GG	On-Demand	Anodyne	PRNP	41	36
O=C(NCC1(N2CCOCC2)CC1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875375853	GD	On-Demand	Anodyne	HCN1	68	36
O=C(NCC1(N2CCOCC2)CC1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875375853	GD	On-Demand	Anodyne	HCN4	47	29
O=C(NCC1(N2CCOCC2)CC1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875375854	GD	On-Demand	Anodyne	HCN1	68	36
O=C(NCC1(N2CCOCC2)CC1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875375854	GD	On-Demand	Anodyne	HCN4	47	29
O=C(N[C@@H]1C[C@H]2CC[C@H]1O2)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875375861	DF	On-Demand	Anodyne	OXTR	62	40
O=C(N[C@@H]1C[C@H]2CC[C@H]1O2)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875375862	DF	On-Demand	Anodyne	OXTR	62	40
O=C(N[C@H]1C[C@H]2CC[C@H]1O2)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875375863	DF	On-Demand	Anodyne	OXTR	62	40
O=C(N[C@H]1C[C@H]2CC[C@H]1O2)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875375864	DF	On-Demand	Anodyne	OXTR	62	40
O=C(NCCCSc1nccs1)NCc1nc(-c2ccncc2)cs1	ZINC000875375871	GH	On-Demand	Clean	ROCK1	22	42
O=C(NCCCSc1nccs1)NCc1nc(-c2ccncc2)cs1	ZINC000875375871	GH	On-Demand	Clean	ROCK2	15	42
CN1CCC(CNC(=O)N[C@H]2C[C@H]3CC[C@H]2O3)(c2ccccc2)CC1	ZINC000875375874	EE	On-Demand	Anodyne	KCNA3	48	37
CN1CCC(CNC(=O)N[C@@H]2C[C@H]3CC[C@H]2O3)(c2ccccc2)CC1	ZINC000875375875	EE	On-Demand	Anodyne	KCNA3	48	37
N#Cc1ccc(NC(=O)C2([C@@H]3CCCCO3)CCOCC2)cc1C(F)(F)F	ZINC000875375878	GH	On-Demand	Mild	AR	44	48
N#Cc1ccc(NC(=O)C2([C@H]3CCCCO3)CCOCC2)cc1C(F)(F)F	ZINC000875375879	GH	On-Demand	Mild	AR	44	48
CCO[C@@H](C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1)C1CCOCC1	ZINC000875375894	FG	On-Demand	Mild	AR	56	45
CCO[C@@H](C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1)C1CCOCC1	ZINC000875375894	FG	On-Demand	Mild	PFKFB3	43	37
COC(=O)CC[C@@H]1CC[C@H](C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)O1	ZINC000875375895	FG	On-Demand	Mild	AR	52	44
COC(=O)CC[C@@H]1CC[C@H](C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)O1	ZINC000875375895	FG	On-Demand	Mild	PFKFB3	54	35
COC(=O)N(C)NC(=O)N[C@H](C)Cc1ccccc1Br	ZINC000875375967	EE	On-Demand	Reactive	ANPEP	19	41
COC(=O)N(C)NC(=O)N[C@@H](C)Cc1ccccc1Br	ZINC000875375968	EE	On-Demand	Reactive	ANPEP	19	41
C[C@H]1CC(=O)N[C@@H](C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)C1	ZINC000875376039	EE	On-Demand	Mild	AR	64	48
C[C@H]1CC(=O)N[C@@H](C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)C1	ZINC000875376039	EE	On-Demand	Mild	PFKFB3	66	39
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCC1(N2CCOCC2)CC1	ZINC000875376062	FC	On-Demand	Anodyne	HCN1	79	38
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCC1(N2CCOCC2)CC1	ZINC000875376062	FC	On-Demand	Anodyne	HCN4	53	35
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCC1(N2CCOCC2)CC1	ZINC000875376063	FC	On-Demand	Anodyne	HCN1	79	38
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCC1(N2CCOCC2)CC1	ZINC000875376063	FC	On-Demand	Anodyne	HCN4	53	35
N#Cc1ccc(NC(=O)[C@H]2CCC(=O)O2)cc1C(F)(F)F	ZINC000875376068	CE	On-Demand	Mild	AR	63	46
C[C@H](NC(=O)C(=O)NCCCOC(F)F)c1ccc(C(F)(F)F)nc1	ZINC000875376119	FE	On-Demand	Anodyne	TRPV1	52	36
COC(=O)[C@@H]1CO[C@H](CCC(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)C1	ZINC000875376120	FF	On-Demand	Mild	AR	58	45
C[C@@H](Cc1ccccc1Br)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875376150	EE	On-Demand	Anodyne	ANPEP	15	44
C[C@H](Cc1ccccc1Br)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875376151	EE	On-Demand	Anodyne	ANPEP	15	44
C[C@H](Cc1ccccc1Br)NC(=O)N1CCCN(C=O)CC1	ZINC000875376160	FE	On-Demand	Anodyne	Q6PRC7_IXORI	59	34
C[C@@H](Cc1ccccc1Br)NC(=O)N1CCCN(C=O)CC1	ZINC000875376161	FE	On-Demand	Anodyne	Q6PRC7_IXORI	59	34
N#Cc1ccc(NC(=O)CCCOC2CCOCC2)cc1C(F)(F)F	ZINC000875376234	FG	On-Demand	Mild	AR	52	42
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@@H]1C[C@H]3CC[C@H]1O3)CC2	ZINC000875376264	EF	On-Demand	Anodyne	SLC18A2	46	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@H]1C[C@H]3CC[C@H]1O3)CC2	ZINC000875376265	EF	On-Demand	Anodyne	SLC18A2	46	34
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)N[C@@H]1C[C@H]3CC[C@H]1O3)CC2	ZINC000875376266	EF	On-Demand	Anodyne	SLC18A2	46	34
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)N[C@H]1C[C@H]3CC[C@H]1O3)CC2	ZINC000875376267	EF	On-Demand	Anodyne	SLC18A2	46	34
CC(C)n1ncc(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)c1Cl	ZINC000875376291	FI	On-Demand	Mild	ABL1	40	34
CC(C)n1ncc(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)c1Cl	ZINC000875376291	FI	On-Demand	Mild	AR	58	46
CC(C)n1ncc(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)c1Cl	ZINC000875376291	FI	On-Demand	Mild	ATF1	55	35
CC(C)n1ncc(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)c1Cl	ZINC000875376291	FI	On-Demand	Mild	RAF1	26	40
CC(C)n1ncc(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)c1Cl	ZINC000875376291	FI	On-Demand	Mild	NFKB1	51	35
N#Cc1ccc(NC(=O)[C@H]2OCCO[C@H]2C(F)(F)F)cc1C(F)(F)F	ZINC000875376307	FF	On-Demand	Mild	AR	58	48
N#Cc1ccc(NC(=O)CN2CCCCC(=O)C2=O)cc1C(F)(F)F	ZINC000875376308	FE	On-Demand	Mild	AR	60	46
CCO[C@H]1COCC[C@@H]1CC(=O)Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000875376312	FG	On-Demand	Mild	AR	50	43
CCO[C@H]1COCC[C@H]1CC(=O)Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000875376314	FG	On-Demand	Mild	AR	50	43
N#Cc1ccc(NC(=O)[C@@H]2COC(=O)N2)cc1C(F)(F)F	ZINC000875376442	CD	On-Demand	Mild	AR	58	48
N#Cc1ccc(NC(=O)[C@@H]2COC(=O)N2)cc1C(F)(F)F	ZINC000875376442	CD	On-Demand	Mild	PFKFB3	65	39
O=C(N[C@H]1C[C@H]2CC[C@H]1O2)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875376496	EF	On-Demand	Anodyne	ETHR	53	47
O=C(N[C@@H]1C[C@H]2CC[C@H]1O2)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875376497	EF	On-Demand	Anodyne	ETHR	53	47
O=C(N[C@H]1C[C@H]2CC[C@H]1O2)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875376515	DE	On-Demand	Anodyne	EPHX2	29	46
O=C(N[C@@H]1C[C@H]2CC[C@H]1O2)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875376516	DE	On-Demand	Anodyne	EPHX2	29	46
Cc1ccn(C[C@H](C)C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)n1	ZINC000875376528	EG	On-Demand	Mild	AR	59	47
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1cnc(Br)cn1	ZINC000875376552	EF	On-Demand	Anodyne	PPARD	34	40
CC[C@]1(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)CCNC1=O	ZINC000875376745	EE	On-Demand	Mild	AR	67	53
O=C(NCc1cccc2ncccc12)C(=O)NCC1(N2CCOCC2)CC1	ZINC000875376789	FC	On-Demand	Anodyne	HCN1	47	35
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](C[C@H](C)O)c1ccccc1	ZINC000875376853	DE	On-Demand	Anodyne	SOAT1	23	41
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](C[C@H](C)O)c1ccccc1	ZINC000875376854	DE	On-Demand	Anodyne	SOAT1	23	41
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](C[C@@H](C)O)c1ccccc1	ZINC000875376855	DE	On-Demand	Anodyne	SOAT1	23	41
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](C[C@@H](C)O)c1ccccc1	ZINC000875376857	DE	On-Demand	Anodyne	SOAT1	23	41
CN(C(=O)c1cccc(OC(C)(C)C)c1)c1ccc(C#N)cc1	ZINC000875376908	DI	On-Demand	Mild	HSD17B2	20	45
CN(C(=O)c1cccc(OC(C)(C)C)c1)c1ccc(C#N)cc1	ZINC000875376908	DI	On-Demand	Mild	GPBAR1	18	45
CCOC1CC2(C1)C[C@@H]2NC(=O)NC[C@@H](C[C@H](C)O)c1ccccc1	ZINC000875376911	EF	On-Demand	Anodyne	TIMP3	46	32
CCOC1CC2(C1)C[C@@H]2NC(=O)NC[C@H](C[C@H](C)O)c1ccccc1	ZINC000875376912	EF	On-Demand	Anodyne	TIMP3	46	32
CCOC1CC2(C1)C[C@@H]2NC(=O)NC[C@@H](C[C@@H](C)O)c1ccccc1	ZINC000875376913	EF	On-Demand	Anodyne	TIMP3	46	32
CCOC1CC2(C1)C[C@@H]2NC(=O)NC[C@H](C[C@@H](C)O)c1ccccc1	ZINC000875376914	EF	On-Demand	Anodyne	TIMP3	46	32
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3C[C@H]4CC[C@H]3O4)cn2)cc1	ZINC000875376947	EE	On-Demand	Mild	ITK	15	47
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3C[C@H]4CC[C@H]3O4)cn2)cc1	ZINC000875376947	EE	On-Demand	Mild	PANC	53	36
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3C[C@H]4CC[C@H]3O4)cn2)cc1	ZINC000875376948	EE	On-Demand	Mild	ITK	15	47
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3C[C@H]4CC[C@H]3O4)cn2)cc1	ZINC000875376948	EE	On-Demand	Mild	PANC	53	36
N#Cc1ccc(NC(=O)C2(F)CCOCC2)cc1C(F)(F)F	ZINC000875376998	DG	On-Demand	Mild	AR	59	54
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1C[C@H]2CC[C@H]1O2	ZINC000875377006	FG	On-Demand	Reactive	LTA4H	21	43
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1C[C@H]2CC[C@H]1O2	ZINC000875377006	FG	On-Demand	Reactive	ADAM17	25	46
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000875377008	FG	On-Demand	Reactive	LTA4H	21	43
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000875377008	FG	On-Demand	Reactive	ADAM17	25	46
CCOC(=O)C1=CC[C@H](NC(=O)NC[C@H](C[C@@H](C)O)c2ccccc2)C1	ZINC000875377062	FE	On-Demand	Anodyne	CAPN2	58	35
CCOC(=O)C1=CC[C@H](NC(=O)NC[C@@H](C[C@@H](C)O)c2ccccc2)C1	ZINC000875377064	FE	On-Demand	Anodyne	CAPN2	58	35
CCOC(=O)C1=CC[C@H](NC(=O)NC[C@@H](C[C@H](C)O)c2ccccc2)C1	ZINC000875377066	FE	On-Demand	Anodyne	CAPN2	58	35
CCOC(=O)C1=CC[C@H](NC(=O)NC[C@H](C[C@H](C)O)c2ccccc2)C1	ZINC000875377068	FE	On-Demand	Anodyne	CAPN2	58	35
O=C(N[C@@H]1C[C@H]2CC[C@H]1O2)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875377069	DF	On-Demand	Anodyne	EPHX2	23	43
O=C(N[C@H]1C[C@H]2CC[C@H]1O2)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875377071	DF	On-Demand	Anodyne	EPHX2	23	43
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(OCC2CC2)c(F)c1	ZINC000875377118	GE	On-Demand	Anodyne	CACNA1H	42	38
C[C@H](C[C@@H]1CCOC1)NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875377142	FF	On-Demand	Mild	PANC	53	36
C[C@@H](C[C@H]1CCOC1)NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875377144	FF	On-Demand	Mild	PANC	53	36
C[C@@H](C[C@@H]1CCOC1)NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875377145	FF	On-Demand	Mild	PANC	53	36
N#Cc1ccc(NC(=O)[C@]2(C#N)CCCOC2)cc1C(F)(F)F	ZINC000875377223	DF	On-Demand	Mild	AR	51	50
N#Cc1ccc(NC(=O)[C@@]2(C#N)CCCOC2)cc1C(F)(F)F	ZINC000875377225	DF	On-Demand	Mild	AR	51	50
C[C@H](C[C@@H]1CCOC1)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875377235	EF	On-Demand	Anodyne	ACE	38	41
C[C@H](C[C@@H]1CCOC1)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875377237	EF	On-Demand	Anodyne	ACE	38	41
C[C@H](C[C@@H]1CCOC1)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875377239	EF	On-Demand	Anodyne	ACE	38	41
C[C@H](C[C@@H]1CCOC1)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875377241	EF	On-Demand	Anodyne	ACE	38	41
O=C(NCc1ccc(Br)cn1)C(=O)NCC1(N2CCOCC2)CC1	ZINC000875377252	GC	On-Demand	Anodyne	HCN1	42	34
C[C@@H](C[C@H]1CCOC1)NC(=O)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875377274	GG	On-Demand	Anodyne	MAPK1	42	31
C[C@@H](C[C@@H]1CCOC1)NC(=O)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875377276	GG	On-Demand	Anodyne	MAPK1	42	31
C[C@H](C[C@@H]1CCOC1)NC(=O)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875377277	GG	On-Demand	Anodyne	MAPK1	42	31
CCOC(=O)COc1ccc(OC(=O)C2CCN(C(C)C)CC2)cc1	ZINC000875377286	EF	On-Demand	Anodyne	HRH3	17	41
O=C(N[C@H]1C[C@H]2CC[C@H]1O2)N1CCC[C@@](F)(c2ccccc2)C1	ZINC000875377314	DF	On-Demand	Anodyne	EPHX2	29	48
O=C(N[C@@H]1C[C@H]2CC[C@H]1O2)N1CCC[C@@](F)(c2ccccc2)C1	ZINC000875377315	DF	On-Demand	Anodyne	EPHX2	29	48
O=C(N[C@H]1C[C@H]2CC[C@H]1O2)N1CCC[C@](F)(c2ccccc2)C1	ZINC000875377316	DF	On-Demand	Anodyne	EPHX2	29	48
O=C(N[C@@H]1C[C@H]2CC[C@H]1O2)N1CCC[C@](F)(c2ccccc2)C1	ZINC000875377317	DF	On-Demand	Anodyne	EPHX2	29	48
CCC1(CC)CCCN1C(=O)NCc1nnc(-c2ccccc2)s1	ZINC000875377327	EI	On-Demand	Anodyne	SLC12A5	58	35
CC[C@@](C)(NC(=O)Cc1cn2cc(F)ccc2n1)C(F)(F)F	ZINC000875377339	DF	On-Demand	Anodyne	MAP3K5	25	43
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@H]2CC[C@H](C(N)=O)O2)CC1	ZINC000875377344	GE	On-Demand	Anodyne	DRD2	15	42
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@H]2CC[C@@H](C(N)=O)O2)CC1	ZINC000875377345	GE	On-Demand	Anodyne	DRD2	15	42
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@@H]2CC[C@H](C(N)=O)O2)CC1	ZINC000875377346	GE	On-Demand	Anodyne	DRD2	15	42
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@@H]2CC[C@@H](C(N)=O)O2)CC1	ZINC000875377347	GE	On-Demand	Anodyne	DRD2	15	42
CCO[C@@H](C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1)[C@@H]1CCOC1	ZINC000875377350	EF	On-Demand	Mild	AR	52	42
CCO[C@@H](C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1)[C@H]1CCOC1	ZINC000875377353	EF	On-Demand	Mild	AR	52	42
O=C(N[C@H]1C[C@H]2CC[C@H]1O2)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875377380	DD	On-Demand	Anodyne	EPHX2	29	49
O=C(N[C@@H]1C[C@H]2CC[C@H]1O2)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875377382	DD	On-Demand	Anodyne	EPHX2	29	49
O=C(N[C@H]1C[C@H]2CC[C@H]1O2)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875377384	DD	On-Demand	Anodyne	EPHX2	29	49
O=C(N[C@@H]1C[C@H]2CC[C@H]1O2)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875377385	DD	On-Demand	Anodyne	EPHX2	29	49
CCN(C(=O)CC(F)(F)C(F)(F)F)c1ccc(C#N)cc1	ZINC000875377388	DG	On-Demand	Mild	MLYCD	29	57
O=C(NC1CCN(C(=O)N[C@H]2C[C@H]3CC[C@H]2O3)CC1)OCc1ccccc1	ZINC000875377422	FE	On-Demand	Anodyne	CTRA_BOVIN	40	31
O=C(NC1CCN(C(=O)N[C@H]2C[C@H]3CC[C@H]2O3)CC1)OCc1ccccc1	ZINC000875377422	FE	On-Demand	Anodyne	CTSK	18	50
O=C(NC1CCN(C(=O)N[C@H]2C[C@H]3CC[C@H]2O3)CC1)OCc1ccccc1	ZINC000875377422	FE	On-Demand	Anodyne	CTSL	23	50
O=C(NC1CCN(C(=O)N[C@H]2C[C@H]3CC[C@H]2O3)CC1)OCc1ccccc1	ZINC000875377422	FE	On-Demand	Anodyne	TGM2	30	45
O=C(NC1CCN(C(=O)N[C@H]2C[C@H]3CC[C@H]2O3)CC1)OCc1ccccc1	ZINC000875377422	FE	On-Demand	Anodyne	F13A1	28	45
O=C(NC1CCN(C(=O)N[C@@H]2C[C@H]3CC[C@H]2O3)CC1)OCc1ccccc1	ZINC000875377423	FE	On-Demand	Anodyne	CTRA_BOVIN	40	31
O=C(NC1CCN(C(=O)N[C@@H]2C[C@H]3CC[C@H]2O3)CC1)OCc1ccccc1	ZINC000875377423	FE	On-Demand	Anodyne	CTSK	18	50
O=C(NC1CCN(C(=O)N[C@@H]2C[C@H]3CC[C@H]2O3)CC1)OCc1ccccc1	ZINC000875377423	FE	On-Demand	Anodyne	CTSL	23	50
O=C(NC1CCN(C(=O)N[C@@H]2C[C@H]3CC[C@H]2O3)CC1)OCc1ccccc1	ZINC000875377423	FE	On-Demand	Anodyne	TGM2	30	45
O=C(NC1CCN(C(=O)N[C@@H]2C[C@H]3CC[C@H]2O3)CC1)OCc1ccccc1	ZINC000875377423	FE	On-Demand	Anodyne	F13A1	28	45
CCN(C(=O)[C@H](CN(C)C)NC(=O)OC(C)(C)C)c1ccc(C#N)cc1	ZINC000875377434	FE	On-Demand	Mild	PAPA1_CARPA	49	41
CCN(C(=O)[C@H](CN(C)C)NC(=O)OC(C)(C)C)c1ccc(C#N)cc1	ZINC000875377434	FE	On-Demand	Mild	CTRB_BOVIN	54	31
N#Cc1ccc(NC(=O)[C@H]2CNC(=O)C[C@H]2C(F)(F)F)cc1C(F)(F)F	ZINC000875377451	GF	On-Demand	Mild	AR	54	46
N#Cc1ccc(NC(=O)[C@@H]2CNC(=O)C[C@@H]2C(F)(F)F)cc1C(F)(F)F	ZINC000875377452	GF	On-Demand	Mild	AR	54	46
N#Cc1ccc(NC(=O)[C@@H]2CNC(=O)C[C@H]2C(F)(F)F)cc1C(F)(F)F	ZINC000875377454	GF	On-Demand	Mild	AR	54	46
N#Cc1ccc(NC(=O)[C@H]2CNC(=O)C[C@@H]2C(F)(F)F)cc1C(F)(F)F	ZINC000875377456	GF	On-Demand	Mild	AR	54	46
CN(C(=O)[C@H](F)[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccc(C#N)cc1	ZINC000875377469	FG	On-Demand	Mild	GPR119	35	42
CN(C(=O)[C@H](F)[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccc(C#N)cc1	ZINC000875377470	FG	On-Demand	Mild	GPR119	35	42
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H](C[C@@H](C)O)c2ccccc2)C1	ZINC000875377564	FE	On-Demand	Anodyne	CAPN2	53	36
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H](C[C@@H](C)O)c2ccccc2)C1	ZINC000875377565	FE	On-Demand	Anodyne	CAPN2	53	36
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H](C[C@H](C)O)c2ccccc2)C1	ZINC000875377566	FE	On-Demand	Anodyne	CAPN2	53	36
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H](C[C@H](C)O)c2ccccc2)C1	ZINC000875377567	FE	On-Demand	Anodyne	CAPN2	53	36
CC[C@H](C[C@H](C)O)NC(=O)NCc1nnc(-c2ccccc2)s1	ZINC000875377596	EF	On-Demand	Anodyne	ANPEP	22	40
CCO[C@H](C(=O)N(C)c1ccc(C#N)cc1)C1CCCC1	ZINC000875377652	CG	On-Demand	Mild	AMY2	43	29
CCO[C@@H](C(=O)N(C)c1ccc(C#N)cc1)C1CCCC1	ZINC000875377653	CG	On-Demand	Mild	AMY2	43	29
Cc1nccnc1[C@H](C)NC(=O)NC[C@@H](C[C@H](C)O)c1ccccc1	ZINC000875377712	EF	On-Demand	Anodyne	SOAT1	18	40
Cc1nccnc1[C@H](C)NC(=O)NC[C@H](C[C@@H](C)O)c1ccccc1	ZINC000875377713	EF	On-Demand	Anodyne	SOAT1	18	40
Cc1nccnc1[C@H](C)NC(=O)NC[C@H](C[C@H](C)O)c1ccccc1	ZINC000875377714	EF	On-Demand	Anodyne	SOAT1	18	40
Cc1nccnc1[C@H](C)NC(=O)NC[C@@H](C[C@@H](C)O)c1ccccc1	ZINC000875377715	EF	On-Demand	Anodyne	SOAT1	18	40
CCCCCCCNC(=O)C(=O)NCC1(N2CCOCC2)CC1	ZINC000875377749	ED	On-Demand	Mild	ASAH1	54	42
CCOC1CC2(C1)C[C@@H]2NC(=O)NCc1nnc(-c2ccccc2)s1	ZINC000875377802	FF	On-Demand	Anodyne	TIMP3	65	35
CCOC1CC2(C1)C[C@H]2NC(=O)NCc1nnc(-c2ccccc2)s1	ZINC000875377803	FF	On-Demand	Anodyne	TIMP3	65	35
O=C(NCC[C@@H]1CCSC1)NCc1nnc(-c2ccccc2)s1	ZINC000875377812	EG	On-Demand	Anodyne	VCP	42	34
O=C(NCC[C@H]1CCSC1)NCc1nnc(-c2ccccc2)s1	ZINC000875377813	EG	On-Demand	Anodyne	VCP	42	34
CCN(C(=O)CCc1ccc(N2CCCS2(=O)=O)cc1)c1ccc(C#N)cc1	ZINC000875377883	GG	On-Demand	Mild	CDK1	15	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C[C@H](C)O)c1ccccc1	ZINC000875377910	FE	On-Demand	Anodyne	SLC6A4	22	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C[C@H](C)O)c1ccccc1	ZINC000875377910	FE	On-Demand	Anodyne	SLC6A3	54	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C[C@@H](C)O)c1ccccc1	ZINC000875377911	FE	On-Demand	Anodyne	SLC6A4	22	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C[C@@H](C)O)c1ccccc1	ZINC000875377911	FE	On-Demand	Anodyne	SLC6A3	54	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C[C@H](C)O)c1ccccc1	ZINC000875377912	FE	On-Demand	Anodyne	SLC6A4	22	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C[C@H](C)O)c1ccccc1	ZINC000875377912	FE	On-Demand	Anodyne	SLC6A3	54	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C[C@@H](C)O)c1ccccc1	ZINC000875377913	FE	On-Demand	Anodyne	SLC6A4	22	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C[C@@H](C)O)c1ccccc1	ZINC000875377913	FE	On-Demand	Anodyne	SLC6A3	54	42
C[C@H](NC(=O)NC[C@H](C[C@@H](C)O)c1ccccc1)c1ccccc1O	ZINC000875377941	EG	On-Demand	Clean	SOAT1	27	43
CC[C@@](C)(NC(=O)[C@@H]1CCC(=O)N1C(C)C)C(F)(F)F	ZINC000875378000	CE	On-Demand	Anodyne	P2RX7	24	49
CCN(C(=O)[C@H](OC)C(=O)OC(C)(C)C)c1ccc(C#N)cc1	ZINC000875378041	DE	On-Demand	Mild	CTRB_BOVIN	44	31
CC[C@@](C)(NC(=O)c1cc(F)c2ncccc2c1)C(F)(F)F	ZINC000875378079	DH	On-Demand	Anodyne	PDE4C	47	37
CN(C(=O)c1noc2c1CC(C)(C)CC2)c1ccc(C#N)cc1	ZINC000875378125	DG	On-Demand	Mild	GPBAR1	18	43
Cc1nnc(NNC(=O)N[C@@H](C)c2ccc(OCC3CC3)c(F)c2)n1C	ZINC000875378170	FE	On-Demand	Reactive	DUT	30	40
Cc1nnc(NNC(=O)N[C@H](C)c2ccc(OCC3CC3)c(F)c2)n1C	ZINC000875378171	FE	On-Demand	Reactive	DUT	30	40
CCN(C(=O)c1ccn(CC)c1C)c1ccc(C#N)cc1	ZINC000875378200	CG	On-Demand	Mild	MLYCD	15	55
CC[C@@](C)(NC(=O)[C@H](CN(C)C)NC(=O)OC(C)(C)C)C(F)(F)F	ZINC000875378258	FE	On-Demand	Anodyne	PAPA1_CARPA	34	40
CC[C@@](C)(NC(=O)Cc1ccc(OCc2ccncc2)cc1)C(F)(F)F	ZINC000875378287	FI	On-Demand	Anodyne	PPARD	17	42
CC[C@@](C)(NC(=O)Cc1ccc(OCc2ccncc2)cc1)C(F)(F)F	ZINC000875378287	FI	On-Demand	Anodyne	FFAR1	20	41
CCC1(CC)CCCN1C(=O)NC[C@H](C[C@@H](C)O)c1ccccc1	ZINC000875378318	EH	On-Demand	Anodyne	SLC12A5	45	34
CCC1(CC)CCCN1C(=O)NC[C@@H](C[C@H](C)O)c1ccccc1	ZINC000875378319	EH	On-Demand	Anodyne	SLC12A5	45	34
CCC1(CC)CCCN1C(=O)NC[C@@H](C[C@@H](C)O)c1ccccc1	ZINC000875378320	EH	On-Demand	Anodyne	SLC12A5	45	34
CCC1(CC)CCCN1C(=O)NC[C@H](C[C@H](C)O)c1ccccc1	ZINC000875378321	EH	On-Demand	Anodyne	SLC12A5	45	34
O=C(NCc1nnc(-c2ccccc2)s1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875378483	GH	On-Demand	Anodyne	EPHX2	22	41
O=C(NCc1nnc(-c2ccccc2)s1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875378484	GH	On-Demand	Anodyne	EPHX2	22	41
CC(=O)N(C)c1ccc(CNC(=O)NC[C@H](C[C@H](C)O)c2ccccc2)cc1	ZINC000875378525	GG	On-Demand	Anodyne	ANPEP	19	41
CC(=O)N(C)c1ccc(CNC(=O)NC[C@H](C[C@H](C)O)c2ccccc2)cc1	ZINC000875378525	GG	On-Demand	Anodyne	SOAT1	15	42
CC(=O)N(C)c1ccc(CNC(=O)NC[C@@H](C[C@H](C)O)c2ccccc2)cc1	ZINC000875378526	GG	On-Demand	Anodyne	ANPEP	19	41
CC(=O)N(C)c1ccc(CNC(=O)NC[C@@H](C[C@H](C)O)c2ccccc2)cc1	ZINC000875378526	GG	On-Demand	Anodyne	SOAT1	15	42
CC(=O)N(C)c1ccc(CNC(=O)NC[C@@H](C[C@@H](C)O)c2ccccc2)cc1	ZINC000875378527	GG	On-Demand	Anodyne	ANPEP	19	41
CC(=O)N(C)c1ccc(CNC(=O)NC[C@@H](C[C@@H](C)O)c2ccccc2)cc1	ZINC000875378527	GG	On-Demand	Anodyne	SOAT1	15	42
CC(=O)N(C)c1ccc(CNC(=O)NC[C@H](C[C@@H](C)O)c2ccccc2)cc1	ZINC000875378528	GG	On-Demand	Anodyne	ANPEP	19	41
CC(=O)N(C)c1ccc(CNC(=O)NC[C@H](C[C@@H](C)O)c2ccccc2)cc1	ZINC000875378528	GG	On-Demand	Anodyne	SOAT1	15	42
O=C(NC1(C(=O)Nc2cnc(Br)cn2)CC1)OCc1ccccc1	ZINC000875378550	GF	On-Demand	Anodyne	CTSK	17	52
O=C(NC1(C(=O)Nc2cnc(Br)cn2)CC1)OCc1ccccc1	ZINC000875378550	GF	On-Demand	Anodyne	CAPNS1	51	34
O=C(NC1(C(=O)Nc2cnc(Br)cn2)CC1)OCc1ccccc1	ZINC000875378550	GF	On-Demand	Anodyne	SLC12A5	42	32
CC[C@@](C)(NC(=O)Cc1ccc2cccnc2c1)C(F)(F)F	ZINC000875378561	DH	On-Demand	Anodyne	SUCNR1	59	35
Cc1cncc([C@@H]2CCCN2C(=O)NCc2nnc(-c3ccccc3)s2)c1	ZINC000875378568	GH	On-Demand	Anodyne	PREP	49	39
Cc1cncc([C@H]2CCCN2C(=O)NCc2nnc(-c3ccccc3)s2)c1	ZINC000875378569	GH	On-Demand	Anodyne	PREP	49	39
CC[C@@](C)(NC(=O)C[C@@H](C)NC(=O)OC(C)(C)C)C(F)(F)F	ZINC000875378586	EG	On-Demand	Anodyne	CTSK	16	41
CC[C@@](C)(NC(=O)C[C@H](C)NC(=O)OC(C)(C)C)C(F)(F)F	ZINC000875378588	EG	On-Demand	Anodyne	CTSK	16	41
CCN(C(=O)[C@H](F)[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccc(C#N)cc1	ZINC000875378598	GH	On-Demand	Mild	MLYCD	19	40
CCN(C(=O)[C@H](F)[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccc(C#N)cc1	ZINC000875378598	GH	On-Demand	Mild	GPR119	37	43
CCN(C(=O)[C@H](F)[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccc(C#N)cc1	ZINC000875378599	GH	On-Demand	Mild	MLYCD	19	40
CCN(C(=O)[C@H](F)[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccc(C#N)cc1	ZINC000875378599	GH	On-Demand	Mild	GPR119	37	43
O=C(NCc1nnc(-c2ccccc2)s1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875378654	GH	On-Demand	Anodyne	F2	42	36
O=C(NCc1nnc(-c2ccccc2)s1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875378654	GH	On-Demand	Anodyne	TRY1_BOVIN	62	36
O=C(NCc1nnc(-c2ccccc2)s1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875378654	GH	On-Demand	Anodyne	TMPRSS11D	55	33
O=C(NCc1nnc(-c2ccccc2)s1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875378655	GH	On-Demand	Anodyne	F2	42	36
O=C(NCc1nnc(-c2ccccc2)s1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875378655	GH	On-Demand	Anodyne	TRY1_BOVIN	62	36
O=C(NCc1nnc(-c2ccccc2)s1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875378655	GH	On-Demand	Anodyne	TMPRSS11D	55	33
COC(=O)CCCCCCCNC(=O)N1CC[C@H](O)[C@H]2CCCC[C@H]21	ZINC000875378668	FF	On-Demand	Anodyne	ASAH1	63	32
COC(=O)CCCCCCCNC(=O)N1CC[C@H](O)[C@@H]2CCCC[C@@H]21	ZINC000875378669	FF	On-Demand	Anodyne	ASAH1	63	32
COC(=O)CCCCCCCNC(=O)N1CC[C@H](O)[C@H]2CCCC[C@@H]21	ZINC000875378670	FF	On-Demand	Anodyne	ASAH1	63	32
COC(=O)CCCCCCCNC(=O)N1CC[C@H](O)[C@@H]2CCCC[C@H]21	ZINC000875378671	FF	On-Demand	Anodyne	ASAH1	63	32
COC(=O)CCCCCCCNC(=O)N1CCCC[C@@H]1[C@H]1CCCC[C@H]1O	ZINC000875378674	GH	On-Demand	Anodyne	ASAH1	59	32
COC(=O)CCCCCCCNC(=O)N1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O	ZINC000875378675	GH	On-Demand	Anodyne	ASAH1	59	32
COC(=O)CCCCCCCNC(=O)N1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O	ZINC000875378676	GH	On-Demand	Anodyne	ASAH1	59	32
COC(=O)CCCCCCCNC(=O)N1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O	ZINC000875378677	GH	On-Demand	Anodyne	ASAH1	59	32
CC[C@@H](NC(=O)NCC1(CCOC)CCCC1)[C@@H](O)c1ccccc1	ZINC000875378694	EG	On-Demand	Anodyne	HCN1	50	31
CC[C@@H](NC(=O)NCC1(CCOC)CCCC1)[C@@H](O)c1ccccc1	ZINC000875378694	EG	On-Demand	Anodyne	HCN4	48	31
CC[C@@H](NC(=O)NCC1(CCOC)CCCC1)[C@H](O)c1ccccc1	ZINC000875378695	EG	On-Demand	Anodyne	HCN1	50	31
CC[C@@H](NC(=O)NCC1(CCOC)CCCC1)[C@H](O)c1ccccc1	ZINC000875378695	EG	On-Demand	Anodyne	HCN4	48	31
COC(=O)CCCCCCCNC(=O)N1CC=CC1	ZINC000875378715	CE	On-Demand	Anodyne	ASAH1	68	33
O=C(NCc1nnc(-c2ccccc2)s1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875378727	GH	On-Demand	Anodyne	F2	42	36
O=C(NCc1nnc(-c2ccccc2)s1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875378727	GH	On-Demand	Anodyne	TRY1_BOVIN	62	36
O=C(NCc1nnc(-c2ccccc2)s1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875378727	GH	On-Demand	Anodyne	TMPRSS11D	55	33
O=C(NCc1nnc(-c2ccccc2)s1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875378729	GH	On-Demand	Anodyne	F2	42	36
O=C(NCc1nnc(-c2ccccc2)s1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875378729	GH	On-Demand	Anodyne	TRY1_BOVIN	62	36
O=C(NCc1nnc(-c2ccccc2)s1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875378729	GH	On-Demand	Anodyne	TMPRSS11D	55	33
COC(=O)CCCCCCCNC(=O)N1[C@H]2CC[C@H]1CC(F)(F)C2	ZINC000875378780	EG	On-Demand	Anodyne	EPHX2	23	48
COC(=O)CCCCCCCNC(=O)N[C@]12CCCC[C@@H]1C2	ZINC000875378782	DG	On-Demand	Anodyne	EPHX2	37	58
COC(=O)CCCCCCCNC(=O)N[C@@]12CCCC[C@@H]1C2	ZINC000875378783	DG	On-Demand	Anodyne	EPHX2	37	58
COC(=O)CCCCCCCNC(=O)N[C@@]12CCCC[C@H]1C2	ZINC000875378785	DG	On-Demand	Anodyne	EPHX2	37	58
CC[C@@](C)(NC(=O)CCc1ccc(N2CCCS2(=O)=O)cc1)C(F)(F)F	ZINC000875378799	GG	On-Demand	Anodyne	CDK1	17	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nnc(-c2ccccc2)s1	ZINC000875378813	FE	On-Demand	Anodyne	SLC6A4	24	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nnc(-c2ccccc2)s1	ZINC000875378813	FE	On-Demand	Anodyne	SLC6A3	47	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nnc(-c2ccccc2)s1	ZINC000875378814	FE	On-Demand	Anodyne	SLC6A4	24	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nnc(-c2ccccc2)s1	ZINC000875378814	FE	On-Demand	Anodyne	SLC6A3	47	40
CN1CCN(C(=O)NCc2nnc(-c3ccccc3)s2)Cc2cccnc21	ZINC000875378832	GF	On-Demand	Anodyne	NAMPT	17	42
C[C@@H](CC(=O)N(C)c1ccc(C#N)cc1)NC(=O)OC(C)(C)C	ZINC000875378840	DF	On-Demand	Mild	CTRB_BOVIN	56	33
CC(C)c1nn(-c2ccccc2)cc1CNC(=O)NCc1ccnc(F)c1	ZINC000875378866	FH	On-Demand	Anodyne	CARM1	41	34
CCOC(=O)[C@@H]1CC[C@H](C(=O)N(C)c2ccc(C#N)cc2)C1	ZINC000875378873	DF	On-Demand	Mild	ITK	17	42
CCOC(=O)[C@@H]1CC[C@H](C(=O)N(C)c2ccc(C#N)cc2)C1	ZINC000875378873	DF	On-Demand	Mild	FASN	35	43
CC[C@@](C)(NC(=O)[C@@H](Cc1cccnc1)C1CCCC1)C(F)(F)F	ZINC000875378874	EI	On-Demand	Anodyne	FKBP1A	20	42
CC[C@@](C)(NC(=O)[C@@H](Cc1cccnc1)C1CCCC1)C(F)(F)F	ZINC000875378874	EI	On-Demand	Anodyne	C3AR1	43	43
CC[C@@](C)(NC(=O)[C@H](Cc1cccnc1)C1CCCC1)C(F)(F)F	ZINC000875378875	EI	On-Demand	Anodyne	FKBP1A	20	42
CC[C@@](C)(NC(=O)[C@H](Cc1cccnc1)C1CCCC1)C(F)(F)F	ZINC000875378875	EI	On-Demand	Anodyne	C3AR1	43	43
COC(=O)CCCCCCCNC(=O)N[C@]12CCCC[C@H]1C2	ZINC000875378913	DG	On-Demand	Anodyne	EPHX2	37	58
CC(=O)C1CCN(C(=O)NCc2nc(C)c(-c3ccc(Cl)cc3)o2)CC1	ZINC000875378926	GH	On-Demand	Anodyne	EPHX2	15	43
COC(=O)CCCCCCCNC(=O)N1[C@H]2CC[C@H]1CC1(CC1)C2	ZINC000875378927	EH	On-Demand	Anodyne	EPHX2	23	49
C#CC[C@@H](CCOC)NC(=O)NCc1nc(C)c(-c2ccc(Cl)cc2)o1	ZINC000875378931	GH	On-Demand	Mild	NPPA	33	43
C#CC[C@H](CCOC)NC(=O)NCc1nc(C)c(-c2ccc(Cl)cc2)o1	ZINC000875378932	GH	On-Demand	Mild	NPPA	33	43
COC(=O)CCCCCCCNC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875378937	DC	On-Demand	Anodyne	EPHX2	29	56
COC(=O)CCCCCCCNC(=O)N[C@@H]1CCOC[C@@H]1O	ZINC000875378938	DC	On-Demand	Anodyne	EPHX2	29	56
COC(=O)CCCCCCCNC(=O)N[C@H]1CCOC[C@H]1O	ZINC000875378939	DC	On-Demand	Anodyne	EPHX2	29	56
COC(=O)CCCCCCCNC(=O)N[C@H]1CCOC[C@@H]1O	ZINC000875378940	DC	On-Demand	Anodyne	EPHX2	29	56
COC(=O)CCCCCCCNC(=O)N1CC[C@H]2CC[C@@H](C1)S2	ZINC000875378961	EG	On-Demand	Anodyne	EPHX2	16	43
COC(=O)CCCCCCCNC(=O)N1CCC(F)(F)C[C@H]1C	ZINC000875378987	EG	On-Demand	Anodyne	EPHX2	16	45
COC(=O)CCCCCCCNC(=O)N1CCC(F)(F)C[C@@H]1C	ZINC000875378988	EG	On-Demand	Anodyne	EPHX2	16	45
COC(=O)CCCCCCCNC(=O)N[C@@H]1COCC[C@H]1O	ZINC000875378989	DC	On-Demand	Anodyne	EPHX2	31	57
COC(=O)CCCCCCCNC(=O)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875378999	EE	On-Demand	Anodyne	EPHX2	16	44
COC(=O)CCCCCCCNC(=O)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875378999	EE	On-Demand	Anodyne	ASAH1	40	33
COC(=O)N(C)NC(=O)N[C@@H]1CCc2c(OC)cccc21	ZINC000875379016	CD	On-Demand	Reactive	MTNR1A	19	40
COC(=O)N(C)NC(=O)N[C@@H]1CCc2c(OC)cccc21	ZINC000875379016	CD	On-Demand	Reactive	MTNR1B	15	40
COC(=O)N(C)NC(=O)N[C@H]1CCc2c(OC)cccc21	ZINC000875379017	CD	On-Demand	Reactive	MTNR1A	19	40
COC(=O)N(C)NC(=O)N[C@H]1CCc2c(OC)cccc21	ZINC000875379017	CD	On-Demand	Reactive	MTNR1B	15	40
COC(=O)CCCCCCCNC(=O)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875379025	FE	On-Demand	Anodyne	ASAH1	42	33
COC(=O)CCCCCCCNC(=O)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875379026	FE	On-Demand	Anodyne	ASAH1	42	33
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1CCc2c(OC)cccc21	ZINC000875379048	GF	On-Demand	Anodyne	HTR1A	27	47
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1CCc2c(OC)cccc21	ZINC000875379048	GF	On-Demand	Anodyne	DRD2	19	45
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1CCc2c(OC)cccc21	ZINC000875379048	GF	On-Demand	Anodyne	ACKR3	63	33
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1CCc2c(OC)cccc21	ZINC000875379049	GF	On-Demand	Anodyne	HTR1A	27	47
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1CCc2c(OC)cccc21	ZINC000875379049	GF	On-Demand	Anodyne	DRD2	19	45
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1CCc2c(OC)cccc21	ZINC000875379049	GF	On-Demand	Anodyne	ACKR3	63	33
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCc2c(OC)cccc21	ZINC000875379066	DF	On-Demand	Anodyne	MTNR1A	21	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCc2c(OC)cccc21	ZINC000875379066	DF	On-Demand	Anodyne	MTNR1B	16	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCc2c(OC)cccc21	ZINC000875379067	DF	On-Demand	Anodyne	MTNR1A	21	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCc2c(OC)cccc21	ZINC000875379067	DF	On-Demand	Anodyne	MTNR1B	16	40
COC(=O)CCCCCCCNC(=O)N[C@H]1CCCC12CC2	ZINC000875379083	DG	On-Demand	Anodyne	EPHX2	30	62
COC(=O)CCCCCCCNC(=O)N[C@@H]1CCCC12CC2	ZINC000875379084	DG	On-Demand	Anodyne	EPHX2	30	62
COC(=O)CCCCCCCNC(=O)N[C@@H]1COC[C@@H]1O	ZINC000875379093	DC	On-Demand	Anodyne	EPHX2	28	58
O=C(NC1CC=CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875379133	CE	On-Demand	Anodyne	DRD4	26	43
O=C(NC1CC=CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875379133	CE	On-Demand	Anodyne	SIGMAR1	41	46
O=C(NC1CC=CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875379133	CE	On-Demand	Anodyne	FAAH	16	42
COC(=O)CCCCCCCNC(=O)N1[C@H]2CC[C@H]1CC1(C2)CC1(F)F	ZINC000875379150	FH	On-Demand	Anodyne	EPHX2	17	45
COC(=O)CCCCCCCNC(=O)N(C)[C@@H]1CCCC[C@H]1O	ZINC000875379153	EE	On-Demand	Anodyne	EPHX2	16	52
COC(=O)CCCCCCCNC(=O)N[C@H]1CCCn2nccc21	ZINC000875379189	EF	On-Demand	Anodyne	EPHX2	16	52
COC(=O)CCCCCCCNC(=O)N[C@@H]1CCCn2nccc21	ZINC000875379190	EF	On-Demand	Anodyne	EPHX2	16	52
COC(=O)CCCCCCCNC(=O)N[C@@H]1Cc2cncn2C1	ZINC000875379199	DD	On-Demand	Anodyne	EPHX2	16	54
COC(=O)CCCCCCCNC(=O)N[C@H]1Cc2cncn2C1	ZINC000875379200	DD	On-Demand	Anodyne	EPHX2	16	54
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCc3c(OC)cccc32)C1	ZINC000875379207	EF	On-Demand	Anodyne	HTR1A	15	46
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCc3c(OC)cccc32)C1	ZINC000875379207	EF	On-Demand	Anodyne	ADRA1D	41	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCc3c(OC)cccc32)C1	ZINC000875379207	EF	On-Demand	Anodyne	ADRA1A	30	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCc3c(OC)cccc32)C1	ZINC000875379207	EF	On-Demand	Anodyne	ADRA1B	42	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCc3c(OC)cccc32)C1	ZINC000875379208	EF	On-Demand	Anodyne	HTR1A	15	46
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCc3c(OC)cccc32)C1	ZINC000875379208	EF	On-Demand	Anodyne	ADRA1D	41	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCc3c(OC)cccc32)C1	ZINC000875379208	EF	On-Demand	Anodyne	ADRA1A	30	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCc3c(OC)cccc32)C1	ZINC000875379208	EF	On-Demand	Anodyne	ADRA1B	42	36
COC(=O)CCCCCCCNC(=O)N[C@]12C[C@@H]1COC2(C)C	ZINC000875379209	EE	On-Demand	Anodyne	EPHX2	33	57
COC(=O)CCCCCCCNC(=O)N[C@@]12C[C@@H]1COC2(C)C	ZINC000875379210	EE	On-Demand	Anodyne	EPHX2	33	57
COC(=O)CCCCCCCNC(=O)N[C@@]12C[C@H]1COC2(C)C	ZINC000875379211	EE	On-Demand	Anodyne	EPHX2	33	57
COC(=O)CCCCCCCNC(=O)N[C@]12C[C@H]1COC2(C)C	ZINC000875379212	EE	On-Demand	Anodyne	EPHX2	33	57
O=C(NCCc1ccc(Cl)nc1)N1CC[C@H]2CC[C@@H](C1)S2(=O)=O	ZINC000875379224	FD	On-Demand	Anodyne	GPBAR1	16	41
O=C(NCCOc1ccc(C(F)(F)F)cn1)NC[C@H]1C[C@H](O)C1	ZINC000875379261	ED	On-Demand	Anodyne	LIPE	17	40
N#Cc1ccc(N2CCN(C(=O)C(=O)NCC3CCN(C4CC4)CC3)CC2)cc1	ZINC000875379300	GD	On-Demand	Mild	HRH3	22	42
COC(=O)CCCCCCCNC(=O)NC1(C)COC1	ZINC000875379332	CD	On-Demand	Anodyne	EPHX2	33	59
O=C(NCc1cccc2ncccc12)C(=O)NCC1CCN(C2CC2)CC1	ZINC000875379445	FD	On-Demand	Anodyne	CCR3	19	42
O=CN1CCCN(C(=O)NCCc2ccc(Cl)nc2)CC1	ZINC000875379457	DD	On-Demand	Anodyne	NACHRBETA2	41	35
O=C(NCCc1ccc(Cl)nc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875379461	FF	On-Demand	Anodyne	ADRB1	26	40
O=C(NCCc1ccc(Cl)nc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875379461	FF	On-Demand	Anodyne	ADRB3	24	40
O=C(NCCc1ccc(Cl)nc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875379463	FF	On-Demand	Anodyne	ADRB1	26	40
O=C(NCCc1ccc(Cl)nc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875379463	FF	On-Demand	Anodyne	ADRB3	24	40
COC(=O)CCCCCCCNC(=O)N1Cc2cccc(OC)c2C1	ZINC000875379466	EG	On-Demand	Anodyne	HTR1A	26	41
COC(=O)CCCCCCCNC(=O)N1Cc2cccc(OC)c2C1	ZINC000875379466	EG	On-Demand	Anodyne	DRD2	27	41
COC(=O)CCCCCCCNC(=O)N1Cc2cccc(OC)c2C1	ZINC000875379466	EG	On-Demand	Anodyne	DRD3	43	41
COC(=O)CCCCCCCNC(=O)N1Cc2cccc(OC)c2C1	ZINC000875379466	EG	On-Demand	Anodyne	HTR7	15	41
COC(=O)CCCCCCCNC(=O)N1Cc2cccc(OC)c2C1	ZINC000875379466	EG	On-Demand	Anodyne	SSTR1	40	32
O=C(NCC1CCN(C2CC2)CC1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875379511	GE	On-Demand	Anodyne	OXTR	53	37
O=C(NCC1CCN(C2CC2)CC1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875379511	GE	On-Demand	Anodyne	SLC18A3	15	41
O=C(NCC1CCN(C2CC2)CC1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875379513	GE	On-Demand	Anodyne	OXTR	53	37
O=C(NCC1CCN(C2CC2)CC1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875379513	GE	On-Demand	Anodyne	SLC18A3	15	41
COC(=O)CCCCCCCNC(=O)N[C@@H]1[C@H](C)O[C@H](C)[C@@H]1C	ZINC000875379546	EF	On-Demand	Anodyne	EPHX2	18	54
COC(=O)CCCCCCCNC(=O)N[C@@H]1[C@H](C)O[C@@H](C)[C@H]1C	ZINC000875379547	EF	On-Demand	Anodyne	EPHX2	18	54
COC(=O)CCCCCCCNC(=O)N[C@@H]1[C@H](C)O[C@H](C)[C@H]1C	ZINC000875379548	EF	On-Demand	Anodyne	EPHX2	18	54
COC(=O)CCCCCCCNC(=O)N[C@@H]1[C@H](C)O[C@@H](C)[C@@H]1C	ZINC000875379550	EF	On-Demand	Anodyne	EPHX2	18	54
CN(C)C[C@@H]1CN(C(=O)NCCc2ccc(Cl)nc2)C[C@H]1CN(C)C	ZINC000875379568	FD	On-Demand	Anodyne	NACHRBETA2	40	33
COc1cccc(C(C)(C)C(=O)Nc2ccc(OC)c(OC)c2OC)c1	ZINC000875379584	FH	On-Demand	Anodyne	MTNR1B	31	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCOc1ccc(C(F)(F)F)cn1	ZINC000875379604	GE	On-Demand	Anodyne	SLC6A3	21	41
O=C(NCCc1ccc(Cl)nc1)N1CCC(CO)(CO)CC1	ZINC000875379630	ED	On-Demand	Anodyne	NACHRBETA2	41	35
C[C@H](NC(=O)C(=O)NCC1CCN(C2CC2)CC1)c1ccnn1C	ZINC000875379641	EC	On-Demand	Anodyne	CACNA1I	40	31
O=C(NCCOc1ccc(C(F)(F)F)cn1)N1CCC(CO)(CO)CC1	ZINC000875379642	GD	On-Demand	Anodyne	LIPE	19	44
COC(=O)C1(O)CN(C(=O)NCCc2ccc(Cl)nc2)C1	ZINC000875379656	DC	On-Demand	Anodyne	NACHRBETA2	44	34
O=C(NCCOc1ccc(Cl)cn1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875379659	FG	On-Demand	Anodyne	EPHX2	18	43
O=C(NCCOc1ccc(Cl)cn1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875379660	FG	On-Demand	Anodyne	EPHX2	18	43
O=C(NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)Nc1nccs1	ZINC000875379667	HE	On-Demand	Reactive	MAP1	100	40
COC(=O)CCCCCCCNC(=O)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875379671	EE	On-Demand	Anodyne	EPHX2	21	46
COC(=O)CCCCCCCNC(=O)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875379672	EE	On-Demand	Anodyne	EPHX2	21	46
COCC(C)(C)CCNC(=O)C(=O)NCC1CCN(C2CC2)CC1	ZINC000875379715	ED	On-Demand	Anodyne	CACNA1I	47	34
O=CN1CCCN(C(=O)NCCOc2ccc(C(F)(F)F)cn2)CC1	ZINC000875379754	FD	On-Demand	Anodyne	LIPE	19	47
O=C(NC1CC=CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875379757	CE	On-Demand	Anodyne	EPHX2	20	48
O=C(NCCOc1ccc(C(F)(F)F)cn1)N1Cc2cccc(O)c2C1	ZINC000875379758	FF	On-Demand	Clean	LIPE	19	42
O=C(NC1CC=CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875379759	CE	On-Demand	Anodyne	EPHX2	20	48
CONC(=O)C1CCN(C(=O)N[C@H]2CCc3c(OC)cccc32)CC1	ZINC000875379768	ED	On-Demand	Anodyne	HTR1A	17	48
CONC(=O)C1CCN(C(=O)N[C@H]2CCc3c(OC)cccc32)CC1	ZINC000875379768	ED	On-Demand	Anodyne	EBP	20	40
CONC(=O)C1CCN(C(=O)N[C@H]2CCc3c(OC)cccc32)CC1	ZINC000875379768	ED	On-Demand	Anodyne	SSTR1	46	34
CONC(=O)C1CCN(C(=O)N[C@@H]2CCc3c(OC)cccc32)CC1	ZINC000875379769	ED	On-Demand	Anodyne	HTR1A	17	48
CONC(=O)C1CCN(C(=O)N[C@@H]2CCc3c(OC)cccc32)CC1	ZINC000875379769	ED	On-Demand	Anodyne	EBP	20	40
CONC(=O)C1CCN(C(=O)N[C@@H]2CCc3c(OC)cccc32)CC1	ZINC000875379769	ED	On-Demand	Anodyne	SSTR1	46	34
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCC1CCN(C2CC2)CC1	ZINC000875379815	FD	On-Demand	Anodyne	CACNA1I	60	34
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCC1CCN(C2CC2)CC1	ZINC000875379816	FD	On-Demand	Anodyne	CACNA1I	60	34
O=C(NCCc1ccc(Cl)nc1)N1CCC(CCO)(CCO)CC1	ZINC000875379829	FD	On-Demand	Anodyne	NACHRBETA2	45	32
C#CCCCNC(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875379832	DG	On-Demand	Mild	DRD4	42	32
CCOC(=O)[C@H](C)C1CN(C(=O)NCCOc2ccc(C(F)(F)F)cn2)C1	ZINC000875379838	GE	On-Demand	Anodyne	LIPE	19	42
CCC[C@H]1[C@@H](C)CCCN1C(=O)c1sccc1CC#N	ZINC000875379857	CH	On-Demand	Mild	TRPC6	44	32
CCC[C@H]1[C@H](C)CCCN1C(=O)c1sccc1CC#N	ZINC000875379858	CH	On-Demand	Mild	TRPC6	44	32
COC(=O)CCCCCCCNC(=O)N1CCN(S(=O)(=O)C2CC2)CC1	ZINC000875379876	GD	On-Demand	Anodyne	EPHX2	16	45
COC(=O)CCCCCCCNC(=O)N[C@@H]1C[C@H](C)O[C@@H]1C	ZINC000875379895	DE	On-Demand	Anodyne	EPHX2	29	55
COC(=O)CCCCCCCNC(=O)N[C@@H]1C[C@@H](C)O[C@H]1C	ZINC000875379897	DE	On-Demand	Anodyne	EPHX2	29	55
COC(=O)CCCCCCCNC(=O)N[C@@H]1C[C@H](C)O[C@H]1C	ZINC000875379899	DE	On-Demand	Anodyne	EPHX2	29	55
COC(=O)CCCCCCCNC(=O)N[C@@H]1C[C@@H](C)O[C@@H]1C	ZINC000875379900	DE	On-Demand	Anodyne	EPHX2	29	55
O=C(NCCc1ccc(Cl)nc1)N1CC=CC1	ZINC000875379903	CD	On-Demand	Anodyne	Q8WSF8_APLCA	41	38
O=C(NCCc1ccc(Cl)nc1)N1CC=CC1	ZINC000875379903	CD	On-Demand	Anodyne	NACHRBETA2	54	38
COC(=O)CCCCCCCNC(=O)N1CC(c2ccccc2)C1	ZINC000875379904	EG	On-Demand	Anodyne	EPHX2	27	44
O=C(NCCOc1ncccc1Cl)N1CCC[C@H](OC2CCC2)CC1	ZINC000875379929	FG	On-Demand	Anodyne	EPHX2	19	46
O=C(NCCOc1ncccc1Cl)N1CCC[C@H](OC2CCC2)CC1	ZINC000875379929	FG	On-Demand	Anodyne	SCD	20	41
O=C(NCCOc1ncccc1Cl)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875379931	FG	On-Demand	Anodyne	EPHX2	19	46
O=C(NCCOc1ncccc1Cl)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875379931	FG	On-Demand	Anodyne	SCD	20	41
COCCN(CC1CCN(C)CC1)C(=O)NCCOc1ccc(Cl)cn1	ZINC000875379944	GE	On-Demand	Anodyne	CACNA1I	49	33
O=C(NCCO)C1CCN(C(=O)NCCc2ccc(Cl)nc2)CC1	ZINC000875379955	FC	On-Demand	Anodyne	GPBAR1	23	43
COC(=O)CCCCCCCNC(=O)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875380003	FG	On-Demand	Anodyne	EPHX2	15	40
COC(=O)CCCCCCCNC(=O)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875380003	FG	On-Demand	Anodyne	ASAH1	61	33
COC(=O)CCCCCCCNC(=O)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875380004	FG	On-Demand	Anodyne	EPHX2	15	40
COC(=O)CCCCCCCNC(=O)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875380004	FG	On-Demand	Anodyne	ASAH1	61	33
C[C@@]1(CO)CN(C(=O)NCCc2ccc(Cl)nc2)C[C@]1(C)CO	ZINC000875380043	ED	On-Demand	Anodyne	NACHRBETA2	51	36
O=C(NCCc1ccc(Cl)nc1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875380080	FF	On-Demand	Anodyne	EPHX2	15	58
O=C(NCCc1ccc(Cl)nc1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875380083	FF	On-Demand	Anodyne	EPHX2	15	58
COC(=O)CCCCCCCNC(=O)N[C@H]1Cc2ccccc2NC1=O	ZINC000875380094	FE	On-Demand	Anodyne	EPHX2	22	46
COC(=O)CCCCCCCNC(=O)N[C@@H]1Cc2ccccc2NC1=O	ZINC000875380095	FE	On-Demand	Anodyne	EPHX2	22	46
COc1ccccc1[C@H]1CCCN(C(=O)NC2CC=CC2)CC1	ZINC000875380104	DH	On-Demand	Anodyne	EPHX2	23	43
COc1ccccc1[C@H]1CCCN(C(=O)NC2CC=CC2)CC1	ZINC000875380104	DH	On-Demand	Anodyne	RBP4	41	43
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CC=CC2)CC1	ZINC000875380106	DH	On-Demand	Anodyne	EPHX2	23	43
COc1ccccc1[C@@H]1CCCN(C(=O)NC2CC=CC2)CC1	ZINC000875380106	DH	On-Demand	Anodyne	RBP4	41	43
O=C(NCCc1ccc(Cl)nc1)N1OC2CCC1CC2	ZINC000875380134	CF	On-Demand	Anodyne	NACHRBETA2	46	36
COC(=O)N(C)NC(=O)NCCc1ccc(OC)cc1Cl	ZINC000875380172	DD	On-Demand	Reactive	NQO2	40	47
COC(=O)N(C)NC(=O)NCCc1ccc(OC)cc1Cl	ZINC000875380172	DD	On-Demand	Reactive	MTNR1A	127	51
COC(=O)N(C)NC(=O)NCCc1ccc(OC)cc1Cl	ZINC000875380172	DD	On-Demand	Reactive	MTNR1B	96	47
O=C(NCCc1ccc(Cl)nc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875380190	FG	On-Demand	Anodyne	PREP	51	36
O=C(NCCc1ccc(Cl)nc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875380191	FG	On-Demand	Anodyne	PREP	51	36
O=C(NCCc1ccc(Cl)nc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875380192	FG	On-Demand	Anodyne	PREP	51	36
O=C(NCCc1ccc(Cl)nc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875380193	FG	On-Demand	Anodyne	PREP	51	36
CCCCCCCNC(=O)C(=O)NCC1CCN(C2CC2)CC1	ZINC000875380196	DE	On-Demand	Mild	ASAH1	72	36
CCCCCCCNC(=O)C(=O)NCc1ncnn1-c1ccccc1	ZINC000875380197	ED	On-Demand	Mild	SOAT1	40	35
CCCCCCCNC(=O)C(=O)NCc1ncnn1-c1ccccc1	ZINC000875380197	ED	On-Demand	Mild	ASAH1	92	39
O=C(NCCOc1ccc(C(F)(F)F)cn1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875380225	GF	On-Demand	Anodyne	LIPE	18	43
O=C(NCCc1ccc(Cl)nc1)N1CCc2nc(C3CC3)ncc2C1	ZINC000875380227	FF	On-Demand	Anodyne	MAPK1	41	39
O=C(NNC(=O)c1ccc(COc2ccccc2-c2ccccc2)cc1)Nc1nccs1	ZINC000875380244	IJ	On-Demand	Reactive	PPIA	40	39
O=C(NNC(=O)c1ccc(COc2ccccc2-c2ccccc2)cc1)Nc1nccs1	ZINC000875380244	IJ	On-Demand	Reactive	PTGER1	43	40
O=C(NNC(=O)c1ccc(COc2ccccc2-c2ccccc2)cc1)Nc1nccs1	ZINC000875380244	IJ	On-Demand	Reactive	MAP1	123	56
O=C(NCC1CCN(C2CC2)CC1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875380251	GE	On-Demand	Anodyne	CHRNA7	46	38
O=C(NCC1CCN(C2CC2)CC1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875380251	GE	On-Demand	Anodyne	C3AR1	40	40
O=C(NCC1CCN(C2CC2)CC1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875380252	GE	On-Demand	Anodyne	CHRNA7	46	38
O=C(NCC1CCN(C2CC2)CC1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875380252	GE	On-Demand	Anodyne	C3AR1	40	40
O=C(NCC1CCN(C2CC2)CC1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875380278	GD	On-Demand	Anodyne	F2	27	41
O=C(NCC1CCN(C2CC2)CC1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875380279	GD	On-Demand	Anodyne	F2	27	41
O=C(NCC1CCN(C2CC2)CC1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875380280	GD	On-Demand	Anodyne	F2	27	41
O=C(NCC1CCN(C2CC2)CC1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875380281	GD	On-Demand	Anodyne	F2	27	41
O=C(NCCc1ccc(Cl)nc1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875380290	GH	On-Demand	Anodyne	OPRL1	16	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccc(Cl)nc1	ZINC000875380312	EE	On-Demand	Anodyne	SLC6A4	21	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccc(Cl)nc1	ZINC000875380312	EE	On-Demand	Anodyne	SLC6A3	42	39
COC(=O)N(C)NC(=O)NCCOc1ccc(C(F)(F)F)cn1	ZINC000875380324	ED	On-Demand	Reactive	LIPE	21	45
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCC2CCN(C3CC3)CC2)c1	ZINC000875380347	FE	On-Demand	Anodyne	CACNA1I	41	31
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCC2CCN(C3CC3)CC2)c1	ZINC000875380348	FE	On-Demand	Anodyne	CACNA1I	41	31
CC[C@@H](NC(=O)NCC1(CCOC)CCC1)[C@H](O)c1ccccc1	ZINC000875380357	EG	On-Demand	Anodyne	HCN1	49	31
CC[C@@H](NC(=O)NCC1(CCOC)CCC1)[C@H](O)c1ccccc1	ZINC000875380357	EG	On-Demand	Anodyne	HCN4	47	31
CC[C@@H](NC(=O)NCC1(CCOC)CCC1)[C@@H](O)c1ccccc1	ZINC000875380359	EG	On-Demand	Anodyne	HCN1	49	31
CC[C@@H](NC(=O)NCC1(CCOC)CCC1)[C@@H](O)c1ccccc1	ZINC000875380359	EG	On-Demand	Anodyne	HCN4	47	31
O=C(NCc1ncc(Cl)s1)C(=O)NCC1CCN(C2CC2)CC1	ZINC000875380384	FD	On-Demand	Anodyne	CACNA1I	46	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCOc1ccc(Cl)cn1	ZINC000875380394	FD	On-Demand	Anodyne	SLC6A3	42	38
CCN(CC)S(=O)(=O)N1CCN(c2nc3ccccc3[nH]2)CC1	ZINC000875380419	ED	On-Demand	Anodyne	NPY5R	20	40
O=C(NCCc1ccc(Cl)nc1)N(C1CC1)C1CC1	ZINC000875380446	CF	On-Demand	Anodyne	NACHRBETA2	42	35
Cc1ccc2nc(C(=O)NC3(C(F)(F)F)CCOCC3)cn2c1	ZINC000875380509	EE	On-Demand	Anodyne	MAP3K5	35	40
O=C(Nc1c(F)cc(F)cc1F)[C@@H]1CC[C@H](Cc2ccccc2)O1	ZINC000875380523	EH	On-Demand	Anodyne	CCR3	19	40
C[C@@H](OC[C@@H](O)CN1CCN(Cc2nc(O)c3ccccc3n2)CC1)c1ccc(Cl)cc1	ZINC000875380557	JG	On-Demand	Anodyne	ACOX1	57	36
C[C@@H](OC[C@H](O)CN1CCN(Cc2nc(O)c3ccccc3n2)CC1)c1ccc(Cl)cc1	ZINC000875380558	JG	On-Demand	Anodyne	ACOX1	57	36
O=C(NCCO)C1CCN(C(=O)NCCc2cccc(-c3ccccc3)c2)CC1	ZINC000875380568	GE	On-Demand	Anodyne	MTNR1B	18	41
O=C(NCCO)C1CCN(C(=O)NCCc2cccc(-c3ccccc3)c2)CC1	ZINC000875380568	GE	On-Demand	Anodyne	EPHX2	17	47
Cc1nsc(NC(=O)C2(NC(=O)OCc3ccccc3)CC2)n1	ZINC000875380582	EE	On-Demand	Anodyne	CTSK	18	50
Cc1nsc(NC(=O)C2(NC(=O)OCc3ccccc3)CC2)n1	ZINC000875380582	EE	On-Demand	Anodyne	CAPN2	44	34
Cc1nsc(NC(=O)C2(NC(=O)OCc3ccccc3)CC2)n1	ZINC000875380582	EE	On-Demand	Anodyne	NAAA	52	38
Cc1nsc(NC(=O)C2(NC(=O)OCc3ccccc3)CC2)n1	ZINC000875380582	EE	On-Demand	Anodyne	SLC12A5	56	33
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CC(C)(C)Oc3ccccc32)C1	ZINC000875380616	FG	On-Demand	Anodyne	GHRHR	44	33
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CC(C)(C)Oc3ccccc32)C1	ZINC000875380617	FG	On-Demand	Anodyne	GHRHR	44	33
O=C(NCc1ccc(C(=O)Nc2ccc(F)cc2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875380661	FF	On-Demand	Anodyne	SSTR3	19	40
CC(=O)c1ccc(NC(=O)NC[C@@H](c2ccc(N(C)C)cc2)c2c[nH]c3ccccc23)cc1	ZINC000875380713	IK	On-Demand	Anodyne	NMBR	40	37
CC(=O)c1ccc(NC(=O)NC[C@H](c2ccc(N(C)C)cc2)c2c[nH]c3ccccc23)cc1	ZINC000875380714	IK	On-Demand	Anodyne	NMBR	40	37
O=C(Nc1c(F)cc(F)cc1F)[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875380715	EI	On-Demand	Anodyne	C3AR1	47	47
O=C(Nc1c(F)cc(F)cc1F)[C@H](Cc1cccnc1)C1CCCC1	ZINC000875380716	EI	On-Demand	Anodyne	C3AR1	47	47
O=C(NC1(C(F)(F)F)CCOCC1)[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875380763	FH	On-Demand	Anodyne	C3AR1	41	41
O=C(NC1(C(F)(F)F)CCOCC1)[C@H](Cc1cccnc1)C1CCCC1	ZINC000875380764	FH	On-Demand	Anodyne	C3AR1	41	41
O=CN1CCCN(C(=O)NCCc2cccc(-c3ccccc3)c2)CC1	ZINC000875380773	FF	On-Demand	Anodyne	FAAH	17	44
O=CN1CCCN(C(=O)NCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)CC1	ZINC000875380839	GE	On-Demand	Anodyne	PRNP	40	34
O=CN1CCCN(C(=O)NCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)CC1	ZINC000875380839	GE	On-Demand	Anodyne	NPSR1	24	40
O=CN1CCCN(C(=O)NCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)CC1	ZINC000875380839	GE	On-Demand	Anodyne	NOD2	42	36
O=C(Nc1ccc(F)cc1)c1ccc(CNC(=O)N2C[C@H]3C(=O)OC[C@H]3C2)cc1	ZINC000875380840	GE	On-Demand	Anodyne	NPSR1	23	40
CC(=O)C1CCN(C(=O)NCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)CC1	ZINC000875381098	GH	On-Demand	Anodyne	HTR1F	48	45
CC(=O)C1CCN(C(=O)NCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)CC1	ZINC000875381098	GH	On-Demand	Anodyne	CCR3	56	43
CC(=O)C1CCN(C(=O)NCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)CC1	ZINC000875381098	GH	On-Demand	Anodyne	PRNP	57	35
CC(=O)C1CCN(C(=O)NCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)CC1	ZINC000875381098	GH	On-Demand	Anodyne	SSTR3	19	41
CC(=O)C1CCN(C(=O)NCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)CC1	ZINC000875381098	GH	On-Demand	Anodyne	EPHX2	36	41
CC(=O)C1CCN(C(=O)NCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)CC1	ZINC000875381098	GH	On-Demand	Anodyne	MCHR1	19	44
CC(=O)C1CCN(C(=O)NCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)CC1	ZINC000875381098	GH	On-Demand	Anodyne	NOD2	42	37
CC(=O)C1CCN(C(=O)NCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)CC1	ZINC000875381098	GH	On-Demand	Anodyne	NAMPT	40	36
O=C(CCc1cccc2ccccc12)NC1(C(F)(F)F)CCOCC1	ZINC000875381099	FI	On-Demand	Anodyne	KCNJ11	57	32
O=C(CCc1ccc(N2CCCS2(=O)=O)cc1)Nc1c(F)cc(F)cc1F	ZINC000875381117	GG	On-Demand	Anodyne	CDK1	19	50
COCC1CC(NC(=O)NCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)C1	ZINC000875381158	GG	On-Demand	Anodyne	SSTR3	18	42
COCC1CC(NC(=O)NCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)C1	ZINC000875381158	GG	On-Demand	Anodyne	EPHX2	30	42
Cc1nn(-c2ccccc2)c(Cl)c1C(=O)N[C@@H](C)c1ccc(C(C)C)cc1	ZINC000875381186	GK	On-Demand	Anodyne	FPR1	26	44
Cc1nn(-c2ccccc2)c(Cl)c1C(=O)N[C@H](C)c1ccc(C(C)C)cc1	ZINC000875381187	GK	On-Demand	Anodyne	FPR1	26	44
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)C1	ZINC000875381199	GH	On-Demand	Anodyne	HTR1F	41	43
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)C1	ZINC000875381199	GH	On-Demand	Anodyne	CCR3	96	38
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)C1	ZINC000875381199	GH	On-Demand	Anodyne	PRNP	50	34
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)C1	ZINC000875381199	GH	On-Demand	Anodyne	SSTR3	19	41
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)C1	ZINC000875381199	GH	On-Demand	Anodyne	DPP7	43	33
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)C1	ZINC000875381199	GH	On-Demand	Anodyne	MCHR1	15	44
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)C1	ZINC000875381199	GH	On-Demand	Anodyne	NOD2	40	35
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)C1	ZINC000875381200	GH	On-Demand	Anodyne	HTR1F	41	43
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)C1	ZINC000875381200	GH	On-Demand	Anodyne	CCR3	96	38
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)C1	ZINC000875381200	GH	On-Demand	Anodyne	PRNP	50	34
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)C1	ZINC000875381200	GH	On-Demand	Anodyne	SSTR3	19	41
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)C1	ZINC000875381200	GH	On-Demand	Anodyne	DPP7	43	33
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)C1	ZINC000875381200	GH	On-Demand	Anodyne	MCHR1	15	44
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(C(=O)Nc3ccc(F)cc3)cc2)C1	ZINC000875381200	GH	On-Demand	Anodyne	NOD2	40	35
O=C(NCCc1cccc(-c2ccccc2)c1)N1CCC(CO)(CO)CC1	ZINC000875381225	FF	On-Demand	Anodyne	FAAH	15	45
O=C(NCCc1cccc(-c2ccccc2)c1)N1CCC(CO)(CO)CC1	ZINC000875381225	FF	On-Demand	Anodyne	HAO2	41	33
CC(C)c1ccc([C@H](C)NC(=O)/C=C\c2cnc3ccccc3n2)cc1	ZINC000875381264	EJ	On-Demand	Anodyne	KCNQ2	54	41
CC(C)c1ccc([C@H](C)NC(=O)/C=C\c2cnc3ccccc3n2)cc1	ZINC000875381264	EJ	On-Demand	Anodyne	UL26	79	40
CC(C)c1ccc([C@H](C)NC(=O)/C=C\c2cnc3ccccc3n2)cc1	ZINC000875381264	EJ	On-Demand	Anodyne	SCAF_EBVB9	70	36
CC(C)c1ccc([C@@H](C)NC(=O)/C=C\c2cnc3ccccc3n2)cc1	ZINC000875381265	EJ	On-Demand	Anodyne	KCNQ2	54	41
CC(C)c1ccc([C@@H](C)NC(=O)/C=C\c2cnc3ccccc3n2)cc1	ZINC000875381265	EJ	On-Demand	Anodyne	UL26	79	40
CC(C)c1ccc([C@@H](C)NC(=O)/C=C\c2cnc3ccccc3n2)cc1	ZINC000875381265	EJ	On-Demand	Anodyne	SCAF_EBVB9	70	36
CC(C)c1ccc([C@@H](C)NC(=O)/C=C/c2cnc3ccccc3n2)cc1	ZINC000875381266	EJ	On-Demand	Anodyne	KCNQ2	54	41
CC(C)c1ccc([C@@H](C)NC(=O)/C=C/c2cnc3ccccc3n2)cc1	ZINC000875381266	EJ	On-Demand	Anodyne	UL26	79	40
CC(C)c1ccc([C@@H](C)NC(=O)/C=C/c2cnc3ccccc3n2)cc1	ZINC000875381266	EJ	On-Demand	Anodyne	SCAF_EBVB9	70	36
CC(C)c1ccc([C@H](C)NC(=O)/C=C/c2cnc3ccccc3n2)cc1	ZINC000875381267	EJ	On-Demand	Anodyne	KCNQ2	54	41
CC(C)c1ccc([C@H](C)NC(=O)/C=C/c2cnc3ccccc3n2)cc1	ZINC000875381267	EJ	On-Demand	Anodyne	UL26	79	40
CC(C)c1ccc([C@H](C)NC(=O)/C=C/c2cnc3ccccc3n2)cc1	ZINC000875381267	EJ	On-Demand	Anodyne	SCAF_EBVB9	70	36
COC(=O)N(C)NC(=O)NCc1ccccc1-n1nc(C)cc1C	ZINC000875381274	ED	On-Demand	Reactive	P2RY1	15	40
Cc1nsc(NC(=O)c2ccc(OC(F)(F)F)cc2C(F)(F)F)n1	ZINC000875381278	FI	On-Demand	Anodyne	SCN10A	25	43
C[C@H](CC(=O)N1c2ccccc2OC[C@H]1C)NC(=O)OC(C)(C)C	ZINC000875381324	EG	On-Demand	Anodyne	FPR1	41	33
C[C@@H](CC(=O)N1c2ccccc2OC[C@H]1C)NC(=O)OC(C)(C)C	ZINC000875381326	EG	On-Demand	Anodyne	FPR1	41	33
C[C@@H](CC(=O)N1c2ccccc2OC[C@@H]1C)NC(=O)OC(C)(C)C	ZINC000875381327	EG	On-Demand	Anodyne	FPR1	41	33
CCCCCCCNC(=O)C(=O)NCC1([S@](C)=O)CCC1	ZINC000875381334	DD	On-Demand	Mild	ASAH1	45	30
CCCCCCCNC(=O)C(=O)NCC1([S@@](C)=O)CCC1	ZINC000875381335	DD	On-Demand	Mild	ASAH1	45	30
COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381336	EG	On-Demand	Anodyne	CHRM2	18	45
COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381336	EG	On-Demand	Anodyne	HTR1A	15	45
COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381336	EG	On-Demand	Anodyne	DRD2	37	48
COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381336	EG	On-Demand	Anodyne	TSHR	56	33
COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381336	EG	On-Demand	Anodyne	FKBP1A	71	40
COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381336	EG	On-Demand	Anodyne	DRD4	71	48
COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381336	EG	On-Demand	Anodyne	ACHE	63	53
COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381336	EG	On-Demand	Anodyne	SLC6A1	70	37
COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381336	EG	On-Demand	Anodyne	DRD3	30	47
COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381336	EG	On-Demand	Anodyne	OPRK1	16	42
COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381336	EG	On-Demand	Anodyne	KCNH2	17	43
COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381336	EG	On-Demand	Anodyne	HTR4	26	43
COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381336	EG	On-Demand	Anodyne	LTA4H	32	44
COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381336	EG	On-Demand	Anodyne	HRH3	16	43
COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381336	EG	On-Demand	Anodyne	SIGMAR1	74	55
COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381336	EG	On-Demand	Anodyne	BCHE	21	43
COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381336	EG	On-Demand	Anodyne	CCR3	38	40
COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381336	EG	On-Demand	Anodyne	CCR5	20	43
COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381336	EG	On-Demand	Anodyne	UTS2R	26	41
COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381336	EG	On-Demand	Anodyne	SLC18A3	26	51
COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381336	EG	On-Demand	Anodyne	MTNR1B	21	40
COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381336	EG	On-Demand	Anodyne	ABCB1	29	40
COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381336	EG	On-Demand	Anodyne	S1PR1	25	42
COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381336	EG	On-Demand	Anodyne	S1PR5	21	42
COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381336	EG	On-Demand	Anodyne	MCHR1	29	46
COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381336	EG	On-Demand	Anodyne	CACNA1G	36	41
COc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381336	EG	On-Demand	Anodyne	CCR8	29	46
COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381337	EG	On-Demand	Anodyne	CHRM2	18	45
COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381337	EG	On-Demand	Anodyne	HTR1A	15	45
COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381337	EG	On-Demand	Anodyne	DRD2	37	48
COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381337	EG	On-Demand	Anodyne	TSHR	56	33
COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381337	EG	On-Demand	Anodyne	FKBP1A	71	40
COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381337	EG	On-Demand	Anodyne	DRD4	71	48
COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381337	EG	On-Demand	Anodyne	ACHE	63	53
COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381337	EG	On-Demand	Anodyne	SLC6A1	70	37
COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381337	EG	On-Demand	Anodyne	DRD3	30	47
COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381337	EG	On-Demand	Anodyne	OPRK1	16	42
COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381337	EG	On-Demand	Anodyne	KCNH2	17	43
COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381337	EG	On-Demand	Anodyne	HTR4	26	43
COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381337	EG	On-Demand	Anodyne	LTA4H	32	44
COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381337	EG	On-Demand	Anodyne	HRH3	16	43
COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381337	EG	On-Demand	Anodyne	SIGMAR1	74	55
COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381337	EG	On-Demand	Anodyne	BCHE	21	43
COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381337	EG	On-Demand	Anodyne	CCR3	38	40
COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381337	EG	On-Demand	Anodyne	CCR5	20	43
COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381337	EG	On-Demand	Anodyne	UTS2R	26	41
COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381337	EG	On-Demand	Anodyne	SLC18A3	26	51
COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381337	EG	On-Demand	Anodyne	MTNR1B	21	40
COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381337	EG	On-Demand	Anodyne	ABCB1	29	40
COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381337	EG	On-Demand	Anodyne	S1PR1	25	42
COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381337	EG	On-Demand	Anodyne	S1PR5	21	42
COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381337	EG	On-Demand	Anodyne	MCHR1	29	46
COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381337	EG	On-Demand	Anodyne	CACNA1G	36	41
COc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1OC	ZINC000875381337	EG	On-Demand	Anodyne	CCR8	29	46
O=C(Nc1cc(Cl)c(Cl)cn1)C1C[C@@H]2CCCC[C@H](C1)C2=O	ZINC000875381397	EI	On-Demand	Anodyne	TYK2	62	39
COc1ccc(OC(=O)[C@H]2CCCN2C(C)=O)c2ccccc12	ZINC000875381416	DF	On-Demand	Anodyne	FKBP1A	82	39
COc1ccc(OC(=O)[C@H]2CCCN2C(C)=O)c2ccccc12	ZINC000875381416	DF	On-Demand	Anodyne	ELANE	44	37
COc1ccc(OC(=O)[C@H]2CCCN2C(C)=O)c2ccccc12	ZINC000875381416	DF	On-Demand	Anodyne	PREP	67	39
COc1ccc(OC(=O)[C@H]2CCCN2C(C)=O)c2ccccc12	ZINC000875381416	DF	On-Demand	Anodyne	ACKR3	51	32
CC(=O)N1CCC[C@@H]1C(=O)Nc1cc(Cl)c(Cl)cn1	ZINC000875381430	DE	On-Demand	Anodyne	TYK2	46	38
O=C(NCCO)C1CCN(C(=O)NCCCOc2ccc3ccccc3c2)CC1	ZINC000875381438	GE	On-Demand	Anodyne	MTNR1A	36	51
O=C(NCCO)C1CCN(C(=O)NCCCOc2ccc3ccccc3c2)CC1	ZINC000875381438	GE	On-Demand	Anodyne	MTNR1B	30	51
O=C(NCCO)C1CCN(C(=O)NCCCOc2ccc3ccccc3c2)CC1	ZINC000875381438	GE	On-Demand	Anodyne	EPHX2	21	42
C[C@@H]1O[C@H](C)[C@H](C(=O)Nc2cc(Cl)c(Cl)cn2)[C@@H]1C	ZINC000875381441	DG	On-Demand	Anodyne	TYK2	44	33
C[C@@H]1O[C@H](C)[C@H](C(=O)Nc2cc(Cl)c(Cl)cn2)[C@H]1C	ZINC000875381442	DG	On-Demand	Anodyne	TYK2	44	33
C[C@@H]1O[C@H](C)[C@@H](C(=O)Nc2cc(Cl)c(Cl)cn2)[C@H]1C	ZINC000875381443	DG	On-Demand	Anodyne	TYK2	44	33
C[C@@H]1O[C@H](C)[C@@H](C(=O)Nc2cc(Cl)c(Cl)cn2)[C@@H]1C	ZINC000875381444	DG	On-Demand	Anodyne	TYK2	44	33
COc1ccc(OC(=O)C2CCN(C(C)C)CC2)cc1OC	ZINC000875381445	DF	On-Demand	Anodyne	HRH3	17	42
COc1ccc(OC(=O)C2CCN(C(C)C)CC2)cc1OC	ZINC000875381445	DF	On-Demand	Anodyne	SLC5A7	33	43
COc1ccc(OC(=O)C2CCN(C(C)C)CC2)cc1OC	ZINC000875381445	DF	On-Demand	Anodyne	EHMT2	54	32
O=C(NCCCOc1ccc2ccccc2c1)NC[C@@]12COCCN1C(=O)OC2	ZINC000875381522	GE	On-Demand	Anodyne	HRH2	26	41
O=C(NCCCOc1ccc2ccccc2c1)NC[C@]12COCCN1C(=O)OC2	ZINC000875381523	GE	On-Demand	Anodyne	HRH2	26	41
CCC(=O)N1CC[C@@H](NC(=O)N2CCC[C@@H](OC3CCC3)CC2)C1	ZINC000875381562	EE	On-Demand	Anodyne	EPHX2	20	46
CCC(=O)N1CC[C@H](NC(=O)N2CCC[C@@H](OC3CCC3)CC2)C1	ZINC000875381564	EE	On-Demand	Anodyne	EPHX2	20	46
CCC(=O)N1CC[C@H](NC(=O)N2CCC[C@H](OC3CCC3)CC2)C1	ZINC000875381566	EE	On-Demand	Anodyne	EPHX2	20	46
CCC(=O)N1CC[C@@H](NC(=O)N2CCC[C@H](OC3CCC3)CC2)C1	ZINC000875381568	EE	On-Demand	Anodyne	EPHX2	20	46
O=C(NCc1ccn2ccnc2c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875381579	EF	On-Demand	Anodyne	EPHX2	19	42
O=C(NCc1ccn2ccnc2c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875381582	EF	On-Demand	Anodyne	EPHX2	19	42
COCC1CC(NC(=O)NCCCOc2ccc3ccccc3c2)C1	ZINC000875381590	EG	On-Demand	Anodyne	HRH2	26	45
COCC1CC(NC(=O)NCCCOc2ccc3ccccc3c2)C1	ZINC000875381590	EG	On-Demand	Anodyne	MTNR1A	51	42
COCC1CC(NC(=O)NCCCOc2ccc3ccccc3c2)C1	ZINC000875381590	EG	On-Demand	Anodyne	MTNR1B	35	42
COCC1CC(NC(=O)NCCCOc2ccc3ccccc3c2)C1	ZINC000875381590	EG	On-Demand	Anodyne	EPHX2	16	45
C[C@@H](NC(=O)N1CCC(c2nccc(-c3cccnc3)n2)CC1)C1CCOCC1	ZINC000875381597	GG	On-Demand	Anodyne	MAPK1	60	32
CN1CCN(C(=O)NCc2ccn3ccnc3c2)Cc2cccnc21	ZINC000875381613	ED	On-Demand	Anodyne	NAMPT	25	41
CCC(=O)N1CC[C@@H](NC(=O)NNc2cccc(F)c2Br)C1	ZINC000875381634	FE	On-Demand	Reactive	EPHX2	30	47
CCC(=O)N1CC[C@@H](NC(=O)NNc2cccc(F)c2Br)C1	ZINC000875381634	FE	On-Demand	Reactive	CCR8	57	37
C=C(C)COCCNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875381635	EF	On-Demand	Mild	ITK	18	51
CCC(=O)N1CC[C@H](NC(=O)NNc2cccc(F)c2Br)C1	ZINC000875381636	FE	On-Demand	Reactive	EPHX2	30	47
CCC(=O)N1CC[C@H](NC(=O)NNc2cccc(F)c2Br)C1	ZINC000875381636	FE	On-Demand	Reactive	CCR8	57	37
O=C(NC1CC(Nc2ccccc2)C1)N[C@@H]1CCN(C(=O)C2CCCC2)C1	ZINC000875381676	FF	On-Demand	Anodyne	EPHX2	40	42
O=C(NC1CC(Nc2ccccc2)C1)N[C@@H]1CCN(C(=O)C2CCCC2)C1	ZINC000875381676	FF	On-Demand	Anodyne	SFRP1	48	34
O=C(NC1CC(Nc2ccccc2)C1)N[C@@H]1CCN(C(=O)C2CCCC2)C1	ZINC000875381676	FF	On-Demand	Anodyne	WNT3	48	34
O=C(NC1CC(Nc2ccccc2)C1)N[C@H]1CCN(C(=O)C2CCCC2)C1	ZINC000875381677	FF	On-Demand	Anodyne	EPHX2	40	42
O=C(NC1CC(Nc2ccccc2)C1)N[C@H]1CCN(C(=O)C2CCCC2)C1	ZINC000875381677	FF	On-Demand	Anodyne	SFRP1	48	34
O=C(NC1CC(Nc2ccccc2)C1)N[C@H]1CCN(C(=O)C2CCCC2)C1	ZINC000875381677	FF	On-Demand	Anodyne	WNT3	48	34
O=C(NCc1ccn2ccnc2c1)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875381684	FG	On-Demand	Anodyne	NAMPT	43	39
O=C(NCc1ccn2ccnc2c1)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875381685	FG	On-Demand	Anodyne	NAMPT	43	39
COc1cccc(C(C)(C)C(=O)Nc2cccc(Cl)n2)c1	ZINC000875381692	DH	On-Demand	Anodyne	TAAR1	19	41
O=C(Nc1cccc(Cl)n1)[C@H]1CC[C@H]1C(=O)Nc1cccc(Cl)n1	ZINC000875381699	FG	On-Demand	Anodyne	TYK2	60	40
O=C(Nc1cccc(Cl)n1)[C@@H]1CC[C@H]1C(=O)Nc1cccc(Cl)n1	ZINC000875381700	FG	On-Demand	Anodyne	TYK2	60	40
O=C(Nc1cccc(Cl)n1)[C@H]1CC[C@@H]1C(=O)Nc1cccc(Cl)n1	ZINC000875381701	FG	On-Demand	Anodyne	TYK2	60	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(C(=O)C2CCCC2)C1	ZINC000875381709	ED	On-Demand	Anodyne	EPHX2	19	44
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(C(=O)C2CCCC2)C1	ZINC000875381710	ED	On-Demand	Anodyne	EPHX2	19	44
C[C@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)C1CCOCC1	ZINC000875381719	FF	On-Demand	Mild	ITK	17	49
C[C@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)C1CCOCC1	ZINC000875381719	FF	On-Demand	Mild	PANC	58	39
Cn1ccnc(NC(=O)[C@@H](Cc2cccnc2)C2CCCC2)c1=O	ZINC000875381721	EE	On-Demand	Anodyne	CHRNA7	40	35
Cn1ccnc(NC(=O)[C@@H](Cc2cccnc2)C2CCCC2)c1=O	ZINC000875381721	EE	On-Demand	Anodyne	C3AR1	47	45
Cn1ccnc(NC(=O)[C@H](Cc2cccnc2)C2CCCC2)c1=O	ZINC000875381722	EE	On-Demand	Anodyne	CHRNA7	40	35
Cn1ccnc(NC(=O)[C@H](Cc2cccnc2)C2CCCC2)c1=O	ZINC000875381722	EE	On-Demand	Anodyne	C3AR1	47	45
O=C1C[C@@H](C(F)(F)F)[C@@H](C(=O)Nc2cc(Cl)c(Cl)cn2)CN1	ZINC000875381727	FF	On-Demand	Anodyne	TYK2	59	35
O=C1C[C@@H](C(F)(F)F)[C@H](C(=O)Nc2cc(Cl)c(Cl)cn2)CN1	ZINC000875381728	FF	On-Demand	Anodyne	TYK2	59	35
O=C1C[C@H](C(F)(F)F)[C@H](C(=O)Nc2cc(Cl)c(Cl)cn2)CN1	ZINC000875381729	FF	On-Demand	Anodyne	TYK2	59	35
O=C1C[C@H](C(F)(F)F)[C@@H](C(=O)Nc2cc(Cl)c(Cl)cn2)CN1	ZINC000875381730	FF	On-Demand	Anodyne	TYK2	59	35
CCC(=O)N1CC[C@@H](NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)C1	ZINC000875381759	ED	On-Demand	Anodyne	EPHX2	32	44
CCC(=O)N1CC[C@H](NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)C1	ZINC000875381761	ED	On-Demand	Anodyne	EPHX2	32	44
CCC(=O)N1CC[C@H](NC(=O)N2CCC[C@](O)(c3ccccc3)C2)C1	ZINC000875381764	ED	On-Demand	Anodyne	EPHX2	32	44
CCC(=O)N1CC[C@@H](NC(=O)N2CCC[C@](O)(c3ccccc3)C2)C1	ZINC000875381765	ED	On-Demand	Anodyne	EPHX2	32	44
C[C@H]1CN(c2ccc(C(=O)Nc3cccc(Cl)n3)cc2)C[C@@H](C)O1	ZINC000875381768	EH	On-Demand	Anodyne	PRNP	46	34
C[C@H]1CN(c2ccc(C(=O)Nc3cccc(Cl)n3)cc2)C[C@@H](C)O1	ZINC000875381768	EH	On-Demand	Anodyne	GRM5	16	40
C[C@H]1CN(c2ccc(C(=O)Nc3cccc(Cl)n3)cc2)C[C@@H](C)O1	ZINC000875381768	EH	On-Demand	Anodyne	MAP3K5	51	37
C[C@H]1CN(c2ccc(C(=O)Nc3cccc(Cl)n3)cc2)C[C@H](C)O1	ZINC000875381770	EH	On-Demand	Anodyne	PRNP	46	34
C[C@H]1CN(c2ccc(C(=O)Nc3cccc(Cl)n3)cc2)C[C@H](C)O1	ZINC000875381770	EH	On-Demand	Anodyne	GRM5	16	40
C[C@H]1CN(c2ccc(C(=O)Nc3cccc(Cl)n3)cc2)C[C@H](C)O1	ZINC000875381770	EH	On-Demand	Anodyne	MAP3K5	51	37
C[C@H](C(=O)Nc1cccc(Cl)n1)n1ccc(C(F)(F)F)n1	ZINC000875381778	DG	On-Demand	Anodyne	CARM1	57	34
CC(=O)c1ccc(NC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1	ZINC000875381794	FE	On-Demand	Reactive	PRNP	15	43
C=C(C)COCCNC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875381796	DE	On-Demand	Mild	SLC12A5	42	32
C=C(C)COCCNC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875381798	DE	On-Demand	Mild	SLC12A5	42	32
CCC(=O)N1CC[C@H](NC(=O)N2CCC[C@@H](CCC(=O)OC)C2)C1	ZINC000875381811	ED	On-Demand	Anodyne	EPHX2	16	42
CCC(=O)N1CC[C@H](NC(=O)N2CCC[C@H](CCC(=O)OC)C2)C1	ZINC000875381813	ED	On-Demand	Anodyne	EPHX2	16	42
CCC(=O)N1CC[C@@H](NC(=O)N2CCC[C@@H](CCC(=O)OC)C2)C1	ZINC000875381814	ED	On-Demand	Anodyne	EPHX2	16	42
CCC(=O)N1CC[C@@H](NC(=O)N2CCC[C@H](CCC(=O)OC)C2)C1	ZINC000875381816	ED	On-Demand	Anodyne	EPHX2	16	42
CCC(=O)N1CC[C@@H](NC(=O)N(C)OCC(F)(F)F)C1	ZINC000875381847	CD	On-Demand	Anodyne	EPHX2	21	42
CCC(=O)N1CC[C@H](NC(=O)N(C)OCC(F)(F)F)C1	ZINC000875381849	CD	On-Demand	Anodyne	EPHX2	21	42
CCC(=O)N1CC[C@@H](NC(=O)NC(C)(C)[C@H]2CCCCO2)C1	ZINC000875381878	DD	On-Demand	Anodyne	EPHX2	19	51
CCC(=O)N1CC[C@@H](NC(=O)NC(C)(C)[C@@H]2CCCCO2)C1	ZINC000875381879	DD	On-Demand	Anodyne	EPHX2	19	51
CCC(=O)N1CC[C@H](NC(=O)NC(C)(C)[C@H]2CCCCO2)C1	ZINC000875381880	DD	On-Demand	Anodyne	EPHX2	19	51
CCC(=O)N1CC[C@H](NC(=O)NC(C)(C)[C@@H]2CCCCO2)C1	ZINC000875381881	DD	On-Demand	Anodyne	EPHX2	19	51
CCC(=O)N1CC[C@H](NC(=O)NCC[C@H](O)C2CCCC2)C1	ZINC000875381886	DD	On-Demand	Anodyne	EPHX2	22	54
CCC(=O)N1CC[C@@H](NC(=O)NCC[C@H](O)C2CCCC2)C1	ZINC000875381887	DD	On-Demand	Anodyne	EPHX2	22	54
CCC(=O)N1CC[C@H](NC(=O)NCC[C@@H](O)C2CCCC2)C1	ZINC000875381888	DD	On-Demand	Anodyne	EPHX2	22	54
CCC(=O)N1CC[C@@H](NC(=O)NCC[C@@H](O)C2CCCC2)C1	ZINC000875381889	DD	On-Demand	Anodyne	EPHX2	22	54
CCC(=O)N1CC[C@@H](NC(=O)N2CCCC2(CC)CC)C1	ZINC000875381891	CE	On-Demand	Anodyne	EPHX2	15	47
CCC(=O)N1CC[C@H](NC(=O)N2CCCC2(CC)CC)C1	ZINC000875381892	CE	On-Demand	Anodyne	EPHX2	15	47
O=C(Nc1cccc(Cl)n1)c1cncc(N2CCCC2)n1	ZINC000875381893	DE	On-Demand	Anodyne	GRM5	15	48
O=C(Nc1cccc(Cl)n1)c1cncc(N2CCCC2)n1	ZINC000875381893	DE	On-Demand	Anodyne	SCN10A	37	41
CCC(=O)N1CC[C@@H](NC(=O)N[C@@H]2CC(C)(C)CC[C@H]2O)C1	ZINC000875381904	DD	On-Demand	Anodyne	EPHX2	24	49
CCC(=O)N1CC[C@H](NC(=O)N[C@@H]2CC(C)(C)CC[C@H]2O)C1	ZINC000875381905	DD	On-Demand	Anodyne	EPHX2	24	49
CN1CCN(C2CCN(C(=O)NCc3ccn4ccnc4c3)CC2)CC1	ZINC000875381908	FD	On-Demand	Anodyne	L3MBTL3	59	38
Cn1nc(C(=O)OC(C)(C)C)cc1C(=O)Nc1cccc(Cl)n1	ZINC000875381912	EF	On-Demand	Anodyne	GRM5	17	45
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000875381928	GE	On-Demand	Reactive	DRD4	36	53
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000875381928	GE	On-Demand	Reactive	ACHE	23	43
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000875381928	GE	On-Demand	Reactive	KCNH2	15	41
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000875381928	GE	On-Demand	Reactive	CHRM3	16	42
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000875381928	GE	On-Demand	Reactive	LTA4H	25	42
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000875381928	GE	On-Demand	Reactive	SIGMAR1	39	60
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000875381928	GE	On-Demand	Reactive	SSTR5	62	37
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000875381928	GE	On-Demand	Reactive	CCR3	34	40
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000875381928	GE	On-Demand	Reactive	CCR5	16	48
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000875381928	GE	On-Demand	Reactive	UTS2R	19	48
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000875381928	GE	On-Demand	Reactive	SLC6A5	29	41
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000875381928	GE	On-Demand	Reactive	EPHX2	23	45
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000875381928	GE	On-Demand	Reactive	CXCR3	30	40
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000875381928	GE	On-Demand	Reactive	MCHR1	56	47
COC(=O)N(C)NC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000875381928	GE	On-Demand	Reactive	CACNA1G	32	41
CONC(=O)C1CCN(C(=O)NCCCOc2ccc3ccccc3c2)CC1	ZINC000875381931	GF	On-Demand	Anodyne	HRH2	36	40
CONC(=O)C1CCN(C(=O)NCCCOc2ccc3ccccc3c2)CC1	ZINC000875381931	GF	On-Demand	Anodyne	HRH3	17	42
CONC(=O)C1CCN(C(=O)NCCCOc2ccc3ccccc3c2)CC1	ZINC000875381931	GF	On-Demand	Anodyne	CXCR4	43	33
CONC(=O)C1CCN(C(=O)NCCCOc2ccc3ccccc3c2)CC1	ZINC000875381931	GF	On-Demand	Anodyne	MTNR1A	43	45
CONC(=O)C1CCN(C(=O)NCCCOc2ccc3ccccc3c2)CC1	ZINC000875381931	GF	On-Demand	Anodyne	MTNR1B	34	45
CONC(=O)C1CCN(C(=O)NCCCOc2ccc3ccccc3c2)CC1	ZINC000875381931	GF	On-Demand	Anodyne	EPHX2	26	41
CCC(=O)N1CC[C@@H](NC(=O)N2CCCC[C@@H]2CNC(=O)NC)C1	ZINC000875381942	EC	On-Demand	Anodyne	EPHX2	16	46
CCC(=O)N1CC[C@@H](NC(=O)N2CCCC[C@H]2CNC(=O)NC)C1	ZINC000875381943	EC	On-Demand	Anodyne	EPHX2	16	46
CCC(=O)N1CC[C@H](NC(=O)N2CCCC[C@@H]2CNC(=O)NC)C1	ZINC000875381944	EC	On-Demand	Anodyne	EPHX2	16	46
CCC(=O)N1CC[C@H](NC(=O)N2CCCC[C@H]2CNC(=O)NC)C1	ZINC000875381946	EC	On-Demand	Anodyne	EPHX2	16	46
NC(=O)C1CC(NC(=O)NCCCOc2ccc3ccccc3c2)C1	ZINC000875381947	EE	On-Demand	Anodyne	HRH2	31	48
NC(=O)C1CC(NC(=O)NCCCOc2ccc3ccccc3c2)C1	ZINC000875381947	EE	On-Demand	Anodyne	CXCR4	42	35
NC(=O)C1CC(NC(=O)NCCCOc2ccc3ccccc3c2)C1	ZINC000875381947	EE	On-Demand	Anodyne	MTNR1A	38	43
NC(=O)C1CC(NC(=O)NCCCOc2ccc3ccccc3c2)C1	ZINC000875381947	EE	On-Demand	Anodyne	MTNR1B	25	43
CCC(=O)N1CC[C@@H](NC(=O)NC[C@@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875381948	ED	On-Demand	Anodyne	EPHX2	26	44
CCC(=O)N1CC[C@H](NC(=O)NC[C@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875381950	ED	On-Demand	Anodyne	EPHX2	26	44
CCC(=O)N1CC[C@H](NC(=O)NC[C@@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875381952	ED	On-Demand	Anodyne	EPHX2	26	44
CCC(=O)N1CC[C@@H](NC(=O)NC[C@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875381954	ED	On-Demand	Anodyne	EPHX2	26	44
Cn1ccnc(NC(=O)[C@H](F)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1=O	ZINC000875382005	FD	On-Demand	Anodyne	GPR119	34	41
Cn1ccnc(NC(=O)[C@@H](F)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1=O	ZINC000875382012	FD	On-Demand	Anodyne	GPR119	34	41
Cn1ccnc(NC(=O)[C@@H](F)[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1=O	ZINC000875382014	FD	On-Demand	Anodyne	GPR119	34	41
Cn1ccnc(NC(=O)[C@H](F)[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1=O	ZINC000875382017	FD	On-Demand	Anodyne	GPR119	34	41
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1cccc(Cl)n1	ZINC000875382032	DG	On-Demand	Anodyne	PPARD	47	43
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1cccc(Cl)n1	ZINC000875382032	DG	On-Demand	Anodyne	MTNR1A	42	41
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1cccc(Cl)n1	ZINC000875382032	DG	On-Demand	Anodyne	MTNR1B	42	41
CCC(=O)N1CC[C@@H](NC(=O)NNc2ccc(OCc3ccccc3)cc2)C1	ZINC000875382045	GF	On-Demand	Reactive	LTA4H	45	43
CCC(=O)N1CC[C@@H](NC(=O)NNc2ccc(OCc3ccccc3)cc2)C1	ZINC000875382045	GF	On-Demand	Reactive	CACNA1B	20	40
CCC(=O)N1CC[C@@H](NC(=O)NNc2ccc(OCc3ccccc3)cc2)C1	ZINC000875382045	GF	On-Demand	Reactive	ADAM17	38	42
CCC(=O)N1CC[C@@H](NC(=O)NNc2ccc(OCc3ccccc3)cc2)C1	ZINC000875382045	GF	On-Demand	Reactive	SLC6A5	38	45
CCC(=O)N1CC[C@@H](NC(=O)NNc2ccc(OCc3ccccc3)cc2)C1	ZINC000875382045	GF	On-Demand	Reactive	EPHX2	49	57
CCC(=O)N1CC[C@@H](NC(=O)NNc2ccc(OCc3ccccc3)cc2)C1	ZINC000875382045	GF	On-Demand	Reactive	TGM2	15	41
CCC(=O)N1CC[C@@H](NC(=O)NNc2ccc(OCc3ccccc3)cc2)C1	ZINC000875382045	GF	On-Demand	Reactive	F13A1	21	41
CCC(=O)N1CC[C@@H](NC(=O)NNc2ccc(OCc3ccccc3)cc2)C1	ZINC000875382045	GF	On-Demand	Reactive	CCR8	54	47
CCC(=O)N1CC[C@@H](NC(=O)NNc2ccc(OCc3ccccc3)cc2)C1	ZINC000875382045	GF	On-Demand	Reactive	BIRC2	19	41
CCC(=O)N1CC[C@H](NC(=O)NNc2ccc(OCc3ccccc3)cc2)C1	ZINC000875382046	GF	On-Demand	Reactive	LTA4H	45	43
CCC(=O)N1CC[C@H](NC(=O)NNc2ccc(OCc3ccccc3)cc2)C1	ZINC000875382046	GF	On-Demand	Reactive	CACNA1B	20	40
CCC(=O)N1CC[C@H](NC(=O)NNc2ccc(OCc3ccccc3)cc2)C1	ZINC000875382046	GF	On-Demand	Reactive	ADAM17	38	42
CCC(=O)N1CC[C@H](NC(=O)NNc2ccc(OCc3ccccc3)cc2)C1	ZINC000875382046	GF	On-Demand	Reactive	SLC6A5	38	45
CCC(=O)N1CC[C@H](NC(=O)NNc2ccc(OCc3ccccc3)cc2)C1	ZINC000875382046	GF	On-Demand	Reactive	EPHX2	49	57
CCC(=O)N1CC[C@H](NC(=O)NNc2ccc(OCc3ccccc3)cc2)C1	ZINC000875382046	GF	On-Demand	Reactive	TGM2	15	41
CCC(=O)N1CC[C@H](NC(=O)NNc2ccc(OCc3ccccc3)cc2)C1	ZINC000875382046	GF	On-Demand	Reactive	F13A1	21	41
CCC(=O)N1CC[C@H](NC(=O)NNc2ccc(OCc3ccccc3)cc2)C1	ZINC000875382046	GF	On-Demand	Reactive	CCR8	54	47
CCC(=O)N1CC[C@H](NC(=O)NNc2ccc(OCc3ccccc3)cc2)C1	ZINC000875382046	GF	On-Demand	Reactive	BIRC2	19	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(C(=O)CC)C2)C1	ZINC000875382062	EC	On-Demand	Anodyne	EPHX2	16	44
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(C(=O)CC)C2)C1	ZINC000875382065	EC	On-Demand	Anodyne	EPHX2	16	44
C=C(C)COCCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875382067	EF	On-Demand	Mild	FKBP1A	52	41
C=C(C)COCCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875382067	EF	On-Demand	Mild	CPT1A	58	34
C=C(C)COCCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875382069	EF	On-Demand	Mild	FKBP1A	52	41
C=C(C)COCCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875382069	EF	On-Demand	Mild	CPT1A	58	34
C=C(C)COCCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875382071	EF	On-Demand	Mild	FKBP1A	52	41
C=C(C)COCCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875382071	EF	On-Demand	Mild	CPT1A	58	34
C=C(C)COCCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875382073	EF	On-Demand	Mild	FKBP1A	52	41
C=C(C)COCCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875382073	EF	On-Demand	Mild	CPT1A	58	34
CCC(=O)N1CC[C@H](NC(=O)NC2CC(Nc3ccccc3)C2)C1	ZINC000875382075	ED	On-Demand	Anodyne	EPHX2	48	57
CCC(=O)N1CC[C@H](NC(=O)NC2CC(Nc3ccccc3)C2)C1	ZINC000875382075	ED	On-Demand	Anodyne	CCR8	45	37
CCC(=O)N1CC[C@H](NC(=O)NC2CC(Nc3ccccc3)C2)C1	ZINC000875382075	ED	On-Demand	Anodyne	BIRC2	21	42
CCC(=O)N1CC[C@@H](NC(=O)NC2CC(Nc3ccccc3)C2)C1	ZINC000875382081	ED	On-Demand	Anodyne	EPHX2	48	57
CCC(=O)N1CC[C@@H](NC(=O)NC2CC(Nc3ccccc3)C2)C1	ZINC000875382081	ED	On-Demand	Anodyne	CCR8	45	37
CCC(=O)N1CC[C@@H](NC(=O)NC2CC(Nc3ccccc3)C2)C1	ZINC000875382081	ED	On-Demand	Anodyne	BIRC2	21	42
O=C(CCc1ccc(N2CCCS2(=O)=O)cc1)Nc1cccc(Cl)n1	ZINC000875382083	GF	On-Demand	Anodyne	CDK1	19	46
CCC(=O)N1CC[C@@H](NC(=O)NNc2cccc(F)c2Cl)C1	ZINC000875382104	EE	On-Demand	Reactive	EPHX2	30	49
CCC(=O)N1CC[C@H](NC(=O)NNc2cccc(F)c2Cl)C1	ZINC000875382105	EE	On-Demand	Reactive	EPHX2	30	49
C=C(C)COCCNC(=O)N[C@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875382118	FE	On-Demand	Mild	MTNR1A	45	40
C=C(C)COCCNC(=O)N[C@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875382118	FE	On-Demand	Mild	MTNR1B	39	40
C=C(C)COCCNC(=O)N[C@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875382119	FE	On-Demand	Mild	MTNR1A	45	40
C=C(C)COCCNC(=O)N[C@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875382119	FE	On-Demand	Mild	MTNR1B	39	40
C=C(C)COCCNC(=O)N[C@@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875382120	FE	On-Demand	Mild	MTNR1A	45	40
C=C(C)COCCNC(=O)N[C@@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875382120	FE	On-Demand	Mild	MTNR1B	39	40
C=C(C)COCCNC(=O)N[C@@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875382121	FE	On-Demand	Mild	MTNR1A	45	40
C=C(C)COCCNC(=O)N[C@@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875382121	FE	On-Demand	Mild	MTNR1B	39	40
CCC(=O)N1CC[C@H](NC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)C1	ZINC000875382126	FE	On-Demand	Anodyne	EPHX2	18	42
CCC(=O)N1CC[C@H](NC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)C1	ZINC000875382126	FE	On-Demand	Anodyne	BIRC2	25	42
CCC(=O)N1CC[C@H](NC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)C1	ZINC000875382128	FE	On-Demand	Anodyne	EPHX2	18	42
CCC(=O)N1CC[C@H](NC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)C1	ZINC000875382128	FE	On-Demand	Anodyne	BIRC2	25	42
CCC(=O)N1CC[C@H](NC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)C1	ZINC000875382130	FE	On-Demand	Anodyne	EPHX2	18	42
CCC(=O)N1CC[C@H](NC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)C1	ZINC000875382130	FE	On-Demand	Anodyne	BIRC2	25	42
CCC(=O)N1CC[C@H](NC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)C1	ZINC000875382132	FE	On-Demand	Anodyne	EPHX2	18	42
CCC(=O)N1CC[C@H](NC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)C1	ZINC000875382132	FE	On-Demand	Anodyne	BIRC2	25	42
O=C(Nc1cccc(Cl)n1)c1ccnc(N2CCOCC2)n1	ZINC000875382146	DD	On-Demand	Anodyne	PIK3CA	35	45
O=C(Nc1cccc(Cl)n1)c1ccnc(N2CCOCC2)n1	ZINC000875382146	DD	On-Demand	Anodyne	PIK3CD	22	40
O=C(Nc1cccc(Cl)n1)c1ccnc(N2CCOCC2)n1	ZINC000875382146	DD	On-Demand	Anodyne	MTOR	26	42
O=C(Nc1cccc(Cl)n1)c1ccnc(N2CCOCC2)n1	ZINC000875382146	DD	On-Demand	Anodyne	PIK3CG	26	42
O=C(Nc1cccc(Cl)n1)c1ccnc(N2CCOCC2)n1	ZINC000875382146	DD	On-Demand	Anodyne	PIK3CB	36	40
CCC(=O)N1CC[C@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875382148	FD	On-Demand	Anodyne	DRD4	39	47
CCC(=O)N1CC[C@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875382148	FD	On-Demand	Anodyne	ACHE	21	40
CCC(=O)N1CC[C@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875382148	FD	On-Demand	Anodyne	SIGMAR1	36	45
CCC(=O)N1CC[C@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875382148	FD	On-Demand	Anodyne	CCR3	24	41
CCC(=O)N1CC[C@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875382148	FD	On-Demand	Anodyne	MLNR	45	36
CCC(=O)N1CC[C@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875382148	FD	On-Demand	Anodyne	CCR2	18	40
CCC(=O)N1CC[C@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875382148	FD	On-Demand	Anodyne	EPHX2	24	47
CCC(=O)N1CC[C@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875382148	FD	On-Demand	Anodyne	MCHR1	18	44
CCC(=O)N1CC[C@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875382148	FD	On-Demand	Anodyne	BIRC2	23	41
CCC(=O)N1CC[C@@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875382150	FD	On-Demand	Anodyne	DRD4	39	47
CCC(=O)N1CC[C@@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875382150	FD	On-Demand	Anodyne	ACHE	21	40
CCC(=O)N1CC[C@@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875382150	FD	On-Demand	Anodyne	SIGMAR1	36	45
CCC(=O)N1CC[C@@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875382150	FD	On-Demand	Anodyne	CCR3	24	41
CCC(=O)N1CC[C@@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875382150	FD	On-Demand	Anodyne	MLNR	45	36
CCC(=O)N1CC[C@@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875382150	FD	On-Demand	Anodyne	CCR2	18	40
CCC(=O)N1CC[C@@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875382150	FD	On-Demand	Anodyne	EPHX2	24	47
CCC(=O)N1CC[C@@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875382150	FD	On-Demand	Anodyne	MCHR1	18	44
CCC(=O)N1CC[C@@H](NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875382150	FD	On-Demand	Anodyne	BIRC2	23	41
CCC(=O)N1CC[C@H](NC(=O)NC2(CNC(=O)OC(C)(C)C)CCCCC2)C1	ZINC000875382166	GF	On-Demand	Anodyne	EPHX2	16	45
CCC(=O)N1CC[C@@H](NC(=O)NC2(CNC(=O)OC(C)(C)C)CCCCC2)C1	ZINC000875382167	GF	On-Demand	Anodyne	EPHX2	16	45
O=C(NNC(=O)c1nnc(O)c2ccccc12)Nc1nccs1	ZINC000875382175	ED	On-Demand	Reactive	MAP1	132	42
CCC(=O)N1CC[C@@H](NC(=O)NN=c2cc[nH]cc2C)C1	ZINC000875382176	CC	On-Demand	Reactive	EPHX2	24	43
CCC(=O)N1CC[C@H](NC(=O)NN=c2cc[nH]cc2C)C1	ZINC000875382177	CC	On-Demand	Reactive	EPHX2	24	43
CCC(=O)N1CC[C@H](NC(=O)N(CC)[C@H](C)[C@H](O)c2ccccc2)C1	ZINC000875382211	EE	On-Demand	Anodyne	EPHX2	18	44
CCC(=O)N1CC[C@H](NC(=O)N(CC)[C@H](C)[C@H](O)c2ccccc2)C1	ZINC000875382211	EE	On-Demand	Anodyne	XIAP	40	39
CCC(=O)N1CC[C@H](NC(=O)N(CC)[C@H](C)[C@H](O)c2ccccc2)C1	ZINC000875382211	EE	On-Demand	Anodyne	BIRC2	31	40
CCC(=O)N1CC[C@H](NC(=O)N(CC)[C@@H](C)[C@@H](O)c2ccccc2)C1	ZINC000875382213	EE	On-Demand	Anodyne	EPHX2	18	44
CCC(=O)N1CC[C@H](NC(=O)N(CC)[C@@H](C)[C@@H](O)c2ccccc2)C1	ZINC000875382213	EE	On-Demand	Anodyne	XIAP	40	39
CCC(=O)N1CC[C@H](NC(=O)N(CC)[C@@H](C)[C@@H](O)c2ccccc2)C1	ZINC000875382213	EE	On-Demand	Anodyne	BIRC2	31	40
CCC(=O)N1CC[C@H](NC(=O)N(CC)[C@H](C)[C@@H](O)c2ccccc2)C1	ZINC000875382215	EE	On-Demand	Anodyne	EPHX2	18	44
CCC(=O)N1CC[C@H](NC(=O)N(CC)[C@H](C)[C@@H](O)c2ccccc2)C1	ZINC000875382215	EE	On-Demand	Anodyne	XIAP	40	39
CCC(=O)N1CC[C@H](NC(=O)N(CC)[C@H](C)[C@@H](O)c2ccccc2)C1	ZINC000875382215	EE	On-Demand	Anodyne	BIRC2	31	40
CCC(=O)N1CC[C@H](NC(=O)N(CC)[C@@H](C)[C@H](O)c2ccccc2)C1	ZINC000875382216	EE	On-Demand	Anodyne	EPHX2	18	44
CCC(=O)N1CC[C@H](NC(=O)N(CC)[C@@H](C)[C@H](O)c2ccccc2)C1	ZINC000875382216	EE	On-Demand	Anodyne	XIAP	40	39
CCC(=O)N1CC[C@H](NC(=O)N(CC)[C@@H](C)[C@H](O)c2ccccc2)C1	ZINC000875382216	EE	On-Demand	Anodyne	BIRC2	31	40
CCC(=O)N1CC[C@H](NC(=O)N[C@H](c2nc3ccccc3[nH]2)C2CCCCC2)C1	ZINC000875382219	GG	On-Demand	Anodyne	EPHX2	16	43
CCC(=O)N1CC[C@H](NC(=O)N[C@H](c2nc3ccccc3[nH]2)C2CCCCC2)C1	ZINC000875382219	GG	On-Demand	Anodyne	BIRC2	22	43
CCC(=O)N1CC[C@H](NC(=O)N[C@@H](c2nc3ccccc3[nH]2)C2CCCCC2)C1	ZINC000875382220	GG	On-Demand	Anodyne	EPHX2	16	43
CCC(=O)N1CC[C@H](NC(=O)N[C@@H](c2nc3ccccc3[nH]2)C2CCCCC2)C1	ZINC000875382220	GG	On-Demand	Anodyne	BIRC2	22	43
CCC(=O)N1CC[C@@H](NC(=O)N[C@@H](c2nc3ccccc3[nH]2)C2CCCCC2)C1	ZINC000875382222	GG	On-Demand	Anodyne	EPHX2	16	43
CCC(=O)N1CC[C@@H](NC(=O)N[C@@H](c2nc3ccccc3[nH]2)C2CCCCC2)C1	ZINC000875382222	GG	On-Demand	Anodyne	BIRC2	22	43
CCC(=O)N1CC[C@@H](NC(=O)N[C@H](c2nc3ccccc3[nH]2)C2CCCCC2)C1	ZINC000875382224	GG	On-Demand	Anodyne	EPHX2	16	43
CCC(=O)N1CC[C@@H](NC(=O)N[C@H](c2nc3ccccc3[nH]2)C2CCCCC2)C1	ZINC000875382224	GG	On-Demand	Anodyne	BIRC2	22	43
COC(=O)N(C)NC(=O)NCCCOc1ccc2ccccc2c1	ZINC000875382286	EF	On-Demand	Reactive	ALOX5	15	44
COC(=O)N(C)NC(=O)NCCCOc1ccc2ccccc2c1	ZINC000875382286	EF	On-Demand	Reactive	HRH2	26	41
COC(=O)N(C)NC(=O)NCCCOc1ccc2ccccc2c1	ZINC000875382286	EF	On-Demand	Reactive	MTNR1A	69	45
COC(=O)N(C)NC(=O)NCCCOc1ccc2ccccc2c1	ZINC000875382286	EF	On-Demand	Reactive	MTNR1B	52	45
CC(C)n1ncc(C(=O)Nc2cccc(Cl)n2)c1Cl	ZINC000875382287	CG	On-Demand	Anodyne	GRM5	17	42
CC(C)n1ncc(C(=O)Nc2cccc(Cl)n2)c1Cl	ZINC000875382287	CG	On-Demand	Anodyne	SORT1	19	41
CC(=O)C1CCN(C(=O)NC2[C@H](C)CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875382303	FG	On-Demand	Anodyne	DRD2	15	43
CC(=O)C1CCN(C(=O)NC2[C@H](C)CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875382303	FG	On-Demand	Anodyne	DRD4	47	43
CC(=O)C1CCN(C(=O)NC2[C@H](C)CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875382303	FG	On-Demand	Anodyne	ACHE	30	41
CC(=O)C1CCN(C(=O)NC2[C@H](C)CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875382303	FG	On-Demand	Anodyne	CHRM3	15	40
CC(=O)C1CCN(C(=O)NC2[C@H](C)CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875382303	FG	On-Demand	Anodyne	HRH3	15	44
CC(=O)C1CCN(C(=O)NC2[C@H](C)CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875382303	FG	On-Demand	Anodyne	SIGMAR1	48	47
CC(=O)C1CCN(C(=O)NC2[C@H](C)CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875382303	FG	On-Demand	Anodyne	CCR3	21	40
CC(=O)C1CCN(C(=O)NC2[C@H](C)CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875382303	FG	On-Demand	Anodyne	MLNR	54	38
CC(=O)C1CCN(C(=O)NC2[C@H](C)CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875382303	FG	On-Demand	Anodyne	EPHX2	23	42
CC(=O)C1CCN(C(=O)NC2[C@H](C)CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875382303	FG	On-Demand	Anodyne	BIRC2	18	40
CC(=O)C1CCN(C(=O)NC2[C@@H](C)CN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000875382306	FG	On-Demand	Anodyne	DRD2	15	43
CC(=O)C1CCN(C(=O)NC2[C@@H](C)CN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000875382306	FG	On-Demand	Anodyne	DRD4	47	43
CC(=O)C1CCN(C(=O)NC2[C@@H](C)CN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000875382306	FG	On-Demand	Anodyne	ACHE	30	41
CC(=O)C1CCN(C(=O)NC2[C@@H](C)CN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000875382306	FG	On-Demand	Anodyne	CHRM3	15	40
CC(=O)C1CCN(C(=O)NC2[C@@H](C)CN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000875382306	FG	On-Demand	Anodyne	HRH3	15	44
CC(=O)C1CCN(C(=O)NC2[C@@H](C)CN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000875382306	FG	On-Demand	Anodyne	SIGMAR1	48	47
CC(=O)C1CCN(C(=O)NC2[C@@H](C)CN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000875382306	FG	On-Demand	Anodyne	CCR3	21	40
CC(=O)C1CCN(C(=O)NC2[C@@H](C)CN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000875382306	FG	On-Demand	Anodyne	MLNR	54	38
CC(=O)C1CCN(C(=O)NC2[C@@H](C)CN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000875382306	FG	On-Demand	Anodyne	EPHX2	23	42
CC(=O)C1CCN(C(=O)NC2[C@@H](C)CN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000875382306	FG	On-Demand	Anodyne	BIRC2	18	40
CC(=O)C1CCN(C(=O)N[C@@H]2[C@@H](C)CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875382311	FG	On-Demand	Anodyne	DRD2	15	43
CC(=O)C1CCN(C(=O)N[C@@H]2[C@@H](C)CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875382311	FG	On-Demand	Anodyne	DRD4	47	43
CC(=O)C1CCN(C(=O)N[C@@H]2[C@@H](C)CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875382311	FG	On-Demand	Anodyne	ACHE	30	41
CC(=O)C1CCN(C(=O)N[C@@H]2[C@@H](C)CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875382311	FG	On-Demand	Anodyne	CHRM3	15	40
CC(=O)C1CCN(C(=O)N[C@@H]2[C@@H](C)CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875382311	FG	On-Demand	Anodyne	HRH3	15	44
CC(=O)C1CCN(C(=O)N[C@@H]2[C@@H](C)CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875382311	FG	On-Demand	Anodyne	SIGMAR1	48	47
CC(=O)C1CCN(C(=O)N[C@@H]2[C@@H](C)CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875382311	FG	On-Demand	Anodyne	CCR3	21	40
CC(=O)C1CCN(C(=O)N[C@@H]2[C@@H](C)CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875382311	FG	On-Demand	Anodyne	MLNR	54	38
CC(=O)C1CCN(C(=O)N[C@@H]2[C@@H](C)CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875382311	FG	On-Demand	Anodyne	EPHX2	23	42
CC(=O)C1CCN(C(=O)N[C@@H]2[C@@H](C)CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875382311	FG	On-Demand	Anodyne	BIRC2	18	40
CCC(=O)N1CC[C@@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875382341	EC	On-Demand	Anodyne	EPHX2	26	53
CCC(=O)N1CC[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)C1	ZINC000875382343	EC	On-Demand	Anodyne	EPHX2	26	53
O=C(NCCCOc1ccc2ccccc2c1)NC[C@H]1C[C@H](O)C1	ZINC000875382356	EF	On-Demand	Anodyne	HRH2	26	41
O=C(NCCCOc1ccc2ccccc2c1)NC[C@H]1C[C@H](O)C1	ZINC000875382356	EF	On-Demand	Anodyne	MTNR1A	34	41
O=C(NCCCOc1ccc2ccccc2c1)NC[C@H]1C[C@H](O)C1	ZINC000875382356	EF	On-Demand	Anodyne	MTNR1B	20	41
CC(=O)[C@H]1CCCN(C(=O)N[C@H](C)c2noc(-c3ccccc3)n2)C1	ZINC000875382364	EF	On-Demand	Anodyne	BMP1	45	35
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)c2noc(-c3ccccc3)n2)C1	ZINC000875382365	EF	On-Demand	Anodyne	BMP1	45	35
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)c2noc(-c3ccccc3)n2)C1	ZINC000875382366	EF	On-Demand	Anodyne	BMP1	45	35
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)c2noc(-c3ccccc3)n2)C1	ZINC000875382367	EF	On-Demand	Anodyne	BMP1	45	35
CC(=O)c1ccc(NC(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)cc1	ZINC000875382405	HI	On-Demand	Reactive	ADORA1	23	43
CC(=O)c1ccc(NC(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)cc1	ZINC000875382405	HI	On-Demand	Reactive	ADORA2A	32	43
CC(=O)c1ccc(NC(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)cc1	ZINC000875382405	HI	On-Demand	Reactive	ADORA2B	33	43
CC(=O)c1ccc(NC(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)cc1	ZINC000875382405	HI	On-Demand	Reactive	TACR3	15	53
CC(=O)c1ccc(NC(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)cc1	ZINC000875382405	HI	On-Demand	Reactive	MT-CO2	41	40
CCC(=O)N1CC[C@@H](NC(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)C1	ZINC000875382426	EE	On-Demand	Anodyne	EPHX2	31	49
CCC(=O)N1CC[C@H](NC(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)C1	ZINC000875382428	EE	On-Demand	Anodyne	EPHX2	31	49
O=C(NCc1ccn2ccnc2c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875382448	FF	On-Demand	Anodyne	PREP	29	43
O=C(NCc1ccn2ccnc2c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875382448	FF	On-Demand	Anodyne	TMPRSS11D	45	32
O=C(NCc1ccn2ccnc2c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875382450	FF	On-Demand	Anodyne	PREP	29	43
O=C(NCc1ccn2ccnc2c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875382450	FF	On-Demand	Anodyne	TMPRSS11D	45	32
O=C(NCc1ccn2ccnc2c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875382452	FF	On-Demand	Anodyne	PREP	29	43
O=C(NCc1ccn2ccnc2c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875382452	FF	On-Demand	Anodyne	TMPRSS11D	45	32
O=C(NCc1ccn2ccnc2c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875382454	FF	On-Demand	Anodyne	PREP	29	43
O=C(NCc1ccn2ccnc2c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875382454	FF	On-Demand	Anodyne	TMPRSS11D	45	32
O=C(NCCO)C1CCN(C(=O)N[C@H]2COc3ccc(Cl)cc32)CC1	ZINC000875382455	FD	On-Demand	Anodyne	EPHX2	18	46
O=C(NCCO)C1CCN(C(=O)N[C@@H]2COc3ccc(Cl)cc32)CC1	ZINC000875382457	FD	On-Demand	Anodyne	EPHX2	18	46
CC(C)n1ncc(C(=O)Nc2cccc(Cl)n2)c1Br	ZINC000875382470	EH	On-Demand	Anodyne	GRM5	15	41
C=C(C)COCCNC(=O)N(CC)[C@@H](C)[C@@H](O)c1ccccc1	ZINC000875382486	DF	On-Demand	Mild	NPY5R	22	40
C=C(C)COCCNC(=O)N(CC)[C@H](C)[C@@H](O)c1ccccc1	ZINC000875382488	DF	On-Demand	Mild	NPY5R	22	40
C=C(C)COCCNC(=O)N(CC)[C@@H](C)[C@H](O)c1ccccc1	ZINC000875382490	DF	On-Demand	Mild	NPY5R	22	40
C=C(C)COCCNC(=O)N(CC)[C@H](C)[C@H](O)c1ccccc1	ZINC000875382491	DF	On-Demand	Mild	NPY5R	22	40
CONC(=O)C1CCN(C(=O)NCc2ccn3ccnc3c2)CC1	ZINC000875382492	EC	On-Demand	Anodyne	EPHX2	17	41
CCC(=O)N1CC[C@H](NC(=O)NCCN2CCOC[C@@H]2CC)C1	ZINC000875382504	EC	On-Demand	Anodyne	EPHX2	15	47
CCC(=O)N1CC[C@@H](NC(=O)NCCN2CCOC[C@@H]2CC)C1	ZINC000875382506	EC	On-Demand	Anodyne	EPHX2	15	47
CCC(=O)N1CC[C@H](NC(=O)NCCN2CCOC[C@H]2CC)C1	ZINC000875382507	EC	On-Demand	Anodyne	EPHX2	15	47
CCC(=O)N1CC[C@@H](NC(=O)NCCN2CCOC[C@H]2CC)C1	ZINC000875382509	EC	On-Demand	Anodyne	EPHX2	15	47
CCc1nncn1CCNC(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875382512	FF	On-Demand	Anodyne	DRD4	43	32
CCC(=O)N1CC[C@H](NC(=O)N2CC(CNC(=O)C(F)(F)F)C2)C1	ZINC000875382513	FC	On-Demand	Anodyne	EPHX2	16	40
CCC(=O)N1CC[C@@H](NC(=O)N2CC(CNC(=O)C(F)(F)F)C2)C1	ZINC000875382515	FC	On-Demand	Anodyne	EPHX2	16	40
C[C@H]1CC(=O)N[C@@H](C(=O)Nc2cc(Cl)c(Cl)cn2)C1	ZINC000875382531	DE	On-Demand	Anodyne	TYK2	53	35
O=C(N[C@@H]1CCN(C(=O)C2CCCC2)C1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875382547	FF	On-Demand	Anodyne	EPHX2	25	41
O=C(N[C@H]1CCN(C(=O)C2CCCC2)C1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875382549	FF	On-Demand	Anodyne	EPHX2	25	41
CCC(=O)N1CC[C@H](NC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875382552	CC	On-Demand	Anodyne	EPHX2	21	46
CCC(=O)N1CC[C@@H](NC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875382553	CC	On-Demand	Anodyne	EPHX2	21	46
CCC(=O)N1CC[C@H](NC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875382555	CC	On-Demand	Anodyne	EPHX2	21	46
CC(=O)C1CCN(C(=O)NCCCOc2ccc3ccccc3c2)CC1	ZINC000875382556	FH	On-Demand	Anodyne	HRH2	39	40
CC(=O)C1CCN(C(=O)NCCCOc2ccc3ccccc3c2)CC1	ZINC000875382556	FH	On-Demand	Anodyne	HRH3	28	44
CC(=O)C1CCN(C(=O)NCCCOc2ccc3ccccc3c2)CC1	ZINC000875382556	FH	On-Demand	Anodyne	MTNR1A	48	45
CC(=O)C1CCN(C(=O)NCCCOc2ccc3ccccc3c2)CC1	ZINC000875382556	FH	On-Demand	Anodyne	MTNR1B	37	45
CCC(=O)N1CC[C@@H](NC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875382557	CC	On-Demand	Anodyne	EPHX2	21	46
O=C(N[C@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCc2ccn3ccnc3c2)C1	ZINC000875382578	GD	On-Demand	Anodyne	EPHX2	15	40
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCc2ccn3ccnc3c2)C1	ZINC000875382579	GD	On-Demand	Anodyne	EPHX2	15	40
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCc2ccn3ccnc3c2)C1	ZINC000875382581	GD	On-Demand	Anodyne	EPHX2	15	40
O=C(N[C@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCc2ccn3ccnc3c2)C1	ZINC000875382583	GD	On-Demand	Anodyne	EPHX2	15	40
C[C@@H](NC(=O)N1CC[C@@H](O)[C@H]1c1ccc(Br)cc1)C1CCOCC1	ZINC000875382607	GG	On-Demand	Anodyne	PRCP	19	41
Cn1ccnc(NC(=O)[C@@H]2CCCC[C@H]2c2cccc(Cl)c2)c1=O	ZINC000875382612	EG	On-Demand	Anodyne	MDM2	49	33
COC(=O)C1(O)CN(C(=O)NC2[C@@H](C)CN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875382618	GD	On-Demand	Anodyne	DRD4	22	45
COC(=O)C1(O)CN(C(=O)NC2[C@H](C)CN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875382619	GD	On-Demand	Anodyne	DRD4	22	45
COC(=O)C1(O)CN(C(=O)N[C@@H]2[C@@H](C)CN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875382620	GD	On-Demand	Anodyne	DRD4	22	45
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875382660	EE	On-Demand	Anodyne	DRD4	23	41
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875382660	EE	On-Demand	Anodyne	PDE8B	43	32
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875382661	EE	On-Demand	Anodyne	DRD4	23	41
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875382661	EE	On-Demand	Anodyne	PDE8B	43	32
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875382662	EE	On-Demand	Anodyne	DRD4	23	41
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875382662	EE	On-Demand	Anodyne	PDE8B	43	32
C[S@](=O)C1(CNC(=O)C(=O)N2CCN(c3ccc(F)cc3F)CC2)CC1	ZINC000875382690	GC	On-Demand	Anodyne	NPY2R	48	36
CCC(=O)N1CC[C@H](NC(=O)NC2([C@@H]3CCCCO3)CCC2)C1	ZINC000875382731	DD	On-Demand	Anodyne	EPHX2	19	48
CCC(=O)N1CC[C@@H](NC(=O)NC2([C@@H]3CCCCO3)CCC2)C1	ZINC000875382732	DD	On-Demand	Anodyne	EPHX2	19	48
CCC(=O)N1CC[C@H](NC(=O)NC2([C@H]3CCCCO3)CCC2)C1	ZINC000875382733	DD	On-Demand	Anodyne	EPHX2	19	48
CCC(=O)N1CC[C@@H](NC(=O)NC2([C@H]3CCCCO3)CCC2)C1	ZINC000875382734	DD	On-Demand	Anodyne	EPHX2	19	48
CCC(=O)N1CC[C@H](NC(=O)N2CCC3(CCN(C)CC3)CC2)C1	ZINC000875382736	ED	On-Demand	Anodyne	EPHX2	16	44
CCC(=O)N1CC[C@@H](NC(=O)N2CCC3(CCN(C)CC3)CC2)C1	ZINC000875382737	ED	On-Demand	Anodyne	EPHX2	16	44
O=C(C1CCCC1)N1CC[C@H](NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)C1	ZINC000875382742	GF	On-Demand	Anodyne	SFRP1	51	35
O=C(C1CCCC1)N1CC[C@H](NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)C1	ZINC000875382742	GF	On-Demand	Anodyne	WNT3	52	35
O=C(C1CCCC1)N1CC[C@H](NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)C1	ZINC000875382743	GF	On-Demand	Anodyne	SFRP1	51	35
O=C(C1CCCC1)N1CC[C@H](NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)C1	ZINC000875382743	GF	On-Demand	Anodyne	WNT3	52	35
O=C(C1CCCC1)N1CC[C@H](NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)C1	ZINC000875382744	GF	On-Demand	Anodyne	SFRP1	51	35
O=C(C1CCCC1)N1CC[C@H](NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)C1	ZINC000875382744	GF	On-Demand	Anodyne	WNT3	52	35
O=C(C1CCCC1)N1CC[C@H](NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)C1	ZINC000875382745	GF	On-Demand	Anodyne	SFRP1	51	35
O=C(C1CCCC1)N1CC[C@H](NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)C1	ZINC000875382745	GF	On-Demand	Anodyne	WNT3	52	35
CCC(=O)N1CC[C@H](NC(=O)N[C@@]23CCC[C@@H]2N(C(=O)OC(C)(C)C)CC3)C1	ZINC000875382746	GE	On-Demand	Anodyne	EPHX2	19	41
CCC(=O)N1CC[C@H](NC(=O)N[C@]23CCC[C@@H]2N(C(=O)OC(C)(C)C)CC3)C1	ZINC000875382747	GE	On-Demand	Anodyne	EPHX2	19	41
CCC(=O)N1CC[C@H](NC(=O)N[C@@]23CCC[C@H]2N(C(=O)OC(C)(C)C)CC3)C1	ZINC000875382748	GE	On-Demand	Anodyne	EPHX2	19	41
CCC(=O)N1CC[C@H](NC(=O)N[C@]23CCC[C@H]2N(C(=O)OC(C)(C)C)CC3)C1	ZINC000875382749	GE	On-Demand	Anodyne	EPHX2	19	41
O=C(Nc1cccc(Cl)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875382755	DG	On-Demand	Anodyne	DRD2	22	46
O=C(Nc1cccc(Cl)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875382755	DG	On-Demand	Anodyne	DRD4	61	46
O=C(Nc1cccc(Cl)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875382755	DG	On-Demand	Anodyne	ACHE	51	42
O=C(Nc1cccc(Cl)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875382755	DG	On-Demand	Anodyne	SLC6A1	48	33
O=C(Nc1cccc(Cl)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875382755	DG	On-Demand	Anodyne	HRH1	15	41
O=C(Nc1cccc(Cl)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875382755	DG	On-Demand	Anodyne	DRD3	21	46
O=C(Nc1cccc(Cl)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875382755	DG	On-Demand	Anodyne	LTA4H	19	46
O=C(Nc1cccc(Cl)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875382755	DG	On-Demand	Anodyne	SIGMAR1	56	59
O=C(Nc1cccc(Cl)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875382755	DG	On-Demand	Anodyne	CCR3	49	39
O=C(Nc1cccc(Cl)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875382755	DG	On-Demand	Anodyne	SLC18A3	20	43
O=C(Nc1cccc(Cl)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875382755	DG	On-Demand	Anodyne	S1PR1	16	41
O=C(Nc1cccc(Cl)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875382755	DG	On-Demand	Anodyne	MCHR1	25	45
O=C(Nc1cccc(Cl)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875382755	DG	On-Demand	Anodyne	CACNA1G	45	44
O=C(Nc1cccc(Cl)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875382756	DG	On-Demand	Anodyne	DRD2	22	46
O=C(Nc1cccc(Cl)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875382756	DG	On-Demand	Anodyne	DRD4	61	46
O=C(Nc1cccc(Cl)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875382756	DG	On-Demand	Anodyne	ACHE	51	42
O=C(Nc1cccc(Cl)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875382756	DG	On-Demand	Anodyne	SLC6A1	48	33
O=C(Nc1cccc(Cl)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875382756	DG	On-Demand	Anodyne	HRH1	15	41
O=C(Nc1cccc(Cl)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875382756	DG	On-Demand	Anodyne	DRD3	21	46
O=C(Nc1cccc(Cl)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875382756	DG	On-Demand	Anodyne	LTA4H	19	46
O=C(Nc1cccc(Cl)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875382756	DG	On-Demand	Anodyne	SIGMAR1	56	59
O=C(Nc1cccc(Cl)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875382756	DG	On-Demand	Anodyne	CCR3	49	39
O=C(Nc1cccc(Cl)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875382756	DG	On-Demand	Anodyne	SLC18A3	20	43
O=C(Nc1cccc(Cl)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875382756	DG	On-Demand	Anodyne	S1PR1	16	41
O=C(Nc1cccc(Cl)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875382756	DG	On-Demand	Anodyne	MCHR1	25	45
O=C(Nc1cccc(Cl)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875382756	DG	On-Demand	Anodyne	CACNA1G	45	44
O=C(Nc1cccc(Cl)n1)C1C[C@@H]2CCCC[C@H](C1)C2=O	ZINC000875382760	DG	On-Demand	Anodyne	TYK2	48	38
CCC(=O)N1CC[C@@H](NC(=O)N2CCC[C@H](c3ccccc3OC)CC2)C1	ZINC000875382781	FF	On-Demand	Anodyne	DRD2	16	45
CCC(=O)N1CC[C@@H](NC(=O)N2CCC[C@H](c3ccccc3OC)CC2)C1	ZINC000875382781	FF	On-Demand	Anodyne	EPHX2	26	44
CCC(=O)N1CC[C@@H](NC(=O)N2CCC[C@@H](c3ccccc3OC)CC2)C1	ZINC000875382783	FF	On-Demand	Anodyne	DRD2	16	45
CCC(=O)N1CC[C@@H](NC(=O)N2CCC[C@@H](c3ccccc3OC)CC2)C1	ZINC000875382783	FF	On-Demand	Anodyne	EPHX2	26	44
CCC(=O)N1CC[C@H](NC(=O)N2CCC[C@H](c3ccccc3OC)CC2)C1	ZINC000875382784	FF	On-Demand	Anodyne	DRD2	16	45
CCC(=O)N1CC[C@H](NC(=O)N2CCC[C@H](c3ccccc3OC)CC2)C1	ZINC000875382784	FF	On-Demand	Anodyne	EPHX2	26	44
CCC(=O)N1CC[C@H](NC(=O)N2CCC[C@@H](c3ccccc3OC)CC2)C1	ZINC000875382785	FF	On-Demand	Anodyne	DRD2	16	45
CCC(=O)N1CC[C@H](NC(=O)N2CCC[C@@H](c3ccccc3OC)CC2)C1	ZINC000875382785	FF	On-Demand	Anodyne	EPHX2	26	44
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1COc2ccc(Cl)cc21	ZINC000875382799	GF	On-Demand	Anodyne	CACNA1I	41	32
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1COc2ccc(Cl)cc21	ZINC000875382800	GF	On-Demand	Anodyne	CACNA1I	41	32
CCC(=O)N1CC[C@@H](NC(=O)N[C@@](C)(CO)Cc2ccc(Cl)cc2)C1	ZINC000875382803	FD	On-Demand	Anodyne	EPHX2	26	53
CCC(=O)N1CC[C@H](NC(=O)N[C@@](C)(CO)Cc2ccc(Cl)cc2)C1	ZINC000875382805	FD	On-Demand	Anodyne	EPHX2	26	53
CCC(=O)N1CC[C@@H](NC(=O)N[C@](C)(CO)Cc2ccc(Cl)cc2)C1	ZINC000875382807	FD	On-Demand	Anodyne	EPHX2	26	53
CCC(=O)N1CC[C@H](NC(=O)N[C@](C)(CO)Cc2ccc(Cl)cc2)C1	ZINC000875382809	FD	On-Demand	Anodyne	EPHX2	26	53
O=C(Nc1cc(Cl)c(Cl)cn1)C12CC(C1)C2	ZINC000875382820	CG	On-Demand	Anodyne	TYK2	41	32
CCC(=O)N1CC[C@@H](NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000875382826	FD	On-Demand	Anodyne	EPHX2	35	57
CCC(=O)N1CC[C@H](NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000875382828	FD	On-Demand	Anodyne	EPHX2	35	57
CCC(=O)N1CC[C@@H](NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000875382830	FD	On-Demand	Anodyne	EPHX2	35	57
CCC(=O)N1CC[C@H](NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000875382832	FD	On-Demand	Anodyne	EPHX2	35	57
CCC(=O)N1CC[C@H](NC(=O)NNc2ccc(OC)cc2Br)C1	ZINC000875382836	GE	On-Demand	Reactive	MTNR1A	17	40
CCC(=O)N1CC[C@H](NC(=O)NNc2ccc(OC)cc2Br)C1	ZINC000875382836	GE	On-Demand	Reactive	MTNR1B	16	41
CCC(=O)N1CC[C@H](NC(=O)NNc2ccc(OC)cc2Br)C1	ZINC000875382836	GE	On-Demand	Reactive	EPHX2	29	54
O=C(Nc1cc(Cl)c(Cl)cn1)[C@H]1OCCO[C@H]1C(F)(F)F	ZINC000875382837	EF	On-Demand	Anodyne	TYK2	46	31
CCC(=O)N1CC[C@@H](NC(=O)NNc2ccc(OC)cc2Br)C1	ZINC000875382838	GE	On-Demand	Reactive	MTNR1A	17	40
CCC(=O)N1CC[C@@H](NC(=O)NNc2ccc(OC)cc2Br)C1	ZINC000875382838	GE	On-Demand	Reactive	MTNR1B	16	41
CCC(=O)N1CC[C@@H](NC(=O)NNc2ccc(OC)cc2Br)C1	ZINC000875382838	GE	On-Demand	Reactive	EPHX2	29	54
CCC(=O)N1CC[C@H](NC(=O)N[C@@H](CC)C[C@H](C)O)C1	ZINC000875382859	CC	On-Demand	Anodyne	EPHX2	21	48
CCC(=O)N1CC[C@H](NC(=O)N[C@H](CC)C[C@H](C)O)C1	ZINC000875382861	CC	On-Demand	Anodyne	EPHX2	21	48
CCC(=O)N1CC[C@H](NC(=O)N[C@H](CC)C[C@@H](C)O)C1	ZINC000875382863	CC	On-Demand	Anodyne	EPHX2	21	48
CCC(=O)N1CC[C@H](NC(=O)N[C@@H](CC)C[C@@H](C)O)C1	ZINC000875382864	CC	On-Demand	Anodyne	EPHX2	21	48
O=C(Nc1cc(Cl)c(Cl)cn1)c1ccnc(N2CCOCC2)n1	ZINC000875382881	FE	On-Demand	Anodyne	PIK3CA	36	44
O=C(Nc1cc(Cl)c(Cl)cn1)c1ccnc(N2CCOCC2)n1	ZINC000875382881	FE	On-Demand	Anodyne	MTOR	27	42
O=C(Nc1cc(Cl)c(Cl)cn1)c1ccnc(N2CCOCC2)n1	ZINC000875382881	FE	On-Demand	Anodyne	PIK3CG	27	40
O=C(Nc1cc(Cl)c(Cl)cn1)c1ccnc(N2CCOCC2)n1	ZINC000875382881	FE	On-Demand	Anodyne	TYK2	44	32
O=C(N[C@@H]1CCC[C@@H]2OCC[C@H]21)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875382920	EF	On-Demand	Anodyne	EPHX2	27	46
O=C(N[C@@H]1CCC[C@@H]2OCC[C@@H]21)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875382921	EF	On-Demand	Anodyne	EPHX2	27	46
O=C(N[C@@H]1CCC[C@@H]2OCC[C@H]21)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875382922	EF	On-Demand	Anodyne	EPHX2	27	46
O=C(N[C@@H]1CCC[C@@H]2OCC[C@@H]21)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875382923	EF	On-Demand	Anodyne	EPHX2	27	46
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](c1cccc(Cl)c1)c1ccccn1	ZINC000875382944	FH	On-Demand	Anodyne	PDS	28	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](c1cccc(Cl)c1)c1ccccn1	ZINC000875382947	FH	On-Demand	Anodyne	PDS	28	40
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCC[C@H]4OCC[C@H]34)cn2)cc1	ZINC000875382956	FF	On-Demand	Mild	ITK	15	45
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCC[C@H]4OCC[C@H]34)cn2)cc1	ZINC000875382956	FF	On-Demand	Mild	PANC	41	34
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCC[C@H]4OCC[C@@H]34)cn2)cc1	ZINC000875382957	FF	On-Demand	Mild	ITK	15	45
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCC[C@H]4OCC[C@@H]34)cn2)cc1	ZINC000875382957	FF	On-Demand	Mild	PANC	41	34
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCC[C@@H]4OCC[C@H]43)cn2)cc1	ZINC000875382958	FF	On-Demand	Mild	ITK	15	45
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCC[C@@H]4OCC[C@H]43)cn2)cc1	ZINC000875382958	FF	On-Demand	Mild	PANC	41	34
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCC[C@@H]4OCC[C@@H]43)cn2)cc1	ZINC000875382959	FF	On-Demand	Mild	ITK	15	45
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCC[C@@H]4OCC[C@@H]43)cn2)cc1	ZINC000875382959	FF	On-Demand	Mild	PANC	41	34
COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)Nc1nccs1)c(=O)n2Cc1ccccc1	ZINC000875382969	JC	On-Demand	Reactive	MAP1	81	38
CCC(=O)N1CC[C@H](NC(=O)N(Cc2ccccc2)[C@H](CC)CO)C1	ZINC000875383014	ED	On-Demand	Anodyne	EPHX2	18	46
CCC(=O)N1CC[C@H](NC(=O)N(Cc2ccccc2)[C@H](CC)CO)C1	ZINC000875383014	ED	On-Demand	Anodyne	BIRC2	18	42
CCC(=O)N1CC[C@@H](NC(=O)N(Cc2ccccc2)[C@H](CC)CO)C1	ZINC000875383016	ED	On-Demand	Anodyne	EPHX2	18	46
CCC(=O)N1CC[C@@H](NC(=O)N(Cc2ccccc2)[C@H](CC)CO)C1	ZINC000875383016	ED	On-Demand	Anodyne	BIRC2	18	42
O=C(C1CCCC1)N1CC[C@H](NC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)C1	ZINC000875383025	GG	On-Demand	Anodyne	WNT3	40	34
O=C(C1CCCC1)N1CC[C@H](NC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)C1	ZINC000875383026	GG	On-Demand	Anodyne	WNT3	40	34
O=C(C1CCCC1)N1CC[C@H](NC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)C1	ZINC000875383027	GG	On-Demand	Anodyne	WNT3	40	34
O=C(C1CCCC1)N1CC[C@H](NC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)C1	ZINC000875383028	GG	On-Demand	Anodyne	WNT3	40	34
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)N[C@@H]1CCN(C(=O)C2CCCC2)C1	ZINC000875383050	GE	On-Demand	Anodyne	EPHX2	31	43
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)N[C@@H]1CCN(C(=O)C2CCCC2)C1	ZINC000875383050	GE	On-Demand	Anodyne	DPP7	19	40
O=C(NC[C@H](O)Cc1cccc(Cl)c1)N[C@@H]1CCN(C(=O)C2CCCC2)C1	ZINC000875383051	GE	On-Demand	Anodyne	EPHX2	31	43
O=C(NC[C@H](O)Cc1cccc(Cl)c1)N[C@@H]1CCN(C(=O)C2CCCC2)C1	ZINC000875383051	GE	On-Demand	Anodyne	DPP7	19	40
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)N[C@H]1CCN(C(=O)C2CCCC2)C1	ZINC000875383052	GE	On-Demand	Anodyne	EPHX2	31	43
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)N[C@H]1CCN(C(=O)C2CCCC2)C1	ZINC000875383052	GE	On-Demand	Anodyne	DPP7	19	40
O=C(NC[C@H](O)Cc1cccc(Cl)c1)N[C@H]1CCN(C(=O)C2CCCC2)C1	ZINC000875383053	GE	On-Demand	Anodyne	EPHX2	31	43
O=C(NC[C@H](O)Cc1cccc(Cl)c1)N[C@H]1CCN(C(=O)C2CCCC2)C1	ZINC000875383053	GE	On-Demand	Anodyne	DPP7	19	40
CCC(=O)N1CC[C@@H](NC(=O)N2C[C@@H]3C[C@H]2CN3c2ccccc2)C1	ZINC000875383056	ED	On-Demand	Anodyne	EPHX2	20	45
CCC(=O)N1CC[C@H](NC(=O)N2C[C@@H]3C[C@H]2CN3c2ccccc2)C1	ZINC000875383058	ED	On-Demand	Anodyne	EPHX2	20	45
O=C(NCCCOc1ccc2ccccc2c1)N1CCC(CO)(CO)CC1	ZINC000875383062	FE	On-Demand	Anodyne	HRH2	28	42
CCC(=O)N1CC[C@@H](NC(=O)NC[C@H]2CN(Cc3ccccc3C)CCO2)C1	ZINC000875383065	GD	On-Demand	Anodyne	EPHX2	16	40
CCC(=O)N1CC[C@@H](NC(=O)NC[C@H]2CN(Cc3ccccc3C)CCO2)C1	ZINC000875383065	GD	On-Demand	Anodyne	CCR8	48	38
CCC(=O)N1CC[C@H](NC(=O)NC[C@H]2CN(Cc3ccccc3C)CCO2)C1	ZINC000875383067	GD	On-Demand	Anodyne	EPHX2	16	40
CCC(=O)N1CC[C@H](NC(=O)NC[C@H]2CN(Cc3ccccc3C)CCO2)C1	ZINC000875383067	GD	On-Demand	Anodyne	CCR8	48	38
CCC(=O)N1CC[C@H](NC(=O)NC[C@@H]2CN(Cc3ccccc3C)CCO2)C1	ZINC000875383069	GD	On-Demand	Anodyne	EPHX2	16	40
CCC(=O)N1CC[C@H](NC(=O)NC[C@@H]2CN(Cc3ccccc3C)CCO2)C1	ZINC000875383069	GD	On-Demand	Anodyne	CCR8	48	38
CC(=O)c1ccc(NC(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	ZINC000875383074	EF	On-Demand	Reactive	F10	25	42
CC(=O)c1ccc(NC(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	ZINC000875383074	EF	On-Demand	Reactive	KCNMA1	28	49
CC(=O)c1ccc(NC(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	ZINC000875383074	EF	On-Demand	Reactive	CA9	15	53
CC(=O)c1ccc(NC(=O)NNC(=O)c2cc(Cl)ccc2O)cc1	ZINC000875383074	EF	On-Demand	Reactive	IMDH_CRYPV	17	42
CCC(=O)N1CC[C@@H](NC(=O)NC[C@@H]2CN(Cc3ccccc3C)CCO2)C1	ZINC000875383076	GD	On-Demand	Anodyne	EPHX2	16	40
CCC(=O)N1CC[C@@H](NC(=O)NC[C@@H]2CN(Cc3ccccc3C)CCO2)C1	ZINC000875383076	GD	On-Demand	Anodyne	CCR8	48	38
CCC(=O)N1CC[C@H](NC(=O)N[C@@H]2C[C@H]3C[C@@]3(C(=O)OC)C2)C1	ZINC000875383078	DC	On-Demand	Anodyne	EPHX2	24	49
CCC(=O)N1CC[C@@H](NC(=O)N[C@@H]2C[C@H]3C[C@@]3(C(=O)OC)C2)C1	ZINC000875383080	DC	On-Demand	Anodyne	EPHX2	24	49
CCC(=O)N1CC[C@@H](NC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875383088	DD	On-Demand	Clean	EPHX2	23	43
CCC(=O)N1CC[C@H](NC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875383089	DD	On-Demand	Clean	EPHX2	23	43
CCC(=O)N1CC[C@H](NC(=O)N2CCCCC[C@@H](NC(=O)OC(C)(C)C)C2)C1	ZINC000875383094	GE	On-Demand	Anodyne	EPHX2	17	50
CCC(=O)N1CC[C@H](NC(=O)N2CCCCC[C@H](NC(=O)OC(C)(C)C)C2)C1	ZINC000875383095	GE	On-Demand	Anodyne	EPHX2	17	50
CCC(=O)N1CC[C@@H](NC(=O)N2CCCCC[C@@H](NC(=O)OC(C)(C)C)C2)C1	ZINC000875383097	GE	On-Demand	Anodyne	EPHX2	17	50
CCC(=O)N1CC[C@@H](NC(=O)N2CCCCC[C@H](NC(=O)OC(C)(C)C)C2)C1	ZINC000875383099	GE	On-Demand	Anodyne	EPHX2	17	50
CCC(=O)N1CC[C@@H](NC(=O)NNc2cccc(C)n2)C1	ZINC000875383101	CD	On-Demand	Reactive	EPHX2	27	48
Cn1ccnc(NC(=O)c2noc3c2CC(C)(C)CC3)c1=O	ZINC000875383102	DD	On-Demand	Anodyne	PANC	48	30
CCC(=O)N1CC[C@H](NC(=O)NNc2cccc(C)n2)C1	ZINC000875383103	CD	On-Demand	Reactive	EPHX2	27	48
O=C(Nc1cccc(Cl)n1)c1cc(C2CC2)[nH]c1C1CC1	ZINC000875383119	DI	On-Demand	Anodyne	SORT1	23	40
O=C(NCCCOc1ccc2ccccc2c1)NCCC[C@H]1CCOC1=O	ZINC000875383131	FG	On-Demand	Anodyne	CXCR4	57	36
O=C(NCCCOc1ccc2ccccc2c1)NCCC[C@H]1CCOC1=O	ZINC000875383131	FG	On-Demand	Anodyne	MTNR1A	29	42
O=C(NCCCOc1ccc2ccccc2c1)NCCC[C@H]1CCOC1=O	ZINC000875383131	FG	On-Demand	Anodyne	MTNR1B	17	42
O=C(NCCCOc1ccc2ccccc2c1)NCCC[C@H]1CCOC1=O	ZINC000875383131	FG	On-Demand	Anodyne	LUXR	29	43
O=C(NCCCOc1ccc2ccccc2c1)NCCC[C@H]1CCOC1=O	ZINC000875383131	FG	On-Demand	Anodyne	TRAR	44	35
O=C(NCCCOc1ccc2ccccc2c1)NCCC[C@@H]1CCOC1=O	ZINC000875383133	FG	On-Demand	Anodyne	CXCR4	57	36
O=C(NCCCOc1ccc2ccccc2c1)NCCC[C@@H]1CCOC1=O	ZINC000875383133	FG	On-Demand	Anodyne	MTNR1A	29	42
O=C(NCCCOc1ccc2ccccc2c1)NCCC[C@@H]1CCOC1=O	ZINC000875383133	FG	On-Demand	Anodyne	MTNR1B	17	42
O=C(NCCCOc1ccc2ccccc2c1)NCCC[C@@H]1CCOC1=O	ZINC000875383133	FG	On-Demand	Anodyne	LUXR	29	43
O=C(NCCCOc1ccc2ccccc2c1)NCCC[C@@H]1CCOC1=O	ZINC000875383133	FG	On-Demand	Anodyne	TRAR	44	35
CN1CCC(CNC(=O)NCc2ccn3ccnc3c2)(c2ccccc2)CC1	ZINC000875383134	GF	On-Demand	Anodyne	SOAT1	15	40
O=C(Nc1cc(Cl)c(Cl)cn1)c1ccnn1CC1CCC1	ZINC000875383139	EH	On-Demand	Anodyne	TYK2	45	33
CCCCCCCNC(=O)C(=O)NCc1ncnn1C(C)(C)C	ZINC000875383141	DD	On-Demand	Mild	ASAH1	92	35
CCC(=O)N1CC[C@H](NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)C1	ZINC000875383147	ED	On-Demand	Anodyne	EPHX2	17	43
CCC(=O)N1CC[C@H](NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)C1	ZINC000875383147	ED	On-Demand	Anodyne	BIRC2	26	40
CCC(=O)N1CC[C@H](NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)C1	ZINC000875383148	ED	On-Demand	Anodyne	EPHX2	17	43
CCC(=O)N1CC[C@H](NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)C1	ZINC000875383148	ED	On-Demand	Anodyne	BIRC2	26	40
CCC(=O)N1CC[C@H](NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)C1	ZINC000875383149	ED	On-Demand	Anodyne	EPHX2	17	43
CCC(=O)N1CC[C@H](NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)C1	ZINC000875383149	ED	On-Demand	Anodyne	BIRC2	26	40
CCC(=O)N1CC[C@H](NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)C1	ZINC000875383150	ED	On-Demand	Anodyne	EPHX2	17	43
CCC(=O)N1CC[C@H](NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)C1	ZINC000875383150	ED	On-Demand	Anodyne	BIRC2	26	40
COc1ccc(N2CCN(C(=O)NCc3ccn4ccnc4c3)CC2)c(OC)c1	ZINC000875383152	GE	On-Demand	Clean	PDGFRB	56	40
CCC(=O)N1CC[C@H](NC(=O)N[C@H](CC)[C@@H](O)c2ccccc2)C1	ZINC000875383154	ED	On-Demand	Anodyne	EPHX2	31	51
CCC(=O)N1CC[C@H](NC(=O)N[C@H](CC)[C@@H](O)c2ccccc2)C1	ZINC000875383154	ED	On-Demand	Anodyne	XIAP	55	42
CCC(=O)N1CC[C@H](NC(=O)N[C@H](CC)[C@@H](O)c2ccccc2)C1	ZINC000875383154	ED	On-Demand	Anodyne	BIRC2	37	41
CCC(=O)N1CC[C@H](NC(=O)N[C@H](CC)[C@@H](O)c2ccccc2)C1	ZINC000875383154	ED	On-Demand	Anodyne	BIRC8	47	36
CCC(=O)N1CC[C@H](NC(=O)N[C@@H](CC)[C@H](O)c2ccccc2)C1	ZINC000875383156	ED	On-Demand	Anodyne	EPHX2	31	51
CCC(=O)N1CC[C@H](NC(=O)N[C@@H](CC)[C@H](O)c2ccccc2)C1	ZINC000875383156	ED	On-Demand	Anodyne	XIAP	55	42
CCC(=O)N1CC[C@H](NC(=O)N[C@@H](CC)[C@H](O)c2ccccc2)C1	ZINC000875383156	ED	On-Demand	Anodyne	BIRC2	37	41
CCC(=O)N1CC[C@H](NC(=O)N[C@@H](CC)[C@H](O)c2ccccc2)C1	ZINC000875383156	ED	On-Demand	Anodyne	BIRC8	47	36
CCC(=O)N1CC[C@H](NC(=O)N[C@H](CC)[C@H](O)c2ccccc2)C1	ZINC000875383157	ED	On-Demand	Anodyne	EPHX2	31	51
CCC(=O)N1CC[C@H](NC(=O)N[C@H](CC)[C@H](O)c2ccccc2)C1	ZINC000875383157	ED	On-Demand	Anodyne	XIAP	55	42
CCC(=O)N1CC[C@H](NC(=O)N[C@H](CC)[C@H](O)c2ccccc2)C1	ZINC000875383157	ED	On-Demand	Anodyne	BIRC2	37	41
CCC(=O)N1CC[C@H](NC(=O)N[C@H](CC)[C@H](O)c2ccccc2)C1	ZINC000875383157	ED	On-Demand	Anodyne	BIRC8	47	36
CCC(=O)N1CC[C@H](NC(=O)N[C@@H](CC)[C@@H](O)c2ccccc2)C1	ZINC000875383158	ED	On-Demand	Anodyne	EPHX2	31	51
CCC(=O)N1CC[C@H](NC(=O)N[C@@H](CC)[C@@H](O)c2ccccc2)C1	ZINC000875383158	ED	On-Demand	Anodyne	XIAP	55	42
CCC(=O)N1CC[C@H](NC(=O)N[C@@H](CC)[C@@H](O)c2ccccc2)C1	ZINC000875383158	ED	On-Demand	Anodyne	BIRC2	37	41
CCC(=O)N1CC[C@H](NC(=O)N[C@@H](CC)[C@@H](O)c2ccccc2)C1	ZINC000875383158	ED	On-Demand	Anodyne	BIRC8	47	36
O=C(Nc1cc(Cl)c(Cl)cn1)[C@@H]1C[C@H]1C1CCOCC1	ZINC000875383241	DG	On-Demand	Anodyne	TYK2	61	35
CCC(=O)N1CC[C@H](NC(=O)N2CC[C@H](C(F)(F)F)O[C@H](C)C2)C1	ZINC000875383266	FD	On-Demand	Anodyne	EPHX2	18	41
CCC(=O)N1CC[C@H](NC(=O)N2CC[C@H](C(F)(F)F)O[C@@H](C)C2)C1	ZINC000875383267	FD	On-Demand	Anodyne	EPHX2	18	41
CCC(=O)N1CC[C@H](NC(=O)N2CC[C@@H](C(F)(F)F)O[C@@H](C)C2)C1	ZINC000875383268	FD	On-Demand	Anodyne	EPHX2	18	41
CCC(=O)N1CC[C@H](NC(=O)N2CC[C@@H](C(F)(F)F)O[C@H](C)C2)C1	ZINC000875383269	FD	On-Demand	Anodyne	EPHX2	18	41
CCC(=O)N1CC[C@@H](NC(=O)NC2CC(C(=O)OC)C2)C1	ZINC000875383275	CC	On-Demand	Anodyne	EPHX2	33	57
CCC(=O)N1CC[C@H](NC(=O)NC2CC(C(=O)OC)C2)C1	ZINC000875383276	CC	On-Demand	Anodyne	EPHX2	33	57
CCC(=O)N1CC[C@@H](NC(=O)NN=c2cc[nH]c(C)c2)C1	ZINC000875383279	CC	On-Demand	Reactive	EPHX2	27	45
CCC(=O)N1CC[C@H](NC(=O)NN=c2cc[nH]c(C)c2)C1	ZINC000875383280	CC	On-Demand	Reactive	EPHX2	27	45
CCC(=O)N1CC[C@@H](NC(=O)NC2(C)CC(F)(F)C2)C1	ZINC000875383281	CD	On-Demand	Anodyne	EPHX2	30	51
CCC(=O)N1CC[C@H](NC(=O)NC2(C)CC(F)(F)C2)C1	ZINC000875383282	CD	On-Demand	Anodyne	EPHX2	30	51
O=C(NCc1ccn2ccnc2c1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875383284	FG	On-Demand	Anodyne	CPT1A	40	35
O=C(NCc1ccn2ccnc2c1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875383284	FG	On-Demand	Anodyne	PREP	23	41
O=C(NCc1ccn2ccnc2c1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875383285	FG	On-Demand	Anodyne	CPT1A	40	35
O=C(NCc1ccn2ccnc2c1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875383285	FG	On-Demand	Anodyne	PREP	23	41
O=C(NCc1ccn2ccnc2c1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875383286	FG	On-Demand	Anodyne	CPT1A	40	35
O=C(NCc1ccn2ccnc2c1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875383286	FG	On-Demand	Anodyne	PREP	23	41
O=C(NCc1ccn2ccnc2c1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875383287	FG	On-Demand	Anodyne	CPT1A	40	35
O=C(NCc1ccn2ccnc2c1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875383287	FG	On-Demand	Anodyne	PREP	23	41
CCC(=O)N1CC[C@H](NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)C1	ZINC000875383294	FE	On-Demand	Anodyne	EPHX2	21	43
CCC(=O)N1CC[C@@H](NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)C1	ZINC000875383295	FE	On-Demand	Anodyne	EPHX2	21	43
CCC(=O)N1CC[C@H](NC(=O)NC[C@@H]2CCO[C@@H]2C(=O)OC)C1	ZINC000875383298	EB	On-Demand	Anodyne	EPHX2	16	45
CCC(=O)N1CC[C@@H](NC(=O)NC[C@@H]2CCO[C@@H]2C(=O)OC)C1	ZINC000875383299	EB	On-Demand	Anodyne	EPHX2	16	45
CCC(=O)N1CC[C@H](NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)C1	ZINC000875383300	CD	On-Demand	Anodyne	EPHX2	19	51
CCC(=O)N1CC[C@H](NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)C1	ZINC000875383301	CD	On-Demand	Anodyne	EPHX2	19	51
CCC(=O)N1CC[C@H](NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)C1	ZINC000875383302	CD	On-Demand	Anodyne	EPHX2	19	51
CCC(=O)N1CC[C@H](NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)C1	ZINC000875383303	CD	On-Demand	Anodyne	EPHX2	19	51
O=C(N[C@@H]1CCN(C(=O)C2CCCC2)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875383315	GE	On-Demand	Anodyne	CCR5	15	40
O=C(N[C@@H]1CCN(C(=O)C2CCCC2)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875383315	GE	On-Demand	Anodyne	EPHX2	22	42
O=C(N[C@@H]1CCN(C(=O)C2CCCC2)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875383316	GE	On-Demand	Anodyne	CCR5	15	40
O=C(N[C@@H]1CCN(C(=O)C2CCCC2)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875383316	GE	On-Demand	Anodyne	EPHX2	22	42
O=C(N[C@H]1CCN(C(=O)C2CCCC2)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875383317	GE	On-Demand	Anodyne	CCR5	15	40
O=C(N[C@H]1CCN(C(=O)C2CCCC2)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875383317	GE	On-Demand	Anodyne	EPHX2	22	42
O=C(N[C@H]1CCN(C(=O)C2CCCC2)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875383318	GE	On-Demand	Anodyne	CCR5	15	40
O=C(N[C@H]1CCN(C(=O)C2CCCC2)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875383318	GE	On-Demand	Anodyne	EPHX2	22	42
CCC(=O)N1CC[C@@H](NC(=O)NN(C)C(=O)OC)C1	ZINC000875383323	CB	On-Demand	Reactive	EPHX2	22	50
CCC(=O)N1CC[C@H](NC(=O)NN(C)C(=O)OC)C1	ZINC000875383324	CB	On-Demand	Reactive	EPHX2	22	50
CCC(=O)N1CC[C@@H](NC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875383325	DD	On-Demand	Anodyne	EPHX2	17	46
CCC(=O)N1CC[C@H](NC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875383326	DD	On-Demand	Anodyne	EPHX2	17	46
CCC(=O)N1CC[C@@H](NC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875383327	DD	On-Demand	Anodyne	EPHX2	17	46
CCC(=O)N1CC[C@H](NC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875383328	DD	On-Demand	Anodyne	EPHX2	17	46
CCC(=O)N1CC[C@@H](NC(=O)N[C@](C)(CO)Cc2ccc(OC)cc2)C1	ZINC000875383342	FD	On-Demand	Anodyne	EPHX2	30	55
CCC(=O)N1CC[C@@H](NC(=O)N[C@@](C)(CO)Cc2ccc(OC)cc2)C1	ZINC000875383343	FD	On-Demand	Anodyne	EPHX2	30	55
CCC(=O)N1CC[C@H](NC(=O)N[C@@](C)(CO)Cc2ccc(OC)cc2)C1	ZINC000875383344	FD	On-Demand	Anodyne	EPHX2	30	55
CCC(=O)N1CC[C@H](NC(=O)N[C@](C)(CO)Cc2ccc(OC)cc2)C1	ZINC000875383345	FD	On-Demand	Anodyne	EPHX2	30	55
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)N1CCCN(C=O)CC1	ZINC000875383355	FE	On-Demand	Anodyne	FAAH	15	41
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)N1CCCN(C=O)CC1	ZINC000875383356	FE	On-Demand	Anodyne	FAAH	15	41
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N1CCCN(C=O)CC1	ZINC000875383357	FE	On-Demand	Anodyne	FAAH	15	41
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875383358	GD	On-Demand	Anodyne	DRD4	35	40
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875383358	GD	On-Demand	Anodyne	GHRHR	43	31
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875383358	GD	On-Demand	Anodyne	SIGMAR1	52	41
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875383358	GD	On-Demand	Anodyne	MLNR	47	36
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875383359	GD	On-Demand	Anodyne	DRD4	35	40
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875383359	GD	On-Demand	Anodyne	GHRHR	43	31
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875383359	GD	On-Demand	Anodyne	SIGMAR1	52	41
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875383359	GD	On-Demand	Anodyne	MLNR	47	36
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875383360	GD	On-Demand	Anodyne	DRD4	35	40
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875383360	GD	On-Demand	Anodyne	GHRHR	43	31
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875383360	GD	On-Demand	Anodyne	SIGMAR1	52	41
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875383360	GD	On-Demand	Anodyne	MLNR	47	36
COCCCn1cc(C(=O)Nc2cccc(Cl)n2)cn1	ZINC000875383419	CE	On-Demand	Anodyne	GRM5	18	44
COCCCn1cc(C(=O)Nc2cccc(Cl)n2)cn1	ZINC000875383419	CE	On-Demand	Anodyne	MAP3K5	40	34
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)N1C[C@H]2C(=O)N(C)C(=O)[C@H]2C1	ZINC000875383450	GD	On-Demand	Anodyne	DRD4	22	40
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N1C[C@H]2C(=O)N(C)C(=O)[C@H]2C1	ZINC000875383451	GD	On-Demand	Anodyne	DRD4	22	40
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)N1C[C@H]2C(=O)N(C)C(=O)[C@H]2C1	ZINC000875383452	GD	On-Demand	Anodyne	DRD4	22	40
O=C(Nc1cccc(Cl)n1)c1cnn(C2CC2)c1	ZINC000875383456	CF	On-Demand	Anodyne	GRM5	15	44
CC(C)n1ncc(C(=O)Nc2cccc(Cl)n2)c1I	ZINC000875383459	GG	On-Demand	Anodyne	GRM5	18	43
CC(C)n1ncc(C(=O)Nc2cccc(Cl)n2)c1I	ZINC000875383459	GG	On-Demand	Anodyne	SORT1	20	42
CCC(=O)N1CC[C@@H](NC(=O)NC2(C)CCC(C)(C)CC2)C1	ZINC000875383471	DF	On-Demand	Anodyne	EPHX2	29	53
CCC(=O)N1CC[C@H](NC(=O)NC2(C)CCC(C)(C)CC2)C1	ZINC000875383472	DF	On-Demand	Anodyne	EPHX2	29	53
CCC(=O)N1CC[C@@H](NC(=O)N[C@@H](C)C2CN(C(=O)OC(C)(C)C)C2)C1	ZINC000875383479	FD	On-Demand	Anodyne	EPHX2	19	43
CCC(=O)N1CC[C@H](NC(=O)N[C@@H](C)C2CN(C(=O)OC(C)(C)C)C2)C1	ZINC000875383480	FD	On-Demand	Anodyne	EPHX2	19	43
CCC(=O)N1CC[C@H](NC(=O)N[C@H](C)C2CN(C(=O)OC(C)(C)C)C2)C1	ZINC000875383481	FD	On-Demand	Anodyne	EPHX2	19	43
CCC(=O)N1CC[C@@H](NC(=O)N[C@H](C)C2CN(C(=O)OC(C)(C)C)C2)C1	ZINC000875383482	FD	On-Demand	Anodyne	EPHX2	19	43
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000875383484	GE	On-Demand	Anodyne	DRD4	23	52
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000875383484	GE	On-Demand	Anodyne	ACHE	17	44
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000875383484	GE	On-Demand	Anodyne	SIGMAR1	30	58
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000875383484	GE	On-Demand	Anodyne	EPHX2	17	46
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000875383484	GE	On-Demand	Anodyne	CXCR3	31	40
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000875383484	GE	On-Demand	Anodyne	MCHR1	41	48
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000875383484	GE	On-Demand	Anodyne	CACNA1I	38	41
COc1ccc([C@@H]2CN(C(=O)NCc3ccn4ccnc4c3)CCO2)cc1	ZINC000875383490	FF	On-Demand	Anodyne	NOS2	81	36
O=C(NCc1ccn2ccnc2c1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875383502	GG	On-Demand	Anodyne	SMO	37	42
O=C(NCc1ccn2ccnc2c1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875383502	GG	On-Demand	Anodyne	ETHR	61	44
O=C(Nc1cccc(Cl)n1)c1ncc2n1CCCC2	ZINC000875383503	CF	On-Demand	Anodyne	GRM5	15	43
CCC(=O)N1CC[C@H](NC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875383517	FE	On-Demand	Mild	MLNR	23	41
CCC(=O)N1CC[C@H](NC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875383517	FE	On-Demand	Mild	EPHX2	31	44
CCC(=O)N1CC[C@H](NC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875383517	FE	On-Demand	Mild	MCHR1	30	41
CCC(=O)N1CC[C@@H](NC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875383518	FE	On-Demand	Mild	MLNR	23	41
CCC(=O)N1CC[C@@H](NC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875383518	FE	On-Demand	Mild	EPHX2	31	44
CCC(=O)N1CC[C@@H](NC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875383518	FE	On-Demand	Mild	MCHR1	30	41
CCC(=O)N1CC[C@@H](NC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875383519	FE	On-Demand	Mild	MLNR	23	41
CCC(=O)N1CC[C@@H](NC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875383519	FE	On-Demand	Mild	EPHX2	31	44
CCC(=O)N1CC[C@@H](NC(=O)N[C@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875383519	FE	On-Demand	Mild	MCHR1	30	41
CCC(=O)N1CC[C@H](NC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875383520	FE	On-Demand	Mild	MLNR	23	41
CCC(=O)N1CC[C@H](NC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875383520	FE	On-Demand	Mild	EPHX2	31	44
CCC(=O)N1CC[C@H](NC(=O)N[C@@H](c2cccc(C#N)c2)C(F)(F)F)C1	ZINC000875383520	FE	On-Demand	Mild	MCHR1	30	41
CCC(=O)N1CC[C@@H](NC(=O)NC(C)(C)C(O)(CC)CC)C1	ZINC000875383527	DD	On-Demand	Anodyne	EPHX2	25	51
CCC(=O)N1CC[C@H](NC(=O)NC(C)(C)C(O)(CC)CC)C1	ZINC000875383528	DD	On-Demand	Anodyne	EPHX2	25	51
O=C(NCc1ccn2ccnc2c1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875383549	FD	On-Demand	Anodyne	ETHR	41	34
O=C(NCc1ccn2ccnc2c1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875383550	FD	On-Demand	Anodyne	ETHR	41	34
Cc1cc(-c2noc([C@H](C)NC(=O)N3CCC[C@@H](C(C)(C)O)C3)n2)ccc1F	ZINC000875383581	GG	On-Demand	Anodyne	GRM5	16	40
Cc1cc(-c2noc([C@@H](C)NC(=O)N3CCC[C@H](C(C)(C)O)C3)n2)ccc1F	ZINC000875383582	GG	On-Demand	Anodyne	GRM5	16	40
Cc1cc(-c2noc([C@@H](C)NC(=O)N3CCC[C@@H](C(C)(C)O)C3)n2)ccc1F	ZINC000875383583	GG	On-Demand	Anodyne	GRM5	16	40
Cc1cc(-c2noc([C@H](C)NC(=O)N3CCC[C@H](C(C)(C)O)C3)n2)ccc1F	ZINC000875383584	GG	On-Demand	Anodyne	GRM5	16	40
CCCCCCCNC(=O)C(=O)NCC1([S@](C)=O)CC1	ZINC000875383606	DD	On-Demand	Mild	ASAH1	53	31
CCCCCCCNC(=O)C(=O)NCC1([S@@](C)=O)CC1	ZINC000875383607	DD	On-Demand	Mild	ASAH1	53	31
O=C(NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)Nc1nccs1	ZINC000875383698	HE	On-Demand	Reactive	MAP1	125	46
C[S@](=O)C1(CNC(=O)C(=O)N2CCC(Cc3ccccc3Cl)CC2)CC1	ZINC000875383734	GE	On-Demand	Anodyne	CCR3	15	42
COC(=O)N(C)NC(=O)N[C@@H]1[C@@H](C)CN(Cc2ccccc2)C[C@H]1C	ZINC000875383798	EE	On-Demand	Reactive	DRD4	31	46
COC(=O)N(C)NC(=O)N[C@@H]1[C@@H](C)CN(Cc2ccccc2)C[C@H]1C	ZINC000875383798	EE	On-Demand	Reactive	SIGMAR1	38	41
COC(=O)N(C)NC(=O)NC1[C@@H](C)CN(Cc2ccccc2)C[C@@H]1C	ZINC000875383799	EE	On-Demand	Reactive	DRD4	31	46
COC(=O)N(C)NC(=O)NC1[C@@H](C)CN(Cc2ccccc2)C[C@@H]1C	ZINC000875383799	EE	On-Demand	Reactive	SIGMAR1	38	41
COC(=O)N(C)NC(=O)NC1[C@H](C)CN(Cc2ccccc2)C[C@H]1C	ZINC000875383800	EE	On-Demand	Reactive	DRD4	31	46
COC(=O)N(C)NC(=O)NC1[C@H](C)CN(Cc2ccccc2)C[C@H]1C	ZINC000875383800	EE	On-Demand	Reactive	SIGMAR1	38	41
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)N1CCS(=O)(=O)[C@H](C)C1	ZINC000875383801	GD	On-Demand	Anodyne	DRD4	35	40
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)N1CCS(=O)(=O)[C@H](C)C1	ZINC000875383801	GD	On-Demand	Anodyne	SIGMAR1	38	41
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)NCCC[C@@H]1CCOC1=O	ZINC000875383843	GF	On-Demand	Anodyne	LUXR	53	33
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)NCCC[C@@H]1CCOC1=O	ZINC000875383843	GF	On-Demand	Anodyne	TRAR	41	37
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)NCCC[C@H]1CCOC1=O	ZINC000875383844	GF	On-Demand	Anodyne	LUXR	53	33
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)NCCC[C@H]1CCOC1=O	ZINC000875383844	GF	On-Demand	Anodyne	TRAR	41	37
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)NCCC[C@H]1CCOC1=O	ZINC000875383845	GF	On-Demand	Anodyne	LUXR	53	33
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)NCCC[C@H]1CCOC1=O	ZINC000875383845	GF	On-Demand	Anodyne	TRAR	41	37
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)NCCC[C@@H]1CCOC1=O	ZINC000875383846	GF	On-Demand	Anodyne	LUXR	53	33
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)NCCC[C@@H]1CCOC1=O	ZINC000875383846	GF	On-Demand	Anodyne	TRAR	41	37
O=C(c1ccc(CNc2nc3ccccc3[nH]2)cc1)N1CCCC1	ZINC000875383858	DG	On-Demand	Anodyne	KCNN3	39	58
O=C(c1ccc(CNc2nc3ccccc3[nH]2)cc1)N1CCCC1	ZINC000875383858	DG	On-Demand	Anodyne	L3MBTL3	64	41
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N1C[C@H]2C(=O)OC[C@H]2C1	ZINC000875383859	FD	On-Demand	Anodyne	NAAA	42	36
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)N1C[C@H]2C(=O)OC[C@H]2C1	ZINC000875383860	FD	On-Demand	Anodyne	NAAA	42	36
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)N1C[C@H]2C(=O)OC[C@H]2C1	ZINC000875383861	FD	On-Demand	Anodyne	NAAA	42	36
Cc1cncc([C@H]2CCCN2C(=O)N[C@H](C)c2noc(-c3ccccc3)n2)c1	ZINC000875383895	GI	On-Demand	Anodyne	CPT1A	80	39
Cc1cncc([C@H]2CCCN2C(=O)N[C@@H](C)c2noc(-c3ccccc3)n2)c1	ZINC000875383896	GI	On-Demand	Anodyne	CPT1A	80	39
Cc1cncc([C@@H]2CCCN2C(=O)N[C@H](C)c2noc(-c3ccccc3)n2)c1	ZINC000875383897	GI	On-Demand	Anodyne	CPT1A	80	39
Cc1cncc([C@@H]2CCCN2C(=O)N[C@@H](C)c2noc(-c3ccccc3)n2)c1	ZINC000875383898	GI	On-Demand	Anodyne	CPT1A	80	39
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N1CC[C@@H]2[C@H](CCN2C)C1	ZINC000875383905	GF	On-Demand	Anodyne	DRD2	18	42
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N1CC[C@@H]2[C@H](CCN2C)C1	ZINC000875383905	GF	On-Demand	Anodyne	DRD4	42	42
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N1CC[C@@H]2[C@H](CCN2C)C1	ZINC000875383905	GF	On-Demand	Anodyne	DRD3	15	42
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N1CC[C@@H]2[C@H](CCN2C)C1	ZINC000875383905	GF	On-Demand	Anodyne	SIGMAR1	37	41
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N1CC[C@@H]2[C@H](CCN2C)C1	ZINC000875383905	GF	On-Demand	Anodyne	MLNR	41	38
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N1CC[C@H]2[C@H](CCN2C)C1	ZINC000875383906	GF	On-Demand	Anodyne	DRD2	18	42
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N1CC[C@H]2[C@H](CCN2C)C1	ZINC000875383906	GF	On-Demand	Anodyne	DRD4	42	42
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N1CC[C@H]2[C@H](CCN2C)C1	ZINC000875383906	GF	On-Demand	Anodyne	DRD3	15	42
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N1CC[C@H]2[C@H](CCN2C)C1	ZINC000875383906	GF	On-Demand	Anodyne	SIGMAR1	37	41
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N1CC[C@H]2[C@H](CCN2C)C1	ZINC000875383906	GF	On-Demand	Anodyne	MLNR	41	38
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N1CC[C@H]2[C@@H](CCN2C)C1	ZINC000875383907	GF	On-Demand	Anodyne	DRD2	18	42
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N1CC[C@H]2[C@@H](CCN2C)C1	ZINC000875383907	GF	On-Demand	Anodyne	DRD4	42	42
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N1CC[C@H]2[C@@H](CCN2C)C1	ZINC000875383907	GF	On-Demand	Anodyne	DRD3	15	42
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N1CC[C@H]2[C@@H](CCN2C)C1	ZINC000875383907	GF	On-Demand	Anodyne	SIGMAR1	37	41
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N1CC[C@H]2[C@@H](CCN2C)C1	ZINC000875383907	GF	On-Demand	Anodyne	MLNR	41	38
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N1CC[C@@H]2[C@@H](CCN2C)C1	ZINC000875383908	GF	On-Demand	Anodyne	DRD2	18	42
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N1CC[C@@H]2[C@@H](CCN2C)C1	ZINC000875383908	GF	On-Demand	Anodyne	DRD4	42	42
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N1CC[C@@H]2[C@@H](CCN2C)C1	ZINC000875383908	GF	On-Demand	Anodyne	DRD3	15	42
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N1CC[C@@H]2[C@@H](CCN2C)C1	ZINC000875383908	GF	On-Demand	Anodyne	SIGMAR1	37	41
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N1CC[C@@H]2[C@@H](CCN2C)C1	ZINC000875383908	GF	On-Demand	Anodyne	MLNR	41	38
CC(=O)c1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	ZINC000875383909	GD	On-Demand	Reactive	PRNP	20	40
CC(=O)c1ccc(NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1	ZINC000875383909	GD	On-Demand	Reactive	IMDH_CRYPV	30	47
O=C1C[C@]2(CCCN(C(=O)NCCc3ccncc3)C2)Oc2ccccc21	ZINC000875383967	FF	On-Demand	Anodyne	EPHX2	18	45
O=C1C[C@@]2(CCCN(C(=O)NCCc3ccncc3)C2)Oc2ccccc21	ZINC000875383968	FF	On-Demand	Anodyne	EPHX2	18	45
COc1ccccc1[C@@H]1CCCN(C(=O)NCCc2ccncc2)CC1	ZINC000875383976	FH	On-Demand	Anodyne	DRD2	20	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCCc2ccncc2)CC1	ZINC000875383976	FH	On-Demand	Anodyne	PDE4A	15	41
COc1ccccc1[C@H]1CCCN(C(=O)NCCc2ccncc2)CC1	ZINC000875383977	FH	On-Demand	Anodyne	DRD2	20	43
COc1ccccc1[C@H]1CCCN(C(=O)NCCc2ccncc2)CC1	ZINC000875383977	FH	On-Demand	Anodyne	PDE4A	15	41
N#Cc1ccc(N2CCN(C(=O)NCCc3ccncc3)CC2)cc1	ZINC000875383980	EE	On-Demand	Mild	CTSK	28	44
N#Cc1ccc(N2CCN(C(=O)NCCc3ccncc3)CC2)cc1	ZINC000875383980	EE	On-Demand	Mild	GPBAR1	30	41
O=C(NCc1ccn2ccnc2c1)NC1CC(Nc2ccccc2)C1	ZINC000875383981	EF	On-Demand	Anodyne	NAMPT	16	41
CC(=O)Nc1cccc2c1CN(C(=O)NCCc1ccncc1)CC2	ZINC000875383987	EE	On-Demand	Anodyne	P2RY14	47	34
O=C(NCCc1ccncc1)NCC[C@@H](O)COCc1ccccc1	ZINC000875383994	ED	On-Demand	Anodyne	GHSR	17	40
C/C=C\CNC(=O)NCCc1ccncc1	ZINC000875384007	BD	On-Demand	Anodyne	CA5A	15	43
C/C=C/CNC(=O)NCCc1ccncc1	ZINC000875384008	BD	On-Demand	Anodyne	CA5A	15	43
CN1CCC(CNC(=O)NCCc2ccncc2)(c2ccccc2)CC1	ZINC000875384009	FF	On-Demand	Anodyne	KCNA3	46	42
CN1CCC(CNC(=O)NCCc2ccncc2)(c2ccccc2)CC1	ZINC000875384009	FF	On-Demand	Anodyne	SOAT1	15	42
COc1cccc([C@H](O)C2CCN(C(=O)NCCc3ccncc3)CC2)c1	ZINC000875384063	FF	On-Demand	Anodyne	DRD4	42	33
COc1cccc([C@H](O)C2CCN(C(=O)NCCc3ccncc3)CC2)c1	ZINC000875384063	FF	On-Demand	Anodyne	OPRD1	16	45
COc1cccc([C@H](O)C2CCN(C(=O)NCCc3ccncc3)CC2)c1	ZINC000875384063	FF	On-Demand	Anodyne	ADRB3	44	37
COc1cccc([C@H](O)C2CCN(C(=O)NCCc3ccncc3)CC2)c1	ZINC000875384063	FF	On-Demand	Anodyne	PDE4A	19	42
COc1cccc([C@H](O)C2CCN(C(=O)NCCc3ccncc3)CC2)c1	ZINC000875384063	FF	On-Demand	Anodyne	MTNR1A	51	37
COc1cccc([C@H](O)C2CCN(C(=O)NCCc3ccncc3)CC2)c1	ZINC000875384063	FF	On-Demand	Anodyne	MTNR1B	48	37
O=C(NCCc1ccncc1)N[C@@H](CCc1ccccc1)C(F)F	ZINC000875384073	EG	On-Demand	Anodyne	CA5A	15	42
O=C(NCCc1ccncc1)N[C@@H](CCc1ccccc1)C(F)F	ZINC000875384073	EG	On-Demand	Anodyne	MMP2	15	41
O=C(NCCc1ccncc1)N[C@@H](CCc1ccccc1)C(F)F	ZINC000875384073	EG	On-Demand	Anodyne	MMP3	24	41
O=C(NCCc1ccncc1)N[C@@H](CCc1ccccc1)C(F)F	ZINC000875384073	EG	On-Demand	Anodyne	LAP3	30	40
O=C(NCCc1ccncc1)N[C@@H](CCc1ccccc1)C(F)F	ZINC000875384073	EG	On-Demand	Anodyne	AMP1_PLAFQ	30	42
O=C(NCCc1ccncc1)N[C@@H](CCc1ccccc1)C(F)F	ZINC000875384073	EG	On-Demand	Anodyne	POLG_WNV	42	31
O=C(NCCc1ccncc1)N[C@H](CCc1ccccc1)C(F)F	ZINC000875384074	EG	On-Demand	Anodyne	CA5A	15	42
O=C(NCCc1ccncc1)N[C@H](CCc1ccccc1)C(F)F	ZINC000875384074	EG	On-Demand	Anodyne	MMP2	15	41
O=C(NCCc1ccncc1)N[C@H](CCc1ccccc1)C(F)F	ZINC000875384074	EG	On-Demand	Anodyne	MMP3	24	41
O=C(NCCc1ccncc1)N[C@H](CCc1ccccc1)C(F)F	ZINC000875384074	EG	On-Demand	Anodyne	LAP3	30	40
O=C(NCCc1ccncc1)N[C@H](CCc1ccccc1)C(F)F	ZINC000875384074	EG	On-Demand	Anodyne	AMP1_PLAFQ	30	42
O=C(NCCc1ccncc1)N[C@H](CCc1ccccc1)C(F)F	ZINC000875384074	EG	On-Demand	Anodyne	POLG_WNV	42	31
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@H](C)c1noc(-c2ccccc2)n1	ZINC000875384078	FG	On-Demand	Anodyne	TIMP3	66	33
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@@H](C)c1noc(-c2ccccc2)n1	ZINC000875384080	FG	On-Demand	Anodyne	TIMP3	66	33
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1noc(-c2ccccc2)n1	ZINC000875384138	FF	On-Demand	Anodyne	SLC6A4	18	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1noc(-c2ccccc2)n1	ZINC000875384138	FF	On-Demand	Anodyne	SLC6A3	38	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1noc(-c2ccccc2)n1	ZINC000875384139	FF	On-Demand	Anodyne	SLC6A4	18	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1noc(-c2ccccc2)n1	ZINC000875384139	FF	On-Demand	Anodyne	SLC6A3	38	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1noc(-c2ccccc2)n1	ZINC000875384140	FF	On-Demand	Anodyne	SLC6A4	18	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1noc(-c2ccccc2)n1	ZINC000875384140	FF	On-Demand	Anodyne	SLC6A3	38	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1noc(-c2ccccc2)n1	ZINC000875384141	FF	On-Demand	Anodyne	SLC6A4	18	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1noc(-c2ccccc2)n1	ZINC000875384141	FF	On-Demand	Anodyne	SLC6A3	38	40
O=C(NCCc1ccncc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875384172	EF	On-Demand	Anodyne	FKBP1A	48	42
O=C(NCCc1ccncc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875384172	EF	On-Demand	Anodyne	PREP	50	35
O=C(NCCc1ccncc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875384173	EF	On-Demand	Anodyne	FKBP1A	48	42
O=C(NCCc1ccncc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875384173	EF	On-Demand	Anodyne	PREP	50	35
O=C(NCCc1ccncc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875384174	EF	On-Demand	Anodyne	FKBP1A	48	42
O=C(NCCc1ccncc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875384174	EF	On-Demand	Anodyne	PREP	50	35
O=C(NCCc1ccncc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875384175	EF	On-Demand	Anodyne	FKBP1A	48	42
O=C(NCCc1ccncc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875384175	EF	On-Demand	Anodyne	PREP	50	35
O=C(NCCc1ccncc1)N1CCC(Oc2cccc(F)c2)CC1	ZINC000875384209	EG	On-Demand	Anodyne	CCR3	52	40
O=C(NCCc1ccncc1)N1CCC(Oc2cccc(F)c2)CC1	ZINC000875384209	EG	On-Demand	Anodyne	MLNR	27	49
O=C(NCCc1ccncc1)N1CCC(Oc2cccc(F)c2)CC1	ZINC000875384209	EG	On-Demand	Anodyne	EPHX2	25	49
O=C(NCCc1ccncc1)N1CCC(Oc2cccc(F)c2)CC1	ZINC000875384209	EG	On-Demand	Anodyne	SCD1	26	47
O=C(NCCc1ccncc1)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875384227	EG	On-Demand	Anodyne	TBXAS1	18	41
O=C(NCCc1ccncc1)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875384227	EG	On-Demand	Anodyne	C3AR1	41	42
O=C(NCCc1ccncc1)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875384227	EG	On-Demand	Anodyne	NAMPT	36	41
O=C(NCCc1ccncc1)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875384228	EG	On-Demand	Anodyne	TBXAS1	18	41
O=C(NCCc1ccncc1)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875384228	EG	On-Demand	Anodyne	C3AR1	41	42
O=C(NCCc1ccncc1)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875384228	EG	On-Demand	Anodyne	NAMPT	36	41
CN1CCN(C2CCN(C(=O)NCCc3ccncc3)CC2)CC1	ZINC000875384231	ED	On-Demand	Anodyne	L3MBTL3	101	43
CN1CCN(C2CCN(C(=O)NCCc3ccncc3)CC2)CC1	ZINC000875384231	ED	On-Demand	Anodyne	NAMPT	21	41
CC(C)(C)OC(=O)CN1CCC(NC(=O)NCCc2ccncc2)CC1	ZINC000875384246	FD	On-Demand	Anodyne	SSTR5	45	38
O=C(NCCc1ccncc1)N1CCN(S(=O)(=O)C2CC2)CC1	ZINC000875384253	EC	On-Demand	Anodyne	CA5B	16	43
O=C(NCCc1ccncc1)N1CCN(S(=O)(=O)C2CC2)CC1	ZINC000875384253	EC	On-Demand	Anodyne	NAMPT	37	40
O=C(NCCc1ccncc1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875384259	EE	On-Demand	Anodyne	FAAH	22	48
O=C(NCCc1ccncc1)N1CCc2cc(C(F)(F)F)ccc2C1	ZINC000875384260	EG	On-Demand	Anodyne	NAMPT	21	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1cccc(Cl)c1)c1ccccn1	ZINC000875384284	GH	On-Demand	Anodyne	SLC6A3	36	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1cccc(Cl)c1)c1ccccn1	ZINC000875384285	GH	On-Demand	Anodyne	SLC6A3	36	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1cccc(Cl)c1)c1ccccn1	ZINC000875384286	GH	On-Demand	Anodyne	SLC6A3	36	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1cccc(Cl)c1)c1ccccn1	ZINC000875384287	GH	On-Demand	Anodyne	SLC6A3	36	42
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)N(C)CCS(N)(=O)=O	ZINC000875384335	GD	On-Demand	Anodyne	DRD4	17	41
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)N(C)CCS(N)(=O)=O	ZINC000875384336	GD	On-Demand	Anodyne	DRD4	17	41
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N(C)CCS(N)(=O)=O	ZINC000875384337	GD	On-Demand	Anodyne	DRD4	17	41
COCC1CC(NC(=O)NC2[C@H](C)CN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875384338	FF	On-Demand	Anodyne	DRD4	28	45
COCC1CC(NC(=O)NC2[C@H](C)CN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875384338	FF	On-Demand	Anodyne	SIGMAR1	36	42
COCC1CC(NC(=O)NC2[C@@H](C)CN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875384339	FF	On-Demand	Anodyne	DRD4	28	45
COCC1CC(NC(=O)NC2[C@@H](C)CN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875384339	FF	On-Demand	Anodyne	SIGMAR1	36	42
COCC1CC(NC(=O)N[C@@H]2[C@@H](C)CN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875384340	FF	On-Demand	Anodyne	DRD4	28	45
COCC1CC(NC(=O)N[C@@H]2[C@@H](C)CN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875384340	FF	On-Demand	Anodyne	SIGMAR1	36	42
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCC1([S@@](C)=O)CC1)CC2	ZINC000875384345	GD	On-Demand	Anodyne	SLC18A2	46	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCC1([S@](C)=O)CC1)CC2	ZINC000875384346	GD	On-Demand	Anodyne	SLC18A2	46	34
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCC1([S@@](C)=O)CC1)CC2	ZINC000875384347	GD	On-Demand	Anodyne	SLC18A2	46	34
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCC1([S@](C)=O)CC1)CC2	ZINC000875384348	GD	On-Demand	Anodyne	SLC18A2	46	34
COc1cccc([C@H](CNC(=O)NCCc2ccncc2)OC)c1	ZINC000875384367	EE	On-Demand	Anodyne	NQO2	24	40
COc1cccc([C@H](CNC(=O)NCCc2ccncc2)OC)c1	ZINC000875384367	EE	On-Demand	Anodyne	ROCK1	19	41
COc1cccc([C@H](CNC(=O)NCCc2ccncc2)OC)c1	ZINC000875384367	EE	On-Demand	Anodyne	MTNR1A	76	40
COc1cccc([C@H](CNC(=O)NCCc2ccncc2)OC)c1	ZINC000875384367	EE	On-Demand	Anodyne	MTNR1B	71	40
COc1cccc([C@H](CNC(=O)NCCc2ccncc2)OC)c1	ZINC000875384367	EE	On-Demand	Anodyne	ROCK2	20	43
O=C(NCCc1ccncc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875384376	EF	On-Demand	Anodyne	F2	33	41
O=C(NCCc1ccncc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875384376	EF	On-Demand	Anodyne	TRY1_BOVIN	41	34
O=C(NCCc1ccncc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875384376	EF	On-Demand	Anodyne	PREP	68	38
O=C(NCCc1ccncc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875384377	EF	On-Demand	Anodyne	F2	33	41
O=C(NCCc1ccncc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875384377	EF	On-Demand	Anodyne	TRY1_BOVIN	41	34
O=C(NCCc1ccncc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875384377	EF	On-Demand	Anodyne	PREP	68	38
O=C(NCCc1ccncc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875384378	EF	On-Demand	Anodyne	F2	33	41
O=C(NCCc1ccncc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875384378	EF	On-Demand	Anodyne	TRY1_BOVIN	41	34
O=C(NCCc1ccncc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875384378	EF	On-Demand	Anodyne	PREP	68	38
O=C(NCCc1ccncc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875384379	EF	On-Demand	Anodyne	F2	33	41
O=C(NCCc1ccncc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875384379	EF	On-Demand	Anodyne	TRY1_BOVIN	41	34
O=C(NCCc1ccncc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875384379	EF	On-Demand	Anodyne	PREP	68	38
CC[C@H](CCc1ccccc1)NC(=O)NCCc1ccncc1	ZINC000875384414	DG	On-Demand	Anodyne	MME	60	40
CC[C@H](CCc1ccccc1)NC(=O)NCCc1ccncc1	ZINC000875384414	DG	On-Demand	Anodyne	ANPEP	60	39
CC[C@H](CCc1ccccc1)NC(=O)NCCc1ccncc1	ZINC000875384414	DG	On-Demand	Anodyne	MMP2	28	45
CC[C@H](CCc1ccccc1)NC(=O)NCCc1ccncc1	ZINC000875384414	DG	On-Demand	Anodyne	MMP3	51	45
CC[C@H](CCc1ccccc1)NC(=O)NCCc1ccncc1	ZINC000875384414	DG	On-Demand	Anodyne	CAPN2	57	39
CC[C@H](CCc1ccccc1)NC(=O)NCCc1ccncc1	ZINC000875384414	DG	On-Demand	Anodyne	CTSC	18	43
CC[C@H](CCc1ccccc1)NC(=O)NCCc1ccncc1	ZINC000875384414	DG	On-Demand	Anodyne	AMP1_PLAFQ	33	44
CC[C@@H](CCc1ccccc1)NC(=O)NCCc1ccncc1	ZINC000875384415	DG	On-Demand	Anodyne	MME	60	40
CC[C@@H](CCc1ccccc1)NC(=O)NCCc1ccncc1	ZINC000875384415	DG	On-Demand	Anodyne	ANPEP	60	39
CC[C@@H](CCc1ccccc1)NC(=O)NCCc1ccncc1	ZINC000875384415	DG	On-Demand	Anodyne	MMP2	28	45
CC[C@@H](CCc1ccccc1)NC(=O)NCCc1ccncc1	ZINC000875384415	DG	On-Demand	Anodyne	MMP3	51	45
CC[C@@H](CCc1ccccc1)NC(=O)NCCc1ccncc1	ZINC000875384415	DG	On-Demand	Anodyne	CAPN2	57	39
CC[C@@H](CCc1ccccc1)NC(=O)NCCc1ccncc1	ZINC000875384415	DG	On-Demand	Anodyne	CTSC	18	43
CC[C@@H](CCc1ccccc1)NC(=O)NCCc1ccncc1	ZINC000875384415	DG	On-Demand	Anodyne	AMP1_PLAFQ	33	44
CS(=O)(=O)NC1CN(C(=O)NCCc2ccncc2)C1	ZINC000875384416	CB	On-Demand	Anodyne	CA5B	16	43
O=C(NCCc1ccncc1)N1CCC[C@@](F)(c2ccccc2)C1	ZINC000875384435	EG	On-Demand	Anodyne	EPHX2	16	57
O=C(NCCc1ccncc1)N1CCC[C@](F)(c2ccccc2)C1	ZINC000875384436	EG	On-Demand	Anodyne	EPHX2	16	57
C[C@@H](NC(=O)NCCc1ccncc1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875384437	EE	On-Demand	Anodyne	GPR119	24	40
O=C(NCCc1ccncc1)N1CC(c2ccccc2)C1	ZINC000875384439	CE	On-Demand	Anodyne	EPHX2	17	47
CS(=O)(=O)c1ccc([C@H]2CN(C(=O)NCCc3ccncc3)CCO2)cc1	ZINC000875384441	GD	On-Demand	Anodyne	CA5B	15	40
CS(=O)(=O)c1ccc([C@H]2CN(C(=O)NCCc3ccncc3)CCO2)cc1	ZINC000875384441	GD	On-Demand	Anodyne	NAMPT	42	38
CS(=O)(=O)c1ccc([C@@H]2CN(C(=O)NCCc3ccncc3)CCO2)cc1	ZINC000875384442	GD	On-Demand	Anodyne	CA5B	15	40
CS(=O)(=O)c1ccc([C@@H]2CN(C(=O)NCCc3ccncc3)CCO2)cc1	ZINC000875384442	GD	On-Demand	Anodyne	NAMPT	42	38
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)NNC(=O)[C@H]1CC[C@@H](C)O1	ZINC000875384482	GE	On-Demand	Reactive	DRD4	23	40
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)NNC(=O)[C@H]1CC[C@@H](C)O1	ZINC000875384482	GE	On-Demand	Reactive	SIGMAR1	25	40
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)NNC(=O)[C@H]1CC[C@@H](C)O1	ZINC000875384483	GE	On-Demand	Reactive	DRD4	23	40
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)NNC(=O)[C@H]1CC[C@@H](C)O1	ZINC000875384483	GE	On-Demand	Reactive	SIGMAR1	25	40
C[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)c1noc(-c2ccccc2)n1	ZINC000875384486	GE	On-Demand	Anodyne	L3MBTL3	40	38
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875384511	GE	On-Demand	Anodyne	GHRHR	62	35
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875384511	GE	On-Demand	Anodyne	MLNR	46	33
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875384512	GE	On-Demand	Anodyne	GHRHR	62	35
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875384512	GE	On-Demand	Anodyne	MLNR	46	33
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875384513	GE	On-Demand	Anodyne	GHRHR	62	35
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875384513	GE	On-Demand	Anodyne	MLNR	46	33
OC[C@@H](O)CN(Cc1cccnc1)Cc1ccco1	ZINC000875384514	CD	On-Demand	Anodyne	NR1D1	40	33
CC[C@@H](NC(=O)N1CCC([C@H](C)O)CC1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000875384527	GE	On-Demand	Anodyne	SIGMAR1	24	43
CC[C@@H](NC(=O)N1CCC([C@H](C)O)CC1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000875384527	GE	On-Demand	Anodyne	BIRC2	19	41
CC[C@@H](NC(=O)N1CCC([C@H](C)O)CC1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000875384528	GE	On-Demand	Anodyne	SIGMAR1	24	43
CC[C@@H](NC(=O)N1CCC([C@H](C)O)CC1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000875384528	GE	On-Demand	Anodyne	BIRC2	19	41
CC[C@@H](NC(=O)NN(C)C(=O)OC)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000875384546	FD	On-Demand	Reactive	DRD4	26	40
CC[C@@H](NC(=O)NN(C)C(=O)OC)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000875384548	FD	On-Demand	Reactive	DRD4	26	40
Cc1cccc(CN2CCO[C@@H](CNC(=O)NCCc3ccncc3)C2)c1	ZINC000875384563	FE	On-Demand	Anodyne	DRD4	21	40
Cc1cccc(CN2CCO[C@H](CNC(=O)NCCc3ccncc3)C2)c1	ZINC000875384564	FE	On-Demand	Anodyne	DRD4	21	40
O=C(NCCc1ccncc1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875384586	FF	On-Demand	Anodyne	SMO	39	44
O=C(NCCc1ccncc1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875384586	FF	On-Demand	Anodyne	ETHR	66	48
COc1ccc([C@@H]2CCN(C(=O)NCCc3ccncc3)C2)cc1F	ZINC000875384588	EF	On-Demand	Anodyne	CCR1	20	40
O=C(NCCc1ccncc1)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875384591	DF	On-Demand	Anodyne	CCR1	18	42
O=C(NCCc1ccncc1)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875384592	DF	On-Demand	Anodyne	CCR1	18	42
O=C(NCCc1ccncc1)N1CCc2ccc(C(F)(F)F)cc2C1	ZINC000875384599	EG	On-Demand	Anodyne	TRPM8	41	39
O=C(NCCc1ccncc1)N1CCc2ccc(C(F)(F)F)cc2C1	ZINC000875384599	EG	On-Demand	Anodyne	NAMPT	15	41
CC[C@@H](NC(=O)NCCc1ccncc1)c1cccc(OC)c1OC	ZINC000875384606	EG	On-Demand	Anodyne	CNR2	24	44
CCC1(CC)CCCN1C(=O)NCc1ccn2ccnc2c1	ZINC000875384633	DG	On-Demand	Anodyne	SLC12A5	44	33
Cc1ccc(CN2CC[C@H](NC(=O)NCCc3ccncc3)C2)cc1	ZINC000875384640	EF	On-Demand	Anodyne	DRD4	30	50
Cc1ccc(CN2CC[C@H](NC(=O)NCCc3ccncc3)C2)cc1	ZINC000875384640	EF	On-Demand	Anodyne	SIGMAR1	22	42
Cc1ccc(CN2CC[C@H](NC(=O)NCCc3ccncc3)C2)cc1	ZINC000875384640	EF	On-Demand	Anodyne	SSTR5	57	41
Cc1ccc(CN2CC[C@H](NC(=O)NCCc3ccncc3)C2)cc1	ZINC000875384640	EF	On-Demand	Anodyne	CCR3	38	43
Cc1ccc(CN2CC[C@H](NC(=O)NCCc3ccncc3)C2)cc1	ZINC000875384640	EF	On-Demand	Anodyne	UTS2R	24	42
Cc1ccc(CN2CC[C@H](NC(=O)NCCc3ccncc3)C2)cc1	ZINC000875384640	EF	On-Demand	Anodyne	MLNR	46	36
Cc1ccc(CN2CC[C@H](NC(=O)NCCc3ccncc3)C2)cc1	ZINC000875384640	EF	On-Demand	Anodyne	CCR2	16	46
Cc1ccc(CN2CC[C@H](NC(=O)NCCc3ccncc3)C2)cc1	ZINC000875384640	EF	On-Demand	Anodyne	MCHR1	46	52
Cc1ccc(CN2CC[C@H](NC(=O)NCCc3ccncc3)C2)cc1	ZINC000875384640	EF	On-Demand	Anodyne	BIRC2	34	44
Cc1ccc(CN2CC[C@@H](NC(=O)NCCc3ccncc3)C2)cc1	ZINC000875384641	EF	On-Demand	Anodyne	DRD4	30	50
Cc1ccc(CN2CC[C@@H](NC(=O)NCCc3ccncc3)C2)cc1	ZINC000875384641	EF	On-Demand	Anodyne	SIGMAR1	22	42
Cc1ccc(CN2CC[C@@H](NC(=O)NCCc3ccncc3)C2)cc1	ZINC000875384641	EF	On-Demand	Anodyne	SSTR5	57	41
Cc1ccc(CN2CC[C@@H](NC(=O)NCCc3ccncc3)C2)cc1	ZINC000875384641	EF	On-Demand	Anodyne	CCR3	38	43
Cc1ccc(CN2CC[C@@H](NC(=O)NCCc3ccncc3)C2)cc1	ZINC000875384641	EF	On-Demand	Anodyne	UTS2R	24	42
Cc1ccc(CN2CC[C@@H](NC(=O)NCCc3ccncc3)C2)cc1	ZINC000875384641	EF	On-Demand	Anodyne	MLNR	46	36
Cc1ccc(CN2CC[C@@H](NC(=O)NCCc3ccncc3)C2)cc1	ZINC000875384641	EF	On-Demand	Anodyne	CCR2	16	46
Cc1ccc(CN2CC[C@@H](NC(=O)NCCc3ccncc3)C2)cc1	ZINC000875384641	EF	On-Demand	Anodyne	MCHR1	46	52
Cc1ccc(CN2CC[C@@H](NC(=O)NCCc3ccncc3)C2)cc1	ZINC000875384641	EF	On-Demand	Anodyne	BIRC2	34	44
N#Cc1ccccc1N1CCC(NC(=O)NCCc2ccncc2)CC1	ZINC000875384645	EE	On-Demand	Mild	DRD4	17	43
N#Cc1ccccc1N1CCC(NC(=O)NCCc2ccncc2)CC1	ZINC000875384645	EE	On-Demand	Mild	NPY1R	20	42
O=C(NCCc1ccncc1)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875384653	EE	On-Demand	Anodyne	NPY2R	55	38
O=C(N[C@H](c1cccc(Cl)c1)c1ccccn1)N1CCC(CO)(CO)CC1	ZINC000875384714	GF	On-Demand	Anodyne	CACNA1H	50	38
O=C(N[C@@H](c1cccc(Cl)c1)c1ccccn1)N1CCC(CO)(CO)CC1	ZINC000875384715	GF	On-Demand	Anodyne	CACNA1H	50	38
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)NC1CC(C(N)=O)C1	ZINC000875384716	FD	On-Demand	Anodyne	DRD4	29	47
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)NC1CC(C(N)=O)C1	ZINC000875384716	FD	On-Demand	Anodyne	SIGMAR1	31	46
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)NC1CC(C(N)=O)C1	ZINC000875384717	FD	On-Demand	Anodyne	DRD4	29	47
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)NC1CC(C(N)=O)C1	ZINC000875384717	FD	On-Demand	Anodyne	SIGMAR1	31	46
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)NC1CC(C(N)=O)C1	ZINC000875384718	FD	On-Demand	Anodyne	DRD4	29	47
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)NC1CC(C(N)=O)C1	ZINC000875384718	FD	On-Demand	Anodyne	SIGMAR1	31	46
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CN(C(=O)NCCc1ccncc1)C2	ZINC000875384724	FE	On-Demand	Anodyne	GPR119	35	42
C[C@@H](NC(=O)NCCc1ccncc1)c1ccccc1O	ZINC000875384758	CE	On-Demand	Clean	CA5B	16	42
O=C(NCCc1ccncc1)N(C1CC1)C1CC1	ZINC000875384780	BD	On-Demand	Anodyne	CA5B	16	44
O=C(NCCc1ccncc1)N1CC[C@H]2CC[C@@H](C1)S2(=O)=O	ZINC000875384800	DC	On-Demand	Anodyne	GPBAR1	18	40
NC(=O)C1CC(NC(=O)NCCc2ccncc2)C1	ZINC000875384804	CC	On-Demand	Anodyne	CA5B	16	43
NC(=O)[C@@H]1C[C@@H](NC(=O)NCCc2ccncc2)C1	ZINC000875384806	CC	On-Demand	Anodyne	CA5B	16	43
CC(=O)c1ccc(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1	ZINC000875384847	GE	On-Demand	Reactive	PRNP	31	42
COc1ccc(N2CCN(C(=O)NCCc3ccncc3)CC2)c(OC)c1	ZINC000875384872	FE	On-Demand	Clean	HTR1A	43	45
COc1ccc(N2CCN(C(=O)NCCc3ccncc3)CC2)c(OC)c1	ZINC000875384872	FE	On-Demand	Clean	DRD2	39	45
COc1ccc(N2CCN(C(=O)NCCc3ccncc3)CC2)c(OC)c1	ZINC000875384872	FE	On-Demand	Clean	DRD4	44	35
COc1ccc(N2CCN(C(=O)NCCc3ccncc3)CC2)c(OC)c1	ZINC000875384872	FE	On-Demand	Clean	HTR1D	18	44
COc1ccc(N2CCN(C(=O)NCCc3ccncc3)CC2)c(OC)c1	ZINC000875384872	FE	On-Demand	Clean	HTR1B	21	44
COc1ccc(N2CCN(C(=O)NCCc3ccncc3)CC2)c(OC)c1	ZINC000875384872	FE	On-Demand	Clean	DRD3	59	41
COc1ccc(N2CCN(C(=O)NCCc3ccncc3)CC2)c(OC)c1	ZINC000875384872	FE	On-Demand	Clean	PDGFRB	51	41
COc1ccc(N2CCN(C(=O)NCCc3ccncc3)CC2)c(OC)c1	ZINC000875384872	FE	On-Demand	Clean	HTR7	33	45
COc1ccc(N2CCN(C(=O)NCCc3ccncc3)CC2)c(OC)c1	ZINC000875384872	FE	On-Demand	Clean	MTNR1A	59	38
COc1ccc(N2CCN(C(=O)NCCc3ccncc3)CC2)c(OC)c1	ZINC000875384872	FE	On-Demand	Clean	MTNR1B	55	39
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NCCc2ccncc2)C(C)(C)C1	ZINC000875384879	GF	On-Demand	Anodyne	GPR119	37	40
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCCc2ccncc2)C(C)(C)C1	ZINC000875384880	GF	On-Demand	Anodyne	GPR119	37	40
COc1ccc([C@@H]2CN(C(=O)NCCc3ccncc3)CCO2)cc1	ZINC000875384882	EE	On-Demand	Anodyne	NOS2	46	36
COc1ccc([C@@H]2CN(C(=O)NCCc3ccncc3)CCO2)cc1	ZINC000875384882	EE	On-Demand	Anodyne	MMP3	15	45
COc1ccc([C@@H]2CN(C(=O)NCCc3ccncc3)CCO2)cc1	ZINC000875384882	EE	On-Demand	Anodyne	MMP7	16	45
COc1ccc([C@@H]2CN(C(=O)NCCc3ccncc3)CCO2)cc1	ZINC000875384882	EE	On-Demand	Anodyne	MMP1	15	45
COc1ccc([C@@H]2CN(C(=O)NCCc3ccncc3)CCO2)cc1	ZINC000875384882	EE	On-Demand	Anodyne	PROKR1	42	30
O=C(NCCc1ccncc1)NCCN1CC[C@@H](O)C1	ZINC000875384883	CB	On-Demand	Anodyne	CCR3	20	43
O=C(NCCc1ccncc1)NCCN1CC[C@H](O)C1	ZINC000875384884	CB	On-Demand	Anodyne	CCR3	20	43
CN(C(=O)NCCc1ccncc1)[C@@H](CCc1ccccc1)C(F)F	ZINC000875384887	EH	On-Demand	Anodyne	AMP1_PLAFQ	28	42
CN(C(=O)NCCc1ccncc1)[C@@H](CCc1ccccc1)C(F)F	ZINC000875384887	EH	On-Demand	Anodyne	POLG_WNV	40	31
CN(C(=O)NCCc1ccncc1)[C@H](CCc1ccccc1)C(F)F	ZINC000875384888	EH	On-Demand	Anodyne	AMP1_PLAFQ	28	42
CN(C(=O)NCCc1ccncc1)[C@H](CCc1ccccc1)C(F)F	ZINC000875384888	EH	On-Demand	Anodyne	POLG_WNV	40	31
O=C(NCCc1ccncc1)N[C@H]1CCN(c2ccc(Cl)cc2F)C1=O	ZINC000875384895	GF	On-Demand	Anodyne	F10	22	47
O=C(NCCc1ccncc1)N[C@@H]1CCN(c2ccc(Cl)cc2F)C1=O	ZINC000875384896	GF	On-Demand	Anodyne	F10	22	47
O=C(NCCc1ccncc1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875384898	EE	On-Demand	Anodyne	EPHX2	17	58
O=C(NCCc1ccncc1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875384899	EE	On-Demand	Anodyne	EPHX2	17	58
Cn1ncc(C(F)(F)F)c1CNC(=O)NCCc1ccncc1	ZINC000875384900	ED	On-Demand	Anodyne	FLT1	24	45
O=C(NCCc1ccncc1)N[C@@H](CO)c1cccc(C(F)(F)F)c1	ZINC000875384917	FF	On-Demand	Anodyne	PDS	40	41
O=C(NCCc1ccncc1)N[C@H](CO)c1cccc(C(F)(F)F)c1	ZINC000875384918	FF	On-Demand	Anodyne	PDS	40	41
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)NCc1ccnc(F)c1	ZINC000875384979	FG	On-Demand	Anodyne	DRD4	19	41
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)NCc1ccnc(F)c1	ZINC000875384980	FG	On-Demand	Anodyne	DRD4	19	41
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)NCc1ccnc(F)c1	ZINC000875384981	FG	On-Demand	Anodyne	DRD4	19	41
CCn1ncc(CNC(=O)N[C@@H]2[C@@H](C)CN(Cc3ccccc3)C[C@H]2C)n1	ZINC000875384984	FE	On-Demand	Anodyne	PDE8B	44	32
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2noc(-c3ccccc3)n2)C1	ZINC000875385017	FF	On-Demand	Anodyne	P2RY12	151	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)c2noc(-c3ccccc3)n2)C1	ZINC000875385017	FF	On-Demand	Anodyne	PDE8B	44	32
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2noc(-c3ccccc3)n2)C1	ZINC000875385018	FF	On-Demand	Anodyne	P2RY12	151	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)c2noc(-c3ccccc3)n2)C1	ZINC000875385018	FF	On-Demand	Anodyne	PDE8B	44	32
O=C(N[C@H](c1cccc(Cl)c1)c1ccccn1)N1CCC2(CCNC2=O)CC1	ZINC000875385021	GG	On-Demand	Anodyne	CACNA1H	69	43
O=C(N[C@@H](c1cccc(Cl)c1)c1ccccn1)N1CCC2(CCNC2=O)CC1	ZINC000875385022	GG	On-Demand	Anodyne	CACNA1H	69	43
CCOC1CC2(C1)C[C@@H]2NC(=O)NC1[C@@H](C)CN(Cc2ccccc2)C[C@@H]1C	ZINC000875385078	GG	On-Demand	Anodyne	DRD4	17	40
CCOC1CC2(C1)C[C@@H]2NC(=O)NC1[C@@H](C)CN(Cc2ccccc2)C[C@@H]1C	ZINC000875385078	GG	On-Demand	Anodyne	TIMP3	70	34
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@@H]1[C@@H](C)CN(Cc2ccccc2)C[C@H]1C	ZINC000875385079	GG	On-Demand	Anodyne	DRD4	17	40
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@@H]1[C@@H](C)CN(Cc2ccccc2)C[C@H]1C	ZINC000875385079	GG	On-Demand	Anodyne	TIMP3	70	34
CCOC1CC2(C1)C[C@@H]2NC(=O)NC1[C@H](C)CN(Cc2ccccc2)C[C@H]1C	ZINC000875385080	GG	On-Demand	Anodyne	DRD4	17	40
CCOC1CC2(C1)C[C@@H]2NC(=O)NC1[C@H](C)CN(Cc2ccccc2)C[C@H]1C	ZINC000875385080	GG	On-Demand	Anodyne	TIMP3	70	34
O=C(NCCc1ccncc1)NC[C@@H]1CN(c2ccc(Cl)cc2)CCO1	ZINC000875385096	FE	On-Demand	Anodyne	MRGPRX1	43	41
O=C(NCCc1ccncc1)NC[C@H]1CN(c2ccc(Cl)cc2)CCO1	ZINC000875385097	FE	On-Demand	Anodyne	MRGPRX1	43	41
O=C(NCCc1ccncc1)N1CC=CC1	ZINC000875385103	BD	On-Demand	Anodyne	CA5B	17	46
O=C(NCCc1ccncc1)N1CC=CC1	ZINC000875385103	BD	On-Demand	Anodyne	CA5A	15	46
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875385107	FD	On-Demand	Anodyne	DRD4	26	41
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875385108	FD	On-Demand	Anodyne	DRD4	26	41
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCc1ccn3ccnc3c1)CC2	ZINC000875385163	GG	On-Demand	Anodyne	HCRTR1	16	43
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCc1ccn3ccnc3c1)CC2	ZINC000875385164	GG	On-Demand	Anodyne	HCRTR1	16	43
O=C(NCCc1ccncc1)N1CCC[C@H](c2ccc(F)c(F)c2)C1	ZINC000875385167	EG	On-Demand	Anodyne	GPBAR1	23	40
O=C(NCCc1ccncc1)N1CCC[C@@H](c2ccc(F)c(F)c2)C1	ZINC000875385168	EG	On-Demand	Anodyne	GPBAR1	23	40
O=C(NCCc1ccncc1)NCc1ccccc1CC(F)(F)F	ZINC000875385185	EG	On-Demand	Anodyne	CA5B	16	41
C[C@@H](NC(=O)NCCc1ccncc1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875385192	GF	On-Demand	Anodyne	GPR119	54	46
O=C(NCCc1ccncc1)N[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1	ZINC000875385195	FD	On-Demand	Anodyne	CA5B	17	43
O=C(NCCc1ccncc1)N[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1	ZINC000875385195	FD	On-Demand	Anodyne	CA5A	15	43
O=C(NC1CCN(C(=O)NCCc2ccncc2)CC1)OCc1ccccc1	ZINC000875385209	GF	On-Demand	Anodyne	DRD4	17	40
O=C(NC1CCN(C(=O)NCCc2ccncc2)CC1)OCc1ccccc1	ZINC000875385209	GF	On-Demand	Anodyne	GRIN2B	35	48
O=C(NC1CCN(C(=O)NCCc2ccncc2)CC1)OCc1ccccc1	ZINC000875385209	GF	On-Demand	Anodyne	CTSB	27	51
O=C(NC1CCN(C(=O)NCCc2ccncc2)CC1)OCc1ccccc1	ZINC000875385209	GF	On-Demand	Anodyne	CTSK	29	51
O=C(NC1CCN(C(=O)NCCc2ccncc2)CC1)OCc1ccccc1	ZINC000875385209	GF	On-Demand	Anodyne	C3AR1	42	41
O=C(NC1CCN(C(=O)NCCc2ccncc2)CC1)OCc1ccccc1	ZINC000875385209	GF	On-Demand	Anodyne	PREP	36	42
O=C(NC1CCN(C(=O)NCCc2ccncc2)CC1)OCc1ccccc1	ZINC000875385209	GF	On-Demand	Anodyne	CAPN2	57	36
O=C(NC1CCN(C(=O)NCCc2ccncc2)CC1)OCc1ccccc1	ZINC000875385209	GF	On-Demand	Anodyne	EPHX2	43	49
O=C(NC1CCN(C(=O)NCCc2ccncc2)CC1)OCc1ccccc1	ZINC000875385209	GF	On-Demand	Anodyne	TGM2	51	46
O=C(NC1CCN(C(=O)NCCc2ccncc2)CC1)OCc1ccccc1	ZINC000875385209	GF	On-Demand	Anodyne	F13A1	27	46
O=C(NC1CCN(C(=O)NCCc2ccncc2)CC1)OCc1ccccc1	ZINC000875385209	GF	On-Demand	Anodyne	NAAA	35	42
C[C@@H]1[C@@H](NC(=O)NCCc2ccncc2)CCN1C(=O)OC(C)(C)C	ZINC000875385215	EE	On-Demand	Anodyne	GPR119	25	40
O=C(NCCc1ccncc1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875385253	DF	On-Demand	Anodyne	EPHX2	21	44
O=C(NCCc1ccncc1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875385254	DF	On-Demand	Anodyne	EPHX2	21	44
O=C(NCCc1ccncc1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875385270	DG	On-Demand	Anodyne	EPHX2	19	40
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCCc1ccncc1)CC2	ZINC000875385282	FF	On-Demand	Anodyne	SLC18A2	48	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCCc1ccncc1)CC2	ZINC000875385282	FF	On-Demand	Anodyne	HCRTR1	15	44
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCCc1ccncc1)CC2	ZINC000875385282	FF	On-Demand	Anodyne	MTNR1B	19	49
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCCc1ccncc1)CC2	ZINC000875385283	FF	On-Demand	Anodyne	SLC18A2	48	35
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCCc1ccncc1)CC2	ZINC000875385283	FF	On-Demand	Anodyne	HCRTR1	15	44
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCCc1ccncc1)CC2	ZINC000875385283	FF	On-Demand	Anodyne	MTNR1B	19	49
O=C(NCCc1ccncc1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875385333	DF	On-Demand	Anodyne	OXTR	33	41
O=C(NCCc1ccncc1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875385333	DF	On-Demand	Anodyne	GHRHR	34	42
O=C(NCCc1ccncc1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875385333	DF	On-Demand	Anodyne	NPY5R	23	41
O=C(NCCc1ccncc1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875385334	DF	On-Demand	Anodyne	OXTR	33	41
O=C(NCCc1ccncc1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875385334	DF	On-Demand	Anodyne	GHRHR	34	42
O=C(NCCc1ccncc1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875385334	DF	On-Demand	Anodyne	NPY5R	23	41
CCNS(=O)(=O)c1ccc(CNC(=O)N2CCCN(C=O)CC2)cc1	ZINC000875385365	FC	On-Demand	Anodyne	NAMPT	43	43
O=C(NCc1ccc(F)cn1)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875385457	FF	On-Demand	Anodyne	NPY2R	44	35
O=C(NCc1ccc(F)cn1)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875385457	FF	On-Demand	Anodyne	SLC27A1	41	34
N#Cc1cc(F)ccc1N1CCN(C(=O)NCc2ccc(F)cn2)CC1	ZINC000875385458	FE	On-Demand	Mild	P2RY12	18	46
O=C(NCCC1CCN(Cc2ccccc2)CC1)NCc1ccc(F)cn1	ZINC000875385479	FG	On-Demand	Anodyne	DRD2	20	48
O=C(NCCC1CCN(Cc2ccccc2)CC1)NCc1ccc(F)cn1	ZINC000875385479	FG	On-Demand	Anodyne	DRD4	41	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)NCc1ccc(F)cn1	ZINC000875385479	FG	On-Demand	Anodyne	ACHE	60	62
O=C(NCCC1CCN(Cc2ccccc2)CC1)NCc1ccc(F)cn1	ZINC000875385479	FG	On-Demand	Anodyne	HRH2	19	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)NCc1ccc(F)cn1	ZINC000875385479	FG	On-Demand	Anodyne	SLC6A3	25	53
O=C(NCCC1CCN(Cc2ccccc2)CC1)NCc1ccc(F)cn1	ZINC000875385479	FG	On-Demand	Anodyne	SIGMAR1	65	51
O=C(NCCC1CCN(Cc2ccccc2)CC1)NCc1ccc(F)cn1	ZINC000875385479	FG	On-Demand	Anodyne	SSTR5	42	39
O=C(NCCC1CCN(Cc2ccccc2)CC1)NCc1ccc(F)cn1	ZINC000875385479	FG	On-Demand	Anodyne	BCHE	16	49
O=C(NCCC1CCN(Cc2ccccc2)CC1)NCc1ccc(F)cn1	ZINC000875385479	FG	On-Demand	Anodyne	CCR3	77	52
O=C(NCCC1CCN(Cc2ccccc2)CC1)NCc1ccc(F)cn1	ZINC000875385479	FG	On-Demand	Anodyne	SCN5A	25	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)NCc1ccc(F)cn1	ZINC000875385479	FG	On-Demand	Anodyne	MCHR1	35	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)NCc1ccc(F)cn1	ZINC000875385479	FG	On-Demand	Anodyne	CACNA1G	39	45
CCNS(=O)(=O)c1ccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875385488	FD	On-Demand	Anodyne	NPY2R	20	50
CCNS(=O)(=O)c1ccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875385488	FD	On-Demand	Anodyne	SFRP1	49	35
CCNS(=O)(=O)c1ccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)cc1	ZINC000875385488	FD	On-Demand	Anodyne	NAMPT	43	42
CCNS(=O)(=O)c1ccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875385489	FD	On-Demand	Anodyne	NPY2R	20	50
CCNS(=O)(=O)c1ccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875385489	FD	On-Demand	Anodyne	SFRP1	49	35
CCNS(=O)(=O)c1ccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)cc1	ZINC000875385489	FD	On-Demand	Anodyne	NAMPT	43	42
O=C(NCc1ccc(F)cn1)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875385499	EG	On-Demand	Anodyne	C3AR1	38	43
O=C(NCc1ccc(F)cn1)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875385499	EG	On-Demand	Anodyne	NAMPT	38	40
O=C(NCc1ccc(F)cn1)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875385500	EG	On-Demand	Anodyne	C3AR1	38	43
O=C(NCc1ccc(F)cn1)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875385500	EG	On-Demand	Anodyne	NAMPT	38	40
CN1CCN(C2CCN(C(=O)NCc3csc(-c4ccco4)n3)CC2)CC1	ZINC000875385570	GE	On-Demand	Anodyne	L3MBTL3	40	37
CN1CCN(C2CCN(C(=O)NCc3csc(-c4ccco4)n3)CC2)CC1	ZINC000875385570	GE	On-Demand	Anodyne	ETHR	41	33
C[C@@](NC(=O)Cc1ccc2cccnc2c1)(C1CC1)C(F)(F)F	ZINC000875385620	DH	On-Demand	Anodyne	CDK5	17	45
C[C@@](NC(=O)Cc1cn2cc(F)ccc2n1)(C1CC1)C(F)(F)F	ZINC000875385658	EF	On-Demand	Anodyne	MAP3K5	20	41
COC(=O)N(C)NC(=O)NCCOc1cc(OC)cc(OC)c1	ZINC000875385711	EC	On-Demand	Reactive	MTNR1A	40	48
COC(=O)N(C)NC(=O)NCCOc1cc(OC)cc(OC)c1	ZINC000875385711	EC	On-Demand	Reactive	MTNR1B	29	48
CCNS(=O)(=O)c1ccc(CNC(=O)N2Cc3cccc(O)c3C2)cc1	ZINC000875385712	GD	On-Demand	Clean	NAMPT	42	56
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccncc1	ZINC000875385750	DD	On-Demand	Anodyne	SLC6A3	47	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccncc1	ZINC000875385751	DD	On-Demand	Anodyne	SLC6A3	47	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC(=O)N[C@H]2CCC[C@@H]2O)cc1	ZINC000875385754	GF	On-Demand	Anodyne	FPR1	40	34
Cc1nc(CCNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)sc1C	ZINC000875385767	FF	On-Demand	Anodyne	CTSV	27	41
Cc1nc(CCNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)sc1C	ZINC000875385768	FF	On-Demand	Anodyne	CTSV	27	41
CO[C@H](CNC(=O)N1CCC(C(=O)NCCO)CC1)c1ccccc1Cl	ZINC000875385783	GD	On-Demand	Anodyne	EPHX2	21	48
O=c1c2cc3ccccc3cc2ncn1C[C@H](O)COc1cccc2ccccc12	ZINC000875385784	GI	On-Demand	Bother	ADRB2	16	48
O=c1c2cc3ccccc3cc2ncn1C[C@H](O)COc1cccc2ccccc12	ZINC000875385784	GI	On-Demand	Bother	ABCB1	44	41
O=c1c2cc3ccccc3cc2ncn1C[C@H](O)COc1cccc2ccccc12	ZINC000875385784	GI	On-Demand	Bother	POLR1A	44	30
O=c1c2cc3ccccc3cc2ncn1C[C@@H](O)COc1cccc2ccccc12	ZINC000875385785	GI	On-Demand	Bother	ADRB2	16	48
O=c1c2cc3ccccc3cc2ncn1C[C@@H](O)COc1cccc2ccccc12	ZINC000875385785	GI	On-Demand	Bother	ABCB1	44	41
O=c1c2cc3ccccc3cc2ncn1C[C@@H](O)COc1cccc2ccccc12	ZINC000875385785	GI	On-Demand	Bother	POLR1A	44	30
CN1CCN(C2CCN(C(=O)NCc3ccc(F)cn3)CC2)CC1	ZINC000875385800	ED	On-Demand	Anodyne	HRH3	19	48
CN1CCN(C2CCN(C(=O)NCc3ccc(F)cn3)CC2)CC1	ZINC000875385800	ED	On-Demand	Anodyne	L3MBTL3	67	42
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CN(C(=O)NCc1ccc(F)cn1)C2	ZINC000875385832	FF	On-Demand	Anodyne	GPR119	41	41
O=C(NC1CCN(C(=O)NCc2ccc(F)cn2)CC1)OCc1ccccc1	ZINC000875385854	GF	On-Demand	Anodyne	GRIN2B	29	41
O=C(NC1CCN(C(=O)NCc2ccc(F)cn2)CC1)OCc1ccccc1	ZINC000875385854	GF	On-Demand	Anodyne	SIGMAR1	16	41
O=C(NC1CCN(C(=O)NCc2ccc(F)cn2)CC1)OCc1ccccc1	ZINC000875385854	GF	On-Demand	Anodyne	SSTR5	25	40
O=C(NC1CCN(C(=O)NCc2ccc(F)cn2)CC1)OCc1ccccc1	ZINC000875385854	GF	On-Demand	Anodyne	CTSB	15	48
O=C(NC1CCN(C(=O)NCc2ccc(F)cn2)CC1)OCc1ccccc1	ZINC000875385854	GF	On-Demand	Anodyne	CTSK	19	48
O=C(NC1CCN(C(=O)NCc2ccc(F)cn2)CC1)OCc1ccccc1	ZINC000875385854	GF	On-Demand	Anodyne	CTSL	20	48
O=C(NC1CCN(C(=O)NCc2ccc(F)cn2)CC1)OCc1ccccc1	ZINC000875385854	GF	On-Demand	Anodyne	EPHX2	43	40
O=C(NC1CCN(C(=O)NCc2ccc(F)cn2)CC1)OCc1ccccc1	ZINC000875385854	GF	On-Demand	Anodyne	TGM2	33	42
O=C(NC1CCN(C(=O)NCc2ccc(F)cn2)CC1)OCc1ccccc1	ZINC000875385854	GF	On-Demand	Anodyne	F13A1	20	42
O=C(NCc1ccc(F)cn1)N1CCC[C@](F)(c2ccccc2)C1	ZINC000875385862	EG	On-Demand	Anodyne	EPHX2	17	45
O=C(NCc1ccc(F)cn1)N1CCC[C@@](F)(c2ccccc2)C1	ZINC000875385863	EG	On-Demand	Anodyne	EPHX2	17	45
COCCN(CC1CCN(C)CC1)C(=O)NC[C@H](OC)c1ccccc1Cl	ZINC000875385948	GG	On-Demand	Anodyne	CACNA1I	49	33
COCCN(CC1CCN(C)CC1)C(=O)NC[C@@H](OC)c1ccccc1Cl	ZINC000875385949	GG	On-Demand	Anodyne	CACNA1I	49	33
O=C(NCc1ccc(F)cn1)NCc1nc(C(F)(F)F)n2c1CCCC2	ZINC000875386024	FF	On-Demand	Anodyne	SLC27A1	42	34
O=C(NCc1ccc(F)cn1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875386034	EG	On-Demand	Anodyne	CPT1A	56	37
O=C(NCc1ccc(F)cn1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875386035	EG	On-Demand	Anodyne	CPT1A	56	37
O=C(NCc1ccc(F)cn1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875386036	EG	On-Demand	Anodyne	CPT1A	56	37
O=C(NCc1ccc(F)cn1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875386037	EG	On-Demand	Anodyne	CPT1A	56	37
O=C(NCc1ccc(F)cn1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875386054	DF	On-Demand	Anodyne	EPHX2	22	46
O=C(NCc1ccc(F)cn1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875386055	DF	On-Demand	Anodyne	EPHX2	22	46
CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H](CNC(=O)NCc1ccc(F)cn1)C2	ZINC000875386058	GG	On-Demand	Anodyne	GPR119	34	43
N#Cc1ccc(N2CCN(C(=O)NCc3ccc(F)cn3)CC2)cc1	ZINC000875386097	EE	On-Demand	Mild	SLC27A1	49	32
C[S@](=N)(=O)N1CCN(C(=O)NCCc2ccncc2)CC1	ZINC000875386114	DC	On-Demand	Anodyne	CA5B	16	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1csc(-c2ccco2)n1	ZINC000875386117	FF	On-Demand	Anodyne	SLC6A4	25	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1csc(-c2ccco2)n1	ZINC000875386117	FF	On-Demand	Anodyne	SLC6A3	46	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1csc(-c2ccco2)n1	ZINC000875386118	FF	On-Demand	Anodyne	SLC6A4	25	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1csc(-c2ccco2)n1	ZINC000875386118	FF	On-Demand	Anodyne	SLC6A3	46	44
O=C(NCCc1ccncc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875386128	EF	On-Demand	Anodyne	CCR3	27	45
O=C(NCCc1ccncc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875386128	EF	On-Demand	Anodyne	MLNR	26	44
O=C(NCCc1ccncc1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875386128	EF	On-Demand	Anodyne	EPHX2	27	51
Cc1nc(CCNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)sc1C	ZINC000875386170	GG	On-Demand	Mild	ITK	15	47
CCNS(=O)(=O)c1ccc(CNC(=O)N2CCN(C)C(C)(C)CC2)cc1	ZINC000875386174	GD	On-Demand	Anodyne	NAMPT	34	40
CC[C@H](C[C@H](C)O)NC(=O)NCCOc1cc(OC)cc(OC)c1	ZINC000875386194	ED	On-Demand	Anodyne	MTNR1A	16	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](OC)c1ccccc1Cl	ZINC000875386206	FF	On-Demand	Anodyne	OPRL1	40	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](OC)c1ccccc1Cl	ZINC000875386206	FF	On-Demand	Anodyne	SLC6A3	54	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](OC)c1ccccc1Cl	ZINC000875386210	FF	On-Demand	Anodyne	OPRL1	40	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](OC)c1ccccc1Cl	ZINC000875386210	FF	On-Demand	Anodyne	SLC6A3	54	39
N#Cc1ccc(N2CCN(C(=O)NCCc3ccncc3)CC2)cn1	ZINC000875386211	ED	On-Demand	Mild	CTSK	26	43
N#Cc1ccc(N2CCN(C(=O)NCCc3ccncc3)CC2)cn1	ZINC000875386211	ED	On-Demand	Mild	CTSL	17	43
N#Cc1ccc(N2CCN(C(=O)NCCc3ccncc3)CC2)cn1	ZINC000875386211	ED	On-Demand	Mild	GPBAR1	22	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](OC)c1ccccc1Cl	ZINC000875386212	FF	On-Demand	Anodyne	OPRL1	40	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](OC)c1ccccc1Cl	ZINC000875386212	FF	On-Demand	Anodyne	SLC6A3	54	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](OC)c1ccccc1Cl	ZINC000875386213	FF	On-Demand	Anodyne	OPRL1	40	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](OC)c1ccccc1Cl	ZINC000875386213	FF	On-Demand	Anodyne	SLC6A3	54	39
Cc1nc(CCNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)sc1C	ZINC000875386227	FG	On-Demand	Anodyne	TRY1_BOVIN	46	34
Cc1nc(CCNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)sc1C	ZINC000875386228	FG	On-Demand	Anodyne	TRY1_BOVIN	46	34
O=C(NCc1ccc(F)cn1)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875386252	FF	On-Demand	Anodyne	EPHX2	17	40
O=C(NCc1ccc(F)cn1)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875386252	FF	On-Demand	Anodyne	SLC12A5	58	36
Cc1nc(CCNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)sc1C	ZINC000875386300	FG	On-Demand	Anodyne	TRY1_BOVIN	46	34
Cc1nc(CCNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)sc1C	ZINC000875386301	FG	On-Demand	Anodyne	TRY1_BOVIN	46	34
COc1cccc([C@H](O)C2CCN(C(=O)NCc3ccc(F)cn3)CC2)c1	ZINC000875386329	FF	On-Demand	Anodyne	CCR3	15	40
COc1ccc(N2CCN(C(=O)NCc3ccc(F)cn3)CC2)c(OC)c1	ZINC000875386339	FE	On-Demand	Clean	HTR1A	53	42
COc1ccc(N2CCN(C(=O)NCc3ccc(F)cn3)CC2)c(OC)c1	ZINC000875386339	FE	On-Demand	Clean	DRD2	43	41
COc1ccc(N2CCN(C(=O)NCc3ccc(F)cn3)CC2)c(OC)c1	ZINC000875386339	FE	On-Demand	Clean	DRD4	40	32
COc1ccc(N2CCN(C(=O)NCc3ccc(F)cn3)CC2)c(OC)c1	ZINC000875386339	FE	On-Demand	Clean	ADRA1D	35	42
COc1ccc(N2CCN(C(=O)NCc3ccc(F)cn3)CC2)c(OC)c1	ZINC000875386339	FE	On-Demand	Clean	HTR1D	15	43
COc1ccc(N2CCN(C(=O)NCc3ccc(F)cn3)CC2)c(OC)c1	ZINC000875386339	FE	On-Demand	Clean	HTR1B	19	43
COc1ccc(N2CCN(C(=O)NCc3ccc(F)cn3)CC2)c(OC)c1	ZINC000875386339	FE	On-Demand	Clean	ADRA1A	34	42
COc1ccc(N2CCN(C(=O)NCc3ccc(F)cn3)CC2)c(OC)c1	ZINC000875386339	FE	On-Demand	Clean	DRD3	58	39
COc1ccc(N2CCN(C(=O)NCc3ccc(F)cn3)CC2)c(OC)c1	ZINC000875386339	FE	On-Demand	Clean	PDGFRB	63	40
COc1ccc(N2CCN(C(=O)NCc3ccc(F)cn3)CC2)c(OC)c1	ZINC000875386339	FE	On-Demand	Clean	HTR7	43	42
COc1ccc(N2CCN(C(=O)NCc3ccc(F)cn3)CC2)c(OC)c1	ZINC000875386339	FE	On-Demand	Clean	CSF1R	18	41
COc1ccc(N2CCN(C(=O)NCc3ccc(F)cn3)CC2)c(OC)c1	ZINC000875386339	FE	On-Demand	Clean	NPBWR1	48	33
CO[C@@H]1CC[C@@H](C)N(C(=O)NCc2ccc(F)cn2)C1	ZINC000875386401	CD	On-Demand	Anodyne	HCRTR1	20	40
C[C@]1(C(F)(F)F)CCN(C(=O)NCCc2ccncc2)C1	ZINC000875386418	DF	On-Demand	Anodyne	EPHX2	15	46
CC(=O)Nc1cccc2c1CN(C(=O)NCc1ccc(F)cn1)CC2	ZINC000875386468	EE	On-Demand	Anodyne	MAPK1	30	42
O=C(NCCc1ccncc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875386469	EE	On-Demand	Anodyne	ADRB1	28	40
O=C(NCCc1ccncc1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875386469	EE	On-Demand	Anodyne	ADRB3	27	40
O=C(NCCc1ccncc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875386471	EE	On-Demand	Anodyne	ADRB1	28	40
O=C(NCCc1ccncc1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875386471	EE	On-Demand	Anodyne	ADRB3	27	40
Cc1cccc(CN2CCO[C@@H](CNC(=O)NCc3ccc(F)cn3)C2)c1	ZINC000875386488	FE	On-Demand	Anodyne	CCR3	21	51
Cc1cccc(CN2CCO[C@@H](CNC(=O)NCc3ccc(F)cn3)C2)c1	ZINC000875386488	FE	On-Demand	Anodyne	MLNR	52	33
Cc1cccc(CN2CCO[C@H](CNC(=O)NCc3ccc(F)cn3)C2)c1	ZINC000875386489	FE	On-Demand	Anodyne	CCR3	21	51
Cc1cccc(CN2CCO[C@H](CNC(=O)NCc3ccc(F)cn3)C2)c1	ZINC000875386489	FE	On-Demand	Anodyne	MLNR	52	33
O=C(NCc1ccc(F)cn1)NCc1cc2c(nc1O)CCCC2	ZINC000875386514	EE	On-Demand	Anodyne	SLC27A1	42	34
O=C(NCc1ccc(F)cn1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875386528	EE	On-Demand	Anodyne	EPHX2	17	45
O=C(NCc1ccc(F)cn1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875386529	EE	On-Demand	Anodyne	EPHX2	17	45
CN1CCC(CNC(=O)NCc2ccc(F)cn2)(c2ccccc2)CC1	ZINC000875386538	FF	On-Demand	Anodyne	KCNA3	54	38
CN1CCC(CNC(=O)NCc2ccc(F)cn2)(c2ccccc2)CC1	ZINC000875386538	FF	On-Demand	Anodyne	SOAT1	15	40
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccc(F)cn2)CC1	ZINC000875386565	FH	On-Demand	Anodyne	DRD2	15	42
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccc(F)cn2)CC1	ZINC000875386565	FH	On-Demand	Anodyne	GRIN2B	18	47
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccc(F)cn2)CC1	ZINC000875386565	FH	On-Demand	Anodyne	EPHX2	16	44
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccc(F)cn2)CC1	ZINC000875386565	FH	On-Demand	Anodyne	RBP4	36	40
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccc(F)cn2)CC1	ZINC000875386565	FH	On-Demand	Anodyne	ACKR3	51	31
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccc(F)cn2)CC1	ZINC000875386566	FH	On-Demand	Anodyne	DRD2	15	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccc(F)cn2)CC1	ZINC000875386566	FH	On-Demand	Anodyne	GRIN2B	18	47
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccc(F)cn2)CC1	ZINC000875386566	FH	On-Demand	Anodyne	EPHX2	16	44
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccc(F)cn2)CC1	ZINC000875386566	FH	On-Demand	Anodyne	RBP4	36	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccc(F)cn2)CC1	ZINC000875386566	FH	On-Demand	Anodyne	ACKR3	51	31
O=C(NCc1cnn(CC(F)(F)F)c1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875386569	GF	On-Demand	Anodyne	PREP	20	41
O=C(NCc1cnn(CC(F)(F)F)c1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875386570	GF	On-Demand	Anodyne	PREP	20	41
O=C(NCc1cnn(CC(F)(F)F)c1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875386571	GF	On-Demand	Anodyne	PREP	20	41
O=C(NCc1cnn(CC(F)(F)F)c1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875386572	GF	On-Demand	Anodyne	PREP	20	41
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC(=O)N2CC=CC2)cc1	ZINC000875386610	EG	On-Demand	Anodyne	FPR1	42	33
O=C(NCCC[C@@H]1CCOC1=O)NCCc1ccncc1	ZINC000875386679	CD	On-Demand	Anodyne	LUXR	63	36
O=C(NCCC[C@@H]1CCOC1=O)NCCc1ccncc1	ZINC000875386679	CD	On-Demand	Anodyne	TRAR	58	36
O=C(NCCC[C@H]1CCOC1=O)NCCc1ccncc1	ZINC000875386680	CD	On-Demand	Anodyne	LUXR	63	36
O=C(NCCC[C@H]1CCOC1=O)NCCc1ccncc1	ZINC000875386680	CD	On-Demand	Anodyne	TRAR	58	36
C[C@@](NC(=O)Cc1ccc(OCc2ccncc2)cc1)(C1CC1)C(F)(F)F	ZINC000875386746	GI	On-Demand	Anodyne	ADAM17	19	44
C[C@@](NC(=O)Cc1ccc(OCc2ccncc2)cc1)(C1CC1)C(F)(F)F	ZINC000875386746	GI	On-Demand	Anodyne	SLC6A5	32	42
O=C(NNc1ccccn1)Nc1nccs1	ZINC000875386788	BD	On-Demand	Reactive	MAP1	132	45
C[C@@H]1CN(C(=O)NCc2csc(-c3ccco3)n2)CC[C@@H](C(F)(F)F)O1	ZINC000875386869	GH	On-Demand	Anodyne	ETHR	45	32
C[C@@H]1CN(C(=O)NCc2csc(-c3ccco3)n2)CC[C@H](C(F)(F)F)O1	ZINC000875386870	GH	On-Demand	Anodyne	ETHR	45	32
O=C(NCc1csc(-c2ccco2)n1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875386872	GG	On-Demand	Anodyne	ETHR	57	33
O=C(NCc1csc(-c2ccco2)n1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875386873	GG	On-Demand	Anodyne	ETHR	57	33
CCNS(=O)(=O)c1ccc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875386893	GD	On-Demand	Anodyne	F2	19	40
CCNS(=O)(=O)c1ccc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875386893	GD	On-Demand	Anodyne	SFRP1	55	35
CCNS(=O)(=O)c1ccc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875386893	GD	On-Demand	Anodyne	WNT3	53	35
CCNS(=O)(=O)c1ccc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)cc1	ZINC000875386893	GD	On-Demand	Anodyne	NAMPT	44	42
CCNS(=O)(=O)c1ccc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875386894	GD	On-Demand	Anodyne	F2	19	40
CCNS(=O)(=O)c1ccc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875386894	GD	On-Demand	Anodyne	SFRP1	55	35
CCNS(=O)(=O)c1ccc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875386894	GD	On-Demand	Anodyne	WNT3	53	35
CCNS(=O)(=O)c1ccc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)cc1	ZINC000875386894	GD	On-Demand	Anodyne	NAMPT	44	42
O=C(NCc1ccc(F)cn1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875386920	FF	On-Demand	Anodyne	SMO	39	43
O=C(NCc1ccc(F)cn1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875386920	FF	On-Demand	Anodyne	ETHR	68	48
CO[C@H](CNC(=O)N1CC(CNC(=O)C(F)(F)F)C1)c1ccccc1Cl	ZINC000875386960	GE	On-Demand	Anodyne	CACNA1I	44	32
CC(C)(C)OC(=O)N1C[C@@H]2CN(C(=O)NCCc3ccncc3)C[C@]2(C)C1	ZINC000875386993	FF	On-Demand	Anodyne	GPR119	22	40
CCNS(=O)(=O)c1ccc(CNC(=O)NC2(C)CC(F)(F)C2)cc1	ZINC000875387031	FD	On-Demand	Anodyne	NAMPT	47	36
O=C(NCCc1ccncc1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875387033	ED	On-Demand	Anodyne	ETHR	59	35
O=C(NCCc1ccncc1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875387035	ED	On-Demand	Anodyne	ETHR	59	35
CC(=O)[C@H]1CCCN(C(=O)NCCc2ccncc2)C1	ZINC000875387042	CD	On-Demand	Anodyne	DPP7	38	44
CC(=O)[C@H]1CCCN(C(=O)NCCc2ccncc2)C1	ZINC000875387042	CD	On-Demand	Anodyne	GPBAR1	25	44
CC(=O)[C@H]1CCCN(C(=O)NCCc2ccncc2)C1	ZINC000875387042	CD	On-Demand	Anodyne	BIRC2	20	41
CC(=O)[C@@H]1CCCN(C(=O)NCCc2ccncc2)C1	ZINC000875387043	CD	On-Demand	Anodyne	DPP7	38	44
CC(=O)[C@@H]1CCCN(C(=O)NCCc2ccncc2)C1	ZINC000875387043	CD	On-Demand	Anodyne	GPBAR1	25	44
CC(=O)[C@@H]1CCCN(C(=O)NCCc2ccncc2)C1	ZINC000875387043	CD	On-Demand	Anodyne	BIRC2	20	41
O=C(N[C@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2ccncc2)C1	ZINC000875387070	FD	On-Demand	Anodyne	GPBAR1	23	44
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2ccncc2)C1	ZINC000875387071	FD	On-Demand	Anodyne	GPBAR1	23	44
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2ccncc2)C1	ZINC000875387072	FD	On-Demand	Anodyne	GPBAR1	23	44
O=C(N[C@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCCc2ccncc2)C1	ZINC000875387073	FD	On-Demand	Anodyne	GPBAR1	23	44
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(F)cn1	ZINC000875387100	ED	On-Demand	Anodyne	ACKR3	45	31
O=C(NCc1ccc(CN2CCNC2=O)cc1)NCc1ccc(F)cn1	ZINC000875387163	FD	On-Demand	Anodyne	SCD	15	42
Cc1ccc(CN2CCO[C@H](CNC(=O)NCc3ccc(F)cn3)C2)cc1	ZINC000875387181	FE	On-Demand	Anodyne	DRD4	15	41
Cc1ccc(CN2CCO[C@H](CNC(=O)NCc3ccc(F)cn3)C2)cc1	ZINC000875387181	FE	On-Demand	Anodyne	CCR3	18	54
Cc1ccc(CN2CCO[C@H](CNC(=O)NCc3ccc(F)cn3)C2)cc1	ZINC000875387181	FE	On-Demand	Anodyne	MLNR	55	38
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NCc2ccc(F)cn2)C(C)(C)C1	ZINC000875387201	GG	On-Demand	Anodyne	GPR119	51	42
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCc2ccc(F)cn2)C(C)(C)C1	ZINC000875387202	GG	On-Demand	Anodyne	GPR119	51	42
Cc1c(NC(=O)[C@H](c2cccnc2)C2CCCCC2)cccc1N1CCOC1=O	ZINC000875387226	GJ	On-Demand	Anodyne	KCNQ2	41	34
Cc1c(NC(=O)[C@H](c2cccnc2)C2CCCCC2)cccc1N1CCOC1=O	ZINC000875387226	GJ	On-Demand	Anodyne	C3AR1	43	44
Cc1c(NC(=O)[C@@H](c2cccnc2)C2CCCCC2)cccc1N1CCOC1=O	ZINC000875387227	GJ	On-Demand	Anodyne	KCNQ2	41	34
Cc1c(NC(=O)[C@@H](c2cccnc2)C2CCCCC2)cccc1N1CCOC1=O	ZINC000875387227	GJ	On-Demand	Anodyne	C3AR1	43	44
C#CC[C@H](COC)NC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387251	EE	On-Demand	Mild	CTSG	24	42
C#CC[C@H](COC)NC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387251	EE	On-Demand	Mild	CTRB1	37	42
C#CC[C@H](COC)NC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387251	EE	On-Demand	Mild	CELA2A	21	42
C#CC[C@@H](COC)NC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387252	EE	On-Demand	Mild	CTSG	24	42
C#CC[C@@H](COC)NC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387252	EE	On-Demand	Mild	CTRB1	37	42
C#CC[C@@H](COC)NC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387252	EE	On-Demand	Mild	CELA2A	21	42
C#CC[C@H](COC)NC(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387253	EE	On-Demand	Mild	CTSG	24	42
C#CC[C@H](COC)NC(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387253	EE	On-Demand	Mild	CTRB1	37	42
C#CC[C@H](COC)NC(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387253	EE	On-Demand	Mild	CELA2A	21	42
C#CC[C@@H](COC)NC(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387254	EE	On-Demand	Mild	CTSG	24	42
C#CC[C@@H](COC)NC(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387254	EE	On-Demand	Mild	CTRB1	37	42
C#CC[C@@H](COC)NC(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387254	EE	On-Demand	Mild	CELA2A	21	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)cc1C	ZINC000875387300	EE	On-Demand	Anodyne	SLC6A4	26	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)cc1C	ZINC000875387300	EE	On-Demand	Anodyne	SLC6A3	49	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)cc1C	ZINC000875387301	EE	On-Demand	Anodyne	SLC6A4	26	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)cc1C	ZINC000875387301	EE	On-Demand	Anodyne	SLC6A3	49	41
O=C(NCc1nc(C2CC2)cs1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875387308	FH	On-Demand	Anodyne	F2	18	40
O=C(NCc1nc(C2CC2)cs1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875387308	FH	On-Demand	Anodyne	CPT1A	84	39
O=C(NCc1nc(C2CC2)cs1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875387309	FH	On-Demand	Anodyne	F2	18	40
O=C(NCc1nc(C2CC2)cs1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875387309	FH	On-Demand	Anodyne	CPT1A	84	39
O=C(NCc1nc(C2CC2)cs1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875387310	FH	On-Demand	Anodyne	F2	18	40
O=C(NCc1nc(C2CC2)cs1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875387310	FH	On-Demand	Anodyne	CPT1A	84	39
O=C(NCc1nc(C2CC2)cs1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875387311	FH	On-Demand	Anodyne	F2	18	40
O=C(NCc1nc(C2CC2)cs1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875387311	FH	On-Demand	Anodyne	CPT1A	84	39
O=CN1CCCN(C(=O)NCCc2ccc(-c3ccccc3)cc2)CC1	ZINC000875387331	FF	On-Demand	Anodyne	FAAH	17	40
O=CN1CCCN(C(=O)NCCc2ccc(-c3ccccc3)cc2)CC1	ZINC000875387331	FF	On-Demand	Anodyne	DPP7	22	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(C3CCCCC3)C2=O)C1	ZINC000875387402	FD	On-Demand	Anodyne	BIRC2	48	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(C3CCCCC3)C2=O)C1	ZINC000875387403	FD	On-Demand	Anodyne	BIRC2	48	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387611	GF	On-Demand	Anodyne	SLC6A4	25	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387611	GF	On-Demand	Anodyne	SLC6A3	59	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387611	GF	On-Demand	Anodyne	AMY2	43	30
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387613	GF	On-Demand	Anodyne	SLC6A4	25	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387613	GF	On-Demand	Anodyne	SLC6A3	59	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387613	GF	On-Demand	Anodyne	AMY2	43	30
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387615	GF	On-Demand	Anodyne	SLC6A4	25	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387615	GF	On-Demand	Anodyne	SLC6A3	59	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387615	GF	On-Demand	Anodyne	AMY2	43	30
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387617	GF	On-Demand	Anodyne	SLC6A4	25	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387617	GF	On-Demand	Anodyne	SLC6A3	59	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387617	GF	On-Demand	Anodyne	AMY2	43	30
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000875387621	DE	On-Demand	Anodyne	MME	45	40
O=C(NC[C@H]1C[C@H](O)C1)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000875387623	DE	On-Demand	Anodyne	MME	45	40
O=C(N[C@H](Cc1ccccc1)C(F)(F)F)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875387644	GH	On-Demand	Anodyne	CTSD	15	40
O=C(N[C@H](Cc1ccccc1)C(F)(F)F)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875387644	GH	On-Demand	Anodyne	REN	25	42
O=C(N[C@H](Cc1ccccc1)C(F)(F)F)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875387650	GH	On-Demand	Anodyne	CTSD	15	40
O=C(N[C@H](Cc1ccccc1)C(F)(F)F)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875387650	GH	On-Demand	Anodyne	REN	25	42
O=C(N[C@@H](Cc1ccccc1)C(F)(F)F)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875387651	GH	On-Demand	Anodyne	CTSD	15	40
O=C(N[C@@H](Cc1ccccc1)C(F)(F)F)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875387651	GH	On-Demand	Anodyne	REN	25	42
O=C(N[C@@H](Cc1ccccc1)C(F)(F)F)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875387653	GH	On-Demand	Anodyne	CTSD	15	40
O=C(N[C@@H](Cc1ccccc1)C(F)(F)F)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875387653	GH	On-Demand	Anodyne	REN	25	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1c(C)cccc1C	ZINC000875387695	DF	On-Demand	Anodyne	SLC6A4	33	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1c(C)cccc1C	ZINC000875387695	DF	On-Demand	Anodyne	SLC6A3	64	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1c(C)cccc1C	ZINC000875387696	DF	On-Demand	Anodyne	SLC6A4	33	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1c(C)cccc1C	ZINC000875387696	DF	On-Demand	Anodyne	SLC6A3	64	40
CN1CCN(C(=O)NCC[C@H]2COc3ccccc3O2)CCC1(C)C	ZINC000875387709	EE	On-Demand	Anodyne	ADRA2B	15	41
CN1CCN(C(=O)NCC[C@@H]2COc3ccccc3O2)CCC1(C)C	ZINC000875387710	EE	On-Demand	Anodyne	ADRA2B	15	41
COC(=O)N(C)NC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000875387713	FD	On-Demand	Reactive	HTR1A	87	60
COC(=O)N(C)NC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000875387713	FD	On-Demand	Reactive	DRD2	73	55
COC(=O)N(C)NC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000875387713	FD	On-Demand	Reactive	DRD1	19	41
COC(=O)N(C)NC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000875387713	FD	On-Demand	Reactive	DRD4	60	50
COC(=O)N(C)NC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000875387713	FD	On-Demand	Reactive	ADRA1D	34	44
COC(=O)N(C)NC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000875387713	FD	On-Demand	Reactive	HTR2A	67	54
COC(=O)N(C)NC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000875387713	FD	On-Demand	Reactive	HTR2C	41	46
COC(=O)N(C)NC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000875387713	FD	On-Demand	Reactive	SLC6A4	19	46
COC(=O)N(C)NC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000875387713	FD	On-Demand	Reactive	ADRA1A	37	44
COC(=O)N(C)NC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000875387713	FD	On-Demand	Reactive	ADRA1B	23	44
COC(=O)N(C)NC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000875387713	FD	On-Demand	Reactive	DRD3	105	60
COC(=O)N(C)NC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000875387713	FD	On-Demand	Reactive	HTR4	24	46
COC(=O)N(C)NC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000875387713	FD	On-Demand	Reactive	HTR7	76	46
COC(=O)N(C)NC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000875387713	FD	On-Demand	Reactive	PLD2	40	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(F)cn1	ZINC000875387803	DD	On-Demand	Anodyne	SLC6A4	27	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(F)cn1	ZINC000875387803	DD	On-Demand	Anodyne	SLC6A3	56	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(F)cn1	ZINC000875387804	DD	On-Demand	Anodyne	SLC6A4	27	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(F)cn1	ZINC000875387804	DD	On-Demand	Anodyne	SLC6A3	56	42
COC(=O)C1(O)CN(C(=O)NCc2ccc(OC)cc2C)C1	ZINC000875387816	DC	On-Demand	Anodyne	MTNR1A	46	37
CC[C@@H]1COCCN1CCNC(=O)NCc1ccc(OC)cc1C	ZINC000875387823	ED	On-Demand	Anodyne	DRD4	40	33
CC[C@@H](NC(=O)NCc1ccc(OC)cc1C)[C@@H](O)c1ccccc1	ZINC000875387863	EG	On-Demand	Anodyne	MTNR1A	48	37
CC[C@@H](NC(=O)NCc1ccc(OC)cc1C)[C@@H](O)c1ccccc1	ZINC000875387863	EG	On-Demand	Anodyne	MTNR1B	41	37
CC[C@@H](NC(=O)NCc1ccc(OC)cc1C)[C@H](O)c1ccccc1	ZINC000875387869	EG	On-Demand	Anodyne	MTNR1A	48	37
CC[C@@H](NC(=O)NCc1ccc(OC)cc1C)[C@H](O)c1ccccc1	ZINC000875387869	EG	On-Demand	Anodyne	MTNR1B	41	37
C#CC[C@@H](CCOC)NC(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387911	FF	On-Demand	Mild	CTSG	26	43
C#CC[C@@H](CCOC)NC(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387911	FF	On-Demand	Mild	CTRB1	39	43
C#CC[C@@H](CCOC)NC(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387911	FF	On-Demand	Mild	CELA2A	24	43
C#CC[C@H](CCOC)NC(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387913	FF	On-Demand	Mild	CTSG	26	43
C#CC[C@H](CCOC)NC(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387913	FF	On-Demand	Mild	CTRB1	39	43
C#CC[C@H](CCOC)NC(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387913	FF	On-Demand	Mild	CELA2A	24	43
C#CC[C@@H](CCOC)NC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387915	FF	On-Demand	Mild	CTSG	26	43
C#CC[C@@H](CCOC)NC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387915	FF	On-Demand	Mild	CTRB1	39	43
C#CC[C@@H](CCOC)NC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387915	FF	On-Demand	Mild	CELA2A	24	43
C#CC[C@H](CCOC)NC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387916	FF	On-Demand	Mild	CTSG	26	43
C#CC[C@H](CCOC)NC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387916	FF	On-Demand	Mild	CTRB1	39	43
C#CC[C@H](CCOC)NC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875387916	FF	On-Demand	Mild	CELA2A	24	43
C[C@H]1CC[C@@H](C)CN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875387930	EG	On-Demand	Anodyne	CTRA_BOVIN	52	31
C[C@H]1CC[C@@H](C)CN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875387930	EG	On-Demand	Anodyne	KLK3	40	30
C[C@H]1CC[C@@H](C)CN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875387930	EG	On-Demand	Anodyne	CTSB	34	47
C[C@H]1CC[C@@H](C)CN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875387930	EG	On-Demand	Anodyne	CTSK	38	47
C[C@H]1CC[C@@H](C)CN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875387930	EG	On-Demand	Anodyne	CTSL	36	47
C[C@H]1CC[C@@H](C)CN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875387930	EG	On-Demand	Anodyne	CAPNS1	59	36
C[C@H]1CC[C@@H](C)CN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875387930	EG	On-Demand	Anodyne	CTSS	16	46
C[C@H]1CC[C@@H](C)CN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875387930	EG	On-Demand	Anodyne	CAPN1	50	39
C[C@H]1CC[C@@H](C)CN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875387930	EG	On-Demand	Anodyne	CAPN2	84	37
C[C@H]1CC[C@@H](C)CN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875387930	EG	On-Demand	Anodyne	NPR	49	35
C[C@H]1CC[C@@H](C)CN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875387930	EG	On-Demand	Anodyne	NAAA	52	37
C[C@H]1CC[C@@H](C)CN1C(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875387930	EG	On-Demand	Anodyne	SLC12A5	66	41
C[C@H]1CC[C@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387933	EG	On-Demand	Anodyne	CTRA_BOVIN	52	31
C[C@H]1CC[C@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387933	EG	On-Demand	Anodyne	KLK3	40	30
C[C@H]1CC[C@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387933	EG	On-Demand	Anodyne	CTSB	34	47
C[C@H]1CC[C@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387933	EG	On-Demand	Anodyne	CTSK	38	47
C[C@H]1CC[C@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387933	EG	On-Demand	Anodyne	CTSL	36	47
C[C@H]1CC[C@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387933	EG	On-Demand	Anodyne	CAPNS1	59	36
C[C@H]1CC[C@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387933	EG	On-Demand	Anodyne	CTSS	16	46
C[C@H]1CC[C@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387933	EG	On-Demand	Anodyne	CAPN1	50	39
C[C@H]1CC[C@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387933	EG	On-Demand	Anodyne	CAPN2	84	37
C[C@H]1CC[C@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387933	EG	On-Demand	Anodyne	NPR	49	35
C[C@H]1CC[C@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387933	EG	On-Demand	Anodyne	NAAA	52	37
C[C@H]1CC[C@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387933	EG	On-Demand	Anodyne	SLC12A5	66	41
C[C@@H]1CC[C@@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387934	EG	On-Demand	Anodyne	CTRA_BOVIN	52	31
C[C@@H]1CC[C@@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387934	EG	On-Demand	Anodyne	KLK3	40	30
C[C@@H]1CC[C@@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387934	EG	On-Demand	Anodyne	CTSB	34	47
C[C@@H]1CC[C@@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387934	EG	On-Demand	Anodyne	CTSK	38	47
C[C@@H]1CC[C@@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387934	EG	On-Demand	Anodyne	CTSL	36	47
C[C@@H]1CC[C@@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387934	EG	On-Demand	Anodyne	CAPNS1	59	36
C[C@@H]1CC[C@@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387934	EG	On-Demand	Anodyne	CTSS	16	46
C[C@@H]1CC[C@@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387934	EG	On-Demand	Anodyne	CAPN1	50	39
C[C@@H]1CC[C@@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387934	EG	On-Demand	Anodyne	CAPN2	84	37
C[C@@H]1CC[C@@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387934	EG	On-Demand	Anodyne	NPR	49	35
C[C@@H]1CC[C@@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387934	EG	On-Demand	Anodyne	NAAA	52	37
C[C@@H]1CC[C@@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387934	EG	On-Demand	Anodyne	SLC12A5	66	41
C[C@H]1CC[C@@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387935	EG	On-Demand	Anodyne	CTRA_BOVIN	52	31
C[C@H]1CC[C@@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387935	EG	On-Demand	Anodyne	KLK3	40	30
C[C@H]1CC[C@@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387935	EG	On-Demand	Anodyne	CTSB	34	47
C[C@H]1CC[C@@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387935	EG	On-Demand	Anodyne	CTSK	38	47
C[C@H]1CC[C@@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387935	EG	On-Demand	Anodyne	CTSL	36	47
C[C@H]1CC[C@@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387935	EG	On-Demand	Anodyne	CAPNS1	59	36
C[C@H]1CC[C@@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387935	EG	On-Demand	Anodyne	CTSS	16	46
C[C@H]1CC[C@@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387935	EG	On-Demand	Anodyne	CAPN1	50	39
C[C@H]1CC[C@@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387935	EG	On-Demand	Anodyne	CAPN2	84	37
C[C@H]1CC[C@@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387935	EG	On-Demand	Anodyne	NPR	49	35
C[C@H]1CC[C@@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387935	EG	On-Demand	Anodyne	NAAA	52	37
C[C@H]1CC[C@@H](C)N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1	ZINC000875387935	EG	On-Demand	Anodyne	SLC12A5	66	41
Cc1c(NC(=O)C2(C(F)F)CCC2)cccc1N1CCOC1=O	ZINC000875387984	DG	On-Demand	Anodyne	KCNQ2	52	33
O=C(NCc1ccc(F)cn1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875388065	ED	On-Demand	Anodyne	ETHR	60	36
O=C(NCc1ccc(F)cn1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875388066	ED	On-Demand	Anodyne	ETHR	60	36
CC[C@@H]1CN(S(C)(=O)=O)CC[C@@H]1NC(=O)NCc1cc(C)ccc1O	ZINC000875388076	FD	On-Demand	Clean	EPHX2	21	41
CC[C@@H]1CN(S(C)(=O)=O)CC[C@H]1NC(=O)NCc1cc(C)ccc1O	ZINC000875388077	FD	On-Demand	Clean	EPHX2	21	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nc(C(C)C)cs1	ZINC000875388113	EF	On-Demand	Anodyne	SLC6A3	41	35
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nc(C(C)C)cs1	ZINC000875388114	EF	On-Demand	Anodyne	SLC6A3	41	35
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000875388116	EG	On-Demand	Anodyne	MME	94	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000875388116	EG	On-Demand	Anodyne	ANPEP	61	37
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000875388116	EG	On-Demand	Anodyne	PAPA1_CARPA	45	35
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000875388116	EG	On-Demand	Anodyne	CTSF	41	34
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000875388116	EG	On-Demand	Anodyne	CAPNS1	55	31
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000875388116	EG	On-Demand	Anodyne	CAPN1	47	35
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000875388116	EG	On-Demand	Anodyne	CAPN2	48	33
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000875388116	EG	On-Demand	Anodyne	ACE2	64	38
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000875388116	EG	On-Demand	Anodyne	FPR1	60	39
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000875388118	EG	On-Demand	Anodyne	MME	94	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000875388118	EG	On-Demand	Anodyne	ANPEP	61	37
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000875388118	EG	On-Demand	Anodyne	PAPA1_CARPA	45	35
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000875388118	EG	On-Demand	Anodyne	CTSF	41	34
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000875388118	EG	On-Demand	Anodyne	CAPNS1	55	31
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000875388118	EG	On-Demand	Anodyne	CAPN1	47	35
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000875388118	EG	On-Demand	Anodyne	CAPN2	48	33
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000875388118	EG	On-Demand	Anodyne	ACE2	64	38
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000875388118	EG	On-Demand	Anodyne	FPR1	60	39
COCC1CC(NC(=O)N[C@H](c2ccccc2)C(C)(C)C(=O)OC)C1	ZINC000875388140	EF	On-Demand	Anodyne	CTSG	25	44
COCC1CC(NC(=O)N[C@H](c2ccccc2)C(C)(C)C(=O)OC)C1	ZINC000875388140	EF	On-Demand	Anodyne	CTRB1	39	44
COCC1CC(NC(=O)N[C@H](c2ccccc2)C(C)(C)C(=O)OC)C1	ZINC000875388140	EF	On-Demand	Anodyne	AMY2	43	29
COCC1CC(NC(=O)N[C@H](c2ccccc2)C(C)(C)C(=O)OC)C1	ZINC000875388140	EF	On-Demand	Anodyne	CELA2A	22	44
COCC1CC(NC(=O)N[C@@H](c2ccccc2)C(C)(C)C(=O)OC)C1	ZINC000875388141	EF	On-Demand	Anodyne	CTSG	25	44
COCC1CC(NC(=O)N[C@@H](c2ccccc2)C(C)(C)C(=O)OC)C1	ZINC000875388141	EF	On-Demand	Anodyne	CTRB1	39	44
COCC1CC(NC(=O)N[C@@H](c2ccccc2)C(C)(C)C(=O)OC)C1	ZINC000875388141	EF	On-Demand	Anodyne	AMY2	43	29
COCC1CC(NC(=O)N[C@@H](c2ccccc2)C(C)(C)C(=O)OC)C1	ZINC000875388141	EF	On-Demand	Anodyne	CELA2A	22	44
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NNC(=O)Nc3nccs3)nc2)C1	ZINC000875388170	HE	On-Demand	Reactive	MAP1	44	31
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(NNC(=O)Nc3nccs3)nc2)C1	ZINC000875388170	HE	On-Demand	Reactive	GCK	23	40
O=C(NCc1nc(C2CC2)cs1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875388197	EF	On-Demand	Anodyne	ETHR	54	36
O=C(NCc1nc(C2CC2)cs1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875388198	EF	On-Demand	Anodyne	ETHR	54	36
O=C(NCC[C@H]1COc2ccccc2O1)N1CCC(CO)(CO)CC1	ZINC000875388237	FC	On-Demand	Anodyne	ADRA2B	16	41
O=C(NCC[C@@H]1COc2ccccc2O1)N1CCC(CO)(CO)CC1	ZINC000875388239	FC	On-Demand	Anodyne	ADRA2B	16	41
O=C(N[C@@H](Cc1ccccc1)C(F)(F)F)N1CCC(CO)(CO)CC1	ZINC000875388246	FD	On-Demand	Anodyne	GHRHR	54	35
O=C(N[C@@H](Cc1ccccc1)C(F)(F)F)N1CCC(CO)(CO)CC1	ZINC000875388246	FD	On-Demand	Anodyne	MME	49	38
O=C(N[C@H](Cc1ccccc1)C(F)(F)F)N1CCC(CO)(CO)CC1	ZINC000875388248	FD	On-Demand	Anodyne	GHRHR	54	35
O=C(N[C@H](Cc1ccccc1)C(F)(F)F)N1CCC(CO)(CO)CC1	ZINC000875388248	FD	On-Demand	Anodyne	MME	49	38
CONC(=O)C1CCN(C(=O)NCc2ccc(F)cn2)CC1	ZINC000875388335	DC	On-Demand	Anodyne	EPHX2	22	42
CONC(=O)C1CCN(C(=O)NCc2ccc(F)cn2)CC1	ZINC000875388335	DC	On-Demand	Anodyne	PTR1	45	33
O=C(N[C@@H]1CCc2n[nH]cc2C1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875388376	FF	On-Demand	Anodyne	CPT1A	59	33
O=C(N[C@@H]1CCc2n[nH]cc2C1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875388377	FF	On-Demand	Anodyne	CPT1A	59	33
O=C(N[C@@H]1CCc2n[nH]cc2C1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875388378	FF	On-Demand	Anodyne	CPT1A	59	33
O=C(N[C@@H]1CCc2n[nH]cc2C1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875388379	FF	On-Demand	Anodyne	CPT1A	59	33
O=C(NCCN1CCN(c2cccc(Cl)c2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875388437	FD	On-Demand	Anodyne	CACNA1H	21	40
O=C(NCCN1CCN(c2cccc(Cl)c2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875388437	FD	On-Demand	Anodyne	HTR1A	68	64
O=C(NCCN1CCN(c2cccc(Cl)c2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875388437	FD	On-Demand	Anodyne	DRD2	54	60
O=C(NCCN1CCN(c2cccc(Cl)c2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875388437	FD	On-Demand	Anodyne	DRD4	54	46
O=C(NCCN1CCN(c2cccc(Cl)c2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875388437	FD	On-Demand	Anodyne	HTR2A	58	54
O=C(NCCN1CCN(c2cccc(Cl)c2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875388437	FD	On-Demand	Anodyne	HTR2C	33	46
O=C(NCCN1CCN(c2cccc(Cl)c2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875388437	FD	On-Demand	Anodyne	SLC6A4	18	47
O=C(NCCN1CCN(c2cccc(Cl)c2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875388437	FD	On-Demand	Anodyne	DRD3	76	53
O=C(NCCN1CCN(c2cccc(Cl)c2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875388437	FD	On-Demand	Anodyne	HTR4	15	41
O=C(NCCN1CCN(c2cccc(Cl)c2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875388437	FD	On-Demand	Anodyne	HTR7	60	45
O=C(NCCN1CCN(c2cccc(Cl)c2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875388437	FD	On-Demand	Anodyne	PLD2	40	38
O=C(NCCN1CCN(c2cccc(Cl)c2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875388437	FD	On-Demand	Anodyne	CACNA1I	51	43
O=C(NCc1nc(C2CC2)cs1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875388463	FG	On-Demand	Anodyne	F2	25	43
O=C(NCc1nc(C2CC2)cs1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875388465	FG	On-Demand	Anodyne	F2	25	43
O=C(NCc1nc(C2CC2)cs1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875388467	FG	On-Demand	Anodyne	F2	25	43
O=C(NCc1nc(C2CC2)cs1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875388469	FG	On-Demand	Anodyne	F2	25	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OC)cc1C	ZINC000875388521	CE	On-Demand	Anodyne	MTNR1A	43	35
COC(=O)C1(O)CN(C(=O)N[C@H](Cc2ccccc2)C(F)(F)F)C1	ZINC000875388540	ED	On-Demand	Anodyne	CYSP_TRYCR	42	31
COC(=O)C1(O)CN(C(=O)N[C@H](Cc2ccccc2)C(F)(F)F)C1	ZINC000875388540	ED	On-Demand	Anodyne	CTSF	43	32
COC(=O)C1(O)CN(C(=O)N[C@H](Cc2ccccc2)C(F)(F)F)C1	ZINC000875388540	ED	On-Demand	Anodyne	CAPN2	43	31
COC(=O)C1(O)CN(C(=O)N[C@@H](Cc2ccccc2)C(F)(F)F)C1	ZINC000875388541	ED	On-Demand	Anodyne	CYSP_TRYCR	42	31
COC(=O)C1(O)CN(C(=O)N[C@@H](Cc2ccccc2)C(F)(F)F)C1	ZINC000875388541	ED	On-Demand	Anodyne	CTSF	43	32
COC(=O)C1(O)CN(C(=O)N[C@@H](Cc2ccccc2)C(F)(F)F)C1	ZINC000875388541	ED	On-Demand	Anodyne	CAPN2	43	31
CC(=O)N[C@H](CC(C)C)C(=O)Nc1cccc(N2CCOC2=O)c1C	ZINC000875388582	EE	On-Demand	Anodyne	KCNQ2	60	37
O=CN1CCCN(C(=O)NCCN2CCN(c3cccc(Cl)c3)CC2)CC1	ZINC000875388613	GD	On-Demand	Anodyne	HTR1A	78	56
O=CN1CCCN(C(=O)NCCN2CCN(c3cccc(Cl)c3)CC2)CC1	ZINC000875388613	GD	On-Demand	Anodyne	DRD2	63	56
O=CN1CCCN(C(=O)NCCN2CCN(c3cccc(Cl)c3)CC2)CC1	ZINC000875388613	GD	On-Demand	Anodyne	DRD1	18	42
O=CN1CCCN(C(=O)NCCN2CCN(c3cccc(Cl)c3)CC2)CC1	ZINC000875388613	GD	On-Demand	Anodyne	DRD4	52	43
O=CN1CCCN(C(=O)NCCN2CCN(c3cccc(Cl)c3)CC2)CC1	ZINC000875388613	GD	On-Demand	Anodyne	HTR2A	57	55
O=CN1CCCN(C(=O)NCCN2CCN(c3cccc(Cl)c3)CC2)CC1	ZINC000875388613	GD	On-Demand	Anodyne	HTR2C	31	46
O=CN1CCCN(C(=O)NCCN2CCN(c3cccc(Cl)c3)CC2)CC1	ZINC000875388613	GD	On-Demand	Anodyne	SLC6A4	15	51
O=CN1CCCN(C(=O)NCCN2CCN(c3cccc(Cl)c3)CC2)CC1	ZINC000875388613	GD	On-Demand	Anodyne	ADRA1A	18	43
O=CN1CCCN(C(=O)NCCN2CCN(c3cccc(Cl)c3)CC2)CC1	ZINC000875388613	GD	On-Demand	Anodyne	DRD3	83	52
O=CN1CCCN(C(=O)NCCN2CCN(c3cccc(Cl)c3)CC2)CC1	ZINC000875388613	GD	On-Demand	Anodyne	HTR7	72	47
O=C(NCCc1ccc(-c2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875388614	FF	On-Demand	Anodyne	GHRHR	45	34
O=C(NCCc1ccc(-c2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875388614	FF	On-Demand	Anodyne	FAAH	15	40
O=C(NCCc1ccc(-c2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875388614	FF	On-Demand	Anodyne	NPFFR1	18	40
CC(=O)C1CCN(C(=O)NCc2ccc(F)cn2)CC1	ZINC000875388633	CD	On-Demand	Anodyne	EPHX2	19	40
O=C(NCc1ccc(F)cn1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875388650	EF	On-Demand	Anodyne	CCR3	20	41
O=C(NCc1ccc(F)cn1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875388650	EF	On-Demand	Anodyne	EPHX2	30	57
O=C(NCc1ccc(F)cn1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875388650	EF	On-Demand	Anodyne	SCD1	24	41
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCC(F)(F)C3)cn2)cc1	ZINC000875388711	EG	On-Demand	Mild	ITK	17	48
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCC(F)(F)C3)cn2)cc1	ZINC000875388711	EG	On-Demand	Mild	PANC	55	38
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCC(F)(F)C3)cn2)cc1	ZINC000875388712	EG	On-Demand	Mild	ITK	17	48
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCC(F)(F)C3)cn2)cc1	ZINC000875388712	EG	On-Demand	Mild	PANC	55	38
COC(=O)N(C)NC(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875388764	ED	On-Demand	Reactive	CTSG	25	43
COC(=O)N(C)NC(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875388764	ED	On-Demand	Reactive	CTRB1	39	43
COC(=O)N(C)NC(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875388764	ED	On-Demand	Reactive	CELA2A	22	43
COC(=O)N(C)NC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875388766	ED	On-Demand	Reactive	CTSG	25	43
COC(=O)N(C)NC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875388766	ED	On-Demand	Reactive	CTRB1	39	43
COC(=O)N(C)NC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875388766	ED	On-Demand	Reactive	CELA2A	22	43
COC(=O)N(C)NC(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000875388859	DE	On-Demand	Reactive	MME	79	39
COC(=O)N(C)NC(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000875388859	DE	On-Demand	Reactive	PAPA1_CARPA	58	39
COC(=O)N(C)NC(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000875388859	DE	On-Demand	Reactive	CYSP_TRYCR	40	33
COC(=O)N(C)NC(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000875388859	DE	On-Demand	Reactive	CAPN1	41	33
COC(=O)N(C)NC(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000875388859	DE	On-Demand	Reactive	CAPN2	54	31
COC(=O)N(C)NC(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000875388859	DE	On-Demand	Reactive	ACE2	45	34
COC(=O)N(C)NC(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000875388862	DE	On-Demand	Reactive	MME	79	39
COC(=O)N(C)NC(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000875388862	DE	On-Demand	Reactive	PAPA1_CARPA	58	39
COC(=O)N(C)NC(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000875388862	DE	On-Demand	Reactive	CYSP_TRYCR	40	33
COC(=O)N(C)NC(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000875388862	DE	On-Demand	Reactive	CAPN1	41	33
COC(=O)N(C)NC(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000875388862	DE	On-Demand	Reactive	CAPN2	54	31
COC(=O)N(C)NC(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000875388862	DE	On-Demand	Reactive	ACE2	45	34
O=C(NCCO)C1CCN(C(=O)N[C@@H](Cc2ccccc2)C(F)(F)F)CC1	ZINC000875388896	GD	On-Demand	Anodyne	CAPN1	19	44
O=C(NCCO)C1CCN(C(=O)N[C@@H](Cc2ccccc2)C(F)(F)F)CC1	ZINC000875388896	GD	On-Demand	Anodyne	CACNA1G	35	41
O=C(NCCO)C1CCN(C(=O)N[C@H](Cc2ccccc2)C(F)(F)F)CC1	ZINC000875388900	GD	On-Demand	Anodyne	CAPN1	19	44
O=C(NCCO)C1CCN(C(=O)N[C@H](Cc2ccccc2)C(F)(F)F)CC1	ZINC000875388900	GD	On-Demand	Anodyne	CACNA1G	35	41
O=C(N[C@H]1CCC(F)(F)C1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875388970	GH	On-Demand	Anodyne	C3AR1	33	41
O=C(N[C@@H]1CCC(F)(F)C1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875388971	GH	On-Demand	Anodyne	C3AR1	33	41
CC(C)(C)OC(=O)N1CCC2(CC1)CN(C(=O)NCc1ccc(F)cn1)C2	ZINC000875388982	GF	On-Demand	Anodyne	GPR119	37	41
CC[C@@H]1CN(S(C)(=O)=O)CC[C@@H]1NC(=O)N[C@H](CC)[C@@H](O)c1ccccc1	ZINC000875388984	GD	On-Demand	Anodyne	XIAP	49	36
CC[C@@H]1CN(S(C)(=O)=O)CC[C@@H]1NC(=O)N[C@H](CC)[C@H](O)c1ccccc1	ZINC000875388986	GD	On-Demand	Anodyne	XIAP	49	36
COC(=O)N(C)NC(=O)NCc1ccc(OC)cc1C	ZINC000875388997	CD	On-Demand	Reactive	MTNR1A	78	40
COC(=O)N(C)NC(=O)NCc1ccc(OC)cc1C	ZINC000875388997	CD	On-Demand	Reactive	MTNR1B	60	38
O=CN1CCCN(C(=O)NCC[C@H]2COc3ccccc3O2)CC1	ZINC000875389058	ED	On-Demand	Anodyne	ADRA2B	16	42
O=CN1CCCN(C(=O)NCC[C@@H]2COc3ccccc3O2)CC1	ZINC000875389059	ED	On-Demand	Anodyne	ADRA2B	16	42
O=C(NCCO)C1CCN(C(=O)NCCc2ccc(-c3ccccc3)cc2)CC1	ZINC000875389100	GE	On-Demand	Anodyne	EPHX2	20	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000875389155	FF	On-Demand	Anodyne	SLC6A4	27	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000875389155	FF	On-Demand	Anodyne	SLC6A3	60	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000875389155	FF	On-Demand	Anodyne	TIMP3	72	33
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000875389160	FF	On-Demand	Anodyne	SLC6A4	27	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000875389160	FF	On-Demand	Anodyne	SLC6A3	60	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000875389160	FF	On-Demand	Anodyne	TIMP3	72	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000875389164	FF	On-Demand	Anodyne	SLC6A4	27	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000875389164	FF	On-Demand	Anodyne	SLC6A3	60	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000875389164	FF	On-Demand	Anodyne	TIMP3	72	33
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000875389169	FF	On-Demand	Anodyne	SLC6A4	27	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000875389169	FF	On-Demand	Anodyne	SLC6A3	60	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000875389169	FF	On-Demand	Anodyne	TIMP3	72	33
O=C(NC[C@H]1CCCS1(=O)=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875389180	GE	On-Demand	Reactive	LTA4H	26	43
Cc1c(NC(=O)[C@@H](NC=O)C(C)C)cccc1N1CCOC1=O	ZINC000875389183	DD	On-Demand	Anodyne	KCNQ2	43	35
N#Cc1ccc(Cn2cc(NC(=O)NCc3nc(C4CC4)cs3)cn2)cc1	ZINC000875389210	GG	On-Demand	Mild	ITK	17	49
N#Cc1ccc(Cn2cc(NC(=O)NCc3nc(C4CC4)cs3)cn2)cc1	ZINC000875389210	GG	On-Demand	Mild	PANC	53	35
Cc1nnc(NNC(=O)NCCN2CCN(c3cccc(Cl)c3)CC2)n1C	ZINC000875389224	GD	On-Demand	Reactive	HTR1A	68	54
Cc1nnc(NNC(=O)NCCN2CCN(c3cccc(Cl)c3)CC2)n1C	ZINC000875389224	GD	On-Demand	Reactive	DRD2	57	51
Cc1nnc(NNC(=O)NCCN2CCN(c3cccc(Cl)c3)CC2)n1C	ZINC000875389224	GD	On-Demand	Reactive	DRD1	16	41
Cc1nnc(NNC(=O)NCCN2CCN(c3cccc(Cl)c3)CC2)n1C	ZINC000875389224	GD	On-Demand	Reactive	DRD4	52	43
Cc1nnc(NNC(=O)NCCN2CCN(c3cccc(Cl)c3)CC2)n1C	ZINC000875389224	GD	On-Demand	Reactive	ADRA1D	17	40
Cc1nnc(NNC(=O)NCCN2CCN(c3cccc(Cl)c3)CC2)n1C	ZINC000875389224	GD	On-Demand	Reactive	HTR2A	61	52
Cc1nnc(NNC(=O)NCCN2CCN(c3cccc(Cl)c3)CC2)n1C	ZINC000875389224	GD	On-Demand	Reactive	HTR2C	38	48
Cc1nnc(NNC(=O)NCCN2CCN(c3cccc(Cl)c3)CC2)n1C	ZINC000875389224	GD	On-Demand	Reactive	SLC6A4	19	48
Cc1nnc(NNC(=O)NCCN2CCN(c3cccc(Cl)c3)CC2)n1C	ZINC000875389224	GD	On-Demand	Reactive	ADRA1A	20	40
Cc1nnc(NNC(=O)NCCN2CCN(c3cccc(Cl)c3)CC2)n1C	ZINC000875389224	GD	On-Demand	Reactive	DRD3	77	52
Cc1nnc(NNC(=O)NCCN2CCN(c3cccc(Cl)c3)CC2)n1C	ZINC000875389224	GD	On-Demand	Reactive	HTR4	17	42
Cc1nnc(NNC(=O)NCCN2CCN(c3cccc(Cl)c3)CC2)n1C	ZINC000875389224	GD	On-Demand	Reactive	HTR7	55	45
O=CN1CCCN(C(=O)N[C@@H](Cc2ccccc2)C(F)(F)F)CC1	ZINC000875389263	EE	On-Demand	Anodyne	ACE	20	40
O=CN1CCCN(C(=O)N[C@@H](Cc2ccccc2)C(F)(F)F)CC1	ZINC000875389263	EE	On-Demand	Anodyne	MME	31	40
O=CN1CCCN(C(=O)N[C@@H](Cc2ccccc2)C(F)(F)F)CC1	ZINC000875389263	EE	On-Demand	Anodyne	CAPN1	41	35
O=CN1CCCN(C(=O)N[C@@H](Cc2ccccc2)C(F)(F)F)CC1	ZINC000875389263	EE	On-Demand	Anodyne	CAPN2	45	31
O=CN1CCCN(C(=O)N[C@H](Cc2ccccc2)C(F)(F)F)CC1	ZINC000875389265	EE	On-Demand	Anodyne	ACE	20	40
O=CN1CCCN(C(=O)N[C@H](Cc2ccccc2)C(F)(F)F)CC1	ZINC000875389265	EE	On-Demand	Anodyne	MME	31	40
O=CN1CCCN(C(=O)N[C@H](Cc2ccccc2)C(F)(F)F)CC1	ZINC000875389265	EE	On-Demand	Anodyne	CAPN1	41	35
O=CN1CCCN(C(=O)N[C@H](Cc2ccccc2)C(F)(F)F)CC1	ZINC000875389265	EE	On-Demand	Anodyne	CAPN2	45	31
O=C1CCN(C(=O)NCC[C@H]2COc3ccccc3O2)CCCCCCN1	ZINC000875389272	GE	On-Demand	Anodyne	ADRA2B	17	41
O=C1CCN(C(=O)NCC[C@@H]2COc3ccccc3O2)CCCCCCN1	ZINC000875389274	GE	On-Demand	Anodyne	ADRA2B	17	41
CCO[C@@H](C(=O)Nc1cccc(N2CCOC2=O)c1C)C(C)C	ZINC000875389275	DF	On-Demand	Anodyne	KCNQ2	52	36
CC(=O)NC[C@@H]1CCCCN1C(=O)NCc1c(C)cccc1C	ZINC000875389281	DF	On-Demand	Anodyne	HCRTR1	18	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](c2ccccc2)C(C)(C)C(=O)OC)C1	ZINC000875389341	GF	On-Demand	Anodyne	AMY2	55	33
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](c2ccccc2)C(C)(C)C(=O)OC)C1	ZINC000875389341	GF	On-Demand	Anodyne	CTRB_BOVIN	56	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](c2ccccc2)C(C)(C)C(=O)OC)C1	ZINC000875389344	GF	On-Demand	Anodyne	AMY2	55	33
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](c2ccccc2)C(C)(C)C(=O)OC)C1	ZINC000875389344	GF	On-Demand	Anodyne	CTRB_BOVIN	56	36
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875389396	FG	On-Demand	Anodyne	TIMP3	76	35
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000875389397	FG	On-Demand	Anodyne	TIMP3	76	35
O=C(N[C@H]1CC2(CCCC2)Oc2ccccc21)N1CCC(CO)(CO)CC1	ZINC000875389424	FF	On-Demand	Anodyne	GHRHR	52	32
O=C(N[C@@H]1CC2(CCCC2)Oc2ccccc21)N1CCC(CO)(CO)CC1	ZINC000875389426	FF	On-Demand	Anodyne	GHRHR	52	32
CCn1ncc(CNC(=O)N[C@@H](c2ccccc2)C(C)(C)C(=O)OC)n1	ZINC000875389590	FE	On-Demand	Anodyne	CTSG	23	41
CCn1ncc(CNC(=O)N[C@@H](c2ccccc2)C(C)(C)C(=O)OC)n1	ZINC000875389590	FE	On-Demand	Anodyne	CTRB1	32	41
CCn1ncc(CNC(=O)N[C@@H](c2ccccc2)C(C)(C)C(=O)OC)n1	ZINC000875389590	FE	On-Demand	Anodyne	CELA2A	20	41
CCn1ncc(CNC(=O)N[C@@H](c2ccccc2)C(C)(C)C(=O)OC)n1	ZINC000875389590	FE	On-Demand	Anodyne	CYP26A1	36	41
CCn1ncc(CNC(=O)N[C@H](c2ccccc2)C(C)(C)C(=O)OC)n1	ZINC000875389591	FE	On-Demand	Anodyne	CTSG	23	41
CCn1ncc(CNC(=O)N[C@H](c2ccccc2)C(C)(C)C(=O)OC)n1	ZINC000875389591	FE	On-Demand	Anodyne	CTRB1	32	41
CCn1ncc(CNC(=O)N[C@H](c2ccccc2)C(C)(C)C(=O)OC)n1	ZINC000875389591	FE	On-Demand	Anodyne	CELA2A	20	41
CCn1ncc(CNC(=O)N[C@H](c2ccccc2)C(C)(C)C(=O)OC)n1	ZINC000875389591	FE	On-Demand	Anodyne	CYP26A1	36	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(C2CCCCC2)C1=O	ZINC000875389630	ED	On-Demand	Anodyne	RIR1_HHV11	16	42
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(C2CCCCC2)C1=O	ZINC000875389631	ED	On-Demand	Anodyne	RIR1_HHV11	16	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](Cc2ccccc2)C(F)(F)F)C1	ZINC000875389634	FG	On-Demand	Anodyne	ACE	54	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](Cc2ccccc2)C(F)(F)F)C1	ZINC000875389634	FG	On-Demand	Anodyne	MME	65	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](Cc2ccccc2)C(F)(F)F)C1	ZINC000875389634	FG	On-Demand	Anodyne	CMA1	57	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](Cc2ccccc2)C(F)(F)F)C1	ZINC000875389634	FG	On-Demand	Anodyne	CYSP_TRYCR	55	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](Cc2ccccc2)C(F)(F)F)C1	ZINC000875389634	FG	On-Demand	Anodyne	TIMP3	50	33
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](Cc2ccccc2)C(F)(F)F)C1	ZINC000875389634	FG	On-Demand	Anodyne	CAPNS1	63	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](Cc2ccccc2)C(F)(F)F)C1	ZINC000875389634	FG	On-Demand	Anodyne	REN	54	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](Cc2ccccc2)C(F)(F)F)C1	ZINC000875389634	FG	On-Demand	Anodyne	CAPN1	48	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](Cc2ccccc2)C(F)(F)F)C1	ZINC000875389634	FG	On-Demand	Anodyne	CTRC	51	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](Cc2ccccc2)C(F)(F)F)C1	ZINC000875389634	FG	On-Demand	Anodyne	ACE2	59	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](Cc2ccccc2)C(F)(F)F)C1	ZINC000875389634	FG	On-Demand	Anodyne	CTRB_BOVIN	52	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](Cc2ccccc2)C(F)(F)F)C1	ZINC000875389634	FG	On-Demand	Anodyne	RBP4	44	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](Cc2ccccc2)C(F)(F)F)C1	ZINC000875389636	FG	On-Demand	Anodyne	ACE	54	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](Cc2ccccc2)C(F)(F)F)C1	ZINC000875389636	FG	On-Demand	Anodyne	MME	65	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](Cc2ccccc2)C(F)(F)F)C1	ZINC000875389636	FG	On-Demand	Anodyne	CMA1	57	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](Cc2ccccc2)C(F)(F)F)C1	ZINC000875389636	FG	On-Demand	Anodyne	CYSP_TRYCR	55	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](Cc2ccccc2)C(F)(F)F)C1	ZINC000875389636	FG	On-Demand	Anodyne	TIMP3	50	33
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](Cc2ccccc2)C(F)(F)F)C1	ZINC000875389636	FG	On-Demand	Anodyne	CAPNS1	63	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](Cc2ccccc2)C(F)(F)F)C1	ZINC000875389636	FG	On-Demand	Anodyne	REN	54	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](Cc2ccccc2)C(F)(F)F)C1	ZINC000875389636	FG	On-Demand	Anodyne	CAPN1	48	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](Cc2ccccc2)C(F)(F)F)C1	ZINC000875389636	FG	On-Demand	Anodyne	CTRC	51	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](Cc2ccccc2)C(F)(F)F)C1	ZINC000875389636	FG	On-Demand	Anodyne	ACE2	59	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](Cc2ccccc2)C(F)(F)F)C1	ZINC000875389636	FG	On-Demand	Anodyne	CTRB_BOVIN	52	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](Cc2ccccc2)C(F)(F)F)C1	ZINC000875389636	FG	On-Demand	Anodyne	RBP4	44	39
CC[C@H](C[C@H](C)O)NC(=O)NCc1c(C)cccc1C	ZINC000875389655	CF	On-Demand	Anodyne	ANPEP	17	43
CONC(=O)C1CCN(C(=O)N[C@@H](c2ccccc2)C(C)(C)C(=O)OC)CC1	ZINC000875389711	GE	On-Demand	Anodyne	AMY2	49	34
CONC(=O)C1CCN(C(=O)N[C@H](c2ccccc2)C(C)(C)C(=O)OC)CC1	ZINC000875389712	GE	On-Demand	Anodyne	AMY2	49	34
CC(C)c1ccc([C@H](C)NC(=O)/C=C\c2ccco2)cc1	ZINC000875389721	CI	On-Demand	Anodyne	KCNQ2	53	45
CC(C)c1ccc([C@H](C)NC(=O)/C=C\c2ccco2)cc1	ZINC000875389721	CI	On-Demand	Anodyne	UL26	60	32
CC(C)c1ccc([C@H](C)NC(=O)/C=C\c2ccco2)cc1	ZINC000875389721	CI	On-Demand	Anodyne	SCAF_EBVB9	54	32
CC(C)c1ccc([C@@H](C)NC(=O)/C=C\c2ccco2)cc1	ZINC000875389731	CI	On-Demand	Anodyne	KCNQ2	53	45
CC(C)c1ccc([C@@H](C)NC(=O)/C=C\c2ccco2)cc1	ZINC000875389731	CI	On-Demand	Anodyne	UL26	60	32
CC(C)c1ccc([C@@H](C)NC(=O)/C=C\c2ccco2)cc1	ZINC000875389731	CI	On-Demand	Anodyne	SCAF_EBVB9	54	32
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCc1ccc(F)cn1)CC2	ZINC000875389844	EE	On-Demand	Anodyne	MAPK1	47	43
N#Cc1ccc(N2CCN(C(=O)NCc3ccc(F)cn3)CC2)cn1	ZINC000875389981	ED	On-Demand	Mild	SLC27A1	42	32
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCc1ccc(F)cn1)CC2	ZINC000875389983	FG	On-Demand	Anodyne	SLC18A2	46	33
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCc1ccc(F)cn1)CC2	ZINC000875389983	FG	On-Demand	Anodyne	HCRTR1	17	46
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCc1ccc(F)cn1)CC2	ZINC000875389984	FG	On-Demand	Anodyne	SLC18A2	46	33
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCc1ccc(F)cn1)CC2	ZINC000875389984	FG	On-Demand	Anodyne	HCRTR1	17	46
CC[C@@H]1CN(S(C)(=O)=O)CC[C@@H]1NC(=O)NCc1cccc2ncccc12	ZINC000875390135	GE	On-Demand	Anodyne	ADAM17	15	40
CC[C@@H]1CN(S(C)(=O)=O)CC[C@H]1NC(=O)NCc1cccc2ncccc12	ZINC000875390136	GE	On-Demand	Anodyne	ADAM17	15	40
O=C(N[C@H]1CCC(F)(F)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875390184	EF	On-Demand	Anodyne	CHRM2	17	49
O=C(N[C@H]1CCC(F)(F)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875390184	EF	On-Demand	Anodyne	CHRM1	16	49
O=C(N[C@H]1CCC(F)(F)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875390184	EF	On-Demand	Anodyne	DRD4	23	41
O=C(N[C@H]1CCC(F)(F)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875390184	EF	On-Demand	Anodyne	CHRM3	23	49
O=C(N[C@H]1CCC(F)(F)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875390184	EF	On-Demand	Anodyne	SIGMAR1	37	43
O=C(N[C@H]1CCC(F)(F)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875390184	EF	On-Demand	Anodyne	CCR3	16	42
O=C(N[C@@H]1CCC(F)(F)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875390185	EF	On-Demand	Anodyne	CHRM2	17	49
O=C(N[C@@H]1CCC(F)(F)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875390185	EF	On-Demand	Anodyne	CHRM1	16	49
O=C(N[C@@H]1CCC(F)(F)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875390185	EF	On-Demand	Anodyne	DRD4	23	41
O=C(N[C@@H]1CCC(F)(F)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875390185	EF	On-Demand	Anodyne	CHRM3	23	49
O=C(N[C@@H]1CCC(F)(F)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875390185	EF	On-Demand	Anodyne	SIGMAR1	37	43
O=C(N[C@@H]1CCC(F)(F)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875390185	EF	On-Demand	Anodyne	CCR3	16	42
O=C(NC1CC(Nc2ccccc2)C1)N[C@H]1CCC(F)(F)C1	ZINC000875390192	DG	On-Demand	Anodyne	EPHX2	20	41
O=C(NC1CC(Nc2ccccc2)C1)N[C@@H]1CCC(F)(F)C1	ZINC000875390193	DG	On-Demand	Anodyne	EPHX2	20	41
O=C(N[C@@H]1CCC(F)(F)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875390218	DF	On-Demand	Anodyne	EPHX2	20	44
O=C(N[C@H]1CCC(F)(F)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875390219	DF	On-Demand	Anodyne	EPHX2	20	44
O=C(N[C@H]1CCC(F)(F)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875390220	DF	On-Demand	Anodyne	EPHX2	20	44
O=C(N[C@@H]1CCC(F)(F)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875390221	DF	On-Demand	Anodyne	EPHX2	20	44
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2O)cc1	ZINC000875390289	DE	On-Demand	Reactive	CA2	15	49
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2O)cc1	ZINC000875390289	DE	On-Demand	Reactive	CA1	47	49
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2O)cc1	ZINC000875390289	DE	On-Demand	Reactive	PRNP	43	50
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2O)cc1	ZINC000875390289	DE	On-Demand	Reactive	CA12	25	49
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2O)cc1	ZINC000875390289	DE	On-Demand	Reactive	CA9	27	59
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2O)cc1	ZINC000875390289	DE	On-Demand	Reactive	MTCA1	24	49
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2O)cc1	ZINC000875390289	DE	On-Demand	Reactive	P96878_MYCTU	31	49
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(O)c(Br)c1	ZINC000875390300	EF	On-Demand	Anodyne	ANPEP	17	40
O=C(N[C@H]1CCCc2c[nH]nc21)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875390308	FG	On-Demand	Anodyne	SMO	39	42
O=C(N[C@H]1CCCc2c[nH]nc21)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875390308	FG	On-Demand	Anodyne	ETHR	56	43
O=C(N[C@@H]1CCCc2c[nH]nc21)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875390309	FG	On-Demand	Anodyne	SMO	39	42
O=C(N[C@@H]1CCCc2c[nH]nc21)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875390309	FG	On-Demand	Anodyne	ETHR	56	43
O=C(N[C@@H]1CCCc2c[nH]nc21)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875390334	FG	On-Demand	Anodyne	CPT1A	45	33
O=C(N[C@@H]1CCCc2c[nH]nc21)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875390335	FG	On-Demand	Anodyne	CPT1A	45	33
O=C(N[C@@H]1CCCc2c[nH]nc21)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875390336	FG	On-Demand	Anodyne	CPT1A	45	33
O=C(N[C@@H]1CCCc2c[nH]nc21)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875390337	FG	On-Demand	Anodyne	CPT1A	45	33
O=C(N[C@H]1CCCc2c[nH]nc21)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875390392	EF	On-Demand	Anodyne	EPHX2	20	46
O=C(N[C@@H]1CCCc2c[nH]nc21)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875390393	EF	On-Demand	Anodyne	EPHX2	20	46
O=C(NNC(=O)c1cc(-c2ccc(Cl)cc2)nc2ccccc12)Nc1nccs1	ZINC000875390400	HI	On-Demand	Reactive	PRS	61	45
O=C(NNC(=O)c1cc(-c2ccc(Cl)cc2)nc2ccccc12)Nc1nccs1	ZINC000875390400	HI	On-Demand	Reactive	MAP1	83	36
O=C(NNC(=O)c1cc(-c2ccc(Cl)cc2)nc2ccccc12)Nc1nccs1	ZINC000875390400	HI	On-Demand	Reactive	TACR3	19	48
O=C(NNC(=O)c1cc(-c2ccc(Cl)cc2)nc2ccccc12)Nc1nccs1	ZINC000875390400	HI	On-Demand	Reactive	MT-CO2	40	40
CN1CCN(C2CCN(C(=O)N[C@H]3CCCc4c[nH]nc43)CC2)CC1	ZINC000875390434	ED	On-Demand	Anodyne	L3MBTL3	56	40
O=C(NNC(=O)c1ccccn1)Nc1nccs1	ZINC000875390447	CD	On-Demand	Reactive	MAP1	139	47
O=C(NNC(=O)c1ccccn1)Nc1nccs1	ZINC000875390447	CD	On-Demand	Reactive	GRM4	69	46
C[C@@H](CC(=O)N(CC(=O)N(C)C)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000875390496	FE	On-Demand	Anodyne	CTSK	20	44
C[C@@H](CC(=O)N(CC(=O)N(C)C)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000875390496	FE	On-Demand	Anodyne	FPR1	46	38
COC(=O)C1=NO[C@@]2(CCN(C(=O)NCc3ccc(OC)c(Cl)c3)C2)C1	ZINC000875390499	GD	On-Demand	Anodyne	PDE5A	46	40
COC(=O)C1=NO[C@@]2(CCN(C(=O)NCc3ccc(OC)c(Cl)c3)C2)C1	ZINC000875390499	GD	On-Demand	Anodyne	PDE6A	43	33
COC(=O)C1=NO[C@]2(CCN(C(=O)NCc3ccc(OC)c(Cl)c3)C2)C1	ZINC000875390500	GD	On-Demand	Anodyne	PDE5A	46	40
COC(=O)C1=NO[C@]2(CCN(C(=O)NCc3ccc(OC)c(Cl)c3)C2)C1	ZINC000875390500	GD	On-Demand	Anodyne	PDE6A	43	33
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OC)c(Cl)c1	ZINC000875390501	DF	On-Demand	Anodyne	PDE5A	45	39
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(OC)c(Cl)c1	ZINC000875390501	DF	On-Demand	Anodyne	PDE6A	49	39
CNC(=O)NC[C@H]1COCCN1C(=O)NCc1ccc(OC)c(Cl)c1	ZINC000875390527	FD	On-Demand	Anodyne	PDE5A	47	41
CNC(=O)NC[C@H]1COCCN1C(=O)NCc1ccc(OC)c(Cl)c1	ZINC000875390527	FD	On-Demand	Anodyne	PDE6A	41	31
COC(=O)c1ccc(CC(=O)N(CC(=O)N(C)C)c2ccccc2)cn1	ZINC000875390559	FD	On-Demand	Anodyne	FAAH	15	41
CC(=O)N(C)c1ccc(CNC(=O)NC2CCN([C@H]3CCC[C@@H]3O)CC2)cc1	ZINC000875390586	GD	On-Demand	Anodyne	SLC18A3	28	42
CC(=O)N(C)c1ccc(CNC(=O)NC2CCN([C@H]3CCC[C@@H]3O)CC2)cc1	ZINC000875390586	GD	On-Demand	Anodyne	EPHX2	17	42
CC(=O)N(C)c1ccc(CNC(=O)NC2CCN([C@@H]3CCC[C@@H]3O)CC2)cc1	ZINC000875390587	GD	On-Demand	Anodyne	SLC18A3	28	42
CC(=O)N(C)c1ccc(CNC(=O)NC2CCN([C@@H]3CCC[C@@H]3O)CC2)cc1	ZINC000875390587	GD	On-Demand	Anodyne	EPHX2	17	42
CC(=O)N(C)c1ccc(CNC(=O)NC2CCN([C@H]3CCC[C@H]3O)CC2)cc1	ZINC000875390588	GD	On-Demand	Anodyne	SLC18A3	28	42
CC(=O)N(C)c1ccc(CNC(=O)NC2CCN([C@H]3CCC[C@H]3O)CC2)cc1	ZINC000875390588	GD	On-Demand	Anodyne	EPHX2	17	42
CC(=O)N(C)c1ccc(CNC(=O)NC2CCN([C@@H]3CCC[C@H]3O)CC2)cc1	ZINC000875390589	GD	On-Demand	Anodyne	SLC18A3	28	42
CC(=O)N(C)c1ccc(CNC(=O)NC2CCN([C@@H]3CCC[C@H]3O)CC2)cc1	ZINC000875390589	GD	On-Demand	Anodyne	EPHX2	17	42
O=C(NOCC(F)(F)F)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875390598	DE	On-Demand	Anodyne	RBP4	46	37
CC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	ZINC000875390601	IE	On-Demand	Reactive	LPL	51	41
CC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	ZINC000875390601	IE	On-Demand	Reactive	CPT1A	34	44
CC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	ZINC000875390601	IE	On-Demand	Reactive	PPARD	15	41
CC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	ZINC000875390601	IE	On-Demand	Reactive	EPHX2	23	45
CC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	ZINC000875390601	IE	On-Demand	Reactive	TGM2	58	38
CC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	ZINC000875390601	IE	On-Demand	Reactive	F13A1	81	45
CC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	ZINC000875390601	IE	On-Demand	Reactive	AKR1C3	65	44
CC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	ZINC000875390601	IE	On-Demand	Reactive	LIPG	20	41
CC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	ZINC000875390601	IE	On-Demand	Reactive	MTCA1	15	43
CC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	ZINC000875390601	IE	On-Demand	Reactive	P96878_MYCTU	16	43
CC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1	ZINC000875390601	IE	On-Demand	Reactive	NAMPT	36	45
O=C(N[C@@H]1CCCc2c[nH]nc21)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875390636	EE	On-Demand	Anodyne	EPHX2	17	40
O=C(N[C@H]1CCCc2c[nH]nc21)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875390637	EE	On-Demand	Anodyne	EPHX2	17	40
O=C(N[C@H]1CCCc2c[nH]nc21)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875390638	EE	On-Demand	Anodyne	EPHX2	17	40
O=C(N[C@@H]1CCCc2c[nH]nc21)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875390639	EE	On-Demand	Anodyne	EPHX2	17	40
CC(=O)N1CCC[C@@H]1C(=O)O[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000875390685	GH	On-Demand	Anodyne	FKBP1A	59	39
CC(=O)N1CCC[C@@H]1C(=O)O[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000875390685	GH	On-Demand	Anodyne	LGMN	37	40
CC(=O)N1CCC[C@@H]1C(=O)O[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000875390686	GH	On-Demand	Anodyne	FKBP1A	59	39
CC(=O)N1CCC[C@@H]1C(=O)O[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000875390686	GH	On-Demand	Anodyne	LGMN	37	40
COC(=O)c1cc(C(=O)N(CC(=O)N(C)C)c2ccccc2)ccc1C	ZINC000875390687	FF	On-Demand	Anodyne	FLT4	17	43
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(OC)c(Cl)c1	ZINC000875390706	GF	On-Demand	Anodyne	PDE5A	47	42
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(OC)c(Cl)c1	ZINC000875390706	GF	On-Demand	Anodyne	HTR4	63	37
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(OC)c(Cl)c1	ZINC000875390706	GF	On-Demand	Anodyne	PDE6A	42	34
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(OC)c(Cl)c1	ZINC000875390706	GF	On-Demand	Anodyne	CACNA1I	54	37
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(OC)c(Cl)c1	ZINC000875390706	GF	On-Demand	Anodyne	ACKR3	62	32
CCO[C@@H](C(=O)N(CC(=O)N(C)C)c1ccccc1)C1CCOCC1	ZINC000875390727	ED	On-Demand	Anodyne	AMY2	44	30
CCO[C@H](C(=O)N(CC(=O)N(C)C)c1ccccc1)C1CCOCC1	ZINC000875390728	ED	On-Demand	Anodyne	AMY2	44	30
CCO[C@@H](C(=O)N(CC(=O)N(C)C)c1ccccc1)C1CCCC1	ZINC000875390746	EF	On-Demand	Anodyne	AMY2	53	36
CCO[C@H](C(=O)N(CC(=O)N(C)C)c1ccccc1)C1CCCC1	ZINC000875390747	EF	On-Demand	Anodyne	AMY2	53	36
O=C(NC1CCN(C(=O)N[C@@H]2CCCc3c[nH]nc32)CC1)OCc1ccccc1	ZINC000875390789	GF	On-Demand	Anodyne	CTSL	17	47
O=C(NC1CCN(C(=O)N[C@@H]2CCCc3c[nH]nc32)CC1)OCc1ccccc1	ZINC000875390789	GF	On-Demand	Anodyne	TGM2	17	41
O=C(NC1CCN(C(=O)N[C@@H]2CCCc3c[nH]nc32)CC1)OCc1ccccc1	ZINC000875390789	GF	On-Demand	Anodyne	F13A1	16	41
O=C(NC1CCN(C(=O)N[C@H]2CCCc3c[nH]nc32)CC1)OCc1ccccc1	ZINC000875390790	GF	On-Demand	Anodyne	CTSL	17	47
O=C(NC1CCN(C(=O)N[C@H]2CCCc3c[nH]nc32)CC1)OCc1ccccc1	ZINC000875390790	GF	On-Demand	Anodyne	TGM2	17	41
O=C(NC1CCN(C(=O)N[C@H]2CCCc3c[nH]nc32)CC1)OCc1ccccc1	ZINC000875390790	GF	On-Demand	Anodyne	F13A1	16	41
CN1CCN(C(=O)NCc2ccc(O)c(Br)c2)Cc2cccnc21	ZINC000875390818	GF	On-Demand	Anodyne	NAMPT	24	43
O=C(NC[C@@H]1[C@@H]2Cc3ccccc3[C@@H]12)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875390860	FH	On-Demand	Anodyne	EPHX2	18	40
O=C(NC[C@@H]1[C@@H]2Cc3ccccc3[C@@H]12)N1CCC[C@H](OC2CCC2)CC1	ZINC000875390861	FH	On-Demand	Anodyne	EPHX2	18	40
O=C(NC[C@H]1[C@H]2c3ccccc3C[C@H]21)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875390862	FH	On-Demand	Anodyne	EPHX2	18	40
O=C(NC[C@H]1[C@H]2c3ccccc3C[C@H]21)N1CCC[C@H](OC2CCC2)CC1	ZINC000875390863	FH	On-Demand	Anodyne	EPHX2	18	40
COC(=O)N(C)NC(=O)NCCc1c(C)cccc1C	ZINC000875390932	CD	On-Demand	Reactive	MTNR1A	44	39
CC(C)(C)OC(=O)N1CC[C@H]([C@H](F)C(=O)Nc2nc3ccc(F)cn3n2)C1	ZINC000875390945	GE	On-Demand	Anodyne	GPR119	34	44
CC(C)(C)OC(=O)N1CC[C@H]([C@@H](F)C(=O)Nc2nc3ccc(F)cn3n2)C1	ZINC000875390946	GE	On-Demand	Anodyne	GPR119	34	44
CC(C)(C)OC(=O)N1CC[C@@H]([C@H](F)C(=O)Nc2nc3ccc(F)cn3n2)C1	ZINC000875390947	GE	On-Demand	Anodyne	GPR119	34	44
CC(C)(C)OC(=O)N1CC[C@@H]([C@@H](F)C(=O)Nc2nc3ccc(F)cn3n2)C1	ZINC000875390948	GE	On-Demand	Anodyne	GPR119	34	44
COC(=O)[C@H](NC(=O)c1cnn(-c2cccc(F)c2)c1C(F)(F)F)C1CC1	ZINC000875390957	GF	On-Demand	Anodyne	MST1R	41	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(OC)c(Cl)c2)C1	ZINC000875390962	FF	On-Demand	Anodyne	PDE5A	49	39
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(OC)c(Cl)c2)C1	ZINC000875390962	FF	On-Demand	Anodyne	PDE6A	49	39
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N[C@@H]1CCc2ccc(Cl)cc21	ZINC000875390991	GG	On-Demand	Anodyne	SLC18A3	25	43
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N[C@H]1CCc2ccc(Cl)cc21	ZINC000875390992	GG	On-Demand	Anodyne	SLC18A3	25	43
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N[C@H]1CCc2ccc(Cl)cc21	ZINC000875390993	GG	On-Demand	Anodyne	SLC18A3	25	43
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N[C@@H]1CCc2ccc(Cl)cc21	ZINC000875390994	GG	On-Demand	Anodyne	SLC18A3	25	43
CC(=O)C1CCN(C(=O)NCc2ccc(O)c(Br)c2)CC1	ZINC000875391103	FF	On-Demand	Anodyne	EPHX2	15	44
COC(=O)[C@H](NC(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)C1CC1	ZINC000875391111	GD	On-Demand	Anodyne	F2	25	42
COC(=O)[C@H](NC(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)C1CC1	ZINC000875391111	GD	On-Demand	Anodyne	ACE	31	47
COC(=O)[C@H](NC(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)C1CC1	ZINC000875391111	GD	On-Demand	Anodyne	CTRA_BOVIN	55	33
COC(=O)[C@H](NC(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)C1CC1	ZINC000875391111	GD	On-Demand	Anodyne	CTSG	42	33
COC(=O)[C@H](NC(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)C1CC1	ZINC000875391111	GD	On-Demand	Anodyne	CTSK	21	40
COC(=O)[C@H](NC(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)C1CC1	ZINC000875391111	GD	On-Demand	Anodyne	PREP	29	43
COC(=O)[C@H](NC(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)C1CC1	ZINC000875391111	GD	On-Demand	Anodyne	CELA2A	42	33
COC(=O)[C@H](NC(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)C1CC1	ZINC000875391111	GD	On-Demand	Anodyne	LGMN	77	44
COC(=O)[C@H](NC(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)C1CC1	ZINC000875391111	GD	On-Demand	Anodyne	CAPN1	45	42
COC(=O)[C@H](NC(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)C1CC1	ZINC000875391111	GD	On-Demand	Anodyne	KLK5	41	41
COC(=O)[C@H](NC(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)C1CC1	ZINC000875391111	GD	On-Demand	Anodyne	BIRC2	24	42
COC(=O)[C@H](NC(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)C1CC1	ZINC000875391111	GD	On-Demand	Anodyne	Q9NAW4_PLAFA	44	51
COC(=O)[C@H](NC(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)C1CC1	ZINC000875391113	GD	On-Demand	Anodyne	F2	25	42
COC(=O)[C@H](NC(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)C1CC1	ZINC000875391113	GD	On-Demand	Anodyne	ACE	31	47
COC(=O)[C@H](NC(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)C1CC1	ZINC000875391113	GD	On-Demand	Anodyne	CTRA_BOVIN	55	33
COC(=O)[C@H](NC(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)C1CC1	ZINC000875391113	GD	On-Demand	Anodyne	CTSG	42	33
COC(=O)[C@H](NC(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)C1CC1	ZINC000875391113	GD	On-Demand	Anodyne	CTSK	21	40
COC(=O)[C@H](NC(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)C1CC1	ZINC000875391113	GD	On-Demand	Anodyne	PREP	29	43
COC(=O)[C@H](NC(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)C1CC1	ZINC000875391113	GD	On-Demand	Anodyne	CELA2A	42	33
COC(=O)[C@H](NC(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)C1CC1	ZINC000875391113	GD	On-Demand	Anodyne	LGMN	77	44
COC(=O)[C@H](NC(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)C1CC1	ZINC000875391113	GD	On-Demand	Anodyne	CAPN1	45	42
COC(=O)[C@H](NC(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)C1CC1	ZINC000875391113	GD	On-Demand	Anodyne	KLK5	41	41
COC(=O)[C@H](NC(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)C1CC1	ZINC000875391113	GD	On-Demand	Anodyne	BIRC2	24	42
COC(=O)[C@H](NC(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1)C1CC1	ZINC000875391113	GD	On-Demand	Anodyne	Q9NAW4_PLAFA	44	51
O=C(NC1CCN([C@H]2CCC[C@@H]2O)CC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875391196	GF	On-Demand	Anodyne	SLC18A3	82	46
O=C(NC1CCN([C@H]2CCC[C@@H]2O)CC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875391196	GF	On-Demand	Anodyne	EPHX2	24	43
O=C(NC1CCN([C@H]2CCC[C@@H]2O)CC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875391196	GF	On-Demand	Anodyne	SMO	16	45
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875391197	GF	On-Demand	Anodyne	SLC18A3	82	46
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875391197	GF	On-Demand	Anodyne	EPHX2	24	43
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875391197	GF	On-Demand	Anodyne	SMO	16	45
O=C(NC1CCN([C@H]2CCC[C@H]2O)CC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875391198	GF	On-Demand	Anodyne	SLC18A3	82	46
O=C(NC1CCN([C@H]2CCC[C@H]2O)CC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875391198	GF	On-Demand	Anodyne	EPHX2	24	43
O=C(NC1CCN([C@H]2CCC[C@H]2O)CC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875391198	GF	On-Demand	Anodyne	SMO	16	45
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875391199	GF	On-Demand	Anodyne	SLC18A3	82	46
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875391199	GF	On-Demand	Anodyne	EPHX2	24	43
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875391199	GF	On-Demand	Anodyne	SMO	16	45
CONC(=O)C1CCN(C(=O)NCc2ccc(O)c(Br)c2)CC1	ZINC000875391279	GD	On-Demand	Anodyne	EPHX2	19	43
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3ccc(OC)c(Cl)c3)C[C@@H]1C2	ZINC000875391291	FE	On-Demand	Anodyne	PDE5A	46	39
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3ccc(OC)c(Cl)c3)C[C@@H]1C2	ZINC000875391291	FE	On-Demand	Anodyne	PDE6A	43	33
N#Cc1cccc([C@H](NC(=O)NCCS(=O)(=O)CC2CC2)C(F)(F)F)c1	ZINC000875391293	GE	On-Demand	Mild	CTSS	17	45
N#Cc1cccc([C@@H](NC(=O)NCCS(=O)(=O)CC2CC2)C(F)(F)F)c1	ZINC000875391294	GE	On-Demand	Mild	CTSS	17	45
CCC[C@H](CCO)NC(=O)NCc1ccc(OC)c(Cl)c1	ZINC000875391297	DF	On-Demand	Anodyne	PDE5A	48	42
CCC[C@H](CCO)NC(=O)NCc1ccc(OC)c(Cl)c1	ZINC000875391297	DF	On-Demand	Anodyne	PDE6A	54	42
CCC[C@@H](CCO)NC(=O)NCc1ccc(OC)c(Cl)c1	ZINC000875391298	DF	On-Demand	Anodyne	PDE5A	48	42
CCC[C@@H](CCO)NC(=O)NCc1ccc(OC)c(Cl)c1	ZINC000875391298	DF	On-Demand	Anodyne	PDE6A	54	42
COC(=O)[C@@]1(OC)CCN(C(=O)NCc2ccc(OC)c(Cl)c2)C1	ZINC000875391313	FD	On-Demand	Anodyne	PDE5A	48	42
COC(=O)[C@@]1(OC)CCN(C(=O)NCc2ccc(OC)c(Cl)c2)C1	ZINC000875391313	FD	On-Demand	Anodyne	PDE6A	45	34
O=C(Nc1nc2ccc(F)cn2n1)[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875391322	FG	On-Demand	Anodyne	C3AR1	44	46
O=C(Nc1nc2ccc(F)cn2n1)[C@H](Cc1cccnc1)C1CCCC1	ZINC000875391323	FG	On-Demand	Anodyne	C3AR1	44	46
CCOC(=O)c1csc(N(C)C(=O)[C@H]2CCc3cc(OC)ccc32)n1	ZINC000875391348	FG	On-Demand	Anodyne	PPARD	44	38
CCOC(=O)c1csc(N(C)C(=O)[C@@H]2CCc3cc(OC)ccc32)n1	ZINC000875391349	FG	On-Demand	Anodyne	PPARD	44	38
CCO[C@H](C(=O)N(CC(=O)N(C)C)c1ccccc1)[C@@H]1CCOC1	ZINC000875391360	ED	On-Demand	Anodyne	AMY2	45	31
CCO[C@@H](C(=O)N(CC(=O)N(C)C)c1ccccc1)[C@@H]1CCOC1	ZINC000875391361	ED	On-Demand	Anodyne	AMY2	45	31
CCO[C@@H](C(=O)N(CC(=O)N(C)C)c1ccccc1)[C@H]1CCOC1	ZINC000875391362	ED	On-Demand	Anodyne	AMY2	45	31
CCO[C@H](C(=O)N(CC(=O)N(C)C)c1ccccc1)[C@H]1CCOC1	ZINC000875391363	ED	On-Demand	Anodyne	AMY2	45	31
CCOC(=O)[C@@]1(C)CN(C(=O)NCc2ccc(OC)c(Cl)c2)CCO1	ZINC000875391380	FE	On-Demand	Anodyne	PDE5A	44	39
CCOC(=O)[C@@]1(C)CN(C(=O)NCc2ccc(OC)c(Cl)c2)CCO1	ZINC000875391380	FE	On-Demand	Anodyne	PDE6A	48	39
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875391391	GE	On-Demand	Anodyne	SLC18A3	51	43
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875391391	GE	On-Demand	Anodyne	EPHX2	24	43
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875391392	GE	On-Demand	Anodyne	SLC18A3	51	43
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875391392	GE	On-Demand	Anodyne	EPHX2	24	43
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875391393	GE	On-Demand	Anodyne	SLC18A3	51	43
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875391393	GE	On-Demand	Anodyne	EPHX2	24	43
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875391394	GE	On-Demand	Anodyne	SLC18A3	51	43
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875391394	GE	On-Demand	Anodyne	EPHX2	24	43
CN1CCC(CNC(=O)N[C@@H]2CCCc3c[nH]nc32)(c2ccccc2)CC1	ZINC000875391405	FF	On-Demand	Anodyne	KCNA3	48	38
CN1CCC(CNC(=O)N[C@@H]2CCCc3c[nH]nc32)(c2ccccc2)CC1	ZINC000875391405	FF	On-Demand	Anodyne	SOAT1	15	41
CN1CCC(CNC(=O)N[C@H]2CCCc3c[nH]nc32)(c2ccccc2)CC1	ZINC000875391406	FF	On-Demand	Anodyne	KCNA3	48	38
CN1CCC(CNC(=O)N[C@H]2CCCc3c[nH]nc32)(c2ccccc2)CC1	ZINC000875391406	FF	On-Demand	Anodyne	SOAT1	15	41
O=C(NCc1ccc(O)c(Br)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875391419	GH	On-Demand	Anodyne	EPHX2	20	41
O=C(NCc1ccc(O)c(Br)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875391420	GH	On-Demand	Anodyne	EPHX2	20	41
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000875391436	EE	On-Demand	Reactive	PRNP	16	44
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000875391436	EE	On-Demand	Reactive	CA12	17	49
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000875391436	EE	On-Demand	Reactive	MTCA1	15	47
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000875391436	EE	On-Demand	Reactive	P96878_MYCTU	21	47
CC(=O)N(C)c1cccc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)c1	ZINC000875391471	GI	On-Demand	Anodyne	TAAR1	48	38
CC(=O)N(C)c1cccc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)c1	ZINC000875391471	GI	On-Demand	Anodyne	KCNK3	125	44
CC(=O)N(C)c1cccc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)c1	ZINC000875391471	GI	On-Demand	Anodyne	KCNK9	84	43
CC(=O)c1ccc(NC(=O)NNC(=O)c2cc(-c3ccccc3)nc3ccccc23)cc1	ZINC000875391480	HJ	On-Demand	Reactive	PRS	59	47
CC(=O)c1ccc(NC(=O)NNC(=O)c2cc(-c3ccccc3)nc3ccccc23)cc1	ZINC000875391480	HJ	On-Demand	Reactive	PRNP	46	47
CC(=O)c1ccc(NC(=O)NNC(=O)c2cc(-c3ccccc3)nc3ccccc23)cc1	ZINC000875391480	HJ	On-Demand	Reactive	TACR3	49	52
CC(=O)c1ccc(NC(=O)NNC(=O)c2cc(-c3ccccc3)nc3ccccc23)cc1	ZINC000875391480	HJ	On-Demand	Reactive	MT-CO2	63	52
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1c(C)cccc1C	ZINC000875391542	EF	On-Demand	Anodyne	SLC6A3	47	38
CCOC(=O)[C@@H]1CC[C@H](C(=O)N(CC(=O)N(C)C)c2ccccc2)C1	ZINC000875391558	EE	On-Demand	Anodyne	AMY2	43	29
COC(=O)N(C)NC(=O)NCc1ccc(OC)c(Cl)c1	ZINC000875391575	DD	On-Demand	Reactive	PDE5A	47	43
COC(=O)N(C)NC(=O)NCc1ccc(OC)c(Cl)c1	ZINC000875391575	DD	On-Demand	Reactive	PDE6A	51	43
COC(=O)N(C)NC(=O)NCc1ccc(OC)c(Cl)c1	ZINC000875391575	DD	On-Demand	Reactive	MT-ND1	23	40
CC(=O)c1ccc(NC(=O)NNC(=O)CCCOc2ccc(Cl)cc2Cl)cc1	ZINC000875391594	HI	On-Demand	Reactive	CPT1A	43	31
CC(=O)c1ccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	ZINC000875391620	HE	On-Demand	Reactive	HTR1A	55	51
CC(=O)c1ccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	ZINC000875391620	HE	On-Demand	Reactive	DRD2	35	56
CC(=O)c1ccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	ZINC000875391620	HE	On-Demand	Reactive	DRD4	36	42
CC(=O)c1ccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	ZINC000875391620	HE	On-Demand	Reactive	HTR2A	29	43
CC(=O)c1ccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	ZINC000875391620	HE	On-Demand	Reactive	DRD3	41	45
CC(=O)c1ccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	ZINC000875391620	HE	On-Demand	Reactive	HTR7	63	44
CC(=O)c1ccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	ZINC000875391620	HE	On-Demand	Reactive	PRNP	70	50
CC(=O)c1ccc(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1	ZINC000875391620	HE	On-Demand	Reactive	EPHX2	21	43
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)Nc3nccs3)cc2)cc1	ZINC000875391642	JF	On-Demand	Reactive	MAP1	118	38
CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)Nc3nccs3)cc2)cc1	ZINC000875391642	JF	On-Demand	Reactive	GCK	23	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(O)c(Br)c1	ZINC000875391664	GE	On-Demand	Anodyne	SLC6A3	48	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(O)c(Br)c1	ZINC000875391665	GE	On-Demand	Anodyne	SLC6A3	48	39
COC(=O)[C@@H]1CN(C(=O)NCc2ccc(OC)c(Cl)c2)C[C@@H](C)O1	ZINC000875391699	FD	On-Demand	Anodyne	PDE5A	46	41
COC(=O)[C@@H]1CN(C(=O)NCc2ccc(OC)c(Cl)c2)C[C@@H](C)O1	ZINC000875391699	FD	On-Demand	Anodyne	PDE6A	45	35
COC(=O)C1(O)CN(C(=O)NCc2ccc(OC)c(Cl)c2)C1	ZINC000875391725	EC	On-Demand	Anodyne	PDE5A	53	42
COC(=O)C1(O)CN(C(=O)NCc2ccc(OC)c(Cl)c2)C1	ZINC000875391725	EC	On-Demand	Anodyne	PDE6A	48	36
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)c(Cl)c1	ZINC000875391786	FF	On-Demand	Anodyne	PDE5A	52	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)c(Cl)c1	ZINC000875391786	FF	On-Demand	Anodyne	SLC6A4	33	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)c(Cl)c1	ZINC000875391786	FF	On-Demand	Anodyne	SLC6A3	56	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)c(Cl)c1	ZINC000875391786	FF	On-Demand	Anodyne	HTR4	25	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)c(Cl)c1	ZINC000875391786	FF	On-Demand	Anodyne	PDE6A	47	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)c(Cl)c1	ZINC000875391787	FF	On-Demand	Anodyne	PDE5A	52	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)c(Cl)c1	ZINC000875391787	FF	On-Demand	Anodyne	SLC6A4	33	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)c(Cl)c1	ZINC000875391787	FF	On-Demand	Anodyne	SLC6A3	56	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)c(Cl)c1	ZINC000875391787	FF	On-Demand	Anodyne	HTR4	25	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(OC)c(Cl)c1	ZINC000875391787	FF	On-Demand	Anodyne	PDE6A	47	37
O=C(NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1)Nc1nccs1	ZINC000875391859	JG	On-Demand	Reactive	MAP1	96	38
O=C(NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1)Nc1nccs1	ZINC000875391859	JG	On-Demand	Reactive	GRM4	29	53
O=C(NCCO)C1CCN(C(=O)NC[C@H]2[C@H]3c4ccccc4C[C@H]32)CC1	ZINC000875391919	FD	On-Demand	Anodyne	MTNR1A	16	41
O=C(NCCO)C1CCN(C(=O)NC[C@H]2[C@H]3c4ccccc4C[C@H]32)CC1	ZINC000875391919	FD	On-Demand	Anodyne	MTNR1B	17	41
O=C(NCCO)C1CCN(C(=O)NC[C@@H]2[C@H]3Cc4ccccc4[C@@H]32)CC1	ZINC000875391920	FD	On-Demand	Anodyne	MTNR1A	16	41
O=C(NCCO)C1CCN(C(=O)NC[C@@H]2[C@H]3Cc4ccccc4[C@@H]32)CC1	ZINC000875391920	FD	On-Demand	Anodyne	MTNR1B	17	41
O=C(NCCO)C1CCN(C(=O)NC[C@@H]2[C@H]3Cc4ccccc4[C@H]32)CC1	ZINC000875391921	FD	On-Demand	Anodyne	MTNR1A	16	41
O=C(NCCO)C1CCN(C(=O)NC[C@@H]2[C@H]3Cc4ccccc4[C@H]32)CC1	ZINC000875391921	FD	On-Demand	Anodyne	MTNR1B	17	41
O=C(NCCO)C1CCN(C(=O)NC[C@@H]2[C@@H]3Cc4ccccc4[C@@H]23)CC1	ZINC000875391922	FD	On-Demand	Anodyne	MTNR1A	16	41
O=C(NCCO)C1CCN(C(=O)NC[C@@H]2[C@@H]3Cc4ccccc4[C@@H]23)CC1	ZINC000875391922	FD	On-Demand	Anodyne	MTNR1B	17	41
CC(=O)c1ccc(NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000875391925	EE	On-Demand	Reactive	CACNA1D	44	35
CC(=O)c1ccc(NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000875391925	EE	On-Demand	Reactive	AKR1C3	20	46
CC(=O)c1ccc(NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000875391925	EE	On-Demand	Reactive	UREA_CANEN	22	49
CC(=O)c1ccc(NC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000875391925	EE	On-Demand	Reactive	KCNK3	44	33
Cn1nnnc1C1CCN(C(=O)NCc2ccc(O)c(Br)c2)CC1	ZINC000875391940	GD	On-Demand	Anodyne	IL2RA	40	32
COc1ccc(N2CCN(C(=O)N[C@H]3CCCc4c[nH]nc43)CC2)c(OC)c1	ZINC000875391971	GE	On-Demand	Clean	HTR1A	18	45
COc1ccc(N2CCN(C(=O)N[C@@H]3CCCc4c[nH]nc43)CC2)c(OC)c1	ZINC000875391972	GE	On-Demand	Clean	HTR1A	18	45
O=C(N[C@H]1CCCC(F)(F)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875392059	EG	On-Demand	Anodyne	EPHX2	20	44
O=C(N[C@@H]1CCCC(F)(F)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875392060	EG	On-Demand	Anodyne	EPHX2	20	44
O=C(N[C@H]1CCCC(F)(F)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875392061	EG	On-Demand	Anodyne	EPHX2	20	44
O=C(N[C@@H]1CCCC(F)(F)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875392062	EG	On-Demand	Anodyne	EPHX2	20	44
Cc1ccc(NC(=O)c2ccnc(OCCN(C)C)c2)cc1N1CCOC1=O	ZINC000875392069	GF	On-Demand	Anodyne	MAPK14	23	45
Cc1ccc(NC(=O)c2ccnc(OCCN(C)C)c2)cc1N1CCOC1=O	ZINC000875392069	GF	On-Demand	Anodyne	KCNK3	15	40
CCCCCCCNC(=O)C(=O)N[C@@H]1CCC(=O)NC1(C)C	ZINC000875392111	DD	On-Demand	Mild	ASAH1	78	35
CCCCCCCNC(=O)C(=O)N[C@@H]1CCC(=O)NC1(C)C	ZINC000875392111	DD	On-Demand	Mild	LASR	54	35
CCCCCCCNC(=O)C(=O)N[C@H]1CCC(=O)NC1(C)C	ZINC000875392112	DD	On-Demand	Mild	ASAH1	78	35
CCCCCCCNC(=O)C(=O)N[C@H]1CCC(=O)NC1(C)C	ZINC000875392112	DD	On-Demand	Mild	LASR	54	35
O=C(N[C@H]1CCCC(F)(F)C1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875392220	EI	On-Demand	Anodyne	EPHX2	22	40
O=C(N[C@@H]1CCCC(F)(F)C1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875392221	EI	On-Demand	Anodyne	EPHX2	22	40
O=C(NNC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1)Nc1nccs1	ZINC000875392244	HJ	On-Demand	Reactive	MAP1	115	40
CC(=O)c1ccc(NC(=O)NNC(=O)c2cc(C)n(-c3ccccc3)c2C)cc1	ZINC000875392294	GH	On-Demand	Reactive	PRNP	32	43
O=C(Cc1csc(C2CC2)n1)N(Cc1cccs1)CC(F)(F)F	ZINC000875392297	FI	On-Demand	Anodyne	ETHR	28	40
Cc1cc(OCc2ccc(C(=O)NNC(=O)Nc3nccs3)cc2)ccc1Cl	ZINC000875392423	HI	On-Demand	Reactive	MAP1	117	40
CC(=O)C1CCN(C(=O)NC2CCN([C@H]3CCC[C@H]3O)CC2)CC1	ZINC000875392438	ED	On-Demand	Anodyne	SLC18A3	59	40
CC(=O)C1CCN(C(=O)NC2CCN([C@@H]3CCC[C@H]3O)CC2)CC1	ZINC000875392439	ED	On-Demand	Anodyne	SLC18A3	59	40
CC(=O)C1CCN(C(=O)NC2CCN([C@H]3CCC[C@@H]3O)CC2)CC1	ZINC000875392440	ED	On-Demand	Anodyne	SLC18A3	59	40
CC(=O)C1CCN(C(=O)NC2CCN([C@@H]3CCC[C@@H]3O)CC2)CC1	ZINC000875392441	ED	On-Demand	Anodyne	SLC18A3	59	40
C[S@](=N)(=O)N1CCN(C(=O)NC2CCN([C@@H]3CCCC[C@H]3O)CC2)CC1	ZINC000875392444	GC	On-Demand	Anodyne	SLC18A3	36	44
C[S@](=N)(=O)N1CCN(C(=O)NC2CCN([C@H]3CCCC[C@H]3O)CC2)CC1	ZINC000875392445	GC	On-Demand	Anodyne	SLC18A3	36	44
C[S@](=N)(=O)N1CCN(C(=O)NC2CCN([C@H]3CCCC[C@@H]3O)CC2)CC1	ZINC000875392446	GC	On-Demand	Anodyne	SLC18A3	36	44
C[S@](=N)(=O)N1CCN(C(=O)NC2CCN([C@@H]3CCCC[C@@H]3O)CC2)CC1	ZINC000875392447	GC	On-Demand	Anodyne	SLC18A3	36	44
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875392448	FE	On-Demand	Anodyne	SLC18A3	33	48
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875392449	FE	On-Demand	Anodyne	SLC18A3	33	48
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875392450	FE	On-Demand	Anodyne	SLC18A3	33	48
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875392451	FE	On-Demand	Anodyne	SLC18A3	33	48
COCCC(=O)N1CCC(NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)CC1	ZINC000875392458	GD	On-Demand	Anodyne	EPHX2	35	42
COCCC(=O)N1CCC(NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)CC1	ZINC000875392458	GD	On-Demand	Anodyne	CCR8	66	35
COCCC(=O)N1CCC(NC(=O)N2CCC[C@](O)(c3ccccc3)C2)CC1	ZINC000875392459	GD	On-Demand	Anodyne	EPHX2	35	42
COCCC(=O)N1CCC(NC(=O)N2CCC[C@](O)(c3ccccc3)C2)CC1	ZINC000875392459	GD	On-Demand	Anodyne	CCR8	66	35
CCC1(CC)CCCN1C(=O)NC1CCN(C(=O)CCOC)CC1	ZINC000875392460	EE	On-Demand	Anodyne	EPHX2	16	40
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875392461	GE	On-Demand	Anodyne	SLC18A3	28	44
O=C(NC1CCN([C@H]2CCCC[C@H]2O)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875392462	GE	On-Demand	Anodyne	SLC18A3	28	44
O=C(NC1CCN([C@H]2CCCC[C@@H]2O)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875392463	GE	On-Demand	Anodyne	SLC18A3	28	44
O=C(NC1CCN([C@@H]2CCCC[C@H]2O)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875392464	GE	On-Demand	Anodyne	SLC18A3	28	44
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875392465	FD	On-Demand	Anodyne	SLC18A3	26	44
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875392466	FD	On-Demand	Anodyne	SLC18A3	26	44
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875392467	FD	On-Demand	Anodyne	SLC18A3	26	44
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875392468	FD	On-Demand	Anodyne	SLC18A3	26	44
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875392473	GE	On-Demand	Anodyne	SLC18A3	47	40
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875392474	GE	On-Demand	Anodyne	SLC18A3	47	40
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875392475	GE	On-Demand	Anodyne	SLC18A3	47	40
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875392476	GE	On-Demand	Anodyne	SLC18A3	47	40
COC(=O)N(C)NC(=O)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000875392477	EC	On-Demand	Reactive	SLC18A3	40	43
COC(=O)N(C)NC(=O)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000875392478	EC	On-Demand	Reactive	SLC18A3	40	43
COC(=O)N(C)NC(=O)NC1CCN([C@H]2CCCC[C@H]2O)CC1	ZINC000875392479	EC	On-Demand	Reactive	SLC18A3	40	43
COC(=O)N(C)NC(=O)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	ZINC000875392480	EC	On-Demand	Reactive	SLC18A3	40	43
O=C(NCC[C@H](O)C1CCCC1)NC1CCN([C@H]2CCC[C@@H]2O)CC1	ZINC000875392485	FD	On-Demand	Anodyne	SLC18A3	28	40
O=C(NCC[C@H](O)C1CCCC1)NC1CCN([C@@H]2CCC[C@H]2O)CC1	ZINC000875392486	FD	On-Demand	Anodyne	SLC18A3	28	40
O=C(NCC[C@H](O)C1CCCC1)NC1CCN([C@H]2CCC[C@H]2O)CC1	ZINC000875392487	FD	On-Demand	Anodyne	SLC18A3	28	40
O=C(NCC[C@H](O)C1CCCC1)NC1CCN([C@@H]2CCC[C@@H]2O)CC1	ZINC000875392488	FD	On-Demand	Anodyne	SLC18A3	28	40
CCC1(CC)CCCN1C(=O)NC1CCN([C@H]2CCC[C@H]2O)CC1	ZINC000875392489	EF	On-Demand	Anodyne	SLC18A3	31	43
CCC1(CC)CCCN1C(=O)NC1CCN([C@@H]2CCC[C@H]2O)CC1	ZINC000875392490	EF	On-Demand	Anodyne	SLC18A3	31	43
CCC1(CC)CCCN1C(=O)NC1CCN([C@H]2CCC[C@@H]2O)CC1	ZINC000875392491	EF	On-Demand	Anodyne	SLC18A3	31	43
CCC1(CC)CCCN1C(=O)NC1CCN([C@@H]2CCC[C@@H]2O)CC1	ZINC000875392492	EF	On-Demand	Anodyne	SLC18A3	31	43
COCCC(=O)N1CCC(NC(=O)N2C[C@@H]3C[C@H]2CN3c2ccccc2)CC1	ZINC000875392515	GD	On-Demand	Anodyne	CCR8	42	33
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000875392525	GF	On-Demand	Anodyne	SIGMAR1	19	48
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000875392525	GF	On-Demand	Anodyne	SLC18A3	37	40
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000875392525	GF	On-Demand	Anodyne	EPHX2	20	44
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000875392525	GF	On-Demand	Anodyne	NCE103	15	40
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN([C@H]2CCCC[C@H]2O)CC1	ZINC000875392526	GF	On-Demand	Anodyne	SIGMAR1	19	48
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN([C@H]2CCCC[C@H]2O)CC1	ZINC000875392526	GF	On-Demand	Anodyne	SLC18A3	37	40
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN([C@H]2CCCC[C@H]2O)CC1	ZINC000875392526	GF	On-Demand	Anodyne	EPHX2	20	44
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN([C@H]2CCCC[C@H]2O)CC1	ZINC000875392526	GF	On-Demand	Anodyne	NCE103	15	40
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000875392527	GF	On-Demand	Anodyne	SIGMAR1	19	48
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000875392527	GF	On-Demand	Anodyne	SLC18A3	37	40
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000875392527	GF	On-Demand	Anodyne	EPHX2	20	44
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000875392527	GF	On-Demand	Anodyne	NCE103	15	40
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	ZINC000875392528	GF	On-Demand	Anodyne	SIGMAR1	19	48
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	ZINC000875392528	GF	On-Demand	Anodyne	SLC18A3	37	40
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	ZINC000875392528	GF	On-Demand	Anodyne	EPHX2	20	44
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	ZINC000875392528	GF	On-Demand	Anodyne	NCE103	15	40
O=C(NC1CCN([C@H]2CCCC[C@@H]2O)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875392630	GF	On-Demand	Anodyne	SIGMAR1	19	49
O=C(NC1CCN([C@H]2CCCC[C@@H]2O)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875392630	GF	On-Demand	Anodyne	SLC18A3	91	47
O=C(NC1CCN([C@H]2CCCC[C@@H]2O)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875392630	GF	On-Demand	Anodyne	EPHX2	38	41
O=C(NC1CCN([C@H]2CCCC[C@H]2O)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875392631	GF	On-Demand	Anodyne	SIGMAR1	19	49
O=C(NC1CCN([C@H]2CCCC[C@H]2O)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875392631	GF	On-Demand	Anodyne	SLC18A3	91	47
O=C(NC1CCN([C@H]2CCCC[C@H]2O)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875392631	GF	On-Demand	Anodyne	EPHX2	38	41
O=C(NC1CCN([C@@H]2CCCC[C@H]2O)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875392632	GF	On-Demand	Anodyne	SIGMAR1	19	49
O=C(NC1CCN([C@@H]2CCCC[C@H]2O)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875392632	GF	On-Demand	Anodyne	SLC18A3	91	47
O=C(NC1CCN([C@@H]2CCCC[C@H]2O)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875392632	GF	On-Demand	Anodyne	EPHX2	38	41
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875392633	GF	On-Demand	Anodyne	SIGMAR1	19	49
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875392633	GF	On-Demand	Anodyne	SLC18A3	91	47
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875392633	GF	On-Demand	Anodyne	EPHX2	38	41
CN1CCN(C(=O)NC2CCN([C@@H]3CCCC[C@@H]3O)CC2)Cc2cccnc21	ZINC000875392636	GD	On-Demand	Anodyne	SLC18A3	51	35
CN1CCN(C(=O)NC2CCN([C@H]3CCCC[C@@H]3O)CC2)Cc2cccnc21	ZINC000875392637	GD	On-Demand	Anodyne	SLC18A3	51	35
CN1CCN(C(=O)NC2CCN([C@H]3CCCC[C@H]3O)CC2)Cc2cccnc21	ZINC000875392638	GD	On-Demand	Anodyne	SLC18A3	51	35
CN1CCN(C(=O)NC2CCN([C@@H]3CCCC[C@H]3O)CC2)Cc2cccnc21	ZINC000875392639	GD	On-Demand	Anodyne	SLC18A3	51	35
C[S@](=N)(=O)N1CCN(C(=O)NC2CCN([C@@H]3CCC[C@H]3O)CC2)CC1	ZINC000875392640	FC	On-Demand	Anodyne	SLC18A3	25	41
C[S@](=N)(=O)N1CCN(C(=O)NC2CCN([C@@H]3CCC[C@@H]3O)CC2)CC1	ZINC000875392641	FC	On-Demand	Anodyne	SLC18A3	25	41
C[S@](=N)(=O)N1CCN(C(=O)NC2CCN([C@H]3CCC[C@H]3O)CC2)CC1	ZINC000875392642	FC	On-Demand	Anodyne	SLC18A3	25	41
C[S@](=N)(=O)N1CCN(C(=O)NC2CCN([C@H]3CCC[C@@H]3O)CC2)CC1	ZINC000875392643	FC	On-Demand	Anodyne	SLC18A3	25	41
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875392644	GF	On-Demand	Anodyne	SLC18A3	57	60
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875392645	GF	On-Demand	Anodyne	SLC18A3	57	60
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875392646	GF	On-Demand	Anodyne	SLC18A3	57	60
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875392647	GF	On-Demand	Anodyne	SLC18A3	57	60
O=C(NC1CCN([C@H]2CCCC[C@@H]2O)CC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875392648	GE	On-Demand	Anodyne	SLC18A3	71	45
O=C(NC1CCN([C@@H]2CCCC[C@H]2O)CC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875392649	GE	On-Demand	Anodyne	SLC18A3	71	45
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875392650	GE	On-Demand	Anodyne	SLC18A3	71	45
O=C(NC1CCN([C@H]2CCCC[C@H]2O)CC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875392651	GE	On-Demand	Anodyne	SLC18A3	71	45
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875392670	ED	On-Demand	Anodyne	SLC18A3	21	41
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875392671	ED	On-Demand	Anodyne	SLC18A3	21	41
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875392672	ED	On-Demand	Anodyne	SLC18A3	21	41
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875392673	ED	On-Demand	Anodyne	SLC18A3	21	41
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875392711	EE	On-Demand	Anodyne	SLC18A3	38	48
O=C(NC1CCN([C@H]2CCCC[C@@H]2O)CC1)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875392712	EE	On-Demand	Anodyne	SLC18A3	38	48
O=C(NC1CCN([C@H]2CCCC[C@H]2O)CC1)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875392713	EE	On-Demand	Anodyne	SLC18A3	38	48
O=C(NC1CCN([C@@H]2CCCC[C@H]2O)CC1)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875392714	EE	On-Demand	Anodyne	SLC18A3	38	48
CN1CCN(C(=O)NC2CCN([C@@H]3CCC[C@@H]3O)CC2)Cc2cccnc21	ZINC000875392744	FD	On-Demand	Anodyne	SLC18A3	46	35
CN1CCN(C(=O)NC2CCN([C@@H]3CCC[C@H]3O)CC2)Cc2cccnc21	ZINC000875392747	FD	On-Demand	Anodyne	SLC18A3	46	35
CN1CCN(C(=O)NC2CCN([C@H]3CCC[C@@H]3O)CC2)Cc2cccnc21	ZINC000875392751	FD	On-Demand	Anodyne	SLC18A3	46	35
CN1CCN(C(=O)NC2CCN([C@H]3CCC[C@H]3O)CC2)Cc2cccnc21	ZINC000875392756	FD	On-Demand	Anodyne	SLC18A3	46	35
O=C(NNC(=O)c1ccc(COc2ccc3ccccc3c2)cc1)Nc1nccs1	ZINC000875392757	HI	On-Demand	Reactive	CYSLTR1	33	41
O=C(NNC(=O)c1ccc(COc2ccc3ccccc3c2)cc1)Nc1nccs1	ZINC000875392757	HI	On-Demand	Reactive	MAP1	122	47
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@@H]1CCOC3(CCCC3)C1)CC2	ZINC000875392777	GH	On-Demand	Anodyne	SLC18A2	40	35
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)N[C@@H]1CCOC3(CCCC3)C1)CC2	ZINC000875392778	GH	On-Demand	Anodyne	SLC18A2	40	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@H]1CCOC3(CCCC3)C1)CC2	ZINC000875392779	GH	On-Demand	Anodyne	SLC18A2	40	35
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)N[C@H]1CCOC3(CCCC3)C1)CC2	ZINC000875392780	GH	On-Demand	Anodyne	SLC18A2	40	35
O=C(NC1CCN([C@H]2CCCC[C@@H]2O)CC1)N[C@@H](CO)c1ccc(Cl)cc1	ZINC000875392845	GE	On-Demand	Anodyne	SLC18A3	30	46
O=C(NC1CCN([C@H]2CCCC[C@H]2O)CC1)N[C@@H](CO)c1ccc(Cl)cc1	ZINC000875392848	GE	On-Demand	Anodyne	SLC18A3	30	46
C[C@@H](NC(=O)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)c1ccccc1O	ZINC000875392867	FF	On-Demand	Clean	SIGMAR1	17	44
C[C@@H](NC(=O)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)c1ccccc1O	ZINC000875392867	FF	On-Demand	Clean	SLC18A3	69	42
C[C@@H](NC(=O)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)c1ccccc1O	ZINC000875392867	FF	On-Demand	Clean	EPHX2	34	40
C[C@@H](NC(=O)NC1CCN([C@H]2CCCC[C@H]2O)CC1)c1ccccc1O	ZINC000875392869	FF	On-Demand	Clean	SIGMAR1	17	44
C[C@@H](NC(=O)NC1CCN([C@H]2CCCC[C@H]2O)CC1)c1ccccc1O	ZINC000875392869	FF	On-Demand	Clean	SLC18A3	69	42
C[C@@H](NC(=O)NC1CCN([C@H]2CCCC[C@H]2O)CC1)c1ccccc1O	ZINC000875392869	FF	On-Demand	Clean	EPHX2	34	40
C[C@H](NC(=O)NC1CCN([C@H]2CCCC[C@@H]2O)CC1)c1ccccc1O	ZINC000875392871	FF	On-Demand	Clean	SIGMAR1	17	44
C[C@H](NC(=O)NC1CCN([C@H]2CCCC[C@@H]2O)CC1)c1ccccc1O	ZINC000875392871	FF	On-Demand	Clean	SLC18A3	69	42
C[C@H](NC(=O)NC1CCN([C@H]2CCCC[C@@H]2O)CC1)c1ccccc1O	ZINC000875392871	FF	On-Demand	Clean	EPHX2	34	40
C[C@@H](NC(=O)NC1CCN([C@H]2CCCC[C@@H]2O)CC1)c1ccccc1O	ZINC000875392873	FF	On-Demand	Clean	SIGMAR1	17	44
C[C@@H](NC(=O)NC1CCN([C@H]2CCCC[C@@H]2O)CC1)c1ccccc1O	ZINC000875392873	FF	On-Demand	Clean	SLC18A3	69	42
C[C@@H](NC(=O)NC1CCN([C@H]2CCCC[C@@H]2O)CC1)c1ccccc1O	ZINC000875392873	FF	On-Demand	Clean	EPHX2	34	40
C[C@@H](NC(=O)NC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1ccccc1O	ZINC000875392875	FF	On-Demand	Clean	SIGMAR1	17	44
C[C@@H](NC(=O)NC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1ccccc1O	ZINC000875392875	FF	On-Demand	Clean	SLC18A3	69	42
C[C@@H](NC(=O)NC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1ccccc1O	ZINC000875392875	FF	On-Demand	Clean	EPHX2	34	40
C[C@H](NC(=O)NC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1ccccc1O	ZINC000875392877	FF	On-Demand	Clean	SIGMAR1	17	44
C[C@H](NC(=O)NC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1ccccc1O	ZINC000875392877	FF	On-Demand	Clean	SLC18A3	69	42
C[C@H](NC(=O)NC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1ccccc1O	ZINC000875392877	FF	On-Demand	Clean	EPHX2	34	40
C[C@H](NC(=O)NC1CCN([C@H]2CCCC[C@H]2O)CC1)c1ccccc1O	ZINC000875392878	FF	On-Demand	Clean	SIGMAR1	17	44
C[C@H](NC(=O)NC1CCN([C@H]2CCCC[C@H]2O)CC1)c1ccccc1O	ZINC000875392878	FF	On-Demand	Clean	SLC18A3	69	42
C[C@H](NC(=O)NC1CCN([C@H]2CCCC[C@H]2O)CC1)c1ccccc1O	ZINC000875392878	FF	On-Demand	Clean	EPHX2	34	40
C[C@H](NC(=O)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)c1ccccc1O	ZINC000875392880	FF	On-Demand	Clean	SIGMAR1	17	44
C[C@H](NC(=O)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)c1ccccc1O	ZINC000875392880	FF	On-Demand	Clean	SLC18A3	69	42
C[C@H](NC(=O)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)c1ccccc1O	ZINC000875392880	FF	On-Demand	Clean	EPHX2	34	40
COCCC(=O)N1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875392894	FD	On-Demand	Anodyne	DRD4	17	44
COCCC(=O)N1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875392894	FD	On-Demand	Anodyne	C3AR1	41	39
COCCC(=O)N1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875392894	FD	On-Demand	Anodyne	EPHX2	54	54
COCCC(=O)N1CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875392894	FD	On-Demand	Anodyne	CCR8	66	36
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875392933	GC	On-Demand	Anodyne	SLC18A3	33	47
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875392936	GC	On-Demand	Anodyne	SLC18A3	33	47
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875392938	GC	On-Demand	Anodyne	SLC18A3	33	47
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N1CCC[C@](F)(c2ccccc2)C1	ZINC000875392949	GG	On-Demand	Anodyne	SLC18A3	56	43
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N1CCC[C@](F)(c2ccccc2)C1	ZINC000875392949	GG	On-Demand	Anodyne	EPHX2	23	42
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1CCC[C@](F)(c2ccccc2)C1	ZINC000875392950	GG	On-Demand	Anodyne	SLC18A3	56	43
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1CCC[C@](F)(c2ccccc2)C1	ZINC000875392950	GG	On-Demand	Anodyne	EPHX2	23	42
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N1CCC[C@@](F)(c2ccccc2)C1	ZINC000875392951	GG	On-Demand	Anodyne	SLC18A3	56	43
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N1CCC[C@@](F)(c2ccccc2)C1	ZINC000875392951	GG	On-Demand	Anodyne	EPHX2	23	42
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1CCC[C@@](F)(c2ccccc2)C1	ZINC000875392953	GG	On-Demand	Anodyne	SLC18A3	56	43
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1CCC[C@@](F)(c2ccccc2)C1	ZINC000875392953	GG	On-Demand	Anodyne	EPHX2	23	42
COCCC(=O)N1CCC(NC(=O)NNc2cccc(C)n2)CC1	ZINC000875392955	ED	On-Demand	Reactive	EPHX2	30	42
COCCC(=O)N1CCC(NC(=O)NNc2cccc(C)n2)CC1	ZINC000875392955	ED	On-Demand	Reactive	CCR8	57	36
C[C@H](NC(=O)NC1CCN([C@@H]2CCC[C@H]2O)CC1)c1ccccc1O	ZINC000875392958	EE	On-Demand	Clean	SLC18A3	62	39
C[C@@H](NC(=O)NC1CCN([C@@H]2CCC[C@H]2O)CC1)c1ccccc1O	ZINC000875392960	EE	On-Demand	Clean	SLC18A3	62	39
C[C@H](NC(=O)NC1CCN([C@H]2CCC[C@@H]2O)CC1)c1ccccc1O	ZINC000875392961	EE	On-Demand	Clean	SLC18A3	62	39
C[C@H](NC(=O)NC1CCN([C@H]2CCC[C@H]2O)CC1)c1ccccc1O	ZINC000875392962	EE	On-Demand	Clean	SLC18A3	62	39
C[C@@H](NC(=O)NC1CCN([C@@H]2CCC[C@@H]2O)CC1)c1ccccc1O	ZINC000875392963	EE	On-Demand	Clean	SLC18A3	62	39
C[C@@H](NC(=O)NC1CCN([C@H]2CCC[C@H]2O)CC1)c1ccccc1O	ZINC000875392964	EE	On-Demand	Clean	SLC18A3	62	39
C[C@@H](NC(=O)NC1CCN([C@H]2CCC[C@@H]2O)CC1)c1ccccc1O	ZINC000875392965	EE	On-Demand	Clean	SLC18A3	62	39
C[C@H](NC(=O)NC1CCN([C@@H]2CCC[C@@H]2O)CC1)c1ccccc1O	ZINC000875392966	EE	On-Demand	Clean	SLC18A3	62	39
COCCC(=O)N1CCC(NC(=O)NN=c2cc[nH]cc2C)CC1	ZINC000875393099	EC	On-Demand	Reactive	EPHX2	26	40
CN(C(=O)[C@@]1(C#N)CCCOC1)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875393107	EE	On-Demand	Mild	SIGMAR1	38	44
CN(C(=O)[C@@]1(C#N)CCCOC1)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875393107	EE	On-Demand	Mild	BIRC2	19	41
CN(C(=O)[C@@]1(C#N)CCCOC1)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875393112	EE	On-Demand	Mild	SIGMAR1	38	44
CN(C(=O)[C@@]1(C#N)CCCOC1)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875393112	EE	On-Demand	Mild	BIRC2	19	41
COCCC(=O)N1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875393130	GD	On-Demand	Anodyne	C3AR1	38	40
COCCC(=O)N1CCC(NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875393130	GD	On-Demand	Anodyne	EPHX2	38	50
COCCC(=O)N1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875393132	GD	On-Demand	Anodyne	C3AR1	38	40
COCCC(=O)N1CCC(NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000875393132	GD	On-Demand	Anodyne	EPHX2	38	50
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875393134	GE	On-Demand	Anodyne	SLC18A3	65	43
O=C(NC1CCN([C@H]2CCC[C@@H]2O)CC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875393136	GE	On-Demand	Anodyne	SLC18A3	65	43
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875393137	GE	On-Demand	Anodyne	SLC18A3	65	43
O=C(NC1CCN([C@H]2CCC[C@H]2O)CC1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875393139	GE	On-Demand	Anodyne	SLC18A3	65	43
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN([C@H]2CCC[C@H]2O)CC1	ZINC000875393141	FE	On-Demand	Anodyne	SIGMAR1	17	48
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN([C@H]2CCC[C@H]2O)CC1	ZINC000875393141	FE	On-Demand	Anodyne	EPHX2	18	42
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN([C@@H]2CCC[C@H]2O)CC1	ZINC000875393144	FE	On-Demand	Anodyne	SIGMAR1	17	48
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN([C@@H]2CCC[C@H]2O)CC1	ZINC000875393144	FE	On-Demand	Anodyne	EPHX2	18	42
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN([C@H]2CCC[C@@H]2O)CC1	ZINC000875393145	FE	On-Demand	Anodyne	SIGMAR1	17	48
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN([C@H]2CCC[C@@H]2O)CC1	ZINC000875393145	FE	On-Demand	Anodyne	EPHX2	18	42
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN([C@@H]2CCC[C@@H]2O)CC1	ZINC000875393147	FE	On-Demand	Anodyne	SIGMAR1	17	48
O=C(NCc1ccc(O)c(Cl)c1)NC1CCN([C@@H]2CCC[C@@H]2O)CC1	ZINC000875393147	FE	On-Demand	Anodyne	EPHX2	18	42
O=C(NNc1cccc(F)c1Cl)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000875393169	GF	On-Demand	Reactive	SLC18A3	42	40
O=C(NNc1cccc(F)c1Cl)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	ZINC000875393175	GF	On-Demand	Reactive	SLC18A3	42	40
O=C(NNc1cccc(F)c1Cl)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000875393177	GF	On-Demand	Reactive	SLC18A3	42	40
O=C(NNc1cccc(F)c1Cl)NC1CCN([C@H]2CCCC[C@H]2O)CC1	ZINC000875393178	GF	On-Demand	Reactive	SLC18A3	42	40
C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000875393185	GH	On-Demand	Anodyne	SLC18A3	33	46
C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)NC1CCN([C@H]2CCCC[C@H]2O)CC1	ZINC000875393186	GH	On-Demand	Anodyne	SLC18A3	33	46
O=C(NC1CCN([C@H]2CCC[C@H]2O)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875393197	GE	On-Demand	Anodyne	HRH3	22	41
O=C(NC1CCN([C@H]2CCC[C@H]2O)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875393197	GE	On-Demand	Anodyne	CCR3	35	41
O=C(NC1CCN([C@H]2CCC[C@H]2O)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875393197	GE	On-Demand	Anodyne	SLC18A3	51	42
O=C(NC1CCN([C@H]2CCC[C@H]2O)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875393197	GE	On-Demand	Anodyne	MLNR	15	41
O=C(NC1CCN([C@H]2CCC[C@H]2O)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875393197	GE	On-Demand	Anodyne	EPHX2	47	50
O=C(NC1CCN([C@H]2CCC[C@@H]2O)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875393198	GE	On-Demand	Anodyne	HRH3	22	41
O=C(NC1CCN([C@H]2CCC[C@@H]2O)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875393198	GE	On-Demand	Anodyne	CCR3	35	41
O=C(NC1CCN([C@H]2CCC[C@@H]2O)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875393198	GE	On-Demand	Anodyne	SLC18A3	51	42
O=C(NC1CCN([C@H]2CCC[C@@H]2O)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875393198	GE	On-Demand	Anodyne	MLNR	15	41
O=C(NC1CCN([C@H]2CCC[C@@H]2O)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875393198	GE	On-Demand	Anodyne	EPHX2	47	50
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875393199	GE	On-Demand	Anodyne	HRH3	22	41
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875393199	GE	On-Demand	Anodyne	CCR3	35	41
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875393199	GE	On-Demand	Anodyne	SLC18A3	51	42
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875393199	GE	On-Demand	Anodyne	MLNR	15	41
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875393199	GE	On-Demand	Anodyne	EPHX2	47	50
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875393200	GE	On-Demand	Anodyne	HRH3	22	41
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875393200	GE	On-Demand	Anodyne	CCR3	35	41
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875393200	GE	On-Demand	Anodyne	SLC18A3	51	42
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875393200	GE	On-Demand	Anodyne	MLNR	15	41
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875393200	GE	On-Demand	Anodyne	EPHX2	47	50
COc1cc(C(=O)NNC(=O)Nc2ccc(C(C)=O)cc2)cc(OC)c1OC	ZINC000875393227	GE	On-Demand	Reactive	CPT1A	21	41
COc1cc(C(=O)NNC(=O)Nc2ccc(C(C)=O)cc2)cc(OC)c1OC	ZINC000875393227	GE	On-Demand	Reactive	TUBB1	47	39
COc1cc(C(=O)NNC(=O)Nc2ccc(C(C)=O)cc2)cc(OC)c1OC	ZINC000875393227	GE	On-Demand	Reactive	PDGFRA	53	40
COc1cc(C(=O)NNC(=O)Nc2ccc(C(C)=O)cc2)cc(OC)c1OC	ZINC000875393227	GE	On-Demand	Reactive	SMO	21	49
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN([C@H]2CCC[C@H]2O)CC1	ZINC000875393228	GD	On-Demand	Anodyne	EPHX2	23	44
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN([C@@H]2CCC[C@H]2O)CC1	ZINC000875393229	GD	On-Demand	Anodyne	EPHX2	23	44
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN([C@@H]2CCC[C@@H]2O)CC1	ZINC000875393283	GD	On-Demand	Anodyne	EPHX2	23	44
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCN([C@H]2CCC[C@@H]2O)CC1	ZINC000875393284	GD	On-Demand	Anodyne	EPHX2	23	44
O=C(NC1CCN([C@@H]2CCCC[C@H]2O)CC1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875393296	GG	On-Demand	Anodyne	SLC18A3	61	63
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875393298	GG	On-Demand	Anodyne	SLC18A3	61	63
O=C(NC1CCN([C@@H]2CCCC[C@H]2O)CC1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875393300	GG	On-Demand	Anodyne	SLC18A3	61	63
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875393303	GG	On-Demand	Anodyne	SLC18A3	61	63
C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)NC1CCN([C@@H]2CCC[C@H]2O)CC1	ZINC000875393305	GG	On-Demand	Anodyne	SLC18A3	28	43
C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)NC1CCN([C@H]2CCC[C@@H]2O)CC1	ZINC000875393308	GG	On-Demand	Anodyne	SLC18A3	28	43
C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)NC1CCN([C@@H]2CCC[C@@H]2O)CC1	ZINC000875393310	GG	On-Demand	Anodyne	SLC18A3	28	43
C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)NC1CCN([C@H]2CCC[C@H]2O)CC1	ZINC000875393312	GG	On-Demand	Anodyne	SLC18A3	28	43
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN([C@H]2CCC[C@H]2O)CC1	ZINC000875393316	DC	On-Demand	Anodyne	SLC18A3	28	41
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN([C@H]2CCC[C@@H]2O)CC1	ZINC000875393321	DC	On-Demand	Anodyne	SLC18A3	28	41
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN([C@@H]2CCC[C@@H]2O)CC1	ZINC000875393322	DC	On-Demand	Anodyne	SLC18A3	28	41
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN([C@@H]2CCC[C@H]2O)CC1	ZINC000875393324	DC	On-Demand	Anodyne	SLC18A3	28	41
O=C(NC1CCN([C@H]2CCC[C@H]2O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875393326	GD	On-Demand	Anodyne	DRD4	26	48
O=C(NC1CCN([C@H]2CCC[C@H]2O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875393326	GD	On-Demand	Anodyne	ACHE	16	40
O=C(NC1CCN([C@H]2CCC[C@H]2O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875393326	GD	On-Demand	Anodyne	CHRM3	17	42
O=C(NC1CCN([C@H]2CCC[C@H]2O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875393326	GD	On-Demand	Anodyne	SIGMAR1	40	48
O=C(NC1CCN([C@H]2CCC[C@H]2O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875393326	GD	On-Demand	Anodyne	CCR3	18	46
O=C(NC1CCN([C@H]2CCC[C@H]2O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875393326	GD	On-Demand	Anodyne	SLC18A3	71	44
O=C(NC1CCN([C@H]2CCC[C@H]2O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875393326	GD	On-Demand	Anodyne	EPHX2	15	43
O=C(NC1CCN([C@H]2CCC[C@H]2O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875393326	GD	On-Demand	Anodyne	MCHR1	18	40
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875393328	GD	On-Demand	Anodyne	DRD4	26	48
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875393328	GD	On-Demand	Anodyne	ACHE	16	40
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875393328	GD	On-Demand	Anodyne	CHRM3	17	42
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875393328	GD	On-Demand	Anodyne	SIGMAR1	40	48
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875393328	GD	On-Demand	Anodyne	CCR3	18	46
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875393328	GD	On-Demand	Anodyne	SLC18A3	71	44
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875393328	GD	On-Demand	Anodyne	EPHX2	15	43
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875393328	GD	On-Demand	Anodyne	MCHR1	18	40
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875393329	GD	On-Demand	Anodyne	DRD4	26	48
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875393329	GD	On-Demand	Anodyne	ACHE	16	40
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875393329	GD	On-Demand	Anodyne	CHRM3	17	42
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875393329	GD	On-Demand	Anodyne	SIGMAR1	40	48
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875393329	GD	On-Demand	Anodyne	CCR3	18	46
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875393329	GD	On-Demand	Anodyne	SLC18A3	71	44
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875393329	GD	On-Demand	Anodyne	EPHX2	15	43
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875393329	GD	On-Demand	Anodyne	MCHR1	18	40
O=C(NC1CCN([C@H]2CCC[C@@H]2O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875393330	GD	On-Demand	Anodyne	DRD4	26	48
O=C(NC1CCN([C@H]2CCC[C@@H]2O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875393330	GD	On-Demand	Anodyne	ACHE	16	40
O=C(NC1CCN([C@H]2CCC[C@@H]2O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875393330	GD	On-Demand	Anodyne	CHRM3	17	42
O=C(NC1CCN([C@H]2CCC[C@@H]2O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875393330	GD	On-Demand	Anodyne	SIGMAR1	40	48
O=C(NC1CCN([C@H]2CCC[C@@H]2O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875393330	GD	On-Demand	Anodyne	CCR3	18	46
O=C(NC1CCN([C@H]2CCC[C@@H]2O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875393330	GD	On-Demand	Anodyne	SLC18A3	71	44
O=C(NC1CCN([C@H]2CCC[C@@H]2O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875393330	GD	On-Demand	Anodyne	EPHX2	15	43
O=C(NC1CCN([C@H]2CCC[C@@H]2O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875393330	GD	On-Demand	Anodyne	MCHR1	18	40
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(C(=O)OC)nc1	ZINC000875393346	FD	On-Demand	Reactive	HCN1	49	33
CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(C(=O)OC)nc1	ZINC000875393346	FD	On-Demand	Reactive	HCN4	41	32
CC[C@@H]1COCCN1CCNC(=O)NC1CCN(C(=O)CCOC)CC1	ZINC000875393352	FC	On-Demand	Anodyne	EPHX2	19	42
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2F)cc1	ZINC000875393367	DE	On-Demand	Reactive	CA1	20	44
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2F)cc1	ZINC000875393367	DE	On-Demand	Reactive	PRNP	41	48
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2F)cc1	ZINC000875393367	DE	On-Demand	Reactive	CA9	17	53
N#Cc1ccc(N2CCN(C(=O)NC3CCN([C@H]4CCC[C@H]4O)CC3)CC2)cc1	ZINC000875393369	GD	On-Demand	Mild	SLC18A3	28	43
N#Cc1ccc(N2CCN(C(=O)NC3CCN([C@@H]4CCC[C@H]4O)CC3)CC2)cc1	ZINC000875393372	GD	On-Demand	Mild	SLC18A3	28	43
N#Cc1ccc(N2CCN(C(=O)NC3CCN([C@@H]4CCC[C@@H]4O)CC3)CC2)cc1	ZINC000875393373	GD	On-Demand	Mild	SLC18A3	28	43
N#Cc1ccc(N2CCN(C(=O)NC3CCN([C@H]4CCC[C@@H]4O)CC3)CC2)cc1	ZINC000875393374	GD	On-Demand	Mild	SLC18A3	28	43
CONC(=O)C1CCN(C(=O)NC2CCN([C@H]3CCCC[C@H]3O)CC2)CC1	ZINC000875393391	GC	On-Demand	Anodyne	SLC18A3	56	39
CONC(=O)C1CCN(C(=O)NC2CCN([C@H]3CCCC[C@H]3O)CC2)CC1	ZINC000875393391	GC	On-Demand	Anodyne	EPHX2	27	40
CONC(=O)C1CCN(C(=O)NC2CCN([C@@H]3CCCC[C@H]3O)CC2)CC1	ZINC000875393392	GC	On-Demand	Anodyne	SLC18A3	56	39
CONC(=O)C1CCN(C(=O)NC2CCN([C@@H]3CCCC[C@H]3O)CC2)CC1	ZINC000875393392	GC	On-Demand	Anodyne	EPHX2	27	40
CONC(=O)C1CCN(C(=O)NC2CCN([C@H]3CCCC[C@@H]3O)CC2)CC1	ZINC000875393393	GC	On-Demand	Anodyne	SLC18A3	56	39
CONC(=O)C1CCN(C(=O)NC2CCN([C@H]3CCCC[C@@H]3O)CC2)CC1	ZINC000875393393	GC	On-Demand	Anodyne	EPHX2	27	40
CONC(=O)C1CCN(C(=O)NC2CCN([C@@H]3CCCC[C@@H]3O)CC2)CC1	ZINC000875393394	GC	On-Demand	Anodyne	SLC18A3	56	39
CONC(=O)C1CCN(C(=O)NC2CCN([C@@H]3CCCC[C@@H]3O)CC2)CC1	ZINC000875393394	GC	On-Demand	Anodyne	EPHX2	27	40
COCCC(=O)N1CCC(NC(=O)NC2(C)CC(F)(F)C2)CC1	ZINC000875393395	ED	On-Demand	Anodyne	EPHX2	33	49
O=C(NC1CCN([C@H]2CCCC[C@@H]2O)CC1)N1Cc2cccc(O)c2C1	ZINC000875393420	FE	On-Demand	Clean	SLC18A3	77	40
O=C(NC1CCN([C@@H]2CCCC[C@H]2O)CC1)N1Cc2cccc(O)c2C1	ZINC000875393421	FE	On-Demand	Clean	SLC18A3	77	40
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N1Cc2cccc(O)c2C1	ZINC000875393422	FE	On-Demand	Clean	SLC18A3	77	40
O=C(NC1CCN([C@H]2CCCC[C@H]2O)CC1)N1Cc2cccc(O)c2C1	ZINC000875393423	FE	On-Demand	Clean	SLC18A3	77	40
CN(C(=O)c1scnc1C(F)F)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875393485	FH	On-Demand	Anodyne	SLC6A1	46	35
CN(C(=O)c1scnc1C(F)F)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875393485	FH	On-Demand	Anodyne	SIGMAR1	32	43
CN(C(=O)c1scnc1C(F)F)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875393485	FH	On-Demand	Anodyne	CCR5	30	40
CN(C(=O)c1scnc1C(F)F)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875393486	FH	On-Demand	Anodyne	SLC6A1	46	35
CN(C(=O)c1scnc1C(F)F)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875393486	FH	On-Demand	Anodyne	SIGMAR1	32	43
CN(C(=O)c1scnc1C(F)F)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875393486	FH	On-Demand	Anodyne	CCR5	30	40
CN(C(=O)c1sccc1CC#N)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875393489	FH	On-Demand	Mild	ACHE	23	41
CN(C(=O)c1sccc1CC#N)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875393489	FH	On-Demand	Mild	SLC6A1	59	39
CN(C(=O)c1sccc1CC#N)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000875393489	FH	On-Demand	Mild	SIGMAR1	37	47
CN(C(=O)c1sccc1CC#N)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875393490	FH	On-Demand	Mild	ACHE	23	41
CN(C(=O)c1sccc1CC#N)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875393490	FH	On-Demand	Mild	SLC6A1	59	39
CN(C(=O)c1sccc1CC#N)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000875393490	FH	On-Demand	Mild	SIGMAR1	37	47
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCOC4(CCCCC4)C3)cn2)cc1	ZINC000875393525	GH	On-Demand	Mild	ITK	15	44
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCOC4(CCCCC4)C3)cn2)cc1	ZINC000875393525	GH	On-Demand	Mild	PANC	53	37
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCOC4(CCCCC4)C3)cn2)cc1	ZINC000875393526	GH	On-Demand	Mild	ITK	15	44
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCOC4(CCCCC4)C3)cn2)cc1	ZINC000875393526	GH	On-Demand	Mild	PANC	53	37
O=C(NC1CCN([C@H]2CCC[C@H]2O)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875393572	FD	On-Demand	Anodyne	SLC18A3	21	42
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875393573	FD	On-Demand	Anodyne	SLC18A3	21	42
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875393574	FD	On-Demand	Anodyne	SLC18A3	21	42
O=C(NC1CCN([C@H]2CCC[C@@H]2O)CC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875393575	FD	On-Demand	Anodyne	SLC18A3	21	42
O=C(NC1CCN([C@H]2CCC[C@H]2O)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875393581	FE	On-Demand	Anodyne	SIGMAR1	18	46
O=C(NC1CCN([C@H]2CCC[C@H]2O)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875393581	FE	On-Demand	Anodyne	SLC18A3	85	44
O=C(NC1CCN([C@H]2CCC[C@H]2O)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875393581	FE	On-Demand	Anodyne	EPHX2	40	41
O=C(NC1CCN([C@H]2CCC[C@@H]2O)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875393582	FE	On-Demand	Anodyne	SIGMAR1	18	46
O=C(NC1CCN([C@H]2CCC[C@@H]2O)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875393582	FE	On-Demand	Anodyne	SLC18A3	85	44
O=C(NC1CCN([C@H]2CCC[C@@H]2O)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875393582	FE	On-Demand	Anodyne	EPHX2	40	41
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875393583	FE	On-Demand	Anodyne	SIGMAR1	18	46
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875393583	FE	On-Demand	Anodyne	SLC18A3	85	44
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875393583	FE	On-Demand	Anodyne	EPHX2	40	41
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875393584	FE	On-Demand	Anodyne	SIGMAR1	18	46
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875393584	FE	On-Demand	Anodyne	SLC18A3	85	44
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)NC1CC(Nc2ccccc2)C1	ZINC000875393584	FE	On-Demand	Anodyne	EPHX2	40	41
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875393592	GF	On-Demand	Anodyne	SLC18A3	28	41
O=C(NC1CCN([C@@H]2CCCC[C@H]2O)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875393593	GF	On-Demand	Anodyne	SLC18A3	28	41
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875393594	GF	On-Demand	Anodyne	SLC18A3	28	41
O=C(NC1CCN([C@@H]2CCCC[C@H]2O)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875393595	GF	On-Demand	Anodyne	SLC18A3	28	41
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN(C(=O)CCOC)CC1	ZINC000875393623	EC	On-Demand	Anodyne	EPHX2	23	42
CC(=O)c1ccc(NC(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)cc1	ZINC000875393639	II	On-Demand	Reactive	PRNP	43	46
CC(=O)c1ccc(NC(=O)NNC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)cc1	ZINC000875393639	II	On-Demand	Reactive	CDK2	15	58
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H](C)Cc2cc(C)[nH]n2)CC1	ZINC000875393722	FH	On-Demand	Anodyne	CALCRL	46	34
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H](C)Cc2cc(C)[nH]n2)CC1	ZINC000875393723	FH	On-Demand	Anodyne	CALCRL	46	34
COc1ccccc1[C@H]1CCCN(C(=O)N[C@@H](C)Cc2cc(C)[nH]n2)CC1	ZINC000875393724	FH	On-Demand	Anodyne	CALCRL	46	34
COc1ccccc1[C@H]1CCCN(C(=O)N[C@H](C)Cc2cc(C)[nH]n2)CC1	ZINC000875393725	FH	On-Demand	Anodyne	CALCRL	46	34
Cn1cc(C#N)c(NC(=O)[C@@H](Cc2cccnc2)C2CCCC2)n1	ZINC000875393791	DF	On-Demand	Mild	C3AR1	42	42
Cn1cc(C#N)c(NC(=O)[C@H](Cc2cccnc2)C2CCCC2)n1	ZINC000875393792	DF	On-Demand	Mild	C3AR1	42	42
C[C@@H](O)C1CCN(C(=O)NC2CCN([C@H]3CCCC[C@H]3O)CC2)CC1	ZINC000875393840	FD	On-Demand	Anodyne	SLC18A3	32	42
C[C@@H](O)C1CCN(C(=O)NC2CCN([C@H]3CCCC[C@H]3O)CC2)CC1	ZINC000875393840	FD	On-Demand	Anodyne	EPHX2	21	40
C[C@@H](O)C1CCN(C(=O)NC2CCN([C@@H]3CCCC[C@H]3O)CC2)CC1	ZINC000875393842	FD	On-Demand	Anodyne	SLC18A3	32	42
C[C@@H](O)C1CCN(C(=O)NC2CCN([C@@H]3CCCC[C@H]3O)CC2)CC1	ZINC000875393842	FD	On-Demand	Anodyne	EPHX2	21	40
O=C(NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)Nc1nccs1	ZINC000875393845	IE	On-Demand	Reactive	MAP1	94	42
O=C(NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)Nc1nccs1	ZINC000875393845	IE	On-Demand	Reactive	NAMPT	23	42
COCCC(=O)N1CCC(NC(=O)N2CCC[C@@H](CCC(=O)OC)C2)CC1	ZINC000875393849	GD	On-Demand	Anodyne	EPHX2	15	42
COCCC(=O)N1CCC(NC(=O)N2CCC[C@H](CCC(=O)OC)C2)CC1	ZINC000875393850	GD	On-Demand	Anodyne	EPHX2	15	42
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000875393861	ED	On-Demand	Anodyne	EPHX2	21	42
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	ZINC000875393863	ED	On-Demand	Anodyne	EPHX2	21	42
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN([C@H]2CCCC[C@H]2O)CC1	ZINC000875393865	ED	On-Demand	Anodyne	EPHX2	21	42
CC[C@H](C[C@H](C)O)NC(=O)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000875393867	ED	On-Demand	Anodyne	EPHX2	21	42
O=C(N[C@H]1CCOC2(CCCC2)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875393883	FG	On-Demand	Anodyne	EPHX2	21	42
O=C(N[C@@H]1CCOC2(CCCC2)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875393884	FG	On-Demand	Anodyne	EPHX2	21	42
O=C(N[C@H]1CCOC2(CCCC2)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875393885	FG	On-Demand	Anodyne	EPHX2	21	42
O=C(N[C@@H]1CCOC2(CCCC2)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875393886	FG	On-Demand	Anodyne	EPHX2	21	42
COCCC(=O)N1CCC(NC(=O)NC2([C@@H]3CCCCO3)CCC2)CC1	ZINC000875393897	FD	On-Demand	Anodyne	EPHX2	20	44
COCCC(=O)N1CCC(NC(=O)NC2([C@H]3CCCCO3)CCC2)CC1	ZINC000875393898	FD	On-Demand	Anodyne	EPHX2	20	44
O=C(NCC[C@H](O)C1CCCC1)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000875393899	FD	On-Demand	Anodyne	SLC18A3	30	41
O=C(NCC[C@H](O)C1CCCC1)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000875393899	FD	On-Demand	Anodyne	EPHX2	17	40
O=C(NCC[C@H](O)C1CCCC1)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	ZINC000875393900	FD	On-Demand	Anodyne	SLC18A3	30	41
O=C(NCC[C@H](O)C1CCCC1)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	ZINC000875393900	FD	On-Demand	Anodyne	EPHX2	17	40
O=C(NCC[C@H](O)C1CCCC1)NC1CCN([C@H]2CCCC[C@H]2O)CC1	ZINC000875393901	FD	On-Demand	Anodyne	SLC18A3	30	41
O=C(NCC[C@H](O)C1CCCC1)NC1CCN([C@H]2CCCC[C@H]2O)CC1	ZINC000875393901	FD	On-Demand	Anodyne	EPHX2	17	40
O=C(NCC[C@H](O)C1CCCC1)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000875393902	FD	On-Demand	Anodyne	SLC18A3	30	41
O=C(NCC[C@H](O)C1CCCC1)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000875393902	FD	On-Demand	Anodyne	EPHX2	17	40
O=C(NNC(=O)c1ccc(NS(=O)(=O)c2ccc(Br)cc2)cc1)Nc1nccs1	ZINC000875393903	JG	On-Demand	Reactive	MAP1	88	38
O=C(NNC(=O)c1ccc(NS(=O)(=O)c2ccc(Br)cc2)cc1)Nc1nccs1	ZINC000875393903	JG	On-Demand	Reactive	CA12	17	42
O=C(NNC(=O)c1ccc(NS(=O)(=O)c2ccc(Br)cc2)cc1)Nc1nccs1	ZINC000875393903	JG	On-Demand	Reactive	IDO1	26	41
CC(=O)C1CCN(C(=O)NC2CCN([C@@H]3CCCC[C@@H]3O)CC2)CC1	ZINC000875393904	FD	On-Demand	Anodyne	SLC18A3	64	44
CC(=O)C1CCN(C(=O)NC2CCN([C@@H]3CCCC[C@@H]3O)CC2)CC1	ZINC000875393904	FD	On-Demand	Anodyne	EPHX2	30	42
CC(=O)C1CCN(C(=O)NC2CCN([C@@H]3CCCC[C@H]3O)CC2)CC1	ZINC000875393905	FD	On-Demand	Anodyne	SLC18A3	64	44
CC(=O)C1CCN(C(=O)NC2CCN([C@@H]3CCCC[C@H]3O)CC2)CC1	ZINC000875393905	FD	On-Demand	Anodyne	EPHX2	30	42
CC(=O)C1CCN(C(=O)NC2CCN([C@H]3CCCC[C@@H]3O)CC2)CC1	ZINC000875393906	FD	On-Demand	Anodyne	SLC18A3	64	44
CC(=O)C1CCN(C(=O)NC2CCN([C@H]3CCCC[C@@H]3O)CC2)CC1	ZINC000875393906	FD	On-Demand	Anodyne	EPHX2	30	42
CC(=O)C1CCN(C(=O)NC2CCN([C@H]3CCCC[C@H]3O)CC2)CC1	ZINC000875393907	FD	On-Demand	Anodyne	SLC18A3	64	44
CC(=O)C1CCN(C(=O)NC2CCN([C@H]3CCCC[C@H]3O)CC2)CC1	ZINC000875393907	FD	On-Demand	Anodyne	EPHX2	30	42
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCOC4(CCCC4)C3)cn2)cc1	ZINC000875393912	GG	On-Demand	Mild	ITK	15	45
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCOC4(CCCC4)C3)cn2)cc1	ZINC000875393912	GG	On-Demand	Mild	PANC	54	37
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCOC4(CCCC4)C3)cn2)cc1	ZINC000875393913	GG	On-Demand	Mild	ITK	15	45
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCOC4(CCCC4)C3)cn2)cc1	ZINC000875393913	GG	On-Demand	Mild	PANC	54	37
COCCC(=O)N1CCC(NC(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)CC1	ZINC000875393916	GE	On-Demand	Anodyne	EPHX2	34	44
O=C(N[C@H]1CCOC2(CCCC2)C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875393917	GH	On-Demand	Anodyne	SMO	38	42
O=C(N[C@H]1CCOC2(CCCC2)C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875393917	GH	On-Demand	Anodyne	ETHR	42	45
O=C(N[C@@H]1CCOC2(CCCC2)C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875393919	GH	On-Demand	Anodyne	SMO	38	42
O=C(N[C@@H]1CCOC2(CCCC2)C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875393919	GH	On-Demand	Anodyne	ETHR	42	45
COCCC(=O)N1CCC(NC(=O)NC2(C)CCC(C)(C)CC2)CC1	ZINC000875393934	FF	On-Demand	Anodyne	EPHX2	33	51
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000875393936	EC	On-Demand	Anodyne	SLC18A3	38	44
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000875393938	EC	On-Demand	Anodyne	SLC18A3	38	44
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN([C@H]2CCCC[C@H]2O)CC1	ZINC000875393940	EC	On-Demand	Anodyne	SLC18A3	38	44
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	ZINC000875393941	EC	On-Demand	Anodyne	SLC18A3	38	44
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)Nc1nccs1	ZINC000875394010	IC	On-Demand	Reactive	MAP1	43	34
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)Nc1nccs1	ZINC000875394010	IC	On-Demand	Reactive	TGM2	46	36
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)Nc1nccs1	ZINC000875394010	IC	On-Demand	Reactive	GCK	22	49
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)Nc1nccs1	ZINC000875394010	IC	On-Demand	Reactive	F13A1	60	36
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)Nc1nccs1	ZINC000875394010	IC	On-Demand	Reactive	NAMPT	43	43
COCCC(=O)N1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@@]3(C(=O)OC)C2)CC1	ZINC000875394050	FC	On-Demand	Anodyne	EPHX2	27	48
O=CN1CCCN(C(=O)NC2CCN([C@H]3CCCC[C@H]3O)CC2)CC1	ZINC000875394072	FC	On-Demand	Anodyne	SLC18A3	34	42
O=CN1CCCN(C(=O)NC2CCN([C@@H]3CCCC[C@H]3O)CC2)CC1	ZINC000875394078	FC	On-Demand	Anodyne	SLC18A3	34	42
O=CN1CCCN(C(=O)NC2CCN([C@H]3CCCC[C@@H]3O)CC2)CC1	ZINC000875394080	FC	On-Demand	Anodyne	SLC18A3	34	42
O=CN1CCCN(C(=O)NC2CCN([C@@H]3CCCC[C@@H]3O)CC2)CC1	ZINC000875394082	FC	On-Demand	Anodyne	SLC18A3	34	42
O=C(NCCCCC1CC1)N[C@@H]1CCCC(F)(F)C1	ZINC000875394083	CG	On-Demand	Anodyne	EPHX2	15	45
O=C(NCCCCC1CC1)N[C@H]1CCCC(F)(F)C1	ZINC000875394084	CG	On-Demand	Anodyne	EPHX2	15	45
COCCC(=O)N1CCC(NC(=O)N[C@]2(C)C[C@H](C)CC(C)(C)C2)CC1	ZINC000875394096	FF	On-Demand	Anodyne	EPHX2	26	49
COCCC(=O)N1CCC(NC(=O)N2Cc3cccc(O)c3C2)CC1	ZINC000875394109	ED	On-Demand	Clean	CCR8	43	34
CCC1(CC)CCCN1C(=O)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000875394117	FG	On-Demand	Anodyne	SLC18A3	34	45
CCC1(CC)CCCN1C(=O)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000875394120	FG	On-Demand	Anodyne	SLC18A3	34	45
CCC1(CC)CCCN1C(=O)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	ZINC000875394122	FG	On-Demand	Anodyne	SLC18A3	34	45
CCC1(CC)CCCN1C(=O)NC1CCN([C@H]2CCCC[C@H]2O)CC1	ZINC000875394124	FG	On-Demand	Anodyne	SLC18A3	34	45
O=C(NC1CCN([C@H]2CCCC[C@H]2O)CC1)N1CCC(CO)(CO)CC1	ZINC000875394132	FC	On-Demand	Anodyne	SLC18A3	37	42
O=C(NC1CCN([C@@H]2CCCC[C@H]2O)CC1)N1CCC(CO)(CO)CC1	ZINC000875394133	FC	On-Demand	Anodyne	SLC18A3	37	42
O=C(NC1CCN([C@H]2CCCC[C@@H]2O)CC1)N1CCC(CO)(CO)CC1	ZINC000875394134	FC	On-Demand	Anodyne	SLC18A3	37	42
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N1CCC(CO)(CO)CC1	ZINC000875394135	FC	On-Demand	Anodyne	SLC18A3	37	42
COC(=O)N(C)NC(=O)NC1CCN([C@@H]2CCC[C@@H]2O)CC1	ZINC000875394144	DC	On-Demand	Reactive	SLC18A3	35	40
COC(=O)N(C)NC(=O)NC1CCN([C@H]2CCC[C@H]2O)CC1	ZINC000875394146	DC	On-Demand	Reactive	SLC18A3	35	40
COC(=O)N(C)NC(=O)NC1CCN([C@H]2CCC[C@@H]2O)CC1	ZINC000875394148	DC	On-Demand	Reactive	SLC18A3	35	40
COC(=O)N(C)NC(=O)NC1CCN([C@@H]2CCC[C@H]2O)CC1	ZINC000875394150	DC	On-Demand	Reactive	SLC18A3	35	40
O=C(N[C@H]1CCOC2(CCC2)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875394181	EF	On-Demand	Anodyne	EPHX2	21	42
COCCC(=O)N1CCC(NC(=O)N2CCC3(CCN(C)CC3)CC2)CC1	ZINC000875394183	GD	On-Demand	Anodyne	EPHX2	16	40
O=C(N[C@H]1CCOC2(CCC2)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875394184	EF	On-Demand	Anodyne	EPHX2	21	42
O=C(N[C@@H]1CCOC2(CCC2)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875394186	EF	On-Demand	Anodyne	EPHX2	21	42
O=C(N[C@@H]1CCOC2(CCC2)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875394188	EF	On-Demand	Anodyne	EPHX2	21	42
COc1ccc(N2CCN(C(=O)N[C@H]3CCOC4(CCC4)C3)CC2)c(OC)c1	ZINC000875394194	GF	On-Demand	Clean	NPBWR1	53	31
COc1ccc(N2CCN(C(=O)N[C@@H]3CCOC4(CCC4)C3)CC2)c(OC)c1	ZINC000875394196	GF	On-Demand	Clean	NPBWR1	53	31
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875394200	ED	On-Demand	Anodyne	SLC18A3	29	44
O=C(NC1CCN([C@H]2CCC[C@H]2O)CC1)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875394201	ED	On-Demand	Anodyne	SLC18A3	29	44
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875394202	ED	On-Demand	Anodyne	SLC18A3	29	44
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCCc1cscn1)CC2	ZINC000875394270	FG	On-Demand	Anodyne	SLC18A2	46	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCCc1cscn1)CC2	ZINC000875394271	FG	On-Demand	Anodyne	SLC18A2	46	35
O=C(NC1CCN([C@H]2CCC[C@@H]2O)CC1)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875394303	ED	On-Demand	Anodyne	SLC18A3	29	44
COCCC(=O)N1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)CC1	ZINC000875394306	ED	On-Demand	Anodyne	EPHX2	21	44
COCCC(=O)N1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)CC1	ZINC000875394307	ED	On-Demand	Anodyne	EPHX2	21	44
COCCC(=O)N1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)CC1	ZINC000875394308	ED	On-Demand	Anodyne	EPHX2	21	44
COCCC(=O)N1CCC(NC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)CC1	ZINC000875394309	ED	On-Demand	Anodyne	EPHX2	21	44
O=C(NC1CCN([C@H]2CCCC[C@@H]2O)CC1)N[C@@H]1CCOC[C@H]1O	ZINC000875394343	EC	On-Demand	Anodyne	SLC18A3	34	42
O=C(NC1CCN([C@@H]2CCCC[C@H]2O)CC1)N[C@@H]1CCOC[C@H]1O	ZINC000875394345	EC	On-Demand	Anodyne	SLC18A3	34	42
O=C(NC1CCN([C@H]2CCCC[C@H]2O)CC1)N[C@@H]1CCOC[C@H]1O	ZINC000875394347	EC	On-Demand	Anodyne	SLC18A3	34	42
COCCC(=O)N1CCC(NC(=O)N2CC[C@@H](C(C)(C)O)C2)CC1	ZINC000875394357	EC	On-Demand	Anodyne	EPHX2	23	41
COCCC(=O)N1CCC(NC(=O)N2CC[C@H](C(C)(C)O)C2)CC1	ZINC000875394359	EC	On-Demand	Anodyne	EPHX2	23	41
CN1CCC(CNC(=O)N[C@H]2CCOC3(CCCC3)C2)(c2ccccc2)CC1	ZINC000875394386	GG	On-Demand	Anodyne	KCNA3	47	40
CN1CCC(CNC(=O)N[C@H]2CCOC3(CCCC3)C2)(c2ccccc2)CC1	ZINC000875394386	GG	On-Demand	Anodyne	SOAT1	15	47
CN1CCC(CNC(=O)N[C@@H]2CCOC3(CCCC3)C2)(c2ccccc2)CC1	ZINC000875394388	GG	On-Demand	Anodyne	KCNA3	47	40
CN1CCC(CNC(=O)N[C@@H]2CCOC3(CCCC3)C2)(c2ccccc2)CC1	ZINC000875394388	GG	On-Demand	Anodyne	SOAT1	15	47
O=C(NC1CCN([C@H]2CCC[C@@H]2O)CC1)N[C@@H](CO)c1ccc(Cl)cc1	ZINC000875394397	GE	On-Demand	Anodyne	SLC18A3	24	43
O=C(NC1CCN([C@H]2CCC[C@H]2O)CC1)N[C@@H](CO)c1ccc(Cl)cc1	ZINC000875394399	GE	On-Demand	Anodyne	SLC18A3	24	43
O=C(N[C@@H]1CCCC(F)(F)C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875394416	EH	On-Demand	Anodyne	EPHX2	36	46
O=C(N[C@H]1CCCC(F)(F)C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875394417	EH	On-Demand	Anodyne	EPHX2	36	46
COCCC(=O)N1CCC(NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875394424	GD	On-Demand	Anodyne	C3AR1	40	41
COCCC(=O)N1CCC(NC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CC1	ZINC000875394424	GD	On-Demand	Anodyne	CCR8	43	35
COCCC(=O)N1CCC(NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875394426	GD	On-Demand	Anodyne	C3AR1	40	41
COCCC(=O)N1CCC(NC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875394426	GD	On-Demand	Anodyne	CCR8	43	35
COCCC(=O)N1CCC(NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875394428	GD	On-Demand	Anodyne	C3AR1	40	41
COCCC(=O)N1CCC(NC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CC1	ZINC000875394428	GD	On-Demand	Anodyne	CCR8	43	35
COCCC(=O)N1CCC(NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875394430	GD	On-Demand	Anodyne	C3AR1	40	41
COCCC(=O)N1CCC(NC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CC1	ZINC000875394430	GD	On-Demand	Anodyne	CCR8	43	35
Cc1ccccc1[C@@H](C)N(C)C(=O)NC1CCN([C@@H]2CCC[C@@H]2O)CC1	ZINC000875394432	FG	On-Demand	Anodyne	SLC18A3	62	42
Cc1ccccc1[C@@H](C)N(C)C(=O)NC1CCN([C@H]2CCC[C@H]2O)CC1	ZINC000875394437	FG	On-Demand	Anodyne	SLC18A3	62	42
Cc1ccccc1[C@@H](C)N(C)C(=O)NC1CCN([C@@H]2CCC[C@H]2O)CC1	ZINC000875394439	FG	On-Demand	Anodyne	SLC18A3	62	42
Cc1ccccc1[C@@H](C)N(C)C(=O)NC1CCN([C@H]2CCC[C@@H]2O)CC1	ZINC000875394441	FG	On-Demand	Anodyne	SLC18A3	62	42
COCCC(=O)N1CCC(NC(=O)NC(C)(C)[C@@H]2CCCCO2)CC1	ZINC000875394443	FD	On-Demand	Anodyne	EPHX2	19	44
COCCC(=O)N1CCC(NC(=O)NC(C)(C)[C@H]2CCCCO2)CC1	ZINC000875394444	FD	On-Demand	Anodyne	EPHX2	19	44
COCCC(=O)N1CCC(NC(=O)NC[C@H]2CC(C(F)(F)F)=NO2)CC1	ZINC000875394500	GD	On-Demand	Anodyne	EPHX2	24	41
COCCC(=O)N1CCC(NC(=O)NC[C@@H]2CC(C(F)(F)F)=NO2)CC1	ZINC000875394501	GD	On-Demand	Anodyne	EPHX2	24	41
O=C(NCCc1cscn1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875394511	EF	On-Demand	Anodyne	NPY5R	21	40
O=C(NCCc1cscn1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875394512	EF	On-Demand	Anodyne	NPY5R	21	40
CC(=O)c1ccc(NC(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000875394553	GG	On-Demand	Reactive	UL80	31	41
CC(=O)c1ccc(NC(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000875394553	GG	On-Demand	Reactive	P2RY1	23	48
CC(=O)c1ccc(NC(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000875394553	GG	On-Demand	Reactive	EPHX2	34	41
CC(=O)c1ccc(NC(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000875394553	GG	On-Demand	Reactive	ACR	29	50
CC(=O)c1ccc(NC(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000875394553	GG	On-Demand	Reactive	TEK	52	36
CC(=O)c1ccc(NC(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000875394553	GG	On-Demand	Reactive	RIPK1	54	37
CC(=O)c1ccc(NC(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000875394553	GG	On-Demand	Reactive	IMDH_CRYPV	57	40
CC(=O)c1ccc(NC(=O)NNC(=O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000875394553	GG	On-Demand	Reactive	PDS	47	46
COCCC(=O)N1CCC(NC(=O)N[C@@H]2CC(C)(C)CC[C@H]2O)CC1	ZINC000875394618	FD	On-Demand	Anodyne	EPHX2	28	49
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875394625	GG	On-Demand	Anodyne	SLC18A3	86	49
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875394625	GG	On-Demand	Anodyne	EPHX2	26	40
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875394625	GG	On-Demand	Anodyne	SMO	17	47
O=C(NC1CCN([C@H]2CCCC[C@@H]2O)CC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875394626	GG	On-Demand	Anodyne	SLC18A3	86	49
O=C(NC1CCN([C@H]2CCCC[C@@H]2O)CC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875394626	GG	On-Demand	Anodyne	EPHX2	26	40
O=C(NC1CCN([C@H]2CCCC[C@@H]2O)CC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875394626	GG	On-Demand	Anodyne	SMO	17	47
O=C(NC1CCN([C@@H]2CCCC[C@H]2O)CC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875394627	GG	On-Demand	Anodyne	SLC18A3	86	49
O=C(NC1CCN([C@@H]2CCCC[C@H]2O)CC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875394627	GG	On-Demand	Anodyne	EPHX2	26	40
O=C(NC1CCN([C@@H]2CCCC[C@H]2O)CC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875394627	GG	On-Demand	Anodyne	SMO	17	47
O=C(NC1CCN([C@H]2CCCC[C@H]2O)CC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875394628	GG	On-Demand	Anodyne	SLC18A3	86	49
O=C(NC1CCN([C@H]2CCCC[C@H]2O)CC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875394628	GG	On-Demand	Anodyne	EPHX2	26	40
O=C(NC1CCN([C@H]2CCCC[C@H]2O)CC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875394628	GG	On-Demand	Anodyne	SMO	17	47
COCCC(=O)N1CCC(NC(=O)NN=c2cc[nH]c(C)c2)CC1	ZINC000875394637	EC	On-Demand	Reactive	EPHX2	28	40
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN([C@@H]3CCC[C@H]3O)CC2)C1	ZINC000875394644	ED	On-Demand	Anodyne	SLC18A3	37	40
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN([C@H]3CCC[C@H]3O)CC2)C1	ZINC000875394645	ED	On-Demand	Anodyne	SLC18A3	37	40
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN([C@@H]3CCC[C@@H]3O)CC2)C1	ZINC000875394646	ED	On-Demand	Anodyne	SLC18A3	37	40
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN([C@H]3CCC[C@@H]3O)CC2)C1	ZINC000875394647	ED	On-Demand	Anodyne	SLC18A3	37	40
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN([C@H]3CCCC[C@H]3O)CC2)C1	ZINC000875394668	FD	On-Demand	Anodyne	SLC18A3	42	43
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN([C@H]3CCCC[C@H]3O)CC2)C1	ZINC000875394668	FD	On-Demand	Anodyne	EPHX2	15	40
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN([C@@H]3CCCC[C@H]3O)CC2)C1	ZINC000875394669	FD	On-Demand	Anodyne	SLC18A3	42	43
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN([C@@H]3CCCC[C@H]3O)CC2)C1	ZINC000875394669	FD	On-Demand	Anodyne	EPHX2	15	40
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN([C@H]3CCCC[C@@H]3O)CC2)C1	ZINC000875394670	FD	On-Demand	Anodyne	SLC18A3	42	43
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN([C@H]3CCCC[C@@H]3O)CC2)C1	ZINC000875394670	FD	On-Demand	Anodyne	EPHX2	15	40
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN([C@@H]3CCCC[C@@H]3O)CC2)C1	ZINC000875394671	FD	On-Demand	Anodyne	SLC18A3	42	43
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN([C@@H]3CCCC[C@@H]3O)CC2)C1	ZINC000875394671	FD	On-Demand	Anodyne	EPHX2	15	40
COCCC(=O)N1CCC(NC(=O)NCC[C@H](O)C2CCCC2)CC1	ZINC000875394718	FD	On-Demand	Anodyne	EPHX2	25	49
COCCC(=O)N1CCC(NC(=O)NCC[C@@H](O)C2CCCC2)CC1	ZINC000875394721	FD	On-Demand	Anodyne	EPHX2	25	49
COCCC(=O)N1CCC(NC(=O)NC2CC(C(=O)OC)C2)CC1	ZINC000875394722	EC	On-Demand	Anodyne	EPHX2	36	52
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	ZINC000875394776	FD	On-Demand	Reactive	ADORA2B	38	43
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	ZINC000875394776	FD	On-Demand	Reactive	CA1	19	45
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	ZINC000875394776	FD	On-Demand	Reactive	ACR	56	37
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1	ZINC000875394776	FD	On-Demand	Reactive	CA9	16	47
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2c(F)cccc2-n2cccn2)C1	ZINC000875394823	FD	On-Demand	Anodyne	HCRTR1	18	40
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2c(F)cccc2-n2cccn2)C1	ZINC000875394823	FD	On-Demand	Anodyne	HCRTR2	33	40
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NC2CCC(OC(F)F)CC2)c1	ZINC000875394859	GF	On-Demand	Anodyne	SSTR5	30	41
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NC2CCC(OC(F)F)CC2)c1	ZINC000875394861	GF	On-Demand	Anodyne	SSTR5	30	41
COc1ccc(N2CCN(C(=O)NCCc3cscn3)CC2)c(OC)c1	ZINC000875394975	GE	On-Demand	Clean	HTR1A	33	40
COc1ccc(N2CCN(C(=O)NCCc3cscn3)CC2)c(OC)c1	ZINC000875394975	GE	On-Demand	Clean	DRD2	30	40
COc1ccc(N2CCN(C(=O)NCCc3cscn3)CC2)c(OC)c1	ZINC000875394975	GE	On-Demand	Clean	DRD4	42	33
COc1ccc(N2CCN(C(=O)NCCc3cscn3)CC2)c(OC)c1	ZINC000875394975	GE	On-Demand	Clean	HTR1B	15	40
COc1ccc(N2CCN(C(=O)NCCc3cscn3)CC2)c(OC)c1	ZINC000875394975	GE	On-Demand	Clean	DRD3	49	37
COc1ccc(N2CCN(C(=O)NCCc3cscn3)CC2)c(OC)c1	ZINC000875394975	GE	On-Demand	Clean	PDGFRB	45	39
COc1ccccc1[C@H](CC(C)C)NC(=O)c1sccc1CC#N	ZINC000875394991	EI	On-Demand	Mild	PTGER3	41	36
COc1ccccc1[C@H](CC(C)C)NC(=O)c1sccc1CC#N	ZINC000875394991	EI	On-Demand	Mild	CTSL	16	41
COc1ccccc1[C@H](CC(C)C)NC(=O)c1sccc1CC#N	ZINC000875394991	EI	On-Demand	Mild	CTSS	15	41
O=C1OC[C@H]2CN(C(=O)NC3CCN([C@H]4CCCC[C@H]4O)CC3)C[C@@H]12	ZINC000875395035	FC	On-Demand	Anodyne	SLC18A3	22	40
O=C1OC[C@H]2CN(C(=O)NC3CCN([C@@H]4CCCC[C@H]4O)CC3)C[C@@H]12	ZINC000875395036	FC	On-Demand	Anodyne	SLC18A3	22	40
O=C1OC[C@H]2CN(C(=O)NC3CCN([C@@H]4CCCC[C@@H]4O)CC3)C[C@@H]12	ZINC000875395037	FC	On-Demand	Anodyne	SLC18A3	22	40
O=C1OC[C@H]2CN(C(=O)NC3CCN([C@H]4CCCC[C@@H]4O)CC3)C[C@@H]12	ZINC000875395038	FC	On-Demand	Anodyne	SLC18A3	22	40
Cc1ccc2nc(C(=O)Nc3nn(C(C)(C)C)cc3C#N)cn2c1	ZINC000875395048	DF	On-Demand	Mild	MAP3K5	66	47
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N1Cc2cccc(O)c2C1	ZINC000875395082	ED	On-Demand	Clean	SLC18A3	73	37
O=C(NC1CCN([C@H]2CCC[C@H]2O)CC1)N1Cc2cccc(O)c2C1	ZINC000875395083	ED	On-Demand	Clean	SLC18A3	73	37
O=C(NC1CCN([C@@H]2CCC[C@H]2O)CC1)N1Cc2cccc(O)c2C1	ZINC000875395084	ED	On-Demand	Clean	SLC18A3	73	37
O=C(NC1CCN([C@H]2CCC[C@@H]2O)CC1)N1Cc2cccc(O)c2C1	ZINC000875395085	ED	On-Demand	Clean	SLC18A3	73	37
COCCC(=O)N1CCC(NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CC1	ZINC000875395090	FC	On-Demand	Anodyne	EPHX2	25	42
CN1CCN(C2CCN(C(=O)NC3CCC(C)(c4ccccc4)CC3)CC2)CC1	ZINC000875395122	GG	On-Demand	Anodyne	OPRL1	18	40
CN1CCN(C2CCN(C(=O)NC3CCC(C)(c4ccccc4)CC3)CC2)CC1	ZINC000875395122	GG	On-Demand	Anodyne	EPHX2	33	44
CN1CCN(C2CCN(C(=O)NC3CCC(C)(c4ccccc4)CC3)CC2)CC1	ZINC000875395122	GG	On-Demand	Anodyne	L3MBTL3	83	44
O=C(N[C@H]1CCCC(F)(F)C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875395150	FH	On-Demand	Anodyne	SMO	38	49
O=C(N[C@H]1CCCC(F)(F)C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875395150	FH	On-Demand	Anodyne	ETHR	55	48
O=C(N[C@@H]1CCCC(F)(F)C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875395152	FH	On-Demand	Anodyne	SMO	38	49
O=C(N[C@@H]1CCCC(F)(F)C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875395152	FH	On-Demand	Anodyne	ETHR	55	48
O=C(NC1CCN(C(=O)N[C@H]2CCCC(F)(F)C2)CC1)OCc1ccccc1	ZINC000875395285	GH	On-Demand	Anodyne	CHRM1	19	41
O=C(NC1CCN(C(=O)N[C@H]2CCCC(F)(F)C2)CC1)OCc1ccccc1	ZINC000875395285	GH	On-Demand	Anodyne	CHRM3	18	41
O=C(NC1CCN(C(=O)N[C@H]2CCCC(F)(F)C2)CC1)OCc1ccccc1	ZINC000875395285	GH	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NC1CCN(C(=O)N[C@H]2CCCC(F)(F)C2)CC1)OCc1ccccc1	ZINC000875395285	GH	On-Demand	Anodyne	CTSB	19	50
O=C(NC1CCN(C(=O)N[C@H]2CCCC(F)(F)C2)CC1)OCc1ccccc1	ZINC000875395285	GH	On-Demand	Anodyne	CTSK	25	50
O=C(NC1CCN(C(=O)N[C@H]2CCCC(F)(F)C2)CC1)OCc1ccccc1	ZINC000875395285	GH	On-Demand	Anodyne	CTSL	28	50
O=C(NC1CCN(C(=O)N[C@H]2CCCC(F)(F)C2)CC1)OCc1ccccc1	ZINC000875395285	GH	On-Demand	Anodyne	PREP	24	40
O=C(NC1CCN(C(=O)N[C@H]2CCCC(F)(F)C2)CC1)OCc1ccccc1	ZINC000875395285	GH	On-Demand	Anodyne	CAPN2	40	34
O=C(NC1CCN(C(=O)N[C@H]2CCCC(F)(F)C2)CC1)OCc1ccccc1	ZINC000875395285	GH	On-Demand	Anodyne	EPHX2	49	41
O=C(NC1CCN(C(=O)N[C@H]2CCCC(F)(F)C2)CC1)OCc1ccccc1	ZINC000875395285	GH	On-Demand	Anodyne	TGM2	30	43
O=C(NC1CCN(C(=O)N[C@H]2CCCC(F)(F)C2)CC1)OCc1ccccc1	ZINC000875395285	GH	On-Demand	Anodyne	NPR	41	30
O=C(NC1CCN(C(=O)N[C@H]2CCCC(F)(F)C2)CC1)OCc1ccccc1	ZINC000875395285	GH	On-Demand	Anodyne	F13A1	25	43
O=C(NC1CCN(C(=O)N[C@H]2CCCC(F)(F)C2)CC1)OCc1ccccc1	ZINC000875395285	GH	On-Demand	Anodyne	BIRC2	18	41
O=C(NC1CCN(C(=O)N[C@H]2CCCC(F)(F)C2)CC1)OCc1ccccc1	ZINC000875395285	GH	On-Demand	Anodyne	SLC12A5	66	38
O=C(NC1CCN(C(=O)N[C@@H]2CCCC(F)(F)C2)CC1)OCc1ccccc1	ZINC000875395288	GH	On-Demand	Anodyne	CHRM1	19	41
O=C(NC1CCN(C(=O)N[C@@H]2CCCC(F)(F)C2)CC1)OCc1ccccc1	ZINC000875395288	GH	On-Demand	Anodyne	CHRM3	18	41
O=C(NC1CCN(C(=O)N[C@@H]2CCCC(F)(F)C2)CC1)OCc1ccccc1	ZINC000875395288	GH	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NC1CCN(C(=O)N[C@@H]2CCCC(F)(F)C2)CC1)OCc1ccccc1	ZINC000875395288	GH	On-Demand	Anodyne	CTSB	19	50
O=C(NC1CCN(C(=O)N[C@@H]2CCCC(F)(F)C2)CC1)OCc1ccccc1	ZINC000875395288	GH	On-Demand	Anodyne	CTSK	25	50
O=C(NC1CCN(C(=O)N[C@@H]2CCCC(F)(F)C2)CC1)OCc1ccccc1	ZINC000875395288	GH	On-Demand	Anodyne	CTSL	28	50
O=C(NC1CCN(C(=O)N[C@@H]2CCCC(F)(F)C2)CC1)OCc1ccccc1	ZINC000875395288	GH	On-Demand	Anodyne	PREP	24	40
O=C(NC1CCN(C(=O)N[C@@H]2CCCC(F)(F)C2)CC1)OCc1ccccc1	ZINC000875395288	GH	On-Demand	Anodyne	CAPN2	40	34
O=C(NC1CCN(C(=O)N[C@@H]2CCCC(F)(F)C2)CC1)OCc1ccccc1	ZINC000875395288	GH	On-Demand	Anodyne	EPHX2	49	41
O=C(NC1CCN(C(=O)N[C@@H]2CCCC(F)(F)C2)CC1)OCc1ccccc1	ZINC000875395288	GH	On-Demand	Anodyne	TGM2	30	43
O=C(NC1CCN(C(=O)N[C@@H]2CCCC(F)(F)C2)CC1)OCc1ccccc1	ZINC000875395288	GH	On-Demand	Anodyne	NPR	41	30
O=C(NC1CCN(C(=O)N[C@@H]2CCCC(F)(F)C2)CC1)OCc1ccccc1	ZINC000875395288	GH	On-Demand	Anodyne	F13A1	25	43
O=C(NC1CCN(C(=O)N[C@@H]2CCCC(F)(F)C2)CC1)OCc1ccccc1	ZINC000875395288	GH	On-Demand	Anodyne	BIRC2	18	41
O=C(NC1CCN(C(=O)N[C@@H]2CCCC(F)(F)C2)CC1)OCc1ccccc1	ZINC000875395288	GH	On-Demand	Anodyne	SLC12A5	66	38
O=C(N[C@@H]1CCO[C@@]2(CCSC2)C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875395298	GG	On-Demand	Anodyne	EPHX2	33	44
O=C(N[C@@H]1CCO[C@]2(CCSC2)C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875395301	GG	On-Demand	Anodyne	EPHX2	33	44
O=C(N[C@H]1CCO[C@@]2(CCSC2)C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875395304	GG	On-Demand	Anodyne	EPHX2	33	44
O=C(N[C@H]1CCO[C@]2(CCSC2)C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875395307	GG	On-Demand	Anodyne	EPHX2	33	44
CC[C@@H](NC(=O)NC1CCN(C(=O)CCOC)CC1)[C@H](O)c1ccccc1	ZINC000875395403	GD	On-Demand	Anodyne	C3AR1	43	42
CC[C@@H](NC(=O)NC1CCN(C(=O)CCOC)CC1)[C@H](O)c1ccccc1	ZINC000875395403	GD	On-Demand	Anodyne	EPHX2	33	45
CC[C@@H](NC(=O)NC1CCN(C(=O)CCOC)CC1)[C@H](O)c1ccccc1	ZINC000875395403	GD	On-Demand	Anodyne	CCR8	52	38
CC[C@@H](NC(=O)NC1CCN(C(=O)CCOC)CC1)[C@@H](O)c1ccccc1	ZINC000875395404	GD	On-Demand	Anodyne	C3AR1	43	42
CC[C@@H](NC(=O)NC1CCN(C(=O)CCOC)CC1)[C@@H](O)c1ccccc1	ZINC000875395404	GD	On-Demand	Anodyne	EPHX2	33	45
CC[C@@H](NC(=O)NC1CCN(C(=O)CCOC)CC1)[C@@H](O)c1ccccc1	ZINC000875395404	GD	On-Demand	Anodyne	CCR8	52	38
COCCC(=O)N1CCC(NC(=O)NNc2cccc(F)c2Cl)CC1	ZINC000875395406	FE	On-Demand	Reactive	EPHX2	33	42
COCCC(=O)N1CCC(NC(=O)NNc2cccc(F)c2Cl)CC1	ZINC000875395406	FE	On-Demand	Reactive	CCR8	54	38
O=C(NC1CCN([C@H]2CCCC[C@@H]2O)CC1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875395409	GF	On-Demand	Anodyne	SLC18A3	26	40
O=C(NC1CCN([C@@H]2CCCC[C@H]2O)CC1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875395410	GF	On-Demand	Anodyne	SLC18A3	26	40
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875395411	GF	On-Demand	Anodyne	SLC18A3	26	40
O=C(NC1CCN([C@H]2CCCC[C@H]2O)CC1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875395412	GF	On-Demand	Anodyne	SLC18A3	26	40
Cc1ccccc1[C@@H](C)N(C)C(=O)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000875395422	FG	On-Demand	Anodyne	SIGMAR1	15	44
Cc1ccccc1[C@@H](C)N(C)C(=O)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000875395422	FG	On-Demand	Anodyne	SLC18A3	68	44
Cc1ccccc1[C@@H](C)N(C)C(=O)NC1CCN([C@H]2CCCC[C@H]2O)CC1	ZINC000875395423	FG	On-Demand	Anodyne	SIGMAR1	15	44
Cc1ccccc1[C@@H](C)N(C)C(=O)NC1CCN([C@H]2CCCC[C@H]2O)CC1	ZINC000875395423	FG	On-Demand	Anodyne	SLC18A3	68	44
Cc1ccccc1[C@@H](C)N(C)C(=O)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	ZINC000875395424	FG	On-Demand	Anodyne	SIGMAR1	15	44
Cc1ccccc1[C@@H](C)N(C)C(=O)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	ZINC000875395424	FG	On-Demand	Anodyne	SLC18A3	68	44
Cc1ccccc1[C@@H](C)N(C)C(=O)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000875395425	FG	On-Demand	Anodyne	SIGMAR1	15	44
Cc1ccccc1[C@@H](C)N(C)C(=O)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000875395425	FG	On-Demand	Anodyne	SLC18A3	68	44
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875395435	EE	On-Demand	Anodyne	SLC18A3	30	44
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875395436	EE	On-Demand	Anodyne	SLC18A3	30	44
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875395437	EE	On-Demand	Anodyne	SLC18A3	30	44
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875395438	EE	On-Demand	Anodyne	SLC18A3	30	44
O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)Nc1nccs1	ZINC000875395550	HE	On-Demand	Reactive	MAP1	108	39
O=C(NCc1ccc(O)c(Cl)c1)NC1[C@@H]2[C@H]3CC[C@@H](C3)[C@@H]12	ZINC000875395556	DF	On-Demand	Anodyne	NCE103	15	46
O=C(NCc1ccc(O)c(Cl)c1)N[C@@H]1[C@H]2[C@H]3CC[C@@H](C3)[C@H]21	ZINC000875395557	DF	On-Demand	Anodyne	NCE103	15	46
O=C(NCc1ccc(O)c(Cl)c1)NC1[C@H]2[C@H]3CC[C@@H](C3)[C@H]12	ZINC000875395558	DF	On-Demand	Anodyne	NCE103	15	46
CCO[C@@H](C(=O)Nc1nn(C)cc1C#N)C1CCCC1	ZINC000875395579	CD	On-Demand	Mild	PFKFB3	41	31
O=C(N[C@H]1CCOC2(CCC2)C1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875395582	EH	On-Demand	Anodyne	EPHX2	20	41
O=C(N[C@@H]1CCOC2(CCC2)C1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875395584	EH	On-Demand	Anodyne	EPHX2	20	41
O=C(N[C@H]1CCOC2(CCOCC2)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875395594	FE	On-Demand	Anodyne	EPHX2	19	40
O=C(N[C@@H]1CCOC2(CCOCC2)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875395596	FE	On-Demand	Anodyne	EPHX2	19	40
O=C(N[C@H]1CCOC2(CCOCC2)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875395599	FE	On-Demand	Anodyne	EPHX2	19	40
O=C(N[C@@H]1CCOC2(CCOCC2)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875395601	FE	On-Demand	Anodyne	EPHX2	19	40
O=C(N[C@@H]1CCCC(F)(F)C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875395615	FF	On-Demand	Anodyne	SMO	30	43
O=C(N[C@@H]1CCCC(F)(F)C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875395615	FF	On-Demand	Anodyne	ETHR	41	37
O=C(N[C@H]1CCCC(F)(F)C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875395617	FF	On-Demand	Anodyne	SMO	30	43
O=C(N[C@H]1CCCC(F)(F)C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875395617	FF	On-Demand	Anodyne	ETHR	41	37
O=C(N[C@H]1CCCC(F)(F)C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875395619	FF	On-Demand	Anodyne	SMO	30	43
O=C(N[C@H]1CCCC(F)(F)C1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875395619	FF	On-Demand	Anodyne	ETHR	41	37
O=C(N[C@@H]1CCCC(F)(F)C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875395621	FF	On-Demand	Anodyne	SMO	30	43
O=C(N[C@@H]1CCCC(F)(F)C1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875395621	FF	On-Demand	Anodyne	ETHR	41	37
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCOC4(CCC4)C3)cn2)cc1	ZINC000875395640	FG	On-Demand	Mild	ITK	15	45
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCOC4(CCC4)C3)cn2)cc1	ZINC000875395640	FG	On-Demand	Mild	PANC	54	37
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCOC4(CCC4)C3)cn2)cc1	ZINC000875395644	FG	On-Demand	Mild	ITK	15	45
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCOC4(CCC4)C3)cn2)cc1	ZINC000875395644	FG	On-Demand	Mild	PANC	54	37
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCC[C@H](c3ccc(Cl)cc3)C2)CC1	ZINC000875395739	GG	On-Demand	Anodyne	CCR1	38	41
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCC[C@@H](c3ccc(Cl)cc3)C2)CC1	ZINC000875395740	GG	On-Demand	Anodyne	CCR1	38	41
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCC[C@@H](c3ccc(Cl)cc3)C2)CC1	ZINC000875395741	GG	On-Demand	Anodyne	CCR1	38	41
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCC[C@H](c3ccc(Cl)cc3)C2)CC1	ZINC000875395742	GG	On-Demand	Anodyne	CCR1	38	41
O=C(NNC(=O)c1ccccc1OCc1ccc(F)cc1)Nc1nccs1	ZINC000875395743	GG	On-Demand	Reactive	PPIA	40	40
O=C(NNC(=O)c1ccccc1OCc1ccc(F)cc1)Nc1nccs1	ZINC000875395743	GG	On-Demand	Reactive	MAP1	133	57
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2OCc2ccc(F)cc2)cc1	ZINC000875395845	HI	On-Demand	Reactive	PPIA	43	44
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2OCc2ccc(F)cc2)cc1	ZINC000875395845	HI	On-Demand	Reactive	KCNK3	55	36
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2OCc2ccc(F)cc2)cc1	ZINC000875395845	HI	On-Demand	Reactive	KCNK9	46	36
O=C(NC1CC(Nc2ccccc2)C1)N[C@H]1CCCC(F)(F)C1	ZINC000875395951	DH	On-Demand	Anodyne	EPHX2	20	45
O=C(NC1CC(Nc2ccccc2)C1)N[C@@H]1CCCC(F)(F)C1	ZINC000875395952	DH	On-Demand	Anodyne	EPHX2	20	45
CC(=O)C1CCN(C(=O)NC2CCC(C)(c3ccccc3)CC2)CC1	ZINC000875395975	EH	On-Demand	Anodyne	EPHX2	47	45
O=C(NC1CCN(C(=O)NCCc2cscn2)CC1)OCc1ccccc1	ZINC000875396053	GF	On-Demand	Anodyne	GRIN2B	26	40
O=C(NC1CCN(C(=O)NCCc2cscn2)CC1)OCc1ccccc1	ZINC000875396053	GF	On-Demand	Anodyne	CTSB	15	48
O=C(NC1CCN(C(=O)NCCc2cscn2)CC1)OCc1ccccc1	ZINC000875396053	GF	On-Demand	Anodyne	CTSK	19	48
O=C(NC1CCN(C(=O)NCCc2cscn2)CC1)OCc1ccccc1	ZINC000875396053	GF	On-Demand	Anodyne	CTSL	21	48
O=C(NC1CCN(C(=O)NCCc2cscn2)CC1)OCc1ccccc1	ZINC000875396053	GF	On-Demand	Anodyne	EPHX2	25	43
O=C(NC1CCN(C(=O)NCCc2cscn2)CC1)OCc1ccccc1	ZINC000875396053	GF	On-Demand	Anodyne	TGM2	30	41
O=C(NC1CCN(C(=O)NCCc2cscn2)CC1)OCc1ccccc1	ZINC000875396053	GF	On-Demand	Anodyne	F13A1	16	41
CCO[C@H](C(=O)N(C)c1ccccc1S(C)(=O)=O)C1CCCC1	ZINC000875396076	EF	On-Demand	Anodyne	AMY2	47	32
CCO[C@@H](C(=O)N(C)c1ccccc1S(C)(=O)=O)C1CCCC1	ZINC000875396078	EF	On-Demand	Anodyne	AMY2	47	32
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)N[C@@H]2[C@H]3[C@H]4CC[C@@H](C4)[C@H]32)[C@H](O)C1	ZINC000875396080	FD	On-Demand	Anodyne	GPR119	21	40
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NC2[C@@H]3[C@H]4CC[C@@H](C4)[C@@H]23)[C@@H](O)C1	ZINC000875396082	FD	On-Demand	Anodyne	GPR119	21	40
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)N[C@@H]2[C@H]3[C@H]4CC[C@@H](C4)[C@H]32)[C@@H](O)C1	ZINC000875396084	FD	On-Demand	Anodyne	GPR119	21	40
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NC2[C@@H]3[C@H]4CC[C@@H](C4)[C@@H]23)[C@H](O)C1	ZINC000875396087	FD	On-Demand	Anodyne	GPR119	21	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccco1)c1ccccc1OC	ZINC000875396090	GG	On-Demand	Anodyne	SLC6A4	17	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccco1)c1ccccc1OC	ZINC000875396090	GG	On-Demand	Anodyne	SLC6A3	36	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccco1)c1ccccc1OC	ZINC000875396091	GG	On-Demand	Anodyne	SLC6A4	17	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccco1)c1ccccc1OC	ZINC000875396091	GG	On-Demand	Anodyne	SLC6A3	36	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccco1)c1ccccc1OC	ZINC000875396092	GG	On-Demand	Anodyne	SLC6A4	17	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccco1)c1ccccc1OC	ZINC000875396092	GG	On-Demand	Anodyne	SLC6A3	36	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccco1)c1ccccc1OC	ZINC000875396093	GG	On-Demand	Anodyne	SLC6A4	17	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccco1)c1ccccc1OC	ZINC000875396093	GG	On-Demand	Anodyne	SLC6A3	36	41
O=C(N[C@@H]1CCOC2(CCOCC2)C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875396107	GF	On-Demand	Anodyne	EPHX2	28	44
O=C(N[C@H]1CCOC2(CCOCC2)C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875396108	GF	On-Demand	Anodyne	EPHX2	28	44
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCCC(F)(F)C3)cn2)cc1	ZINC000875396199	FH	On-Demand	Mild	ITK	15	47
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCCC(F)(F)C3)cn2)cc1	ZINC000875396199	FH	On-Demand	Mild	PANC	53	37
O=C(NCCc1cscn1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875396202	EF	On-Demand	Anodyne	EPHX2	22	48
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCCC(F)(F)C3)cn2)cc1	ZINC000875396208	FH	On-Demand	Mild	ITK	15	47
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCCC(F)(F)C3)cn2)cc1	ZINC000875396208	FH	On-Demand	Mild	PANC	53	37
CN1CCN(C2CCN(C(=O)N[C@H]3CCCC(F)(F)C3)CC2)CC1	ZINC000875396260	ED	On-Demand	Anodyne	L3MBTL3	42	39
C[C@@H](NC(=O)NCCc1cscn1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875396276	GG	On-Demand	Anodyne	GPR119	44	41
CN1CCN(C2CCN(C(=O)N[C@@H]3CCCC(F)(F)C3)CC2)CC1	ZINC000875396284	ED	On-Demand	Anodyne	L3MBTL3	42	39
O=C(NC1[C@@H]2[C@H]3CC[C@@H](C3)[C@@H]12)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875396288	FG	On-Demand	Anodyne	SMO	35	41
O=C(NC1[C@@H]2[C@H]3CC[C@@H](C3)[C@@H]12)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875396288	FG	On-Demand	Anodyne	ETHR	55	49
O=C(N[C@@H]1[C@H]2[C@H]3CC[C@@H](C3)[C@H]21)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875396292	FG	On-Demand	Anodyne	SMO	35	41
O=C(N[C@@H]1[C@H]2[C@H]3CC[C@@H](C3)[C@H]21)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875396292	FG	On-Demand	Anodyne	ETHR	55	49
O=C(NC1[C@H]2[C@H]3CC[C@@H](C3)[C@H]12)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875396295	FG	On-Demand	Anodyne	SMO	35	41
O=C(NC1[C@H]2[C@H]3CC[C@@H](C3)[C@H]12)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875396295	FG	On-Demand	Anodyne	ETHR	55	49
O=C(N[C@H]1CCOC2(CCOCC2)C1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875396322	FG	On-Demand	Anodyne	EPHX2	20	41
O=C(N[C@@H]1CCOC2(CCOCC2)C1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875396326	FG	On-Demand	Anodyne	EPHX2	20	41
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)cc1	ZINC000875396431	IH	On-Demand	Reactive	TSHR	57	36
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)cc1	ZINC000875396431	IH	On-Demand	Reactive	MAOB	26	42
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)cc1	ZINC000875396431	IH	On-Demand	Reactive	PPIA	42	45
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)cc1	ZINC000875396431	IH	On-Demand	Reactive	LTA4H	56	57
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)cc1	ZINC000875396431	IH	On-Demand	Reactive	ADORA2B	33	43
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)cc1	ZINC000875396431	IH	On-Demand	Reactive	CA1	41	54
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)cc1	ZINC000875396431	IH	On-Demand	Reactive	SCN2A	20	48
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)cc1	ZINC000875396431	IH	On-Demand	Reactive	ADAM17	20	46
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)cc1	ZINC000875396431	IH	On-Demand	Reactive	S1PR4	22	42
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)cc1	ZINC000875396431	IH	On-Demand	Reactive	HDAC8	16	46
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)cc1	ZINC000875396431	IH	On-Demand	Reactive	PRNP	22	42
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)cc1	ZINC000875396431	IH	On-Demand	Reactive	PLA2G4B	64	37
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)cc1	ZINC000875396431	IH	On-Demand	Reactive	EPHX2	15	45
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)cc1	ZINC000875396431	IH	On-Demand	Reactive	F7	20	52
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)cc1	ZINC000875396431	IH	On-Demand	Reactive	ACR	45	35
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)cc1	ZINC000875396431	IH	On-Demand	Reactive	CA12	19	54
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)cc1	ZINC000875396431	IH	On-Demand	Reactive	ADAMTS4	25	42
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)cc1	ZINC000875396431	IH	On-Demand	Reactive	CA9	23	54
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)cc1	ZINC000875396431	IH	On-Demand	Reactive	FFAR1	33	42
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCC(C)(C)C(C)(C)O)CC2	ZINC000875396434	GE	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCC(C)(C)C(C)(C)O)CC2	ZINC000875396435	GE	On-Demand	Anodyne	SLC18A2	48	36
CN1CCN(C2CCN(C(=O)N[C@@H]3[C@H]4[C@H]5CC[C@@H](C5)[C@H]43)CC2)CC1	ZINC000875396525	ED	On-Demand	Anodyne	L3MBTL3	42	40
CN1CCN(C2CCN(C(=O)NC3[C@H]4[C@H]5CC[C@@H](C5)[C@H]34)CC2)CC1	ZINC000875396528	ED	On-Demand	Anodyne	L3MBTL3	42	40
CN1CCN(C2CCN(C(=O)NC3[C@@H]4[C@H]5CC[C@@H](C5)[C@@H]34)CC2)CC1	ZINC000875396531	ED	On-Demand	Anodyne	L3MBTL3	42	40
CONC(=O)C1CCN(C(=O)NC2CCC(C)(c3ccccc3)CC2)CC1	ZINC000875396544	FF	On-Demand	Anodyne	EPHX2	39	44
CC(=O)c1ccc(NC(=O)NNC(=O)COc2cccc(C)c2)cc1	ZINC000875396555	EE	On-Demand	Reactive	CA1	23	42
CC(=O)c1ccc(NC(=O)NNC(=O)COc2cccc(C)c2)cc1	ZINC000875396555	EE	On-Demand	Reactive	KDR	25	41
CC(=O)c1ccc(NC(=O)NNC(=O)COc2cccc(C)c2)cc1	ZINC000875396555	EE	On-Demand	Reactive	PDGFRA	21	40
CC(=O)c1ccc(NC(=O)NNC(=O)COc2cccc(C)c2)cc1	ZINC000875396555	EE	On-Demand	Reactive	CA9	15	42
CC(=O)c1ccc(NC(=O)NNC(=O)COc2cccc(C)c2)cc1	ZINC000875396555	EE	On-Demand	Reactive	KCNK3	53	38
CC(=O)c1ccc(NC(=O)NNC(=O)COc2cccc(C)c2)cc1	ZINC000875396555	EE	On-Demand	Reactive	KCNK9	41	35
Cn1cc(C#N)c(NC(=O)c2noc3c2CC(C)(C)CC3)n1	ZINC000875396562	CE	On-Demand	Mild	PANC	50	32
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2-c2ccccc2)cc1	ZINC000875396563	HH	On-Demand	Reactive	PRNP	36	47
O=C(N[C@H]1CCOC2(CCC2)C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875396671	EG	On-Demand	Anodyne	EPHX2	33	44
O=C(N[C@@H]1CCOC2(CCC2)C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875396673	EG	On-Demand	Anodyne	EPHX2	33	44
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)N[C@@H]1CCOC3(CCC3)C1)CC2	ZINC000875396676	FG	On-Demand	Anodyne	SLC18A2	40	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@@H]1CCOC3(CCC3)C1)CC2	ZINC000875396677	FG	On-Demand	Anodyne	SLC18A2	40	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@H]1CCOC3(CCC3)C1)CC2	ZINC000875396678	FG	On-Demand	Anodyne	SLC18A2	40	37
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)N[C@H]1CCOC3(CCC3)C1)CC2	ZINC000875396679	FG	On-Demand	Anodyne	SLC18A2	40	37
O=C(N[C@H]1CCOC2(CCC2)C1)N1CCC[C@](F)(c2ccccc2)C1	ZINC000875396717	EH	On-Demand	Anodyne	EPHX2	24	41
O=C(N[C@H]1CCOC2(CCC2)C1)N1CCC[C@@](F)(c2ccccc2)C1	ZINC000875396719	EH	On-Demand	Anodyne	EPHX2	24	41
O=C(N[C@@H]1CCOC2(CCC2)C1)N1CCC[C@@](F)(c2ccccc2)C1	ZINC000875396722	EH	On-Demand	Anodyne	EPHX2	24	41
O=C(N[C@@H]1CCOC2(CCC2)C1)N1CCC[C@](F)(c2ccccc2)C1	ZINC000875396724	EH	On-Demand	Anodyne	EPHX2	24	41
CN1CCC(CNC(=O)N[C@H]2CCOC3(CCC3)C2)(c2ccccc2)CC1	ZINC000875396828	FG	On-Demand	Anodyne	KCNA3	47	40
CN1CCC(CNC(=O)N[C@H]2CCOC3(CCC3)C2)(c2ccccc2)CC1	ZINC000875396828	FG	On-Demand	Anodyne	SOAT1	15	44
CN1CCC(CNC(=O)N[C@@H]2CCOC3(CCC3)C2)(c2ccccc2)CC1	ZINC000875396830	FG	On-Demand	Anodyne	KCNA3	47	40
CN1CCC(CNC(=O)N[C@@H]2CCOC3(CCC3)C2)(c2ccccc2)CC1	ZINC000875396830	FG	On-Demand	Anodyne	SOAT1	15	44
C#Cc1cccc(CNC(=O)C(=O)N2CCC[C@H](C(C)=O)C2)c1	ZINC000875396867	DD	On-Demand	Mild	DPP7	26	41
C#Cc1cccc(CNC(=O)C(=O)N2CCC[C@@H](C(C)=O)C2)c1	ZINC000875396869	DD	On-Demand	Mild	DPP7	26	41
O=C(NNC(=O)c1cccc(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)c1)Nc1nccs1	ZINC000875396925	JG	On-Demand	Reactive	MAP1	64	33
O=C(NNC(=O)c1cccc(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)c1)Nc1nccs1	ZINC000875396925	JG	On-Demand	Reactive	TEK	26	40
O=C(NNC(=O)c1cccc(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)c1)Nc1nccs1	ZINC000875396925	JG	On-Demand	Reactive	RIPK1	41	36
O=C(NCCc1cscn1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875396956	FF	On-Demand	Anodyne	SMO	35	41
O=C(NCCc1cscn1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875396956	FF	On-Demand	Anodyne	ETHR	62	45
O=C(NCCC[C@@H]1CCOC1=O)NC1[C@@H]2[C@H]3CC[C@@H](C3)[C@@H]12	ZINC000875396958	CD	On-Demand	Anodyne	LASR	42	32
O=C(NCCC[C@@H]1CCOC1=O)NC1[C@H]2[C@H]3CC[C@@H](C3)[C@H]12	ZINC000875396961	CD	On-Demand	Anodyne	LASR	42	32
CCCCCCCNC(=O)C(=O)NCC(C)(C)C(C)(C)O	ZINC000875396963	DD	On-Demand	Mild	ASAH1	81	33
O=C(NCCC[C@H]1CCOC1=O)N[C@@H]1[C@H]2[C@H]3CC[C@@H](C3)[C@H]21	ZINC000875396964	CD	On-Demand	Anodyne	LASR	42	32
O=C(NCCC[C@@H]1CCOC1=O)N[C@@H]1[C@H]2[C@H]3CC[C@@H](C3)[C@H]21	ZINC000875396967	CD	On-Demand	Anodyne	LASR	42	32
O=C(N[C@H]1CCOC2(CCC2)C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875396992	FG	On-Demand	Anodyne	SMO	37	42
O=C(N[C@H]1CCOC2(CCC2)C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875396992	FG	On-Demand	Anodyne	ETHR	42	45
O=C(N[C@@H]1CCOC2(CCC2)C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875396995	FG	On-Demand	Anodyne	SMO	37	42
O=C(N[C@@H]1CCOC2(CCC2)C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875396995	FG	On-Demand	Anodyne	ETHR	42	45
CCCCCCCNC(=O)C(=O)NC1CCC(OC(F)F)CC1	ZINC000875397005	EF	On-Demand	Mild	ASAH1	51	35
COc1cccc([C@H](O)C2CCN(C(=O)NCCc3cscn3)CC2)c1	ZINC000875397023	GF	On-Demand	Anodyne	DRD4	40	31
O=C(N[C@@H]1[C@H]2[C@H]3CC[C@@H](C3)[C@H]21)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875397105	EE	On-Demand	Anodyne	ETHR	41	35
O=C(NC1[C@@H]2[C@H]3CC[C@@H](C3)[C@@H]12)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875397106	EE	On-Demand	Anodyne	ETHR	41	35
O=C(NC1[C@@H]2[C@H]3CC[C@@H](C3)[C@@H]12)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875397107	EE	On-Demand	Anodyne	ETHR	41	35
O=C(N[C@@H]1[C@H]2[C@H]3CC[C@@H](C3)[C@H]21)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875397108	EE	On-Demand	Anodyne	ETHR	41	35
O=C(NCCc1cscn1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875397135	ED	On-Demand	Anodyne	ETHR	47	34
O=C(NCCc1cscn1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875397137	ED	On-Demand	Anodyne	ETHR	47	34
O=C(NCc1nc(-c2ccncc2)cs1)N[C@@H]1CCCC(F)(F)C1	ZINC000875397358	FH	On-Demand	Anodyne	ROCK1	20	42
O=C(NCc1nc(-c2ccncc2)cs1)N[C@H]1CCCC(F)(F)C1	ZINC000875397359	FH	On-Demand	Anodyne	ROCK1	20	42
N#Cc1ccc(Cn2cc(NC(=O)NC3[C@@H]4[C@H]5CC[C@@H](C5)[C@@H]34)cn2)cc1	ZINC000875397419	EF	On-Demand	Mild	ITK	17	50
N#Cc1ccc(Cn2cc(NC(=O)NC3[C@@H]4[C@H]5CC[C@@H](C5)[C@@H]34)cn2)cc1	ZINC000875397419	EF	On-Demand	Mild	PANC	56	38
N#Cc1ccc(Cn2cc(NC(=O)NC3[C@H]4[C@H]5CC[C@@H](C5)[C@H]34)cn2)cc1	ZINC000875397420	EF	On-Demand	Mild	ITK	17	50
N#Cc1ccc(Cn2cc(NC(=O)NC3[C@H]4[C@H]5CC[C@@H](C5)[C@H]34)cn2)cc1	ZINC000875397420	EF	On-Demand	Mild	PANC	56	38
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3[C@H]4[C@H]5CC[C@@H](C5)[C@H]43)cn2)cc1	ZINC000875397421	EF	On-Demand	Mild	ITK	17	50
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3[C@H]4[C@H]5CC[C@@H](C5)[C@H]43)cn2)cc1	ZINC000875397421	EF	On-Demand	Mild	PANC	56	38
C[C@@H](CC(=O)N(C)c1ccccc1S(C)(=O)=O)NC(=O)OC(C)(C)C	ZINC000875397444	FE	On-Demand	Anodyne	FPR1	46	38
CN1CC[C@@H](C(=O)OCc2cccc(OC(F)(F)F)c2)[C@@H](c2cnn(C)c2)C1	ZINC000875397586	GG	On-Demand	Anodyne	SLC6A9	23	42
CN1CCC(CNC(=O)NCCc2cscn2)(c2ccccc2)CC1	ZINC000875397587	FF	On-Demand	Anodyne	KCNA3	40	37
CN1CC[C@@H](C(=O)OCc2cccc(OC(F)(F)F)c2)[C@H](c2cnn(C)c2)C1	ZINC000875397591	GG	On-Demand	Anodyne	SLC6A9	23	42
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	ZINC000875397593	FF	On-Demand	Reactive	ADORA2B	25	44
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	ZINC000875397593	FF	On-Demand	Reactive	CA1	25	45
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	ZINC000875397593	FF	On-Demand	Reactive	ACR	44	34
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1	ZINC000875397593	FF	On-Demand	Reactive	CA9	18	45
O=C(NCc1nc(-c2ccncc2)cs1)NC1[C@H]2[C@H]3CC[C@@H](C3)[C@H]12	ZINC000875397609	EG	On-Demand	Anodyne	ROCK1	22	44
O=C(NCc1nc(-c2ccncc2)cs1)NC1[C@H]2[C@H]3CC[C@@H](C3)[C@H]12	ZINC000875397609	EG	On-Demand	Anodyne	ROCK2	16	44
O=C(NCc1nc(-c2ccncc2)cs1)N[C@@H]1[C@H]2[C@H]3CC[C@@H](C3)[C@H]21	ZINC000875397611	EG	On-Demand	Anodyne	ROCK1	22	44
O=C(NCc1nc(-c2ccncc2)cs1)N[C@@H]1[C@H]2[C@H]3CC[C@@H](C3)[C@H]21	ZINC000875397611	EG	On-Demand	Anodyne	ROCK2	16	44
O=C(NCc1nc(-c2ccncc2)cs1)NC1[C@@H]2[C@H]3CC[C@@H](C3)[C@@H]12	ZINC000875397613	EG	On-Demand	Anodyne	ROCK1	22	44
O=C(NCc1nc(-c2ccncc2)cs1)NC1[C@@H]2[C@H]3CC[C@@H](C3)[C@@H]12	ZINC000875397613	EG	On-Demand	Anodyne	ROCK2	16	44
O=C(N[C@H]1CCOC2(CCOCC2)C1)N1CCC[C@](F)(c2ccccc2)C1	ZINC000875397632	GG	On-Demand	Anodyne	EPHX2	23	40
O=C(N[C@@H]1CCOC2(CCOCC2)C1)N1CCC[C@@](F)(c2ccccc2)C1	ZINC000875397633	GG	On-Demand	Anodyne	EPHX2	23	40
O=C(N[C@H]1CCOC2(CCOCC2)C1)N1CCC[C@@](F)(c2ccccc2)C1	ZINC000875397634	GG	On-Demand	Anodyne	EPHX2	23	40
O=C(N[C@@H]1CCOC2(CCOCC2)C1)N1CCC[C@](F)(c2ccccc2)C1	ZINC000875397635	GG	On-Demand	Anodyne	EPHX2	23	40
O=C(NCCn1cc([N+](=O)[O-])cn1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875397703	FD	On-Demand	Bother	FAAH	16	40
COc1ccccc1[C@@H](NC(=O)N[C@H]1CCN(CC(C)(C)O)C1)c1ccco1	ZINC000875397734	GF	On-Demand	Anodyne	BIRC2	23	40
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@@H](c1ccco1)c1ccccc1OC	ZINC000875397740	FH	On-Demand	Anodyne	TIMP3	42	30
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@H](c1ccco1)c1ccccc1OC	ZINC000875397743	FH	On-Demand	Anodyne	TIMP3	42	30
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(Br)cc2)cc1	ZINC000875397767	HF	On-Demand	Reactive	ADORA2B	33	44
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(Br)cc2)cc1	ZINC000875397767	HF	On-Demand	Reactive	CA1	25	48
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(Br)cc2)cc1	ZINC000875397767	HF	On-Demand	Reactive	HDAC8	15	41
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(Br)cc2)cc1	ZINC000875397767	HF	On-Demand	Reactive	PLA2G4B	40	34
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(Br)cc2)cc1	ZINC000875397767	HF	On-Demand	Reactive	ACR	51	44
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(Br)cc2)cc1	ZINC000875397767	HF	On-Demand	Reactive	CA12	16	48
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(Br)cc2)cc1	ZINC000875397767	HF	On-Demand	Reactive	CA9	19	48
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(Br)cc2)cc1	ZINC000875397767	HF	On-Demand	Reactive	IDO1	18	43
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(Br)cc2)cc1	ZINC000875397767	HF	On-Demand	Reactive	TRAR	16	40
CCOc1ccccc1OCC(=O)NNC(=O)Nc1ccc(C(C)=O)cc1	ZINC000875397816	FF	On-Demand	Reactive	PPIA	36	44
CCOc1ccccc1OCC(=O)NNC(=O)Nc1ccc(C(C)=O)cc1	ZINC000875397816	FF	On-Demand	Reactive	CA1	25	44
CCOc1ccccc1OCC(=O)NNC(=O)Nc1ccc(C(C)=O)cc1	ZINC000875397816	FF	On-Demand	Reactive	PRNP	27	41
CC(=O)N(C)c1ccc(CNC(=O)NC(C(C)C)C(C)C)cc1	ZINC000875397860	DG	On-Demand	Anodyne	ANPEP	16	42
C#Cc1cccc(CNC(=O)C(=O)N2CCC[C@H]2c2nc(C)cs2)c1	ZINC000875397870	FE	On-Demand	Mild	CPT1A	65	40
C#Cc1cccc(CNC(=O)C(=O)N2CCC[C@@H]2c2nc(C)cs2)c1	ZINC000875397871	FE	On-Demand	Mild	CPT1A	65	40
C#Cc1cccc(CNC(=O)C(=O)N2CCC(CCF)CC2)c1	ZINC000875397891	DD	On-Demand	Mild	ST14	45	32
C#Cc1cccc(CNC(=O)C(=O)N[C@H](CC)c2cccc(OC)c2OC)c1	ZINC000875397909	GF	On-Demand	Mild	PDS	42	34
C#Cc1cccc(CNC(=O)C(=O)N[C@@H](CC)c2cccc(OC)c2OC)c1	ZINC000875397910	GF	On-Demand	Mild	PDS	42	34
CC(=O)c1ccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	ZINC000875397911	HD	On-Demand	Reactive	CA2	15	51
CC(=O)c1ccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	ZINC000875397911	HD	On-Demand	Reactive	CA1	15	43
CC(=O)c1ccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	ZINC000875397911	HD	On-Demand	Reactive	CA12	20	48
CC(=O)c1ccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	ZINC000875397911	HD	On-Demand	Reactive	CA9	20	51
CC(=O)c1ccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	ZINC000875397911	HD	On-Demand	Reactive	IDO1	31	42
CC(=O)c1ccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	ZINC000875397911	HD	On-Demand	Reactive	MTCA1	33	48
CC(=O)c1ccc(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1	ZINC000875397911	HD	On-Demand	Reactive	P96878_MYCTU	41	48
O=C(N[C@H]1CCO[C@@]2(CCSC2)C1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875398037	FG	On-Demand	Anodyne	EPHX2	20	41
O=C(N[C@@H]1CCO[C@]2(CCSC2)C1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875398038	FG	On-Demand	Anodyne	EPHX2	20	41
O=C(N[C@H]1CCO[C@]2(CCSC2)C1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875398039	FG	On-Demand	Anodyne	EPHX2	20	41
O=C(N[C@@H]1CCO[C@@]2(CCSC2)C1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875398041	FG	On-Demand	Anodyne	EPHX2	20	41
C#Cc1cccc(CNC(=O)C(=O)NC[C@H](CCC)OCC)c1	ZINC000875398069	DD	On-Demand	Mild	PDS	45	35
C#Cc1cccc(CNC(=O)C(=O)NC[C@@H](CCC)OCC)c1	ZINC000875398070	DD	On-Demand	Mild	PDS	45	35
O=C(NCc1ccc2c(c1)COC2)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875398212	FF	On-Demand	Anodyne	NAMPT	23	40
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2Cc2ccccc2)cc1	ZINC000875398260	HH	On-Demand	Reactive	PPIA	39	43
N#Cc1cccc([C@H](NC(=O)NCc2ccc3c(c2)COC3)C(F)(F)F)c1	ZINC000875398277	GH	On-Demand	Mild	CTSF	46	32
N#Cc1cccc([C@@H](NC(=O)NCc2ccc3c(c2)COC3)C(F)(F)F)c1	ZINC000875398279	GH	On-Demand	Mild	CTSF	46	32
C#Cc1cccc(CNC(=O)C(=O)NC[C@@H]2CCN2Cc2ccc(OC)cc2)c1	ZINC000875398332	GD	On-Demand	Mild	DRD2	28	40
C#Cc1cccc(CNC(=O)C(=O)NC[C@@H]2CCN2Cc2ccc(OC)cc2)c1	ZINC000875398332	GD	On-Demand	Mild	SIGMAR1	18	42
C#Cc1cccc(CNC(=O)C(=O)NC[C@H]2CCN2Cc2ccc(OC)cc2)c1	ZINC000875398333	GD	On-Demand	Mild	DRD2	28	40
C#Cc1cccc(CNC(=O)C(=O)NC[C@H]2CCN2Cc2ccc(OC)cc2)c1	ZINC000875398333	GD	On-Demand	Mild	SIGMAR1	18	42
CC(=O)c1ccc(NC(=O)NNC(=O)CSc2ccc(Cl)cc2)cc1	ZINC000875398357	GG	On-Demand	Reactive	IMDH_CRYPV	20	44
CC(=O)c1ccc(NC(=O)NNC(=O)CSc2ccc(Cl)cc2)cc1	ZINC000875398357	GG	On-Demand	Reactive	FAS	42	41
O=C(NCc1ccc2c(c1)COC2)N1Cc2cccnc2N2C[C@H](O)C[C@H]2C1	ZINC000875398388	GD	On-Demand	Anodyne	NAMPT	21	40
C#Cc1cccc(CNC(=O)C(=O)N2CCC(N3CCN(C)CC3)CC2)c1	ZINC000875398389	FC	On-Demand	Mild	L3MBTL3	76	40
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCO[C@]4(CCSC4)C3)cn2)cc1	ZINC000875398402	GF	On-Demand	Mild	PANC	45	36
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCO[C@@]4(CCSC4)C3)cn2)cc1	ZINC000875398403	GF	On-Demand	Mild	PANC	45	36
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCO[C@@]4(CCSC4)C3)cn2)cc1	ZINC000875398404	GF	On-Demand	Mild	PANC	45	36
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCO[C@]4(CCSC4)C3)cn2)cc1	ZINC000875398405	GF	On-Demand	Mild	PANC	45	36
O=C(NCc1ccc2c(c1)COC2)N1CCC[C@H](OC2CCC2)CC1	ZINC000875398412	EG	On-Demand	Anodyne	EPHX2	19	40
O=C(NCc1ccc2c(c1)COC2)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875398413	EG	On-Demand	Anodyne	EPHX2	19	40
CN1CCN(C(=O)c2scnc2C(F)F)c2cc(Cl)ccc21	ZINC000875398587	EH	On-Demand	Anodyne	GPBAR1	15	42
O=C(CCN1CCN(C(c2ccccc2)c2ccccc2)CC1)NNC(=O)Nc1nccs1	ZINC000875398598	JG	On-Demand	Reactive	CASR	19	49
O=C(CCN1CCN(C(c2ccccc2)c2ccccc2)CC1)NNC(=O)Nc1nccs1	ZINC000875398598	JG	On-Demand	Reactive	MAP1	105	38
C#Cc1cccc(CNC(=O)C(=O)NCCCCCCC)c1	ZINC000875398751	DE	On-Demand	Mild	S1PR2	44	33
C#Cc1cccc(CNC(=O)C(=O)NCCCCCCC)c1	ZINC000875398751	DE	On-Demand	Mild	ASAH1	76	36
O=C(NCc1ccc2c(c1)COC2)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875398753	FG	On-Demand	Anodyne	PREP	19	42
O=C(NCc1ccc2c(c1)COC2)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875398753	FG	On-Demand	Anodyne	TMPRSS11D	54	33
O=C(NCc1ccc2c(c1)COC2)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875398754	FG	On-Demand	Anodyne	PREP	19	42
O=C(NCc1ccc2c(c1)COC2)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875398754	FG	On-Demand	Anodyne	TMPRSS11D	54	33
O=C(NCc1ccc2c(c1)COC2)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875398755	FG	On-Demand	Anodyne	PREP	19	42
O=C(NCc1ccc2c(c1)COC2)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875398755	FG	On-Demand	Anodyne	TMPRSS11D	54	33
O=C(NCc1ccc2c(c1)COC2)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875398756	FG	On-Demand	Anodyne	PREP	19	42
O=C(NCc1ccc2c(c1)COC2)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875398756	FG	On-Demand	Anodyne	TMPRSS11D	54	33
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc2c(c1)COC2	ZINC000875398767	ED	On-Demand	Anodyne	SLC6A3	42	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc2c(c1)COC2	ZINC000875398768	ED	On-Demand	Anodyne	SLC6A3	42	37
O=C(NCc1ccc2c(c1)COC2)N1Cc2cccc(O)c2C1	ZINC000875398820	DF	On-Demand	Clean	NAMPT	23	45
C[C@H](NC(=O)/C=C\c1ccc(O)cc1)c1ccccc1Br	ZINC000875398894	EI	On-Demand	Anodyne	F3	25	41
C[C@H](NC(=O)/C=C\c1ccc(O)cc1)c1ccccc1Br	ZINC000875398894	EI	On-Demand	Anodyne	MMP2	15	49
C[C@H](NC(=O)/C=C\c1ccc(O)cc1)c1ccccc1Br	ZINC000875398894	EI	On-Demand	Anodyne	HDAC6	18	49
C[C@H](NC(=O)/C=C\c1ccc(O)cc1)c1ccccc1Br	ZINC000875398894	EI	On-Demand	Anodyne	MMP9	15	49
C[C@H](NC(=O)/C=C\c1ccc(O)cc1)c1ccccc1Br	ZINC000875398894	EI	On-Demand	Anodyne	UL26	51	38
C[C@H](NC(=O)/C=C/c1ccc(O)cc1)c1ccccc1Br	ZINC000875398896	EI	On-Demand	Anodyne	F3	25	41
C[C@H](NC(=O)/C=C/c1ccc(O)cc1)c1ccccc1Br	ZINC000875398896	EI	On-Demand	Anodyne	MMP2	15	49
C[C@H](NC(=O)/C=C/c1ccc(O)cc1)c1ccccc1Br	ZINC000875398896	EI	On-Demand	Anodyne	HDAC6	18	49
C[C@H](NC(=O)/C=C/c1ccc(O)cc1)c1ccccc1Br	ZINC000875398896	EI	On-Demand	Anodyne	MMP9	15	49
C[C@H](NC(=O)/C=C/c1ccc(O)cc1)c1ccccc1Br	ZINC000875398896	EI	On-Demand	Anodyne	UL26	51	38
CN1CCN(C(=O)c2c(C(F)F)nc3n2CCCC3)c2cc(Cl)ccc21	ZINC000875398958	GH	On-Demand	Anodyne	CNR1	51	31
C#Cc1cccc(CNC(=O)C(=O)N2CCn3c(nnc3-c3cn(C)cn3)C2)c1	ZINC000875398969	GC	On-Demand	Mild	P2RX7	24	41
C#Cc1cccc(CNC(=O)C(=O)N(C)C[C@H](C)NC(=O)OC(C)(C)C)c1	ZINC000875399027	FD	On-Demand	Mild	FPR1	40	34
C#Cc1cccc(CNC(=O)C(=O)N(C)C[C@@H](C)NC(=O)OC(C)(C)C)c1	ZINC000875399029	FD	On-Demand	Mild	FPR1	40	34
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1ncccc1OC)CC2	ZINC000875399080	GD	On-Demand	Anodyne	SLC18A2	45	33
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1ncccc1OC)CC2	ZINC000875399080	GD	On-Demand	Anodyne	HCRTR1	17	46
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1ncccc1OC)CC2	ZINC000875399080	GD	On-Demand	Anodyne	MTNR1B	15	44
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1ncccc1OC)CC2	ZINC000875399080	GD	On-Demand	Anodyne	HCRTR2	15	46
CC(=O)c1ccc(NC(=O)NNC(=O)CN2CCCc3ccccc32)cc1	ZINC000875399082	FE	On-Demand	Reactive	AVPR2	76	49
CC(=O)c1ccc(NC(=O)NNC(=O)CN2CCCc3ccccc32)cc1	ZINC000875399082	FE	On-Demand	Reactive	AVPR1A	32	49
CC(=O)c1ccc(NC(=O)NNC(=O)CN2CCCc3ccccc32)cc1	ZINC000875399082	FE	On-Demand	Reactive	NOD2	40	33
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1ncccc1OC)CC2	ZINC000875399083	GD	On-Demand	Anodyne	SLC18A2	45	33
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1ncccc1OC)CC2	ZINC000875399083	GD	On-Demand	Anodyne	HCRTR1	17	46
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1ncccc1OC)CC2	ZINC000875399083	GD	On-Demand	Anodyne	MTNR1B	15	44
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1ncccc1OC)CC2	ZINC000875399083	GD	On-Demand	Anodyne	HCRTR2	15	46
CCCCCCCNC(=O)C(=O)NCc1ncccc1OC	ZINC000875399118	DD	On-Demand	Mild	HTR1A	15	43
CCCCCCCNC(=O)C(=O)NCc1ncccc1OC	ZINC000875399118	DD	On-Demand	Mild	INHA	38	40
CCCCCCCNC(=O)C(=O)NCc1ncccc1OC	ZINC000875399118	DD	On-Demand	Mild	FAAH	22	45
CCCCCCCNC(=O)C(=O)NCc1ncccc1OC	ZINC000875399118	DD	On-Demand	Mild	ASAH1	81	34
CC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	ZINC000875399136	HD	On-Demand	Reactive	CA1	27	43
CC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	ZINC000875399136	HD	On-Demand	Reactive	CA12	19	46
CC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	ZINC000875399136	HD	On-Demand	Reactive	CA9	21	58
CC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	ZINC000875399136	HD	On-Demand	Reactive	MTCA1	30	46
CC(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1	ZINC000875399136	HD	On-Demand	Reactive	P96878_MYCTU	36	46
C#Cc1cccc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)c1	ZINC000875399162	FD	On-Demand	Mild	SIRT3	42	34
C#Cc1cccc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)c1	ZINC000875399162	FD	On-Demand	Mild	SIRT2	46	34
C#Cc1cccc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)c1	ZINC000875399162	FD	On-Demand	Mild	SIRT1	42	34
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC(C(C)C)C(C)C	ZINC000875399186	CE	On-Demand	Anodyne	SLC6A4	18	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC(C(C)C)C(C)C	ZINC000875399186	CE	On-Demand	Anodyne	SLC6A3	37	40
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	ZINC000875399218	IE	On-Demand	Reactive	CA2	15	66
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	ZINC000875399218	IE	On-Demand	Reactive	LPL	49	40
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	ZINC000875399218	IE	On-Demand	Reactive	EPHX2	28	50
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	ZINC000875399218	IE	On-Demand	Reactive	TGM2	85	46
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	ZINC000875399218	IE	On-Demand	Reactive	CA9	19	66
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	ZINC000875399218	IE	On-Demand	Reactive	F13A1	98	55
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	ZINC000875399218	IE	On-Demand	Reactive	LIPG	20	40
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	ZINC000875399218	IE	On-Demand	Reactive	MTCA1	39	50
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	ZINC000875399218	IE	On-Demand	Reactive	P96878_MYCTU	48	50
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1	ZINC000875399218	IE	On-Demand	Reactive	NAMPT	45	51
C#Cc1cccc(CNC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)c1	ZINC000875399230	GE	On-Demand	Mild	CPT1A	15	40
C#Cc1cccc(CNC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)c1	ZINC000875399230	GE	On-Demand	Mild	ETHR	62	43
N#CCc1ccsc1C(=O)N1CCCC[C@H]1CNC(=O)c1ccccc1	ZINC000875399247	FG	On-Demand	Mild	HCRTR1	37	60
N#CCc1ccsc1C(=O)N1CCCC[C@H]1CNC(=O)c1ccccc1	ZINC000875399247	FG	On-Demand	Mild	PREP	33	41
N#CCc1ccsc1C(=O)N1CCCC[C@H]1CNC(=O)c1ccccc1	ZINC000875399247	FG	On-Demand	Mild	HCRTR2	18	60
N#CCc1ccsc1C(=O)N1CCCC[C@@H]1CNC(=O)c1ccccc1	ZINC000875399248	FG	On-Demand	Mild	HCRTR1	37	60
N#CCc1ccsc1C(=O)N1CCCC[C@@H]1CNC(=O)c1ccccc1	ZINC000875399248	FG	On-Demand	Mild	PREP	33	41
N#CCc1ccsc1C(=O)N1CCCC[C@@H]1CNC(=O)c1ccccc1	ZINC000875399248	FG	On-Demand	Mild	HCRTR2	18	60
CC[C@@H](NC(=O)C(=O)NCC1(COC)CCCC1)c1cccc(OC)c1OC	ZINC000875399339	GF	On-Demand	Anodyne	HCN1	50	32
CC[C@@H](NC(=O)C(=O)NCC1(COC)CCCC1)c1cccc(OC)c1OC	ZINC000875399339	GF	On-Demand	Anodyne	HCN4	48	32
Cn1nc(Cl)c(C(=O)N2CCCC[C@@H]2CNC(=O)c2ccccc2)c1Cl	ZINC000875399345	GG	On-Demand	Anodyne	HCRTR1	37	60
Cn1nc(Cl)c(C(=O)N2CCCC[C@@H]2CNC(=O)c2ccccc2)c1Cl	ZINC000875399345	GG	On-Demand	Anodyne	PREP	24	43
Cn1nc(Cl)c(C(=O)N2CCCC[C@@H]2CNC(=O)c2ccccc2)c1Cl	ZINC000875399345	GG	On-Demand	Anodyne	HCRTR2	18	60
Cn1nc(Cl)c(C(=O)N2CCCC[C@@H]2CNC(=O)c2ccccc2)c1Cl	ZINC000875399345	GG	On-Demand	Anodyne	CACNA1I	61	37
Cn1nc(Cl)c(C(=O)N2CCCC[C@H]2CNC(=O)c2ccccc2)c1Cl	ZINC000875399349	GG	On-Demand	Anodyne	HCRTR1	37	60
Cn1nc(Cl)c(C(=O)N2CCCC[C@H]2CNC(=O)c2ccccc2)c1Cl	ZINC000875399349	GG	On-Demand	Anodyne	PREP	24	43
Cn1nc(Cl)c(C(=O)N2CCCC[C@H]2CNC(=O)c2ccccc2)c1Cl	ZINC000875399349	GG	On-Demand	Anodyne	HCRTR2	18	60
Cn1nc(Cl)c(C(=O)N2CCCC[C@H]2CNC(=O)c2ccccc2)c1Cl	ZINC000875399349	GG	On-Demand	Anodyne	CACNA1I	61	37
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(OCCC(C)C)cc2)cc1	ZINC000875399364	GH	On-Demand	Reactive	CA1	15	44
O=C(NCc1cccc2c1OCCCO2)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875399497	FG	On-Demand	Anodyne	EPHX2	19	42
O=C(NCc1cccc2c1OCCCO2)N1CCC[C@H](OC2CCC2)CC1	ZINC000875399498	FG	On-Demand	Anodyne	EPHX2	19	42
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(F)cc2)cc1	ZINC000875399540	EE	On-Demand	Reactive	ADORA2B	40	45
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(F)cc2)cc1	ZINC000875399540	EE	On-Demand	Reactive	CA1	23	47
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(F)cc2)cc1	ZINC000875399540	EE	On-Demand	Reactive	FAAH	16	40
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(F)cc2)cc1	ZINC000875399540	EE	On-Demand	Reactive	EPHX2	18	41
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(F)cc2)cc1	ZINC000875399540	EE	On-Demand	Reactive	ACR	46	35
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(F)cc2)cc1	ZINC000875399540	EE	On-Demand	Reactive	CA12	17	47
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(F)cc2)cc1	ZINC000875399540	EE	On-Demand	Reactive	PDGFRA	27	40
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(F)cc2)cc1	ZINC000875399540	EE	On-Demand	Reactive	CA9	19	47
CC(=O)c1ccc(NC(=O)NNC(=O)[C@H](C)Oc2c(C)cc(Cl)cc2C)cc1	ZINC000875399672	HH	On-Demand	Reactive	IMDH_CRYPV	24	43
CC(=O)c1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2c(C)cc(Cl)cc2C)cc1	ZINC000875399673	HH	On-Demand	Reactive	IMDH_CRYPV	24	43
CCCOc1cccc(CCNC(=O)N(C)OCC(F)(F)F)c1	ZINC000875399705	EG	On-Demand	Anodyne	MTNR1A	32	41
CCCOc1cccc(CCNC(=O)N(C)OCC(F)(F)F)c1	ZINC000875399705	EG	On-Demand	Anodyne	CRTM	50	35
CCCOc1cccc(CCNC(=O)N(C)OCC(F)(F)F)c1	ZINC000875399705	EG	On-Demand	Anodyne	PDS	61	42
COc1ccc([C@H](NC(=O)C(=O)N2CCC(C(C)=O)CC2)c2ccco2)cc1	ZINC000875399709	GE	On-Demand	Anodyne	CHRM2	41	35
COc1ccc([C@@H](NC(=O)C(=O)N2CCC(C(C)=O)CC2)c2ccco2)cc1	ZINC000875399710	GE	On-Demand	Anodyne	CHRM2	41	35
Cc1cc(C)c2c(c1)CCCN2C(=O)c1nn(C)cc1Cl	ZINC000875399717	DG	On-Demand	Anodyne	CNR1	40	32
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C)cc2)cc1	ZINC000875399747	EE	On-Demand	Reactive	ADORA2B	38	46
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C)cc2)cc1	ZINC000875399747	EE	On-Demand	Reactive	CA1	30	48
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C)cc2)cc1	ZINC000875399747	EE	On-Demand	Reactive	PRNP	16	40
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C)cc2)cc1	ZINC000875399747	EE	On-Demand	Reactive	PLA2G4B	40	34
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C)cc2)cc1	ZINC000875399747	EE	On-Demand	Reactive	ACR	51	44
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C)cc2)cc1	ZINC000875399747	EE	On-Demand	Reactive	CA12	18	48
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccc(C)cc2)cc1	ZINC000875399747	EE	On-Demand	Reactive	CA9	22	48
O=C(NCc1ccn(C2CCCC2)n1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875399765	FH	On-Demand	Anodyne	EPHX2	18	40
O=C(NCc1ccn(C2CCCC2)n1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875399766	FH	On-Demand	Anodyne	EPHX2	18	40
CN1CCN(C2CCN(C(=O)N[C@H]3CC(C)(C)c4ccccc43)CC2)CC1	ZINC000875399830	FF	On-Demand	Anodyne	L3MBTL3	73	41
O=C(N[C@@H](c1cccc(Cl)c1)C1CCCC1)N1CCC2(CCNC2=O)CC1	ZINC000875399850	GH	On-Demand	Anodyne	CACNA1H	56	40
O=C(N[C@H](c1cccc(Cl)c1)C1CCCC1)N1CCC2(CCNC2=O)CC1	ZINC000875399851	GH	On-Demand	Anodyne	CACNA1H	56	40
CCCOc1cccc(CCNC(=O)NC2(C)CC(F)(F)C2)c1	ZINC000875399870	EH	On-Demand	Anodyne	HRH2	29	45
CCCOc1cccc(CCNC(=O)NC2(C)CC(F)(F)C2)c1	ZINC000875399870	EH	On-Demand	Anodyne	MTNR1A	37	41
CCCOc1cccc(CCNC(=O)NC2(C)CC(F)(F)C2)c1	ZINC000875399870	EH	On-Demand	Anodyne	PDS	41	36
CN1CCN(C2CCN(C(=O)N[C@@H]3CC(C)(C)c4ccccc43)CC2)CC1	ZINC000875399960	FF	On-Demand	Anodyne	L3MBTL3	73	41
CC(=O)c1ccc(NC(=O)NNC(=O)COc2ccccc2C#N)cc1	ZINC000875399974	FD	On-Demand	Reactive	ADRB1	56	46
CCCOc1cccc(CCNC(=O)N2Cc3cccc(O)c3C2)c1	ZINC000875400072	EG	On-Demand	Clean	HRH2	28	41
CCCOc1cccc(CCNC(=O)N(CCOC)C2CCOCC2)c1	ZINC000875400075	FF	On-Demand	Anodyne	CRTM	54	34
CCCCCCCNC(=O)C(=O)N[C@@H]1CCO[C@H](c2nccn2C)C1	ZINC000875400127	FD	On-Demand	Mild	ASAH1	48	35
CCCCCCCNC(=O)C(=O)N[C@H]1CCO[C@H](c2nccn2C)C1	ZINC000875400128	FD	On-Demand	Mild	ASAH1	48	35
CCCCCCCNC(=O)C(=O)N[C@@H]1CCO[C@@H](c2nccn2C)C1	ZINC000875400129	FD	On-Demand	Mild	ASAH1	48	35
CCCCCCCNC(=O)C(=O)N[C@H]1CCO[C@@H](c2nccn2C)C1	ZINC000875400130	FD	On-Demand	Mild	ASAH1	48	35
CCCOc1cccc(CCNC(=O)N2CCC(C(=O)NCCO)CC2)c1	ZINC000875400134	GD	On-Demand	Anodyne	HRH2	32	43
CCCOc1cccc(CCNC(=O)N2CCC(C(=O)NCCO)CC2)c1	ZINC000875400134	GD	On-Demand	Anodyne	MTNR1A	39	52
CCCOc1cccc(CCNC(=O)N2CCC(C(=O)NCCO)CC2)c1	ZINC000875400134	GD	On-Demand	Anodyne	MTNR1B	33	43
CCCOc1cccc(CCNC(=O)N2CCC(C(=O)NCCO)CC2)c1	ZINC000875400134	GD	On-Demand	Anodyne	EPHX2	17	42
CCCOc1cccc(CCNC(=O)N2CCC(C(=O)NCCO)CC2)c1	ZINC000875400134	GD	On-Demand	Anodyne	CACNA1G	25	42
CC(=O)c1ccc(NC(=O)NNC(=O)CSc2ccc(C)cc2)cc1	ZINC000875400135	FG	On-Demand	Reactive	FAS	45	35
CCCOc1cccc(CCNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875400296	EF	On-Demand	Anodyne	HRH2	30	43
CCCOc1cccc(CCNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875400297	EF	On-Demand	Anodyne	HRH2	30	43
CCCOc1cccc(CCNC(=O)N2CC(CNC(=O)C(F)(F)F)C2)c1	ZINC000875400356	GE	On-Demand	Anodyne	HRH2	28	41
CCCOc1cccc(CCNC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875400465	DE	On-Demand	Anodyne	HRH2	30	48
CCCOc1cccc(CCNC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875400465	DE	On-Demand	Anodyne	MTNR1A	43	41
CCCOc1cccc(CCNC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875400465	DE	On-Demand	Anodyne	PDS	52	37
CCCOc1cccc(CCNC(=O)N2CC(O)(C(=O)OC)C2)c1	ZINC000875400491	EC	On-Demand	Anodyne	HRH2	29	42
CCCOc1cccc(CCNC(=O)N2CC(O)(C(=O)OC)C2)c1	ZINC000875400491	EC	On-Demand	Anodyne	MTNR1A	43	42
CCCOc1cccc(CCNC(=O)N2CC(O)(C(=O)OC)C2)c1	ZINC000875400491	EC	On-Demand	Anodyne	MTNR1B	32	42
CCCOc1cccc(CCNC(=O)NC[C@@H]2CCO[C@@H]2C(=O)OC)c1	ZINC000875400516	FD	On-Demand	Anodyne	HRH2	26	43
O=C(N[C@@H]1CCOC2(CCSCC2)C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875400517	GG	On-Demand	Anodyne	EPHX2	33	42
O=C(N[C@H]1CCOC2(CCSCC2)C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875400518	GG	On-Demand	Anodyne	EPHX2	33	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccn(C2CCCC2)n1	ZINC000875400566	EE	On-Demand	Anodyne	SLC6A3	40	35
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccn(C2CCCC2)n1	ZINC000875400567	EE	On-Demand	Anodyne	SLC6A3	40	35
N#Cc1ccccc1OCC(=O)NNC(=O)Nc1nccs1	ZINC000875400651	DD	On-Demand	Reactive	ADRB1	49	39
N#Cc1ccccc1OCC(=O)NNC(=O)Nc1nccs1	ZINC000875400651	DD	On-Demand	Reactive	MAP1	122	45
C[C@H](NC(=O)/C=C\c1ccc2ccccc2n1)c1ccccc1Br	ZINC000875400654	GJ	On-Demand	Anodyne	UL26	60	39
C[C@H](NC(=O)/C=C\c1ccc2ccccc2n1)c1ccccc1Br	ZINC000875400654	GJ	On-Demand	Anodyne	SCAF_EBVB9	51	39
Cc1cc(C)c2c(c1)CCCN2C(=O)c1ccc(NS(C)(=O)=O)nc1	ZINC000875400669	FF	On-Demand	Anodyne	AVPR2	35	41
CCCOc1cccc(CCNC(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875400679	FD	On-Demand	Anodyne	HRH2	35	44
CCCOc1cccc(CCNC(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875400679	FD	On-Demand	Anodyne	MTNR1A	32	40
CCCOc1cccc(CCNC(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875400679	FD	On-Demand	Anodyne	CRTM	40	37
CCCOc1cccc(CCNC(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875400679	FD	On-Demand	Anodyne	PDS	45	36
CC(=O)c1ccc(NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	ZINC000875400688	FF	On-Demand	Reactive	HTR1D	18	43
CC(=O)c1ccc(NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	ZINC000875400688	FF	On-Demand	Reactive	HTR1B	19	43
CC(=O)c1ccc(NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	ZINC000875400688	FF	On-Demand	Reactive	TACR1	20	40
CC(=O)c1ccc(NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	ZINC000875400688	FF	On-Demand	Reactive	CCKAR	28	42
CC(=O)c1ccc(NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	ZINC000875400688	FF	On-Demand	Reactive	BRS3	25	47
CC(=O)c1ccc(NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	ZINC000875400688	FF	On-Demand	Reactive	NMBR	89	37
CC(=O)c1ccc(NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	ZINC000875400688	FF	On-Demand	Reactive	MMP2	21	44
CC(=O)c1ccc(NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	ZINC000875400688	FF	On-Demand	Reactive	GRPR	54	37
CC(=O)c1ccc(NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	ZINC000875400688	FF	On-Demand	Reactive	SSTR3	21	44
CC(=O)c1ccc(NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	ZINC000875400688	FF	On-Demand	Reactive	MMP11	43	31
CC(=O)c1ccc(NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	ZINC000875400688	FF	On-Demand	Reactive	CCKBR	28	40
CC(=O)c1ccc(NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	ZINC000875400688	FF	On-Demand	Reactive	CFTR	34	43
CC(=O)c1ccc(NC(=O)NNC(=O)Cc2c[nH]c3ccccc23)cc1	ZINC000875400688	FF	On-Demand	Reactive	MMP9	20	44
CCCOc1cccc(CCNC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)c1	ZINC000875400731	GE	On-Demand	Anodyne	HRH2	26	41
CN1CC[C@@H](C(=O)OCc2ccc(Cl)cc2Cl)[C@H](c2cnn(C)c2)C1	ZINC000875400777	GH	On-Demand	Anodyne	SLC6A3	23	45
CN1CC[C@@H](C(=O)OCc2ccc(Cl)cc2Cl)[C@@H](c2cnn(C)c2)C1	ZINC000875400779	GH	On-Demand	Anodyne	SLC6A3	23	45
O=C(N[C@@H](c1cccc(Cl)c1)C1CCCC1)N1CCC(CO)(CO)CC1	ZINC000875400825	GG	On-Demand	Anodyne	CACNA1H	57	38
O=C(N[C@@H](c1cccc(Cl)c1)C1CCCC1)N1CCC(CO)(CO)CC1	ZINC000875400825	GG	On-Demand	Anodyne	CCKBR	20	41
O=C(N[C@H](c1cccc(Cl)c1)C1CCCC1)N1CCC(CO)(CO)CC1	ZINC000875400826	GG	On-Demand	Anodyne	CACNA1H	57	38
O=C(N[C@H](c1cccc(Cl)c1)C1CCCC1)N1CCC(CO)(CO)CC1	ZINC000875400826	GG	On-Demand	Anodyne	CCKBR	20	41
CCCOc1cccc(CCNC(=O)N2CCCN(C=O)CC2)c1	ZINC000875400950	ED	On-Demand	Anodyne	HRH2	46	45
CC(=O)c1ccc(NC(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)cc1	ZINC000875400962	GH	On-Demand	Reactive	NPR1	40	33
CC(=O)c1ccc(NC(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)cc1	ZINC000875400962	GH	On-Demand	Reactive	CA1	48	43
CC(=O)c1ccc(NC(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)cc1	ZINC000875400962	GH	On-Demand	Reactive	F7	15	41
CC(=O)c1ccc(NC(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)cc1	ZINC000875400962	GH	On-Demand	Reactive	CA12	17	43
CC(=O)c1ccc(NC(=O)NNC(=O)[C@H](C)Oc2ccc3ccccc3c2)cc1	ZINC000875400962	GH	On-Demand	Reactive	CA9	20	43
CC(=O)c1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)cc1	ZINC000875400963	GH	On-Demand	Reactive	NPR1	40	33
CC(=O)c1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)cc1	ZINC000875400963	GH	On-Demand	Reactive	CA1	48	43
CC(=O)c1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)cc1	ZINC000875400963	GH	On-Demand	Reactive	F7	15	41
CC(=O)c1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)cc1	ZINC000875400963	GH	On-Demand	Reactive	CA12	17	43
CC(=O)c1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2ccc3ccccc3c2)cc1	ZINC000875400963	GH	On-Demand	Reactive	CA9	20	43
CC[C@@H](NC(=O)NCc1ccn(C2CCCC2)n1)[C@@H](O)c1ccccc1	ZINC000875401072	FG	On-Demand	Anodyne	XIAP	46	36
CC[C@@H](NC(=O)NCc1ccn(C2CCCC2)n1)[C@H](O)c1ccccc1	ZINC000875401077	FG	On-Demand	Anodyne	XIAP	46	36
Cc1cc(C)c2c(c1)CCCN2C(=O)c1ccnc(N2CCOCC2)n1	ZINC000875401106	FF	On-Demand	Anodyne	EPHB4	42	31
CC(=O)c1ccc(NC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)cc1	ZINC000875401156	HG	On-Demand	Reactive	CA1	22	41
CC(=O)c1ccc(NC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)cc1	ZINC000875401157	HG	On-Demand	Reactive	CA1	22	41
CCCOc1cccc(CCNC(=O)NNc2nnc(C)n2C)c1	ZINC000875401278	ED	On-Demand	Reactive	HRH2	27	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CC(C)(C)c3ccccc32)C1	ZINC000875401294	EG	On-Demand	Anodyne	GHRHR	64	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CC(C)(C)c3ccccc32)C1	ZINC000875401295	EG	On-Demand	Anodyne	GHRHR	64	35
CCCOc1cccc(CCNC(=O)NN(C)C(=O)OC)c1	ZINC000875401309	DD	On-Demand	Reactive	HRH2	27	44
CCCOc1cccc(CCNC(=O)NN(C)C(=O)OC)c1	ZINC000875401309	DD	On-Demand	Reactive	MTNR1A	71	47
CCCOc1cccc(CCNC(=O)NN(C)C(=O)OC)c1	ZINC000875401309	DD	On-Demand	Reactive	MTNR1B	54	42
CCCOc1cccc(CCNC(=O)NN(C)C(=O)OC)c1	ZINC000875401309	DD	On-Demand	Reactive	CRTM	56	35
CCCOc1cccc(CCNC(=O)NN(C)C(=O)OC)c1	ZINC000875401309	DD	On-Demand	Reactive	PDS	56	36
O=C(NCCO)C1CCN(C(=O)NCc2ccn(C3CCCC3)n2)CC1	ZINC000875401364	FD	On-Demand	Anodyne	EPHX2	17	45
C[C@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)[C@H]1CN(C)CCO1	ZINC000875401398	FD	On-Demand	Mild	ITK	16	45
C[C@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)[C@H]1CN(C)CCO1	ZINC000875401398	FD	On-Demand	Mild	PANC	41	36
C[C@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)[C@@H]1CN(C)CCO1	ZINC000875401400	FD	On-Demand	Mild	ITK	16	45
C[C@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)[C@@H]1CN(C)CCO1	ZINC000875401400	FD	On-Demand	Mild	PANC	41	36
Cc1cc(C)c2c(c1)CCCN2C(=O)c1ccc(C(=O)N2CCOCC2)cc1	ZINC000875401471	GG	On-Demand	Anodyne	AVPR2	33	43
Cc1cc(C)c2c(c1)CCCN2C(=O)c1ccc(C(=O)N2CCOCC2)cc1	ZINC000875401471	GG	On-Demand	Anodyne	L3MBTL3	42	33
CC(=O)C1CCN(C(=O)N[C@@H]2[C@@H]3CCc4ccccc4[C@@H]32)CC1	ZINC000875401572	DF	On-Demand	Anodyne	EPHX2	19	43
CC(=O)C1CCN(C(=O)N[C@H]2[C@@H]3c4ccccc4CC[C@H]32)CC1	ZINC000875401573	DF	On-Demand	Anodyne	EPHX2	19	43
CC(=O)C1CCN(C(=O)N[C@@H]2[C@H]3CCc4ccccc4[C@@H]32)CC1	ZINC000875401574	DF	On-Demand	Anodyne	EPHX2	19	43
CC(=O)C1CCN(C(=O)N[C@@H]2[C@H]3CCc4ccccc4[C@H]32)CC1	ZINC000875401575	DF	On-Demand	Anodyne	EPHX2	19	43
COC(=O)N(C)NC(=O)NCCCc1ccccn1	ZINC000875401592	CC	On-Demand	Reactive	HRH2	21	47
COC(=O)N(C)NC(=O)NCCCc1ccccn1	ZINC000875401592	CC	On-Demand	Reactive	MTNR1B	17	44
O=C(NCCOCC1CCCC1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875401595	EB	On-Demand	Anodyne	SPHK1	16	41
COc1cccc([C@H](O)C2CCN(C(=O)NCCCc3ccccn3)CC2)c1	ZINC000875401611	GG	On-Demand	Anodyne	DRD4	41	31
COc1cccc([C@H](O)C2CCN(C(=O)NCCCc3ccccn3)CC2)c1	ZINC000875401611	GG	On-Demand	Anodyne	MTNR1B	32	45
CN1CCN(C2CCN(C(=O)C(=O)NCC(C)(C)C3=CCCC3)CC2)CC1	ZINC000875401614	GD	On-Demand	Anodyne	L3MBTL3	52	39
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CN(C(=O)NCCCc1ccccn1)C2	ZINC000875401673	FF	On-Demand	Anodyne	GPR119	30	41
COC(=O)Cc1ccccc1NC(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875401693	GI	On-Demand	Anodyne	KCNK3	42	36
O=C(NCCC[C@H]1C=CCC1)C(=O)NCCOCC1CCCC1	ZINC000875401729	DE	On-Demand	Anodyne	SPHK1	15	40
O=C(NCCC[C@@H]1C=CCC1)C(=O)NCCOCC1CCCC1	ZINC000875401730	DE	On-Demand	Anodyne	SPHK1	15	40
Cc1ncc(CCNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)s1	ZINC000875401763	FG	On-Demand	Anodyne	CPT1A	65	33
Cc1ncc(CCNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)s1	ZINC000875401764	FG	On-Demand	Anodyne	CPT1A	65	33
Cc1ncc(CCNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)s1	ZINC000875401765	FG	On-Demand	Anodyne	CPT1A	65	33
Cc1ncc(CCNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)s1	ZINC000875401766	FG	On-Demand	Anodyne	CPT1A	65	33
COc1cc(C(=O)NNC(=O)Nc2ccc(C(C)=O)cc2)ccc1OCCC(C)C	ZINC000875401770	HH	On-Demand	Reactive	PDGFRA	45	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2[C@@H]3c4ccccc4CC[C@H]32)C1	ZINC000875401803	EF	On-Demand	Anodyne	ACE	21	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2[C@@H]3CCc4ccccc4[C@@H]32)C1	ZINC000875401804	EF	On-Demand	Anodyne	ACE	21	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2[C@H]3CCc4ccccc4[C@@H]32)C1	ZINC000875401805	EF	On-Demand	Anodyne	ACE	21	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2[C@H]3CCc4ccccc4[C@H]32)C1	ZINC000875401806	EF	On-Demand	Anodyne	ACE	21	43
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1	ZINC000875401817	FD	On-Demand	Reactive	PRNP	41	40
C[C@@H](O)C1CCN(C(=O)N[C@H]2[C@@H]3c4ccccc4CC[C@H]32)CC1	ZINC000875401820	DF	On-Demand	Anodyne	EPHX2	15	42
C[C@@H](O)C1CCN(C(=O)N[C@@H]2[C@@H]3CCc4ccccc4[C@@H]32)CC1	ZINC000875401821	DF	On-Demand	Anodyne	EPHX2	15	42
C[C@@H](O)C1CCN(C(=O)N[C@@H]2[C@H]3CCc4ccccc4[C@H]32)CC1	ZINC000875401822	DF	On-Demand	Anodyne	EPHX2	15	42
O=C(NCCCc1ccccn1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875401829	EF	On-Demand	Anodyne	FKBP1A	21	43
O=C(NCCCc1ccccn1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875401830	EF	On-Demand	Anodyne	FKBP1A	21	43
O=C(NCCCc1ccccn1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875401831	EF	On-Demand	Anodyne	FKBP1A	21	43
O=C(NCCCc1ccccn1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875401832	EF	On-Demand	Anodyne	FKBP1A	21	43
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC(=O)NCCCc2ccccn2)CC1	ZINC000875401863	GG	On-Demand	Anodyne	GRIN2B	18	40
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC(=O)NCCCc2ccccn2)CC1	ZINC000875401863	GG	On-Demand	Anodyne	ACACB	15	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2cccc(OCC)c2)C1	ZINC000875401956	EE	On-Demand	Anodyne	HRH2	25	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2cccc(OCC)c2)C1	ZINC000875401956	EE	On-Demand	Anodyne	PDS	71	38
CCN(CCNC(=O)OC(C)(C)C)C(=O)NCCCc1ccccn1	ZINC000875401962	FF	On-Demand	Anodyne	HRH2	16	40
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H](C1CCC1)C1CC1	ZINC000875401999	FF	On-Demand	Anodyne	C3AR1	41	42
O=C(N[C@@H](C1CCC1)C1CC1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875402000	FF	On-Demand	Anodyne	C3AR1	41	42
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@H](C1CCC1)C1CC1	ZINC000875402001	FF	On-Demand	Anodyne	C3AR1	41	42
O=C(N[C@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@H](C1CCC1)C1CC1	ZINC000875402002	FF	On-Demand	Anodyne	C3AR1	41	42
C=CCC[C@H](NC(=O)N(C)CCN1CC2(CCOCC2)C1)c1ccccc1	ZINC000875402003	FG	On-Demand	Mild	CASR	50	38
C=CCC[C@@H](NC(=O)N(C)CCN1CC2(CCOCC2)C1)c1ccccc1	ZINC000875402004	FG	On-Demand	Mild	CASR	50	38
CN(Cc1ccc[nH]1)C(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875402011	EH	On-Demand	Anodyne	HSD17B2	17	40
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)N[C@@H](C1CCC1)C1CC1	ZINC000875402018	FF	On-Demand	Anodyne	ROCK1	24	40
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)N[C@@H](C1CCC1)C1CC1	ZINC000875402018	FF	On-Demand	Anodyne	ROCK2	16	40
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)N[C@H](C1CCC1)C1CC1	ZINC000875402019	FF	On-Demand	Anodyne	ROCK1	24	40
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)N[C@H](C1CCC1)C1CC1	ZINC000875402019	FF	On-Demand	Anodyne	ROCK2	16	40
C[C@H]1CCc2c(sc3ncn(C[C@@H](O)c4ccc(F)cc4)c(=O)c23)C1	ZINC000875402030	FG	On-Demand	Anodyne	HTR1B	19	40
C=CCC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccccc1	ZINC000875402051	EG	On-Demand	Mild	SLC6A4	24	41
C=CCC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccccc1	ZINC000875402051	EG	On-Demand	Mild	SLC6A3	55	42
C=CCC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccccc1	ZINC000875402052	EG	On-Demand	Mild	SLC6A4	24	41
C=CCC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccccc1	ZINC000875402052	EG	On-Demand	Mild	SLC6A3	55	42
C=CCC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccccc1	ZINC000875402053	EG	On-Demand	Mild	SLC6A4	24	41
C=CCC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccccc1	ZINC000875402053	EG	On-Demand	Mild	SLC6A3	55	42
C=CCC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccccc1	ZINC000875402054	EG	On-Demand	Mild	SLC6A4	24	41
C=CCC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccccc1	ZINC000875402054	EG	On-Demand	Mild	SLC6A3	55	42
CC(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1	ZINC000875402061	EC	On-Demand	Reactive	EPHX2	19	43
CC(=O)c1ccc(NC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1	ZINC000875402063	EC	On-Demand	Reactive	EPHX2	19	43
C[C@H]1C[C@H](NC(=O)OC(C)(C)C)CN1C(=O)NCCCc1ccccn1	ZINC000875402072	FF	On-Demand	Anodyne	INHA	49	38
C[C@@H]1C[C@H](NC(=O)OC(C)(C)C)CN1C(=O)NCCCc1ccccn1	ZINC000875402074	FF	On-Demand	Anodyne	INHA	49	38
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2[C@H]3CCc4ccccc4[C@H]32)CC1	ZINC000875402075	ED	On-Demand	Anodyne	EPHX2	17	43
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2[C@H]3CCc4ccccc4[C@@H]32)CC1	ZINC000875402076	ED	On-Demand	Anodyne	EPHX2	17	43
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2[C@@H]3CCc4ccccc4[C@@H]32)CC1	ZINC000875402077	ED	On-Demand	Anodyne	EPHX2	17	43
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2[C@@H]3c4ccccc4CC[C@H]32)CC1	ZINC000875402078	ED	On-Demand	Anodyne	EPHX2	17	43
COC(=O)Cc1ccccc1NC(=O)c1c(C(F)(F)F)coc1C	ZINC000875402093	EH	On-Demand	Anodyne	KCNJ11	46	33
C[C@@H]1[C@@H](NC(=O)NCCCc2ccccn2)CCN1C(=O)OC(C)(C)C	ZINC000875402099	FF	On-Demand	Anodyne	GPR119	17	40
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCc1cnc(C)cn1)CC2	ZINC000875402103	GD	On-Demand	Anodyne	SLC18A2	45	34
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCc1cnc(C)cn1)CC2	ZINC000875402105	GD	On-Demand	Anodyne	SLC18A2	45	34
O=C(NCCOCC1CCCC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875402119	CD	On-Demand	Anodyne	SPHK1	15	42
O=C(NCCOCC1CCCC1)C(=O)N[C@H]1CC12CCC2	ZINC000875402120	CD	On-Demand	Anodyne	SPHK1	15	42
O=C(NCCCc1ccccn1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875402125	EF	On-Demand	Anodyne	EPHX2	16	53
O=C(NCCCc1ccccn1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875402126	EF	On-Demand	Anodyne	EPHX2	16	53
Cn1cnc(CCNC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)c1	ZINC000875402198	FD	On-Demand	Anodyne	OXTR	30	44
Cc1ncc(CCNC(=O)N(Cc2cccc(O)c2)[C@@H]2CC[C@@H](O)CC2)s1	ZINC000875402200	GG	On-Demand	Anodyne	HSD17B2	19	40
Cn1cnc(CCNC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)c1	ZINC000875402201	FD	On-Demand	Anodyne	OXTR	30	44
CCNC(=O)C(C)(C)CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875402276	FF	On-Demand	Mild	CTSF	42	32
CCNC(=O)C(C)(C)CNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875402277	FF	On-Demand	Mild	CTSF	42	32
CC(C)CN1CCC[C@@H](CNC(=O)N2CCC(c3nnnn3C)CC2)C1	ZINC000875402278	FD	On-Demand	Anodyne	CCR3	40	35
CC(C)CN1CCC[C@H](CNC(=O)N2CCC(c3nnnn3C)CC2)C1	ZINC000875402279	FD	On-Demand	Anodyne	CCR3	40	35
C=CCC[C@@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccccc1	ZINC000875402292	FG	On-Demand	Mild	UTS2	66	37
C=CCC[C@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccccc1	ZINC000875402293	FG	On-Demand	Mild	UTS2	66	37
C=CCC[C@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875402307	EH	On-Demand	Mild	AMY2	43	30
C=CCC[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875402308	EH	On-Demand	Mild	AMY2	43	30
C=CCC[C@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875402309	EH	On-Demand	Mild	AMY2	43	30
C=CCC[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875402310	EH	On-Demand	Mild	AMY2	43	30
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)cc1	ZINC000875402317	GH	On-Demand	Reactive	LTA4H	31	40
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)cc1	ZINC000875402317	GH	On-Demand	Reactive	CA1	20	41
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)cc1	ZINC000875402317	GH	On-Demand	Reactive	PRNP	31	42
Cc1nnc(NNC(=O)NCC2(Cc3ccccc3)CC2)n1C	ZINC000875402334	DD	On-Demand	Reactive	NPFFR2	22	41
Cc1nnc(NNC(=O)NCC2(Cc3ccccc3)CC2)n1C	ZINC000875402334	DD	On-Demand	Reactive	NPFFR1	31	41
CN1CC[C@H]2CN(C(=O)NCCNS(=O)(=O)c3cccnc3)CC[C@H]21	ZINC000875402350	FC	On-Demand	Anodyne	CHRNA7	40	33
CN1CC[C@H]2CN(C(=O)NCCNS(=O)(=O)c3cccnc3)CC[C@H]21	ZINC000875402350	FC	On-Demand	Anodyne	NAMPT	72	37
CN1CC[C@H]2CN(C(=O)NCCNS(=O)(=O)c3cccnc3)CC[C@@H]21	ZINC000875402353	FC	On-Demand	Anodyne	CHRNA7	40	33
CN1CC[C@H]2CN(C(=O)NCCNS(=O)(=O)c3cccnc3)CC[C@@H]21	ZINC000875402353	FC	On-Demand	Anodyne	NAMPT	72	37
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCc1cn(C)cn1)CC2	ZINC000875402416	GD	On-Demand	Anodyne	SLC18A2	45	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCc1cn(C)cn1)CC2	ZINC000875402417	GD	On-Demand	Anodyne	SLC18A2	45	34
O=C(N[C@@H]1CCCN(CC(F)(F)F)C1=O)N1Cc2cccc(O)c2C1	ZINC000875402450	FD	On-Demand	Clean	CALCRL	26	43
O=C(N[C@H]1CCCN(CC(F)(F)F)C1=O)N1Cc2cccc(O)c2C1	ZINC000875402451	FD	On-Demand	Clean	CALCRL	26	43
CCCCCCCNC(=O)C(=O)NC[C@H]1CC[C@@H](C)O1	ZINC000875402613	CD	On-Demand	Mild	ASAH1	49	32
CCCCCCCNC(=O)C(=O)NC[C@@H]1CC[C@@H](C)O1	ZINC000875402614	CD	On-Demand	Mild	ASAH1	49	32
CCCCCCCNC(=O)C(=O)NC[C@H]1CC[C@H](C)O1	ZINC000875402615	CD	On-Demand	Mild	ASAH1	49	32
CCCCCCCNC(=O)C(=O)NC[C@@H]1CC[C@H](C)O1	ZINC000875402616	CD	On-Demand	Mild	ASAH1	49	32
C=CCC[C@@H](NC(=O)N(C)OCC(F)(F)F)c1ccccc1	ZINC000875402629	DH	On-Demand	Mild	UTS2	53	35
C=CCC[C@H](NC(=O)N(C)OCC(F)(F)F)c1ccccc1	ZINC000875402630	DH	On-Demand	Mild	UTS2	53	35
C[C@H](NC(=O)C(=O)NCCCCN(C)C1CC1)c1ccc(C(F)(F)F)nc1	ZINC000875402667	GE	On-Demand	Anodyne	TRPV1	50	32
O=C(NCCNS(=O)(=O)c1cccnc1)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875402678	FC	On-Demand	Anodyne	TBXAS1	45	40
O=C(NCCNS(=O)(=O)c1cccnc1)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875402678	FC	On-Demand	Anodyne	NAMPT	74	37
N#CCc1ccsc1C(=O)N[C@H](CC(N)=O)C1CCCCC1	ZINC000875402691	DE	On-Demand	Mild	LGMN	44	32
N#CCc1ccsc1C(=O)N[C@@H](CC(N)=O)C1CCCCC1	ZINC000875402692	DE	On-Demand	Mild	LGMN	44	32
CCNC(=O)C(C)(C)CNC(=O)N(CC)[C@H](C)[C@@H](O)c1ccccc1	ZINC000875402718	EE	On-Demand	Anodyne	NPY5R	22	42
CCNC(=O)C(C)(C)CNC(=O)N(CC)[C@@H](C)[C@@H](O)c1ccccc1	ZINC000875402719	EE	On-Demand	Anodyne	NPY5R	22	42
CCNC(=O)C(C)(C)CNC(=O)N(CC)[C@@H](C)[C@H](O)c1ccccc1	ZINC000875402720	EE	On-Demand	Anodyne	NPY5R	22	42
CCNC(=O)C(C)(C)CNC(=O)N(CC)[C@H](C)[C@H](O)c1ccccc1	ZINC000875402721	EE	On-Demand	Anodyne	NPY5R	22	42
O=C1CCN(C(=O)N[C@@H]2CCCN(CC(F)(F)F)C2=O)CCCCCCN1	ZINC000875402731	GD	On-Demand	Anodyne	CALCRL	16	43
O=C1CCN(C(=O)N[C@H]2CCCN(CC(F)(F)F)C2=O)CCCCCCN1	ZINC000875402732	GD	On-Demand	Anodyne	CALCRL	16	43
CC(C)CN1CCC[C@@H](CNC(=O)N2CCO[C@@H](c3noc(C4CC4)n3)C2)C1	ZINC000875402757	GE	On-Demand	Anodyne	SMO	29	43
CC(C)CN1CCC[C@H](CNC(=O)N2CCO[C@@H](c3noc(C4CC4)n3)C2)C1	ZINC000875402758	GE	On-Demand	Anodyne	SMO	29	43
CC(C)CN1CCC[C@@H](CNC(=O)N2CCO[C@H](c3noc(C4CC4)n3)C2)C1	ZINC000875402759	GE	On-Demand	Anodyne	SMO	29	43
CC(C)CN1CCC[C@H](CNC(=O)N2CCO[C@H](c3noc(C4CC4)n3)C2)C1	ZINC000875402760	GE	On-Demand	Anodyne	SMO	29	43
C=CCC[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875402883	DG	On-Demand	Mild	CYP2J2	45	34
C=CCC[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875402884	DG	On-Demand	Mild	CYP2J2	45	34
C=CCC[C@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875402886	DG	On-Demand	Mild	CYP2J2	45	34
C=CCC[C@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875402888	DG	On-Demand	Mild	CYP2J2	45	34
Cc1nnc(NNC(=O)NCCCc2ccccn2)n1C	ZINC000875402894	CC	On-Demand	Reactive	HRH2	20	43
O=C(NCCCc1ccccn1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875402942	FG	On-Demand	Anodyne	F2	16	42
O=C(NCCCc1ccccn1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875402942	FG	On-Demand	Anodyne	FKBP1A	30	47
O=C(NCCCc1ccccn1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875402944	FG	On-Demand	Anodyne	F2	16	42
O=C(NCCCc1ccccn1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875402944	FG	On-Demand	Anodyne	FKBP1A	30	47
O=C(NCCCc1ccccn1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875402946	FG	On-Demand	Anodyne	F2	16	42
O=C(NCCCc1ccccn1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875402946	FG	On-Demand	Anodyne	FKBP1A	30	47
O=C(NCCCc1ccccn1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875402948	FG	On-Demand	Anodyne	F2	16	42
O=C(NCCCc1ccccn1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875402948	FG	On-Demand	Anodyne	FKBP1A	30	47
CCNC(=O)C(C)(C)CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875402995	FE	On-Demand	Anodyne	FKBP1A	45	47
CCNC(=O)C(C)(C)CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875402996	FE	On-Demand	Anodyne	FKBP1A	45	47
CCNC(=O)C(C)(C)CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875402997	FE	On-Demand	Anodyne	FKBP1A	45	47
CCNC(=O)C(C)(C)CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875402998	FE	On-Demand	Anodyne	FKBP1A	45	47
CCO[C@@H](C(=O)N(CC)c1ccccc1S(=O)(=O)CC)C1CCCC1	ZINC000875403031	FG	On-Demand	Anodyne	AMY2	48	34
CCO[C@H](C(=O)N(CC)c1ccccc1S(=O)(=O)CC)C1CCCC1	ZINC000875403032	FG	On-Demand	Anodyne	AMY2	48	34
CC(C)CN1CCC[C@@H](CNC(=O)N2CC3(CC(=O)N3Cc3ccccc3)C2)C1	ZINC000875403063	GF	On-Demand	Anodyne	CCR3	33	40
CC(C)CN1CCC[C@H](CNC(=O)N2CC3(CC(=O)N3Cc3ccccc3)C2)C1	ZINC000875403064	GF	On-Demand	Anodyne	CCR3	33	40
CC(C)(C)OC(=O)N1CCO[C@@H](CNC(=O)C(=O)NCCCCC2CC2)C1	ZINC000875403134	GD	On-Demand	Anodyne	GPR119	16	40
CC(C)(C)OC(=O)N1CCO[C@H](CNC(=O)C(=O)NCCCCC2CC2)C1	ZINC000875403135	GD	On-Demand	Anodyne	GPR119	16	40
O=C(NC[C@H]1C[C@H](O)C1)NCC1(Cc2ccccc2)CC1	ZINC000875403148	CE	On-Demand	Anodyne	NPFFR2	17	41
O=C(NC[C@H]1C[C@H](O)C1)NCC1(Cc2ccccc2)CC1	ZINC000875403148	CE	On-Demand	Anodyne	EPHX2	16	44
O=C(NC[C@H]1C[C@H](O)C1)NCC1(Cc2ccccc2)CC1	ZINC000875403148	CE	On-Demand	Anodyne	NPFFR1	21	41
COc1cccc([C@H](CNC(=O)c2ccc(C(=O)O)s2)N2CCCC2)c1	ZINC000875403165	FG	On-Demand	Anodyne	DRD4	47	37
COc1cccc([C@H](CNC(=O)c2ccc(C(=O)O)s2)N2CCCC2)c1	ZINC000875403165	FG	On-Demand	Anodyne	KCNQ2	24	43
COc1cccc([C@H](CNC(=O)c2ccc(C(=O)O)s2)N2CCCC2)c1	ZINC000875403165	FG	On-Demand	Anodyne	MTNR1A	40	39
COc1cccc([C@H](CNC(=O)c2ccc(C(=O)O)s2)N2CCCC2)c1	ZINC000875403165	FG	On-Demand	Anodyne	MTNR1B	45	39
C[C@]1(C(F)(F)F)CCN(C(=O)NCCNS(=O)(=O)c2cccnc2)C1	ZINC000875403184	GD	On-Demand	Anodyne	SFRP1	94	38
C[C@]1(C(F)(F)F)CCN(C(=O)NCCNS(=O)(=O)c2cccnc2)C1	ZINC000875403184	GD	On-Demand	Anodyne	WNT3	69	35
C[C@]1(C(F)(F)F)CCN(C(=O)NCCNS(=O)(=O)c2cccnc2)C1	ZINC000875403184	GD	On-Demand	Anodyne	NAMPT	49	38
O=CN1CCCN(C(=O)NCC2(Cc3ccccc3)CC2)CC1	ZINC000875403185	DD	On-Demand	Anodyne	NPFFR2	18	44
O=CN1CCCN(C(=O)NCC2(Cc3ccccc3)CC2)CC1	ZINC000875403185	DD	On-Demand	Anodyne	NPFFR1	25	44
O=CN1CCCN(C(=O)NCC2(Cc3ccccc3)CC2)CC1	ZINC000875403185	DD	On-Demand	Anodyne	SLC12A5	43	34
O=C(N[C@H]1[C@@H]2c3ccccc3CC[C@H]21)N1CCC(CO)(CO)CC1	ZINC000875403211	ED	On-Demand	Anodyne	EPHX2	20	48
O=C(N[C@@H]1[C@H]2CCc3ccccc3[C@H]21)N1CCC(CO)(CO)CC1	ZINC000875403212	ED	On-Demand	Anodyne	EPHX2	20	48
O=C(N[C@@H]1[C@@H]2CCc3ccccc3[C@@H]21)N1CCC(CO)(CO)CC1	ZINC000875403213	ED	On-Demand	Anodyne	EPHX2	20	48
O=C(N[C@@H]1[C@H]2CCc3ccccc3[C@@H]21)N1CCC(CO)(CO)CC1	ZINC000875403214	ED	On-Demand	Anodyne	EPHX2	20	48
Cc1ncc(CCNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)s1	ZINC000875403215	EF	On-Demand	Anodyne	PREP	43	34
Cc1ncc(CCNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)s1	ZINC000875403216	EF	On-Demand	Anodyne	PREP	43	34
Cc1ncc(CCNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)s1	ZINC000875403217	EF	On-Demand	Anodyne	PREP	43	34
Cc1ncc(CCNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)s1	ZINC000875403218	EF	On-Demand	Anodyne	PREP	43	34
O=C(N[C@@H]1CCCN(CC(F)(F)F)C1=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875403267	EE	On-Demand	Anodyne	CALCRL	16	43
O=C(N[C@H]1CCCN(CC(F)(F)F)C1=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875403268	EE	On-Demand	Anodyne	CALCRL	16	43
Cc1csc([C@H]2CCN(C(=O)N[C@H]3CCCN(CC(F)(F)F)C3=O)C2)n1	ZINC000875403280	GF	On-Demand	Anodyne	CALCRL	19	45
Cc1csc([C@H]2CCN(C(=O)N[C@H]3CCCN(CC(F)(F)F)C3=O)C2)n1	ZINC000875403280	GF	On-Demand	Anodyne	ETHR	42	38
CONC(=O)C1CCN(C(=O)N[C@H]2[C@@H]3c4ccccc4CC[C@H]32)CC1	ZINC000875403292	ED	On-Demand	Anodyne	EPHX2	18	40
CONC(=O)C1CCN(C(=O)N[C@@H]2[C@H]3CCc4ccccc4[C@H]32)CC1	ZINC000875403294	ED	On-Demand	Anodyne	EPHX2	18	40
CONC(=O)C1CCN(C(=O)N[C@@H]2[C@@H]3CCc4ccccc4[C@@H]32)CC1	ZINC000875403297	ED	On-Demand	Anodyne	EPHX2	18	40
O=C(N[C@@H]1CCCN(CC(F)(F)F)C1=O)N1CCC(CO)(CO)CC1	ZINC000875403298	FC	On-Demand	Anodyne	CALCRL	29	46
CONC(=O)C1CCN(C(=O)N[C@@H]2[C@H]3CCc4ccccc4[C@@H]32)CC1	ZINC000875403299	ED	On-Demand	Anodyne	EPHX2	18	40
O=C(N[C@H]1CCCN(CC(F)(F)F)C1=O)N1CCC(CO)(CO)CC1	ZINC000875403300	FC	On-Demand	Anodyne	CALCRL	29	46
O=C(N[C@H]1CCCN(CC(F)(F)F)C1=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875403302	GF	On-Demand	Anodyne	CALCRL	20	41
O=C(N[C@H]1CCCN(CC(F)(F)F)C1=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875403309	GF	On-Demand	Anodyne	CALCRL	20	41
O=C(N[C@@H]1CCCN(CC(F)(F)F)C1=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875403311	GF	On-Demand	Anodyne	CALCRL	20	41
O=C(N[C@@H]1CCCN(CC(F)(F)F)C1=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875403313	GF	On-Demand	Anodyne	CALCRL	20	41
O=C(N[C@@H]1CCCN(CC(F)(F)F)C1=O)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875403362	GC	On-Demand	Anodyne	CALCRL	16	42
O=C(N[C@@H]1CCCN(CC(F)(F)F)C1=O)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875403363	GC	On-Demand	Anodyne	CALCRL	16	42
O=C(N[C@@H]1CCCN(CC(F)(F)F)C1=O)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875403364	GC	On-Demand	Anodyne	CALCRL	16	42
O=C(N[C@@H]1CCCN(CC(F)(F)F)C1=O)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875403365	GC	On-Demand	Anodyne	CALCRL	16	42
C=CCC[C@H](NC(=O)N(CCOC)C1CCOCC1)c1ccccc1	ZINC000875403391	EH	On-Demand	Mild	UTS2	49	34
C=CCC[C@@H](NC(=O)N(CCOC)C1CCOCC1)c1ccccc1	ZINC000875403392	EH	On-Demand	Mild	UTS2	49	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCc1ccc(C)cn1)CC2	ZINC000875403422	GE	On-Demand	Anodyne	SLC18A2	44	33
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCc1ccc(C)cn1)CC2	ZINC000875403423	GE	On-Demand	Anodyne	SLC18A2	44	33
O=C(NCCO)C1CCN(C(=O)NCC2(Cc3ccccc3)CC2)CC1	ZINC000875403447	FD	On-Demand	Anodyne	NPFFR2	16	41
O=C(NCCO)C1CCN(C(=O)NCC2(Cc3ccccc3)CC2)CC1	ZINC000875403447	FD	On-Demand	Anodyne	CACNA1G	36	42
O=C(NCCO)C1CCN(C(=O)NCC2(Cc3ccccc3)CC2)CC1	ZINC000875403447	FD	On-Demand	Anodyne	NPFFR1	21	41
COC(=O)C1(O)CN(C(=O)NCC2(Cc3ccccc3)CC2)C1	ZINC000875403469	DC	On-Demand	Anodyne	NPFFR2	20	41
COC(=O)C1(O)CN(C(=O)NCC2(Cc3ccccc3)CC2)C1	ZINC000875403469	DC	On-Demand	Anodyne	NPFFR1	27	41
COC(=O)C1(O)CN(C(=O)NCC2(Cc3ccccc3)CC2)C1	ZINC000875403469	DC	On-Demand	Anodyne	SLC12A5	69	41
COc1cccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N2CCCC2)c1	ZINC000875403472	IG	On-Demand	Anodyne	ACE	25	43
COc1cccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N2CCCC2)c1	ZINC000875403472	IG	On-Demand	Anodyne	FKBP1A	40	35
COc1cccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N2CCCC2)c1	ZINC000875403472	IG	On-Demand	Anodyne	DRD4	40	32
COc1cccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N2CCCC2)c1	ZINC000875403472	IG	On-Demand	Anodyne	OPRD1	24	40
COc1cccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N2CCCC2)c1	ZINC000875403472	IG	On-Demand	Anodyne	CELA1	20	45
COc1cccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N2CCCC2)c1	ZINC000875403472	IG	On-Demand	Anodyne	ELANE	31	40
COc1cccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N2CCCC2)c1	ZINC000875403472	IG	On-Demand	Anodyne	TACR1	17	49
COc1cccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N2CCCC2)c1	ZINC000875403472	IG	On-Demand	Anodyne	CTSD	17	40
COc1cccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N2CCCC2)c1	ZINC000875403472	IG	On-Demand	Anodyne	CASP3	17	43
COc1cccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N2CCCC2)c1	ZINC000875403472	IG	On-Demand	Anodyne	BMP1	18	41
COc1cccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N2CCCC2)c1	ZINC000875403472	IG	On-Demand	Anodyne	KCNQ2	19	41
COc1cccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N2CCCC2)c1	ZINC000875403472	IG	On-Demand	Anodyne	KLK3	78	37
COc1cccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N2CCCC2)c1	ZINC000875403472	IG	On-Demand	Anodyne	CTSB	75	47
COc1cccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N2CCCC2)c1	ZINC000875403472	IG	On-Demand	Anodyne	PAPA1_CARPA	75	38
COc1cccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N2CCCC2)c1	ZINC000875403472	IG	On-Demand	Anodyne	CYSP_TRYCR	53	40
COc1cccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N2CCCC2)c1	ZINC000875403472	IG	On-Demand	Anodyne	CTSK	48	47
COc1cccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N2CCCC2)c1	ZINC000875403472	IG	On-Demand	Anodyne	CTSL	62	41
COc1cccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N2CCCC2)c1	ZINC000875403472	IG	On-Demand	Anodyne	CAPNS1	64	37
COc1cccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N2CCCC2)c1	ZINC000875403472	IG	On-Demand	Anodyne	CTSS	38	42
COc1cccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N2CCCC2)c1	ZINC000875403472	IG	On-Demand	Anodyne	CAPN1	85	47
COc1cccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N2CCCC2)c1	ZINC000875403472	IG	On-Demand	Anodyne	CTRC	16	43
COc1cccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N2CCCC2)c1	ZINC000875403472	IG	On-Demand	Anodyne	CAPN2	135	47
COc1cccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N2CCCC2)c1	ZINC000875403472	IG	On-Demand	Anodyne	NPR	77	37
COc1cccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N2CCCC2)c1	ZINC000875403472	IG	On-Demand	Anodyne	PSMB5	46	41
COc1cccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N2CCCC2)c1	ZINC000875403472	IG	On-Demand	Anodyne	PSMB8	45	33
COc1cccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N2CCCC2)c1	ZINC000875403472	IG	On-Demand	Anodyne	Q6PRC7_IXORI	45	40
CN1CCN(C(=O)N[C@@H]2CCCN(CC(F)(F)F)C2=O)Cc2cccnc21	ZINC000875403495	GD	On-Demand	Anodyne	CALCRL	40	42
CN1CCN(C(=O)N[C@H]2CCCN(CC(F)(F)F)C2=O)Cc2cccnc21	ZINC000875403496	GD	On-Demand	Anodyne	CALCRL	40	42
CC(C)CN1CCC[C@@H](CNC(=O)N(C)CCc2cccc(C#N)c2)C1	ZINC000875403503	FG	On-Demand	Mild	CCR3	32	43
CC(C)CN1CCC[C@@H](CNC(=O)N(C)CCc2cccc(C#N)c2)C1	ZINC000875403503	FG	On-Demand	Mild	MCHR1	36	40
CC(C)CN1CCC[C@H](CNC(=O)N(C)CCc2cccc(C#N)c2)C1	ZINC000875403504	FG	On-Demand	Mild	CCR3	32	43
CC(C)CN1CCC[C@H](CNC(=O)N(C)CCc2cccc(C#N)c2)C1	ZINC000875403504	FG	On-Demand	Mild	MCHR1	36	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCCN(CC(F)(F)F)C2=O)C1	ZINC000875403505	ED	On-Demand	Anodyne	CALCRL	18	43
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCCN(CC(F)(F)F)C2=O)C1	ZINC000875403506	ED	On-Demand	Anodyne	CALCRL	18	43
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCCN(CC(F)(F)F)C2=O)C1	ZINC000875403507	ED	On-Demand	Anodyne	CALCRL	18	43
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(CC(F)(F)F)C2=O)C1	ZINC000875403508	ED	On-Demand	Anodyne	CALCRL	18	43
O=C(NCc1nc(-c2ccncc2)cs1)N[C@@H]1[C@H]2CCc3ccccc3[C@@H]21	ZINC000875403605	GH	On-Demand	Anodyne	ROCK1	22	43
O=C(NCc1nc(-c2ccncc2)cs1)N[C@@H]1[C@H]2CCc3ccccc3[C@@H]21	ZINC000875403605	GH	On-Demand	Anodyne	ROCK2	15	43
O=C(NCc1nc(-c2ccncc2)cs1)N[C@@H]1[C@@H]2CCc3ccccc3[C@@H]21	ZINC000875403606	GH	On-Demand	Anodyne	ROCK1	22	43
O=C(NCc1nc(-c2ccncc2)cs1)N[C@@H]1[C@@H]2CCc3ccccc3[C@@H]21	ZINC000875403606	GH	On-Demand	Anodyne	ROCK2	15	43
O=C(NCc1nc(-c2ccncc2)cs1)N[C@H]1[C@@H]2c3ccccc3CC[C@H]21	ZINC000875403607	GH	On-Demand	Anodyne	ROCK1	22	43
O=C(NCc1nc(-c2ccncc2)cs1)N[C@H]1[C@@H]2c3ccccc3CC[C@H]21	ZINC000875403607	GH	On-Demand	Anodyne	ROCK2	15	43
O=C(NCc1nc(-c2ccncc2)cs1)N[C@@H]1[C@H]2CCc3ccccc3[C@H]21	ZINC000875403608	GH	On-Demand	Anodyne	ROCK1	22	43
O=C(NCc1nc(-c2ccncc2)cs1)N[C@@H]1[C@H]2CCc3ccccc3[C@H]21	ZINC000875403608	GH	On-Demand	Anodyne	ROCK2	15	43
C[C@H](NC(=O)C(=O)NCCOCC1CCCC1)c1ccc(C(F)(F)F)nc1	ZINC000875403665	GF	On-Demand	Anodyne	TRPV1	49	40
CN1CCN(C2CCN(C(=O)C(=O)N[C@H](C3CCC3)C3CC3)CC2)CC1	ZINC000875403713	FC	On-Demand	Anodyne	L3MBTL3	49	41
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H](C3CCC3)C3CC3)CC2)CC1	ZINC000875403714	FC	On-Demand	Anodyne	L3MBTL3	49	41
C=CCC[C@@H](NC(=O)NN(C)C(=O)OC)c1ccccc1	ZINC000875403735	CF	On-Demand	Reactive	UTS2	71	39
C=CCC[C@H](NC(=O)NN(C)C(=O)OC)c1ccccc1	ZINC000875403736	CF	On-Demand	Reactive	UTS2	71	39
C[C@H]1CC[C@H](CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)O1	ZINC000875403738	GE	On-Demand	Anodyne	DRD2	28	45
C[C@H]1CC[C@H](CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)O1	ZINC000875403738	GE	On-Demand	Anodyne	DRD4	52	45
C[C@H]1CC[C@H](CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)O1	ZINC000875403738	GE	On-Demand	Anodyne	ACHE	62	59
C[C@H]1CC[C@H](CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)O1	ZINC000875403738	GE	On-Demand	Anodyne	DRD3	23	42
C[C@H]1CC[C@H](CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)O1	ZINC000875403738	GE	On-Demand	Anodyne	SLC6A3	16	47
C[C@H]1CC[C@H](CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)O1	ZINC000875403738	GE	On-Demand	Anodyne	HTR4	31	41
C[C@H]1CC[C@H](CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)O1	ZINC000875403738	GE	On-Demand	Anodyne	SIGMAR1	60	43
C[C@H]1CC[C@H](CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)O1	ZINC000875403738	GE	On-Demand	Anodyne	BCHE	17	52
C[C@H]1CC[C@H](CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)O1	ZINC000875403738	GE	On-Demand	Anodyne	CACNA1I	50	38
C[C@H]1CC[C@@H](CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)O1	ZINC000875403739	GE	On-Demand	Anodyne	DRD2	28	45
C[C@H]1CC[C@@H](CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)O1	ZINC000875403739	GE	On-Demand	Anodyne	DRD4	52	45
C[C@H]1CC[C@@H](CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)O1	ZINC000875403739	GE	On-Demand	Anodyne	ACHE	62	59
C[C@H]1CC[C@@H](CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)O1	ZINC000875403739	GE	On-Demand	Anodyne	DRD3	23	42
C[C@H]1CC[C@@H](CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)O1	ZINC000875403739	GE	On-Demand	Anodyne	SLC6A3	16	47
C[C@H]1CC[C@@H](CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)O1	ZINC000875403739	GE	On-Demand	Anodyne	HTR4	31	41
C[C@H]1CC[C@@H](CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)O1	ZINC000875403739	GE	On-Demand	Anodyne	SIGMAR1	60	43
C[C@H]1CC[C@@H](CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)O1	ZINC000875403739	GE	On-Demand	Anodyne	BCHE	17	52
C[C@H]1CC[C@@H](CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)O1	ZINC000875403739	GE	On-Demand	Anodyne	CACNA1I	50	38
Cc1cnc(CCNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)cn1	ZINC000875403761	FD	On-Demand	Anodyne	SIRT3	50	31
Cc1cnc(CCNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)cn1	ZINC000875403761	FD	On-Demand	Anodyne	SIRT2	52	33
Cc1cnc(CCNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)cn1	ZINC000875403761	FD	On-Demand	Anodyne	SIRT1	50	33
Cc1ncc(CCNC(=O)N2CC(c3ccccc3)C2)s1	ZINC000875403852	DF	On-Demand	Anodyne	MGEA5	33	41
CCNC(=O)C(C)(C)CNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875403872	GG	On-Demand	Anodyne	RBP4	34	41
CN1CCN(C2CCN(C(=O)N[C@H]3[C@@H]4c5ccccc5CC[C@H]43)CC2)CC1	ZINC000875403873	FE	On-Demand	Anodyne	EPHX2	16	49
CN1CCN(C2CCN(C(=O)N[C@H]3[C@@H]4c5ccccc5CC[C@H]43)CC2)CC1	ZINC000875403873	FE	On-Demand	Anodyne	L3MBTL3	68	40
CCNC(=O)C(C)(C)CNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875403874	GG	On-Demand	Anodyne	RBP4	34	41
CN1CCN(C2CCN(C(=O)N[C@@H]3[C@H]4CCc5ccccc5[C@@H]43)CC2)CC1	ZINC000875403878	FE	On-Demand	Anodyne	EPHX2	16	49
CN1CCN(C2CCN(C(=O)N[C@@H]3[C@H]4CCc5ccccc5[C@@H]43)CC2)CC1	ZINC000875403878	FE	On-Demand	Anodyne	L3MBTL3	68	40
CN1CCN(C2CCN(C(=O)N[C@@H]3[C@H]4CCc5ccccc5[C@H]43)CC2)CC1	ZINC000875403882	FE	On-Demand	Anodyne	EPHX2	16	49
CN1CCN(C2CCN(C(=O)N[C@@H]3[C@H]4CCc5ccccc5[C@H]43)CC2)CC1	ZINC000875403882	FE	On-Demand	Anodyne	L3MBTL3	68	40
CN1CCN(C2CCN(C(=O)N[C@@H]3[C@@H]4CCc5ccccc5[C@@H]43)CC2)CC1	ZINC000875403883	FE	On-Demand	Anodyne	EPHX2	16	49
CN1CCN(C2CCN(C(=O)N[C@@H]3[C@@H]4CCc5ccccc5[C@@H]43)CC2)CC1	ZINC000875403883	FE	On-Demand	Anodyne	L3MBTL3	68	40
CC(=O)N(C)c1ccc(CNC(=O)NC[C@@H]2CCCN(CC(C)C)C2)cc1	ZINC000875403973	FF	On-Demand	Anodyne	CCR3	51	35
CC(=O)N(C)c1ccc(CNC(=O)NC[C@H]2CCCN(CC(C)C)C2)cc1	ZINC000875403974	FF	On-Demand	Anodyne	CCR3	51	35
CCCCCCCNC(=O)C(=O)NCCc1ccc(C)cn1	ZINC000875403981	DE	On-Demand	Mild	ASAH1	86	36
CC[C@H](C[C@H](C)O)NC(=O)NCC1(Cc2ccccc2)CC1	ZINC000875403983	DF	On-Demand	Anodyne	ANPEP	32	42
CC[C@H](C[C@H](C)O)NC(=O)NCC1(Cc2ccccc2)CC1	ZINC000875403983	DF	On-Demand	Anodyne	CAPN2	57	32
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2C)cc1	ZINC000875404007	DF	On-Demand	Reactive	AVPR2	33	46
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2C)cc1	ZINC000875404007	DF	On-Demand	Reactive	AVPR1A	20	44
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2C)cc1	ZINC000875404007	DF	On-Demand	Reactive	CA1	28	45
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2C)cc1	ZINC000875404007	DF	On-Demand	Reactive	PRNP	37	49
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2C)cc1	ZINC000875404007	DF	On-Demand	Reactive	CA12	15	45
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2C)cc1	ZINC000875404007	DF	On-Demand	Reactive	CA9	18	54
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2C)cc1	ZINC000875404007	DF	On-Demand	Reactive	AKR1C3	15	44
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2C)cc1	ZINC000875404007	DF	On-Demand	Reactive	AKR1C2	17	44
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2C)cc1	ZINC000875404007	DF	On-Demand	Reactive	KCNK3	35	46
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccccc2C)cc1	ZINC000875404007	DF	On-Demand	Reactive	KCNK9	27	43
O=C(NCC1(Cc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875404010	ED	On-Demand	Anodyne	NPFFR2	29	50
O=C(NCC1(Cc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875404010	ED	On-Demand	Anodyne	NPFFR1	38	50
O=C(NCC1(Cc2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875404010	ED	On-Demand	Anodyne	SLC12A5	42	34
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2(Cc3ccccc3)CC2)C1	ZINC000875404016	EF	On-Demand	Anodyne	ACE	21	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2(Cc3ccccc3)CC2)C1	ZINC000875404016	EF	On-Demand	Anodyne	CTSK	19	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2(Cc3ccccc3)CC2)C1	ZINC000875404016	EF	On-Demand	Anodyne	NPFFR2	20	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2(Cc3ccccc3)CC2)C1	ZINC000875404016	EF	On-Demand	Anodyne	NPFFR1	25	41
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2(Cc3ccccc3)CC2)C1	ZINC000875404016	EF	On-Demand	Anodyne	SLC12A5	48	34
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2(Cc3ccccc3)CC2)C1	ZINC000875404016	EF	On-Demand	Anodyne	HCN1	55	32
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2(Cc3ccccc3)CC2)C1	ZINC000875404016	EF	On-Demand	Anodyne	HCN4	47	32
O=C(N[C@@H](C1CCC1)C1CC1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875404021	GF	On-Demand	Anodyne	ETHR	55	49
O=C(N[C@H](C1CCC1)C1CC1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875404022	GF	On-Demand	Anodyne	ETHR	55	49
O=C(NCCNS(=O)(=O)c1cccnc1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875404027	FC	On-Demand	Anodyne	NAMPT	72	38
O=C(NCCNS(=O)(=O)c1cccnc1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875404028	FC	On-Demand	Anodyne	NAMPT	72	38
O=C(NCCNS(=O)(=O)c1cccnc1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875404029	FC	On-Demand	Anodyne	NAMPT	72	38
O=C(NCCNS(=O)(=O)c1cccnc1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875404030	FC	On-Demand	Anodyne	NAMPT	72	38
CC(C)CN1CCC[C@@H](CNC(=O)NNC(=O)c2ccc(=O)n(C)c2)C1	ZINC000875404052	FC	On-Demand	Reactive	CCR3	53	36
CC(C)CN1CCC[C@H](CNC(=O)NNC(=O)c2ccc(=O)n(C)c2)C1	ZINC000875404053	FC	On-Demand	Reactive	CCR3	53	36
Cn1nc(Cl)c(C(=O)N[C@@H](CS(C)(=O)=O)c2ccccc2)c1Cl	ZINC000875404064	GE	On-Demand	Anodyne	TACR3	53	44
Cn1nc(Cl)c(C(=O)N[C@H](CS(C)(=O)=O)c2ccccc2)c1Cl	ZINC000875404065	GE	On-Demand	Anodyne	TACR3	53	44
CC(C)CN1CCC[C@@H](CNC(=O)N[C@H](C)c2ccccc2O)C1	ZINC000875404067	EG	On-Demand	Clean	HTR4	42	38
CC(C)CN1CCC[C@@H](CNC(=O)N[C@@H](C)c2ccccc2O)C1	ZINC000875404068	EG	On-Demand	Clean	HTR4	42	38
CC(C)CN1CCC[C@H](CNC(=O)N[C@H](C)c2ccccc2O)C1	ZINC000875404069	EG	On-Demand	Clean	HTR4	42	38
CC(C)CN1CCC[C@H](CNC(=O)N[C@@H](C)c2ccccc2O)C1	ZINC000875404070	EG	On-Demand	Clean	HTR4	42	38
C[C@H]1CC[C@H](CNC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)O1	ZINC000875404089	GD	On-Demand	Anodyne	SMO	33	40
C[C@H]1CC[C@H](CNC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)O1	ZINC000875404089	GD	On-Demand	Anodyne	ETHR	54	47
C[C@H]1CC[C@@H](CNC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)O1	ZINC000875404090	GD	On-Demand	Anodyne	SMO	33	40
C[C@H]1CC[C@@H](CNC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)O1	ZINC000875404090	GD	On-Demand	Anodyne	ETHR	54	47
CCNC(=O)C(C)(C)CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875404095	EE	On-Demand	Anodyne	FKBP1A	40	43
CCNC(=O)C(C)(C)CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875404096	EE	On-Demand	Anodyne	FKBP1A	40	43
CCNC(=O)C(C)(C)CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875404097	EE	On-Demand	Anodyne	FKBP1A	40	43
CCNC(=O)C(C)(C)CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875404098	EE	On-Demand	Anodyne	FKBP1A	40	43
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NC[C@@H]1CC[C@@H](C)O1)CC2	ZINC000875404126	GD	On-Demand	Anodyne	SLC18A2	46	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NC[C@H]1CC[C@H](C)O1)CC2	ZINC000875404127	GD	On-Demand	Anodyne	SLC18A2	46	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NC[C@H]1CC[C@@H](C)O1)CC2	ZINC000875404128	GD	On-Demand	Anodyne	SLC18A2	46	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NC[C@@H]1CC[C@H](C)O1)CC2	ZINC000875404129	GD	On-Demand	Anodyne	SLC18A2	46	34
COc1ccc(N2CCN(C(=O)C(=O)NC[C@H]3CC[C@@H](C)O3)CC2)c(OC)c1	ZINC000875404138	GD	On-Demand	Clean	DRD4	40	32
COc1ccc(N2CCN(C(=O)C(=O)NC[C@H]3CC[C@@H](C)O3)CC2)c(OC)c1	ZINC000875404138	GD	On-Demand	Clean	MTNR1B	20	40
COc1ccc(N2CCN(C(=O)C(=O)NC[C@H]3CC[C@H](C)O3)CC2)c(OC)c1	ZINC000875404139	GD	On-Demand	Clean	DRD4	40	32
COc1ccc(N2CCN(C(=O)C(=O)NC[C@H]3CC[C@H](C)O3)CC2)c(OC)c1	ZINC000875404139	GD	On-Demand	Clean	MTNR1B	20	40
COc1ccc(N2CCN(C(=O)C(=O)NC[C@@H]3CC[C@H](C)O3)CC2)c(OC)c1	ZINC000875404140	GD	On-Demand	Clean	DRD4	40	32
COc1ccc(N2CCN(C(=O)C(=O)NC[C@@H]3CC[C@H](C)O3)CC2)c(OC)c1	ZINC000875404140	GD	On-Demand	Clean	MTNR1B	20	40
COc1ccc(N2CCN(C(=O)C(=O)NC[C@@H]3CC[C@@H](C)O3)CC2)c(OC)c1	ZINC000875404141	GD	On-Demand	Clean	DRD4	40	32
COc1ccc(N2CCN(C(=O)C(=O)NC[C@@H]3CC[C@@H](C)O3)CC2)c(OC)c1	ZINC000875404141	GD	On-Demand	Clean	MTNR1B	20	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1(Cc2ccccc2)CC1	ZINC000875404143	EF	On-Demand	Anodyne	SLC6A4	23	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1(Cc2ccccc2)CC1	ZINC000875404143	EF	On-Demand	Anodyne	SLC6A3	50	42
CCCCCCCNC(=O)C(=O)NCCc1cnc(C)cn1	ZINC000875404185	DD	On-Demand	Mild	ASAH1	86	35
COC(=O)[C@@]12C[C@@H](NC(=O)NCC3(Cc4ccccc4)CC3)C[C@@H]1C2	ZINC000875404205	EF	On-Demand	Anodyne	SLC12A5	65	38
Cn1cnc(CCNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000875404239	GD	On-Demand	Anodyne	DRD2	25	42
Cn1cnc(CCNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000875404239	GD	On-Demand	Anodyne	DRD4	46	44
Cn1cnc(CCNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000875404239	GD	On-Demand	Anodyne	ACHE	64	58
Cn1cnc(CCNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000875404239	GD	On-Demand	Anodyne	DRD3	22	44
Cn1cnc(CCNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000875404239	GD	On-Demand	Anodyne	HTR4	36	43
Cn1cnc(CCNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000875404239	GD	On-Demand	Anodyne	SIGMAR1	54	42
Cn1cnc(CCNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000875404239	GD	On-Demand	Anodyne	BCHE	19	47
Cn1cnc(CCNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000875404239	GD	On-Demand	Anodyne	MCHR1	26	40
Cn1cnc(CCNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000875404239	GD	On-Demand	Anodyne	CACNA1G	28	40
Cn1cnc(CCNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000875404239	GD	On-Demand	Anodyne	SIRT3	40	31
Cn1cnc(CCNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000875404239	GD	On-Demand	Anodyne	SIRT2	45	31
Cn1cnc(CCNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)c1	ZINC000875404239	GD	On-Demand	Anodyne	SIRT1	41	36
Cn1nnnc1C1CCN(C(=O)N[C@@H]2CCCN(CC(F)(F)F)C2=O)CC1	ZINC000875404244	GC	On-Demand	Anodyne	CALCRL	20	43
Cn1nnnc1C1CCN(C(=O)N[C@H]2CCCN(CC(F)(F)F)C2=O)CC1	ZINC000875404245	GC	On-Demand	Anodyne	CALCRL	20	43
CCCCCCCNC(=O)C(=O)NCCc1cn(C)cn1	ZINC000875404281	CD	On-Demand	Mild	CPB2	24	41
CCCCCCCNC(=O)C(=O)NCCc1cn(C)cn1	ZINC000875404281	CD	On-Demand	Mild	ASAH1	101	40
O=C(N[C@@H]1CCCN(CC(F)(F)F)C1=O)N1CCC2(CCNC2=O)CC1	ZINC000875404315	GC	On-Demand	Anodyne	CALCRL	22	65
O=C(N[C@H]1CCCN(CC(F)(F)F)C1=O)N1CCC2(CCNC2=O)CC1	ZINC000875404316	GC	On-Demand	Anodyne	CALCRL	22	65
O=C(N[C@@H]1CCCN(CC(F)(F)F)C1=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875404328	GE	On-Demand	Anodyne	CALCRL	29	44
O=C(N[C@H]1CCCN(CC(F)(F)F)C1=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875404329	GE	On-Demand	Anodyne	CALCRL	29	44
O=C(N[C@@H]1CCCN(CC(F)(F)F)C1=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875404330	GE	On-Demand	Anodyne	CALCRL	29	44
O=C(N[C@H]1CCCN(CC(F)(F)F)C1=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875404331	GE	On-Demand	Anodyne	CALCRL	29	44
COC(=O)N(C)NC(=O)NCC1(Cc2ccccc2)CC1	ZINC000875404418	CD	On-Demand	Reactive	NPFFR2	20	41
COC(=O)N(C)NC(=O)NCC1(Cc2ccccc2)CC1	ZINC000875404418	CD	On-Demand	Reactive	NPFFR1	23	41
O=C(NCC1(Cc2ccccc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875404424	DG	On-Demand	Clean	NPFFR2	15	40
CN1CCN(C(=O)NCCNS(=O)(=O)c2cccnc2)CCC1(C)C	ZINC000875404445	FC	On-Demand	Anodyne	NAMPT	55	39
O=C(N[C@@H]1CCCN(CC(F)(F)F)C1=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875404477	GD	On-Demand	Anodyne	CALCRL	17	42
O=C(N[C@H]1CCCN(CC(F)(F)F)C1=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875404478	GD	On-Demand	Anodyne	CALCRL	17	42
O=C(N[C@H]1CCCN(CC(F)(F)F)C1=O)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875404479	GD	On-Demand	Anodyne	CALCRL	17	42
O=C(N[C@@H]1CCCN(CC(F)(F)F)C1=O)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875404480	GD	On-Demand	Anodyne	CALCRL	17	42
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCCN(CC(F)(F)F)C1=O	ZINC000875404532	ED	On-Demand	Anodyne	RIR1_HHV11	20	43
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCCN(CC(F)(F)F)C1=O	ZINC000875404534	ED	On-Demand	Anodyne	RIR1_HHV11	20	43
CC(=O)C1CCN(C(=O)N[C@@H]2CCCN(CC(F)(F)F)C2=O)CC1	ZINC000875404536	ED	On-Demand	Anodyne	CALCRL	25	44
CC(=O)C1CCN(C(=O)N[C@H]2CCCN(CC(F)(F)F)C2=O)CC1	ZINC000875404537	ED	On-Demand	Anodyne	CALCRL	25	44
CONC(=O)C1CCN(C(=O)N[C@@H]2CCCN(CC(F)(F)F)C2=O)CC1	ZINC000875404540	GC	On-Demand	Anodyne	CALCRL	17	42
CONC(=O)C1CCN(C(=O)N[C@H]2CCCN(CC(F)(F)F)C2=O)CC1	ZINC000875404541	GC	On-Demand	Anodyne	CALCRL	17	42
O=C(N[C@@H]1CCCN(CC(F)(F)F)C1=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875404544	FD	On-Demand	Anodyne	CALCRL	17	42
O=C(N[C@@H]1CCCN(CC(F)(F)F)C1=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875404545	FD	On-Demand	Anodyne	CALCRL	17	42
O=C(N[C@@H]1CCCN(CC(F)(F)F)C1=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875404546	FD	On-Demand	Anodyne	CALCRL	17	42
O=C(N[C@@H]1CCCN(CC(F)(F)F)C1=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875404547	FD	On-Demand	Anodyne	CALCRL	17	42
C[C@@H](CCCc1cccnc1)NC(=O)C(=O)N[C@@H]1C[C@H](C(=O)OC(C)(C)C)C1	ZINC000875404615	GE	On-Demand	Anodyne	PTAFR	37	46
C[C@@H](CCCc1cccnc1)NC(=O)C(=O)NC1CC(C(=O)OC(C)(C)C)C1	ZINC000875404619	GE	On-Demand	Anodyne	PTAFR	37	46
C[C@@H](CCCc1cccnc1)NC(=O)C(=O)N[C@@H]1C[C@@H](C(=O)OC(C)(C)C)C1	ZINC000875404620	GE	On-Demand	Anodyne	PTAFR	37	46
O=C(NCc1ccc(Sc2ccccc2)cc1)N1CCC(CO)(CO)CC1	ZINC000875404622	GG	On-Demand	Anodyne	NAMPT	24	45
CC[C@@H](NC(=O)NCc1ccc(OC)c(C#N)c1)[C@H](O)c1ccccc1	ZINC000875404624	FF	On-Demand	Mild	CASR	33	41
CC[C@@H](NC(=O)NCc1ccc(OC)c(C#N)c1)[C@@H](O)c1ccccc1	ZINC000875404625	FF	On-Demand	Mild	CASR	33	41
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](C)CCCc1cccnc1	ZINC000875404716	ED	On-Demand	Mild	PTAFR	40	52
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](C)CCCc1cccnc1	ZINC000875404717	ED	On-Demand	Mild	PTAFR	40	52
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](C)CCCc1cccnc1	ZINC000875404718	ED	On-Demand	Mild	PTAFR	40	52
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](C)CCCc1cccnc1	ZINC000875404719	ED	On-Demand	Mild	PTAFR	40	52
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)Cc2cc(C)nn2-c2ccccc2)C1	ZINC000875404742	GF	On-Demand	Anodyne	P2RY12	63	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)Cc2cc(C)nn2-c2ccccc2)C1	ZINC000875404743	GF	On-Demand	Anodyne	P2RY12	63	36
C[C@@H](CCCc1cccnc1)NC(=O)C(=O)NCc1cccc2ncccc12	ZINC000875404758	GF	On-Demand	Anodyne	PTAFR	37	47
O=C(NC[C@H]1CCCn2ccnc21)NNc1ccc(OCc2ccccc2)cc1	ZINC000875404792	GH	On-Demand	Reactive	ADAM17	19	41
O=C(NC[C@@H]1CCCn2ccnc21)NNc1ccc(OCc2ccccc2)cc1	ZINC000875404793	GH	On-Demand	Reactive	ADAM17	19	41
C[C@@H](CCCc1cccnc1)NC(=O)C(=O)NCc1ncc(Cl)s1	ZINC000875404824	FE	On-Demand	Anodyne	TBXAS1	24	40
C[C@@H](CCCc1cccnc1)NC(=O)C(=O)NCc1ncc(Cl)s1	ZINC000875404824	FE	On-Demand	Anodyne	PTAFR	36	48
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)nc1C	ZINC000875404843	FD	On-Demand	Anodyne	SIRT3	52	32
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)nc1C	ZINC000875404843	FD	On-Demand	Anodyne	SIRT2	53	33
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)nc1C	ZINC000875404843	FD	On-Demand	Anodyne	SIRT1	52	32
Cc1ccc(CNC(=O)C(=O)N2CCN(c3ccc(F)cc3C#N)CC2)nc1C	ZINC000875404880	GD	On-Demand	Mild	P2RY12	17	42
C[C@@H](CCCc1cccnc1)NC(=O)C(=O)NC[C@H]1c2ccccc2CN1C	ZINC000875404902	GE	On-Demand	Anodyne	PTAFR	38	46
C[C@@H](CCCc1cccnc1)NC(=O)C(=O)NC[C@@H]1c2ccccc2CN1C	ZINC000875404903	GE	On-Demand	Anodyne	PTAFR	38	46
C[C@@H](CCCc1cccnc1)NC(=O)C(=O)NCc1ccc(C(C)(C)C)o1	ZINC000875404994	FG	On-Demand	Anodyne	PTAFR	33	45
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(OC)c(C#N)c1	ZINC000875404998	FE	On-Demand	Mild	ACKR3	63	33
C[C@@H](CCCc1cccnc1)NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875405012	DD	On-Demand	Anodyne	PTAFR	36	47
C[C@@H](CCCc1cccnc1)NC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875405012	DD	On-Demand	Anodyne	C3AR1	40	39
C[C@@H](CCCc1cccnc1)NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875405015	DD	On-Demand	Anodyne	PTAFR	36	47
C[C@@H](CCCc1cccnc1)NC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875405015	DD	On-Demand	Anodyne	C3AR1	40	39
C[C@@H](CCCc1cccnc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875405066	ED	On-Demand	Anodyne	TBXAS1	38	43
C[C@@H](CCCc1cccnc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875405066	ED	On-Demand	Anodyne	PTAFR	46	51
C[C@@H](CCCc1cccnc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875405068	ED	On-Demand	Anodyne	TBXAS1	38	43
C[C@@H](CCCc1cccnc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875405068	ED	On-Demand	Anodyne	PTAFR	46	51
C[C@@H](CCCc1cccnc1)NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1	ZINC000875405110	FE	On-Demand	Anodyne	PTAFR	35	46
C[C@@H](CCCc1cccnc1)NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1	ZINC000875405110	FE	On-Demand	Anodyne	CHRNA7	40	35
C[C@@H](CCCc1cccnc1)NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1	ZINC000875405110	FE	On-Demand	Anodyne	C3AR1	43	45
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2(N3CCOCC3)CCOCC2)C1	ZINC000875405119	GB	On-Demand	Anodyne	HCN1	41	31
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2(N3CCOCC3)CCOCC2)C1	ZINC000875405119	GB	On-Demand	Anodyne	HCN4	41	31
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2(N3CCOCC3)CCOCC2)C1	ZINC000875405120	GB	On-Demand	Anodyne	HCN1	41	31
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2(N3CCOCC3)CCOCC2)C1	ZINC000875405120	GB	On-Demand	Anodyne	HCN4	41	31
CCOC(=O)[C@@H]1CN(C(=O)NCc2ccc(OC)c(C#N)c2)CCC1(F)F	ZINC000875405149	GE	On-Demand	Mild	P2RY12	19	46
CC(=O)c1cccc(OC[C@H](O)CN2C(=O)N[C@H](C)C2=O)c1	ZINC000875405206	DC	On-Demand	Anodyne	ABCB1	29	51
CC(=O)c1cccc(OC[C@@H](O)CN2C(=O)N[C@@H](C)C2=O)c1	ZINC000875405207	DC	On-Demand	Anodyne	ABCB1	29	51
CC(=O)c1cccc(OC[C@H](O)CN2C(=O)N[C@@H](C)C2=O)c1	ZINC000875405208	DC	On-Demand	Anodyne	ABCB1	29	51
CC(=O)c1cccc(OC[C@@H](O)CN2C(=O)N[C@H](C)C2=O)c1	ZINC000875405209	DC	On-Demand	Anodyne	ABCB1	29	51
CCCCCCCNC(=O)C(=O)NCc1ccc(C)c(C)n1	ZINC000875405281	DE	On-Demand	Mild	ASAH1	91	40
C[C@@H](CCCc1cccnc1)NC(=O)C(=O)NCC[C@@H]1CCSC1	ZINC000875405336	EE	On-Demand	Anodyne	PTAFR	37	44
C[C@@H](CCCc1cccnc1)NC(=O)C(=O)NCC[C@H]1CCSC1	ZINC000875405337	EE	On-Demand	Anodyne	PTAFR	37	44
O=C(NCCOc1ncccc1C(F)(F)F)N1Cc2cccc(O)c2C1	ZINC000875405429	FF	On-Demand	Clean	P2RX7	41	38
O=C(NCC[C@H]1C[C@H]2CC[C@H]1O2)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875405438	FE	On-Demand	Anodyne	OXTR	53	36
O=C(NCC[C@H]1C[C@H]2CC[C@H]1O2)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875405439	FE	On-Demand	Anodyne	OXTR	53	36
O=C(NCC[C@@H]1C[C@H]2CC[C@H]1O2)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875405440	FE	On-Demand	Anodyne	OXTR	53	36
O=C(NCC[C@@H]1C[C@H]2CC[C@H]1O2)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875405441	FE	On-Demand	Anodyne	OXTR	53	36
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1cncc(F)c1	ZINC000875405475	DE	On-Demand	Mild	ASAH1	85	36
O=CN1CCCN(C(=O)NCc2ccc(Sc3ccccc3)cc2)CC1	ZINC000875405484	FG	On-Demand	Anodyne	NAMPT	15	42
C[C@@H](CCCc1cccnc1)NC(=O)C(=O)NCc1nn(C)cc1C(F)F	ZINC000875405499	GD	On-Demand	Anodyne	PTAFR	34	44
C[C@@H](CCCc1cccnc1)NC(=O)C(=O)NCCC[C@@H]1C=CCC1	ZINC000875405502	EF	On-Demand	Anodyne	PTAFR	36	44
C[C@@H](CCCc1cccnc1)NC(=O)C(=O)NCCC[C@H]1C=CCC1	ZINC000875405504	EF	On-Demand	Anodyne	PTAFR	36	44
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(OC)c(C#N)c2)C1	ZINC000875405518	ED	On-Demand	Mild	P2RY12	21	46
C[C@@H](CCCc1cccnc1)NC(=O)C(=O)N[C@@H](C)c1cc2cnccc2o1	ZINC000875405546	GF	On-Demand	Anodyne	PTAFR	39	51
C[C@@H](CCCc1cccnc1)NC(=O)C(=O)N[C@H](C)c1cc2cnccc2o1	ZINC000875405548	GF	On-Demand	Anodyne	PTAFR	39	51
O=C(NCCOc1ncccc1F)N1CCC[C@H](OC2CCC2)CC1	ZINC000875405558	FF	On-Demand	Anodyne	EPHX2	18	42
O=C(NCCOc1ncccc1F)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875405559	FF	On-Demand	Anodyne	EPHX2	18	42
Cn1nc(Cl)c(C(=O)N2CCCc3c(F)cccc32)c1Cl	ZINC000875405586	EG	On-Demand	Anodyne	AVPR2	46	41
C[C@@H]1NC(=O)N(C[C@H](O)COc2cccc3ccccc23)C1=O	ZINC000875405631	DD	On-Demand	Anodyne	ADRB2	26	48
C[C@@H]1NC(=O)N(C[C@H](O)COc2cccc3ccccc23)C1=O	ZINC000875405631	DD	On-Demand	Anodyne	ADRB1	21	48
C[C@@H]1NC(=O)N(C[C@H](O)COc2cccc3ccccc23)C1=O	ZINC000875405631	DD	On-Demand	Anodyne	HTR1A	15	48
C[C@@H]1NC(=O)N(C[C@H](O)COc2cccc3ccccc23)C1=O	ZINC000875405631	DD	On-Demand	Anodyne	SLC6A4	19	41
C[C@@H]1NC(=O)N(C[C@H](O)COc2cccc3ccccc23)C1=O	ZINC000875405631	DD	On-Demand	Anodyne	ABCB1	53	39
C[C@@H]1NC(=O)N(C[C@@H](O)COc2cccc3ccccc23)C1=O	ZINC000875405633	DD	On-Demand	Anodyne	ADRB2	26	48
C[C@@H]1NC(=O)N(C[C@@H](O)COc2cccc3ccccc23)C1=O	ZINC000875405633	DD	On-Demand	Anodyne	ADRB1	21	48
C[C@@H]1NC(=O)N(C[C@@H](O)COc2cccc3ccccc23)C1=O	ZINC000875405633	DD	On-Demand	Anodyne	HTR1A	15	48
C[C@@H]1NC(=O)N(C[C@@H](O)COc2cccc3ccccc23)C1=O	ZINC000875405633	DD	On-Demand	Anodyne	SLC6A4	19	41
C[C@@H]1NC(=O)N(C[C@@H](O)COc2cccc3ccccc23)C1=O	ZINC000875405633	DD	On-Demand	Anodyne	ABCB1	53	39
C[C@@H](NC(=O)NCCOc1ncccc1F)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875405639	GE	On-Demand	Anodyne	GPR119	23	42
Cc1ccc(CNC(=O)C(=O)NCc2ccc(OC(F)F)cc2F)nc1C	ZINC000875405682	GE	On-Demand	Anodyne	TRPV1	43	33
CCCCCCCNC(=O)C(=O)NCc1ccc2cncn2c1	ZINC000875405734	DE	On-Demand	Mild	ASAH1	94	37
O=CN1CCCN(C(=O)NCCOc2ncccc2C(F)(F)F)CC1	ZINC000875405736	FD	On-Demand	Anodyne	RBP4	56	33
O=C(c1c(C(F)F)nc2n1CCCC2)N1CCCc2c(F)cccc21	ZINC000875405794	EH	On-Demand	Anodyne	AVPR2	31	41
O=C(NCCOc1ncccc1C(F)(F)F)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875405814	GF	On-Demand	Anodyne	SCD	16	41
C[C@H](NC(=O)C(=O)NCC(C)(C)CC#N)c1ccnn1C	ZINC000875405821	CC	On-Demand	Mild	CTSV	41	32
CCCCCCCNC(=O)C(=O)NCC1(N2CCOCC2)CCOCC1	ZINC000875405859	FD	On-Demand	Mild	ASAH1	50	42
Cc1ccc(CNC(=O)C(=O)N[C@H](C)c2ccc(C(F)(F)F)nc2)nc1C	ZINC000875405889	GF	On-Demand	Anodyne	TRPV1	65	32
Cc1ccc(CNC(=O)C(=O)N[C@@H](C)c2ccc(C(F)(F)F)nc2)nc1C	ZINC000875405890	GF	On-Demand	Anodyne	TRPV1	65	32
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCC(C)(C)CC#N)CC2	ZINC000875405892	FE	On-Demand	Mild	SLC18A2	47	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCC(C)(C)CC#N)CC2	ZINC000875405893	FE	On-Demand	Mild	SLC18A2	47	35
C[C@@H]1NC(=O)N(C[C@H](O)COc2ccccc2)C1=O	ZINC000875405918	CC	On-Demand	Anodyne	ADRB2	26	43
C[C@@H]1NC(=O)N(C[C@H](O)COc2ccccc2)C1=O	ZINC000875405918	CC	On-Demand	Anodyne	ABCB1	44	37
C[C@@H]1NC(=O)N(C[C@@H](O)COc2ccccc2)C1=O	ZINC000875405919	CC	On-Demand	Anodyne	ADRB2	26	43
C[C@@H]1NC(=O)N(C[C@@H](O)COc2ccccc2)C1=O	ZINC000875405919	CC	On-Demand	Anodyne	ABCB1	44	37
COC[C@H](NC(=O)C(=O)NCC(C)(C)CC#N)c1cccc(Br)c1	ZINC000875405970	GE	On-Demand	Mild	PAPA1_CARPA	18	41
COC[C@@H](NC(=O)C(=O)NCC(C)(C)CC#N)c1cccc(Br)c1	ZINC000875405971	GE	On-Demand	Mild	PAPA1_CARPA	18	41
C[C@@H]1NC(=O)N(C[C@@H](O)COc2ccccc2F)C1=O	ZINC000875406001	CC	On-Demand	Anodyne	ADRB2	22	42
C[C@@H]1NC(=O)N(C[C@@H](O)COc2ccccc2F)C1=O	ZINC000875406001	CC	On-Demand	Anodyne	ABCB1	43	39
C[C@@H]1NC(=O)N(C[C@H](O)COc2ccccc2F)C1=O	ZINC000875406002	CC	On-Demand	Anodyne	ADRB2	22	42
C[C@@H]1NC(=O)N(C[C@H](O)COc2ccccc2F)C1=O	ZINC000875406002	CC	On-Demand	Anodyne	ABCB1	43	39
C[C@@H]1NC(=O)N(C[C@H](O)COC(c2ccc(F)cc2)c2ccc(F)cc2)C1=O	ZINC000875406005	GE	On-Demand	Anodyne	SLC6A3	44	43
C[C@@H]1NC(=O)N(C[C@@H](O)COC(c2ccc(F)cc2)c2ccc(F)cc2)C1=O	ZINC000875406007	GE	On-Demand	Anodyne	SLC6A3	44	43
C[C@@H]1NC(=O)N(C[C@@H](O)COC(c2ccccc2)c2ccccc2)C1=O	ZINC000875406031	FE	On-Demand	Anodyne	SLC6A3	27	40
C[C@@H]1NC(=O)N(C[C@H](O)COC(c2ccccc2)c2ccccc2)C1=O	ZINC000875406032	FE	On-Demand	Anodyne	SLC6A3	27	40
Cc1ccc2nc(C(=O)N(C)c3ccc(C(=O)N4CCOCC4)cc3C)cn2c1	ZINC000875406174	GF	On-Demand	Anodyne	LRRK2	15	40
O=C(NCCOc1ncccc1F)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875406193	FE	On-Demand	Anodyne	EPHX2	19	44
O=C(NCCOc1ncccc1F)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875406194	FE	On-Demand	Anodyne	EPHX2	19	44
C[C@H](NC(=O)C(=O)NCC[C@H]1C[C@H]2CC[C@H]1O2)c1ccc(C(F)(F)F)nc1	ZINC000875406203	GE	On-Demand	Anodyne	TRPV1	40	32
C[C@H](NC(=O)C(=O)NCC[C@@H]1C[C@H]2CC[C@H]1O2)c1ccc(C(F)(F)F)nc1	ZINC000875406205	GE	On-Demand	Anodyne	TRPV1	40	32
CC(=O)c1ccc(OC[C@H](O)CN2C(=O)N[C@H](C)C2=O)cc1	ZINC000875406223	DC	On-Demand	Anodyne	ABCB1	19	42
CC(=O)c1ccc(OC[C@@H](O)CN2C(=O)N[C@@H](C)C2=O)cc1	ZINC000875406224	DC	On-Demand	Anodyne	ABCB1	19	42
CC(=O)c1ccc(OC[C@H](O)CN2C(=O)N[C@@H](C)C2=O)cc1	ZINC000875406225	DC	On-Demand	Anodyne	ABCB1	19	42
CC(=O)c1ccc(OC[C@@H](O)CN2C(=O)N[C@H](C)C2=O)cc1	ZINC000875406226	DC	On-Demand	Anodyne	ABCB1	19	42
C[C@@H](NC(=O)N1CCCN(C=O)CC1)[C@H](OC1CCOCC1)c1ccccc1	ZINC000875406273	GE	On-Demand	Anodyne	CTSS	23	41
C[C@@H](NC(=O)N1CCCN(C=O)CC1)[C@@H](OC1CCOCC1)c1ccccc1	ZINC000875406274	GE	On-Demand	Anodyne	CTSS	23	41
O=C(NCCOc1ncccc1C(F)(F)F)N1CCC(CO)(CO)CC1	ZINC000875406275	GD	On-Demand	Anodyne	RBP4	61	34
C[C@@H]1NC(=O)N(C[C@@H](O)COc2ccccc2Cl)C1=O	ZINC000875406277	CD	On-Demand	Anodyne	ADRB2	23	42
C[C@@H]1NC(=O)N(C[C@@H](O)COc2ccccc2Cl)C1=O	ZINC000875406277	CD	On-Demand	Anodyne	ADRB1	16	40
C[C@@H]1NC(=O)N(C[C@@H](O)COc2ccccc2Cl)C1=O	ZINC000875406277	CD	On-Demand	Anodyne	ABCB1	47	37
C[C@@H]1NC(=O)N(C[C@H](O)COc2ccccc2Cl)C1=O	ZINC000875406278	CD	On-Demand	Anodyne	ADRB2	23	42
C[C@@H]1NC(=O)N(C[C@H](O)COc2ccccc2Cl)C1=O	ZINC000875406278	CD	On-Demand	Anodyne	ADRB1	16	40
C[C@@H]1NC(=O)N(C[C@H](O)COc2ccccc2Cl)C1=O	ZINC000875406278	CD	On-Demand	Anodyne	ABCB1	47	37
CCOC(=O)[C@H](C)C1CN(C(=O)NCCOc2ncccc2C(F)(F)F)C1	ZINC000875406478	GE	On-Demand	Anodyne	RBP4	56	37
COCC[C@@H](C)CNC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875406482	FD	On-Demand	Anodyne	ROCK1	24	42
COCC[C@@H](C)CNC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875406482	FD	On-Demand	Anodyne	ROCK2	17	42
COCC[C@H](C)CNC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875406484	FD	On-Demand	Anodyne	ROCK1	24	42
COCC[C@H](C)CNC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875406484	FD	On-Demand	Anodyne	ROCK2	17	42
CCCCCCCNC(=O)C(=O)NCC(C)(C)CC#N	ZINC000875406493	CE	On-Demand	Mild	ASAH1	58	33
O=C(NCc1cccc(F)n1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875406552	ED	On-Demand	Anodyne	PDE8B	41	32
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)C(=O)NC[C@H]1CNC(=O)C1	ZINC000875406568	GD	On-Demand	Anodyne	MDM2	50	31
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)C(=O)NC[C@@H]1CNC(=O)C1	ZINC000875406569	GD	On-Demand	Anodyne	MDM2	50	31
O=C(NCc1cccc(F)n1)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875406571	CD	On-Demand	Anodyne	PDE8B	40	32
O=C(NCc1cccc(F)n1)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875406572	CD	On-Demand	Anodyne	PDE8B	40	32
C[C@@H]1NC(=O)N(C[C@H](O)COc2ccc3ccccc3c2)C1=O	ZINC000875406606	DD	On-Demand	Anodyne	ACOX1	42	36
C[C@@H]1NC(=O)N(C[C@@H](O)COc2ccc3ccccc3c2)C1=O	ZINC000875406608	DD	On-Demand	Anodyne	ACOX1	42	36
CC(=O)CCc1ccc(OC[C@H](O)CN2C(=O)N[C@@H](C)C2=O)cc1	ZINC000875406652	EC	On-Demand	Anodyne	ADRB1	33	42
CC(=O)CCc1ccc(OC[C@H](O)CN2C(=O)N[C@@H](C)C2=O)cc1	ZINC000875406652	EC	On-Demand	Anodyne	ABCB1	37	40
CC(=O)CCc1ccc(OC[C@@H](O)CN2C(=O)N[C@@H](C)C2=O)cc1	ZINC000875406653	EC	On-Demand	Anodyne	ADRB1	33	42
CC(=O)CCc1ccc(OC[C@@H](O)CN2C(=O)N[C@@H](C)C2=O)cc1	ZINC000875406653	EC	On-Demand	Anodyne	ABCB1	37	40
CC(=O)CCc1ccc(OC[C@@H](O)CN2C(=O)N[C@H](C)C2=O)cc1	ZINC000875406654	EC	On-Demand	Anodyne	ADRB1	33	42
CC(=O)CCc1ccc(OC[C@@H](O)CN2C(=O)N[C@H](C)C2=O)cc1	ZINC000875406654	EC	On-Demand	Anodyne	ABCB1	37	40
CC(=O)CCc1ccc(OC[C@H](O)CN2C(=O)N[C@H](C)C2=O)cc1	ZINC000875406655	EC	On-Demand	Anodyne	ADRB1	33	42
CC(=O)CCc1ccc(OC[C@H](O)CN2C(=O)N[C@H](C)C2=O)cc1	ZINC000875406655	EC	On-Demand	Anodyne	ABCB1	37	40
COc1ccc(N2CCN(C(=O)C(=O)NCC(C)(C)CC#N)CC2)c(OC)c1	ZINC000875406670	GD	On-Demand	Mild	DRD4	45	36
COc1ccc(N2CCN(C(=O)C(=O)NCC(C)(C)CC#N)CC2)c(OC)c1	ZINC000875406670	GD	On-Demand	Mild	DRD3	42	38
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)NCC(C)(C)CC#N)C2)c1	ZINC000875406684	GD	On-Demand	Mild	DRD4	19	42
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)NCC(C)(C)CC#N)C2)c1	ZINC000875406685	GD	On-Demand	Mild	DRD4	19	42
COCC[C@H](C)CNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875406714	GD	On-Demand	Clean	DRD2	30	41
COCC[C@H](C)CNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875406714	GD	On-Demand	Clean	DRD4	43	34
COCC[C@H](C)CNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875406714	GD	On-Demand	Clean	DRD3	50	41
COCC[C@@H](C)CNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875406715	GD	On-Demand	Clean	DRD2	30	41
COCC[C@@H](C)CNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875406715	GD	On-Demand	Clean	DRD4	43	34
COCC[C@@H](C)CNC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1	ZINC000875406715	GD	On-Demand	Clean	DRD3	50	41
C[C@H]1CCC[C@@H](C2CN(C(=O)NCc3cccc(F)n3)C2)C1	ZINC000875406724	DG	On-Demand	Anodyne	PDE8B	40	31
COCC[C@H](C)CNC(=O)C(=O)N(C)C[C@H]1CCCCN1Cc1ccccc1	ZINC000875406739	GE	On-Demand	Anodyne	DRD2	17	42
COCC[C@@H](C)CNC(=O)C(=O)N(C)C[C@H]1CCCCN1Cc1ccccc1	ZINC000875406740	GE	On-Demand	Anodyne	DRD2	17	42
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875406743	FD	On-Demand	Anodyne	GPR119	15	40
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875406745	FD	On-Demand	Anodyne	GPR119	15	40
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NC[C@@H]1CNC(=O)C1)CC2	ZINC000875406747	GC	On-Demand	Anodyne	SLC18A2	47	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NC[C@H]1CNC(=O)C1)CC2	ZINC000875406748	GC	On-Demand	Anodyne	SLC18A2	47	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NC[C@@H]1CNC(=O)C1)CC2	ZINC000875406749	GC	On-Demand	Anodyne	SLC18A2	47	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NC[C@H]1CNC(=O)C1)CC2	ZINC000875406750	GC	On-Demand	Anodyne	SLC18A2	47	36
CCCCCCCNC(=O)C(=O)NCc1ccn(CC)n1	ZINC000875406768	CD	On-Demand	Mild	ASAH1	95	40
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)N1CC(c2ccccc2)C1	ZINC000875406788	EF	On-Demand	Anodyne	FPR1	45	36
CCCCCCCNC(=O)C(=O)N[C@H](C)c1ccn(C)n1	ZINC000875406820	CD	On-Demand	Mild	ASAH1	97	43
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1ccn(C)n1	ZINC000875406821	CD	On-Demand	Mild	ASAH1	97	43
O=C(NCc1cccc(F)n1)N1CCc2nc(C3CC3)ncc2C1	ZINC000875406862	EE	On-Demand	Anodyne	MAPK1	46	43
C[C@H]1[C@H](CC(F)(F)F)C[C@@H](C)N1C(=O)NCc1cccc(F)n1	ZINC000875406908	EG	On-Demand	Anodyne	PDE8B	40	32
COCC[C@@H](C)CNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875406947	GD	On-Demand	Anodyne	ETHR	53	45
COCC[C@H](C)CNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875406948	GD	On-Demand	Anodyne	ETHR	53	45
CN(C)CC1CCC(NC(=O)N2CCC[C@](O)(c3ccccc3)C2)CC1	ZINC000875406952	FF	On-Demand	Anodyne	EPHX2	26	46
CN(C)CC1CCC(NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)CC1	ZINC000875406953	FF	On-Demand	Anodyne	EPHX2	26	46
O=C(NCc1cccc(F)n1)N1C[C@H](O)C[C@H]1C1CC1	ZINC000875406954	CD	On-Demand	Anodyne	PDE8B	41	34
O=C(NCc1cccc(F)n1)N1C[C@@H](O)C[C@@H]1C1CC1	ZINC000875406955	CD	On-Demand	Anodyne	PDE8B	41	34
O=C(NCc1cccc(F)n1)N1C[C@@H](O)C[C@H]1C1CC1	ZINC000875406956	CD	On-Demand	Anodyne	PDE8B	41	34
O=C(NCc1cccc(F)n1)N1C[C@H](O)C[C@@H]1C1CC1	ZINC000875406957	CD	On-Demand	Anodyne	PDE8B	41	34
O=C1C[C@@H](CNC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CN1	ZINC000875406971	EC	On-Demand	Anodyne	OXTR	50	36
O=C1C[C@H](CNC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CN1	ZINC000875406972	EC	On-Demand	Anodyne	OXTR	50	36
O=C1C[C@H](CNC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CN1	ZINC000875406973	EC	On-Demand	Anodyne	OXTR	50	36
O=C1C[C@@H](CNC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CN1	ZINC000875406974	EC	On-Demand	Anodyne	OXTR	50	36
O=C(NCc1cccc(F)n1)N1C[C@@H]2C[C@H]1CN2c1ccccc1	ZINC000875406980	EE	On-Demand	Anodyne	PDE8B	43	34
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@H](C)c1ccn(C)n1)CC2	ZINC000875407047	GD	On-Demand	Anodyne	SLC18A2	46	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H](C)c1ccn(C)n1)CC2	ZINC000875407048	GD	On-Demand	Anodyne	SLC18A2	46	35
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@@H](C)c1ccn(C)n1)CC2	ZINC000875407049	GD	On-Demand	Anodyne	SLC18A2	46	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H](C)c1ccn(C)n1)CC2	ZINC000875407050	GD	On-Demand	Anodyne	SLC18A2	46	35
O=C(NCc1cccc(F)n1)N1CC(c2ccccc2)C1	ZINC000875407058	CF	On-Demand	Anodyne	PDE8B	46	40
CC(=O)NC[C@@H]1CCCCN1C(=O)NCc1cccc(F)n1	ZINC000875407081	DD	On-Demand	Anodyne	HCRTR1	24	40
CC(=O)NC[C@@H]1CCCCN1C(=O)NCc1cccc(F)n1	ZINC000875407081	DD	On-Demand	Anodyne	PDE8B	43	35
C[C@H](NC(=O)C(=O)NCC[C@H]1CCCN(C)C1)c1ccnn1C	ZINC000875407088	DC	On-Demand	Anodyne	CCR3	40	31
COCC[C@H](C)CNC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1C	ZINC000875407096	GD	On-Demand	Anodyne	SLC18A2	53	38
COCC[C@@H](C)CNC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1C	ZINC000875407097	GD	On-Demand	Anodyne	SLC18A2	53	38
COCC[C@H](C)CNC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1C	ZINC000875407098	GD	On-Demand	Anodyne	SLC18A2	53	38
COCC[C@@H](C)CNC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1C	ZINC000875407099	GD	On-Demand	Anodyne	SLC18A2	53	38
CC(C)(C)OC(=O)N1CCC2(CC1)CN(C(=O)NCc1cccc(F)n1)C2	ZINC000875407141	GF	On-Demand	Anodyne	GPR119	32	40
CC(=O)[C@H]1CCCN(C(=O)NCCc2nnc(-c3ccccc3)o2)C1	ZINC000875407193	EE	On-Demand	Anodyne	PDE8B	40	31
CC(=O)[C@@H]1CCCN(C(=O)NCCc2nnc(-c3ccccc3)o2)C1	ZINC000875407195	EE	On-Demand	Anodyne	PDE8B	40	31
COc1ccccc1COC[C@@H](O)CN1C(=O)N[C@H](C(C)C)C1=O	ZINC000875407204	ED	On-Demand	Anodyne	SLC18A2	24	46
COc1ccccc1COC[C@H](O)CN1C(=O)N[C@@H](C(C)C)C1=O	ZINC000875407205	ED	On-Demand	Anodyne	SLC18A2	24	46
COc1ccccc1COC[C@H](O)CN1C(=O)N[C@H](C(C)C)C1=O	ZINC000875407206	ED	On-Demand	Anodyne	SLC18A2	24	46
COc1ccccc1COC[C@@H](O)CN1C(=O)N[C@@H](C(C)C)C1=O	ZINC000875407207	ED	On-Demand	Anodyne	SLC18A2	24	46
CN(Cc1ccc2cc[nH]c2c1)C(=O)NC[C@@H](c1ccccc1)C(C)(C)CO	ZINC000875407225	GI	On-Demand	Anodyne	MTTP	45	34
CN(Cc1ccc2cc[nH]c2c1)C(=O)NC[C@H](c1ccccc1)C(C)(C)CO	ZINC000875407226	GI	On-Demand	Anodyne	MTTP	45	34
C[C@H](NC(=O)C(=O)NCC[C@@H]1CCCN(C)C1)c1ccnn1C	ZINC000875407238	DC	On-Demand	Anodyne	CCR3	40	31
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1ccn(C)n1	ZINC000875407276	FF	On-Demand	Anodyne	FAAH	54	39
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1ccn(C)n1	ZINC000875407276	FF	On-Demand	Anodyne	CES1	53	33
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1ccn(C)n1	ZINC000875407276	FF	On-Demand	Anodyne	CAPN2	48	39
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1ccn(C)n1	ZINC000875407276	FF	On-Demand	Anodyne	AMP1_PLAFQ	23	45
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1ccn(C)n1	ZINC000875407276	FF	On-Demand	Anodyne	CES1D	45	33
C[C@H](NC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1)c1ccn(C)n1	ZINC000875407290	GD	On-Demand	Anodyne	NPY2R	69	41
CN1CCN(C(=O)N[C@@H](CCC#N)c2ccccc2)CCC1(C)C	ZINC000875407311	EG	On-Demand	Mild	PTAFR	21	40
CN1CCN(C(=O)N[C@H](CCC#N)c2ccccc2)CCC1(C)C	ZINC000875407314	EG	On-Demand	Mild	PTAFR	21	40
CCC(CC)[C@@H](CCNC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)OC	ZINC000875407327	GF	On-Demand	Anodyne	ETHR	41	33
CCC(CC)[C@H](CCNC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)OC	ZINC000875407328	GF	On-Demand	Anodyne	ETHR	41	33
CCC(CC)[C@@H](CCNC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)OC	ZINC000875407330	GF	On-Demand	Anodyne	ETHR	41	33
CCC(CC)[C@H](CCNC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)OC	ZINC000875407331	GF	On-Demand	Anodyne	ETHR	41	33
CN1CCC[C@@H](CCNC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000875407341	FD	On-Demand	Anodyne	OXTR	53	36
CN1CCC[C@@H](CCNC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000875407342	FD	On-Demand	Anodyne	OXTR	53	36
O=C(NCc1cccc(F)n1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875407345	EE	On-Demand	Anodyne	EPHX2	15	43
O=C(NCc1cccc(F)n1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875407346	EE	On-Demand	Anodyne	EPHX2	15	43
O=C(NCc1cccc(F)n1)N1CC(Cc2cccs2)C1	ZINC000875407360	DF	On-Demand	Anodyne	PDE8B	41	33
COCC[C@H](C)CNC(=O)C(=O)NC[C@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000875407394	GD	On-Demand	Anodyne	DRD4	18	44
COCC[C@@H](C)CNC(=O)C(=O)NC[C@@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000875407395	GD	On-Demand	Anodyne	DRD4	18	44
COCC[C@@H](C)CNC(=O)C(=O)NC[C@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000875407396	GD	On-Demand	Anodyne	DRD4	18	44
COCC[C@H](C)CNC(=O)C(=O)NC[C@@H]1CN(Cc2ccc(C)cc2)CCO1	ZINC000875407397	GD	On-Demand	Anodyne	DRD4	18	44
COCC[C@H](C)CNC(=O)C(=O)NCC1(c2cccc(Cl)c2)CCC1	ZINC000875407409	FF	On-Demand	Anodyne	KCNA3	41	35
COCC[C@@H](C)CNC(=O)C(=O)NCC1(c2cccc(Cl)c2)CCC1	ZINC000875407410	FF	On-Demand	Anodyne	KCNA3	41	35
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)N1CCc2nc(C3CC3)ncc2C1	ZINC000875407414	GF	On-Demand	Anodyne	MAPK1	43	37
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NCC[C@H]2CCCN(C)C2)CCO1	ZINC000875407488	GD	On-Demand	Anodyne	ACKR3	50	30
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NCC[C@@H]2CCCN(C)C2)CCO1	ZINC000875407491	GD	On-Demand	Anodyne	ACKR3	50	30
COc1ccccc1[C@H]1CN(C(=O)C(=O)NCC[C@@H]2CCCN(C)C2)CCO1	ZINC000875407494	GD	On-Demand	Anodyne	ACKR3	50	30
COc1ccccc1[C@H]1CN(C(=O)C(=O)NCC[C@H]2CCCN(C)C2)CCO1	ZINC000875407497	GD	On-Demand	Anodyne	ACKR3	50	30
O=C(NCc1cccc(F)n1)NC[C@H]1C[C@H](O)C1	ZINC000875407502	CC	On-Demand	Anodyne	PDE8B	41	32
C[C@@]1(CO)CN(C(=O)NCc2cccc(F)n2)C[C@]1(C)CO	ZINC000875407511	DC	On-Demand	Anodyne	PDE8B	40	31
CS(=O)(=O)NC1CN(C(=O)NCc2cccc(F)n2)C1	ZINC000875407542	DB	On-Demand	Anodyne	PDE8B	40	31
CN1CCC[C@@H](CCNC(=O)C(=O)NCc2ncc(Cl)s2)C1	ZINC000875407543	ED	On-Demand	Anodyne	SIRT3	48	30
CN1CCC[C@@H](CCNC(=O)C(=O)NCc2ncc(Cl)s2)C1	ZINC000875407543	ED	On-Demand	Anodyne	SIRT2	50	32
CN1CCC[C@@H](CCNC(=O)C(=O)NCc2ncc(Cl)s2)C1	ZINC000875407543	ED	On-Demand	Anodyne	SIRT1	49	32
CN1CCC[C@@H](CCNC(=O)C(=O)NCc2ncc(Br)s2)C1	ZINC000875407553	GD	On-Demand	Anodyne	SIRT3	48	30
CN1CCC[C@@H](CCNC(=O)C(=O)NCc2ncc(Br)s2)C1	ZINC000875407553	GD	On-Demand	Anodyne	SIRT2	50	32
CN1CCC[C@@H](CCNC(=O)C(=O)NCc2ncc(Br)s2)C1	ZINC000875407553	GD	On-Demand	Anodyne	SIRT1	49	32
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(F)n1	ZINC000875407597	DD	On-Demand	Anodyne	SLC6A3	56	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(F)n1	ZINC000875407597	DD	On-Demand	Anodyne	PDE8B	41	33
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(F)n1	ZINC000875407599	DD	On-Demand	Anodyne	SLC6A3	56	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(F)n1	ZINC000875407599	DD	On-Demand	Anodyne	PDE8B	41	33
CC(=O)c1ccc(OC[C@@H](O)CN2C(=O)N[C@H](C(C)C)C2=O)cc1	ZINC000875407663	ED	On-Demand	Anodyne	ABCB1	17	41
CC(=O)c1ccc(OC[C@H](O)CN2C(=O)N[C@@H](C(C)C)C2=O)cc1	ZINC000875407664	ED	On-Demand	Anodyne	ABCB1	17	41
CC(=O)c1ccc(OC[C@H](O)CN2C(=O)N[C@H](C(C)C)C2=O)cc1	ZINC000875407665	ED	On-Demand	Anodyne	ABCB1	17	41
CC(=O)c1ccc(OC[C@@H](O)CN2C(=O)N[C@@H](C(C)C)C2=O)cc1	ZINC000875407666	ED	On-Demand	Anodyne	ABCB1	17	41
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1ccn(C)n1	ZINC000875407691	GE	On-Demand	Anodyne	DRD2	17	40
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1ccn(C)n1	ZINC000875407691	GE	On-Demand	Anodyne	DRD4	35	40
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1ccn(C)n1	ZINC000875407691	GE	On-Demand	Anodyne	ACHE	60	54
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1ccn(C)n1	ZINC000875407691	GE	On-Demand	Anodyne	HTR4	25	44
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1ccn(C)n1	ZINC000875407691	GE	On-Demand	Anodyne	SIGMAR1	39	45
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1ccn(C)n1	ZINC000875407691	GE	On-Demand	Anodyne	BCHE	17	44
C[C@H](NC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1)c1ccn(C)n1	ZINC000875407691	GE	On-Demand	Anodyne	MCHR1	24	43
Cn1cc(CNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)c(C(F)(F)F)n1	ZINC000875407705	GF	On-Demand	Anodyne	EPHX2	15	49
Cn1cc(CNC(=O)N2CCC[C@](O)(c3ccccc3)C2)c(C(F)(F)F)n1	ZINC000875407706	GF	On-Demand	Anodyne	EPHX2	15	49
CO[C@H]1CN(C(=O)NCc2cccc(F)n2)[C@@](C)(CO)C1	ZINC000875407801	CC	On-Demand	Anodyne	PDE8B	42	34
CO[C@H]1CN(C(=O)NCc2cccc(F)n2)[C@](C)(CO)C1	ZINC000875407809	CC	On-Demand	Anodyne	PDE8B	42	34
CCCCCCCNC(=O)C(=O)NCC[C@@H]1CCCN(C)C1	ZINC000875407895	DD	On-Demand	Mild	TPP2	17	41
CCCCCCCNC(=O)C(=O)NCC[C@@H]1CCCN(C)C1	ZINC000875407895	DD	On-Demand	Mild	ASAH1	55	36
CCCCCCCNC(=O)C(=O)NCC[C@H]1CCCN(C)C1	ZINC000875407896	DD	On-Demand	Mild	TPP2	17	41
CCCCCCCNC(=O)C(=O)NCC[C@H]1CCCN(C)C1	ZINC000875407896	DD	On-Demand	Mild	ASAH1	55	36
COCCN(CC1CCN(C)CC1)C(=O)NCc1cccc(F)n1	ZINC000875407908	ED	On-Demand	Anodyne	PDE8B	40	34
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2nnc(-c3ccccc3)o2)C1	ZINC000875407909	FE	On-Demand	Anodyne	PDE8B	52	33
O=C(NCc1cccc(F)n1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875407918	DF	On-Demand	Anodyne	EPHX2	22	41
O=C(NCc1cccc(F)n1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875407920	DF	On-Demand	Anodyne	EPHX2	22	41
O=C(NCc1cccc(F)n1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875407922	DE	On-Demand	Anodyne	PDE8B	40	32
C[C@H]1c2ccccc2CCN1C(=O)C1(C)CC(F)(F)C1	ZINC000875407926	CH	On-Demand	Anodyne	TRPM8	25	40
COC(=O)c1ccc(OC[C@H](O)CN2C(=O)N[C@@H](C)C2=O)cc1	ZINC000875407932	DC	On-Demand	Anodyne	ADRB2	20	42
COC(=O)c1ccc(OC[C@@H](O)CN2C(=O)N[C@H](C)C2=O)cc1	ZINC000875407933	DC	On-Demand	Anodyne	ADRB2	20	42
COC(=O)c1ccc(OC[C@H](O)CN2C(=O)N[C@H](C)C2=O)cc1	ZINC000875407934	DC	On-Demand	Anodyne	ADRB2	20	42
COC(=O)c1ccc(OC[C@@H](O)CN2C(=O)N[C@@H](C)C2=O)cc1	ZINC000875407935	DC	On-Demand	Anodyne	ADRB2	20	42
CONC(=O)C1CCN(C(=O)NC[C@@H](c2ccccc2)C(C)(C)CO)CC1	ZINC000875407976	GD	On-Demand	Anodyne	AMY2	46	32
CONC(=O)C1CCN(C(=O)NC[C@H](c2ccccc2)C(C)(C)CO)CC1	ZINC000875407977	GD	On-Demand	Anodyne	AMY2	46	32
COC(=O)[C@@H]1CN(C(=O)NCc2cccc(F)n2)C[C@@H](C)O1	ZINC000875407999	DC	On-Demand	Anodyne	PDE8B	40	33
C#CC[C@H](CCOC)NC(=O)NCc1cccc(-c2ccccn2)c1	ZINC000875408000	EF	On-Demand	Mild	ROCK1	18	40
C#CC[C@H](CCOC)NC(=O)NCc1cccc(-c2ccccn2)c1	ZINC000875408000	EF	On-Demand	Mild	ROCK2	30	40
C#CC[C@@H](CCOC)NC(=O)NCc1cccc(-c2ccccn2)c1	ZINC000875408001	EF	On-Demand	Mild	ROCK1	18	40
C#CC[C@@H](CCOC)NC(=O)NCc1cccc(-c2ccccn2)c1	ZINC000875408001	EF	On-Demand	Mild	ROCK2	30	40
O=C(NCc1cccc(F)n1)NCC1CC(O)C1	ZINC000875408002	CC	On-Demand	Anodyne	PDE8B	41	32
O=C(NCc1cccc(F)n1)NC[C@@H]1C[C@H](O)C1	ZINC000875408003	CC	On-Demand	Anodyne	PDE8B	41	32
N#CCC[C@H](NC(=O)N1CCCN(C=O)CC1)c1ccccc1	ZINC000875408050	DD	On-Demand	Mild	PTAFR	27	46
N#CCC[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccccc1	ZINC000875408051	DD	On-Demand	Mild	PTAFR	27	46
N#CCC[C@@H](NC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1ccccc1	ZINC000875408052	FG	On-Demand	Mild	CTSS	26	42
N#CCC[C@H](NC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1ccccc1	ZINC000875408053	FG	On-Demand	Mild	CTSS	26	42
N#CCC[C@@H](NC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1ccccc1	ZINC000875408054	FG	On-Demand	Mild	CTSS	26	42
N#CCC[C@H](NC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1ccccc1	ZINC000875408055	FG	On-Demand	Mild	CTSS	26	42
CC[C@@H](NC(=O)C(=O)NCC[C@@H]1CCCN(C)C1)c1cccc(OC)c1OC	ZINC000875408061	GE	On-Demand	Anodyne	DRD2	26	40
CC[C@@H](NC(=O)C(=O)NCC[C@@H]1CCCN(C)C1)c1cccc(OC)c1OC	ZINC000875408061	GE	On-Demand	Anodyne	ACKR3	45	31
CC[C@@H](NC(=O)C(=O)NCC[C@H]1CCCN(C)C1)c1cccc(OC)c1OC	ZINC000875408062	GE	On-Demand	Anodyne	DRD2	26	40
CC[C@@H](NC(=O)C(=O)NCC[C@H]1CCCN(C)C1)c1cccc(OC)c1OC	ZINC000875408062	GE	On-Demand	Anodyne	ACKR3	45	31
COC(=O)c1ccc(OC[C@@H](O)CN2C(=O)N[C@H](C(C)C)C2=O)cc1	ZINC000875408076	FC	On-Demand	Anodyne	ADRB2	20	43
COC(=O)c1ccc(OC[C@@H](O)CN2C(=O)N[C@@H](C(C)C)C2=O)cc1	ZINC000875408077	FC	On-Demand	Anodyne	ADRB2	20	43
COC(=O)c1ccc(OC[C@H](O)CN2C(=O)N[C@@H](C(C)C)C2=O)cc1	ZINC000875408078	FC	On-Demand	Anodyne	ADRB2	20	43
COC(=O)c1ccc(OC[C@H](O)CN2C(=O)N[C@H](C(C)C)C2=O)cc1	ZINC000875408079	FC	On-Demand	Anodyne	ADRB2	20	43
CCCCCCCNC(=O)C(=O)NC[C@H]1CNC(=O)C1	ZINC000875408106	CC	On-Demand	Mild	ASAH1	86	36
CCCCCCCNC(=O)C(=O)NC[C@@H]1CNC(=O)C1	ZINC000875408107	CC	On-Demand	Mild	ASAH1	86	36
C[C@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(F)n1	ZINC000875408112	CD	On-Demand	Anodyne	PDE8B	41	33
C[C@H]1[C@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(F)n1	ZINC000875408113	CD	On-Demand	Anodyne	PDE8B	41	33
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(F)n1	ZINC000875408114	CD	On-Demand	Anodyne	PDE8B	41	33
O=C(NCc1cccc(F)n1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875408118	EG	On-Demand	Anodyne	CPT1A	66	34
O=C(NCc1cccc(F)n1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875408119	EG	On-Demand	Anodyne	CPT1A	66	34
O=C(NCc1cccc(F)n1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875408120	EG	On-Demand	Anodyne	CPT1A	66	34
O=C(NCc1cccc(F)n1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875408121	EG	On-Demand	Anodyne	CPT1A	66	34
CC(=O)C1CCN(C(=O)C(=O)NCc2ccc(C)c3ccccc23)CC1	ZINC000875408163	FF	On-Demand	Anodyne	EPHX2	19	40
CN(C)CC1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875408164	GG	On-Demand	Mild	ITK	18	47
CN(C)CC1CCC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CC1	ZINC000875408164	GG	On-Demand	Mild	PANC	53	36
COCC[C@@H](C)CNC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875408180	FE	On-Demand	Anodyne	PTAFR	21	40
COCC[C@H](C)CNC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875408181	FE	On-Demand	Anodyne	PTAFR	21	40
COCC[C@@H](C)CNC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875408183	FE	On-Demand	Anodyne	PTAFR	21	40
COCC[C@H](C)CNC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875408184	FE	On-Demand	Anodyne	PTAFR	21	40
C[C@@H]1NC(=O)N(C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1=O	ZINC000875408202	ED	On-Demand	Anodyne	HRH1	17	43
C[C@@H]1NC(=O)N(C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1=O	ZINC000875408202	ED	On-Demand	Anodyne	CCR3	18	43
C[C@@H]1NC(=O)N(C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1=O	ZINC000875408205	ED	On-Demand	Anodyne	HRH1	17	43
C[C@@H]1NC(=O)N(C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1=O	ZINC000875408205	ED	On-Demand	Anodyne	CCR3	18	43
CCOC1CC2(C1)C[C@H]2NC(=O)NC[C@H](c1ccccc1)C(C)(C)CO	ZINC000875408243	FG	On-Demand	Anodyne	TIMP3	54	32
CCOC1CC2(C1)C[C@@H]2NC(=O)NC[C@H](c1ccccc1)C(C)(C)CO	ZINC000875408244	FG	On-Demand	Anodyne	TIMP3	54	32
CCOC1CC2(C1)C[C@@H]2NC(=O)NC[C@@H](c1ccccc1)C(C)(C)CO	ZINC000875408245	FG	On-Demand	Anodyne	TIMP3	54	32
CCOC1CC2(C1)C[C@H]2NC(=O)NC[C@@H](c1ccccc1)C(C)(C)CO	ZINC000875408246	FG	On-Demand	Anodyne	TIMP3	54	32
COC(=O)N(C)NC(=O)N[C@H](CCC#N)c1ccccc1	ZINC000875408284	CD	On-Demand	Reactive	PAPA1_CARPA	44	36
COC(=O)N(C)NC(=O)N[C@H](CCC#N)c1ccccc1	ZINC000875408284	CD	On-Demand	Reactive	UTS2	66	40
COC(=O)N(C)NC(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000875408289	CD	On-Demand	Reactive	PAPA1_CARPA	44	36
COC(=O)N(C)NC(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000875408289	CD	On-Demand	Reactive	UTS2	66	40
CN1CCC[C@@H](CCNC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875408332	GE	On-Demand	Anodyne	C3AR1	41	39
CN1CCC[C@@H](CCNC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875408333	GE	On-Demand	Anodyne	C3AR1	41	39
C#CC[C@@H](COC)NC(=O)NCc1cccc(-c2ccccn2)c1	ZINC000875408338	DF	On-Demand	Mild	PDS	51	33
C#CC[C@H](COC)NC(=O)NCc1cccc(-c2ccccn2)c1	ZINC000875408339	DF	On-Demand	Mild	PDS	51	33
CCCCCCCNC(=O)C(=O)N[C@@H]1CCO[C@H]1CC	ZINC000875408342	CD	On-Demand	Mild	LASR	47	35
CN1CCC[C@@H](CCNC(=O)C(=O)NCc2cccc3ncccc23)C1	ZINC000875408365	FD	On-Demand	Anodyne	SIRT3	40	32
CN1CCC[C@@H](CCNC(=O)C(=O)NCc2cccc3ncccc23)C1	ZINC000875408365	FD	On-Demand	Anodyne	SIRT2	44	32
CN1CCC[C@@H](CCNC(=O)C(=O)NCc2cccc3ncccc23)C1	ZINC000875408365	FD	On-Demand	Anodyne	SIRT1	41	33
CN(C)C[C@@H]1CN(C(=O)N[C@@H](CCC#N)c2ccccc2)C[C@H]1CN(C)C	ZINC000875408505	FE	On-Demand	Mild	UTS2	59	36
CN(C)C[C@@H]1CN(C(=O)N[C@H](CCC#N)c2ccccc2)C[C@H]1CN(C)C	ZINC000875408506	FE	On-Demand	Mild	UTS2	59	36
O=C(NCc1cccc(F)n1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875408519	EE	On-Demand	Anodyne	FAAH	15	41
O=C(NCc1cccc(F)n1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875408519	EE	On-Demand	Anodyne	PDE8B	41	32
CN1CC[C@H]2CN(C(=O)NCCc3nnc(-c4ccccc4)o3)CC[C@@H]21	ZINC000875408531	FE	On-Demand	Anodyne	CALCRL	15	45
CN1CC[C@H]2CN(C(=O)NCCc3nnc(-c4ccccc4)o3)CC[C@H]21	ZINC000875408533	FE	On-Demand	Anodyne	CALCRL	15	45
O=C(Nc1nccs1)Nn1cnc2ccccc21	ZINC000875408579	CE	On-Demand	Anodyne	MAP1	117	38
O=C(Nc1nccs1)Nn1cnc2ccccc21	ZINC000875408579	CE	On-Demand	Anodyne	GCK	18	40
CNC(=O)NC[C@H]1COCCN1C(=O)NCc1cccc(F)n1	ZINC000875408737	EC	On-Demand	Anodyne	PDE8B	41	33
O=C(NCc1cccc(F)n1)NC1CC(Nc2ccccc2)C1	ZINC000875408801	DF	On-Demand	Anodyne	PDE8B	40	31
COc1ccccc1[C@H]1CCCN(C(=O)NCC2(OC)CCOCC2)CC1	ZINC000875408814	GG	On-Demand	Anodyne	HCN1	40	36
COc1ccccc1[C@H]1CCCN(C(=O)NCC2(OC)CCOCC2)CC1	ZINC000875408814	GG	On-Demand	Anodyne	ACKR3	44	31
COc1ccccc1[C@@H]1CCCN(C(=O)NCC2(OC)CCOCC2)CC1	ZINC000875408816	GG	On-Demand	Anodyne	HCN1	40	36
COc1ccccc1[C@@H]1CCCN(C(=O)NCC2(OC)CCOCC2)CC1	ZINC000875408816	GG	On-Demand	Anodyne	ACKR3	44	31
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1ccccc1)C(C)(C)CO	ZINC000875408818	FF	On-Demand	Anodyne	SLC6A4	22	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1ccccc1)C(C)(C)CO	ZINC000875408818	FF	On-Demand	Anodyne	SLC6A3	52	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1ccccc1)C(C)(C)CO	ZINC000875408820	FF	On-Demand	Anodyne	SLC6A4	22	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1ccccc1)C(C)(C)CO	ZINC000875408820	FF	On-Demand	Anodyne	SLC6A3	52	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1ccccc1)C(C)(C)CO	ZINC000875408822	FF	On-Demand	Anodyne	SLC6A4	22	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](c1ccccc1)C(C)(C)CO	ZINC000875408822	FF	On-Demand	Anodyne	SLC6A3	52	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1ccccc1)C(C)(C)CO	ZINC000875408825	FF	On-Demand	Anodyne	SLC6A4	22	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](c1ccccc1)C(C)(C)CO	ZINC000875408825	FF	On-Demand	Anodyne	SLC6A3	52	42
C[C@@H]1NC(=O)N(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1=O	ZINC000875408850	DC	On-Demand	Bother	CACNA1C	50	34
C[C@@H]1NC(=O)N(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1=O	ZINC000875408850	DC	On-Demand	Bother	CACNA1D	79	34
C[C@@H]1NC(=O)N(C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1=O	ZINC000875408851	DC	On-Demand	Bother	CACNA1C	50	34
C[C@@H]1NC(=O)N(C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1=O	ZINC000875408851	DC	On-Demand	Bother	CACNA1D	79	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC(=O)N(C)c2ccccc21	ZINC000875408889	GE	On-Demand	Anodyne	ACE	85	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC(=O)N(C)c2ccccc21	ZINC000875408889	GE	On-Demand	Anodyne	TYR	33	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC(=O)N(C)c2ccccc21	ZINC000875408889	GE	On-Demand	Anodyne	MME	109	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC(=O)N(C)c2ccccc21	ZINC000875408889	GE	On-Demand	Anodyne	ANPEP	51	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC(=O)N(C)c2ccccc21	ZINC000875408889	GE	On-Demand	Anodyne	CMA1	44	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC(=O)N(C)c2ccccc21	ZINC000875408889	GE	On-Demand	Anodyne	CTRA_BOVIN	63	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC(=O)N(C)c2ccccc21	ZINC000875408889	GE	On-Demand	Anodyne	FCER2	51	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC(=O)N(C)c2ccccc21	ZINC000875408889	GE	On-Demand	Anodyne	KLK3	61	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC(=O)N(C)c2ccccc21	ZINC000875408889	GE	On-Demand	Anodyne	CTSB	73	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC(=O)N(C)c2ccccc21	ZINC000875408889	GE	On-Demand	Anodyne	PAPA1_CARPA	75	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC(=O)N(C)c2ccccc21	ZINC000875408889	GE	On-Demand	Anodyne	CYSP_TRYCR	70	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC(=O)N(C)c2ccccc21	ZINC000875408889	GE	On-Demand	Anodyne	CTSK	45	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC(=O)N(C)c2ccccc21	ZINC000875408889	GE	On-Demand	Anodyne	CTSL	54	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC(=O)N(C)c2ccccc21	ZINC000875408889	GE	On-Demand	Anodyne	NPFFR2	41	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC(=O)N(C)c2ccccc21	ZINC000875408889	GE	On-Demand	Anodyne	TIMP3	76	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC(=O)N(C)c2ccccc21	ZINC000875408889	GE	On-Demand	Anodyne	CAPNS1	68	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC(=O)N(C)c2ccccc21	ZINC000875408889	GE	On-Demand	Anodyne	HLA-DRB1	85	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC(=O)N(C)c2ccccc21	ZINC000875408889	GE	On-Demand	Anodyne	CELA2A	52	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC(=O)N(C)c2ccccc21	ZINC000875408889	GE	On-Demand	Anodyne	REN	25	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC(=O)N(C)c2ccccc21	ZINC000875408889	GE	On-Demand	Anodyne	CTSS	23	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC(=O)N(C)c2ccccc21	ZINC000875408889	GE	On-Demand	Anodyne	CAPN1	108	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC(=O)N(C)c2ccccc21	ZINC000875408889	GE	On-Demand	Anodyne	CAPN2	126	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC(=O)N(C)c2ccccc21	ZINC000875408889	GE	On-Demand	Anodyne	ACE2	80	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC(=O)N(C)c2ccccc21	ZINC000875408889	GE	On-Demand	Anodyne	FPR1	53	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC(=O)N(C)c2ccccc21	ZINC000875408889	GE	On-Demand	Anodyne	CTRB_BOVIN	49	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC(=O)N(C)c2ccccc21	ZINC000875408889	GE	On-Demand	Anodyne	NPFFR1	52	32
CN1C(=O)CN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)c2ccccc21	ZINC000875408901	GE	On-Demand	Anodyne	PAPA1_CARPA	40	35
CN1C(=O)CN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)c2ccccc21	ZINC000875408901	GE	On-Demand	Anodyne	CYSP_TRYCR	39	40
CN1C(=O)CN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)c2ccccc21	ZINC000875408901	GE	On-Demand	Anodyne	CTSK	31	45
CN1C(=O)CN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)c2ccccc21	ZINC000875408901	GE	On-Demand	Anodyne	CTSL	36	40
CN1C(=O)CN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)c2ccccc21	ZINC000875408901	GE	On-Demand	Anodyne	CAPNS1	57	33
CN1C(=O)CN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)c2ccccc21	ZINC000875408901	GE	On-Demand	Anodyne	CAPN1	44	35
CN1C(=O)CN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)c2ccccc21	ZINC000875408901	GE	On-Demand	Anodyne	CAPN2	70	33
CN1C(=O)CN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)c2ccccc21	ZINC000875408901	GE	On-Demand	Anodyne	NPR	51	31
CN1C(=O)CN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)c2ccccc21	ZINC000875408901	GE	On-Demand	Anodyne	SLC12A5	60	38
CCOC(=O)[C@@H]1CN(C(=O)NCc2cccc(F)n2)CCC1(F)F	ZINC000875408923	ED	On-Demand	Anodyne	PDE8B	40	33
COCC[C@H](C)CNC(=O)C(=O)NC[C@H]1CN(Cc2cccc(C)c2)CCO1	ZINC000875408928	GD	On-Demand	Anodyne	DRD4	25	41
COCC[C@@H](C)CNC(=O)C(=O)NC[C@@H]1CN(Cc2cccc(C)c2)CCO1	ZINC000875408929	GD	On-Demand	Anodyne	DRD4	25	41
COCC[C@@H](C)CNC(=O)C(=O)NC[C@H]1CN(Cc2cccc(C)c2)CCO1	ZINC000875408930	GD	On-Demand	Anodyne	DRD4	25	41
COCC[C@H](C)CNC(=O)C(=O)NC[C@@H]1CN(Cc2cccc(C)c2)CCO1	ZINC000875408931	GD	On-Demand	Anodyne	DRD4	25	41
Cc1cncc([C@H]2CCCN2C(=O)NCCc2nnc(-c3ccccc3)o2)c1	ZINC000875408949	GH	On-Demand	Anodyne	HCRTR1	19	41
Cc1cncc([C@@H]2CCCN2C(=O)NCCc2nnc(-c3ccccc3)o2)c1	ZINC000875408950	GH	On-Demand	Anodyne	HCRTR1	19	41
O=C1C[C@@H](CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)CN1	ZINC000875408984	GC	On-Demand	Anodyne	DRD2	21	43
O=C1C[C@@H](CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)CN1	ZINC000875408984	GC	On-Demand	Anodyne	DRD4	43	43
O=C1C[C@@H](CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)CN1	ZINC000875408984	GC	On-Demand	Anodyne	ACHE	60	58
O=C1C[C@@H](CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)CN1	ZINC000875408984	GC	On-Demand	Anodyne	DRD3	16	41
O=C1C[C@@H](CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)CN1	ZINC000875408984	GC	On-Demand	Anodyne	HTR4	29	43
O=C1C[C@@H](CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)CN1	ZINC000875408984	GC	On-Demand	Anodyne	SIGMAR1	57	45
O=C1C[C@@H](CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)CN1	ZINC000875408984	GC	On-Demand	Anodyne	CACNA1I	51	39
O=C1C[C@H](CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)CN1	ZINC000875408986	GC	On-Demand	Anodyne	DRD2	21	43
O=C1C[C@H](CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)CN1	ZINC000875408986	GC	On-Demand	Anodyne	DRD4	43	43
O=C1C[C@H](CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)CN1	ZINC000875408986	GC	On-Demand	Anodyne	ACHE	60	58
O=C1C[C@H](CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)CN1	ZINC000875408986	GC	On-Demand	Anodyne	DRD3	16	41
O=C1C[C@H](CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)CN1	ZINC000875408986	GC	On-Demand	Anodyne	HTR4	29	43
O=C1C[C@H](CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)CN1	ZINC000875408986	GC	On-Demand	Anodyne	SIGMAR1	57	45
O=C1C[C@H](CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)CN1	ZINC000875408986	GC	On-Demand	Anodyne	CACNA1I	51	39
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2(N3CCOCC3)CCN(C)CC2)C1	ZINC000875409016	GB	On-Demand	Anodyne	HCN1	43	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2(N3CCOCC3)CCN(C)CC2)C1	ZINC000875409018	GB	On-Demand	Anodyne	HCN1	43	32
O=C1C[C@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)CN1	ZINC000875409044	ED	On-Demand	Anodyne	FAAH	43	39
O=C1C[C@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)CN1	ZINC000875409044	ED	On-Demand	Anodyne	CES1	55	34
O=C1C[C@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)CN1	ZINC000875409044	ED	On-Demand	Anodyne	AMP1_PLAFQ	21	43
O=C1C[C@@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)CN1	ZINC000875409046	ED	On-Demand	Anodyne	FAAH	43	39
O=C1C[C@@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)CN1	ZINC000875409046	ED	On-Demand	Anodyne	CES1	55	34
O=C1C[C@@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)CN1	ZINC000875409046	ED	On-Demand	Anodyne	AMP1_PLAFQ	21	43
Cc1cncc([C@H]2CCCN2C(=O)NC[C@@H](c2ccccc2)C(C)(C)CO)c1	ZINC000875409073	GI	On-Demand	Anodyne	WNT3	42	34
Cc1cncc([C@H]2CCCN2C(=O)NC[C@H](c2ccccc2)C(C)(C)CO)c1	ZINC000875409075	GI	On-Demand	Anodyne	WNT3	42	34
Cc1cncc([C@@H]2CCCN2C(=O)NC[C@H](c2ccccc2)C(C)(C)CO)c1	ZINC000875409077	GI	On-Demand	Anodyne	WNT3	42	34
Cc1cncc([C@@H]2CCCN2C(=O)NC[C@@H](c2ccccc2)C(C)(C)CO)c1	ZINC000875409079	GI	On-Demand	Anodyne	WNT3	42	34
O=C(NCc1cccc(F)n1)N(Cc1cccc(O)c1)[C@@H]1CC[C@@H](O)CC1	ZINC000875409097	FF	On-Demand	Anodyne	HSD17B2	18	42
O=C(NCc1cccc(F)n1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875409123	FF	On-Demand	Anodyne	PDE8B	40	32
COCC[C@@H](C)CNC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875409130	FD	On-Demand	Anodyne	NPY2R	71	37
COCC[C@H](C)CNC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875409131	FD	On-Demand	Anodyne	NPY2R	71	37
O=C(NCc1cccc(F)n1)N1OC2CCC1CC2	ZINC000875409134	CD	On-Demand	Anodyne	PDE8B	42	33
CN1CCC[C@@H](CCNC(=O)C(=O)N2CCN(c3ccc(F)cc3F)CC2)C1	ZINC000875409143	GD	On-Demand	Anodyne	CCR3	47	35
O=C(NCCN1CC[C@@H](O)C1)NCc1cccc(F)n1	ZINC000875409155	CC	On-Demand	Anodyne	PLD2	48	31
O=C(NCCN1CC[C@H](O)C1)NCc1cccc(F)n1	ZINC000875409156	CC	On-Demand	Anodyne	PLD2	48	31
N#CCC[C@H](NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)c1ccccc1	ZINC000875409196	FH	On-Demand	Mild	DPP4	19	43
N#CCC[C@H](NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)c1ccccc1	ZINC000875409197	FH	On-Demand	Mild	DPP4	19	43
N#CCC[C@H](NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)c1ccccc1	ZINC000875409198	FH	On-Demand	Mild	DPP4	19	43
N#CCC[C@H](NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)c1ccccc1	ZINC000875409199	FH	On-Demand	Mild	DPP4	19	43
N#CCC[C@@H](NC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F)c1ccccc1	ZINC000875409223	GJ	On-Demand	Mild	CTSF	67	33
N#CCC[C@@H](NC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F)c1ccccc1	ZINC000875409223	GJ	On-Demand	Mild	CTSL	22	40
N#CCC[C@@H](NC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F)c1ccccc1	ZINC000875409223	GJ	On-Demand	Mild	CTSS	15	40
N#CCC[C@@H](NC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F)c1ccccc1	ZINC000875409224	GJ	On-Demand	Mild	CTSF	67	33
N#CCC[C@@H](NC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F)c1ccccc1	ZINC000875409224	GJ	On-Demand	Mild	CTSL	22	40
N#CCC[C@@H](NC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F)c1ccccc1	ZINC000875409224	GJ	On-Demand	Mild	CTSS	15	40
N#CCC[C@H](NC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F)c1ccccc1	ZINC000875409225	GJ	On-Demand	Mild	CTSF	67	33
N#CCC[C@H](NC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F)c1ccccc1	ZINC000875409225	GJ	On-Demand	Mild	CTSL	22	40
N#CCC[C@H](NC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F)c1ccccc1	ZINC000875409225	GJ	On-Demand	Mild	CTSS	15	40
N#CCC[C@H](NC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F)c1ccccc1	ZINC000875409226	GJ	On-Demand	Mild	CTSF	67	33
N#CCC[C@H](NC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F)c1ccccc1	ZINC000875409226	GJ	On-Demand	Mild	CTSL	22	40
N#CCC[C@H](NC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F)c1ccccc1	ZINC000875409226	GJ	On-Demand	Mild	CTSS	15	40
N#CCC[C@H](NC(=O)N1Cc2cccnc2N2CCC[C@H]2C1)c1ccccc1	ZINC000875409227	GH	On-Demand	Mild	PTAFR	33	44
N#CCC[C@@H](NC(=O)N1Cc2cccnc2N2CCC[C@H]2C1)c1ccccc1	ZINC000875409228	GH	On-Demand	Mild	PTAFR	33	44
CC(=O)CCc1ccc(OC[C@@H](O)CN2C(=O)N[C@H](C(C)C)C2=O)cc1	ZINC000875409260	FD	On-Demand	Anodyne	ADRB1	29	45
CC(=O)CCc1ccc(OC[C@H](O)CN2C(=O)N[C@H](C(C)C)C2=O)cc1	ZINC000875409261	FD	On-Demand	Anodyne	ADRB1	29	45
CC(=O)CCc1ccc(OC[C@@H](O)CN2C(=O)N[C@@H](C(C)C)C2=O)cc1	ZINC000875409262	FD	On-Demand	Anodyne	ADRB1	29	45
CC(=O)CCc1ccc(OC[C@H](O)CN2C(=O)N[C@@H](C(C)C)C2=O)cc1	ZINC000875409263	FD	On-Demand	Anodyne	ADRB1	29	45
CC(=O)[C@@H]1CCCN(C(=O)NC[C@@H](c2ccccc2)C(C)(C)CO)C1	ZINC000875409266	EF	On-Demand	Anodyne	SLC6A1	42	37
CC(=O)[C@@H]1CCCN(C(=O)NC[C@@H](c2ccccc2)C(C)(C)CO)C1	ZINC000875409266	EF	On-Demand	Anodyne	SFRP1	61	32
CC(=O)[C@@H]1CCCN(C(=O)NC[C@@H](c2ccccc2)C(C)(C)CO)C1	ZINC000875409266	EF	On-Demand	Anodyne	WNT3	53	32
CC(=O)[C@@H]1CCCN(C(=O)NC[C@H](c2ccccc2)C(C)(C)CO)C1	ZINC000875409267	EF	On-Demand	Anodyne	SLC6A1	42	37
CC(=O)[C@@H]1CCCN(C(=O)NC[C@H](c2ccccc2)C(C)(C)CO)C1	ZINC000875409267	EF	On-Demand	Anodyne	SFRP1	61	32
CC(=O)[C@@H]1CCCN(C(=O)NC[C@H](c2ccccc2)C(C)(C)CO)C1	ZINC000875409267	EF	On-Demand	Anodyne	WNT3	53	32
CC(=O)[C@H]1CCCN(C(=O)NC[C@@H](c2ccccc2)C(C)(C)CO)C1	ZINC000875409268	EF	On-Demand	Anodyne	SLC6A1	42	37
CC(=O)[C@H]1CCCN(C(=O)NC[C@@H](c2ccccc2)C(C)(C)CO)C1	ZINC000875409268	EF	On-Demand	Anodyne	SFRP1	61	32
CC(=O)[C@H]1CCCN(C(=O)NC[C@@H](c2ccccc2)C(C)(C)CO)C1	ZINC000875409268	EF	On-Demand	Anodyne	WNT3	53	32
CC(=O)[C@H]1CCCN(C(=O)NC[C@H](c2ccccc2)C(C)(C)CO)C1	ZINC000875409269	EF	On-Demand	Anodyne	SLC6A1	42	37
CC(=O)[C@H]1CCCN(C(=O)NC[C@H](c2ccccc2)C(C)(C)CO)C1	ZINC000875409269	EF	On-Demand	Anodyne	SFRP1	61	32
CC(=O)[C@H]1CCCN(C(=O)NC[C@H](c2ccccc2)C(C)(C)CO)C1	ZINC000875409269	EF	On-Demand	Anodyne	WNT3	53	32
CC(=O)C1CCN(C(=O)NC[C@H](c2ccccc2)C(C)(C)CO)CC1	ZINC000875409296	EF	On-Demand	Anodyne	SFRP1	65	34
CC(=O)C1CCN(C(=O)NC[C@@H](c2ccccc2)C(C)(C)CO)CC1	ZINC000875409297	EF	On-Demand	Anodyne	SFRP1	65	34
C[C@H](NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)c1ccn(C)n1	ZINC000875409349	FD	On-Demand	Anodyne	OXTR	40	37
C[C@H](NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)c1ccn(C)n1	ZINC000875409351	FD	On-Demand	Anodyne	OXTR	40	37
C[C@H](NC(=O)C(=O)NCC[C@H]1CCCN(C)C1)c1ccc(C(F)(F)F)nc1	ZINC000875409395	GE	On-Demand	Anodyne	TRPV1	55	38
C[C@H](NC(=O)C(=O)NCC[C@@H]1CCCN(C)C1)c1ccc(C(F)(F)F)nc1	ZINC000875409396	GE	On-Demand	Anodyne	TRPV1	55	38
CN(C)C[C@@H]1CN(C(=O)NCc2cccc(F)n2)C[C@H]1CN(C)C	ZINC000875409439	ED	On-Demand	Anodyne	PDE8B	41	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000875409440	EF	On-Demand	Mild	SLC6A4	23	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000875409440	EF	On-Demand	Mild	SLC6A3	54	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000875409441	EF	On-Demand	Mild	SLC6A4	23	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000875409441	EF	On-Demand	Mild	SLC6A3	54	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000875409442	EF	On-Demand	Mild	SLC6A4	23	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000875409442	EF	On-Demand	Mild	SLC6A3	54	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000875409443	EF	On-Demand	Mild	SLC6A4	23	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000875409443	EF	On-Demand	Mild	SLC6A3	54	42
CCC1(CC)CCCN1C(=O)NCCc1nnc(-c2ccccc2)o1	ZINC000875409505	EH	On-Demand	Anodyne	SLC12A5	55	35
CC(=O)c1cccc(OC[C@@H](O)CN2C(=O)N[C@H](C(C)C)C2=O)c1	ZINC000875409512	ED	On-Demand	Anodyne	ABCB1	29	49
CC(=O)c1cccc(OC[C@H](O)CN2C(=O)N[C@@H](C(C)C)C2=O)c1	ZINC000875409513	ED	On-Demand	Anodyne	ABCB1	29	49
CC(=O)c1cccc(OC[C@H](O)CN2C(=O)N[C@H](C(C)C)C2=O)c1	ZINC000875409514	ED	On-Demand	Anodyne	ABCB1	29	49
CC(=O)c1cccc(OC[C@@H](O)CN2C(=O)N[C@@H](C(C)C)C2=O)c1	ZINC000875409515	ED	On-Demand	Anodyne	ABCB1	29	49
O=C(NCCc1nnc(-c2ccccc2)o1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875409517	GF	On-Demand	Anodyne	CALCRL	18	43
O=C(NCCc1nnc(-c2ccccc2)o1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875409518	GF	On-Demand	Anodyne	CALCRL	18	43
C[C@H]1c2ccccc2CCN1C(=O)c1c(C(F)F)nc2n1CCCC2	ZINC000875409622	EH	On-Demand	Anodyne	TRPC6	20	41
COc1ccccc1[C@@H]1CSCCCN1C(=O)NCC1(OC)CCOCC1	ZINC000875409648	GG	On-Demand	Anodyne	HCN1	47	34
C[C@H]1c2ccccc2CCN1C(=O)c1scnc1C(F)F	ZINC000875409768	DH	On-Demand	Anodyne	TRPC6	21	44
C[C@H]1c2ccccc2CCN1C(=O)c1scnc1C(F)F	ZINC000875409768	DH	On-Demand	Anodyne	TRPC3	15	44
CC[C@@H](NC(=O)C(=O)N[C@@H](C1CCC1)[C@H]1CCOC1)c1ccccc1	ZINC000875409818	EF	On-Demand	Anodyne	TACR3	43	35
CC[C@@H](NC(=O)C(=O)N[C@@H](C1CCC1)[C@@H]1CCOC1)c1ccccc1	ZINC000875409819	EF	On-Demand	Anodyne	TACR3	43	35
CC[C@@H](NC(=O)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1)c1ccccc1	ZINC000875409820	EF	On-Demand	Anodyne	TACR3	43	35
CC[C@@H](NC(=O)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1)c1ccccc1	ZINC000875409821	EF	On-Demand	Anodyne	TACR3	43	35
COC[C@H](NC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1)C1CC1	ZINC000875409859	EF	On-Demand	Anodyne	CPT1A	70	34
COC[C@H](NC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1)C1CC1	ZINC000875409860	EF	On-Demand	Anodyne	CPT1A	70	34
COC[C@H](NC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1)C1CC1	ZINC000875409861	EF	On-Demand	Anodyne	CPT1A	70	34
COC[C@H](NC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1)C1CC1	ZINC000875409862	EF	On-Demand	Anodyne	CPT1A	70	34
O=C(c1cccn(C2CC2)c1=O)N(CC(F)(F)F)C1CCCC1	ZINC000875409878	EG	On-Demand	Anodyne	ACE	38	42
COc1cccc(C(C)(C)CNC(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875409920	FD	On-Demand	Anodyne	DRD4	43	32
CC(=O)c1ccc(NC(=O)NNC(=O)c2ccc(-c3ccc(F)cc3)s2)cc1	ZINC000875409925	GI	On-Demand	Reactive	MAPK11	19	47
Cc1ccc(CNC(=O)C(=O)NC[C@@H]2CCN(C)[C@H]2c2cccnc2)o1	ZINC000875409928	FD	On-Demand	Anodyne	CHRNA7	15	40
COC[C@@H](NC(=O)N1CCC[C@@H](c2ccccc2OC)CC1)C1CC1	ZINC000875409968	EG	On-Demand	Anodyne	RBP4	34	40
COC[C@@H](NC(=O)N1CCC[C@H](c2ccccc2OC)CC1)C1CC1	ZINC000875409969	EG	On-Demand	Anodyne	RBP4	34	40
COC[C@H](NC(=O)N1CCC[C@@H](c2ccccc2OC)CC1)C1CC1	ZINC000875409970	EG	On-Demand	Anodyne	RBP4	34	40
COC[C@H](NC(=O)N1CCC[C@H](c2ccccc2OC)CC1)C1CC1	ZINC000875409971	EG	On-Demand	Anodyne	RBP4	34	40
COC[C@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)C1CC1	ZINC000875410014	EE	On-Demand	Mild	ITK	22	49
COC[C@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)C1CC1	ZINC000875410014	EE	On-Demand	Mild	PANC	58	40
COC[C@@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)C1CC1	ZINC000875410015	EE	On-Demand	Mild	ITK	22	49
COC[C@@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)C1CC1	ZINC000875410015	EE	On-Demand	Mild	PANC	58	40
CCO[C@H](C(=O)N1c2ccccc2CC[C@@H]1CC)C1CCOCC1	ZINC000875410021	EH	On-Demand	Anodyne	ACE	15	40
CCO[C@H](C(=O)N1c2ccccc2CC[C@@H]1CC)C1CCOCC1	ZINC000875410021	EH	On-Demand	Anodyne	TPP2	51	31
CCO[C@@H](C(=O)N1c2ccccc2CC[C@H]1CC)C1CCOCC1	ZINC000875410022	EH	On-Demand	Anodyne	ACE	15	40
CCO[C@@H](C(=O)N1c2ccccc2CC[C@H]1CC)C1CCOCC1	ZINC000875410022	EH	On-Demand	Anodyne	TPP2	51	31
CCO[C@H](C(=O)N1c2ccccc2CC[C@H]1CC)C1CCOCC1	ZINC000875410023	EH	On-Demand	Anodyne	ACE	15	40
CCO[C@H](C(=O)N1c2ccccc2CC[C@H]1CC)C1CCOCC1	ZINC000875410023	EH	On-Demand	Anodyne	TPP2	51	31
CCO[C@@H](C(=O)N1c2ccccc2CC[C@@H]1CC)C1CCOCC1	ZINC000875410024	EH	On-Demand	Anodyne	ACE	15	40
CCO[C@@H](C(=O)N1c2ccccc2CC[C@@H]1CC)C1CCOCC1	ZINC000875410024	EH	On-Demand	Anodyne	TPP2	51	31
CN1CC[C@@H](CNC(=O)C(=O)N2CCC(CCF)CC2)[C@@H]1c1cccnc1	ZINC000875410037	GD	On-Demand	Anodyne	NAMPT	18	40
CN1CC[C@@H](CNC(=O)C(=O)N2CCN(CCC#N)CC2)[C@@H]1c1cccnc1	ZINC000875410053	GC	On-Demand	Mild	PTAFR	18	40
COc1cccc(C(C)(C)CNC(=O)N(C)CCN2CC3(CCOCC3)C2)c1	ZINC000875410069	GF	On-Demand	Anodyne	DRD4	42	32
COC[C@H](NC(=O)N1CCC(c2nccc(-c3cccnc3)n2)CC1)C1CC1	ZINC000875410087	GF	On-Demand	Anodyne	ABL1	15	42
COC[C@@H](NC(=O)N1CCC(c2nccc(-c3cccnc3)n2)CC1)C1CC1	ZINC000875410088	GF	On-Demand	Anodyne	ABL1	15	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC(C)(C)c1cccc(OC)c1	ZINC000875410107	FF	On-Demand	Anodyne	SLC6A4	21	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC(C)(C)c1cccc(OC)c1	ZINC000875410107	FF	On-Demand	Anodyne	SLC6A3	36	40
CC[C@H](C[C@H](C)O)NC(=O)NCC(C)(C)c1cccc(OC)c1	ZINC000875410110	DF	On-Demand	Anodyne	MTNR1A	30	40
CC[C@H](C[C@H](C)O)NC(=O)NCC(C)(C)c1cccc(OC)c1	ZINC000875410110	DF	On-Demand	Anodyne	PDS	53	34
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(COCC(F)(F)F)c1	ZINC000875410122	FG	On-Demand	Anodyne	ANPEP	16	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(COCC(F)(F)F)c1	ZINC000875410122	FG	On-Demand	Anodyne	PDS	70	38
COC[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)C1CC1	ZINC000875410161	CD	On-Demand	Anodyne	REN	16	44
COC[C@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)C1CC1	ZINC000875410162	CD	On-Demand	Anodyne	REN	16	44
COC[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)C1CC1	ZINC000875410163	CD	On-Demand	Anodyne	REN	16	44
COC[C@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)C1CC1	ZINC000875410164	CD	On-Demand	Anodyne	REN	16	44
O=C(c1cccc2scnc12)N(CC(F)(F)F)C1CCCC1	ZINC000875410199	EI	On-Demand	Anodyne	ACE	41	38
COc1cccc(C(C)(C)CNC(=O)N2CCC(C(=O)NCCO)CC2)c1	ZINC000875410243	GD	On-Demand	Anodyne	DRD4	43	33
COc1cccc(C(C)(C)CNC(=O)N2CCC(C(=O)NCCO)CC2)c1	ZINC000875410243	GD	On-Demand	Anodyne	NQO2	16	41
COc1cccc(C(C)(C)CNC(=O)N2CCC(C(=O)NCCO)CC2)c1	ZINC000875410243	GD	On-Demand	Anodyne	MTNR1A	35	43
COc1cccc(C(C)(C)CNC(=O)N2CCC(C(=O)NCCO)CC2)c1	ZINC000875410243	GD	On-Demand	Anodyne	MTNR1B	35	43
COc1cccc(C(C)(C)CNC(=O)N2CCC(C(=O)NCCO)CC2)c1	ZINC000875410243	GD	On-Demand	Anodyne	EPHX2	16	42
COc1cccc(C(C)(C)CNC(=O)N2CCC(C(=O)NCCO)CC2)c1	ZINC000875410243	GD	On-Demand	Anodyne	CACNA1G	31	45
COc1cccc(C(C)(C)CNC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875410274	EG	On-Demand	Anodyne	DRD4	42	33
COc1cccc(C(C)(C)CNC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875410274	EG	On-Demand	Anodyne	CHRM3	23	43
COc1cccc(C(C)(C)CNC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875410274	EG	On-Demand	Anodyne	MTNR1B	40	38
COc1cccc(C(C)(C)CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875410275	EG	On-Demand	Anodyne	DRD4	42	33
COc1cccc(C(C)(C)CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875410275	EG	On-Demand	Anodyne	CHRM3	23	43
COc1cccc(C(C)(C)CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875410275	EG	On-Demand	Anodyne	MTNR1B	40	38
COC(=O)C1(O)CN(C(=O)NCC(C)(C)c2cccc(OC)c2)C1	ZINC000875410292	EC	On-Demand	Anodyne	DRD4	41	31
COC(=O)N(C)NC(=O)NCC(C)(C)c1cccc(OC)c1	ZINC000875410373	DD	On-Demand	Reactive	MTNR1A	52	38
COC(=O)N(C)NC(=O)NCC(C)(C)c1cccc(OC)c1	ZINC000875410373	DD	On-Demand	Reactive	MTNR1B	48	39
COC[C@H](NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)C1CC1	ZINC000875410383	DE	On-Demand	Anodyne	ACE	30	40
COC[C@H](NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)C1CC1	ZINC000875410384	DE	On-Demand	Anodyne	ACE	30	40
COC[C@H](NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)C1CC1	ZINC000875410385	DE	On-Demand	Anodyne	ACE	30	40
COC[C@H](NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)C1CC1	ZINC000875410386	DE	On-Demand	Anodyne	ACE	30	40
CN1CC[C@@H](CNC(=O)C(=O)NCCCCC2CC2)[C@@H]1c1cccnc1	ZINC000875410393	FD	On-Demand	Anodyne	NAMPT	19	49
O=C(Cc1ccc2cccnc2c1)N(CC(F)(F)F)C1CCCC1	ZINC000875410412	EI	On-Demand	Anodyne	CDK5	15	40
COc1cccc(C(C)(C)CNC(=O)N2C[C@@H](CN(C)C)[C@H](CN(C)C)C2)c1	ZINC000875410418	GE	On-Demand	Anodyne	DRD4	40	30
COc1cccc(C(C)(C)CNC(=O)N2Cc3cccc(O)c3C2)c1	ZINC000875410428	EG	On-Demand	Clean	DRD4	44	34
COc1cccc(C(C)(C)CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875410435	FE	On-Demand	Anodyne	DRD4	42	32
COc1cccc(C(C)(C)CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875410435	FE	On-Demand	Anodyne	CHRM3	15	45
COc1cccc(C(C)(C)CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875410435	FE	On-Demand	Anodyne	MTNR1A	19	43
COc1cccc(C(C)(C)CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875410435	FE	On-Demand	Anodyne	MTNR1B	21	43
COc1cccc(C(C)(C)CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875410435	FE	On-Demand	Anodyne	CCR2	24	44
COc1cccc(C(C)(C)CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875410435	FE	On-Demand	Anodyne	MCHR1	18	44
COc1cccc(C(C)(C)CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875410435	FE	On-Demand	Anodyne	HPGDS	17	40
COc1cccc(C(C)(C)CNC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875410439	DE	On-Demand	Anodyne	DRD4	40	31
COCCN(CC1CCN(C)CC1)C(=O)NCC(C)(C)c1cccc(OC)c1	ZINC000875410455	GF	On-Demand	Anodyne	DRD4	43	32
COCCN(CC1CCN(C)CC1)C(=O)NCC(C)(C)c1cccc(OC)c1	ZINC000875410455	GF	On-Demand	Anodyne	CACNA1I	49	35
COCCN(CC1CCN(C)CC1)C(=O)NCC(C)(C)c1cccc(OC)c1	ZINC000875410455	GF	On-Demand	Anodyne	ACKR3	65	33
COc1cccc(C(C)(C)CNC(=O)NC2(C)CC(F)(F)C2)c1	ZINC000875410463	EG	On-Demand	Anodyne	DRD4	41	31
Cc1nnc(NNC(=O)NCc2cccc(COCC(F)(F)F)c2)n1C	ZINC000875410505	FE	On-Demand	Reactive	CARM1	52	34
O=C(c1ccnc(-n2cccc2)c1)N(CC(F)(F)F)C1CCCC1	ZINC000875410563	EH	On-Demand	Anodyne	ACE	42	37
COc1cccc(C(C)(C)CNC(=O)N2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000875410565	FG	On-Demand	Anodyne	DRD4	41	31
COc1cccc(C(C)(C)CNC(=O)N2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000875410566	FG	On-Demand	Anodyne	DRD4	41	31
COc1cccc(C(C)(C)CNC(=O)N2CCCN(C=O)CC2)c1	ZINC000875410607	ED	On-Demand	Anodyne	DRD4	42	33
COC[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)C1CC1	ZINC000875410631	EF	On-Demand	Anodyne	OPRL1	15	44
COC[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)C1CC1	ZINC000875410632	EF	On-Demand	Anodyne	OPRL1	15	44
COc1cccc(C(C)(C)CNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875410634	EF	On-Demand	Anodyne	DRD4	45	34
COc1cccc(C(C)(C)CNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875410634	EF	On-Demand	Anodyne	MTNR1B	42	38
COc1cccc(C(C)(C)CNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875410635	EF	On-Demand	Anodyne	DRD4	45	34
COc1cccc(C(C)(C)CNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875410635	EF	On-Demand	Anodyne	MTNR1B	42	38
O=C(NCc1ncccc1F)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875410647	DE	On-Demand	Anodyne	EPHX2	17	44
O=C(NCc1ncccc1F)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875410648	DE	On-Demand	Anodyne	EPHX2	17	44
O=C(NCc1ccc(COC2CCOCC2)cc1)N1Cc2cccc(O)c2C1	ZINC000875410665	GG	On-Demand	Clean	NAMPT	26	46
CCCCCCCNC(=O)C(=O)NC[C@@H]1CCO[C@H]1c1cnn(C)c1	ZINC000875410788	FD	On-Demand	Mild	ASAH1	89	36
COCC1CCC(NC(=O)C(=O)N2CCN(c3ccc(F)cc3F)CC2)CC1	ZINC000875410810	GD	On-Demand	Anodyne	SLC6A9	21	44
COCC1CCC(NC(=O)C(=O)N2CCN(c3ccc(F)cc3F)CC2)CC1	ZINC000875410810	GD	On-Demand	Anodyne	NPY5R	25	44
O=C(NCc1ncccc1F)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875410843	FF	On-Demand	Anodyne	NPY2R	61	36
CN1CCN(C(=O)NCc2ncccc2F)Cc2cccnc21	ZINC000875410883	DD	On-Demand	Anodyne	NAMPT	15	40
O=C(NCc1ncccc1F)N1CC2(CC(=O)N2Cc2ccccc2)C1	ZINC000875410944	FD	On-Demand	Anodyne	NAMPT	22	40
Cc1nnc(NNC(=O)N[C@@H](CC2CCCC2)c2ccccc2)n1C	ZINC000875410967	EG	On-Demand	Reactive	CCR5	30	41
CCOC(=O)[C@@H]1CC[C@H](C(=O)N(CC(F)F)c2ccccc2)C1	ZINC000875410968	EG	On-Demand	Anodyne	AMY2	45	31
Cc1nnc(NNC(=O)N[C@H](CC2CCCC2)c2ccccc2)n1C	ZINC000875410970	EG	On-Demand	Reactive	CCR5	30	41
CCOc1cccc([C@@H](CC)OC(=O)[C@H]2CCCN2C(C)=O)c1	ZINC000875410993	DG	On-Demand	Anodyne	ACE	20	40
CCOc1cccc([C@@H](CC)OC(=O)[C@H]2CCCN2C(C)=O)c1	ZINC000875410993	DG	On-Demand	Anodyne	FKBP1A	97	52
CCOc1cccc([C@@H](CC)OC(=O)[C@H]2CCCN2C(C)=O)c1	ZINC000875410993	DG	On-Demand	Anodyne	CPT1A	17	40
CCOc1cccc([C@@H](CC)OC(=O)[C@H]2CCCN2C(C)=O)c1	ZINC000875410993	DG	On-Demand	Anodyne	CPT2	26	40
CCOc1cccc([C@@H](CC)OC(=O)[C@H]2CCCN2C(C)=O)c1	ZINC000875410993	DG	On-Demand	Anodyne	PREP	40	36
CCOc1cccc([C@@H](CC)OC(=O)[C@H]2CCCN2C(C)=O)c1	ZINC000875410993	DG	On-Demand	Anodyne	LGMN	61	43
CCOc1cccc([C@H](CC)OC(=O)[C@H]2CCCN2C(C)=O)c1	ZINC000875410994	DG	On-Demand	Anodyne	ACE	20	40
CCOc1cccc([C@H](CC)OC(=O)[C@H]2CCCN2C(C)=O)c1	ZINC000875410994	DG	On-Demand	Anodyne	FKBP1A	97	52
CCOc1cccc([C@H](CC)OC(=O)[C@H]2CCCN2C(C)=O)c1	ZINC000875410994	DG	On-Demand	Anodyne	CPT1A	17	40
CCOc1cccc([C@H](CC)OC(=O)[C@H]2CCCN2C(C)=O)c1	ZINC000875410994	DG	On-Demand	Anodyne	CPT2	26	40
CCOc1cccc([C@H](CC)OC(=O)[C@H]2CCCN2C(C)=O)c1	ZINC000875410994	DG	On-Demand	Anodyne	PREP	40	36
CCOc1cccc([C@H](CC)OC(=O)[C@H]2CCCN2C(C)=O)c1	ZINC000875410994	DG	On-Demand	Anodyne	LGMN	61	43
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@@H](C)SC)CC1	ZINC000875411029	EH	On-Demand	Anodyne	RBP4	29	40
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@H](C)SC)CC1	ZINC000875411032	EH	On-Demand	Anodyne	RBP4	29	40
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@@H](C)SC)CC1	ZINC000875411034	EH	On-Demand	Anodyne	RBP4	29	40
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@H](C)SC)CC1	ZINC000875411035	EH	On-Demand	Anodyne	RBP4	29	40
CN1CCC(CNC(=O)NCc2ncccc2F)(c2ccccc2)CC1	ZINC000875411064	FF	On-Demand	Anodyne	KCNA3	43	38
CN1CCC(CNC(=O)NCc2ncccc2F)(c2ccccc2)CC1	ZINC000875411064	FF	On-Demand	Anodyne	SOAT1	16	40
CCOc1cccc([C@H](CC)OC(=O)C(C)(C)NC(=O)C(C)(C)NC(C)=O)c1	ZINC000875411080	GF	On-Demand	Anodyne	PDS	69	36
CCOc1cccc([C@@H](CC)OC(=O)C(C)(C)NC(=O)C(C)(C)NC(C)=O)c1	ZINC000875411082	GF	On-Demand	Anodyne	PDS	69	36
COCCCOc1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875411088	GD	On-Demand	Anodyne	DRD4	25	43
COCCCOc1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875411088	GD	On-Demand	Anodyne	HRH2	45	48
COCCCOc1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875411088	GD	On-Demand	Anodyne	CCR3	26	43
COCCCOc1cccc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875411088	GD	On-Demand	Anodyne	MCHR1	20	49
CS(=O)(=O)c1ccccc1CNC(=O)C(=O)NCCC1CCC1	ZINC000875411091	ED	On-Demand	Anodyne	TRPV1	42	34
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCc1ncccc1F)CC2	ZINC000875411156	FG	On-Demand	Anodyne	SLC18A2	46	33
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCc1ncccc1F)CC2	ZINC000875411156	FG	On-Demand	Anodyne	HCRTR1	16	46
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCc1ncccc1F)CC2	ZINC000875411156	FG	On-Demand	Anodyne	MTNR1B	16	46
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCc1ncccc1F)CC2	ZINC000875411156	FG	On-Demand	Anodyne	HCRTR2	17	46
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCc1ncccc1F)CC2	ZINC000875411157	FG	On-Demand	Anodyne	SLC18A2	46	33
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCc1ncccc1F)CC2	ZINC000875411157	FG	On-Demand	Anodyne	HCRTR1	16	46
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCc1ncccc1F)CC2	ZINC000875411157	FG	On-Demand	Anodyne	MTNR1B	16	46
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCc1ncccc1F)CC2	ZINC000875411157	FG	On-Demand	Anodyne	HCRTR2	17	46
C[C@H](NC(=O)/C=C\c1ccc(Br)o1)c1ccccc1Br	ZINC000875411160	GJ	On-Demand	Anodyne	KCNQ2	46	35
C[C@H](NC(=O)/C=C\c1ccc(Br)o1)c1ccccc1Br	ZINC000875411160	GJ	On-Demand	Anodyne	UL26	69	50
C[C@H](NC(=O)/C=C\c1ccc(Br)o1)c1ccccc1Br	ZINC000875411160	GJ	On-Demand	Anodyne	SCAF_EBVB9	65	50
CS(=O)(=O)Nc1ccc(C(=O)Oc2ccc(N3CCCC3)cc2)cn1	ZINC000875411197	FE	On-Demand	Anodyne	ACR	41	32
COC(=O)c1cc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)cn1C	ZINC000875411293	GG	On-Demand	Anodyne	KCNK3	73	35
O=C(N[C@@H](CC1CCCC1)c1ccccc1)N1CCC2(CCNC2=O)CC1	ZINC000875411298	FH	On-Demand	Anodyne	CACNA1H	30	42
O=C(N[C@H](CC1CCCC1)c1ccccc1)N1CCC2(CCNC2=O)CC1	ZINC000875411299	FH	On-Demand	Anodyne	CACNA1H	30	42
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CN(C(=O)NCc1ncccc1F)C2	ZINC000875411318	FF	On-Demand	Anodyne	GPR119	44	42
COCCCOc1cccc(CNC(=O)N(C)OCC(F)(F)F)c1	ZINC000875411346	FF	On-Demand	Anodyne	CRTM	40	34
COCCCOc1cccc(CNC(=O)N(C)OCC(F)(F)F)c1	ZINC000875411346	FF	On-Demand	Anodyne	PDS	65	43
CS[C@H](C)CNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875411356	EF	On-Demand	Mild	ITK	16	52
CCCCCCCNC(=O)C(=O)NCc1ccccc1S(C)(=O)=O	ZINC000875411363	FD	On-Demand	Mild	GRIA1	45	33
CCCCCCCNC(=O)C(=O)NCc1ccccc1S(C)(=O)=O	ZINC000875411363	FD	On-Demand	Mild	ASAH1	89	36
CCCCCCCNC(=O)C(=O)N[C@@H]1CS[C@H](C)C1	ZINC000875411385	CE	On-Demand	Mild	EPHX2	17	43
CCCCCCCNC(=O)C(=O)N[C@@H]1CS[C@H](C)C1	ZINC000875411385	CE	On-Demand	Mild	ASAH1	42	32
CCCCCCCNC(=O)C(=O)N[C@H]1CS[C@@H](C)C1	ZINC000875411386	CE	On-Demand	Mild	EPHX2	17	43
CCCCCCCNC(=O)C(=O)N[C@H]1CS[C@@H](C)C1	ZINC000875411386	CE	On-Demand	Mild	ASAH1	42	32
CCCCCCCNC(=O)C(=O)N[C@@H]1CS[C@@H](C)C1	ZINC000875411387	CE	On-Demand	Mild	EPHX2	17	43
CCCCCCCNC(=O)C(=O)N[C@@H]1CS[C@@H](C)C1	ZINC000875411387	CE	On-Demand	Mild	ASAH1	42	32
CCCCCCCNC(=O)C(=O)N[C@H]1CS[C@H](C)C1	ZINC000875411388	CE	On-Demand	Mild	EPHX2	17	43
CCCCCCCNC(=O)C(=O)N[C@H]1CS[C@H](C)C1	ZINC000875411388	CE	On-Demand	Mild	ASAH1	42	32
COCCCOc1cccc(CNC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875411436	GG	On-Demand	Anodyne	HRH2	39	45
COCCCOc1cccc(CNC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875411436	GG	On-Demand	Anodyne	CCR8	26	40
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NC[C@@H]1C[C@H](C)O[C@@H]1C)CC2	ZINC000875411440	GE	On-Demand	Anodyne	SLC18A2	49	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NC[C@@H]1C[C@@H](C)O[C@@H]1C)CC2	ZINC000875411441	GE	On-Demand	Anodyne	SLC18A2	49	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NC[C@@H]1C[C@@H](C)O[C@H]1C)CC2	ZINC000875411442	GE	On-Demand	Anodyne	SLC18A2	49	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NC[C@@H]1C[C@H](C)O[C@H]1C)CC2	ZINC000875411443	GE	On-Demand	Anodyne	SLC18A2	49	37
N#Cc1ccc(Cn2cc(NC(=O)NCC3(C4CC4)CCC3)cn2)cc1	ZINC000875411449	EH	On-Demand	Mild	ITK	17	49
N#Cc1ccc(Cn2cc(NC(=O)NCC3(C4CC4)CCC3)cn2)cc1	ZINC000875411449	EH	On-Demand	Mild	PANC	55	37
O=C(NCc1ncccc1F)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875411455	FF	On-Demand	Anodyne	SMO	40	44
O=C(NCc1ncccc1F)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875411455	FF	On-Demand	Anodyne	ETHR	69	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ncccc1F	ZINC000875411483	DD	On-Demand	Anodyne	SLC6A3	53	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ncccc1F	ZINC000875411484	DD	On-Demand	Anodyne	SLC6A3	53	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(C)cc(OC)c1	ZINC000875411485	EE	On-Demand	Anodyne	SLC6A3	43	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(C)cc(OC)c1	ZINC000875411486	EE	On-Demand	Anodyne	SLC6A3	43	38
CS[C@H](C)CNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875411545	EF	On-Demand	Anodyne	OPRL1	15	46
O=C(Nc1ccc(-c2nnc3n2CCCCCC3)cc1)Nc1nccs1	ZINC000875411550	FI	On-Demand	Anodyne	MAP1	90	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccnc(OC(C)C)c1	ZINC000875411574	EE	On-Demand	Anodyne	SLC6A3	48	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccnc(OC(C)C)c1	ZINC000875411576	EE	On-Demand	Anodyne	SLC6A3	48	37
CS[C@H](C)CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875411639	DF	On-Demand	Anodyne	ACE	40	39
CS[C@H](C)CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875411642	DF	On-Demand	Anodyne	ACE	40	39
CS[C@H](C)CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875411645	DF	On-Demand	Anodyne	ACE	40	39
CS[C@H](C)CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875411648	DF	On-Demand	Anodyne	ACE	40	39
Cc1noc(C)c1[C@H](C)CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875411722	FH	On-Demand	Anodyne	CPT1A	42	34
Cc1noc(C)c1[C@H](C)CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875411723	FH	On-Demand	Anodyne	CPT1A	42	34
Cc1noc(C)c1[C@H](C)CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875411724	FH	On-Demand	Anodyne	CPT1A	42	34
Cc1noc(C)c1[C@H](C)CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875411725	FH	On-Demand	Anodyne	CPT1A	42	34
COCCCOc1cccc(CNC(=O)NN(C)C(=O)OC)c1	ZINC000875411783	ED	On-Demand	Reactive	HRH2	28	42
COCCCOc1cccc(CNC(=O)NN(C)C(=O)OC)c1	ZINC000875411783	ED	On-Demand	Reactive	ROCK1	21	41
COCCCOc1cccc(CNC(=O)NN(C)C(=O)OC)c1	ZINC000875411783	ED	On-Demand	Reactive	MTNR1A	33	41
COCCCOc1cccc(CNC(=O)NN(C)C(=O)OC)c1	ZINC000875411783	ED	On-Demand	Reactive	ROCK2	35	47
COCCCOc1cccc(CNC(=O)NN(C)C(=O)OC)c1	ZINC000875411783	ED	On-Demand	Reactive	CRTM	54	36
COCCCOc1cccc(CNC(=O)NN(C)C(=O)OC)c1	ZINC000875411783	ED	On-Demand	Reactive	PDS	62	37
O=C(N[C@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCc2ncccc2F)C1	ZINC000875411832	GD	On-Demand	Anodyne	EPHX2	20	40
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCc2ncccc2F)C1	ZINC000875411834	GD	On-Demand	Anodyne	EPHX2	20	40
O=C(N[C@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCc2ncccc2F)C1	ZINC000875411835	GD	On-Demand	Anodyne	EPHX2	20	40
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCc2ncccc2F)C1	ZINC000875411836	GD	On-Demand	Anodyne	EPHX2	20	40
COC(=O)c1cc(C(=O)N(CC(F)(F)F)C2CCCC2)ccc1C	ZINC000875411837	EH	On-Demand	Anodyne	ACE	55	36
CC(C)(C)OC(=O)N1CC[C@H]2[C@H]1CCCN2C(=O)NCc1ncccc1F	ZINC000875411838	GF	On-Demand	Anodyne	GPR119	23	40
CC(C)(C)OC(=O)N1CC[C@H]2[C@@H]1CCCN2C(=O)NCc1ncccc1F	ZINC000875411839	GF	On-Demand	Anodyne	GPR119	23	40
CC(C)(C)OC(=O)N1CC[C@@H]2[C@H]1CCCN2C(=O)NCc1ncccc1F	ZINC000875411841	GF	On-Demand	Anodyne	GPR119	23	40
CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H]1CCCN2C(=O)NCc1ncccc1F	ZINC000875411842	GF	On-Demand	Anodyne	GPR119	23	40
O=C(NCc1ncccc1F)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875411845	EF	On-Demand	Anodyne	GRIN2B	17	41
O=C(NCc1ncccc1F)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875411845	EF	On-Demand	Anodyne	CCR3	20	42
O=C(NCc1ncccc1F)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875411845	EF	On-Demand	Anodyne	EPHX2	39	54
O=C(NCc1ncccc1F)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875411845	EF	On-Demand	Anodyne	LIPG	22	40
C[C@@H]1CN(C(=O)NCc2ncccc2F)Cc2ccccc21	ZINC000875411857	CG	On-Demand	Anodyne	NAMPT	15	41
C[C@]1(C(F)(F)F)CCN(C(=O)NCc2ncccc2F)C1	ZINC000875411886	DF	On-Demand	Anodyne	EPHX2	28	41
CN1CCN(C2CCN(C(=O)NCc3ncccc3F)CC2)CC1	ZINC000875411935	ED	On-Demand	Anodyne	EPHX2	19	43
CN1CCN(C2CCN(C(=O)NCc3ncccc3F)CC2)CC1	ZINC000875411935	ED	On-Demand	Anodyne	CALCRL	65	39
CN1CCN(C2CCN(C(=O)NCc3ncccc3F)CC2)CC1	ZINC000875411935	ED	On-Demand	Anodyne	L3MBTL3	65	40
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCc1ccnc(OC(C)C)c1)CC2	ZINC000875412118	GG	On-Demand	Anodyne	MAPK1	15	40
N#Cc1ccc(N2CCN(C(=O)NCc3ncccc3F)CC2)cc1	ZINC000875412160	EE	On-Demand	Mild	P2RY12	16	42
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(N2CCCC2)cc1	ZINC000875412213	DF	On-Demand	Anodyne	CTSB	19	43
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(N2CCCC2)cc1	ZINC000875412213	DF	On-Demand	Anodyne	CTSK	29	44
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(N2CCCC2)cc1	ZINC000875412213	DF	On-Demand	Anodyne	CTSL	22	44
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(N2CCCC2)cc1	ZINC000875412213	DF	On-Demand	Anodyne	CAPN1	46	42
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc(N2CCCC2)cc1	ZINC000875412213	DF	On-Demand	Anodyne	CAPN2	41	33
COCCCOc1cccc(CNC(=O)N[C@@H]2C[C@H]3C[C@@]3(C(=O)OC)C2)c1	ZINC000875412239	GE	On-Demand	Anodyne	HRH2	29	44
CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1CN2C(=O)NCc1ncccc1F	ZINC000875412240	FE	On-Demand	Anodyne	GPR119	20	40
CO[C@@H]1CC[C@@H](C)N(C(=O)NCc2ncccc2F)C1	ZINC000875412273	CD	On-Demand	Anodyne	HCRTR2	34	40
COCCCOc1cccc(CNC(=O)N2CC(O)(C(=O)OC)C2)c1	ZINC000875412286	FC	On-Demand	Anodyne	HRH2	31	42
COCCCOc1cccc(CNC(=O)N2CC(O)(C(=O)OC)C2)c1	ZINC000875412286	FC	On-Demand	Anodyne	ROCK2	25	42
COCCCOc1cccc(CNC(=O)N2CC(O)(C(=O)OC)C2)c1	ZINC000875412286	FC	On-Demand	Anodyne	PDS	40	34
COCCCOc1cccc(CNC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875412295	DD	On-Demand	Anodyne	HRH2	30	45
COCCCOc1cccc(CNC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875412295	DD	On-Demand	Anodyne	GRIN2B	18	42
COCCCOc1cccc(CNC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875412295	DD	On-Demand	Anodyne	ROCK2	26	45
COCCCOc1cccc(CNC(=O)NC[C@H]2C[C@H](O)C2)c1	ZINC000875412295	DD	On-Demand	Anodyne	PDS	57	36
COCCCOc1cccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875412307	FE	On-Demand	Anodyne	HRH2	38	40
COCCCOc1cccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875412307	FE	On-Demand	Anodyne	PDS	42	35
COCCCOc1cccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875412308	FE	On-Demand	Anodyne	HRH2	38	40
COCCCOc1cccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875412308	FE	On-Demand	Anodyne	PDS	42	35
Cc1cc(C(F)(F)F)nc(C(=O)N(CC(F)(F)F)C2CCCC2)n1	ZINC000875412333	FH	On-Demand	Anodyne	ACE	45	32
CC[C@H]1CN(C(=O)C2CC2)CC[C@@H]1NC(=O)NC1CC(Nc2ccccc2)C1	ZINC000875412361	GF	On-Demand	Anodyne	EPHX2	30	47
CC[C@H]1CN(C(=O)C2CC2)CC[C@H]1NC(=O)NC1CC(Nc2ccccc2)C1	ZINC000875412362	GF	On-Demand	Anodyne	EPHX2	30	47
COC1([C@@H](C)NC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)CCC1	ZINC000875412384	GE	On-Demand	Anodyne	ETHR	41	43
COC1([C@H](C)NC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)CCC1	ZINC000875412385	GE	On-Demand	Anodyne	ETHR	41	43
COCC1CCC(NC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000875412450	FE	On-Demand	Anodyne	OXTR	50	37
COCC1CCC(NC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000875412450	FE	On-Demand	Anodyne	NPY5R	25	40
COCC1CCC(NC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000875412451	FE	On-Demand	Anodyne	OXTR	50	37
COCC1CCC(NC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000875412451	FE	On-Demand	Anodyne	NPY5R	25	40
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ncccc2F)CC1	ZINC000875412491	FH	On-Demand	Anodyne	ADRA1A	20	42
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ncccc2F)CC1	ZINC000875412491	FH	On-Demand	Anodyne	ADRA1B	15	42
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ncccc2F)CC1	ZINC000875412491	FH	On-Demand	Anodyne	GRIN2B	15	42
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ncccc2F)CC1	ZINC000875412491	FH	On-Demand	Anodyne	EPHX2	21	46
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ncccc2F)CC1	ZINC000875412491	FH	On-Demand	Anodyne	RBP4	51	43
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ncccc2F)CC1	ZINC000875412491	FH	On-Demand	Anodyne	CALCRL	40	36
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ncccc2F)CC1	ZINC000875412491	FH	On-Demand	Anodyne	ACKR3	45	32
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ncccc2F)CC1	ZINC000875412493	FH	On-Demand	Anodyne	ADRA1A	20	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ncccc2F)CC1	ZINC000875412493	FH	On-Demand	Anodyne	ADRA1B	15	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ncccc2F)CC1	ZINC000875412493	FH	On-Demand	Anodyne	GRIN2B	15	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ncccc2F)CC1	ZINC000875412493	FH	On-Demand	Anodyne	EPHX2	21	46
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ncccc2F)CC1	ZINC000875412493	FH	On-Demand	Anodyne	RBP4	51	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ncccc2F)CC1	ZINC000875412493	FH	On-Demand	Anodyne	CALCRL	40	36
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ncccc2F)CC1	ZINC000875412493	FH	On-Demand	Anodyne	ACKR3	45	32
CS[C@H](C)CNC(=O)NNc1cccc(C)n1	ZINC000875412512	CD	On-Demand	Reactive	GRM5	17	40
CC(=O)C1CCN(C(=O)N[C@@H](CC2CCCC2)c2ccccc2)CC1	ZINC000875412542	EI	On-Demand	Anodyne	CACNA1B	18	40
CC(=O)C1CCN(C(=O)N[C@@H](CC2CCCC2)c2ccccc2)CC1	ZINC000875412542	EI	On-Demand	Anodyne	CCR5	37	44
CC(=O)C1CCN(C(=O)N[C@@H](CC2CCCC2)c2ccccc2)CC1	ZINC000875412542	EI	On-Demand	Anodyne	REN	42	42
CC(=O)C1CCN(C(=O)N[C@H](CC2CCCC2)c2ccccc2)CC1	ZINC000875412551	EI	On-Demand	Anodyne	CACNA1B	18	40
CC(=O)C1CCN(C(=O)N[C@H](CC2CCCC2)c2ccccc2)CC1	ZINC000875412551	EI	On-Demand	Anodyne	CCR5	37	44
CC(=O)C1CCN(C(=O)N[C@H](CC2CCCC2)c2ccccc2)CC1	ZINC000875412551	EI	On-Demand	Anodyne	REN	42	42
CN1CC[C@H]2CN(C(=O)NCc3ncccc3F)CC[C@@H]21	ZINC000875412561	CD	On-Demand	Anodyne	CALCRL	46	37
CN1CC[C@H]2CN(C(=O)NCc3ncccc3F)CC[C@H]21	ZINC000875412564	CD	On-Demand	Anodyne	CALCRL	46	37
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCc1ncccc1F)CC2	ZINC000875412605	EE	On-Demand	Anodyne	P2RY14	43	33
CC(=O)C1CCN(C(=O)NCc2ncccc2F)CC1	ZINC000875412630	CD	On-Demand	Anodyne	EPHX2	30	45
CC(=O)C1CCN(C(=O)NCc2ncccc2F)CC1	ZINC000875412630	CD	On-Demand	Anodyne	CALCRL	43	35
COCCCOc1cccc(CNC(=O)N2CCN(C)C(C)(C)CC2)c1	ZINC000875412651	FF	On-Demand	Anodyne	HRH2	34	41
COCCCOc1cccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875412691	GH	On-Demand	Anodyne	HRH2	34	41
COCCCOc1cccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875412691	GH	On-Demand	Anodyne	EPHX2	27	41
COCCCOc1cccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875412691	GH	On-Demand	Anodyne	CHRNA10	43	36
COCCCOc1cccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875412692	GH	On-Demand	Anodyne	HRH2	34	41
COCCCOc1cccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875412692	GH	On-Demand	Anodyne	EPHX2	27	41
COCCCOc1cccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875412692	GH	On-Demand	Anodyne	CHRNA10	43	36
COCCCOc1cccc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875412697	FF	On-Demand	Anodyne	FKBP1A	18	40
COCCCOc1cccc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875412697	FF	On-Demand	Anodyne	HRH2	40	41
COCCCOc1cccc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875412697	FF	On-Demand	Anodyne	HRH3	18	47
COCCCOc1cccc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875412697	FF	On-Demand	Anodyne	REN	24	44
COCCCOc1cccc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875412697	FF	On-Demand	Anodyne	EPHX2	17	40
COCCCOc1cccc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875412697	FF	On-Demand	Anodyne	CHRNA10	44	36
COCCCOc1cccc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875412698	FF	On-Demand	Anodyne	FKBP1A	18	40
COCCCOc1cccc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875412698	FF	On-Demand	Anodyne	HRH2	40	41
COCCCOc1cccc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875412698	FF	On-Demand	Anodyne	HRH3	18	47
COCCCOc1cccc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875412698	FF	On-Demand	Anodyne	REN	24	44
COCCCOc1cccc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875412698	FF	On-Demand	Anodyne	EPHX2	17	40
COCCCOc1cccc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875412698	FF	On-Demand	Anodyne	CHRNA10	44	36
Cc1cncc([C@@H]2CCCN2C(=O)NC2CCC(OC(C)C)CC2)c1	ZINC000875412778	EH	On-Demand	Anodyne	SSTR5	30	41
Cc1cncc([C@H]2CCCN2C(=O)NC2CCC(OC(C)C)CC2)c1	ZINC000875412779	EH	On-Demand	Anodyne	SSTR5	30	41
CS[C@H](C)CNC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O	ZINC000875412863	ED	On-Demand	Anodyne	GPR119	27	40
CS[C@H](C)CNC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O	ZINC000875412864	ED	On-Demand	Anodyne	GPR119	27	40
CS[C@H](C)CNC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O	ZINC000875412865	ED	On-Demand	Anodyne	GPR119	27	40
CS[C@H](C)CNC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O	ZINC000875412866	ED	On-Demand	Anodyne	GPR119	27	40
C[C@]1(NC(=O)C(F)(F)F)CCN(C(=O)NCc2ncccc2F)C1	ZINC000875412876	ED	On-Demand	Anodyne	EPHX2	25	40
CONC(=O)C1CCN(C(=O)N[C@@H](CC2CCCC2)c2ccccc2)CC1	ZINC000875412893	FG	On-Demand	Anodyne	F2	24	40
CONC(=O)C1CCN(C(=O)N[C@@H](CC2CCCC2)c2ccccc2)CC1	ZINC000875412893	FG	On-Demand	Anodyne	CCR5	29	42
CONC(=O)C1CCN(C(=O)N[C@@H](CC2CCCC2)c2ccccc2)CC1	ZINC000875412893	FG	On-Demand	Anodyne	AMY2	47	33
CONC(=O)C1CCN(C(=O)N[C@@H](CC2CCCC2)c2ccccc2)CC1	ZINC000875412893	FG	On-Demand	Anodyne	REN	50	45
CONC(=O)C1CCN(C(=O)N[C@H](CC2CCCC2)c2ccccc2)CC1	ZINC000875412895	FG	On-Demand	Anodyne	F2	24	40
CONC(=O)C1CCN(C(=O)N[C@H](CC2CCCC2)c2ccccc2)CC1	ZINC000875412895	FG	On-Demand	Anodyne	CCR5	29	42
CONC(=O)C1CCN(C(=O)N[C@H](CC2CCCC2)c2ccccc2)CC1	ZINC000875412895	FG	On-Demand	Anodyne	AMY2	47	33
CONC(=O)C1CCN(C(=O)N[C@H](CC2CCCC2)c2ccccc2)CC1	ZINC000875412895	FG	On-Demand	Anodyne	REN	50	45
O=C(NCc1ncccc1F)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875412938	ED	On-Demand	Anodyne	ETHR	62	37
O=C(NCc1ncccc1F)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875412940	ED	On-Demand	Anodyne	ETHR	62	37
CC(=O)N[C@H](CC(C)C)C(=O)N(C)C1CCC(NC(=O)OC(C)(C)C)CC1	ZINC000875412975	GF	On-Demand	Anodyne	POLG_HCV1	18	40
CC(=O)N[C@H](CC(C)C)C(=O)N(C)C1CCC(NC(=O)OC(C)(C)C)CC1	ZINC000875412975	GF	On-Demand	Anodyne	FPR1	45	36
CC(=O)N1CCC[C@@H]1C(=O)Oc1ccc(N2CCCC2)cc1	ZINC000875413013	DE	On-Demand	Anodyne	FKBP1A	46	35
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H]3CS[C@@H](C)C3)CC2)c(OC)c1	ZINC000875413040	GD	On-Demand	Clean	DRD2	16	41
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H]3CS[C@@H](C)C3)CC2)c(OC)c1	ZINC000875413040	GD	On-Demand	Clean	NPBWR1	43	32
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H]3CS[C@H](C)C3)CC2)c(OC)c1	ZINC000875413041	GD	On-Demand	Clean	DRD2	16	41
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H]3CS[C@H](C)C3)CC2)c(OC)c1	ZINC000875413041	GD	On-Demand	Clean	NPBWR1	43	32
COc1ccc(N2CCN(C(=O)C(=O)N[C@H]3CS[C@@H](C)C3)CC2)c(OC)c1	ZINC000875413042	GD	On-Demand	Clean	DRD2	16	41
COc1ccc(N2CCN(C(=O)C(=O)N[C@H]3CS[C@@H](C)C3)CC2)c(OC)c1	ZINC000875413042	GD	On-Demand	Clean	NPBWR1	43	32
COc1ccc(N2CCN(C(=O)C(=O)N[C@H]3CS[C@H](C)C3)CC2)c(OC)c1	ZINC000875413043	GD	On-Demand	Clean	DRD2	16	41
COc1ccc(N2CCN(C(=O)C(=O)N[C@H]3CS[C@H](C)C3)CC2)c(OC)c1	ZINC000875413043	GD	On-Demand	Clean	NPBWR1	43	32
CN1CC[C@@H](CNC(=O)C(=O)NCC2CC=CC2)[C@@H]1c1cccnc1	ZINC000875413075	ED	On-Demand	Anodyne	CHRNA7	31	41
CN1CC[C@@H](CNC(=O)C(=O)NCC2CC=CC2)[C@@H]1c1cccnc1	ZINC000875413075	ED	On-Demand	Anodyne	ACHP_LYMST	16	41
COc1ccc(N2CCN(C(=O)NCc3ncccc3F)CC2)c(OC)c1	ZINC000875413102	FE	On-Demand	Clean	HTR1A	53	45
COc1ccc(N2CCN(C(=O)NCc3ncccc3F)CC2)c(OC)c1	ZINC000875413102	FE	On-Demand	Clean	DRD2	45	43
COc1ccc(N2CCN(C(=O)NCc3ncccc3F)CC2)c(OC)c1	ZINC000875413102	FE	On-Demand	Clean	DRD4	45	35
COc1ccc(N2CCN(C(=O)NCc3ncccc3F)CC2)c(OC)c1	ZINC000875413102	FE	On-Demand	Clean	ADRA1D	40	45
COc1ccc(N2CCN(C(=O)NCc3ncccc3F)CC2)c(OC)c1	ZINC000875413102	FE	On-Demand	Clean	HTR1D	16	45
COc1ccc(N2CCN(C(=O)NCc3ncccc3F)CC2)c(OC)c1	ZINC000875413102	FE	On-Demand	Clean	HTR1B	18	45
COc1ccc(N2CCN(C(=O)NCc3ncccc3F)CC2)c(OC)c1	ZINC000875413102	FE	On-Demand	Clean	ADRA1A	39	45
COc1ccc(N2CCN(C(=O)NCc3ncccc3F)CC2)c(OC)c1	ZINC000875413102	FE	On-Demand	Clean	DRD3	62	40
COc1ccc(N2CCN(C(=O)NCc3ncccc3F)CC2)c(OC)c1	ZINC000875413102	FE	On-Demand	Clean	P2RY12	15	43
COc1ccc(N2CCN(C(=O)NCc3ncccc3F)CC2)c(OC)c1	ZINC000875413102	FE	On-Demand	Clean	PDGFRB	75	43
COc1ccc(N2CCN(C(=O)NCc3ncccc3F)CC2)c(OC)c1	ZINC000875413102	FE	On-Demand	Clean	HTR7	45	41
COc1ccc(N2CCN(C(=O)NCc3ncccc3F)CC2)c(OC)c1	ZINC000875413102	FE	On-Demand	Clean	NPY2R	26	40
COc1ccc(N2CCN(C(=O)NCc3ncccc3F)CC2)c(OC)c1	ZINC000875413102	FE	On-Demand	Clean	RBP4	20	44
COCCCOc1cccc(CNC(=O)NC2CC(C(=O)OC)C2)c1	ZINC000875413131	FD	On-Demand	Anodyne	HRH2	40	49
COCCCOc1cccc(CNC(=O)NC2CC(C(=O)OC)C2)c1	ZINC000875413131	FD	On-Demand	Anodyne	ROCK2	28	46
COCCCOc1cccc(CNC(=O)NC2CC(C(=O)OC)C2)c1	ZINC000875413131	FD	On-Demand	Anodyne	EPHX2	24	40
COCCCOc1cccc(CNC(=O)NC2CC(C(=O)OC)C2)c1	ZINC000875413131	FD	On-Demand	Anodyne	PDS	50	35
CCOc1cccc([C@H](CC)OC(=O)COCc2ccnc(O)c2)c1	ZINC000875413137	EG	On-Demand	Anodyne	PDS	50	34
COC(=O)[C@@]12C[C@@H](NC(=O)NC3CCC(OC(C)C)CC3)C[C@@H]1C2	ZINC000875413151	EE	On-Demand	Anodyne	EPHX2	22	40
O=C(Nc1ccccc1C(=O)NCCCN1CCCCCC1=O)c1cccs1	ZINC000875413184	GH	On-Demand	Anodyne	TYRO3	20	42
CC[C@H]1CN(C(=O)C2CC2)CC[C@@H]1NC(=O)NC1CC(C(=O)OC)C1	ZINC000875413199	FD	On-Demand	Anodyne	EPHX2	19	40
CC[C@H]1CN(C(=O)C2CC2)CC[C@H]1NC(=O)NC1CC(C(=O)OC)C1	ZINC000875413200	FD	On-Demand	Anodyne	EPHX2	19	40
O=CN1CCCN(C(=O)N[C@@H](CC2CCCC2)c2ccccc2)CC1	ZINC000875413211	EG	On-Demand	Anodyne	REN	25	43
O=CN1CCCN(C(=O)N[C@H](CC2CCCC2)c2ccccc2)CC1	ZINC000875413213	EG	On-Demand	Anodyne	REN	25	43
O=C(NCc1ncccc1F)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875413303	EG	On-Demand	Anodyne	C3AR1	40	39
O=C(NCc1ncccc1F)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875413304	EG	On-Demand	Anodyne	C3AR1	40	39
N#Cc1cc(F)ccc1N1CCN(C(=O)NCc2ncccc2F)CC1	ZINC000875413313	FE	On-Demand	Mild	P2RY12	20	49
CS[C@H](C)CNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875413327	DE	On-Demand	Anodyne	CTSV	29	40
CS[C@H](C)CNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875413327	DE	On-Demand	Anodyne	PDS	51	38
CS[C@H](C)CNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875413328	DE	On-Demand	Anodyne	CTSV	29	40
CS[C@H](C)CNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875413328	DE	On-Demand	Anodyne	PDS	51	38
CC(=O)C1CCN(C(=O)NCCNS(=O)(=O)c2ccc(Cl)s2)CC1	ZINC000875413375	GD	On-Demand	Anodyne	CCR4	43	34
CONC(=O)C1CCN(C(=O)NCc2ncccc2F)CC1	ZINC000875413376	DC	On-Demand	Anodyne	EPHX2	32	45
O=C(NCCO)C1CCN(C(=O)N[C@@H](CC2CCCC2)c2ccccc2)CC1	ZINC000875413377	GF	On-Demand	Anodyne	CCR5	22	40
O=C(NCCO)C1CCN(C(=O)N[C@H](CC2CCCC2)c2ccccc2)CC1	ZINC000875413379	GF	On-Demand	Anodyne	CCR5	22	40
O=C(NC1CCN(C(=O)NCc2ncccc2F)CC1)OCc1ccccc1	ZINC000875413387	GF	On-Demand	Anodyne	GRIN2B	29	44
O=C(NC1CCN(C(=O)NCc2ncccc2F)CC1)OCc1ccccc1	ZINC000875413387	GF	On-Demand	Anodyne	CTSK	18	48
O=C(NC1CCN(C(=O)NCc2ncccc2F)CC1)OCc1ccccc1	ZINC000875413387	GF	On-Demand	Anodyne	CTSL	18	48
O=C(NC1CCN(C(=O)NCc2ncccc2F)CC1)OCc1ccccc1	ZINC000875413387	GF	On-Demand	Anodyne	C3AR1	38	40
O=C(NC1CCN(C(=O)NCc2ncccc2F)CC1)OCc1ccccc1	ZINC000875413387	GF	On-Demand	Anodyne	EPHX2	49	43
O=C(NC1CCN(C(=O)NCc2ncccc2F)CC1)OCc1ccccc1	ZINC000875413387	GF	On-Demand	Anodyne	TGM2	30	41
O=C(NC1CCN(C(=O)NCc2ncccc2F)CC1)OCc1ccccc1	ZINC000875413387	GF	On-Demand	Anodyne	F13A1	18	41
CCOc1cccc([C@@H](CC)OC(=O)COCc2ccnc(O)c2)c1	ZINC000875413449	EG	On-Demand	Anodyne	PDS	50	34
CCOc1cccc([C@@H](CC)OC(=O)[C@@H](NC=O)C(C)C)c1	ZINC000875413459	DF	On-Demand	Anodyne	PDS	72	39
CCOc1cccc([C@H](CC)OC(=O)[C@@H](NC=O)C(C)C)c1	ZINC000875413460	DF	On-Demand	Anodyne	PDS	72	39
N#Cc1cc(C(=O)N(CC(F)(F)F)C2CCCC2)co1	ZINC000875413465	CG	On-Demand	Mild	ACE	40	33
COCCCOc1cccc(CNC(=O)N2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000875413468	GF	On-Demand	Anodyne	PDS	41	36
COCCCOc1cccc(CNC(=O)N2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000875413469	GF	On-Demand	Anodyne	PDS	41	36
CCOc1cccc([C@H](CC)OC(=O)C2(F)CCOCC2)c1	ZINC000875413483	DH	On-Demand	Anodyne	PDS	59	34
CCOc1cccc([C@@H](CC)OC(=O)C2(F)CCOCC2)c1	ZINC000875413484	DH	On-Demand	Anodyne	PDS	59	34
COCCN(CC1CCN(C)CC1)C(=O)NCc1ncccc1F	ZINC000875413510	ED	On-Demand	Anodyne	ACKR3	49	32
COCCCOc1cccc(CNC(=O)NNc2cccc(C)n2)c1	ZINC000875413513	EF	On-Demand	Reactive	ROCK2	31	48
COCCCOc1cccc(CNC(=O)NNc2cccc(C)n2)c1	ZINC000875413513	EF	On-Demand	Reactive	PDS	48	34
CC(=O)Nc1cccc2c1CN(C(=O)NCc1ncccc1F)CC2	ZINC000875413531	EE	On-Demand	Anodyne	P2RY14	43	33
COCCCOc1cccc(CNC(=O)NC[C@@H]2CC(C(F)(F)F)=NO2)c1	ZINC000875413532	GF	On-Demand	Anodyne	PDS	42	38
COCCCOc1cccc(CNC(=O)NC[C@H]2CC(C(F)(F)F)=NO2)c1	ZINC000875413533	GF	On-Demand	Anodyne	PDS	42	38
O=C(Cc1ccc(OCc2ccncc2)cc1)N(CC(F)(F)F)C1CCC1	ZINC000875413563	GI	On-Demand	Anodyne	SLC6A5	32	40
COCC1CCC(NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875413614	GF	On-Demand	Anodyne	C3AR1	41	42
COCC1CCC(NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875413615	GF	On-Demand	Anodyne	C3AR1	41	42
CS[C@H](C)CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875413723	EG	On-Demand	Mild	CTSF	63	36
CS[C@H](C)CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875413723	EG	On-Demand	Mild	CTSK	29	42
CS[C@H](C)CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875413723	EG	On-Demand	Mild	CTSL	23	42
CS[C@H](C)CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875413723	EG	On-Demand	Mild	CTSS	16	42
CS[C@H](C)CNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875413726	EG	On-Demand	Mild	CTSF	63	36
CS[C@H](C)CNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875413726	EG	On-Demand	Mild	CTSK	29	42
CS[C@H](C)CNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875413726	EG	On-Demand	Mild	CTSL	23	42
CS[C@H](C)CNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875413726	EG	On-Demand	Mild	CTSS	16	42
COCCCOc1cccc(CNC(=O)N2CCCN(C=O)CC2)c1	ZINC000875413752	ED	On-Demand	Anodyne	HRH2	44	44
COCCCOc1cccc(CNC(=O)N2CCCN(C=O)CC2)c1	ZINC000875413752	ED	On-Demand	Anodyne	DPP7	17	40
COCCCOc1cccc(CNC(=O)N2CCCN(C=O)CC2)c1	ZINC000875413752	ED	On-Demand	Anodyne	PDS	49	35
CO[C@@](C)(C1CC1)[C@H](C)NC(=O)C(=O)N(C)[C@@H](C)c1ccccc1C	ZINC000875413781	EF	On-Demand	Anodyne	AMY2	45	32
CO[C@@](C)(C1CC1)[C@@H](C)NC(=O)C(=O)N(C)[C@@H](C)c1ccccc1C	ZINC000875413782	EF	On-Demand	Anodyne	AMY2	45	32
O=C(c1cccn(C2CC2)c1=O)N(CC(F)(F)F)C1CCC1	ZINC000875413915	DF	On-Demand	Anodyne	ACE	30	40
O=C(N[C@H](CC1CCCC1)c1ccccc1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875413929	GG	On-Demand	Anodyne	CCR5	24	41
O=C(N[C@H](CC1CCCC1)c1ccccc1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875413929	GG	On-Demand	Anodyne	REN	24	41
O=C(N[C@H](CC1CCCC1)c1ccccc1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875413933	GG	On-Demand	Anodyne	CCR5	24	41
O=C(N[C@H](CC1CCCC1)c1ccccc1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875413933	GG	On-Demand	Anodyne	REN	24	41
O=C(N[C@H](CC1CCCC1)c1ccccc1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875413936	GG	On-Demand	Anodyne	CCR5	24	41
O=C(N[C@H](CC1CCCC1)c1ccccc1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875413936	GG	On-Demand	Anodyne	REN	24	41
O=C(N[C@H](CC1CCCC1)c1ccccc1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875413939	GG	On-Demand	Anodyne	CCR5	24	41
O=C(N[C@H](CC1CCCC1)c1ccccc1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875413939	GG	On-Demand	Anodyne	REN	24	41
O=C(N[C@@H](CC1CCCC1)c1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875413972	FG	On-Demand	Anodyne	REN	25	40
O=C(N[C@@H](CC1CCCC1)c1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875413972	FG	On-Demand	Anodyne	CTSS	16	47
O=C(N[C@H](CC1CCCC1)c1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875413974	FG	On-Demand	Anodyne	REN	25	40
O=C(N[C@H](CC1CCCC1)c1ccccc1)N1CCC(CO)(CO)CC1	ZINC000875413974	FG	On-Demand	Anodyne	CTSS	16	47
CO[C@@H]1CC[C@@H](C)N(C(=O)NCc2ccnc(OC(C)C)c2)C1	ZINC000875414042	DF	On-Demand	Anodyne	HCRTR1	21	43
CO[C@@H]1CC[C@@H](C)N(C(=O)NCc2ccnc(OC(C)C)c2)C1	ZINC000875414042	DF	On-Demand	Anodyne	HCRTR2	34	43
CN1CCN(C2CCN(C(=O)N[C@H](CC3CCCC3)c3ccccc3)CC2)CC1	ZINC000875414108	GH	On-Demand	Anodyne	CCR5	38	48
CN1CCN(C2CCN(C(=O)N[C@H](CC3CCCC3)c3ccccc3)CC2)CC1	ZINC000875414108	GH	On-Demand	Anodyne	L3MBTL3	77	42
CN1CCN(C2CCN(C(=O)N[C@@H](CC3CCCC3)c3ccccc3)CC2)CC1	ZINC000875414109	GH	On-Demand	Anodyne	CCR5	38	48
CN1CCN(C2CCN(C(=O)N[C@@H](CC3CCCC3)c3ccccc3)CC2)CC1	ZINC000875414109	GH	On-Demand	Anodyne	L3MBTL3	77	42
COc1ccc([C@@H](NC(=O)N2CCC(C(C)=O)CC2)c2ccccc2OC)cc1	ZINC000875414139	GH	On-Demand	Anodyne	CHRM2	44	36
COc1ccc([C@H](NC(=O)N2CCC(C(C)=O)CC2)c2ccccc2OC)cc1	ZINC000875414140	GH	On-Demand	Anodyne	CHRM2	44	36
O=C(NCc1ncccc1F)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875414170	EG	On-Demand	Anodyne	CPT1A	42	38
O=C(NCc1ncccc1F)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875414171	EG	On-Demand	Anodyne	CPT1A	42	38
O=C(NCc1ncccc1F)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875414172	EG	On-Demand	Anodyne	CPT1A	42	38
O=C(NCc1ncccc1F)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875414173	EG	On-Demand	Anodyne	CPT1A	42	38
COC(=O)c1cc(C(=O)N(CC(F)(F)F)C2CCC2)ccc1C	ZINC000875414188	EG	On-Demand	Anodyne	ACE	47	34
O=C(NCc1ncccc1F)N1CCC[C@H](OC2CCC2)CC1	ZINC000875414195	DF	On-Demand	Anodyne	EPHX2	28	52
O=C(NCc1ncccc1F)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875414197	DF	On-Demand	Anodyne	EPHX2	28	52
COc1cccc([C@H](O)C2CCN(C(=O)NCc3ncccc3F)CC2)c1	ZINC000875414201	FF	On-Demand	Anodyne	DRD4	42	33
COc1cccc([C@H](O)C2CCN(C(=O)NCc3ncccc3F)CC2)c1	ZINC000875414201	FF	On-Demand	Anodyne	EPHX2	16	41
CCOc1cccc([C@H](CC)OC(=O)[C@H](NC(C)=O)C(C)C)c1	ZINC000875414265	DG	On-Demand	Anodyne	ACACA	17	40
CCOc1cccc([C@H](CC)OC(=O)[C@H](NC(C)=O)C(C)C)c1	ZINC000875414265	DG	On-Demand	Anodyne	ACACB	19	49
CCOc1cccc([C@H](CC)OC(=O)[C@H](NC(C)=O)C(C)C)c1	ZINC000875414265	DG	On-Demand	Anodyne	MTNR1A	15	43
CCOc1cccc([C@H](CC)OC(=O)[C@H](NC(C)=O)C(C)C)c1	ZINC000875414265	DG	On-Demand	Anodyne	PDS	73	42
CCOc1cccc([C@@H](CC)OC(=O)[C@H](NC(C)=O)C(C)C)c1	ZINC000875414266	DG	On-Demand	Anodyne	ACACA	17	40
CCOc1cccc([C@@H](CC)OC(=O)[C@H](NC(C)=O)C(C)C)c1	ZINC000875414266	DG	On-Demand	Anodyne	ACACB	19	49
CCOc1cccc([C@@H](CC)OC(=O)[C@H](NC(C)=O)C(C)C)c1	ZINC000875414266	DG	On-Demand	Anodyne	MTNR1A	15	43
CCOc1cccc([C@@H](CC)OC(=O)[C@H](NC(C)=O)C(C)C)c1	ZINC000875414266	DG	On-Demand	Anodyne	PDS	73	42
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H]1CS[C@H](C)C1)CC2	ZINC000875414301	GE	On-Demand	Anodyne	SLC18A2	46	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H]1CS[C@H](C)C1)CC2	ZINC000875414302	GE	On-Demand	Anodyne	SLC18A2	46	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H]1CS[C@@H](C)C1)CC2	ZINC000875414303	GE	On-Demand	Anodyne	SLC18A2	46	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H]1CS[C@@H](C)C1)CC2	ZINC000875414304	GE	On-Demand	Anodyne	SLC18A2	46	35
COCCCOc1cccc(CNC(=O)NC2(C)CC(F)(F)C2)c1	ZINC000875414312	EG	On-Demand	Anodyne	HRH2	30	42
COCCCOc1cccc(CNC(=O)NC2(C)CC(F)(F)C2)c1	ZINC000875414312	EG	On-Demand	Anodyne	MMP13	16	40
COCCCOc1cccc(CNC(=O)NC2(C)CC(F)(F)C2)c1	ZINC000875414312	EG	On-Demand	Anodyne	ROCK2	26	45
COCCCOc1cccc(CNC(=O)NC2(C)CC(F)(F)C2)c1	ZINC000875414312	EG	On-Demand	Anodyne	PDS	53	37
COCCCOc1cccc(CNC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)c1	ZINC000875414313	GE	On-Demand	Anodyne	SLC6A3	43	39
COCCCOc1cccc(CNC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)c1	ZINC000875414313	GE	On-Demand	Anodyne	ROCK2	22	40
COCCCOc1cccc(CNC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)c1	ZINC000875414314	GE	On-Demand	Anodyne	SLC6A3	43	39
COCCCOc1cccc(CNC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)c1	ZINC000875414314	GE	On-Demand	Anodyne	ROCK2	22	40
O=C(NCc1ncccc1F)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875414415	EE	On-Demand	Anodyne	FAAH	21	44
O=C(NCc1ncccc1F)N1CCC[C@](F)(c2ccccc2)C1	ZINC000875414441	EG	On-Demand	Anodyne	EPHX2	23	49
O=C(NCc1ncccc1F)N1CCC[C@@](F)(c2ccccc2)C1	ZINC000875414442	EG	On-Demand	Anodyne	EPHX2	23	49
O=C(NCc1ncccc1F)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875414443	GG	On-Demand	Anodyne	CALCRL	46	40
O=C(NCc1ncccc1F)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875414468	EE	On-Demand	Anodyne	EPHX2	23	49
O=C(NCc1ncccc1F)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875414469	EE	On-Demand	Anodyne	EPHX2	23	49
CCOc1cccc([C@@H](CC)OC(=O)[C@]2(C)CCC(=O)N2)c1	ZINC000875414488	DF	On-Demand	Anodyne	PDS	44	34
CCOc1cccc([C@H](CC)OC(=O)[C@]2(C)CCC(=O)N2)c1	ZINC000875414489	DF	On-Demand	Anodyne	PDS	44	34
COCCCOc1cccc(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@@H]23)c1	ZINC000875414493	EF	On-Demand	Anodyne	HRH2	27	40
COCCCOc1cccc(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@@H]32)c1	ZINC000875414494	EF	On-Demand	Anodyne	HRH2	27	40
COCCCOc1cccc(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@@H]2C[C@H]32)c1	ZINC000875414495	EF	On-Demand	Anodyne	HRH2	27	40
COCCCOc1cccc(CNC(=O)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C[C@H]23)c1	ZINC000875414496	EF	On-Demand	Anodyne	HRH2	27	40
COCCCOc1cccc(CNC(=O)NN=c2cc[nH]cc2C)c1	ZINC000875414508	EE	On-Demand	Reactive	ROCK1	17	44
COCCCOc1cccc(CNC(=O)NN=c2cc[nH]cc2C)c1	ZINC000875414508	EE	On-Demand	Reactive	ROCK2	24	44
Cn1cc(-c2ccc(C(=O)N(CC(F)(F)F)C3CCCC3)cc2)cn1	ZINC000875414509	FI	On-Demand	Anodyne	ACE	32	41
CCOC1CC2(C1)C[C@H]2C(=O)N(CC(F)F)c1ccccc1	ZINC000875414510	DG	On-Demand	Anodyne	TIMP3	56	31
O=C(NCc1ncccc1F)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875414519	EG	On-Demand	Anodyne	RBP4	52	32
CCO[C@H](C(=O)N(CC(F)F)c1ccccc1)C1CCOCC1	ZINC000875414524	EG	On-Demand	Anodyne	AMY2	43	30
CCO[C@@H](C(=O)N(CC(F)F)c1ccccc1)C1CCOCC1	ZINC000875414525	EG	On-Demand	Anodyne	AMY2	43	30
O=C(Cc1ccc2cccnc2c1)N(CC(F)(F)F)C1CCC1	ZINC000875414538	DH	On-Demand	Anodyne	CDK5	15	41
COC1([C@@H](C)NC(=O)C(=O)NCc2nc(-c3ccncc3)cs2)CCC1	ZINC000875414574	FD	On-Demand	Anodyne	ROCK1	24	40
COC1([C@@H](C)NC(=O)C(=O)NCc2nc(-c3ccncc3)cs2)CCC1	ZINC000875414574	FD	On-Demand	Anodyne	ROCK2	17	41
COC1([C@H](C)NC(=O)C(=O)NCc2nc(-c3ccncc3)cs2)CCC1	ZINC000875414575	FD	On-Demand	Anodyne	ROCK1	24	40
COC1([C@H](C)NC(=O)C(=O)NCc2nc(-c3ccncc3)cs2)CCC1	ZINC000875414575	FD	On-Demand	Anodyne	ROCK2	17	41
CCCCCCCNC(=O)C(=O)NCc1cnccc1C(C)(C)C	ZINC000875414588	EG	On-Demand	Mild	ASAH1	69	33
CCO[C@H]1COCC[C@@H]1CC(=O)N(CC(F)F)c1ccccc1	ZINC000875414671	EG	On-Demand	Anodyne	TIMP3	60	31
CCO[C@H]1COCC[C@H]1CC(=O)N(CC(F)F)c1ccccc1	ZINC000875414673	EG	On-Demand	Anodyne	TIMP3	60	31
COCCCOc1cccc(CNC(=O)N2CC[C@]3(C(=O)OC)CCC[C@H]23)c1	ZINC000875414687	GF	On-Demand	Anodyne	HRH2	35	41
COCCCOc1cccc(CNC(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875414703	FD	On-Demand	Anodyne	HRH2	36	45
COCCCOc1cccc(CNC(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875414703	FD	On-Demand	Anodyne	ROCK2	22	42
COCCCOc1cccc(CNC(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875414703	FD	On-Demand	Anodyne	PDS	50	36
COCCCOc1cccc(CNC(=O)N2CCCCCCNC(=O)CC2)c1	ZINC000875414704	GF	On-Demand	Anodyne	HRH2	49	45
CC(C)(C)OC(=O)N1C[C@]2(C)CN(C(=O)NCc3ncccc3F)C[C@]2(C)C1	ZINC000875414709	GG	On-Demand	Anodyne	GPR119	32	41
COCCCOc1cccc(CNC(=O)NN=c2cc[nH]c(C)c2)c1	ZINC000875414710	EE	On-Demand	Reactive	ROCK1	16	46
COCCCOc1cccc(CNC(=O)NN=c2cc[nH]c(C)c2)c1	ZINC000875414710	EE	On-Demand	Reactive	ROCK2	23	46
CCN1CC[C@H](NC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)C1	ZINC000875414769	EC	On-Demand	Anodyne	FKBP1A	23	41
CCN1CC[C@H](NC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)C1	ZINC000875414770	EC	On-Demand	Anodyne	FKBP1A	23	41
CCN1CC[C@H](NC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)C1	ZINC000875414771	EC	On-Demand	Anodyne	FKBP1A	23	41
CCN1CC[C@H](NC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)C1	ZINC000875414772	EC	On-Demand	Anodyne	FKBP1A	23	41
CCOc1cc(Cl)ccc1CNC(=O)NNc1nnc(C)n1C	ZINC000875414858	EE	On-Demand	Reactive	P2RX7	40	38
CCN1CC[C@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414863	GD	On-Demand	Anodyne	CHRM2	27	44
CCN1CC[C@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414863	GD	On-Demand	Anodyne	CHRM1	27	44
CCN1CC[C@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414863	GD	On-Demand	Anodyne	DRD2	40	52
CCN1CC[C@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414863	GD	On-Demand	Anodyne	DRD4	65	52
CCN1CC[C@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414863	GD	On-Demand	Anodyne	ACHE	67	59
CCN1CC[C@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414863	GD	On-Demand	Anodyne	DRD3	31	47
CCN1CC[C@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414863	GD	On-Demand	Anodyne	SLC6A3	19	47
CCN1CC[C@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414863	GD	On-Demand	Anodyne	HTR4	35	44
CCN1CC[C@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414863	GD	On-Demand	Anodyne	CHRM3	35	44
CCN1CC[C@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414863	GD	On-Demand	Anodyne	LTA4H	19	42
CCN1CC[C@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414863	GD	On-Demand	Anodyne	SIGMAR1	61	51
CCN1CC[C@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414863	GD	On-Demand	Anodyne	SSTR5	50	36
CCN1CC[C@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414863	GD	On-Demand	Anodyne	BCHE	19	48
CCN1CC[C@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414863	GD	On-Demand	Anodyne	CCR3	49	43
CCN1CC[C@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414863	GD	On-Demand	Anodyne	UTS2R	22	40
CCN1CC[C@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414863	GD	On-Demand	Anodyne	CCR2	23	44
CCN1CC[C@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414863	GD	On-Demand	Anodyne	SLC6A5	15	43
CCN1CC[C@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414863	GD	On-Demand	Anodyne	MCHR1	48	47
CCN1CC[C@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414863	GD	On-Demand	Anodyne	CACNA1G	34	41
CCN1CC[C@@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414864	GD	On-Demand	Anodyne	CHRM2	27	44
CCN1CC[C@@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414864	GD	On-Demand	Anodyne	CHRM1	27	44
CCN1CC[C@@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414864	GD	On-Demand	Anodyne	DRD2	40	52
CCN1CC[C@@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414864	GD	On-Demand	Anodyne	DRD4	65	52
CCN1CC[C@@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414864	GD	On-Demand	Anodyne	ACHE	67	59
CCN1CC[C@@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414864	GD	On-Demand	Anodyne	DRD3	31	47
CCN1CC[C@@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414864	GD	On-Demand	Anodyne	SLC6A3	19	47
CCN1CC[C@@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414864	GD	On-Demand	Anodyne	HTR4	35	44
CCN1CC[C@@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414864	GD	On-Demand	Anodyne	CHRM3	35	44
CCN1CC[C@@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414864	GD	On-Demand	Anodyne	LTA4H	19	42
CCN1CC[C@@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414864	GD	On-Demand	Anodyne	SIGMAR1	61	51
CCN1CC[C@@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414864	GD	On-Demand	Anodyne	SSTR5	50	36
CCN1CC[C@@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414864	GD	On-Demand	Anodyne	BCHE	19	48
CCN1CC[C@@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414864	GD	On-Demand	Anodyne	CCR3	49	43
CCN1CC[C@@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414864	GD	On-Demand	Anodyne	UTS2R	22	40
CCN1CC[C@@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414864	GD	On-Demand	Anodyne	CCR2	23	44
CCN1CC[C@@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414864	GD	On-Demand	Anodyne	SLC6A5	15	43
CCN1CC[C@@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414864	GD	On-Demand	Anodyne	MCHR1	48	47
CCN1CC[C@@H](NC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)C1	ZINC000875414864	GD	On-Demand	Anodyne	CACNA1G	34	41
CCN1CC[C@H](NC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000875414871	ED	On-Demand	Anodyne	OXTR	55	38
CCN1CC[C@H](NC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000875414871	ED	On-Demand	Anodyne	SIGMAR1	19	42
CCN1CC[C@H](NC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000875414872	ED	On-Demand	Anodyne	OXTR	55	38
CCN1CC[C@H](NC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000875414872	ED	On-Demand	Anodyne	SIGMAR1	19	42
CCN1CC[C@@H](NC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000875414873	ED	On-Demand	Anodyne	OXTR	55	38
CCN1CC[C@@H](NC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)C1	ZINC000875414873	ED	On-Demand	Anodyne	SIGMAR1	19	42
CCN1CC[C@@H](NC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000875414874	ED	On-Demand	Anodyne	OXTR	55	38
CCN1CC[C@@H](NC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)C1	ZINC000875414874	ED	On-Demand	Anodyne	SIGMAR1	19	42
CCN1CC[C@@H](NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875414910	FD	On-Demand	Anodyne	CHRNA7	42	36
CCN1CC[C@@H](NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875414910	FD	On-Demand	Anodyne	C3AR1	46	44
CCN1CC[C@@H](NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875414910	FD	On-Demand	Anodyne	BIRC2	33	41
CCN1CC[C@@H](NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875414911	FD	On-Demand	Anodyne	CHRNA7	42	36
CCN1CC[C@@H](NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875414911	FD	On-Demand	Anodyne	C3AR1	46	44
CCN1CC[C@@H](NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875414911	FD	On-Demand	Anodyne	BIRC2	33	41
CCN1CC[C@H](NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875414912	FD	On-Demand	Anodyne	CHRNA7	42	36
CCN1CC[C@H](NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875414912	FD	On-Demand	Anodyne	C3AR1	46	44
CCN1CC[C@H](NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875414912	FD	On-Demand	Anodyne	BIRC2	33	41
CCN1CC[C@H](NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875414913	FD	On-Demand	Anodyne	CHRNA7	42	36
CCN1CC[C@H](NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875414913	FD	On-Demand	Anodyne	C3AR1	46	44
CCN1CC[C@H](NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)C1	ZINC000875414913	FD	On-Demand	Anodyne	BIRC2	33	41
CC[C@@H](NC(=O)C(=O)N[C@H]1CCN(CC)C1)c1cccc(OC)c1OC	ZINC000875414936	FD	On-Demand	Anodyne	DRD2	18	45
CC[C@@H](NC(=O)C(=O)N[C@@H]1CCN(CC)C1)c1cccc(OC)c1OC	ZINC000875414938	FD	On-Demand	Anodyne	DRD2	18	45
C[C@H]1C[C@H](CO)CCN1C(=O)C(=O)NC1CN(C(=O)OCc2ccccc2)C1	ZINC000875414949	GC	On-Demand	Anodyne	GRIN2B	32	48
C[C@H]1C[C@H](CO)CCN1C(=O)C(=O)NC1CN(C(=O)OCc2ccccc2)C1	ZINC000875414949	GC	On-Demand	Anodyne	CTSB	22	42
C[C@H]1C[C@H](CO)CCN1C(=O)C(=O)NC1CN(C(=O)OCc2ccccc2)C1	ZINC000875414949	GC	On-Demand	Anodyne	CTSK	21	42
C[C@H]1C[C@H](CO)CCN1C(=O)C(=O)NC1CN(C(=O)OCc2ccccc2)C1	ZINC000875414949	GC	On-Demand	Anodyne	CTSL	22	42
C[C@H]1C[C@H](CO)CCN1C(=O)C(=O)NC1CN(C(=O)OCc2ccccc2)C1	ZINC000875414949	GC	On-Demand	Anodyne	PREP	25	40
C[C@H]1C[C@H](CO)CCN1C(=O)C(=O)NC1CN(C(=O)OCc2ccccc2)C1	ZINC000875414949	GC	On-Demand	Anodyne	CAPNS1	48	32
C[C@H]1C[C@H](CO)CCN1C(=O)C(=O)NC1CN(C(=O)OCc2ccccc2)C1	ZINC000875414949	GC	On-Demand	Anodyne	CAPN2	68	35
C[C@H]1C[C@H](CO)CCN1C(=O)C(=O)NC1CN(C(=O)OCc2ccccc2)C1	ZINC000875414949	GC	On-Demand	Anodyne	BIRC2	16	43
CCOc1cc(Cl)ccc1CNC(=O)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875414956	GF	On-Demand	Anodyne	P2RX7	40	39
CCOc1cc(Cl)ccc1CNC(=O)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875414956	GF	On-Demand	Anodyne	EPHX2	15	44
CCOc1cc(Cl)ccc1CNC(=O)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875414956	GF	On-Demand	Anodyne	CACNA1I	57	33
CCN1CC[C@@H](NC(=O)C(=O)NC[C@H]2CN(Cc3ccccc3C)CCO2)C1	ZINC000875414961	GC	On-Demand	Anodyne	DRD4	25	44
CCN1CC[C@H](NC(=O)C(=O)NC[C@H]2CN(Cc3ccccc3C)CCO2)C1	ZINC000875414962	GC	On-Demand	Anodyne	DRD4	25	44
CCN1CC[C@H](NC(=O)C(=O)NC[C@@H]2CN(Cc3ccccc3C)CCO2)C1	ZINC000875414963	GC	On-Demand	Anodyne	DRD4	25	44
CCN1CC[C@@H](NC(=O)C(=O)NC[C@@H]2CN(Cc3ccccc3C)CCO2)C1	ZINC000875414964	GC	On-Demand	Anodyne	DRD4	25	44
CCOc1cc(Cl)ccc1CNC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875414993	EG	On-Demand	Anodyne	EPHX2	21	50
CCOc1cc(Cl)ccc1CNC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875414993	EG	On-Demand	Anodyne	CACNA1I	62	36
CCOc1cc(Cl)ccc1CNC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875414994	EG	On-Demand	Anodyne	EPHX2	21	50
CCOc1cc(Cl)ccc1CNC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875414994	EG	On-Demand	Anodyne	CACNA1I	62	36
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(Cl)cc2OCC)C1	ZINC000875415014	FG	On-Demand	Anodyne	EPHX2	15	42
CCCCCCCNC(=O)C(=O)N[C@@H]1CCC(=O)N[C@H]1c1ccccc1	ZINC000875415031	FE	On-Demand	Mild	ASAH1	82	38
O=C(NC1CN(C(=O)OCc2ccccc2)C1)C(=O)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875415116	GC	On-Demand	Anodyne	GRIN2B	19	40
O=C(NC1CN(C(=O)OCc2ccccc2)C1)C(=O)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875415116	GC	On-Demand	Anodyne	TGM2	25	40
O=C(NC1CN(C(=O)OCc2ccccc2)C1)C(=O)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875415116	GC	On-Demand	Anodyne	F13A1	27	40
O=C(NC1CN(C(=O)OCc2ccccc2)C1)C(=O)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875415117	GC	On-Demand	Anodyne	GRIN2B	19	40
O=C(NC1CN(C(=O)OCc2ccccc2)C1)C(=O)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875415117	GC	On-Demand	Anodyne	TGM2	25	40
O=C(NC1CN(C(=O)OCc2ccccc2)C1)C(=O)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875415117	GC	On-Demand	Anodyne	F13A1	27	40
CCOc1cc(Cl)ccc1CNC(=O)N1CCC(CO)(CO)CC1	ZINC000875415158	FE	On-Demand	Anodyne	CACNA1H	46	35
CCOc1cc(Cl)ccc1CNC(=O)N1CCC(CO)(CO)CC1	ZINC000875415158	FE	On-Demand	Anodyne	EPHX2	20	52
CCOc1cc(Cl)ccc1CNC(=O)N1CCC(CO)(CO)CC1	ZINC000875415158	FE	On-Demand	Anodyne	HCN1	43	33
CCN1CC[C@@H](NC(=O)C(=O)N2CCc3cc(OC)c(OC)cc3[C@@H]2C)C1	ZINC000875415165	GD	On-Demand	Anodyne	SLC18A2	48	36
CCN1CC[C@@H](NC(=O)C(=O)N2CCc3cc(OC)c(OC)cc3[C@@H]2C)C1	ZINC000875415165	GD	On-Demand	Anodyne	HTR4	49	41
CCN1CC[C@H](NC(=O)C(=O)N2CCc3cc(OC)c(OC)cc3[C@H]2C)C1	ZINC000875415166	GD	On-Demand	Anodyne	SLC18A2	48	36
CCN1CC[C@H](NC(=O)C(=O)N2CCc3cc(OC)c(OC)cc3[C@H]2C)C1	ZINC000875415166	GD	On-Demand	Anodyne	HTR4	49	41
CCN1CC[C@@H](NC(=O)C(=O)N2CCc3cc(OC)c(OC)cc3[C@H]2C)C1	ZINC000875415167	GD	On-Demand	Anodyne	SLC18A2	48	36
CCN1CC[C@@H](NC(=O)C(=O)N2CCc3cc(OC)c(OC)cc3[C@H]2C)C1	ZINC000875415167	GD	On-Demand	Anodyne	HTR4	49	41
CCN1CC[C@H](NC(=O)C(=O)N2CCc3cc(OC)c(OC)cc3[C@@H]2C)C1	ZINC000875415168	GD	On-Demand	Anodyne	SLC18A2	48	36
CCN1CC[C@H](NC(=O)C(=O)N2CCc3cc(OC)c(OC)cc3[C@@H]2C)C1	ZINC000875415168	GD	On-Demand	Anodyne	HTR4	49	41
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875415173	GG	On-Demand	Mild	PGA5	44	33
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875415176	GG	On-Demand	Mild	PGA5	44	33
CCOc1cc(Cl)ccc1CNC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875415179	GD	On-Demand	Anodyne	P2RX7	40	39
CCOc1cc(Cl)ccc1CNC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875415179	GD	On-Demand	Anodyne	EPHX2	32	63
O=C1CC[C@@H](NC(=O)C(=O)NCc2cccc(F)c2F)[C@H](c2ccccc2)N1	ZINC000875415200	GD	On-Demand	Anodyne	P2RX7	18	44
CCN1CC[C@@H](NC(=O)C(=O)NC[C@H]2CN(Cc3ccc(C)cc3)CCO2)C1	ZINC000875415210	GC	On-Demand	Anodyne	DRD4	37	43
CCN1CC[C@@H](NC(=O)C(=O)NC[C@H]2CN(Cc3ccc(C)cc3)CCO2)C1	ZINC000875415210	GC	On-Demand	Anodyne	SSTR5	40	35
CCN1CC[C@@H](NC(=O)C(=O)NC[C@H]2CN(Cc3ccc(C)cc3)CCO2)C1	ZINC000875415210	GC	On-Demand	Anodyne	CCR3	25	43
CCN1CC[C@@H](NC(=O)C(=O)NC[C@H]2CN(Cc3ccc(C)cc3)CCO2)C1	ZINC000875415210	GC	On-Demand	Anodyne	CCR2	15	43
CCN1CC[C@@H](NC(=O)C(=O)NC[C@H]2CN(Cc3ccc(C)cc3)CCO2)C1	ZINC000875415210	GC	On-Demand	Anodyne	MCHR1	28	42
CCN1CC[C@H](NC(=O)C(=O)NC[C@H]2CN(Cc3ccc(C)cc3)CCO2)C1	ZINC000875415211	GC	On-Demand	Anodyne	DRD4	37	43
CCN1CC[C@H](NC(=O)C(=O)NC[C@H]2CN(Cc3ccc(C)cc3)CCO2)C1	ZINC000875415211	GC	On-Demand	Anodyne	SSTR5	40	35
CCN1CC[C@H](NC(=O)C(=O)NC[C@H]2CN(Cc3ccc(C)cc3)CCO2)C1	ZINC000875415211	GC	On-Demand	Anodyne	CCR3	25	43
CCN1CC[C@H](NC(=O)C(=O)NC[C@H]2CN(Cc3ccc(C)cc3)CCO2)C1	ZINC000875415211	GC	On-Demand	Anodyne	CCR2	15	43
CCN1CC[C@H](NC(=O)C(=O)NC[C@H]2CN(Cc3ccc(C)cc3)CCO2)C1	ZINC000875415211	GC	On-Demand	Anodyne	MCHR1	28	42
CCN1CC[C@H](NC(=O)C(=O)NC[C@@H]2CN(Cc3ccc(C)cc3)CCO2)C1	ZINC000875415212	GC	On-Demand	Anodyne	DRD4	37	43
CCN1CC[C@H](NC(=O)C(=O)NC[C@@H]2CN(Cc3ccc(C)cc3)CCO2)C1	ZINC000875415212	GC	On-Demand	Anodyne	SSTR5	40	35
CCN1CC[C@H](NC(=O)C(=O)NC[C@@H]2CN(Cc3ccc(C)cc3)CCO2)C1	ZINC000875415212	GC	On-Demand	Anodyne	CCR3	25	43
CCN1CC[C@H](NC(=O)C(=O)NC[C@@H]2CN(Cc3ccc(C)cc3)CCO2)C1	ZINC000875415212	GC	On-Demand	Anodyne	CCR2	15	43
CCN1CC[C@H](NC(=O)C(=O)NC[C@@H]2CN(Cc3ccc(C)cc3)CCO2)C1	ZINC000875415212	GC	On-Demand	Anodyne	MCHR1	28	42
CCN1CC[C@@H](NC(=O)C(=O)NC[C@@H]2CN(Cc3ccc(C)cc3)CCO2)C1	ZINC000875415213	GC	On-Demand	Anodyne	DRD4	37	43
CCN1CC[C@@H](NC(=O)C(=O)NC[C@@H]2CN(Cc3ccc(C)cc3)CCO2)C1	ZINC000875415213	GC	On-Demand	Anodyne	SSTR5	40	35
CCN1CC[C@@H](NC(=O)C(=O)NC[C@@H]2CN(Cc3ccc(C)cc3)CCO2)C1	ZINC000875415213	GC	On-Demand	Anodyne	CCR3	25	43
CCN1CC[C@@H](NC(=O)C(=O)NC[C@@H]2CN(Cc3ccc(C)cc3)CCO2)C1	ZINC000875415213	GC	On-Demand	Anodyne	CCR2	15	43
CCN1CC[C@@H](NC(=O)C(=O)NC[C@@H]2CN(Cc3ccc(C)cc3)CCO2)C1	ZINC000875415213	GC	On-Demand	Anodyne	MCHR1	28	42
O=C(NCCO)C1CCN(C(=O)NCCOc2ccccc2Cl)CC1	ZINC000875415229	FD	On-Demand	Anodyne	EPHX2	28	51
O=C(NCCO)C1CCN(C(=O)NCCOc2ccccc2Cl)CC1	ZINC000875415229	FD	On-Demand	Anodyne	SCD	17	48
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875415248	FF	On-Demand	Mild	PGA5	45	34
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875415249	FF	On-Demand	Mild	PGA5	45	34
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875415250	FF	On-Demand	Mild	PGA5	45	34
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875415251	FF	On-Demand	Mild	PGA5	45	34
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)NC1CCC(C)(N(C)C)CC1	ZINC000875415278	FF	On-Demand	Mild	TIMP3	48	35
CCOc1cc(Cl)ccc1CNC(=O)N(CCOC)C1CCOCC1	ZINC000875415280	FG	On-Demand	Anodyne	PYGL	27	42
CCN1CC[C@@H](NC(=O)C(=O)N2CCc3c(C(=O)OC)ccc(OC)c3C2)C1	ZINC000875415281	GC	On-Demand	Anodyne	HTR4	30	40
CCN1CC[C@H](NC(=O)C(=O)N2CCc3c(C(=O)OC)ccc(OC)c3C2)C1	ZINC000875415282	GC	On-Demand	Anodyne	HTR4	30	40
CC(=O)C1CCN(C(=O)C(=O)NC2CN(C(=O)OCc3ccccc3)C2)CC1	ZINC000875415334	GC	On-Demand	Anodyne	GRIN2B	40	47
CC(=O)C1CCN(C(=O)C(=O)NC2CN(C(=O)OCc3ccccc3)C2)CC1	ZINC000875415334	GC	On-Demand	Anodyne	CTSB	23	43
CC(=O)C1CCN(C(=O)C(=O)NC2CN(C(=O)OCc3ccccc3)C2)CC1	ZINC000875415334	GC	On-Demand	Anodyne	CTSK	22	43
CC(=O)C1CCN(C(=O)C(=O)NC2CN(C(=O)OCc3ccccc3)C2)CC1	ZINC000875415334	GC	On-Demand	Anodyne	CTSL	26	43
CC(=O)C1CCN(C(=O)C(=O)NC2CN(C(=O)OCc3ccccc3)C2)CC1	ZINC000875415334	GC	On-Demand	Anodyne	PREP	32	44
CC(=O)C1CCN(C(=O)C(=O)NC2CN(C(=O)OCc3ccccc3)C2)CC1	ZINC000875415334	GC	On-Demand	Anodyne	CAPNS1	46	31
CC(=O)C1CCN(C(=O)C(=O)NC2CN(C(=O)OCc3ccccc3)C2)CC1	ZINC000875415334	GC	On-Demand	Anodyne	CAPN2	51	34
CC(=O)C1CCN(C(=O)C(=O)NC2CN(C(=O)OCc3ccccc3)C2)CC1	ZINC000875415334	GC	On-Demand	Anodyne	TGM2	48	47
CC(=O)C1CCN(C(=O)C(=O)NC2CN(C(=O)OCc3ccccc3)C2)CC1	ZINC000875415334	GC	On-Demand	Anodyne	F13A1	40	47
CC(=O)C1CCN(C(=O)C(=O)NC2CN(C(=O)OCc3ccccc3)C2)CC1	ZINC000875415334	GC	On-Demand	Anodyne	BIRC2	18	49
CC(=O)C1CCN(C(=O)C(=O)NC2CN(C(=O)OCc3ccccc3)C2)CC1	ZINC000875415334	GC	On-Demand	Anodyne	SLC12A5	67	36
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCN([S@@](C)(=N)=O)CC1	ZINC000875415351	GD	On-Demand	Mild	CAPNS1	44	32
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCN([S@@](C)(=N)=O)CC1	ZINC000875415351	GD	On-Demand	Mild	CAPN1	43	36
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCN([S@@](C)(=N)=O)CC1	ZINC000875415351	GD	On-Demand	Mild	CAPN2	57	34
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCN([S@@](C)(=N)=O)CC1	ZINC000875415351	GD	On-Demand	Mild	TGM2	46	37
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCN([S@@](C)(=N)=O)CC1	ZINC000875415351	GD	On-Demand	Mild	PGA5	46	35
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCN([S@@](C)(=N)=O)CC1	ZINC000875415351	GD	On-Demand	Mild	F13A1	52	37
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCN([S@](C)(=N)=O)CC1	ZINC000875415352	GD	On-Demand	Mild	CAPNS1	44	32
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCN([S@](C)(=N)=O)CC1	ZINC000875415352	GD	On-Demand	Mild	CAPN1	43	36
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCN([S@](C)(=N)=O)CC1	ZINC000875415352	GD	On-Demand	Mild	CAPN2	57	34
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCN([S@](C)(=N)=O)CC1	ZINC000875415352	GD	On-Demand	Mild	TGM2	46	37
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCN([S@](C)(=N)=O)CC1	ZINC000875415352	GD	On-Demand	Mild	PGA5	46	35
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCN([S@](C)(=N)=O)CC1	ZINC000875415352	GD	On-Demand	Mild	F13A1	52	37
CCN1CC[C@@H](NC(=O)C(=O)N2CCO[C@H](c3ccccc3OC)C2)C1	ZINC000875415366	FC	On-Demand	Anodyne	DRD4	21	42
CCN1CC[C@@H](NC(=O)C(=O)N2CCO[C@@H](c3ccccc3OC)C2)C1	ZINC000875415367	FC	On-Demand	Anodyne	DRD4	21	42
CCN1CC[C@H](NC(=O)C(=O)N2CCO[C@@H](c3ccccc3OC)C2)C1	ZINC000875415368	FC	On-Demand	Anodyne	DRD4	21	42
CCN1CC[C@H](NC(=O)C(=O)N2CCO[C@H](c3ccccc3OC)C2)C1	ZINC000875415369	FC	On-Demand	Anodyne	DRD4	21	42
CCN1CC[C@H](NC(=O)C(=O)N[C@@H](C)c2cc3cnccc3o2)C1	ZINC000875415387	ED	On-Demand	Anodyne	SSTR5	49	34
CCN1CC[C@@H](NC(=O)C(=O)N[C@H](C)c2cc3cnccc3o2)C1	ZINC000875415388	ED	On-Demand	Anodyne	SSTR5	49	34
CCN1CC[C@@H](NC(=O)C(=O)N[C@@H](C)c2cc3cnccc3o2)C1	ZINC000875415389	ED	On-Demand	Anodyne	SSTR5	49	34
CCN1CC[C@H](NC(=O)C(=O)N[C@H](C)c2cc3cnccc3o2)C1	ZINC000875415390	ED	On-Demand	Anodyne	SSTR5	49	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@H]1CCN(C(C)=O)C[C@@H]1C)CC2	ZINC000875415391	GF	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@H]1CCN(C(C)=O)C[C@H]1C)CC2	ZINC000875415392	GF	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@@H]1CCN(C(C)=O)C[C@H]1C)CC2	ZINC000875415393	GF	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@@H]1CCN(C(C)=O)C[C@@H]1C)CC2	ZINC000875415394	GF	On-Demand	Anodyne	SLC18A2	48	36
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2CCN(C(C)=O)C[C@@H]2C)CC1	ZINC000875415401	GG	On-Demand	Anodyne	EPHX2	19	43
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CCN(C(C)=O)C[C@@H]2C)CC1	ZINC000875415402	GG	On-Demand	Anodyne	EPHX2	19	43
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2CCN(C(C)=O)C[C@H]2C)CC1	ZINC000875415403	GG	On-Demand	Anodyne	EPHX2	19	43
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CCN(C(C)=O)C[C@H]2C)CC1	ZINC000875415404	GG	On-Demand	Anodyne	EPHX2	19	43
CCOc1cc(Cl)ccc1CNC(=O)NC1(C)CC(F)(F)C1	ZINC000875415417	EH	On-Demand	Anodyne	P2RX7	36	41
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1C[C@H](OC)CC[C@@H]1C	ZINC000875415419	EE	On-Demand	Mild	CYSP_TRYCR	43	34
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1C[C@H](OC)CC[C@@H]1C	ZINC000875415419	EE	On-Demand	Mild	TIMP3	69	38
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1C[C@H](OC)CC[C@@H]1C	ZINC000875415419	EE	On-Demand	Mild	CAPNS1	46	32
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1C[C@H](OC)CC[C@@H]1C	ZINC000875415419	EE	On-Demand	Mild	PGA5	41	31
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1C[C@@H](OC)CC[C@@H]1C	ZINC000875415420	EE	On-Demand	Mild	CYSP_TRYCR	43	34
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1C[C@@H](OC)CC[C@@H]1C	ZINC000875415420	EE	On-Demand	Mild	TIMP3	69	38
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1C[C@@H](OC)CC[C@@H]1C	ZINC000875415420	EE	On-Demand	Mild	CAPNS1	46	32
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1C[C@@H](OC)CC[C@@H]1C	ZINC000875415420	EE	On-Demand	Mild	PGA5	41	31
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1C[C@H](OC)CC[C@H]1C	ZINC000875415421	EE	On-Demand	Mild	CYSP_TRYCR	43	34
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1C[C@H](OC)CC[C@H]1C	ZINC000875415421	EE	On-Demand	Mild	TIMP3	69	38
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1C[C@H](OC)CC[C@H]1C	ZINC000875415421	EE	On-Demand	Mild	CAPNS1	46	32
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1C[C@H](OC)CC[C@H]1C	ZINC000875415421	EE	On-Demand	Mild	PGA5	41	31
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1C[C@@H](OC)CC[C@H]1C	ZINC000875415422	EE	On-Demand	Mild	CYSP_TRYCR	43	34
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1C[C@@H](OC)CC[C@H]1C	ZINC000875415422	EE	On-Demand	Mild	TIMP3	69	38
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1C[C@@H](OC)CC[C@H]1C	ZINC000875415422	EE	On-Demand	Mild	CAPNS1	46	32
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1C[C@@H](OC)CC[C@H]1C	ZINC000875415422	EE	On-Demand	Mild	PGA5	41	31
CCN1CC[C@@H](NC(=O)C(=O)NC[C@H]2CN(Cc3cccc(C)c3)CCO2)C1	ZINC000875415452	GC	On-Demand	Anodyne	DRD4	41	45
CCN1CC[C@@H](NC(=O)C(=O)NC[C@H]2CN(Cc3cccc(C)c3)CCO2)C1	ZINC000875415452	GC	On-Demand	Anodyne	CHRM3	15	45
CCN1CC[C@@H](NC(=O)C(=O)NC[C@H]2CN(Cc3cccc(C)c3)CCO2)C1	ZINC000875415452	GC	On-Demand	Anodyne	SSTR5	45	35
CCN1CC[C@@H](NC(=O)C(=O)NC[C@H]2CN(Cc3cccc(C)c3)CCO2)C1	ZINC000875415452	GC	On-Demand	Anodyne	CCR3	27	41
CCN1CC[C@@H](NC(=O)C(=O)NC[C@H]2CN(Cc3cccc(C)c3)CCO2)C1	ZINC000875415452	GC	On-Demand	Anodyne	CCR2	16	40
CCN1CC[C@@H](NC(=O)C(=O)NC[C@H]2CN(Cc3cccc(C)c3)CCO2)C1	ZINC000875415452	GC	On-Demand	Anodyne	MCHR1	22	43
CCN1CC[C@H](NC(=O)C(=O)NC[C@H]2CN(Cc3cccc(C)c3)CCO2)C1	ZINC000875415453	GC	On-Demand	Anodyne	DRD4	41	45
CCN1CC[C@H](NC(=O)C(=O)NC[C@H]2CN(Cc3cccc(C)c3)CCO2)C1	ZINC000875415453	GC	On-Demand	Anodyne	CHRM3	15	45
CCN1CC[C@H](NC(=O)C(=O)NC[C@H]2CN(Cc3cccc(C)c3)CCO2)C1	ZINC000875415453	GC	On-Demand	Anodyne	SSTR5	45	35
CCN1CC[C@H](NC(=O)C(=O)NC[C@H]2CN(Cc3cccc(C)c3)CCO2)C1	ZINC000875415453	GC	On-Demand	Anodyne	CCR3	27	41
CCN1CC[C@H](NC(=O)C(=O)NC[C@H]2CN(Cc3cccc(C)c3)CCO2)C1	ZINC000875415453	GC	On-Demand	Anodyne	CCR2	16	40
CCN1CC[C@H](NC(=O)C(=O)NC[C@H]2CN(Cc3cccc(C)c3)CCO2)C1	ZINC000875415453	GC	On-Demand	Anodyne	MCHR1	22	43
CCN1CC[C@H](NC(=O)C(=O)NC[C@@H]2CN(Cc3cccc(C)c3)CCO2)C1	ZINC000875415454	GC	On-Demand	Anodyne	DRD4	41	45
CCN1CC[C@H](NC(=O)C(=O)NC[C@@H]2CN(Cc3cccc(C)c3)CCO2)C1	ZINC000875415454	GC	On-Demand	Anodyne	CHRM3	15	45
CCN1CC[C@H](NC(=O)C(=O)NC[C@@H]2CN(Cc3cccc(C)c3)CCO2)C1	ZINC000875415454	GC	On-Demand	Anodyne	SSTR5	45	35
CCN1CC[C@H](NC(=O)C(=O)NC[C@@H]2CN(Cc3cccc(C)c3)CCO2)C1	ZINC000875415454	GC	On-Demand	Anodyne	CCR3	27	41
CCN1CC[C@H](NC(=O)C(=O)NC[C@@H]2CN(Cc3cccc(C)c3)CCO2)C1	ZINC000875415454	GC	On-Demand	Anodyne	CCR2	16	40
CCN1CC[C@H](NC(=O)C(=O)NC[C@@H]2CN(Cc3cccc(C)c3)CCO2)C1	ZINC000875415454	GC	On-Demand	Anodyne	MCHR1	22	43
CCN1CC[C@@H](NC(=O)C(=O)NC[C@@H]2CN(Cc3cccc(C)c3)CCO2)C1	ZINC000875415455	GC	On-Demand	Anodyne	DRD4	41	45
CCN1CC[C@@H](NC(=O)C(=O)NC[C@@H]2CN(Cc3cccc(C)c3)CCO2)C1	ZINC000875415455	GC	On-Demand	Anodyne	CHRM3	15	45
CCN1CC[C@@H](NC(=O)C(=O)NC[C@@H]2CN(Cc3cccc(C)c3)CCO2)C1	ZINC000875415455	GC	On-Demand	Anodyne	SSTR5	45	35
CCN1CC[C@@H](NC(=O)C(=O)NC[C@@H]2CN(Cc3cccc(C)c3)CCO2)C1	ZINC000875415455	GC	On-Demand	Anodyne	CCR3	27	41
CCN1CC[C@@H](NC(=O)C(=O)NC[C@@H]2CN(Cc3cccc(C)c3)CCO2)C1	ZINC000875415455	GC	On-Demand	Anodyne	CCR2	16	40
CCN1CC[C@@H](NC(=O)C(=O)NC[C@@H]2CN(Cc3cccc(C)c3)CCO2)C1	ZINC000875415455	GC	On-Demand	Anodyne	MCHR1	22	43
CCN1CC[C@@H](NC(=O)C(=O)N[C@@H]2CC[C@@H](CNC(=O)OC(C)(C)C)CC2)C1	ZINC000875415465	GD	On-Demand	Anodyne	CACNA1I	42	33
CCN1CC[C@H](NC(=O)C(=O)N[C@@H]2CC[C@@H](CNC(=O)OC(C)(C)C)CC2)C1	ZINC000875415466	GD	On-Demand	Anodyne	CACNA1I	42	33
CCOc1cc(Cl)ccc1CNC(=O)N1CCCN(C=O)CC1	ZINC000875415493	EE	On-Demand	Anodyne	EPHX2	18	46
CCCCCCCNC(=O)C(=O)N[C@H](C)C1(OC)CCC1	ZINC000875415498	CE	On-Demand	Mild	ASAH1	53	30
CCCCCCCNC(=O)C(=O)N[C@@H](C)C1(OC)CCC1	ZINC000875415499	CE	On-Demand	Mild	ASAH1	53	30
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(C(C)=O)C[C@@H]1C	ZINC000875415502	CD	On-Demand	Anodyne	RIR1_HHV11	41	36
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(C(C)=O)C[C@@H]1C	ZINC000875415503	CD	On-Demand	Anodyne	RIR1_HHV11	41	36
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCN(C(C)=O)C[C@H]1C	ZINC000875415504	CD	On-Demand	Anodyne	RIR1_HHV11	41	36
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCN(C(C)=O)C[C@H]1C	ZINC000875415505	CD	On-Demand	Anodyne	RIR1_HHV11	41	36
CCN1CC[C@H](NC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)C1	ZINC000875415520	GD	On-Demand	Anodyne	ETHR	55	47
CCN1CC[C@@H](NC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)C1	ZINC000875415521	GD	On-Demand	Anodyne	ETHR	55	47
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1csnn1	ZINC000875415550	FF	On-Demand	Anodyne	SCNN1A	43	39
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1csnn1	ZINC000875415550	FF	On-Demand	Anodyne	ANPEP	15	43
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1csnn1	ZINC000875415550	FF	On-Demand	Anodyne	FAAH	47	39
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1csnn1	ZINC000875415550	FF	On-Demand	Anodyne	CES1	48	37
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1csnn1	ZINC000875415550	FF	On-Demand	Anodyne	AMP1_PLAFQ	23	45
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)NCc1cnn(CC)n1	ZINC000875415563	ED	On-Demand	Mild	MME	41	34
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)NCc1cnn(CC)n1	ZINC000875415563	ED	On-Demand	Mild	PGA5	44	33
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1csnn1	ZINC000875415580	CD	On-Demand	Mild	ASAH1	85	34
CCCCCCCNC(=O)C(=O)N[C@H](C)c1csnn1	ZINC000875415581	CD	On-Demand	Mild	ASAH1	85	34
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N(C)CCN1CC2(CCOCC2)C1	ZINC000875415587	GD	On-Demand	Mild	PGA5	41	31
CCOc1cc(Cl)ccc1CNC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875415653	DE	On-Demand	Anodyne	CACNA1I	45	34
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CC[C@@H](c2nc(C)cs2)C1	ZINC000875415675	GG	On-Demand	Mild	PGA5	44	33
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CC[C@H](c2nc(C)cs2)C1	ZINC000875415677	GG	On-Demand	Mild	PGA5	44	33
CCOc1cc(Cl)ccc1CNC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1	ZINC000875415678	GF	On-Demand	Anodyne	EPHX2	16	47
CC[C@H]1CN(C(=O)C2CC2)CC[C@@H]1NC(=O)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875415702	GG	On-Demand	Anodyne	EPHX2	26	43
CC[C@H]1CN(C(=O)C2CC2)CC[C@H]1NC(=O)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875415705	GG	On-Demand	Anodyne	EPHX2	26	43
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875415729	ED	On-Demand	Mild	PGA5	45	33
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875415730	ED	On-Demand	Mild	PGA5	45	33
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CC[C@@H]2[C@H](CCN2C)C1	ZINC000875415737	FD	On-Demand	Mild	PGA5	45	34
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CC[C@@H]2[C@@H](CCN2C)C1	ZINC000875415738	FD	On-Demand	Mild	PGA5	45	34
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CC[C@H]2[C@@H](CCN2C)C1	ZINC000875415739	FD	On-Demand	Mild	PGA5	45	34
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CC[C@H]2[C@H](CCN2C)C1	ZINC000875415740	FD	On-Demand	Mild	PGA5	45	34
CCN1CC[C@@H](NC(=O)C(=O)N2CCC[C@H]2c2cncc(C)c2)C1	ZINC000875415745	ED	On-Demand	Anodyne	SSTR5	31	42
CCN1CC[C@H](NC(=O)C(=O)N2CCC[C@H]2c2cncc(C)c2)C1	ZINC000875415746	ED	On-Demand	Anodyne	SSTR5	31	42
CCN1CC[C@@H](NC(=O)C(=O)N2CCC[C@@H]2c2cncc(C)c2)C1	ZINC000875415747	ED	On-Demand	Anodyne	SSTR5	31	42
CCN1CC[C@H](NC(=O)C(=O)N2CCC[C@@H]2c2cncc(C)c2)C1	ZINC000875415748	ED	On-Demand	Anodyne	SSTR5	31	42
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875415749	EE	On-Demand	Mild	CAPN1	34	40
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(C(C)=O)CC1	ZINC000875415749	EE	On-Demand	Mild	PGA5	45	34
CCOc1cc(Cl)ccc1CNC(=O)N[C@H](CC)C[C@@H](C)O	ZINC000875415757	EG	On-Demand	Anodyne	PDS	40	35
CCOc1cc(Cl)ccc1CNC(=O)N[C@@H](CC)C[C@H](C)O	ZINC000875415758	EG	On-Demand	Anodyne	PDS	40	35
CCOc1cc(Cl)ccc1CNC(=O)N[C@@H](CC)C[C@@H](C)O	ZINC000875415759	EG	On-Demand	Anodyne	PDS	40	35
CCOc1cc(Cl)ccc1CNC(=O)N[C@H](CC)C[C@H](C)O	ZINC000875415760	EG	On-Demand	Anodyne	PDS	40	35
CCN1CC[C@H](NC(=O)C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)C1	ZINC000875415769	GC	On-Demand	Clean	HTR1A	39	40
CCN1CC[C@H](NC(=O)C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)C1	ZINC000875415769	GC	On-Demand	Clean	DRD2	39	44
CCN1CC[C@H](NC(=O)C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)C1	ZINC000875415769	GC	On-Demand	Clean	DRD4	40	32
CCN1CC[C@H](NC(=O)C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)C1	ZINC000875415769	GC	On-Demand	Clean	ADRA1D	30	41
CCN1CC[C@H](NC(=O)C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)C1	ZINC000875415769	GC	On-Demand	Clean	ADRA1A	28	41
CCN1CC[C@H](NC(=O)C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)C1	ZINC000875415769	GC	On-Demand	Clean	ADRA1B	22	41
CCN1CC[C@H](NC(=O)C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)C1	ZINC000875415769	GC	On-Demand	Clean	DRD3	45	38
CCN1CC[C@H](NC(=O)C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)C1	ZINC000875415769	GC	On-Demand	Clean	HTR4	38	41
CCN1CC[C@H](NC(=O)C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)C1	ZINC000875415769	GC	On-Demand	Clean	HTR7	31	40
CCN1CC[C@H](NC(=O)C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)C1	ZINC000875415769	GC	On-Demand	Clean	MTNR1A	15	43
CCN1CC[C@H](NC(=O)C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)C1	ZINC000875415769	GC	On-Demand	Clean	MTNR1B	18	43
CCN1CC[C@@H](NC(=O)C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)C1	ZINC000875415770	GC	On-Demand	Clean	HTR1A	39	40
CCN1CC[C@@H](NC(=O)C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)C1	ZINC000875415770	GC	On-Demand	Clean	DRD2	39	44
CCN1CC[C@@H](NC(=O)C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)C1	ZINC000875415770	GC	On-Demand	Clean	DRD4	40	32
CCN1CC[C@@H](NC(=O)C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)C1	ZINC000875415770	GC	On-Demand	Clean	ADRA1D	30	41
CCN1CC[C@@H](NC(=O)C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)C1	ZINC000875415770	GC	On-Demand	Clean	ADRA1A	28	41
CCN1CC[C@@H](NC(=O)C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)C1	ZINC000875415770	GC	On-Demand	Clean	ADRA1B	22	41
CCN1CC[C@@H](NC(=O)C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)C1	ZINC000875415770	GC	On-Demand	Clean	DRD3	45	38
CCN1CC[C@@H](NC(=O)C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)C1	ZINC000875415770	GC	On-Demand	Clean	HTR4	38	41
CCN1CC[C@@H](NC(=O)C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)C1	ZINC000875415770	GC	On-Demand	Clean	HTR7	31	40
CCN1CC[C@@H](NC(=O)C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)C1	ZINC000875415770	GC	On-Demand	Clean	MTNR1A	15	43
CCN1CC[C@@H](NC(=O)C(=O)N2CCN(c3ccc(OC)cc3OC)CC2)C1	ZINC000875415770	GC	On-Demand	Clean	MTNR1B	18	43
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@@H](C1CCC1)[C@@H]1CCOC1	ZINC000875415775	FF	On-Demand	Mild	PGA5	47	35
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@H](C1CCC1)[C@@H]1CCOC1	ZINC000875415776	FF	On-Demand	Mild	PGA5	47	35
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@H](C1CCC1)[C@H]1CCOC1	ZINC000875415777	FF	On-Demand	Mild	PGA5	47	35
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@@H](C1CCC1)[C@H]1CCOC1	ZINC000875415778	FF	On-Demand	Mild	PGA5	47	35
CCN1CC[C@H](NC(=O)C(=O)N2CCN(c3ccc(F)cc3C#N)CC2)C1	ZINC000875415804	FC	On-Demand	Mild	CCR3	34	41
CCN1CC[C@@H](NC(=O)C(=O)N2CCN(c3ccc(F)cc3C#N)CC2)C1	ZINC000875415805	FC	On-Demand	Mild	CCR3	34	41
CCN1CC[C@H](NC(=O)C(=O)NCc2cc(C(F)(F)F)cc(Cl)n2)C1	ZINC000875415806	GD	On-Demand	Anodyne	CCR2	60	43
CCN1CC[C@@H](NC(=O)C(=O)NCc2cc(C(F)(F)F)cc(Cl)n2)C1	ZINC000875415807	GD	On-Demand	Anodyne	CCR2	60	43
CCOc1cc(Cl)ccc1CNC(=O)N1Cc2cccc(O)c2C1	ZINC000875415828	EH	On-Demand	Clean	EPHX2	15	40
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875415867	ED	On-Demand	Mild	MME	53	37
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875415867	ED	On-Demand	Mild	CAPNS1	42	33
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875415867	ED	On-Demand	Mild	ACE2	47	34
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875415867	ED	On-Demand	Mild	PGA5	44	35
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875415867	ED	On-Demand	Mild	MMP7	22	40
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875415868	ED	On-Demand	Mild	MME	53	37
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875415868	ED	On-Demand	Mild	CAPNS1	42	33
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875415868	ED	On-Demand	Mild	ACE2	47	34
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875415868	ED	On-Demand	Mild	PGA5	44	35
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875415868	ED	On-Demand	Mild	MMP7	22	40
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCCCCCNC(=O)CC1	ZINC000875415890	GE	On-Demand	Mild	PGA5	42	32
CC(=O)N1CCC[C@@H]1C(=O)O[C@H](c1cccc(Cl)c1)C(F)(F)F	ZINC000875415948	EG	On-Demand	Anodyne	FKBP1A	55	39
CC(=O)N1CCC[C@@H]1C(=O)O[C@H](c1cccc(Cl)c1)C(F)(F)F	ZINC000875415948	EG	On-Demand	Anodyne	LGMN	43	36
CC(=O)N1CCC[C@@H]1C(=O)O[C@@H](c1cccc(Cl)c1)C(F)(F)F	ZINC000875415949	EG	On-Demand	Anodyne	FKBP1A	55	39
CC(=O)N1CCC[C@@H]1C(=O)O[C@@H](c1cccc(Cl)c1)C(F)(F)F	ZINC000875415949	EG	On-Demand	Anodyne	LGMN	43	36
CC(=O)N1CCC[C@@H]1C(=O)O[C@H](c1cccc(Br)c1)C(F)(F)F	ZINC000875415997	GH	On-Demand	Anodyne	FKBP1A	53	39
CC(=O)N1CCC[C@@H]1C(=O)O[C@@H](c1cccc(Br)c1)C(F)(F)F	ZINC000875415998	GH	On-Demand	Anodyne	FKBP1A	53	39
CC[C@H](C[C@H](C)O)NC(=O)NCCOc1ccccc1Cl	ZINC000875416035	DF	On-Demand	Anodyne	PDS	24	44
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875416058	EE	On-Demand	Mild	OPRM1	22	42
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875416058	EE	On-Demand	Mild	REN	45	36
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@@H](C(C)=O)C1	ZINC000875416058	EE	On-Demand	Mild	PGA5	47	36
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875416060	EE	On-Demand	Mild	OPRM1	22	42
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875416060	EE	On-Demand	Mild	REN	45	36
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@H](C(C)=O)C1	ZINC000875416060	EE	On-Demand	Mild	PGA5	47	36
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875416062	GD	On-Demand	Mild	PGA5	44	33
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875416062	GD	On-Demand	Mild	L3MBTL3	50	37
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875416113	FE	On-Demand	Mild	PGC	40	34
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875416113	FE	On-Demand	Mild	CTRA_BOVIN	42	33
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875416113	FE	On-Demand	Mild	CELA2A	49	33
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875416113	FE	On-Demand	Mild	PGA5	44	34
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1CCC[C@@H]2[C@H](O)C(C)(C)[C@@H]21	ZINC000875416113	FE	On-Demand	Mild	BRCA1	59	31
N#Cc1ccc(Cn2cc(NC(=O)NCC3(C4CC4)CC3)cn2)cc1	ZINC000875416181	EG	On-Demand	Mild	CCR3	15	40
N#Cc1ccc(Cn2cc(NC(=O)NCC3(C4CC4)CC3)cn2)cc1	ZINC000875416181	EG	On-Demand	Mild	ITK	17	51
N#Cc1ccc(Cn2cc(NC(=O)NCC3(C4CC4)CC3)cn2)cc1	ZINC000875416181	EG	On-Demand	Mild	PANC	54	36
O=C(NCC1(C2CC2)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875416232	DF	On-Demand	Anodyne	EPHX2	15	44
O=C(NCC1(C2CC2)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875416233	DF	On-Demand	Anodyne	EPHX2	15	44
O=C(NCc1nnc(C2CC2)s1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875416236	GE	On-Demand	Anodyne	OXTR	52	35
O=C(NCc1nnc(C2CC2)s1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875416237	GE	On-Demand	Anodyne	OXTR	52	35
C=CC[C@H](Cc1ccccc1)NC(=O)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875416269	EF	On-Demand	Mild	PGA5	43	32
CCCCCCCNC(=O)C(=O)N[C@@H]1CCN(CC(F)F)C1	ZINC000875416319	DD	On-Demand	Mild	ASAH1	84	37
CCCCCCCNC(=O)C(=O)N[C@H]1CCN(CC(F)F)C1	ZINC000875416320	DD	On-Demand	Mild	ASAH1	84	37
O=C(N[C@@H]1CC[C@@H](O)CC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875416350	DF	On-Demand	Anodyne	EPHX2	28	41
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)[C@@H](NC=O)C(C)C	ZINC000875416376	GE	On-Demand	Anodyne	HCN1	43	34
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)[C@@H](NC=O)C(C)C	ZINC000875416376	GE	On-Demand	Anodyne	HCN4	41	34
O=C(N[C@@H]1CC[C@@H](O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875416456	ED	On-Demand	Anodyne	CHRM2	15	40
O=C(N[C@@H]1CC[C@@H](O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875416456	ED	On-Demand	Anodyne	DRD4	30	49
O=C(N[C@@H]1CC[C@@H](O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875416456	ED	On-Demand	Anodyne	CHRM3	16	40
O=C(N[C@@H]1CC[C@@H](O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875416456	ED	On-Demand	Anodyne	SIGMAR1	41	49
O=C(N[C@@H]1CC[C@@H](O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875416456	ED	On-Demand	Anodyne	FAAH	15	40
O=C(N[C@@H]1CC[C@@H](O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875416456	ED	On-Demand	Anodyne	EPHX2	15	43
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2CCOC2)CC1	ZINC000875416457	DF	On-Demand	Anodyne	EPHX2	16	40
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2CCOC2)CC1	ZINC000875416457	DF	On-Demand	Anodyne	RBP4	31	40
COc1ccccc1[C@H]1CCCN(C(=O)N[C@H]2CCOC2)CC1	ZINC000875416459	DF	On-Demand	Anodyne	EPHX2	16	40
COc1ccccc1[C@H]1CCCN(C(=O)N[C@H]2CCOC2)CC1	ZINC000875416459	DF	On-Demand	Anodyne	RBP4	31	40
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CCOC2)CC1	ZINC000875416460	DF	On-Demand	Anodyne	EPHX2	16	40
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CCOC2)CC1	ZINC000875416460	DF	On-Demand	Anodyne	RBP4	31	40
COc1ccccc1[C@H]1CCCN(C(=O)N[C@@H]2CCOC2)CC1	ZINC000875416461	DF	On-Demand	Anodyne	EPHX2	16	40
COc1ccccc1[C@H]1CCCN(C(=O)N[C@@H]2CCOC2)CC1	ZINC000875416461	DF	On-Demand	Anodyne	RBP4	31	40
O=C(N[C@@H]1CCOC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875416520	CD	On-Demand	Anodyne	EPHX2	22	44
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)N[C@@H]1CC[C@@H](O)CC1	ZINC000875416529	ED	On-Demand	Anodyne	EPHX2	17	48
O=C(NC[C@H](O)Cc1cccc(Cl)c1)N[C@@H]1CC[C@@H](O)CC1	ZINC000875416530	ED	On-Demand	Anodyne	EPHX2	17	48
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)N[C@@H]2CCN(CC(F)F)C2)c1	ZINC000875416552	FD	On-Demand	Anodyne	SSTR5	29	42
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)N[C@H]2CCN(CC(F)F)C2)c1	ZINC000875416553	FD	On-Demand	Anodyne	SSTR5	29	42
Cc1cncc([C@H]2CCCN2C(=O)C(=O)N[C@@H]2CCN(CC(F)F)C2)c1	ZINC000875416554	FD	On-Demand	Anodyne	SSTR5	29	42
Cc1cncc([C@H]2CCCN2C(=O)C(=O)N[C@H]2CCN(CC(F)F)C2)c1	ZINC000875416555	FD	On-Demand	Anodyne	SSTR5	29	42
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@@H](CC)CSc1ccccc1	ZINC000875416622	EH	On-Demand	Anodyne	TIMP3	70	34
O=C(N[C@H]1CCOC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875416625	CD	On-Demand	Anodyne	EPHX2	22	44
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@H](CC)CSc1ccccc1	ZINC000875416626	EH	On-Demand	Anodyne	TIMP3	70	34
O=C(N[C@H]1CCOC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875416628	CD	On-Demand	Anodyne	EPHX2	22	44
O=C(N[C@@H]1CCOC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875416629	CD	On-Demand	Anodyne	EPHX2	22	44
CC[C@H]1CN(C(=O)C(C)C)CC[C@@H]1NC(=O)NC1CCC(C)(N(C)C)CC1	ZINC000875416690	GF	On-Demand	Anodyne	EPHX2	18	41
CC[C@H]1CN(C(=O)C(C)C)CC[C@H]1NC(=O)NC1CCC(C)(N(C)C)CC1	ZINC000875416691	GF	On-Demand	Anodyne	EPHX2	18	41
O=C(N[C@H]1CCOC1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875416720	FE	On-Demand	Anodyne	MAPK1	43	32
O=C(N[C@@H]1CCOC1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875416721	FE	On-Demand	Anodyne	MAPK1	43	32
O=C(N[C@@H]1CC[C@@H](O)CC1)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875416855	EF	On-Demand	Anodyne	CHRNA7	44	38
O=C(N[C@@H]1CC[C@@H](O)CC1)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875416855	EF	On-Demand	Anodyne	C3AR1	47	46
O=C(N[C@@H]1CC[C@@H](O)CC1)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875416855	EF	On-Demand	Anodyne	NAMPT	30	45
O=C(N[C@@H]1CC[C@@H](O)CC1)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875416856	EF	On-Demand	Anodyne	CHRNA7	44	38
O=C(N[C@@H]1CC[C@@H](O)CC1)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875416856	EF	On-Demand	Anodyne	C3AR1	47	46
O=C(N[C@@H]1CC[C@@H](O)CC1)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875416856	EF	On-Demand	Anodyne	NAMPT	30	45
O=C(N[C@@H]1CC[C@@H](O)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875416873	DE	On-Demand	Anodyne	CCR3	28	40
O=C(N[C@@H]1CC[C@@H](O)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875416873	DE	On-Demand	Anodyne	EPHX2	51	52
C[C@H]1C[C@H](CCNC(=O)NC[C@H]2C[C@H](O)C2)CN1Cc1ccccc1	ZINC000875416881	EE	On-Demand	Anodyne	ACHE	15	44
O=C(NCc1nnc(C2CC2)s1)C(=O)NCc1cccc2ncccc12	ZINC000875417007	FD	On-Demand	Anodyne	CDK5	23	41
CCCCCCCNC(=O)C(=O)NCC(C)(C)c1cccnc1	ZINC000875417024	DF	On-Demand	Mild	FAAH	17	47
CCCCCCCNC(=O)C(=O)NCC(C)(C)c1cccnc1	ZINC000875417024	DF	On-Demand	Mild	ASAH1	77	34
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCC(C)(C)c2cccnc2)c1	ZINC000875417062	FF	On-Demand	Anodyne	FKBP1A	19	43
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCC(C)(C)c2cccnc2)c1	ZINC000875417062	FF	On-Demand	Anodyne	PREP	15	42
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCC(C)(C)c2cccnc2)c1	ZINC000875417063	FF	On-Demand	Anodyne	FKBP1A	19	43
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCC(C)(C)c2cccnc2)c1	ZINC000875417063	FF	On-Demand	Anodyne	PREP	15	42
O=C(N[C@@H]1CC[C@@H](O)CC1)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875417129	EE	On-Demand	Anodyne	CCR3	15	42
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)C1(F)CCOCC1	ZINC000875417144	GG	On-Demand	Anodyne	HCN1	42	33
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)C1(F)CCOCC1	ZINC000875417144	GG	On-Demand	Anodyne	HCN4	41	33
C[C@@H](O)C1CCN(C(=O)NCC[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)CC1	ZINC000875417150	FG	On-Demand	Anodyne	ACHE	23	42
C[C@@H](O)C1CCN(C(=O)NCC[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)CC1	ZINC000875417153	FG	On-Demand	Anodyne	ACHE	23	42
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000875417183	FF	On-Demand	Anodyne	LTA4H	17	44
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000875417183	FF	On-Demand	Anodyne	SIGMAR1	29	48
CC[C@H]1CN(C(=O)C(C)C)CC[C@@H]1NC(=O)NCc1cccc2ncccc12	ZINC000875417264	GG	On-Demand	Anodyne	ADAM17	23	40
CC[C@H]1CN(C(=O)C(C)C)CC[C@H]1NC(=O)NCc1cccc2ncccc12	ZINC000875417265	GG	On-Demand	Anodyne	ADAM17	23	40
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCOC1	ZINC000875417361	EF	On-Demand	Reactive	MAOB	19	40
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCOC1	ZINC000875417361	EF	On-Demand	Reactive	LTA4H	41	46
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCOC1	ZINC000875417361	EF	On-Demand	Reactive	ADAM17	20	47
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCOC1	ZINC000875417361	EF	On-Demand	Reactive	FAAH	19	40
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCOC1	ZINC000875417361	EF	On-Demand	Reactive	SLC6A5	32	42
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCOC1	ZINC000875417361	EF	On-Demand	Reactive	EPHX2	23	47
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCOC1	ZINC000875417361	EF	On-Demand	Reactive	NAAA	19	47
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCOC1	ZINC000875417361	EF	On-Demand	Reactive	FFAR1	24	40
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCOC1	ZINC000875417362	EF	On-Demand	Reactive	MAOB	19	40
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCOC1	ZINC000875417362	EF	On-Demand	Reactive	LTA4H	41	46
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCOC1	ZINC000875417362	EF	On-Demand	Reactive	ADAM17	20	47
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCOC1	ZINC000875417362	EF	On-Demand	Reactive	FAAH	19	40
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCOC1	ZINC000875417362	EF	On-Demand	Reactive	SLC6A5	32	42
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCOC1	ZINC000875417362	EF	On-Demand	Reactive	EPHX2	23	47
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCOC1	ZINC000875417362	EF	On-Demand	Reactive	NAAA	19	47
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCOC1	ZINC000875417362	EF	On-Demand	Reactive	FFAR1	24	40
COc1ccc(N2CCN(C(=O)N[C@@H]3CC[C@@H](O)CC3)CC2)c(OC)c1	ZINC000875417388	FD	On-Demand	Clean	HTR1A	34	42
COc1ccc(N2CCN(C(=O)N[C@@H]3CC[C@@H](O)CC3)CC2)c(OC)c1	ZINC000875417388	FD	On-Demand	Clean	DRD2	28	47
COc1ccc(N2CCN(C(=O)N[C@@H]3CC[C@@H](O)CC3)CC2)c(OC)c1	ZINC000875417388	FD	On-Demand	Clean	DRD4	40	31
COc1ccc(N2CCN(C(=O)N[C@@H]3CC[C@@H](O)CC3)CC2)c(OC)c1	ZINC000875417388	FD	On-Demand	Clean	ADRA1D	29	47
COc1ccc(N2CCN(C(=O)N[C@@H]3CC[C@@H](O)CC3)CC2)c(OC)c1	ZINC000875417388	FD	On-Demand	Clean	HTR1B	15	42
COc1ccc(N2CCN(C(=O)N[C@@H]3CC[C@@H](O)CC3)CC2)c(OC)c1	ZINC000875417388	FD	On-Demand	Clean	ADRA1A	25	47
COc1ccc(N2CCN(C(=O)N[C@@H]3CC[C@@H](O)CC3)CC2)c(OC)c1	ZINC000875417388	FD	On-Demand	Clean	ADRA1B	20	47
COc1ccc(N2CCN(C(=O)N[C@@H]3CC[C@@H](O)CC3)CC2)c(OC)c1	ZINC000875417388	FD	On-Demand	Clean	DRD3	30	40
COc1ccc(N2CCN(C(=O)N[C@@H]3CC[C@@H](O)CC3)CC2)c(OC)c1	ZINC000875417388	FD	On-Demand	Clean	PDGFRB	37	41
COc1ccc(N2CCN(C(=O)N[C@@H]3CC[C@@H](O)CC3)CC2)c(OC)c1	ZINC000875417388	FD	On-Demand	Clean	MTNR1B	18	44
COc1ccc(N2CCN(C(=O)N[C@@H]3CC[C@@H](O)CC3)CC2)c(OC)c1	ZINC000875417388	FD	On-Demand	Clean	NPBWR1	47	34
CC[C@@H](NC(=O)NC[C@H]1CCCN1S(C)(=O)=O)[C@H](O)c1ccccc1	ZINC000875417391	FD	On-Demand	Anodyne	XIAP	48	36
CC[C@@H](NC(=O)NC[C@H]1CCCN1S(C)(=O)=O)[C@@H](O)c1ccccc1	ZINC000875417392	FD	On-Demand	Anodyne	XIAP	48	36
CC[C@@H](NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1)[C@@H]1CC1(C)C	ZINC000875417405	FF	On-Demand	Anodyne	ROCK1	23	40
CC[C@@H](NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1)[C@@H]1CC1(C)C	ZINC000875417405	FF	On-Demand	Anodyne	ROCK2	15	40
CC[C@@H](NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1)[C@H]1CC1(C)C	ZINC000875417406	FF	On-Demand	Anodyne	ROCK1	23	40
CC[C@@H](NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1)[C@H]1CC1(C)C	ZINC000875417406	FF	On-Demand	Anodyne	ROCK2	15	40
CO[C@H](CNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1)CC(C)C	ZINC000875417451	GE	On-Demand	Anodyne	ETHR	49	45
CN1CCC(CNC(=O)N[C@@H]2CC[C@@H](O)CC2)(c2ccccc2)CC1	ZINC000875417458	EE	On-Demand	Anodyne	KCNA3	56	48
CN1CCC(CNC(=O)N[C@@H]2CC[C@@H](O)CC2)(c2ccccc2)CC1	ZINC000875417458	EE	On-Demand	Anodyne	SLC6A9	15	41
CN1CCC(CNC(=O)N[C@@H]2CC[C@@H](O)CC2)(c2ccccc2)CC1	ZINC000875417458	EE	On-Demand	Anodyne	SOAT1	16	46
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CC[C@@H](O)CC1	ZINC000875417499	FG	On-Demand	Reactive	PLG	16	40
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CC[C@@H](O)CC1	ZINC000875417499	FG	On-Demand	Reactive	ALOX5	18	42
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CC[C@@H](O)CC1	ZINC000875417499	FG	On-Demand	Reactive	LTA4H	42	49
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CC[C@@H](O)CC1	ZINC000875417499	FG	On-Demand	Reactive	ADAM17	29	49
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CC[C@@H](O)CC1	ZINC000875417499	FG	On-Demand	Reactive	SLC6A5	34	44
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CC[C@@H](O)CC1	ZINC000875417499	FG	On-Demand	Reactive	EPHX2	42	47
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CC[C@@H](O)CC1	ZINC000875417499	FG	On-Demand	Reactive	PLAU	24	40
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CC[C@@H](O)CC1	ZINC000875417499	FG	On-Demand	Reactive	NAAA	19	44
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CC[C@@H](O)CC1	ZINC000875417499	FG	On-Demand	Reactive	FFAR1	32	43
CCCCCCCNC(=O)C(=O)N[C@@H]1CCN(CC)C1	ZINC000875417614	CD	On-Demand	Mild	ASAH1	82	36
CCCCCCCNC(=O)C(=O)N[C@H]1CCN(CC)C1	ZINC000875417615	CD	On-Demand	Mild	ASAH1	82	36
CC(=O)C1CCN(C(=O)NCC[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)CC1	ZINC000875417686	FG	On-Demand	Anodyne	ACHE	26	43
CC(=O)C1CCN(C(=O)NCC[C@H]2C[C@H](C)N(Cc3ccccc3)C2)CC1	ZINC000875417687	FG	On-Demand	Anodyne	ACHE	26	43
CC(=O)C1CCN(C(=O)NCC[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)CC1	ZINC000875417688	FG	On-Demand	Anodyne	ACHE	26	43
CC(=O)C1CCN(C(=O)NCC[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)CC1	ZINC000875417689	FG	On-Demand	Anodyne	ACHE	26	43
O=C(N[C@@H]1CC[C@@H](O)CC1)N1CCC[C@@](F)(c2ccccc2)C1	ZINC000875417737	DF	On-Demand	Anodyne	EPHX2	30	47
O=C(N[C@@H]1CC[C@@H](O)CC1)N1CCC[C@](F)(c2ccccc2)C1	ZINC000875417739	DF	On-Demand	Anodyne	EPHX2	30	47
CC(=O)N1CCC[C@@H]1C(=O)O[C@@H](c1ccccc1)c1nc(C)no1	ZINC000875417745	EE	On-Demand	Anodyne	FKBP1A	51	40
CC(=O)N1CCC[C@@H]1C(=O)O[C@@H](c1ccccc1)c1nc(C)no1	ZINC000875417745	EE	On-Demand	Anodyne	CPT1A	55	37
CC(=O)N1CCC[C@@H]1C(=O)O[C@@H](c1ccccc1)c1nc(C)no1	ZINC000875417745	EE	On-Demand	Anodyne	PREP	47	34
CC(=O)N1CCC[C@@H]1C(=O)O[C@H](c1ccccc1)c1nc(C)no1	ZINC000875417749	EE	On-Demand	Anodyne	FKBP1A	51	40
CC(=O)N1CCC[C@@H]1C(=O)O[C@H](c1ccccc1)c1nc(C)no1	ZINC000875417749	EE	On-Demand	Anodyne	CPT1A	55	37
CC(=O)N1CCC[C@@H]1C(=O)O[C@H](c1ccccc1)c1nc(C)no1	ZINC000875417749	EE	On-Demand	Anodyne	PREP	47	34
CS(=O)(=O)N1CC[C@@H](CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875417755	GC	On-Demand	Anodyne	DRD4	22	42
CS(=O)(=O)N1CC[C@@H](CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875417755	GC	On-Demand	Anodyne	ACHE	34	42
CS(=O)(=O)N1CC[C@@H](CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875417755	GC	On-Demand	Anodyne	HTR4	43	40
CS(=O)(=O)N1CC[C@@H](CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875417755	GC	On-Demand	Anodyne	SIGMAR1	33	41
CS(=O)(=O)N1CC[C@H](CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875417757	GC	On-Demand	Anodyne	DRD4	22	42
CS(=O)(=O)N1CC[C@H](CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875417757	GC	On-Demand	Anodyne	ACHE	34	42
CS(=O)(=O)N1CC[C@H](CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875417757	GC	On-Demand	Anodyne	HTR4	43	40
CS(=O)(=O)N1CC[C@H](CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C1	ZINC000875417757	GC	On-Demand	Anodyne	SIGMAR1	33	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CC[C@@H](C)c3ccccc32)C1	ZINC000875417830	EG	On-Demand	Anodyne	ACE	17	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CC[C@H](C)c3ccccc32)C1	ZINC000875417832	EG	On-Demand	Anodyne	ACE	17	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CC[C@@H](C)c3ccccc32)C1	ZINC000875417834	EG	On-Demand	Anodyne	ACE	17	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CC[C@H](C)c3ccccc32)C1	ZINC000875417836	EG	On-Demand	Anodyne	ACE	17	41
O=C(N[C@@H]1CC[C@@H](O)CC1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875417845	DF	On-Demand	Anodyne	OXTR	49	38
O=C(N[C@@H]1CC[C@@H](O)CC1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875417845	DF	On-Demand	Anodyne	SLC18A3	17	43
O=C(N[C@@H]1CC[C@@H](O)CC1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875417847	DF	On-Demand	Anodyne	OXTR	49	38
O=C(N[C@@H]1CC[C@@H](O)CC1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875417847	DF	On-Demand	Anodyne	SLC18A3	17	43
C[C@@H]1CC[C@H](NC(=O)N2CC[C@@H]3CS(=O)(=O)C[C@H]3C2)c2ccccc21	ZINC000875417879	FF	On-Demand	Anodyne	RBP4	52	32
C[C@@H]1CC[C@H](NC(=O)N2CC[C@@H]3CS(=O)(=O)C[C@@H]3C2)c2ccccc21	ZINC000875417880	FF	On-Demand	Anodyne	RBP4	52	32
C[C@@H]1CC[C@H](NC(=O)N2CC[C@H]3CS(=O)(=O)C[C@H]3C2)c2ccccc21	ZINC000875417882	FF	On-Demand	Anodyne	RBP4	52	32
C[C@@H]1CC[C@H](NC(=O)N2CC[C@H]3CS(=O)(=O)C[C@@H]3C2)c2ccccc21	ZINC000875417885	FF	On-Demand	Anodyne	RBP4	52	32
CC(=O)N1CCC[C@@H]1C(=O)O[C@H](c1ccccc1C(F)(F)F)C(F)(F)F	ZINC000875417910	GH	On-Demand	Anodyne	FKBP1A	50	40
CC(=O)N1CCC[C@@H]1C(=O)O[C@H](c1ccccc1C(F)(F)F)C(F)(F)F	ZINC000875417910	GH	On-Demand	Anodyne	ELANE	59	36
CC(=O)N1CCC[C@@H]1C(=O)O[C@H](c1ccccc1C(F)(F)F)C(F)(F)F	ZINC000875417910	GH	On-Demand	Anodyne	PREP	43	33
CC(=O)N1CCC[C@@H]1C(=O)O[C@H](c1ccccc1C(F)(F)F)C(F)(F)F	ZINC000875417910	GH	On-Demand	Anodyne	SFRP1	47	35
CC(=O)N1CCC[C@@H]1C(=O)O[C@H](c1ccccc1C(F)(F)F)C(F)(F)F	ZINC000875417910	GH	On-Demand	Anodyne	WNT3	55	41
CC(=O)N1CCC[C@@H]1C(=O)O[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F	ZINC000875417911	GH	On-Demand	Anodyne	FKBP1A	50	40
CC(=O)N1CCC[C@@H]1C(=O)O[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F	ZINC000875417911	GH	On-Demand	Anodyne	ELANE	59	36
CC(=O)N1CCC[C@@H]1C(=O)O[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F	ZINC000875417911	GH	On-Demand	Anodyne	PREP	43	33
CC(=O)N1CCC[C@@H]1C(=O)O[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F	ZINC000875417911	GH	On-Demand	Anodyne	SFRP1	47	35
CC(=O)N1CCC[C@@H]1C(=O)O[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F	ZINC000875417911	GH	On-Demand	Anodyne	WNT3	55	41
CS(=O)(=O)N1CC[C@@H](CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000875418013	GC	On-Demand	Anodyne	EPHX2	16	42
CS(=O)(=O)N1CC[C@@H](CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000875418013	GC	On-Demand	Anodyne	CACNA1I	58	39
CS(=O)(=O)N1CC[C@H](CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000875418014	GC	On-Demand	Anodyne	EPHX2	16	42
CS(=O)(=O)N1CC[C@H](CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000875418014	GC	On-Demand	Anodyne	CACNA1I	58	39
CS(=O)(=O)N1CC[C@H](CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000875418015	GC	On-Demand	Anodyne	EPHX2	16	42
CS(=O)(=O)N1CC[C@H](CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000875418015	GC	On-Demand	Anodyne	CACNA1I	58	39
CS(=O)(=O)N1CC[C@@H](CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000875418016	GC	On-Demand	Anodyne	EPHX2	16	42
CS(=O)(=O)N1CC[C@@H](CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000875418016	GC	On-Demand	Anodyne	CACNA1I	58	39
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CC[C@@H](O)CC2)CC1	ZINC000875418091	EG	On-Demand	Anodyne	EPHX2	30	43
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CC[C@@H](O)CC2)CC1	ZINC000875418091	EG	On-Demand	Anodyne	RBP4	41	43
COc1ccccc1[C@H]1CCCN(C(=O)N[C@@H]2CC[C@@H](O)CC2)CC1	ZINC000875418093	EG	On-Demand	Anodyne	EPHX2	30	43
COc1ccccc1[C@H]1CCCN(C(=O)N[C@@H]2CC[C@@H](O)CC2)CC1	ZINC000875418093	EG	On-Demand	Anodyne	RBP4	41	43
O=C(N[C@@H]1CC[C@@H](O)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875418113	DD	On-Demand	Anodyne	EPHX2	29	47
O=C(N[C@@H]1CC[C@@H](O)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875418114	DD	On-Demand	Anodyne	EPHX2	29	47
O=C(NCc1ccc(O)c(Cl)c1)N[C@@H]1CC[C@@H](O)CC1	ZINC000875418151	CE	On-Demand	Anodyne	NCE103	17	47
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)[C@@]1(CC)CCNC1=O	ZINC000875418190	GF	On-Demand	Anodyne	HCN1	42	34
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)[C@@]1(CC)CCNC1=O	ZINC000875418190	GF	On-Demand	Anodyne	HCN4	42	34
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)[C@]1(CC)CCNC1=O	ZINC000875418193	GF	On-Demand	Anodyne	HCN1	42	34
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)[C@]1(CC)CCNC1=O	ZINC000875418193	GF	On-Demand	Anodyne	HCN4	42	34
O=C(NCCOc1ccccc1Cl)N1CCC(CO)(CO)CC1	ZINC000875418235	ED	On-Demand	Anodyne	EPHX2	15	43
CN1CCN(C2CCN(C(=O)C(=O)NCC(C)(C)c3cccnc3)CC2)CC1	ZINC000875418242	GC	On-Demand	Anodyne	L3MBTL3	47	40
CC[C@H]1CN(C(=O)C(C)C)CC[C@H]1NC(=O)N[C@@H](CO)c1ccc(Cl)cc1	ZINC000875418315	GF	On-Demand	Anodyne	CCR1	45	39
CC[C@H]1CN(C(=O)C(C)C)CC[C@@H]1NC(=O)N[C@@H](CO)c1ccc(Cl)cc1	ZINC000875418316	GF	On-Demand	Anodyne	CCR1	45	39
C[C@@H]1CC[C@H](NC(=O)N2CCO[C@H](c3noc(C4CC4)n3)C2)c2ccccc21	ZINC000875418333	GH	On-Demand	Anodyne	ETHR	46	33
C[C@@H]1CC[C@H](NC(=O)N2CCO[C@@H](c3noc(C4CC4)n3)C2)c2ccccc21	ZINC000875418335	GH	On-Demand	Anodyne	ETHR	46	33
CC[C@H]1CN(C(=O)C(C)C)CC[C@@H]1NC(=O)NC1CC(Nc2ccccc2)C1	ZINC000875418346	GG	On-Demand	Anodyne	EPHX2	24	44
CC[C@H]1CN(C(=O)C(C)C)CC[C@H]1NC(=O)NC1CC(Nc2ccccc2)C1	ZINC000875418347	GG	On-Demand	Anodyne	EPHX2	24	44
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCOC3)cn2)cc1	ZINC000875418408	DD	On-Demand	Mild	CCR3	20	41
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCOC3)cn2)cc1	ZINC000875418408	DD	On-Demand	Mild	ITK	16	49
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCOC3)cn2)cc1	ZINC000875418408	DD	On-Demand	Mild	PANC	56	39
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCOC3)cn2)cc1	ZINC000875418409	DD	On-Demand	Mild	CCR3	20	41
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCOC3)cn2)cc1	ZINC000875418409	DD	On-Demand	Mild	ITK	16	49
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCOC3)cn2)cc1	ZINC000875418409	DD	On-Demand	Mild	PANC	56	39
CC[C@@H](NC(=O)N[C@@H]1CC[C@@H](O)CC1)[C@@H](O)c1ccccc1	ZINC000875418430	DE	On-Demand	Anodyne	XIAP	49	40
CC[C@@H](NC(=O)N[C@@H]1CC[C@@H](O)CC1)[C@H](O)c1ccccc1	ZINC000875418431	DE	On-Demand	Anodyne	XIAP	49	40
O=C(N[C@H]1CCN(CC(F)F)C1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875418444	GD	On-Demand	Anodyne	CHRNA7	40	36
O=C(N[C@H]1CCN(CC(F)F)C1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875418444	GD	On-Demand	Anodyne	C3AR1	48	46
O=C(N[C@@H]1CCN(CC(F)F)C1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875418446	GD	On-Demand	Anodyne	CHRNA7	40	36
O=C(N[C@@H]1CCN(CC(F)F)C1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875418446	GD	On-Demand	Anodyne	C3AR1	48	46
O=C(N[C@H]1CCN(CC(F)F)C1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875418448	GD	On-Demand	Anodyne	CHRNA7	40	36
O=C(N[C@H]1CCN(CC(F)F)C1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875418448	GD	On-Demand	Anodyne	C3AR1	48	46
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H]1CCN(CC(F)F)C1	ZINC000875418450	GD	On-Demand	Anodyne	CHRNA7	40	36
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H]1CCN(CC(F)F)C1	ZINC000875418450	GD	On-Demand	Anodyne	C3AR1	48	46
O=C(N[C@@H]1CC[C@@H](O)CC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875418526	EF	On-Demand	Anodyne	SMO	40	50
O=C(N[C@@H]1CC[C@@H](O)CC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875418526	EF	On-Demand	Anodyne	ETHR	62	52
CC(=O)[C@@H]1CCCN(C(=O)NC2CCC(N3CCC(C)CC3)CC2)C1	ZINC000875418530	EG	On-Demand	Anodyne	L3MBTL3	40	35
CC(=O)[C@H]1CCCN(C(=O)NC2CCC(N3CCC(C)CC3)CC2)C1	ZINC000875418532	EG	On-Demand	Anodyne	L3MBTL3	40	35
COc1cccc([C@H](O)C2CCN(C(=O)N[C@@H]3CC[C@@H](O)CC3)CC2)c1	ZINC000875418543	FE	On-Demand	Anodyne	MTNR1A	18	40
COc1cccc([C@H](O)C2CCN(C(=O)N[C@@H]3CC[C@@H](O)CC3)CC2)c1	ZINC000875418543	FE	On-Demand	Anodyne	MTNR1B	27	40
COc1cccc([C@H](O)C2CCN(C(=O)N[C@@H]3CC[C@@H](O)CC3)CC2)c1	ZINC000875418543	FE	On-Demand	Anodyne	EPHX2	20	44
CS(=O)(=O)N1CC[C@H](CNC(=O)N2CCC[C@](O)(c3ccccc3)C2)C1	ZINC000875418593	GC	On-Demand	Anodyne	EPHX2	16	41
CS(=O)(=O)N1CC[C@@H](CNC(=O)N2CCC[C@](O)(c3ccccc3)C2)C1	ZINC000875418594	GC	On-Demand	Anodyne	EPHX2	16	41
CS(=O)(=O)N1CC[C@H](CNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)C1	ZINC000875418595	GC	On-Demand	Anodyne	EPHX2	16	41
CS(=O)(=O)N1CC[C@@H](CNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)C1	ZINC000875418596	GC	On-Demand	Anodyne	EPHX2	16	41
C[C@H]1CC[C@@H](NC(=O)N2CCC(N3CCN(C)CC3)CC2)c2ccccc21	ZINC000875418606	FG	On-Demand	Anodyne	EPHX2	15	43
C[C@H]1CC[C@@H](NC(=O)N2CCC(N3CCN(C)CC3)CC2)c2ccccc21	ZINC000875418606	FG	On-Demand	Anodyne	L3MBTL3	75	43
C[C@H]1CC[C@H](NC(=O)N2CCC(N3CCN(C)CC3)CC2)c2ccccc21	ZINC000875418608	FG	On-Demand	Anodyne	EPHX2	15	43
C[C@H]1CC[C@H](NC(=O)N2CCC(N3CCN(C)CC3)CC2)c2ccccc21	ZINC000875418608	FG	On-Demand	Anodyne	L3MBTL3	75	43
C[C@H]1CC[C@@H](NC(=O)N2CCC(CO)(CO)CC2)c2ccccc21	ZINC000875418619	EE	On-Demand	Anodyne	EPHX2	21	44
C[C@H]1CC[C@H](NC(=O)N2CCC(CO)(CO)CC2)c2ccccc21	ZINC000875418620	EE	On-Demand	Anodyne	EPHX2	21	44
CO[C@H](CNC(=O)C(=O)NCc1cccc2ncccc12)CC(C)C	ZINC000875418621	EE	On-Demand	Anodyne	ANPEP	17	40
CO[C@H](CNC(=O)C(=O)NCc1cccc2ncccc12)CC(C)C	ZINC000875418621	EE	On-Demand	Anodyne	AMP1_PLAFQ	19	41
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)C1(OC(C)C)CCC1	ZINC000875418680	GH	On-Demand	Anodyne	HCN1	45	34
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)C1(OC(C)C)CCC1	ZINC000875418680	GH	On-Demand	Anodyne	HCN4	42	34
O=C(N[C@@H]1CC[C@@H](O)CC1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875418705	GF	On-Demand	Anodyne	MERTK	19	40
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)c1c(OC)ccc(F)c1OC	ZINC000875418850	GG	On-Demand	Anodyne	F10	21	41
CCOc1ccc(C(=O)N(C)C)cc1NC(=O)c1c(OC)ccc(F)c1OC	ZINC000875418850	GG	On-Demand	Anodyne	SLC9A1	48	34
CS(=O)(=O)N1CC[C@H](CNC(=O)NC2CC(Nc3ccccc3)C2)C1	ZINC000875418851	FD	On-Demand	Anodyne	EPHX2	31	40
CS(=O)(=O)N1CC[C@@H](CNC(=O)NC2CC(Nc3ccccc3)C2)C1	ZINC000875418852	FD	On-Demand	Anodyne	EPHX2	31	40
CC[C@H]1CN(C(=O)C(C)C)CC[C@H]1NC(=O)NC1CCC(OC(C)(C)C)CC1	ZINC000875418869	GH	On-Demand	Anodyne	EPHX2	17	43
CC[C@H]1CN(C(=O)C(C)C)CC[C@@H]1NC(=O)NC1CCC(OC(C)(C)C)CC1	ZINC000875418870	GH	On-Demand	Anodyne	EPHX2	17	43
O=C(N[C@@H]1CC[C@@H](O)CC1)N1CC2(CC(=O)N2Cc2ccccc2)C1	ZINC000875418893	ED	On-Demand	Anodyne	DRD4	15	41
O=C(N[C@@H]1CC[C@@H](O)CC1)N1CC2(CC(=O)N2Cc2ccccc2)C1	ZINC000875418893	ED	On-Demand	Anodyne	SIGMAR1	17	40
O=C(NC1CCN(C(=O)N[C@@H]2CC[C@@H](O)CC2)CC1)OCc1ccccc1	ZINC000875418895	GE	On-Demand	Anodyne	DRD4	18	45
O=C(NC1CCN(C(=O)N[C@@H]2CC[C@@H](O)CC2)CC1)OCc1ccccc1	ZINC000875418895	GE	On-Demand	Anodyne	GRIN2B	39	42
O=C(NC1CCN(C(=O)N[C@@H]2CC[C@@H](O)CC2)CC1)OCc1ccccc1	ZINC000875418895	GE	On-Demand	Anodyne	SIGMAR1	18	43
O=C(NC1CCN(C(=O)N[C@@H]2CC[C@@H](O)CC2)CC1)OCc1ccccc1	ZINC000875418895	GE	On-Demand	Anodyne	CTSB	31	58
O=C(NC1CCN(C(=O)N[C@@H]2CC[C@@H](O)CC2)CC1)OCc1ccccc1	ZINC000875418895	GE	On-Demand	Anodyne	CTSK	30	58
O=C(NC1CCN(C(=O)N[C@@H]2CC[C@@H](O)CC2)CC1)OCc1ccccc1	ZINC000875418895	GE	On-Demand	Anodyne	CTSL	39	58
O=C(NC1CCN(C(=O)N[C@@H]2CC[C@@H](O)CC2)CC1)OCc1ccccc1	ZINC000875418895	GE	On-Demand	Anodyne	PREP	30	43
O=C(NC1CCN(C(=O)N[C@@H]2CC[C@@H](O)CC2)CC1)OCc1ccccc1	ZINC000875418895	GE	On-Demand	Anodyne	CAPNS1	46	30
O=C(NC1CCN(C(=O)N[C@@H]2CC[C@@H](O)CC2)CC1)OCc1ccccc1	ZINC000875418895	GE	On-Demand	Anodyne	CAPN1	41	37
O=C(NC1CCN(C(=O)N[C@@H]2CC[C@@H](O)CC2)CC1)OCc1ccccc1	ZINC000875418895	GE	On-Demand	Anodyne	CAPN2	61	35
O=C(NC1CCN(C(=O)N[C@@H]2CC[C@@H](O)CC2)CC1)OCc1ccccc1	ZINC000875418895	GE	On-Demand	Anodyne	EPHX2	56	41
O=C(NC1CCN(C(=O)N[C@@H]2CC[C@@H](O)CC2)CC1)OCc1ccccc1	ZINC000875418895	GE	On-Demand	Anodyne	TGM2	37	48
O=C(NC1CCN(C(=O)N[C@@H]2CC[C@@H](O)CC2)CC1)OCc1ccccc1	ZINC000875418895	GE	On-Demand	Anodyne	DPP7	18	53
O=C(NC1CCN(C(=O)N[C@@H]2CC[C@@H](O)CC2)CC1)OCc1ccccc1	ZINC000875418895	GE	On-Demand	Anodyne	TPSAB1	16	42
O=C(NC1CCN(C(=O)N[C@@H]2CC[C@@H](O)CC2)CC1)OCc1ccccc1	ZINC000875418895	GE	On-Demand	Anodyne	F13A1	28	48
O=C(NC1CCN(C(=O)N[C@@H]2CC[C@@H](O)CC2)CC1)OCc1ccccc1	ZINC000875418895	GE	On-Demand	Anodyne	NAAA	60	39
O=C(NC1CCN(C(=O)N[C@@H]2CC[C@@H](O)CC2)CC1)OCc1ccccc1	ZINC000875418895	GE	On-Demand	Anodyne	SLC12A5	71	39
O=C(NC1CCN(C(=O)N[C@@H]2CC[C@@H](O)CC2)CC1)OCc1ccccc1	ZINC000875418895	GE	On-Demand	Anodyne	Q9NAW4_PLAFA	35	40
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)[C@]1(C)CCC(=O)N1	ZINC000875418896	FE	On-Demand	Anodyne	HCN1	41	32
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)[C@]1(C)CCC(=O)N1	ZINC000875418896	FE	On-Demand	Anodyne	HCN4	40	32
COc1ccccc1[C@@H]1CN(C(=O)C(=O)N[C@H]2CCN(CC(F)F)C2)CCO1	ZINC000875418911	GD	On-Demand	Anodyne	DRD4	19	42
COc1ccccc1[C@@H]1CN(C(=O)C(=O)N[C@@H]2CCN(CC(F)F)C2)CCO1	ZINC000875418912	GD	On-Demand	Anodyne	DRD4	19	42
COc1ccccc1[C@H]1CN(C(=O)C(=O)N[C@@H]2CCN(CC(F)F)C2)CCO1	ZINC000875418913	GD	On-Demand	Anodyne	DRD4	19	42
COc1ccccc1[C@H]1CN(C(=O)C(=O)N[C@H]2CCN(CC(F)F)C2)CCO1	ZINC000875418914	GD	On-Demand	Anodyne	DRD4	19	42
O=C(N[C@@H]1CCN(CC(F)F)C1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875418919	GD	On-Demand	Anodyne	OXTR	49	36
O=C(N[C@@H]1CCN(CC(F)F)C1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875418919	GD	On-Demand	Anodyne	SIGMAR1	18	40
O=C(N[C@@H]1CCN(CC(F)F)C1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875418919	GD	On-Demand	Anodyne	SLC18A3	16	40
O=C(N[C@H]1CCN(CC(F)F)C1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875418920	GD	On-Demand	Anodyne	OXTR	49	36
O=C(N[C@H]1CCN(CC(F)F)C1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875418920	GD	On-Demand	Anodyne	SIGMAR1	18	40
O=C(N[C@H]1CCN(CC(F)F)C1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875418920	GD	On-Demand	Anodyne	SLC18A3	16	40
O=C(N[C@@H]1CCN(CC(F)F)C1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875418921	GD	On-Demand	Anodyne	OXTR	49	36
O=C(N[C@@H]1CCN(CC(F)F)C1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875418921	GD	On-Demand	Anodyne	SIGMAR1	18	40
O=C(N[C@@H]1CCN(CC(F)F)C1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875418921	GD	On-Demand	Anodyne	SLC18A3	16	40
O=C(N[C@H]1CCN(CC(F)F)C1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875418922	GD	On-Demand	Anodyne	OXTR	49	36
O=C(N[C@H]1CCN(CC(F)F)C1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875418922	GD	On-Demand	Anodyne	SIGMAR1	18	40
O=C(N[C@H]1CCN(CC(F)F)C1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875418922	GD	On-Demand	Anodyne	SLC18A3	16	40
O=C(N[C@@H]1CCN(CC(F)F)C1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875418923	GD	On-Demand	Anodyne	BIRC2	36	40
O=C(N[C@@H]1CCN(CC(F)F)C1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875418924	GD	On-Demand	Anodyne	BIRC2	36	40
O=C(N[C@@H]1CCN(CC(F)F)C1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875418925	GD	On-Demand	Anodyne	BIRC2	36	40
O=C(N[C@@H]1CCN(CC(F)F)C1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875418926	GD	On-Demand	Anodyne	BIRC2	36	40
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)C1(C)CC(F)(F)C1	ZINC000875418951	GI	On-Demand	Anodyne	HCN1	41	32
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)C1(C)CC(F)(F)C1	ZINC000875418951	GI	On-Demand	Anodyne	HCN4	41	32
CC[C@@H](NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1)[C@H]1CC1(C)C	ZINC000875419104	GF	On-Demand	Anodyne	ETHR	54	46
CC[C@@H](NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1)[C@@H]1CC1(C)C	ZINC000875419105	GF	On-Demand	Anodyne	ETHR	54	46
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)[C@]1(C#N)CCCOC1	ZINC000875419112	GF	On-Demand	Mild	HCN1	41	33
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)[C@]1(C#N)CCCOC1	ZINC000875419112	GF	On-Demand	Mild	HCN4	41	33
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)[C@@]1(C#N)CCCOC1	ZINC000875419113	GF	On-Demand	Mild	HCN1	41	33
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)[C@@]1(C#N)CCCOC1	ZINC000875419113	GF	On-Demand	Mild	HCN4	41	33
CC[C@H]1CN(C(=O)C(C)C)CC[C@@H]1NC(=O)N(C)[C@@H](C)c1ccc(Cl)cc1	ZINC000875419120	GI	On-Demand	Anodyne	CCR1	41	39
CC[C@H]1CN(C(=O)C(C)C)CC[C@@H]1NC(=O)N(C)[C@H](C)c1ccc(Cl)cc1	ZINC000875419121	GI	On-Demand	Anodyne	CCR1	41	39
CC[C@H]1CN(C(=O)C(C)C)CC[C@H]1NC(=O)N(C)[C@H](C)c1ccc(Cl)cc1	ZINC000875419122	GI	On-Demand	Anodyne	CCR1	41	39
CC[C@H]1CN(C(=O)C(C)C)CC[C@H]1NC(=O)N(C)[C@@H](C)c1ccc(Cl)cc1	ZINC000875419123	GI	On-Demand	Anodyne	CCR1	41	39
C[C@@H]1CC[C@H](NC(=O)N2CC[C@@H](C(C)(C)O)C2)c2ccccc21	ZINC000875419243	DG	On-Demand	Anodyne	RBP4	51	35
C[C@@H]1CC[C@H](NC(=O)N2CC[C@H](C(C)(C)O)C2)c2ccccc21	ZINC000875419247	DG	On-Demand	Anodyne	RBP4	51	35
CCCCCCCNC(=O)C(=O)NC[C@@H]1CC12CCSCC2	ZINC000875419299	EF	On-Demand	Mild	EPHX2	24	46
CCCCCCCNC(=O)C(=O)NC[C@H]1CC12CCSCC2	ZINC000875419300	EF	On-Demand	Mild	EPHX2	24	46
CC[C@H]1CN(C(=O)C(C)C)CC[C@H]1NC(=O)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875419352	GH	On-Demand	Anodyne	CCR5	15	42
CC[C@H]1CN(C(=O)C(C)C)CC[C@H]1NC(=O)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875419352	GH	On-Demand	Anodyne	EPHX2	23	43
CC[C@H]1CN(C(=O)C(C)C)CC[C@@H]1NC(=O)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875419355	GH	On-Demand	Anodyne	CCR5	15	42
CC[C@H]1CN(C(=O)C(C)C)CC[C@@H]1NC(=O)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875419355	GH	On-Demand	Anodyne	EPHX2	23	43
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1cc(C)nc(C)c1)CC2	ZINC000875419452	GE	On-Demand	Anodyne	SLC18A2	46	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1cc(C)nc(C)c1)CC2	ZINC000875419452	GE	On-Demand	Anodyne	HCRTR1	15	44
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1cc(C)nc(C)c1)CC2	ZINC000875419453	GE	On-Demand	Anodyne	SLC18A2	46	34
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1cc(C)nc(C)c1)CC2	ZINC000875419453	GE	On-Demand	Anodyne	HCRTR1	15	44
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)N[C@@H]1CC[C@@H](O)CC1)CC2	ZINC000875419466	EF	On-Demand	Anodyne	SLC18A2	49	38
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@@H]1CC[C@@H](O)CC1)CC2	ZINC000875419467	EF	On-Demand	Anodyne	SLC18A2	49	38
O=C(NCCO)C1CCN(C(=O)NCCOCc2ccc(Cl)cc2)CC1	ZINC000875419478	GD	On-Demand	Anodyne	EPHX2	17	52
C[C@@H]1CC[C@H](NC(=O)N2CC[C@H]3[C@H](CCN3C)C2)c2ccccc21	ZINC000875419532	EG	On-Demand	Anodyne	RBP4	52	32
C[C@@H]1CC[C@H](NC(=O)N2CC[C@@H]3[C@@H](CCN3C)C2)c2ccccc21	ZINC000875419533	EG	On-Demand	Anodyne	RBP4	52	32
C[C@@H]1CC[C@H](NC(=O)N2CC[C@H]3[C@@H](CCN3C)C2)c2ccccc21	ZINC000875419534	EG	On-Demand	Anodyne	RBP4	52	32
C[C@@H]1CC[C@H](NC(=O)N2CC[C@@H]3[C@H](CCN3C)C2)c2ccccc21	ZINC000875419535	EG	On-Demand	Anodyne	RBP4	52	32
C[C@H]1CC[C@@H](NC(=O)N2CCC3(CCNC3=O)CC2)c2ccccc21	ZINC000875419636	EF	On-Demand	Anodyne	CALCRL	32	53
C[C@H]1CC[C@H](NC(=O)N2CCC3(CCNC3=O)CC2)c2ccccc21	ZINC000875419637	EF	On-Demand	Anodyne	CALCRL	32	53
CO[C@H](CNC(=O)C(=O)NCc1nc(-c2ccncc2)cs1)CC(C)C	ZINC000875419642	GD	On-Demand	Anodyne	ROCK1	24	41
CO[C@H](CNC(=O)C(=O)NCc1nc(-c2ccncc2)cs1)CC(C)C	ZINC000875419642	GD	On-Demand	Anodyne	ROCK2	17	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2ccccn2)C1	ZINC000875419650	ED	On-Demand	Anodyne	SLC6A4	22	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2ccccn2)C1	ZINC000875419650	ED	On-Demand	Anodyne	SLC6A3	42	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2ccccn2)C1	ZINC000875419651	ED	On-Demand	Anodyne	SLC6A4	22	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2ccccn2)C1	ZINC000875419651	ED	On-Demand	Anodyne	SLC6A3	42	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2ccccn2)C1	ZINC000875419652	ED	On-Demand	Anodyne	SLC6A4	22	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(c2ccccn2)C1	ZINC000875419652	ED	On-Demand	Anodyne	SLC6A3	42	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2ccccn2)C1	ZINC000875419653	ED	On-Demand	Anodyne	SLC6A4	22	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(c2ccccn2)C1	ZINC000875419653	ED	On-Demand	Anodyne	SLC6A3	42	40
CCCCCCCNC(=O)C(=O)NCc1cc(C)nc(C)c1	ZINC000875419688	DE	On-Demand	Mild	LPAR2	43	34
CCCCCCCNC(=O)C(=O)NCc1cc(C)nc(C)c1	ZINC000875419688	DE	On-Demand	Mild	S1PR2	58	34
CCCCCCCNC(=O)C(=O)NCc1cc(C)nc(C)c1	ZINC000875419688	DE	On-Demand	Mild	ASAH1	93	38
O=C(N[C@H]1CCN(c2ccccn2)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875419690	FE	On-Demand	Anodyne	EPHX2	17	40
O=C(N[C@@H]1CCN(c2ccccn2)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875419691	FE	On-Demand	Anodyne	EPHX2	17	40
O=C(N[C@H]1CCN(c2ccccn2)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875419692	FE	On-Demand	Anodyne	EPHX2	17	40
O=C(N[C@@H]1CCN(c2ccccn2)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875419693	FE	On-Demand	Anodyne	EPHX2	17	40
CC(=O)C1CCN(C(=O)N[C@@H](C[C@H]2CCOC2)c2ccccc2)CC1	ZINC000875419721	EG	On-Demand	Anodyne	CCR5	22	40
CC(=O)C1CCN(C(=O)N[C@@H](C[C@@H]2CCOC2)c2ccccc2)CC1	ZINC000875419722	EG	On-Demand	Anodyne	CCR5	22	40
CC(=O)C1CCN(C(=O)N[C@H](C[C@@H]2CCOC2)c2ccccc2)CC1	ZINC000875419723	EG	On-Demand	Anodyne	CCR5	22	40
CC(=O)C1CCN(C(=O)N[C@H](C[C@H]2CCOC2)c2ccccc2)CC1	ZINC000875419724	EG	On-Demand	Anodyne	CCR5	22	40
CCC1(CNC(=O)NN(C)C(=O)OC)CCN(Cc2ccccc2)CC1	ZINC000875419726	FF	On-Demand	Reactive	DRD4	22	40
CCC1(CNC(=O)NN(C)C(=O)OC)CCN(Cc2ccccc2)CC1	ZINC000875419726	FF	On-Demand	Reactive	SIGMAR1	58	38
CCC1(CNC(=O)NN(C)C(=O)OC)CCN(Cc2ccccc2)CC1	ZINC000875419726	FF	On-Demand	Reactive	NPFFR2	42	49
CCC1(CNC(=O)NN(C)C(=O)OC)CCN(Cc2ccccc2)CC1	ZINC000875419726	FF	On-Demand	Reactive	NPFFR1	55	49
C[C@@H](O)C1CCN(C(=O)N[C@H](C[C@H]2CCOC2)c2ccccc2)CC1	ZINC000875419750	EF	On-Demand	Anodyne	CCR5	18	42
C[C@@H](O)C1CCN(C(=O)N[C@@H](C[C@H]2CCOC2)c2ccccc2)CC1	ZINC000875419751	EF	On-Demand	Anodyne	CCR5	18	42
O=C(N[C@@H]1CCN(c2ccccn2)C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875419773	FF	On-Demand	Anodyne	EPHX2	22	46
O=C(N[C@H]1CCN(c2ccccn2)C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875419774	FF	On-Demand	Anodyne	EPHX2	22	46
O=C(N[C@@H]1CCN(c2ccccn2)C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875419775	FF	On-Demand	Anodyne	EPHX2	22	46
O=C(N[C@H]1CCN(c2ccccn2)C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875419776	FF	On-Demand	Anodyne	EPHX2	22	46
C[S@](=N)(=O)N1CCN(C(=O)N[C@H](C[C@@H]2CCOC2)c2ccccc2)CC1	ZINC000875419801	GE	On-Demand	Anodyne	CCR5	15	40
C[S@](=N)(=O)N1CCN(C(=O)N[C@H](C[C@H]2CCOC2)c2ccccc2)CC1	ZINC000875419802	GE	On-Demand	Anodyne	CCR5	15	40
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H](C[C@H]2CCOC2)c2ccccc2)CC1	ZINC000875419803	GE	On-Demand	Anodyne	CCR5	15	40
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H](C[C@@H]2CCOC2)c2ccccc2)CC1	ZINC000875419804	GE	On-Demand	Anodyne	CCR5	15	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C[C@@H]2CCOC2)c2ccccc2)C1	ZINC000875419865	FF	On-Demand	Anodyne	REN	22	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C[C@H]2CCOC2)c2ccccc2)C1	ZINC000875419866	FF	On-Demand	Anodyne	REN	22	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C[C@@H]2CCOC2)c2ccccc2)C1	ZINC000875419867	FF	On-Demand	Anodyne	REN	22	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C[C@H]2CCOC2)c2ccccc2)C1	ZINC000875419868	FF	On-Demand	Anodyne	REN	22	40
CCC1(CNC(=O)NC[C@H]2C[C@H](O)C2)CCN(Cc2ccccc2)CC1	ZINC000875419910	FF	On-Demand	Anodyne	DRD4	26	41
CCC1(CNC(=O)NC[C@H]2C[C@H](O)C2)CCN(Cc2ccccc2)CC1	ZINC000875419910	FF	On-Demand	Anodyne	ACHE	33	41
CCC1(CNC(=O)NC[C@H]2C[C@H](O)C2)CCN(Cc2ccccc2)CC1	ZINC000875419910	FF	On-Demand	Anodyne	SIGMAR1	65	39
CCC1(CNC(=O)NC[C@H]2C[C@H](O)C2)CCN(Cc2ccccc2)CC1	ZINC000875419910	FF	On-Demand	Anodyne	NPFFR2	43	49
CCC1(CNC(=O)NC[C@H]2C[C@H](O)C2)CCN(Cc2ccccc2)CC1	ZINC000875419910	FF	On-Demand	Anodyne	CACNA1G	17	40
CCC1(CNC(=O)NC[C@H]2C[C@H](O)C2)CCN(Cc2ccccc2)CC1	ZINC000875419910	FF	On-Demand	Anodyne	NPFFR1	54	49
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NCc2cc(C)nc(C)c2)CCO1	ZINC000875419935	GD	On-Demand	Anodyne	DRD4	15	41
COc1ccccc1[C@H]1CN(C(=O)C(=O)NCc2cc(C)nc(C)c2)CCO1	ZINC000875419936	GD	On-Demand	Anodyne	DRD4	15	41
O=C(N[C@H]1CCN(c2ccccn2)C1)N1Cc2cccc(O)c2C1	ZINC000875419969	DE	On-Demand	Clean	SSTR1	15	40
O=C(N[C@@H]1CCN(c2ccccn2)C1)N1Cc2cccc(O)c2C1	ZINC000875419970	DE	On-Demand	Clean	SSTR1	15	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C[C@@H]1CCOC1)c1ccccc1	ZINC000875420008	FF	On-Demand	Anodyne	SLC6A4	18	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C[C@@H]1CCOC1)c1ccccc1	ZINC000875420008	FF	On-Demand	Anodyne	SLC6A3	44	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C[C@H]1CCOC1)c1ccccc1	ZINC000875420009	FF	On-Demand	Anodyne	SLC6A4	18	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C[C@H]1CCOC1)c1ccccc1	ZINC000875420009	FF	On-Demand	Anodyne	SLC6A3	44	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C[C@@H]1CCOC1)c1ccccc1	ZINC000875420010	FF	On-Demand	Anodyne	SLC6A4	18	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C[C@@H]1CCOC1)c1ccccc1	ZINC000875420010	FF	On-Demand	Anodyne	SLC6A3	44	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C[C@H]1CCOC1)c1ccccc1	ZINC000875420011	FF	On-Demand	Anodyne	SLC6A4	18	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C[C@H]1CCOC1)c1ccccc1	ZINC000875420011	FF	On-Demand	Anodyne	SLC6A3	44	41
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C[C@H]2CCOC2)c2ccccc2)C1	ZINC000875420018	EG	On-Demand	Anodyne	SLC6A1	50	35
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C[C@H]2CCOC2)c2ccccc2)C1	ZINC000875420018	EG	On-Demand	Anodyne	CCR5	25	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C[C@H]2CCOC2)c2ccccc2)C1	ZINC000875420019	EG	On-Demand	Anodyne	SLC6A1	50	35
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C[C@H]2CCOC2)c2ccccc2)C1	ZINC000875420019	EG	On-Demand	Anodyne	CCR5	25	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C[C@@H]2CCOC2)c2ccccc2)C1	ZINC000875420020	EG	On-Demand	Anodyne	SLC6A1	50	35
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](C[C@@H]2CCOC2)c2ccccc2)C1	ZINC000875420020	EG	On-Demand	Anodyne	CCR5	25	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C[C@@H]2CCOC2)c2ccccc2)C1	ZINC000875420021	EG	On-Demand	Anodyne	SLC6A1	50	35
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C[C@@H]2CCOC2)c2ccccc2)C1	ZINC000875420021	EG	On-Demand	Anodyne	CCR5	25	40
Cc1ccc(-n2nc(C)cc2NC(=O)c2noc3c2CC(C)(C)CC3)nn1	ZINC000875420080	FG	On-Demand	Anodyne	PANC	49	32
Cc1cncc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)c1	ZINC000875420081	EI	On-Demand	Anodyne	CSF1R	17	42
Cc1cncc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)c1	ZINC000875420081	EI	On-Demand	Anodyne	KCNK3	83	41
Cc1cncc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)c1	ZINC000875420081	EI	On-Demand	Anodyne	KCNK9	45	40
Cc1ccc(-n2nc(C)cc2NC(=O)[C@@H](Cc2cccnc2)C2CCCC2)nn1	ZINC000875420188	GH	On-Demand	Anodyne	C3AR1	41	42
Cc1ccc(-n2nc(C)cc2NC(=O)[C@H](Cc2cccnc2)C2CCCC2)nn1	ZINC000875420189	GH	On-Demand	Anodyne	C3AR1	41	42
CCC1(CNC(=O)N2CCCN(C=O)CC2)CCN(Cc2ccccc2)CC1	ZINC000875420190	GF	On-Demand	Anodyne	SIGMAR1	53	40
CCC1(CNC(=O)N2CCCN(C=O)CC2)CCN(Cc2ccccc2)CC1	ZINC000875420190	GF	On-Demand	Anodyne	NPFFR2	40	48
CCC1(CNC(=O)N2CCCN(C=O)CC2)CCN(Cc2ccccc2)CC1	ZINC000875420190	GF	On-Demand	Anodyne	FAAH	19	42
CCC1(CNC(=O)N2CCCN(C=O)CC2)CCN(Cc2ccccc2)CC1	ZINC000875420190	GF	On-Demand	Anodyne	NPFFR1	52	48
O=CN1CCCN(C(=O)NCCOCc2ccc(Cl)cc2)CC1	ZINC000875420363	ED	On-Demand	Anodyne	DPP7	41	38
O=C(NCC[C@H](O)C1CCCC1)N[C@@H]1CCN(c2ccccn2)C1	ZINC000875420402	ED	On-Demand	Anodyne	EPHX2	17	43
O=C(NCC[C@H](O)C1CCCC1)N[C@H]1CCN(c2ccccn2)C1	ZINC000875420403	ED	On-Demand	Anodyne	EPHX2	17	43
O=C(NCC[C@@H](O)C1CCCC1)N[C@@H]1CCN(c2ccccn2)C1	ZINC000875420404	ED	On-Demand	Anodyne	EPHX2	17	43
O=C(NCC[C@@H](O)C1CCCC1)N[C@H]1CCN(c2ccccn2)C1	ZINC000875420405	ED	On-Demand	Anodyne	EPHX2	17	43
O=C(N[C@@H]1CC[C@@H](O)CC1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875420547	FD	On-Demand	Anodyne	CHRNA7	43	38
O=C(N[C@@H]1CC[C@@H](O)CC1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875420547	FD	On-Demand	Anodyne	C3AR1	46	45
O=C(N[C@@H]1CC[C@@H](O)CC1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875420547	FD	On-Demand	Anodyne	NAMPT	18	42
O=C(N[C@@H]1CC[C@@H](O)CC1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875420548	FD	On-Demand	Anodyne	CHRNA7	43	38
O=C(N[C@@H]1CC[C@@H](O)CC1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875420548	FD	On-Demand	Anodyne	C3AR1	46	45
O=C(N[C@@H]1CC[C@@H](O)CC1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875420548	FD	On-Demand	Anodyne	NAMPT	18	42
CCC1(CNC(=O)NNc2nnc(C)n2C)CCN(Cc2ccccc2)CC1	ZINC000875420653	GE	On-Demand	Reactive	NPFFR2	41	48
CCC1(CNC(=O)NNc2nnc(C)n2C)CCN(Cc2ccccc2)CC1	ZINC000875420653	GE	On-Demand	Reactive	NPFFR1	53	48
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000875420779	EE	On-Demand	Anodyne	SIGMAR1	26	44
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000875420779	EE	On-Demand	Anodyne	S1PR3	17	40
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000875420779	EE	On-Demand	Anodyne	FAAH	45	42
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000875420779	EE	On-Demand	Anodyne	CES1	57	40
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000875420779	EE	On-Demand	Anodyne	AMP1_PLAFQ	23	46
Cc1ccccc1CN1CCO[C@@H](CNC(=O)C(=O)N[C@@H]2CC[C@@H](O)CC2)C1	ZINC000875420784	GC	On-Demand	Anodyne	DRD4	15	45
CC[C@H]1C[C@H](NC(=O)C(=O)NC[C@@H]2CCCCN2Cc2ccccc2)CCO1	ZINC000875420873	GE	On-Demand	Anodyne	DRD2	33	42
CC[C@H]1C[C@H](NC(=O)C(=O)NC[C@@H]2CCCCN2Cc2ccccc2)CCO1	ZINC000875420873	GE	On-Demand	Anodyne	SIGMAR1	19	44
CC[C@H]1C[C@H](NC(=O)C(=O)NC[C@H]2CCCCN2Cc2ccccc2)CCO1	ZINC000875420874	GE	On-Demand	Anodyne	DRD2	33	42
CC[C@H]1C[C@H](NC(=O)C(=O)NC[C@H]2CCCCN2Cc2ccccc2)CCO1	ZINC000875420874	GE	On-Demand	Anodyne	SIGMAR1	19	44
Cc1cccc(CN2CCO[C@@H](CNC(=O)C(=O)N[C@@H]3CC[C@@H](O)CC3)C2)c1	ZINC000875421015	GC	On-Demand	Anodyne	DRD4	38	45
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)N[C@@H]3CC[C@@H](O)CC3)C2)c1	ZINC000875421016	GC	On-Demand	Anodyne	DRD4	38	45
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@@H]1CC[C@@H](O)CC1)CC2	ZINC000875421081	GD	On-Demand	Anodyne	SLC18A2	47	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H]1CC[C@@H](O)CC1)CC2	ZINC000875421082	GD	On-Demand	Anodyne	SLC18A2	47	36
CC[C@H]1C[C@H](NC(=O)C(=O)NCCCCCCc2ccccc2)CCO1	ZINC000875421093	FF	On-Demand	Anodyne	AMP1_PLAFQ	21	41
CC[C@@H]1C[C@@H](NC(=O)C(=O)NCCCCCCc2ccccc2)CCO1	ZINC000875421095	FF	On-Demand	Anodyne	AMP1_PLAFQ	21	41
O=C(N[C@@H]1CC[C@@H](O)CC1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875421129	ED	On-Demand	Anodyne	OXTR	47	38
O=C(N[C@@H]1CC[C@@H](O)CC1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875421129	ED	On-Demand	Anodyne	SLC18A3	16	42
O=C(N[C@@H]1CC[C@@H](O)CC1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875421130	ED	On-Demand	Anodyne	OXTR	47	38
O=C(N[C@@H]1CC[C@@H](O)CC1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875421130	ED	On-Demand	Anodyne	SLC18A3	16	42
COC(=O)CN(C(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1)C1CC1	ZINC000875421168	FF	On-Demand	Anodyne	ACE	38	41
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCCC1(O)CCC1)CC2	ZINC000875421220	GD	On-Demand	Anodyne	SLC18A2	47	37
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCCC1(O)CCC1)CC2	ZINC000875421221	GD	On-Demand	Anodyne	SLC18A2	47	37
O=C(N[C@@H]1CC[C@@H](O)CC1)C(=O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000875421425	GF	On-Demand	Anodyne	SIGMAR1	16	47
O=C(N[C@@H]1CC[C@@H](O)CC1)C(=O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000875421425	GF	On-Demand	Anodyne	EPHX2	21	40
CCCCCCCCNC(=O)N1CCO[C@@H](C(F)F)CC1	ZINC000875421484	DG	On-Demand	Mild	ASAH1	93	40
CCCCCCCCNC(=O)N1CCO[C@H](C(F)F)CC1	ZINC000875421485	DG	On-Demand	Mild	ASAH1	93	40
CCCCCCCCNC(=O)Nc1cnn(C2CCN(C)CC2)c1	ZINC000875421497	EH	On-Demand	Mild	EPHX2	17	45
CCCCCCCCNC(=O)Nc1cnn(C2CCN(C)CC2)c1	ZINC000875421497	EH	On-Demand	Mild	ASAH1	89	36
C[C@H](CNC(=O)N1CC2(CCN(C(=O)OC(C)(C)C)CC2)C1)S(C)(=O)=O	ZINC000875421499	GD	On-Demand	Anodyne	GPR119	23	43
C[C@@H](CNC(=O)N1CC2(CCN(C(=O)OC(C)(C)C)CC2)C1)S(C)(=O)=O	ZINC000875421500	GD	On-Demand	Anodyne	GPR119	23	43
CCCCCCCCNC(=O)N1CCn2nnc(CO)c2C1	ZINC000875421522	DD	On-Demand	Mild	ASAH1	92	37
CCCCCCCCNC(=O)NN(C)C(=O)OC	ZINC000875421531	CE	On-Demand	Reactive	EPHX2	21	43
CCCCCCCCNC(=O)NN(C)C(=O)OC	ZINC000875421531	CE	On-Demand	Reactive	ASAH1	80	34
CN(C)C1CCC(NC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1	ZINC000875421553	FE	On-Demand	Anodyne	OXTR	49	36
CN(C)C1CCC(NC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1	ZINC000875421554	FE	On-Demand	Anodyne	OXTR	49	36
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000875421608	GD	On-Demand	Anodyne	CHRM2	17	47
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000875421608	GD	On-Demand	Anodyne	CHRM1	15	47
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000875421608	GD	On-Demand	Anodyne	DRD2	36	53
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000875421608	GD	On-Demand	Anodyne	DRD4	60	51
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000875421608	GD	On-Demand	Anodyne	ACHE	66	63
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000875421608	GD	On-Demand	Anodyne	DRD3	32	50
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000875421608	GD	On-Demand	Anodyne	SLC6A3	18	50
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000875421608	GD	On-Demand	Anodyne	HTR4	24	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000875421608	GD	On-Demand	Anodyne	CHRM3	23	47
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000875421608	GD	On-Demand	Anodyne	LTA4H	21	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000875421608	GD	On-Demand	Anodyne	SIGMAR1	68	54
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000875421608	GD	On-Demand	Anodyne	BCHE	19	51
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000875421608	GD	On-Demand	Anodyne	CCR3	35	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000875421608	GD	On-Demand	Anodyne	SLC6A5	16	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000875421608	GD	On-Demand	Anodyne	MCHR1	48	47
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000875421608	GD	On-Demand	Anodyne	CACNA1G	29	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000875421608	GD	On-Demand	Anodyne	SIRT3	40	31
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000875421608	GD	On-Demand	Anodyne	SIRT2	44	32
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000875421608	GD	On-Demand	Anodyne	SIRT1	41	36
C[C@@H](CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F)S(C)(=O)=O	ZINC000875421631	FD	On-Demand	Mild	CTSF	70	38
C[C@@H](CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F)S(C)(=O)=O	ZINC000875421631	FD	On-Demand	Mild	CTSK	30	41
C[C@@H](CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F)S(C)(=O)=O	ZINC000875421631	FD	On-Demand	Mild	CTSL	25	40
C[C@@H](CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F)S(C)(=O)=O	ZINC000875421631	FD	On-Demand	Mild	CTSS	19	41
CN(C)C1CCC(NC(=O)C(=O)N2CCN(c3ccc(F)cc3F)CC2)CC1	ZINC000875421636	GD	On-Demand	Anodyne	NPY5R	15	40
CCCCCCCCNC(=O)N(C)C[C@@H]1C[C@H](O)C1	ZINC000875421642	CF	On-Demand	Mild	EPHX2	15	44
CCCCCCCCNC(=O)N(C)C[C@@H]1C[C@H](O)C1	ZINC000875421642	CF	On-Demand	Mild	ASAH1	49	33
CCCCCCCCNC(=O)N1CC(O)(C(=O)OC)C1	ZINC000875421657	CD	On-Demand	Mild	ASAH1	101	39
CCCCCCCCNC(=O)N1CCOC[C@@H]1CNS(C)(=O)=O	ZINC000875421674	ED	On-Demand	Mild	ASAH1	92	41
CCCCCCCCNC(=O)N1CCOC[C@H]1CNS(C)(=O)=O	ZINC000875421676	ED	On-Demand	Mild	ASAH1	92	41
CC[C@H]1C[C@H](NC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)CCO1	ZINC000875421680	GE	On-Demand	Anodyne	ETHR	54	46
CC[C@@H]1C[C@@H](NC(=O)C(=O)N2CCC(c3nc(C4CCC4)no3)CC2)CCO1	ZINC000875421685	GE	On-Demand	Anodyne	ETHR	54	46
CC[C@H]1C[C@H](NC(=O)C(=O)N2CCN(c3ccc(F)cc3F)CC2)CCO1	ZINC000875421699	GD	On-Demand	Anodyne	NPY2R	53	36
CCCCCCCCNC(=O)NCc1cc(OC)no1	ZINC000875421720	CF	On-Demand	Mild	EPHX2	16	41
CCCCCCCCNC(=O)NCc1cc(OC)no1	ZINC000875421720	CF	On-Demand	Mild	ASAH1	76	34
CCCCCCCCNC(=O)N1CCOC[C@@H]1CNC(=O)NC	ZINC000875421741	ED	On-Demand	Mild	EPHX2	21	42
CCCCCCCCNC(=O)N1CCOC[C@@H]1CNC(=O)NC	ZINC000875421741	ED	On-Demand	Mild	ASAH1	92	41
CCCCCCCCNC(=O)N1CCOC[C@H]1CNC(=O)NC	ZINC000875421742	ED	On-Demand	Mild	EPHX2	21	42
CCCCCCCCNC(=O)N1CCOC[C@H]1CNC(=O)NC	ZINC000875421742	ED	On-Demand	Mild	ASAH1	92	41
CC[C@@H]1C[C@@H](NC(=O)C(=O)N2CCN(c3ccc(F)cc3F)CC2)CCO1	ZINC000875421747	GD	On-Demand	Anodyne	NPY2R	53	36
CCCCCCCCNC(=O)NCCN1CC[C@H](O)C1	ZINC000875421765	CD	On-Demand	Mild	EPHX2	25	47
CCCCCCCCNC(=O)NCCN1CC[C@H](O)C1	ZINC000875421765	CD	On-Demand	Mild	ASAH1	69	37
CCCCCCCCNC(=O)NCCN1CC[C@@H](O)C1	ZINC000875421767	CD	On-Demand	Mild	EPHX2	25	47
CCCCCCCCNC(=O)NCCN1CC[C@@H](O)C1	ZINC000875421767	CD	On-Demand	Mild	ASAH1	69	37
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NC1CCN(OC)CC1)CC2	ZINC000875421785	GD	On-Demand	Anodyne	SLC18A2	46	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NC1CCN(OC)CC1)CC2	ZINC000875421787	GD	On-Demand	Anodyne	SLC18A2	46	36
C[C@@H](O)C1CCN(C(=O)N[C@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)c(F)c2)CC1	ZINC000875421793	GF	On-Demand	Anodyne	CACNA1H	41	35
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)c(F)c2)CC1	ZINC000875421795	GF	On-Demand	Anodyne	CACNA1H	41	35
CCCCCCCNC(=O)C(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000875421815	CD	On-Demand	Mild	EPHX2	17	55
CCCCCCCNC(=O)C(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000875421815	CD	On-Demand	Mild	AXL	18	40
CCCCCCCNC(=O)C(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000875421815	CD	On-Demand	Mild	TYRO3	20	40
CCCCCCCNC(=O)C(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000875421815	CD	On-Demand	Mild	MERTK	33	43
CCCCCCCNC(=O)C(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000875421815	CD	On-Demand	Mild	ASAH1	68	36
CCCCCCCNC(=O)C(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000875421815	CD	On-Demand	Mild	LASR	45	32
CC[C@@H]1C[C@@H](NC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CCO1	ZINC000875421850	FE	On-Demand	Anodyne	OXTR	56	38
CC[C@@H]1C[C@@H](NC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CCO1	ZINC000875421851	FE	On-Demand	Anodyne	OXTR	56	38
C[C@@H](O)C1CCN(C(=O)N[C@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)c(F)c2)CC1	ZINC000875421864	GF	On-Demand	Anodyne	CACNA1H	41	35
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)c(F)c2)CC1	ZINC000875421865	GF	On-Demand	Anodyne	CACNA1H	41	35
CCCCCCCCNC(=O)N[C@@H]1C[C@H](CO)C1	ZINC000875421878	CE	On-Demand	Mild	EPHX2	40	63
CCCCCCCCNC(=O)N[C@@H]1C[C@H](CO)C1	ZINC000875421878	CE	On-Demand	Mild	ASAH1	68	34
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)C(=O)N[C@@H]1CC[C@@H](O)CC1	ZINC000875421935	GD	On-Demand	Anodyne	SIGMAR1	25	44
CCCCCCCCNC(=O)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875421978	EF	On-Demand	Mild	CES2	51	42
CCCCCCCCNC(=O)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875421978	EF	On-Demand	Mild	EST1_PIG	72	42
CCCCCCCCNC(=O)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875421978	EF	On-Demand	Mild	CES2C	60	42
CCCCCCCCNC(=O)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875421978	EF	On-Demand	Mild	ASAH1	101	42
CC[C@@H]1C[C@@H](NC(=O)C(=O)N2CCc3cc(OC)c(OC)cc3[C@@H]2C)CCO1	ZINC000875421982	GE	On-Demand	Anodyne	SLC18A2	46	34
CC[C@@H]1C[C@@H](NC(=O)C(=O)N2CCc3cc(OC)c(OC)cc3[C@H]2C)CCO1	ZINC000875421988	GE	On-Demand	Anodyne	SLC18A2	46	34
CN(C)C1CCC(NC(=O)C(=O)NCc2ccc(C3(C)OCCO3)cc2)CC1	ZINC000875422016	GD	On-Demand	Anodyne	AVPR1A	36	42
CCCCCCCCNC(=O)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875422070	DG	On-Demand	Mild	ASAH1	109	45
CCCCCCCCNC(=O)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875422071	DG	On-Demand	Mild	ASAH1	109	45
CCCCCCCCNC(=O)N(C)Cc1ccns1	ZINC000875422072	CH	On-Demand	Mild	ASAH1	86	35
CCCCCCCCNC(=O)N1CC(NS(C)(=O)=O)C1	ZINC000875422073	DD	On-Demand	Mild	ASAH1	97	37
CCCCCCCCNC(=O)N(C)CCN1CC2(CCOCC2)C1	ZINC000875422074	EG	On-Demand	Mild	ASAH1	43	35
CCCCCCCCNC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875422081	CG	On-Demand	Mild	ASAH1	103	41
CCCCCCCCNC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875422082	CG	On-Demand	Mild	ASAH1	103	41
CCCCCCCCNC(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000875422103	EG	On-Demand	Mild	ASAH1	102	39
CCCCCCCCNC(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000875422104	EG	On-Demand	Mild	ASAH1	102	39
N#Cc1cc(F)ccc1NC(=O)[C@H](Cc1cccnc1)C1CCCC1	ZINC000875422106	EI	On-Demand	Mild	C3AR1	41	44
N#Cc1cc(F)ccc1NC(=O)[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875422108	EI	On-Demand	Mild	C3AR1	41	44
CCCCCCCCNC(=O)N[C@@H]1Cc2cncn2C1	ZINC000875422112	CE	On-Demand	Mild	EPHX2	18	49
CCCCCCCCNC(=O)N[C@@H]1Cc2cncn2C1	ZINC000875422112	CE	On-Demand	Mild	ASAH1	80	35
CCCCCCCCNC(=O)N[C@H]1Cc2cncn2C1	ZINC000875422114	CE	On-Demand	Mild	EPHX2	18	49
CCCCCCCCNC(=O)N[C@H]1Cc2cncn2C1	ZINC000875422114	CE	On-Demand	Mild	ASAH1	80	35
CCCCCCCCNC(=O)N1Cc2cccnc2N2C[C@H](O)C[C@H]2C1	ZINC000875422123	FF	On-Demand	Mild	ASAH1	84	34
CCCCCCCCNC(=O)N1CCc2nc(C3CC3)ncc2C1	ZINC000875422143	EH	On-Demand	Mild	ASAH1	90	38
CCCCCCCCNC(=O)N1CC[C@@](OC)(C(=O)OC)C1	ZINC000875422172	DE	On-Demand	Mild	ASAH1	94	36
CCCCCCCCNC(=O)N1CC[C@](OC)(C(=O)OC)C1	ZINC000875422174	DE	On-Demand	Mild	ASAH1	94	36
CCCCCCCCNC(=O)NNc1nnc(C)n1C	ZINC000875422215	CE	On-Demand	Reactive	ASAH1	103	41
CCCCCCCNC(=O)C(=O)NC1CCN(OC)CC1	ZINC000875422217	CD	On-Demand	Mild	EPHX2	17	52
CCCCCCCNC(=O)C(=O)NC1CCN(OC)CC1	ZINC000875422217	CD	On-Demand	Mild	ASAH1	65	34
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H]3CC[C@@H](O)CC3)CC2)c(OC)c1	ZINC000875422246	GC	On-Demand	Clean	DRD2	20	46
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H]3CC[C@@H](O)CC3)CC2)c(OC)c1	ZINC000875422246	GC	On-Demand	Clean	ADRA1D	25	46
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H]3CC[C@@H](O)CC3)CC2)c(OC)c1	ZINC000875422246	GC	On-Demand	Clean	ADRA1A	20	46
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H]3CC[C@@H](O)CC3)CC2)c(OC)c1	ZINC000875422246	GC	On-Demand	Clean	ADRA1B	18	46
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H]3CC[C@@H](O)CC3)CC2)c(OC)c1	ZINC000875422246	GC	On-Demand	Clean	MTNR1B	16	43
CCCCCCCCNC(=O)N1CCC(CO)(CO)CC1	ZINC000875422339	DE	On-Demand	Mild	ASAH1	102	39
CCCCCCCCNC(=O)N1CCCN(C=O)CC1	ZINC000875422355	CE	On-Demand	Mild	ASAH1	98	37
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@@H](C)S(C)(=O)=O)CC1	ZINC000875422364	FE	On-Demand	Anodyne	DRD2	16	43
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@@H](C)S(C)(=O)=O)CC1	ZINC000875422364	FE	On-Demand	Anodyne	ADRA1D	24	41
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@@H](C)S(C)(=O)=O)CC1	ZINC000875422364	FE	On-Demand	Anodyne	ADRA1A	19	41
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@@H](C)S(C)(=O)=O)CC1	ZINC000875422364	FE	On-Demand	Anodyne	ADRA1B	20	41
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@H](C)S(C)(=O)=O)CC1	ZINC000875422365	FE	On-Demand	Anodyne	DRD2	16	43
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@H](C)S(C)(=O)=O)CC1	ZINC000875422365	FE	On-Demand	Anodyne	ADRA1D	24	41
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@H](C)S(C)(=O)=O)CC1	ZINC000875422365	FE	On-Demand	Anodyne	ADRA1A	19	41
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@H](C)S(C)(=O)=O)CC1	ZINC000875422365	FE	On-Demand	Anodyne	ADRA1B	20	41
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@@H](C)S(C)(=O)=O)CC1	ZINC000875422366	FE	On-Demand	Anodyne	DRD2	16	43
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@@H](C)S(C)(=O)=O)CC1	ZINC000875422366	FE	On-Demand	Anodyne	ADRA1D	24	41
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@@H](C)S(C)(=O)=O)CC1	ZINC000875422366	FE	On-Demand	Anodyne	ADRA1A	19	41
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@@H](C)S(C)(=O)=O)CC1	ZINC000875422366	FE	On-Demand	Anodyne	ADRA1B	20	41
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@H](C)S(C)(=O)=O)CC1	ZINC000875422367	FE	On-Demand	Anodyne	DRD2	16	43
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@H](C)S(C)(=O)=O)CC1	ZINC000875422367	FE	On-Demand	Anodyne	ADRA1D	24	41
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@H](C)S(C)(=O)=O)CC1	ZINC000875422367	FE	On-Demand	Anodyne	ADRA1A	19	41
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@H](C)S(C)(=O)=O)CC1	ZINC000875422367	FE	On-Demand	Anodyne	ADRA1B	20	41
CCCCCCCCNC(=O)N[C@@H]1CCO[C@H]1c1cc[nH]n1	ZINC000875422380	DF	On-Demand	Mild	EPHX2	18	43
CCCCCCCCNC(=O)N[C@@H]1CCO[C@H]1c1cc[nH]n1	ZINC000875422380	DF	On-Demand	Mild	ASAH1	59	33
CCCCCCCNC(=O)C(=O)NC1CCC(N(C)C)CC1	ZINC000875422417	DE	On-Demand	Mild	ASAH1	55	32
CCCCCCCNC(=O)C(=O)NC1CCC(N(C)C)CC1	ZINC000875422417	DE	On-Demand	Mild	LASR	45	33
N#Cc1cc(F)ccc1NC(=O)CCc1ccc(N2CCCS2(=O)=O)cc1	ZINC000875422442	GF	On-Demand	Mild	CDK1	18	49
CCCCCCCCNC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875422451	CD	On-Demand	Mild	EPHX2	29	52
CCCCCCCCNC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875422451	CD	On-Demand	Mild	ASAH1	82	38
CCCCCCCCNC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875422451	CD	On-Demand	Mild	LASR	46	34
CCCCCCCCNC(=O)N[C@@H]1CCOC[C@@H]1O	ZINC000875422452	CD	On-Demand	Mild	EPHX2	29	52
CCCCCCCCNC(=O)N[C@@H]1CCOC[C@@H]1O	ZINC000875422452	CD	On-Demand	Mild	ASAH1	82	38
CCCCCCCCNC(=O)N[C@@H]1CCOC[C@@H]1O	ZINC000875422452	CD	On-Demand	Mild	LASR	46	34
CCCCCCCCNC(=O)N[C@H]1CCOC[C@H]1O	ZINC000875422453	CD	On-Demand	Mild	EPHX2	29	52
CCCCCCCCNC(=O)N[C@H]1CCOC[C@H]1O	ZINC000875422453	CD	On-Demand	Mild	ASAH1	82	38
CCCCCCCCNC(=O)N[C@H]1CCOC[C@H]1O	ZINC000875422453	CD	On-Demand	Mild	LASR	46	34
CCCCCCCCNC(=O)N[C@H]1CCOC[C@@H]1O	ZINC000875422454	CD	On-Demand	Mild	EPHX2	29	52
CCCCCCCCNC(=O)N[C@H]1CCOC[C@@H]1O	ZINC000875422454	CD	On-Demand	Mild	ASAH1	82	38
CCCCCCCCNC(=O)N[C@H]1CCOC[C@@H]1O	ZINC000875422454	CD	On-Demand	Mild	LASR	46	34
CCCCCCCCNC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875422466	ED	On-Demand	Mild	TPP2	20	41
CCCCCCCCNC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875422466	ED	On-Demand	Mild	ASAH1	95	38
CN(C)C1CCC(NC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875422470	GE	On-Demand	Anodyne	C3AR1	44	42
CN(C)C1CCC(NC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)CC1	ZINC000875422471	GE	On-Demand	Anodyne	C3AR1	44	42
CCCCCCCCNC(=O)N1CC[C@]2(CC(C(=O)OC)=NO2)C1	ZINC000875422483	EE	On-Demand	Mild	ASAH1	82	33
CCCCCCCCNC(=O)N1CC[C@@]2(CC(C(=O)OC)=NO2)C1	ZINC000875422484	EE	On-Demand	Mild	ASAH1	82	33
COC(=O)c1ccc(C(=O)NNC(=O)CSc2ccc(Cl)cc2)cn1	ZINC000875422503	GE	On-Demand	Reactive	FAS	77	44
C[C@@H](CNC(=O)N1CC[C@H](c2cccc(Cl)c2)C1(C)C)S(C)(=O)=O	ZINC000875422521	FG	On-Demand	Anodyne	MDM2	148	38
C[C@@H](CNC(=O)N1CC[C@@H](c2cccc(Cl)c2)C1(C)C)S(C)(=O)=O	ZINC000875422522	FG	On-Demand	Anodyne	MDM2	148	38
C[C@@H](CNC(=O)N(C)C[C@H]1CCCCN1Cc1ccccc1)S(C)(=O)=O	ZINC000875422552	GE	On-Demand	Anodyne	SIGMAR1	15	45
C[C@H](CNC(=O)N(C)C[C@H]1CCCCN1Cc1ccccc1)S(C)(=O)=O	ZINC000875422553	GE	On-Demand	Anodyne	SIGMAR1	15	45
CCCCCCCCNC(=O)N[C@@H]1COC[C@@H]1O	ZINC000875422556	CD	On-Demand	Mild	EPHX2	27	54
CCCCCCCCNC(=O)N[C@@H]1COC[C@@H]1O	ZINC000875422556	CD	On-Demand	Mild	ASAH1	82	34
CCCCCCCCNC(=O)N(C)[C@H]1C[C@@H](C(N)=O)C1	ZINC000875422579	CE	On-Demand	Mild	ASAH1	59	33
CCCCCCCCNC(=O)N1C[C@H](OC)C[C@]1(C)CO	ZINC000875422619	DF	On-Demand	Mild	ASAH1	94	37
CCCCCCCCNC(=O)N1C[C@@H](OC)C[C@]1(C)CO	ZINC000875422620	DF	On-Demand	Mild	ASAH1	94	37
CCCCCCCCNC(=O)N1C[C@@H](OC)C[C@@]1(C)CO	ZINC000875422621	DF	On-Demand	Mild	ASAH1	94	37
CCCCCCCCNC(=O)N1C[C@H](OC)C[C@@]1(C)CO	ZINC000875422622	DF	On-Demand	Mild	ASAH1	94	37
CCCCCCCCNC(=O)N1CC[C@H]2CC[C@@H](C1)S2(=O)=O	ZINC000875422628	EF	On-Demand	Mild	ASAH1	101	40
CCCCCCCCNC(=O)N1C[C@@](C)(CO)[C@@](C)(CO)C1	ZINC000875422636	DE	On-Demand	Mild	ASAH1	111	43
CCCCCCCCNC(=O)NC[C@@H]1C[C@H](O)C1	ZINC000875422639	CE	On-Demand	Mild	EPHX2	38	54
CCCCCCCCNC(=O)NC[C@@H]1C[C@H](O)C1	ZINC000875422639	CE	On-Demand	Mild	ASAH1	75	35
CCCCCCCCNC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875422640	CE	On-Demand	Mild	EPHX2	38	54
CCCCCCCCNC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875422640	CE	On-Demand	Mild	ASAH1	75	35
CCCCCCCCNC(=O)NCC1CC(O)C1	ZINC000875422641	CE	On-Demand	Mild	EPHX2	38	54
CCCCCCCCNC(=O)NCC1CC(O)C1	ZINC000875422641	CE	On-Demand	Mild	ASAH1	75	35
CCCCCCCCNC(=O)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875422650	CF	On-Demand	Mild	GBA	17	40
CCCCCCCCNC(=O)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875422650	CF	On-Demand	Mild	EPHX2	20	44
CCCCCCCCNC(=O)N1C[C@H]2C[C@H](O)C[C@H]1C2	ZINC000875422650	CF	On-Demand	Mild	ASAH1	104	42
CCCCCCCCNC(=O)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875422651	CF	On-Demand	Mild	GBA	17	40
CCCCCCCCNC(=O)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875422651	CF	On-Demand	Mild	EPHX2	20	44
CCCCCCCCNC(=O)N1C[C@H]2C[C@@H](O)C[C@H]1C2	ZINC000875422651	CF	On-Demand	Mild	ASAH1	104	42
CCCCCCCCNC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875422656	DH	On-Demand	Mild	ASAH1	95	40
C[C@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)C1CCC1	ZINC000875422742	DG	On-Demand	Mild	ITK	21	51
C[C@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)C1CCC1	ZINC000875422742	DG	On-Demand	Mild	PANC	58	39
O=C(NCCc1cnc(C2CC2)nc1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875422761	FF	On-Demand	Anodyne	PREP	57	37
O=C(NCCc1cnc(C2CC2)nc1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875422762	FF	On-Demand	Anodyne	PREP	57	37
O=C(NCCc1cnc(C2CC2)nc1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875422763	FF	On-Demand	Anodyne	PREP	57	37
O=C(NCCc1cnc(C2CC2)nc1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875422764	FF	On-Demand	Anodyne	PREP	57	37
C[C@H]1CC(=O)N[C@@H](C(=O)Nc2ccc(-c3ccccc3)nn2)C1	ZINC000875422782	DD	On-Demand	Anodyne	TRHR	43	37
CN(C)C1CCC(NC(=O)C(=O)NCC2(c3cccc(Cl)c3)CCC2)CC1	ZINC000875422832	GF	On-Demand	Anodyne	AVPR1A	39	47
CCCCCCCCNC(=O)N1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000875422838	CF	On-Demand	Mild	ASAH1	112	45
CCCCCCCCNC(=O)N[C@@H]1COCC[C@H]1O	ZINC000875422856	CD	On-Demand	Mild	EPHX2	31	53
CCCCCCCCNC(=O)N[C@@H]1COCC[C@H]1O	ZINC000875422856	CD	On-Demand	Mild	ASAH1	69	34
CCCCCCCCNC(=O)N[C@@H]1COCC[C@H]1O	ZINC000875422856	CD	On-Demand	Mild	LASR	47	35
CCCCCCCCNC(=O)N1[C@H]2CC[C@H]1[C@@H](C)[C@H](O)C2	ZINC000875422864	CG	On-Demand	Mild	ASAH1	99	40
CCCCCCCCNC(=O)N1[C@H]2CC[C@H]1[C@@H](C)[C@@H](O)C2	ZINC000875422865	CG	On-Demand	Mild	ASAH1	99	40
CCCCCCCCNC(=O)N1[C@H]2CC[C@H]1[C@H](C)[C@@H](O)C2	ZINC000875422866	CG	On-Demand	Mild	ASAH1	99	40
CCCCCCCCNC(=O)N1[C@H]2CC[C@H]1[C@H](C)[C@H](O)C2	ZINC000875422867	CG	On-Demand	Mild	ASAH1	99	40
CCCCCCCCNC(=O)N1CC2(CCCO2)C1	ZINC000875422888	CF	On-Demand	Mild	ASAH1	94	36
CSc1ccc(C)c(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)c1	ZINC000875422979	JH	On-Demand	Reactive	AKR1B1	38	44
CCCCCCCCNC(=O)N1CCC[C@@H]1Cn1ccnc1	ZINC000875423023	DG	On-Demand	Mild	TBXAS1	22	43
CCCCCCCCNC(=O)N1CCC[C@@H]1Cn1ccnc1	ZINC000875423023	DG	On-Demand	Mild	TPP2	18	42
CCCCCCCCNC(=O)N1CCC[C@@H]1Cn1ccnc1	ZINC000875423023	DG	On-Demand	Mild	ASAH1	95	39
CCCCCCCCNC(=O)N1CC=CC1	ZINC000875423033	BF	On-Demand	Mild	EPHX2	16	42
CCCCCCCCNC(=O)N1CC=CC1	ZINC000875423033	BF	On-Demand	Mild	ASAH1	119	47
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1CS(=O)(=O)N1CCCC1	ZINC000875423043	GD	On-Demand	Anodyne	KCNQ2	41	31
CO[C@H](C(=O)Nc1ccc(F)cc1C#N)C(=O)OC(C)(C)C	ZINC000875423060	DD	On-Demand	Mild	PAPA1_CARPA	25	40
CCCCCCCCNC(=O)N1C[C@H](O)C[C@H]1C1CC1	ZINC000875423067	CF	On-Demand	Mild	ASAH1	101	40
CCCCCCCCNC(=O)N1C[C@@H](O)C[C@H]1C1CC1	ZINC000875423068	CF	On-Demand	Mild	ASAH1	101	40
CCCCCCCCNC(=O)N1C[C@H](O)C[C@@H]1C1CC1	ZINC000875423069	CF	On-Demand	Mild	ASAH1	101	40
CCCCCCCCNC(=O)N1C[C@@H](O)C[C@@H]1C1CC1	ZINC000875423070	CF	On-Demand	Mild	ASAH1	101	40
CCCCCCCCNC(=O)NCc1nc(N(C)C)n[nH]1	ZINC000875423076	CE	On-Demand	Mild	EPHX2	15	41
CCCCCCCCNC(=O)NCc1nc(N(C)C)n[nH]1	ZINC000875423076	CE	On-Demand	Mild	ASAH1	61	33
CCCCCCCCNC(=O)NC[C@H](O)[C@@H]1CCCO1	ZINC000875423077	CE	On-Demand	Mild	EPHX2	21	47
CCCCCCCCNC(=O)NC[C@@H](O)[C@@H]1CCCO1	ZINC000875423078	CE	On-Demand	Mild	EPHX2	21	47
CCCCCCCCNC(=O)NC[C@H](O)[C@H]1CCCO1	ZINC000875423079	CE	On-Demand	Mild	EPHX2	21	47
CCCCCCCCNC(=O)NC[C@@H](O)[C@H]1CCCO1	ZINC000875423080	CE	On-Demand	Mild	EPHX2	21	47
CCCCCCCCNC(=O)NCc1conc1C	ZINC000875423102	CG	On-Demand	Mild	EPHX2	17	40
CCCCCCCCNC(=O)NCc1conc1C	ZINC000875423102	CG	On-Demand	Mild	ASAH1	82	35
O=C(NCCc1cnc(C2CC2)nc1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875423208	GG	On-Demand	Anodyne	CPT1A	54	33
O=C(NCCc1cnc(C2CC2)nc1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875423209	GG	On-Demand	Anodyne	CPT1A	54	33
O=C(NCCc1cnc(C2CC2)nc1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875423210	GG	On-Demand	Anodyne	CPT1A	54	33
O=C(NCCc1cnc(C2CC2)nc1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875423211	GG	On-Demand	Anodyne	CPT1A	54	33
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCC1Cc2ccccc2C1	ZINC000875423237	EF	On-Demand	Anodyne	SLC6A4	25	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCC1Cc2ccccc2C1	ZINC000875423237	EF	On-Demand	Anodyne	SLC6A3	49	40
O=C1CC[C@H](C(=O)Nc2cc(Br)c(F)cc2Cl)O1	ZINC000875423270	EF	On-Demand	Anodyne	HEMY	45	36
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@H](C)c1ccc([S@@](C)=O)cc1)CC2	ZINC000875423306	GG	On-Demand	Anodyne	MAPK1	43	42
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@@H](C)c1ccc([S@@](C)=O)cc1)CC2	ZINC000875423307	GG	On-Demand	Anodyne	MAPK1	43	42
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@@H](C)c1ccc([S@](C)=O)cc1)CC2	ZINC000875423308	GG	On-Demand	Anodyne	MAPK1	43	42
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@H](C)c1ccc([S@](C)=O)cc1)CC2	ZINC000875423309	GG	On-Demand	Anodyne	MAPK1	43	42
CN(C[C@@H]1CN(c2ccccc2)C(=O)O1)C(=O)NCc1cccc(N(C)C)n1	ZINC000875423385	GE	On-Demand	Anodyne	PDE8B	43	34
CN1CC[C@H](NC(=O)N2CCC(CO)(CO)CC2)[C@H]1c1ccc(Cl)c(F)c1	ZINC000875423388	GE	On-Demand	Anodyne	CACNA1H	61	39
CN1CC[C@H](NC(=O)N2CCC(CO)(CO)CC2)[C@H]1c1ccc(Cl)c(F)c1	ZINC000875423388	GE	On-Demand	Anodyne	ENV	40	38
CN1CC[C@H](NC(=O)N2CCC(CO)(CO)CC2)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000875423390	GE	On-Demand	Anodyne	CACNA1H	61	39
CN1CC[C@H](NC(=O)N2CCC(CO)(CO)CC2)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000875423390	GE	On-Demand	Anodyne	ENV	40	38
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)C1CCC1	ZINC000875423414	EG	On-Demand	Anodyne	OPRL1	17	49
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)C1CCC1	ZINC000875423415	EG	On-Demand	Anodyne	OPRL1	17	49
C[C@@H](NC(=O)NCCc1cnc(C2CC2)nc1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875423416	GE	On-Demand	Anodyne	GPR119	20	41
O=C(CCCOC1CCOCC1)Nc1ccc(-c2ccccc2)nn1	ZINC000875423419	EG	On-Demand	Anodyne	P2RY12	61	39
O=C(CCCOC1CCOCC1)Nc1ccc(-c2ccccc2)nn1	ZINC000875423419	EG	On-Demand	Anodyne	GSK3A	16	41
CN1CCC(CNC(=O)NCc2cccc(N(C)C)n2)(c2ccccc2)CC1	ZINC000875423427	GF	On-Demand	Anodyne	KCNA3	40	35
CN1CCC(CNC(=O)NCc2cccc(N(C)C)n2)(c2ccccc2)CC1	ZINC000875423427	GF	On-Demand	Anodyne	SOAT1	16	42
COc1ccc(N2CCN(C(=O)NCc3cccc(N(C)C)n3)CC2)c(OC)c1	ZINC000875423433	GE	On-Demand	Clean	HTR1A	46	44
COc1ccc(N2CCN(C(=O)NCc3cccc(N(C)C)n3)CC2)c(OC)c1	ZINC000875423433	GE	On-Demand	Clean	DRD2	38	40
COc1ccc(N2CCN(C(=O)NCc3cccc(N(C)C)n3)CC2)c(OC)c1	ZINC000875423433	GE	On-Demand	Clean	DRD4	44	35
COc1ccc(N2CCN(C(=O)NCc3cccc(N(C)C)n3)CC2)c(OC)c1	ZINC000875423433	GE	On-Demand	Clean	HTR1D	15	44
COc1ccc(N2CCN(C(=O)NCc3cccc(N(C)C)n3)CC2)c(OC)c1	ZINC000875423433	GE	On-Demand	Clean	HTR1B	18	44
COc1ccc(N2CCN(C(=O)NCc3cccc(N(C)C)n3)CC2)c(OC)c1	ZINC000875423433	GE	On-Demand	Clean	DRD3	55	39
COc1ccc(N2CCN(C(=O)NCc3cccc(N(C)C)n3)CC2)c(OC)c1	ZINC000875423433	GE	On-Demand	Clean	PDGFRB	47	39
COc1ccc(N2CCN(C(=O)NCc3cccc(N(C)C)n3)CC2)c(OC)c1	ZINC000875423433	GE	On-Demand	Clean	LCK	20	41
COc1ccc(N2CCN(C(=O)NCc3cccc(N(C)C)n3)CC2)c(OC)c1	ZINC000875423433	GE	On-Demand	Clean	NPBWR1	43	32
COc1cccc(C(C)(C)C(=O)Nc2ccc([N+](=O)[O-])c(C)n2)c1	ZINC000875423438	EG	On-Demand	Bother	TAAR1	26	40
CC(=O)C1CCN(C(=O)NCc2cccc(N(C)C)n2)CC1	ZINC000875423480	DD	On-Demand	Anodyne	EPHX2	15	40
CCO[C@H]1COCC[C@H]1CC(=O)Nc1ccc(-c2ccccc2)nn1	ZINC000875423492	EF	On-Demand	Anodyne	TIMP3	63	32
CCO[C@H]1COCC[C@@H]1CC(=O)Nc1ccc(-c2ccccc2)nn1	ZINC000875423493	EF	On-Demand	Anodyne	TIMP3	63	32
CC(=O)[C@@H]1CCCN(C(=O)NCc2cccc(N(C)C)n2)C1	ZINC000875423494	DD	On-Demand	Anodyne	PDE8B	40	32
CC(=O)[C@H]1CCCN(C(=O)NCc2cccc(N(C)C)n2)C1	ZINC000875423495	DD	On-Demand	Anodyne	PDE8B	40	32
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCCc1ccncc1C)CC2	ZINC000875423541	FG	On-Demand	Anodyne	SLC18A2	45	32
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCCc1ccncc1C)CC2	ZINC000875423541	FG	On-Demand	Anodyne	MTNR1B	17	43
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCCc1ccncc1C)CC2	ZINC000875423542	FG	On-Demand	Anodyne	SLC18A2	45	32
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCCc1ccncc1C)CC2	ZINC000875423542	FG	On-Demand	Anodyne	MTNR1B	17	43
O=c1c2cc([N+](=O)[O-])c(Cl)cc2ncn1C[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000875423588	IH	On-Demand	Bother	FASN	21	40
O=c1c2cc([N+](=O)[O-])c(Cl)cc2ncn1C[C@H](O)COc1c(Cl)cccc1Cl	ZINC000875423593	IH	On-Demand	Bother	FASN	21	40
COC(=O)c1ccc(C(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)cn1	ZINC000875423637	FE	On-Demand	Reactive	EPHX2	16	41
COc1ccc(N2CCN(C(=O)NCCc3ccncc3C)CC2)c(OC)c1	ZINC000875423640	GE	On-Demand	Clean	HTR1A	32	43
COc1ccc(N2CCN(C(=O)NCCc3ccncc3C)CC2)c(OC)c1	ZINC000875423640	GE	On-Demand	Clean	DRD2	27	40
COc1ccc(N2CCN(C(=O)NCCc3ccncc3C)CC2)c(OC)c1	ZINC000875423640	GE	On-Demand	Clean	DRD4	44	34
COc1ccc(N2CCN(C(=O)NCCc3ccncc3C)CC2)c(OC)c1	ZINC000875423640	GE	On-Demand	Clean	ADRA1D	27	41
COc1ccc(N2CCN(C(=O)NCCc3ccncc3C)CC2)c(OC)c1	ZINC000875423640	GE	On-Demand	Clean	HTR1D	16	43
COc1ccc(N2CCN(C(=O)NCCc3ccncc3C)CC2)c(OC)c1	ZINC000875423640	GE	On-Demand	Clean	HTR1B	20	43
COc1ccc(N2CCN(C(=O)NCCc3ccncc3C)CC2)c(OC)c1	ZINC000875423640	GE	On-Demand	Clean	ADRA1A	24	41
COc1ccc(N2CCN(C(=O)NCCc3ccncc3C)CC2)c(OC)c1	ZINC000875423640	GE	On-Demand	Clean	DRD3	45	39
COc1ccc(N2CCN(C(=O)NCCc3ccncc3C)CC2)c(OC)c1	ZINC000875423640	GE	On-Demand	Clean	PDGFRB	44	40
COc1ccc(N2CCN(C(=O)NCCc3ccncc3C)CC2)c(OC)c1	ZINC000875423640	GE	On-Demand	Clean	MTNR1A	51	39
COc1ccc(N2CCN(C(=O)NCCc3ccncc3C)CC2)c(OC)c1	ZINC000875423640	GE	On-Demand	Clean	MTNR1B	44	39
CC[C@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875423650	GE	On-Demand	Anodyne	DRD4	25	40
CC[C@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875423650	GE	On-Demand	Anodyne	SIGMAR1	31	40
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875423651	GE	On-Demand	Anodyne	DRD4	25	40
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875423651	GE	On-Demand	Anodyne	SIGMAR1	31	40
CC[C@H]1CN(C(C)=O)CC[C@H]1NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875423652	GE	On-Demand	Anodyne	DRD4	25	40
CC[C@H]1CN(C(C)=O)CC[C@H]1NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875423652	GE	On-Demand	Anodyne	SIGMAR1	31	40
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875423653	GE	On-Demand	Anodyne	DRD4	25	40
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875423653	GE	On-Demand	Anodyne	SIGMAR1	31	40
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875423683	FF	On-Demand	Anodyne	OXTR	53	38
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875423684	FF	On-Demand	Anodyne	OXTR	53	38
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875423685	FF	On-Demand	Anodyne	OXTR	53	38
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875423686	FF	On-Demand	Anodyne	OXTR	53	38
CONC(=O)C1CCN(C(=O)NCc2cccc(N(C)C)n2)CC1	ZINC000875423692	EC	On-Demand	Anodyne	EPHX2	18	42
CONC(=O)C1CCN(C(=O)NCc2cccc(N(C)C)n2)CC1	ZINC000875423692	EC	On-Demand	Anodyne	PDE8B	42	34
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccc(Cl)c(F)c2)CC1	ZINC000875423789	GG	On-Demand	Anodyne	CACNA1H	41	34
C[C@@H](O)C1CCN(C(=O)N[C@H]2CCN(C)[C@H]2c2ccc(Cl)c(F)c2)CC1	ZINC000875423790	GG	On-Demand	Anodyne	CACNA1H	41	34
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875423809	GF	On-Demand	Anodyne	PRSS2	49	30
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875423809	GF	On-Demand	Anodyne	CCR3	60	40
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875423809	GF	On-Demand	Anodyne	EPHX2	38	48
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875423809	GF	On-Demand	Anodyne	LIPG	15	40
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875423810	GF	On-Demand	Anodyne	PRSS2	49	30
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875423810	GF	On-Demand	Anodyne	CCR3	60	40
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875423810	GF	On-Demand	Anodyne	EPHX2	38	48
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875423810	GF	On-Demand	Anodyne	LIPG	15	40
CC[C@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875423811	GF	On-Demand	Anodyne	PRSS2	49	30
CC[C@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875423811	GF	On-Demand	Anodyne	CCR3	60	40
CC[C@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875423811	GF	On-Demand	Anodyne	EPHX2	38	48
CC[C@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875423811	GF	On-Demand	Anodyne	LIPG	15	40
CC[C@H]1CN(C(C)=O)CC[C@H]1NC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875423812	GF	On-Demand	Anodyne	PRSS2	49	30
CC[C@H]1CN(C(C)=O)CC[C@H]1NC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875423812	GF	On-Demand	Anodyne	CCR3	60	40
CC[C@H]1CN(C(C)=O)CC[C@H]1NC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875423812	GF	On-Demand	Anodyne	EPHX2	38	48
CC[C@H]1CN(C(C)=O)CC[C@H]1NC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875423812	GF	On-Demand	Anodyne	LIPG	15	40
O=c1c2cc([N+](=O)[O-])c(Cl)cc2ncn1C[C@H](O)COc1ccccc1F	ZINC000875423830	GF	On-Demand	Bother	FASN	21	40
O=c1c2cc([N+](=O)[O-])c(Cl)cc2ncn1C[C@@H](O)COc1ccccc1F	ZINC000875423832	GF	On-Demand	Bother	FASN	21	40
CN1CC[C@H](C(=O)N(C)c2cc(Cl)ccc2C#N)[C@@H](c2cnn(C)c2)C1	ZINC000875423977	FF	On-Demand	Mild	NOS3	17	42
CN1CC[C@@H](C(=O)N(C)c2cc(Cl)ccc2C#N)[C@@H](c2cnn(C)c2)C1	ZINC000875423979	FF	On-Demand	Mild	NOS3	17	42
CN1CC[C@H](C(=O)N(C)c2cc(Cl)ccc2C#N)[C@H](c2cnn(C)c2)C1	ZINC000875423982	FF	On-Demand	Mild	NOS3	17	42
CN1CC[C@@H](C(=O)N(C)c2cc(Cl)ccc2C#N)[C@H](c2cnn(C)c2)C1	ZINC000875423984	FF	On-Demand	Mild	NOS3	17	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(N(C)C)n1	ZINC000875424008	ED	On-Demand	Anodyne	SLC6A3	44	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(N(C)C)n1	ZINC000875424010	ED	On-Demand	Anodyne	SLC6A3	44	36
C[C@@H](NC(=O)N(C)[C@H](C)c1ccc(Cl)cc1)c1ccc([S@@](C)=O)cc1	ZINC000875424021	GJ	On-Demand	Anodyne	UTS2	44	35
C[C@@H](NC(=O)N(C)[C@H](C)c1ccc(Cl)cc1)c1ccc([S@](C)=O)cc1	ZINC000875424025	GJ	On-Demand	Anodyne	UTS2	44	35
C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)N[C@H](C)c1ccc([S@](C)=O)cc1	ZINC000875424027	GJ	On-Demand	Anodyne	UTS2	44	35
C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)N[C@H](C)c1ccc([S@@](C)=O)cc1	ZINC000875424029	GJ	On-Demand	Anodyne	UTS2	44	35
CN1CC[C@H](NC(=O)NC[C@H]2C[C@H](O)C2)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000875424065	FE	On-Demand	Anodyne	CACNA1I	45	37
CN1CC[C@H](NC(=O)NC[C@H]2C[C@H](O)C2)[C@H]1c1ccc(Cl)c(F)c1	ZINC000875424068	FE	On-Demand	Anodyne	CACNA1I	45	37
CN1CCN(C2CCN(C(=O)NCc3cccc(N(C)C)n3)CC2)CC1	ZINC000875424071	FD	On-Demand	Anodyne	L3MBTL3	59	40
CCOC1CC2(C1)C[C@H]2C(=O)Nc1ccc(-c2ccccc2)nn1	ZINC000875424104	DG	On-Demand	Anodyne	TIMP3	73	35
CC[C@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875424132	FG	On-Demand	Anodyne	EPHX2	29	45
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875424133	FG	On-Demand	Anodyne	EPHX2	29	45
CC[C@H]1CN(C(C)=O)CC[C@H]1NC(=O)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875424134	FG	On-Demand	Anodyne	EPHX2	29	45
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875424135	FG	On-Demand	Anodyne	EPHX2	29	45
CCOC(=O)[C@H](C)C1CN(C(=O)NCCC2Cc3ccccc3C2)C1	ZINC000875424240	EF	On-Demand	Anodyne	ACE	18	40
O=CN1CCCN(C(=O)NCCC2Cc3ccccc3C2)CC1	ZINC000875424279	DD	On-Demand	Anodyne	PREP	33	41
O=C(CN1CCCCC(=O)C1=O)Nc1cc(Br)c(F)cc1Cl	ZINC000875424280	GF	On-Demand	Anodyne	HEMY	55	40
C[C@@H]1CN(C(=O)NCc2cccc(N(C)C)n2)Cc2ccccc21	ZINC000875424295	DF	On-Demand	Anodyne	PDE8B	37	40
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCCc1ccncc1C)CC2	ZINC000875424399	FF	On-Demand	Anodyne	P2RY14	47	35
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N[C@H](CC)[C@H](O)c1ccccc1	ZINC000875424474	FE	On-Demand	Anodyne	XIAP	62	39
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N[C@H](CC)[C@H](O)c1ccccc1	ZINC000875424474	FE	On-Demand	Anodyne	BIRC2	46	39
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N[C@H](CC)[C@@H](O)c1ccccc1	ZINC000875424476	FE	On-Demand	Anodyne	XIAP	62	39
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N[C@H](CC)[C@@H](O)c1ccccc1	ZINC000875424476	FE	On-Demand	Anodyne	BIRC2	46	39
CC[C@H]1CN(C(C)=O)CC[C@H]1NC(=O)NCc1ccc(O)c(Cl)c1	ZINC000875424499	FE	On-Demand	Anodyne	EPHX2	15	40
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)NCc1ccc(O)c(Cl)c1	ZINC000875424500	FE	On-Demand	Anodyne	EPHX2	15	40
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)NCc1ccc(O)c(Cl)c1	ZINC000875424501	FE	On-Demand	Anodyne	EPHX2	15	40
CC[C@H]1CN(C(C)=O)CC[C@@H]1NC(=O)NCc1ccc(O)c(Cl)c1	ZINC000875424502	FE	On-Demand	Anodyne	EPHX2	15	40
C[C@@H](NC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1)c1ccc([S@](C)=O)cc1	ZINC000875424544	GG	On-Demand	Anodyne	EPHX2	18	41
C[C@@H](NC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1)c1ccc([S@@](C)=O)cc1	ZINC000875424545	GG	On-Demand	Anodyne	EPHX2	18	41
C[C@@H](NC(=O)N1CCC[C@@](O)(c2ccccc2)C1)C1CCC1	ZINC000875424567	DF	On-Demand	Anodyne	OPRL1	17	41
C[C@@H](NC(=O)N1CCC[C@](O)(c2ccccc2)C1)C1CCC1	ZINC000875424569	DF	On-Demand	Anodyne	OPRL1	17	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc([S@@](C)=O)cc1	ZINC000875424581	FE	On-Demand	Anodyne	SLC6A4	22	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc([S@@](C)=O)cc1	ZINC000875424581	FE	On-Demand	Anodyne	SLC6A3	44	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc([S@@](C)=O)cc1	ZINC000875424582	FE	On-Demand	Anodyne	SLC6A4	22	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc([S@@](C)=O)cc1	ZINC000875424582	FE	On-Demand	Anodyne	SLC6A3	44	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc([S@](C)=O)cc1	ZINC000875424583	FE	On-Demand	Anodyne	SLC6A4	22	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc([S@](C)=O)cc1	ZINC000875424583	FE	On-Demand	Anodyne	SLC6A3	44	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc([S@](C)=O)cc1	ZINC000875424584	FE	On-Demand	Anodyne	SLC6A4	22	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc([S@](C)=O)cc1	ZINC000875424584	FE	On-Demand	Anodyne	SLC6A3	44	48
CC(=O)Nc1cccc2c1CN(C(=O)NCCc1ccncc1C)CC2	ZINC000875424609	FF	On-Demand	Anodyne	P2RY14	50	38
CC(=O)N1CCC[C@@H]1C(=O)Oc1ccccc1C(=O)N(C)C	ZINC000875424699	DD	On-Demand	Anodyne	PREP	51	35
O=C([C@@H](Cc1cccnc1)C1CCCC1)N1CCSc2ccncc21	ZINC000875424703	FH	On-Demand	Anodyne	C3AR1	43	43
O=C([C@H](Cc1cccnc1)C1CCCC1)N1CCSc2ccncc21	ZINC000875424704	FH	On-Demand	Anodyne	C3AR1	43	43
C[C@@]1(C(=O)N2CCCc3c(NC(=O)c4ccc(F)cc4)cccc32)CCC(=O)N1	ZINC000875424714	GG	On-Demand	Anodyne	AVPR2	42	38
O=c1c2cc([N+](=O)[O-])c(Cl)cc2ncn1C[C@@H](O)COCc1ccc(Cl)cc1	ZINC000875424719	HG	On-Demand	Bother	FASN	20	41
O=c1c2cc([N+](=O)[O-])c(Cl)cc2ncn1C[C@H](O)COCc1ccc(Cl)cc1	ZINC000875424722	HG	On-Demand	Bother	FASN	20	41
CC[C@H]1CN(C(C)=O)CC[C@@H]1NC(=O)NC1CC(C(=O)OC)C1	ZINC000875424725	EC	On-Demand	Anodyne	EPHX2	21	47
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)NC1CC(C(=O)OC)C1	ZINC000875424727	EC	On-Demand	Anodyne	EPHX2	21	47
CC[C@H]1CN(C(C)=O)CC[C@H]1NC(=O)NC1CC(C(=O)OC)C1	ZINC000875424729	EC	On-Demand	Anodyne	EPHX2	21	47
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)NC1CC(C(=O)OC)C1	ZINC000875424731	EC	On-Demand	Anodyne	EPHX2	21	47
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875424764	FE	On-Demand	Anodyne	EPHX2	29	47
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875424765	FE	On-Demand	Anodyne	EPHX2	29	47
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875424767	FE	On-Demand	Anodyne	EPHX2	29	47
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875424768	FE	On-Demand	Anodyne	EPHX2	29	47
O=c1c2cc([N+](=O)[O-])c(Cl)cc2ncn1C[C@@H](O)COC(c1ccccc1)c1ccccc1	ZINC000875424771	JI	On-Demand	Bother	FASN	20	42
O=c1c2cc([N+](=O)[O-])c(Cl)cc2ncn1C[C@H](O)COC(c1ccccc1)c1ccccc1	ZINC000875424772	JI	On-Demand	Bother	FASN	20	42
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N[C@](C)(CO)Cc1ccc(OC)cc1	ZINC000875424791	GD	On-Demand	Anodyne	MMP13	30	41
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N[C@](C)(CO)Cc1ccc(OC)cc1	ZINC000875424791	GD	On-Demand	Anodyne	MMP3	29	41
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N[C@](C)(CO)Cc1ccc(OC)cc1	ZINC000875424791	GD	On-Demand	Anodyne	MMP9	26	41
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N[C@](C)(CO)Cc1ccc(OC)cc1	ZINC000875424791	GD	On-Demand	Anodyne	MMP7	28	41
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N[C@](C)(CO)Cc1ccc(OC)cc1	ZINC000875424791	GD	On-Demand	Anodyne	MMP1	32	41
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)N[C@](C)(CO)Cc1ccc(OC)cc1	ZINC000875424792	GD	On-Demand	Anodyne	MMP13	30	41
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)N[C@](C)(CO)Cc1ccc(OC)cc1	ZINC000875424792	GD	On-Demand	Anodyne	MMP3	29	41
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)N[C@](C)(CO)Cc1ccc(OC)cc1	ZINC000875424792	GD	On-Demand	Anodyne	MMP9	26	41
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)N[C@](C)(CO)Cc1ccc(OC)cc1	ZINC000875424792	GD	On-Demand	Anodyne	MMP7	28	41
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)N[C@](C)(CO)Cc1ccc(OC)cc1	ZINC000875424792	GD	On-Demand	Anodyne	MMP1	32	41
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N[C@@](C)(CO)Cc1ccc(OC)cc1	ZINC000875424794	GD	On-Demand	Anodyne	MMP13	30	41
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N[C@@](C)(CO)Cc1ccc(OC)cc1	ZINC000875424794	GD	On-Demand	Anodyne	MMP3	29	41
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N[C@@](C)(CO)Cc1ccc(OC)cc1	ZINC000875424794	GD	On-Demand	Anodyne	MMP9	26	41
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N[C@@](C)(CO)Cc1ccc(OC)cc1	ZINC000875424794	GD	On-Demand	Anodyne	MMP7	28	41
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N[C@@](C)(CO)Cc1ccc(OC)cc1	ZINC000875424794	GD	On-Demand	Anodyne	MMP1	32	41
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)N[C@@](C)(CO)Cc1ccc(OC)cc1	ZINC000875424795	GD	On-Demand	Anodyne	MMP13	30	41
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)N[C@@](C)(CO)Cc1ccc(OC)cc1	ZINC000875424795	GD	On-Demand	Anodyne	MMP3	29	41
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)N[C@@](C)(CO)Cc1ccc(OC)cc1	ZINC000875424795	GD	On-Demand	Anodyne	MMP9	26	41
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)N[C@@](C)(CO)Cc1ccc(OC)cc1	ZINC000875424795	GD	On-Demand	Anodyne	MMP7	28	41
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)N[C@@](C)(CO)Cc1ccc(OC)cc1	ZINC000875424795	GD	On-Demand	Anodyne	MMP1	32	41
CC[C@@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)[C@@H]1CCCO1	ZINC000875424963	FF	On-Demand	Mild	ITK	24	45
CC[C@@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)[C@@H]1CCCO1	ZINC000875424963	FF	On-Demand	Mild	PANC	56	37
CC[C@@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)[C@H]1CCCO1	ZINC000875424964	FF	On-Demand	Mild	ITK	24	45
CC[C@@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)[C@H]1CCCO1	ZINC000875424964	FF	On-Demand	Mild	PANC	56	37
CC(=O)CCc1ccc(OC[C@@H](O)Cn2cnc3cc(Cl)c([N+](=O)[O-])cc3c2=O)cc1	ZINC000875424983	IF	On-Demand	Bother	FASN	16	40
CC(=O)CCc1ccc(OC[C@H](O)Cn2cnc3cc(Cl)c([N+](=O)[O-])cc3c2=O)cc1	ZINC000875424984	IF	On-Demand	Bother	FASN	16	40
CCCc1ccc(OC(=O)c2ccc(NS(C)(=O)=O)nc2)cc1	ZINC000875425016	EF	On-Demand	Anodyne	ACR	58	37
O=c1c2cc([N+](=O)[O-])c(Cl)cc2ncn1C[C@H](O)COc1ccc2ccccc2c1	ZINC000875425030	IH	On-Demand	Bother	FASN	21	44
O=c1c2cc([N+](=O)[O-])c(Cl)cc2ncn1C[C@@H](O)COc1ccc2ccccc2c1	ZINC000875425031	IH	On-Demand	Bother	FASN	21	44
N#Cc1ccc(OC[C@H](O)Cn2cnc3cc(Cl)c([N+](=O)[O-])cc3c2=O)cc1	ZINC000875425056	HE	On-Demand	Mild	FASN	17	40
N#Cc1ccc(OC[C@@H](O)Cn2cnc3cc(Cl)c([N+](=O)[O-])cc3c2=O)cc1	ZINC000875425057	HE	On-Demand	Mild	FASN	17	40
O=C(c1cccn(C2CC2)c1=O)N1CCSc2ccncc21	ZINC000875425122	DE	On-Demand	Anodyne	GPBAR1	41	39
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1	ZINC000875425148	GD	On-Demand	Clean	CACNA1I	50	34
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1	ZINC000875425246	GD	On-Demand	Clean	CACNA1I	50	34
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875425272	GE	On-Demand	Anodyne	EPHX2	16	41
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875425273	GE	On-Demand	Anodyne	EPHX2	16	41
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875425274	GE	On-Demand	Anodyne	EPHX2	16	41
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875425275	GE	On-Demand	Anodyne	EPHX2	16	41
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N1CCCN(C(=O)CC(C)C)CC1	ZINC000875425291	GD	On-Demand	Anodyne	RIR1_HHV11	45	33
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)N1CCCN(C(=O)CC(C)C)CC1	ZINC000875425292	GD	On-Demand	Anodyne	RIR1_HHV11	45	33
CC[C@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N1CCCN(C(=O)CC(C)C)CC1	ZINC000875425293	GD	On-Demand	Anodyne	RIR1_HHV11	45	33
CC[C@H]1CN(C(C)=O)CC[C@H]1NC(=O)N1CCCN(C(=O)CC(C)C)CC1	ZINC000875425294	GD	On-Demand	Anodyne	RIR1_HHV11	45	33
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N1CCC[C@@](F)(c2ccccc2)C1	ZINC000875425297	GG	On-Demand	Anodyne	EPHX2	28	46
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)N1CCC[C@@](F)(c2ccccc2)C1	ZINC000875425298	GG	On-Demand	Anodyne	EPHX2	28	46
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N1CCC[C@](F)(c2ccccc2)C1	ZINC000875425299	GG	On-Demand	Anodyne	EPHX2	28	46
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)N1CCC[C@](F)(c2ccccc2)C1	ZINC000875425300	GG	On-Demand	Anodyne	EPHX2	28	46
COc1cccc([C@H](O)C2CCN(C(=O)NCCc3ccncc3C)CC2)c1	ZINC000875425425	GG	On-Demand	Anodyne	DRD4	41	33
COc1cccc([C@H](O)C2CCN(C(=O)NCCc3ccncc3C)CC2)c1	ZINC000875425425	GG	On-Demand	Anodyne	MTNR1A	50	38
COc1cccc([C@H](O)C2CCN(C(=O)NCCc3ccncc3C)CC2)c1	ZINC000875425425	GG	On-Demand	Anodyne	MTNR1B	42	35
CCc1nn(C)c(CC)c1CNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875425432	GF	On-Demand	Anodyne	CTSV	30	41
CCc1nn(C)c(CC)c1CNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875425433	GF	On-Demand	Anodyne	CTSV	30	41
CN(C)C[C@@H]1CN(C(=O)NCc2cccc(N(C)C)n2)C[C@H]1CN(C)C	ZINC000875425443	FD	On-Demand	Anodyne	PDE8B	40	33
C=CCCC(C)(C)CNC(=O)C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1	ZINC000875425491	GF	On-Demand	Mild	CACNA1I	45	32
C=CCCC(C)(C)CNC(=O)C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1	ZINC000875425494	GF	On-Demand	Mild	CACNA1I	45	32
C=CC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1	ZINC000875425564	FE	On-Demand	Mild	CACNA1I	41	33
C=CC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1	ZINC000875425566	FE	On-Demand	Mild	CACNA1I	41	33
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875425606	GE	On-Demand	Anodyne	NPY2R	54	37
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875425606	GE	On-Demand	Anodyne	CCR3	58	39
CC[C@H]1CN(C(C)=O)CC[C@H]1NC(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875425607	GE	On-Demand	Anodyne	NPY2R	54	37
CC[C@H]1CN(C(C)=O)CC[C@H]1NC(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875425607	GE	On-Demand	Anodyne	CCR3	58	39
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875425608	GE	On-Demand	Anodyne	NPY2R	54	37
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875425608	GE	On-Demand	Anodyne	CCR3	58	39
CC[C@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875425609	GE	On-Demand	Anodyne	NPY2R	54	37
CC[C@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875425609	GE	On-Demand	Anodyne	CCR3	58	39
O=c1c2cc([N+](=O)[O-])c(Cl)cc2ncn1C[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000875425646	JI	On-Demand	Bother	FASN	24	50
O=c1c2cc([N+](=O)[O-])c(Cl)cc2ncn1C[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000875425647	JI	On-Demand	Bother	FASN	24	50
O=C(NC1(C(=O)N2CCSc3ccncc32)CC1)OCc1ccccc1	ZINC000875425652	FF	On-Demand	Anodyne	SLC12A5	41	32
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875425667	GG	On-Demand	Anodyne	CHRNA7	40	35
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875425667	GG	On-Demand	Anodyne	C3AR1	50	47
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875425668	GG	On-Demand	Anodyne	CHRNA7	40	35
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875425668	GG	On-Demand	Anodyne	C3AR1	50	47
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875425669	GG	On-Demand	Anodyne	CHRNA7	40	35
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875425669	GG	On-Demand	Anodyne	C3AR1	50	47
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875425670	GG	On-Demand	Anodyne	CHRNA7	40	35
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875425670	GG	On-Demand	Anodyne	C3AR1	50	47
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N(C)CCc1cccc(C#N)c1	ZINC000875425675	FE	On-Demand	Mild	CCR3	16	40
CC[C@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N(C)CCc1cccc(C#N)c1	ZINC000875425676	FE	On-Demand	Mild	CCR3	16	40
CC[C@H]1CN(C(C)=O)CC[C@H]1NC(=O)N(C)CCc1cccc(C#N)c1	ZINC000875425677	FE	On-Demand	Mild	CCR3	16	40
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)N(C)CCc1cccc(C#N)c1	ZINC000875425678	FE	On-Demand	Mild	CCR3	16	40
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N(CC)[C@H](C)[C@H](O)c1ccccc1	ZINC000875425699	GF	On-Demand	Anodyne	XIAP	40	37
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N(CC)[C@@H](C)[C@@H](O)c1ccccc1	ZINC000875425700	GF	On-Demand	Anodyne	XIAP	40	37
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N(CC)[C@@H](C)[C@H](O)c1ccccc1	ZINC000875425701	GF	On-Demand	Anodyne	XIAP	40	37
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N(CC)[C@H](C)[C@@H](O)c1ccccc1	ZINC000875425702	GF	On-Demand	Anodyne	XIAP	40	37
O=c1c2cc([N+](=O)[O-])c(Cl)cc2ncn1C[C@@H](O)COc1ccc(Br)cc1	ZINC000875425703	JG	On-Demand	Bother	FASN	19	41
O=c1c2cc([N+](=O)[O-])c(Cl)cc2ncn1C[C@H](O)COc1ccc(Br)cc1	ZINC000875425704	JG	On-Demand	Bother	FASN	19	41
CC(=O)c1ccc(OC[C@H](O)Cn2cnc3cc(Cl)c([N+](=O)[O-])cc3c2=O)cc1	ZINC000875425711	HF	On-Demand	Bother	FASN	17	40
CC(=O)c1ccc(OC[C@@H](O)Cn2cnc3cc(Cl)c([N+](=O)[O-])cc3c2=O)cc1	ZINC000875425712	HF	On-Demand	Bother	FASN	17	40
O=c1c2cc([N+](=O)[O-])c(Cl)cc2ncn1C[C@@H](O)COCc1ccccc1Cl	ZINC000875425719	HG	On-Demand	Bother	FASN	20	40
O=c1c2cc([N+](=O)[O-])c(Cl)cc2ncn1C[C@H](O)COCc1ccccc1Cl	ZINC000875425720	HG	On-Demand	Bother	FASN	20	40
CC[C@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N[C@@H](CO)c1ccc(Cl)cc1	ZINC000875425779	FE	On-Demand	Anodyne	UTS2	42	34
CC[C@H]1CN(C(C)=O)CC[C@H]1NC(=O)N[C@@H](CO)c1ccc(Cl)cc1	ZINC000875425780	FE	On-Demand	Anodyne	UTS2	42	34
O=c1c2cc([N+](=O)[O-])c(Cl)cc2ncn1C[C@H](O)COc1cccc2ccccc12	ZINC000875425788	IH	On-Demand	Bother	FASN	21	41
O=c1c2cc([N+](=O)[O-])c(Cl)cc2ncn1C[C@@H](O)COc1cccc2ccccc12	ZINC000875425789	IH	On-Demand	Bother	FASN	21	41
CC[C@H]1CN(C(C)=O)CC[C@H]1NC(=O)N(C)[C@@H](C)c1ccc(Cl)cc1	ZINC000875425864	FH	On-Demand	Anodyne	UTS2	41	32
CC[C@H]1CN(C(C)=O)CC[C@H]1NC(=O)N(C)[C@H](C)c1ccc(Cl)cc1	ZINC000875425865	FH	On-Demand	Anodyne	UTS2	41	32
CC[C@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N(C)[C@H](C)c1ccc(Cl)cc1	ZINC000875425866	FH	On-Demand	Anodyne	UTS2	41	32
CC[C@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N(C)[C@@H](C)c1ccc(Cl)cc1	ZINC000875425867	FH	On-Demand	Anodyne	UTS2	41	32
O=c1c2cc([N+](=O)[O-])c(Cl)cc2ncn1C[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000875425945	IH	On-Demand	Bother	FASN	20	41
O=c1c2cc([N+](=O)[O-])c(Cl)cc2ncn1C[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000875425946	IH	On-Demand	Bother	FASN	20	41
C=C[C@@H]1OCC[C@H]1CNC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875425964	GD	On-Demand	Mild	ETHR	42	45
CCOc1ccc(OC[C@H](O)Cn2cnc3cc(Cl)c([N+](=O)[O-])cc3c2=O)cc1	ZINC000875426002	HF	On-Demand	Bother	FASN	19	41
CCOc1ccc(OC[C@@H](O)Cn2cnc3cc(Cl)c([N+](=O)[O-])cc3c2=O)cc1	ZINC000875426003	HF	On-Demand	Bother	FASN	19	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)C1CCC1	ZINC000875426016	BE	On-Demand	Anodyne	RIR1_HHV11	40	33
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)C1CCC1	ZINC000875426017	BE	On-Demand	Anodyne	RIR1_HHV11	40	33
C[C@@H](NC(=O)NC[C@@H](O)Cc1cccc(Cl)c1)C1CCC1	ZINC000875426040	DF	On-Demand	Anodyne	CTSV	29	41
C[C@@H](NC(=O)NC[C@H](O)Cc1cccc(Cl)c1)C1CCC1	ZINC000875426041	DF	On-Demand	Anodyne	CTSV	29	41
C[C@H](NC(=O)NC[C@H](O)Cc1cccc(Cl)c1)C1CCC1	ZINC000875426043	DF	On-Demand	Anodyne	CTSV	29	41
O=C(NCC1CCS(=O)(=O)CC1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875426122	GE	On-Demand	Anodyne	F2	23	40
O=C(NCC1CCS(=O)(=O)CC1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875426123	GE	On-Demand	Anodyne	F2	23	40
O=C(NCC1CCS(=O)(=O)CC1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875426124	GE	On-Demand	Anodyne	F2	23	40
O=C(NCC1CCS(=O)(=O)CC1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875426125	GE	On-Demand	Anodyne	F2	23	40
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NCC1CCS(=O)(=O)CC1	ZINC000875426153	GD	On-Demand	Anodyne	CACNA1I	51	34
O=c1c2cc([N+](=O)[O-])c(Cl)cc2ncn1C[C@H](O)COc1ccccc1Cl	ZINC000875426162	HG	On-Demand	Bother	FASN	21	41
O=c1c2cc([N+](=O)[O-])c(Cl)cc2ncn1C[C@@H](O)COc1ccccc1Cl	ZINC000875426163	HG	On-Demand	Bother	FASN	21	41
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)NCC1CCS(=O)(=O)CC1	ZINC000875426182	GG	On-Demand	Anodyne	MDM2	63	34
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)NCC1CCS(=O)(=O)CC1	ZINC000875426182	GG	On-Demand	Anodyne	CACNA1I	55	40
CC[C@H]1CN(C(C)=O)CC[C@H]1NC(=O)NC1CC(Nc2ccccc2)C1	ZINC000875426262	FF	On-Demand	Anodyne	EPHX2	38	47
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)NC1CC(Nc2ccccc2)C1	ZINC000875426263	FF	On-Demand	Anodyne	EPHX2	38	47
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)NC1CC(Nc2ccccc2)C1	ZINC000875426264	FF	On-Demand	Anodyne	EPHX2	38	47
CC[C@H]1CN(C(C)=O)CC[C@@H]1NC(=O)NC1CC(Nc2ccccc2)C1	ZINC000875426265	FF	On-Demand	Anodyne	EPHX2	38	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCSc2ccncc21	ZINC000875426297	FF	On-Demand	Anodyne	CTSB	34	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCSc2ccncc21	ZINC000875426297	FF	On-Demand	Anodyne	PAPA1_CARPA	41	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCSc2ccncc21	ZINC000875426297	FF	On-Demand	Anodyne	CYSP_TRYCR	62	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCSc2ccncc21	ZINC000875426297	FF	On-Demand	Anodyne	CTSL	37	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCSc2ccncc21	ZINC000875426297	FF	On-Demand	Anodyne	TIMP3	49	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCSc2ccncc21	ZINC000875426297	FF	On-Demand	Anodyne	CAPNS1	61	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCSc2ccncc21	ZINC000875426297	FF	On-Demand	Anodyne	HLA-DRB1	60	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCSc2ccncc21	ZINC000875426297	FF	On-Demand	Anodyne	CELA2A	49	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCSc2ccncc21	ZINC000875426297	FF	On-Demand	Anodyne	CAPN1	59	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCSc2ccncc21	ZINC000875426297	FF	On-Demand	Anodyne	CAPN2	80	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCSc2ccncc21	ZINC000875426297	FF	On-Demand	Anodyne	ACE2	65	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCSc2ccncc21	ZINC000875426297	FF	On-Demand	Anodyne	GPR142	48	38
C=C[C@@H]1OCC[C@H]1CNC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875426399	FD	On-Demand	Mild	OXTR	40	35
C=C[C@@H]1OCC[C@H]1CNC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875426400	FD	On-Demand	Mild	OXTR	40	35
C=C[C@@H]1OCC[C@H]1CNC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1C	ZINC000875426511	GD	On-Demand	Mild	SLC18A2	47	35
CN1Cc2ccccc2[C@@H](NC(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875426513	DF	On-Demand	Anodyne	RBP4	51	35
CN1Cc2ccccc2[C@H](NC(=O)N2C[C@H]3CC=CC[C@H]3C2)C1	ZINC000875426514	DF	On-Demand	Anodyne	RBP4	51	35
C#CC[C@H](NC(=O)N[C@H](CC)[C@@H](O)c1ccccc1)c1ccccc1	ZINC000875426556	EH	On-Demand	Mild	TACR3	41	35
C#CC[C@H](NC(=O)N[C@H](CC)[C@H](O)c1ccccc1)c1ccccc1	ZINC000875426557	EH	On-Demand	Mild	TACR3	41	35
C#CC[C@H](NC(=O)N[C@@H](CC)[C@H](O)c1ccccc1)c1ccccc1	ZINC000875426558	EH	On-Demand	Mild	TACR3	41	35
C#CC[C@H](NC(=O)N[C@@H](CC)[C@@H](O)c1ccccc1)c1ccccc1	ZINC000875426559	EH	On-Demand	Mild	TACR3	41	35
CN1Cc2ccccc2[C@@H](NC(=O)N2CCC3(CCNC3=O)CC2)C1	ZINC000875426566	ED	On-Demand	Anodyne	CALCRL	22	49
CN1Cc2ccccc2[C@H](NC(=O)N2CCC3(CCNC3=O)CC2)C1	ZINC000875426567	ED	On-Demand	Anodyne	CALCRL	22	49
C=C[C@@H]1OCC[C@H]1CNC(=O)C(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1C	ZINC000875426612	GD	On-Demand	Mild	SLC18A2	47	35
COc1ccccc1[C@H]1CCCN(C(=O)NCC2CCS(=O)(=O)CC2)CC1	ZINC000875426622	GF	On-Demand	Anodyne	RBP4	29	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCC2CCS(=O)(=O)CC2)CC1	ZINC000875426623	GF	On-Demand	Anodyne	RBP4	29	40
O=c1c2cc([N+](=O)[O-])c(Cl)cc2ncn1C[C@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000875426624	JI	On-Demand	Bother	FASN	20	46
O=c1c2cc([N+](=O)[O-])c(Cl)cc2ncn1C[C@@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000875426625	JI	On-Demand	Bother	FASN	20	46
COc1ccccc1[C@H]1CCCN(C(=O)NCCCNC(=O)C(C)C)CC1	ZINC000875426627	GG	On-Demand	Anodyne	HTR1A	28	40
COc1ccccc1[C@H]1CCCN(C(=O)NCCCNC(=O)C(C)C)CC1	ZINC000875426627	GG	On-Demand	Anodyne	DRD2	32	44
COc1ccccc1[C@H]1CCCN(C(=O)NCCCNC(=O)C(C)C)CC1	ZINC000875426627	GG	On-Demand	Anodyne	DRD4	16	44
COc1ccccc1[C@H]1CCCN(C(=O)NCCCNC(=O)C(C)C)CC1	ZINC000875426627	GG	On-Demand	Anodyne	RBP4	37	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCNC(=O)C(C)C)CC1	ZINC000875426628	GG	On-Demand	Anodyne	HTR1A	28	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCNC(=O)C(C)C)CC1	ZINC000875426628	GG	On-Demand	Anodyne	DRD2	32	44
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCNC(=O)C(C)C)CC1	ZINC000875426628	GG	On-Demand	Anodyne	DRD4	16	44
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCNC(=O)C(C)C)CC1	ZINC000875426628	GG	On-Demand	Anodyne	RBP4	37	42
COC(=O)c1ccc(C(=O)NNC(=O)c2ccc(COc3ccc(Cl)c(C)c3)cc2)cn1	ZINC000875426727	JG	On-Demand	Reactive	SLC6A5	31	41
COC(=O)c1ccc(C(=O)NNC(=O)c2ccc(COc3ccc(Cl)c(C)c3)cc2)cn1	ZINC000875426727	JG	On-Demand	Reactive	ADCYAP1R1	43	33
COc1cccc(COC(=O)CC(F)(F)C(F)(F)F)n1	ZINC000875426790	CF	On-Demand	Anodyne	ALS	42	33
C#CC[C@H](NC(=O)N1Cc2cccnc2N2CCC[C@H]2C1)c1ccccc1	ZINC000875426801	FG	On-Demand	Mild	PTAFR	22	44
C#CC[C@@H](NC(=O)N1Cc2cccnc2N2CCC[C@H]2C1)c1ccccc1	ZINC000875426802	FG	On-Demand	Mild	PTAFR	22	44
C#CC[C@H](NC(=O)NC(C)(C)[C@H]1CCCCO1)c1ccccc1	ZINC000875426810	DG	On-Demand	Mild	AMY2	44	31
C#CC[C@@H](NC(=O)NC(C)(C)[C@H]1CCCCO1)c1ccccc1	ZINC000875426811	DG	On-Demand	Mild	AMY2	44	31
O=C(NCC1CCS(=O)(=O)CC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875426903	FD	On-Demand	Anodyne	F2	28	44
O=C(NCC1CCS(=O)(=O)CC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875426904	FD	On-Demand	Anodyne	F2	28	44
O=C(NCC1CCS(=O)(=O)CC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875426905	FD	On-Demand	Anodyne	F2	28	44
O=C(NCC1CCS(=O)(=O)CC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875426906	FD	On-Demand	Anodyne	F2	28	44
C#CC[C@H](NC(=O)NC(C)(C)[C@@H]1CCCCO1)c1ccccc1	ZINC000875426912	DG	On-Demand	Mild	AMY2	44	31
C#CC[C@@H](NC(=O)NC(C)(C)[C@@H]1CCCCO1)c1ccccc1	ZINC000875426913	DG	On-Demand	Mild	AMY2	44	31
C[C@@H](NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)c1cn[nH]c1	ZINC000875426944	ED	On-Demand	Anodyne	CTSK	18	40
C[C@@H](NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)c1cn[nH]c1	ZINC000875426944	ED	On-Demand	Anodyne	FAAH	17	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC(=O)C(=O)NCc1cccc(F)c1F)C2	ZINC000875427020	GD	On-Demand	Anodyne	P2RX7	17	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](CNC(=O)C(=O)NCc1cccc(F)c1F)C2	ZINC000875427021	GD	On-Demand	Anodyne	P2RX7	17	43
O=C(NCC1CCS(=O)(=O)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875427029	FD	On-Demand	Anodyne	EPHX2	16	42
O=C(NCC1CCS(=O)(=O)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875427030	FD	On-Demand	Anodyne	EPHX2	16	42
O=C(NCC1CCS(=O)(=O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875427036	GD	On-Demand	Anodyne	DRD4	20	40
O=C(NCC1CCS(=O)(=O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875427036	GD	On-Demand	Anodyne	ACHE	24	40
O=C(NCC1CCS(=O)(=O)CC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875427036	GD	On-Demand	Anodyne	FAAH	15	40
C#CC[C@@H](NC(=O)N1CCCC[C@H]1CNC(=O)NC)c1ccccc1	ZINC000875427096	EE	On-Demand	Mild	HCRTR1	15	42
C#CC[C@@H](NC(=O)N1CCCC[C@@H]1CNC(=O)NC)c1ccccc1	ZINC000875427098	EE	On-Demand	Mild	HCRTR1	15	42
C#CC[C@H](NC(=O)N1CCCC[C@H]1CNC(=O)NC)c1ccccc1	ZINC000875427100	EE	On-Demand	Mild	HCRTR1	15	42
C#CC[C@H](NC(=O)N1CCCC[C@@H]1CNC(=O)NC)c1ccccc1	ZINC000875427101	EE	On-Demand	Mild	HCRTR1	15	42
C=C[C@@H]1OCC[C@H]1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875427135	GE	On-Demand	Mild	DRD4	30	41
C=C[C@@H]1OCC[C@H]1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875427135	GE	On-Demand	Mild	ACHE	52	54
C=C[C@@H]1OCC[C@H]1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875427135	GE	On-Demand	Mild	SIGMAR1	43	40
C#CC[C@H](NC(=O)Nc1cnn(C2CCN(C)CC2)c1)c1ccccc1	ZINC000875427138	FG	On-Demand	Mild	ITK	47	33
C#CC[C@@H](NC(=O)Nc1cnn(C2CCN(C)CC2)c1)c1ccccc1	ZINC000875427140	FG	On-Demand	Mild	ITK	47	33
CN1Cc2ccccc2[C@@H](NC(=O)N2CCN(c3ccc(C#N)nc3)CC2)C1	ZINC000875427178	GD	On-Demand	Mild	SSTR1	42	33
N#CCc1ccc(OC[C@H](O)Cn2cnc3cc(Cl)c([N+](=O)[O-])cc3c2=O)cc1	ZINC000875427179	HE	On-Demand	Mild	FASN	16	41
CN1Cc2ccccc2[C@H](NC(=O)N2CCN(c3ccc(C#N)nc3)CC2)C1	ZINC000875427180	GD	On-Demand	Mild	SSTR1	42	33
N#CCc1ccc(OC[C@@H](O)Cn2cnc3cc(Cl)c([N+](=O)[O-])cc3c2=O)cc1	ZINC000875427198	HE	On-Demand	Mild	FASN	16	41
COc1cccc(COC(=O)C2CCN(C(C)C)CC2)n1	ZINC000875427220	CE	On-Demand	Anodyne	ALS	52	31
COc1cccc(COC(=O)C2CCN(C(C)C)CC2)n1	ZINC000875427220	CE	On-Demand	Anodyne	PTR1	44	32
C#CC[C@H](NC(=O)N1CCCN(C=O)CC1)c1ccccc1	ZINC000875427231	CD	On-Demand	Mild	PTAFR	15	46
C#CC[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccccc1	ZINC000875427233	CD	On-Demand	Mild	PTAFR	15	46
O=c1c2cc([N+](=O)[O-])c(Cl)cc2ncn1C[C@H](O)Cc1ccccc1	ZINC000875427354	FF	On-Demand	Bother	FASN	21	44
O=c1c2cc([N+](=O)[O-])c(Cl)cc2ncn1C[C@@H](O)Cc1ccccc1	ZINC000875427357	FF	On-Demand	Bother	FASN	21	44
C[C@@H]1CN(C(=O)N[C@@H]2CN(C)Cc3ccccc32)CC[C@H](C(F)(F)F)O1	ZINC000875427376	FF	On-Demand	Anodyne	RBP4	51	35
C[C@@H]1CN(C(=O)N[C@H]2CN(C)Cc3ccccc32)CC[C@@H](C(F)(F)F)O1	ZINC000875427379	FF	On-Demand	Anodyne	RBP4	51	35
C[C@@H]1CN(C(=O)N[C@H]2CN(C)Cc3ccccc32)CC[C@H](C(F)(F)F)O1	ZINC000875427381	FF	On-Demand	Anodyne	RBP4	51	35
C[C@@H]1CN(C(=O)N[C@@H]2CN(C)Cc3ccccc32)CC[C@@H](C(F)(F)F)O1	ZINC000875427382	FF	On-Demand	Anodyne	RBP4	51	35
CN1Cc2ccccc2[C@@H](NC(=O)N2CC(CNC(=O)C(F)(F)F)C2)C1	ZINC000875427436	FD	On-Demand	Anodyne	RBP4	42	37
CN1Cc2ccccc2[C@H](NC(=O)N2CC(CNC(=O)C(F)(F)F)C2)C1	ZINC000875427437	FD	On-Demand	Anodyne	RBP4	42	37
CN1Cc2ccccc2[C@@H](NC(=O)N2CCC(c3nc(C4CCC4)no3)CC2)C1	ZINC000875427446	GG	On-Demand	Anodyne	CPT1A	20	42
CN1Cc2ccccc2[C@@H](NC(=O)N2CCC(c3nc(C4CCC4)no3)CC2)C1	ZINC000875427446	GG	On-Demand	Anodyne	SMO	44	45
CN1Cc2ccccc2[C@@H](NC(=O)N2CCC(c3nc(C4CCC4)no3)CC2)C1	ZINC000875427446	GG	On-Demand	Anodyne	ETHR	46	42
CN1Cc2ccccc2[C@H](NC(=O)N2CCC(c3nc(C4CCC4)no3)CC2)C1	ZINC000875427447	GG	On-Demand	Anodyne	CPT1A	20	42
CN1Cc2ccccc2[C@H](NC(=O)N2CCC(c3nc(C4CCC4)no3)CC2)C1	ZINC000875427447	GG	On-Demand	Anodyne	SMO	44	45
CN1Cc2ccccc2[C@H](NC(=O)N2CCC(c3nc(C4CCC4)no3)CC2)C1	ZINC000875427447	GG	On-Demand	Anodyne	ETHR	46	42
Cn1cc([C@@H]2OCC[C@H]2NC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)cn1	ZINC000875427450	GD	On-Demand	Anodyne	OXTR	42	36
Cn1cc([C@@H]2OCC[C@H]2NC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)cn1	ZINC000875427451	GD	On-Demand	Anodyne	OXTR	42	36
C#CC[C@H](NC(=O)NCCc1ccc(OC)c(O)c1)c1ccccc1	ZINC000875427456	EG	On-Demand	Mild	INHA	48	33
C#CC[C@@H](NC(=O)NCCc1ccc(OC)c(O)c1)c1ccccc1	ZINC000875427457	EG	On-Demand	Mild	INHA	48	33
C#CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccccc1	ZINC000875427507	EE	On-Demand	Mild	SLC6A4	23	42
C#CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccccc1	ZINC000875427507	EE	On-Demand	Mild	SLC6A3	57	42
C#CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccccc1	ZINC000875427508	EE	On-Demand	Mild	SLC6A4	23	42
C#CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccccc1	ZINC000875427508	EE	On-Demand	Mild	SLC6A3	57	42
C#CC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccccc1	ZINC000875427509	EE	On-Demand	Mild	SLC6A4	23	42
C#CC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccccc1	ZINC000875427509	EE	On-Demand	Mild	SLC6A3	57	42
C#CC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccccc1	ZINC000875427510	EE	On-Demand	Mild	SLC6A4	23	42
C#CC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccccc1	ZINC000875427510	EE	On-Demand	Mild	SLC6A3	57	42
C#CC[C@H](NC(=O)N(C)CCN1CC2(CCOCC2)C1)c1ccccc1	ZINC000875427533	FF	On-Demand	Mild	CASR	46	36
C#CC[C@@H](NC(=O)N(C)CCN1CC2(CCOCC2)C1)c1ccccc1	ZINC000875427534	FF	On-Demand	Mild	CASR	46	36
C[C@H](NC(=O)NC[C@H](O)Cc1cccc(Cl)c1)c1cn[nH]c1	ZINC000875427582	DE	On-Demand	Anodyne	MAPK1	32	40
C[C@H](NC(=O)NC[C@H](O)Cc1cccc(Cl)c1)c1cn[nH]c1	ZINC000875427582	DE	On-Demand	Anodyne	ROCK2	26	46
C[C@@H](NC(=O)NC[C@H](O)Cc1cccc(Cl)c1)c1cn[nH]c1	ZINC000875427583	DE	On-Demand	Anodyne	MAPK1	32	40
C[C@@H](NC(=O)NC[C@H](O)Cc1cccc(Cl)c1)c1cn[nH]c1	ZINC000875427583	DE	On-Demand	Anodyne	ROCK2	26	46
C[C@@H](NC(=O)NC[C@@H](O)Cc1cccc(Cl)c1)c1cn[nH]c1	ZINC000875427584	DE	On-Demand	Anodyne	MAPK1	32	40
C[C@@H](NC(=O)NC[C@@H](O)Cc1cccc(Cl)c1)c1cn[nH]c1	ZINC000875427584	DE	On-Demand	Anodyne	ROCK2	26	46
CN1Cc2ccccc2[C@@H](NC(=O)N2CCO[C@@H](c3noc(C4CC4)n3)C2)C1	ZINC000875427603	GE	On-Demand	Anodyne	SMO	37	41
CN1Cc2ccccc2[C@H](NC(=O)N2CCO[C@@H](c3noc(C4CC4)n3)C2)C1	ZINC000875427604	GE	On-Demand	Anodyne	SMO	37	41
CN1Cc2ccccc2[C@@H](NC(=O)N2CCO[C@H](c3noc(C4CC4)n3)C2)C1	ZINC000875427605	GE	On-Demand	Anodyne	SMO	37	41
CN1Cc2ccccc2[C@H](NC(=O)N2CCO[C@H](c3noc(C4CC4)n3)C2)C1	ZINC000875427606	GE	On-Demand	Anodyne	SMO	37	41
C#CC[C@H](NC(=O)N[C@H](C)[C@H](O)c1cc(OC)ccc1OC)c1ccccc1	ZINC000875427612	GG	On-Demand	Mild	SOAT1	26	42
C#CC[C@H](NC(=O)N[C@H](C)[C@@H](O)c1cc(OC)ccc1OC)c1ccccc1	ZINC000875427613	GG	On-Demand	Mild	SOAT1	26	42
C#CC[C@H](NC(=O)N[C@@H](C)[C@@H](O)c1cc(OC)ccc1OC)c1ccccc1	ZINC000875427614	GG	On-Demand	Mild	SOAT1	26	42
C#CC[C@H](NC(=O)N[C@@H](C)[C@H](O)c1cc(OC)ccc1OC)c1ccccc1	ZINC000875427615	GG	On-Demand	Mild	SOAT1	26	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CN(C)Cc2ccccc21	ZINC000875427616	ED	On-Demand	Anodyne	SLC6A4	26	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CN(C)Cc2ccccc21	ZINC000875427616	ED	On-Demand	Anodyne	SLC6A3	49	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CN(C)Cc2ccccc21	ZINC000875427617	ED	On-Demand	Anodyne	SLC6A4	26	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CN(C)Cc2ccccc21	ZINC000875427617	ED	On-Demand	Anodyne	SLC6A3	49	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CN(C)Cc2ccccc21	ZINC000875427618	ED	On-Demand	Anodyne	SLC6A4	26	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CN(C)Cc2ccccc21	ZINC000875427618	ED	On-Demand	Anodyne	SLC6A3	49	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CN(C)Cc2ccccc21	ZINC000875427619	ED	On-Demand	Anodyne	SLC6A4	26	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CN(C)Cc2ccccc21	ZINC000875427619	ED	On-Demand	Anodyne	SLC6A3	49	40
C=CCCOCCNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875427634	EF	On-Demand	Mild	ITK	15	49
CC(=O)C1CCN(C(=O)N[C@H]2CN(C)Cc3ccccc32)CC1	ZINC000875427635	DE	On-Demand	Anodyne	EPHX2	15	41
CC(=O)C1CCN(C(=O)N[C@@H]2CN(C)Cc3ccccc32)CC1	ZINC000875427636	DE	On-Demand	Anodyne	EPHX2	15	41
CN1Cc2ccccc2[C@H](NC(=O)N2CCO[C@H](C(F)(F)F)CC2)C1	ZINC000875427651	FF	On-Demand	Anodyne	RBP4	51	37
CN1Cc2ccccc2[C@@H](NC(=O)N2CCO[C@H](C(F)(F)F)CC2)C1	ZINC000875427652	FF	On-Demand	Anodyne	RBP4	51	37
CN1Cc2ccccc2[C@H](NC(=O)N2CCO[C@@H](C(F)(F)F)CC2)C1	ZINC000875427653	FF	On-Demand	Anodyne	RBP4	51	37
CN1Cc2ccccc2[C@@H](NC(=O)N2CCO[C@@H](C(F)(F)F)CC2)C1	ZINC000875427654	FF	On-Demand	Anodyne	RBP4	51	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CN(C)Cc3ccccc32)C1	ZINC000875427669	EE	On-Demand	Anodyne	ACE	22	46
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CN(C)Cc3ccccc32)C1	ZINC000875427670	EE	On-Demand	Anodyne	ACE	22	46
CN1Cc2ccccc2[C@@H](NC(=O)N2CCN([S@@](C)(=N)=O)CC2)C1	ZINC000875427707	FD	On-Demand	Anodyne	RBP4	49	34
CN1Cc2ccccc2[C@H](NC(=O)N2CCN([S@](C)(=N)=O)CC2)C1	ZINC000875427708	FD	On-Demand	Anodyne	RBP4	49	34
CN1Cc2ccccc2[C@@H](NC(=O)N2CCN([S@](C)(=N)=O)CC2)C1	ZINC000875427709	FD	On-Demand	Anodyne	RBP4	49	34
CN1Cc2ccccc2[C@H](NC(=O)N2CCN([S@@](C)(=N)=O)CC2)C1	ZINC000875427710	FD	On-Demand	Anodyne	RBP4	49	34
Cn1cc([C@@H]2OCC[C@H]2NC(=O)C(=O)NCCCCCCc2ccccc2)cn1	ZINC000875427712	GE	On-Demand	Anodyne	FAAH	69	37
Cn1cc([C@@H]2OCC[C@H]2NC(=O)C(=O)NCCCCCCc2ccccc2)cn1	ZINC000875427712	GE	On-Demand	Anodyne	CES1	66	37
Cn1cc([C@@H]2OCC[C@H]2NC(=O)C(=O)NCCCCCCc2ccccc2)cn1	ZINC000875427712	GE	On-Demand	Anodyne	CES1D	54	34
CN1Cc2ccccc2[C@H](NC(=O)N2CC[C@@](C)(C(F)(F)F)C2)C1	ZINC000875427749	EG	On-Demand	Anodyne	RBP4	52	32
CN1Cc2ccccc2[C@@H](NC(=O)N2CC[C@@](C)(C(F)(F)F)C2)C1	ZINC000875427750	EG	On-Demand	Anodyne	RBP4	52	32
CN1Cc2ccccc2[C@@H](NC(=O)N2CC[C@](C)(C(F)(F)F)C2)C1	ZINC000875427751	EG	On-Demand	Anodyne	RBP4	52	32
CN1Cc2ccccc2[C@H](NC(=O)N2CC[C@](C)(C(F)(F)F)C2)C1	ZINC000875427752	EG	On-Demand	Anodyne	RBP4	52	32
C[C@@H](NC(=O)N1CCCCC[C@H](NC(=O)OC(C)(C)C)C1)c1cn[nH]c1	ZINC000875427761	FF	On-Demand	Anodyne	REN	42	35
C[C@@H](NC(=O)N1CCCCC[C@@H](NC(=O)OC(C)(C)C)C1)c1cn[nH]c1	ZINC000875427762	FF	On-Demand	Anodyne	REN	42	35
C#CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)c1ccccc1	ZINC000875427814	FH	On-Demand	Mild	OPRL1	17	50
C#CC[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)c1ccccc1	ZINC000875427815	FH	On-Demand	Mild	OPRL1	17	50
C=CCCOCCNC(=O)N(CC)[C@@H](C)[C@@H](O)c1ccccc1	ZINC000875427833	DF	On-Demand	Mild	NPY5R	21	41
C=CCCOCCNC(=O)N(CC)[C@H](C)[C@@H](O)c1ccccc1	ZINC000875427834	DF	On-Demand	Mild	NPY5R	21	41
C=CCCOCCNC(=O)N(CC)[C@@H](C)[C@H](O)c1ccccc1	ZINC000875427835	DF	On-Demand	Mild	NPY5R	21	41
C=CCCOCCNC(=O)N(CC)[C@H](C)[C@H](O)c1ccccc1	ZINC000875427836	DF	On-Demand	Mild	NPY5R	21	41
C#CC[C@H](NC(=O)N(C)[C@@H]1CCCCN(C)C1=O)c1ccccc1	ZINC000875427922	EE	On-Demand	Mild	AMY2	42	29
C#CC[C@@H](NC(=O)N(C)[C@@H]1CCCCN(C)C1=O)c1ccccc1	ZINC000875427923	EE	On-Demand	Mild	AMY2	42	29
C#CC[C@H](NC(=O)N(C)[C@H]1CCCCN(C)C1=O)c1ccccc1	ZINC000875427924	EE	On-Demand	Mild	AMY2	42	29
C#CC[C@@H](NC(=O)N(C)[C@H]1CCCCN(C)C1=O)c1ccccc1	ZINC000875427925	EE	On-Demand	Mild	AMY2	42	29
C#CC[C@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccccc1	ZINC000875427937	FE	On-Demand	Mild	UTS2	42	34
C#CC[C@@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccccc1	ZINC000875427938	FE	On-Demand	Mild	UTS2	42	34
C#CC[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875427952	DF	On-Demand	Mild	AMY2	45	32
C#CC[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875427953	DF	On-Demand	Mild	AMY2	45	32
C#CC[C@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccccc1	ZINC000875427954	DF	On-Demand	Mild	AMY2	45	32
C#CC[C@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccccc1	ZINC000875427955	DF	On-Demand	Mild	AMY2	45	32
CN1CCN(C2CCN(C(=O)N[C@H]3CN(C)Cc4ccccc43)CC2)CC1	ZINC000875428017	FD	On-Demand	Anodyne	CALCRL	55	36
CN1CCN(C2CCN(C(=O)N[C@H]3CN(C)Cc4ccccc43)CC2)CC1	ZINC000875428017	FD	On-Demand	Anodyne	L3MBTL3	84	44
CN1CCN(C2CCN(C(=O)N[C@@H]3CN(C)Cc4ccccc43)CC2)CC1	ZINC000875428018	FD	On-Demand	Anodyne	CALCRL	55	36
CN1CCN(C2CCN(C(=O)N[C@@H]3CN(C)Cc4ccccc43)CC2)CC1	ZINC000875428018	FD	On-Demand	Anodyne	L3MBTL3	84	44
CCOC(=O)c1cc(CNC(=O)NCCN2CCC(N(C)C)CC2)on1	ZINC000875428078	FC	On-Demand	Anodyne	HTR4	48	34
C#CC[C@H](NC(=O)NCCN1CC[C@@H](O)C1)c1ccccc1	ZINC000875428112	DD	On-Demand	Mild	SLC6A1	41	35
C#CC[C@H](NC(=O)NCCN1CC[C@@H](O)C1)c1ccccc1	ZINC000875428112	DD	On-Demand	Mild	OPRK1	20	41
C#CC[C@H](NC(=O)NCCN1CC[C@H](O)C1)c1ccccc1	ZINC000875428113	DD	On-Demand	Mild	SLC6A1	41	35
C#CC[C@H](NC(=O)NCCN1CC[C@H](O)C1)c1ccccc1	ZINC000875428113	DD	On-Demand	Mild	OPRK1	20	41
C#CC[C@@H](NC(=O)NCCN1CC[C@@H](O)C1)c1ccccc1	ZINC000875428114	DD	On-Demand	Mild	SLC6A1	41	35
C#CC[C@@H](NC(=O)NCCN1CC[C@@H](O)C1)c1ccccc1	ZINC000875428114	DD	On-Demand	Mild	OPRK1	20	41
C#CC[C@@H](NC(=O)NCCN1CC[C@H](O)C1)c1ccccc1	ZINC000875428115	DD	On-Demand	Mild	SLC6A1	41	35
C#CC[C@@H](NC(=O)NCCN1CC[C@H](O)C1)c1ccccc1	ZINC000875428115	DD	On-Demand	Mild	OPRK1	20	41
C#CC[C@@H](NC(=O)N(C)[C@@H]1CCCC[C@H]1O)c1ccccc1	ZINC000875428121	DF	On-Demand	Mild	AMY2	46	31
C#CC[C@H](NC(=O)N(C)[C@@H]1CCCC[C@H]1O)c1ccccc1	ZINC000875428122	DF	On-Demand	Mild	AMY2	46	31
COc1ccccc1[C@@H]1CN(C(=O)NCCN2CCC(N(C)C)CC2)CCO1	ZINC000875428272	GD	On-Demand	Anodyne	HTR1A	39	41
COc1ccccc1[C@@H]1CN(C(=O)NCCN2CCC(N(C)C)CC2)CCO1	ZINC000875428272	GD	On-Demand	Anodyne	DRD2	41	43
COc1ccccc1[C@@H]1CN(C(=O)NCCN2CCC(N(C)C)CC2)CCO1	ZINC000875428272	GD	On-Demand	Anodyne	DRD4	42	32
COc1ccccc1[C@@H]1CN(C(=O)NCCN2CCC(N(C)C)CC2)CCO1	ZINC000875428272	GD	On-Demand	Anodyne	ADRA1D	41	38
COc1ccccc1[C@@H]1CN(C(=O)NCCN2CCC(N(C)C)CC2)CCO1	ZINC000875428272	GD	On-Demand	Anodyne	DRD3	47	38
COc1ccccc1[C@@H]1CN(C(=O)NCCN2CCC(N(C)C)CC2)CCO1	ZINC000875428272	GD	On-Demand	Anodyne	HTR4	46	36
COc1ccccc1[C@@H]1CN(C(=O)NCCN2CCC(N(C)C)CC2)CCO1	ZINC000875428272	GD	On-Demand	Anodyne	CCR5	18	41
COc1ccccc1[C@H]1CN(C(=O)NCCN2CCC(N(C)C)CC2)CCO1	ZINC000875428273	GD	On-Demand	Anodyne	HTR1A	39	41
COc1ccccc1[C@H]1CN(C(=O)NCCN2CCC(N(C)C)CC2)CCO1	ZINC000875428273	GD	On-Demand	Anodyne	DRD2	41	43
COc1ccccc1[C@H]1CN(C(=O)NCCN2CCC(N(C)C)CC2)CCO1	ZINC000875428273	GD	On-Demand	Anodyne	DRD4	42	32
COc1ccccc1[C@H]1CN(C(=O)NCCN2CCC(N(C)C)CC2)CCO1	ZINC000875428273	GD	On-Demand	Anodyne	ADRA1D	41	38
COc1ccccc1[C@H]1CN(C(=O)NCCN2CCC(N(C)C)CC2)CCO1	ZINC000875428273	GD	On-Demand	Anodyne	DRD3	47	38
COc1ccccc1[C@H]1CN(C(=O)NCCN2CCC(N(C)C)CC2)CCO1	ZINC000875428273	GD	On-Demand	Anodyne	HTR4	46	36
COc1ccccc1[C@H]1CN(C(=O)NCCN2CCC(N(C)C)CC2)CCO1	ZINC000875428273	GD	On-Demand	Anodyne	CCR5	18	41
COCC(C)(C)CCNC(=O)NCCN1CCC(N(C)C)CC1	ZINC000875428284	ED	On-Demand	Anodyne	CACNA1H	22	42
CC(=O)Nc1ccc2c(c1)CN(C(=O)NCCN1CCC(N(C)C)CC1)CC2	ZINC000875428488	GD	On-Demand	Anodyne	MCHR1	28	42
C[C@H](NC(=O)NCCN1CCC(N(C)C)CC1)c1ccccc1O	ZINC000875428496	ED	On-Demand	Clean	CCR5	37	40
C[C@H](NC(=O)NCCN1CCC(N(C)C)CC1)c1ccccc1O	ZINC000875428496	ED	On-Demand	Clean	PLD1	44	34
C[C@H](NC(=O)NCCN1CCC(N(C)C)CC1)c1ccccc1O	ZINC000875428496	ED	On-Demand	Clean	PLD2	43	34
C[C@@H](NC(=O)NCCN1CCC(N(C)C)CC1)c1ccccc1O	ZINC000875428497	ED	On-Demand	Clean	CCR5	37	40
C[C@@H](NC(=O)NCCN1CCC(N(C)C)CC1)c1ccccc1O	ZINC000875428497	ED	On-Demand	Clean	PLD1	44	34
C[C@@H](NC(=O)NCCN1CCC(N(C)C)CC1)c1ccccc1O	ZINC000875428497	ED	On-Demand	Clean	PLD2	43	34
CCCCCCCNC(=O)C(=O)N[C@@H]1CCO[C@H]1c1cnn(C)c1	ZINC000875428544	ED	On-Demand	Mild	ASAH1	87	37
CC(=O)N(C)c1ccc(CNC(=O)NCCN2CCC(N(C)C)CC2)cc1	ZINC000875428552	GD	On-Demand	Anodyne	CCR3	16	44
CC(=O)N(C)c1ccc(CNC(=O)NCCN2CCC(N(C)C)CC2)cc1	ZINC000875428552	GD	On-Demand	Anodyne	CYP2J2	44	32
CC[C@@H](NC(=O)NCCN1CCC(N(C)C)CC1)c1cccc(OC)c1OC	ZINC000875428556	GE	On-Demand	Anodyne	HTR1A	31	40
CC[C@@H](NC(=O)NCCN1CCC(N(C)C)CC1)c1cccc(OC)c1OC	ZINC000875428556	GE	On-Demand	Anodyne	DRD4	42	32
CC[C@@H](NC(=O)NCCN1CCC(N(C)C)CC1)c1cccc(OC)c1OC	ZINC000875428556	GE	On-Demand	Anodyne	DRD3	40	38
CC[C@@H](NC(=O)NCCN1CCC(N(C)C)CC1)c1cccc(OC)c1OC	ZINC000875428556	GE	On-Demand	Anodyne	HTR4	51	35
CCC1(CC)CCCN1C(=O)N[C@H]1CCN(C(C)=O)c2ccccc21	ZINC000875428685	EH	On-Demand	Anodyne	SLC12A5	45	33
CCC1(CC)CCCN1C(=O)N[C@@H]1CCN(C(C)=O)c2ccccc21	ZINC000875428686	EH	On-Demand	Anodyne	SLC12A5	45	33
C#CC[C@H](NC(=O)N1CCCC[C@@H]1CNC(C)=O)c1ccccc1	ZINC000875428791	EE	On-Demand	Mild	HCRTR1	17	40
C#CC[C@@H](NC(=O)N1CCCC[C@@H]1CNC(C)=O)c1ccccc1	ZINC000875428792	EE	On-Demand	Mild	HCRTR1	17	40
C#CC[C@H](NC(=O)N1CCCC[C@H]1CNC(C)=O)c1ccccc1	ZINC000875428793	EE	On-Demand	Mild	HCRTR1	17	40
C#CC[C@@H](NC(=O)N1CCCC[C@H]1CNC(C)=O)c1ccccc1	ZINC000875428794	EE	On-Demand	Mild	HCRTR1	17	40
CC[C@@H](NC(=O)NC[C@H](O)Cc1cccc(Cl)c1)c1c(C)noc1C	ZINC000875428827	FG	On-Demand	Anodyne	PDS	63	38
CC[C@@H](NC(=O)NC[C@@H](O)Cc1cccc(Cl)c1)c1c(C)noc1C	ZINC000875428828	FG	On-Demand	Anodyne	PDS	63	38
Cn1cc(-c2ccccc2CNC(=O)N2CCC(C(=O)NCCO)CC2)cn1	ZINC000875428931	GD	On-Demand	Anodyne	EPHX2	21	46
COC(=O)C1(O)CN(C(=O)NCCCc2cc(OC)ccc2OC)C1	ZINC000875428932	FC	On-Demand	Anodyne	MTNR1A	68	51
COC(=O)C1(O)CN(C(=O)NCCCc2cc(OC)ccc2OC)C1	ZINC000875428932	FC	On-Demand	Anodyne	MTNR1B	58	61
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCN(C(C)=O)c3ccccc32)C1	ZINC000875428954	FE	On-Demand	Anodyne	ACE	21	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCN(C(C)=O)c3ccccc32)C1	ZINC000875428955	FE	On-Demand	Anodyne	ACE	21	43
C#CC[C@@H](NC(=O)N1CCc2nc(C3CC3)ncc2C1)c1ccccc1	ZINC000875429044	EG	On-Demand	Mild	MAPK1	51	37
C#CC[C@H](NC(=O)N1CCc2nc(C3CC3)ncc2C1)c1ccccc1	ZINC000875429046	EG	On-Demand	Mild	MAPK1	51	37
C[C@@H](NC(=O)NCCN1CCC(N(C)C)CC1)c1ccc(C(F)(F)F)nc1	ZINC000875429047	GE	On-Demand	Anodyne	TRPV1	59	34
C[C@H](NC(=O)NCCN1CCC(N(C)C)CC1)c1ccc(C(F)(F)F)nc1	ZINC000875429049	GE	On-Demand	Anodyne	TRPV1	59	34
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cnn(C)c1C	ZINC000875429063	DC	On-Demand	Anodyne	SLC6A3	48	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cnn(C)c1C	ZINC000875429065	DC	On-Demand	Anodyne	SLC6A3	48	37
COc1ccc([C@@H]2CN(C(=O)NCCN3CCC(N(C)C)CC3)CCO2)cc1	ZINC000875429095	GD	On-Demand	Anodyne	DRD4	43	32
COc1ccc([C@@H]2CN(C(=O)NCCN3CCC(N(C)C)CC3)CCO2)cc1	ZINC000875429095	GD	On-Demand	Anodyne	MCHR1	21	42
CN(Cc1ccc2cc[nH]c2c1)C(=O)NCCN1CCC(N(C)C)CC1	ZINC000875429144	FE	On-Demand	Anodyne	PLD1	58	35
CN(Cc1ccc2cc[nH]c2c1)C(=O)NCCN1CCC(N(C)C)CC1	ZINC000875429144	FE	On-Demand	Anodyne	PLD2	64	35
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCc1cc(OC)ccc1OC	ZINC000875429192	GE	On-Demand	Anodyne	FKBP1A	17	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCc1cc(OC)ccc1OC	ZINC000875429192	GE	On-Demand	Anodyne	MTNR1A	47	48
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCc1cc(OC)ccc1OC	ZINC000875429192	GE	On-Demand	Anodyne	MTNR1B	39	54
COc1cccc([C@H](O)C2CCN(C(=O)NCCC[C@@H](C)CO)CC2)c1	ZINC000875429255	FF	On-Demand	Anodyne	DRD4	42	33
COc1cccc([C@H](O)C2CCN(C(=O)NCCC[C@H](C)CO)CC2)c1	ZINC000875429256	FF	On-Demand	Anodyne	DRD4	42	33
COc1ncnc(N(C)C)c1NC(=O)[C@@H](F)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000875429276	GE	On-Demand	Anodyne	GPR119	52	39
COc1ncnc(N(C)C)c1NC(=O)[C@H](F)[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000875429277	GE	On-Demand	Anodyne	GPR119	52	39
COc1ncnc(N(C)C)c1NC(=O)[C@@H](F)[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000875429278	GE	On-Demand	Anodyne	GPR119	52	39
COc1ncnc(N(C)C)c1NC(=O)[C@H](F)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000875429279	GE	On-Demand	Anodyne	GPR119	52	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1-c1cnn(C)c1	ZINC000875429300	FE	On-Demand	Anodyne	SLC6A3	46	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1-c1cnn(C)c1	ZINC000875429301	FE	On-Demand	Anodyne	SLC6A3	46	39
Cn1cc(-c2ccccc2CNC(=O)N2CCO[C@H](C(F)(F)F)CC2)cn1	ZINC000875429333	GF	On-Demand	Anodyne	EPHX2	15	40
Cn1cc(-c2ccccc2CNC(=O)N2CCO[C@@H](C(F)(F)F)CC2)cn1	ZINC000875429334	GF	On-Demand	Anodyne	EPHX2	15	40
CN(C(=O)Cc1csc(C2CCCC2)n1)c1ccc(-c2ccccc2)nn1	ZINC000875429358	GI	On-Demand	Anodyne	SLC12A5	23	41
CCOC1CC2(C1)C[C@H]2C(=O)N(C)c1ccc(-c2ccccc2)nn1	ZINC000875429366	EG	On-Demand	Anodyne	TIMP3	69	33
C[C@H](CO)CCCNC(=O)NC1CCN(c2ccccc2C#N)CC1	ZINC000875429381	EE	On-Demand	Mild	DRD2	20	41
C[C@H](CO)CCCNC(=O)NC1CCN(c2ccccc2C#N)CC1	ZINC000875429381	EE	On-Demand	Mild	DRD4	20	41
C[C@H](CO)CCCNC(=O)NC1CCN(c2ccccc2C#N)CC1	ZINC000875429381	EE	On-Demand	Mild	NPY1R	16	40
C[C@@H](CO)CCCNC(=O)NC1CCN(c2ccccc2C#N)CC1	ZINC000875429382	EE	On-Demand	Mild	DRD2	20	41
C[C@@H](CO)CCCNC(=O)NC1CCN(c2ccccc2C#N)CC1	ZINC000875429382	EE	On-Demand	Mild	DRD4	20	41
C[C@@H](CO)CCCNC(=O)NC1CCN(c2ccccc2C#N)CC1	ZINC000875429382	EE	On-Demand	Mild	NPY1R	16	40
C[C@H](CO)CCCNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875429411	ED	On-Demand	Anodyne	NPFFR1	54	39
C[C@@H](CO)CCCNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875429412	ED	On-Demand	Anodyne	NPFFR1	54	39
COc1ncnc(N(C)C)c1NC(=O)Cc1ccc(Cl)cn1	ZINC000875429422	DD	On-Demand	Anodyne	F10	48	34
COc1ccc(N2CCN(C(=O)NCCC[C@H](C)CO)CC2)c(OC)c1	ZINC000875429423	FD	On-Demand	Clean	HTR1A	42	43
COc1ccc(N2CCN(C(=O)NCCC[C@H](C)CO)CC2)c(OC)c1	ZINC000875429423	FD	On-Demand	Clean	DRD2	37	46
COc1ccc(N2CCN(C(=O)NCCC[C@H](C)CO)CC2)c(OC)c1	ZINC000875429423	FD	On-Demand	Clean	DRD4	43	34
COc1ccc(N2CCN(C(=O)NCCC[C@H](C)CO)CC2)c(OC)c1	ZINC000875429423	FD	On-Demand	Clean	ADRA1D	30	41
COc1ccc(N2CCN(C(=O)NCCC[C@H](C)CO)CC2)c(OC)c1	ZINC000875429423	FD	On-Demand	Clean	HTR1B	16	43
COc1ccc(N2CCN(C(=O)NCCC[C@H](C)CO)CC2)c(OC)c1	ZINC000875429423	FD	On-Demand	Clean	ADRA1A	29	41
COc1ccc(N2CCN(C(=O)NCCC[C@H](C)CO)CC2)c(OC)c1	ZINC000875429423	FD	On-Demand	Clean	DRD3	59	43
COc1ccc(N2CCN(C(=O)NCCC[C@@H](C)CO)CC2)c(OC)c1	ZINC000875429424	FD	On-Demand	Clean	HTR1A	42	43
COc1ccc(N2CCN(C(=O)NCCC[C@@H](C)CO)CC2)c(OC)c1	ZINC000875429424	FD	On-Demand	Clean	DRD2	37	46
COc1ccc(N2CCN(C(=O)NCCC[C@@H](C)CO)CC2)c(OC)c1	ZINC000875429424	FD	On-Demand	Clean	DRD4	43	34
COc1ccc(N2CCN(C(=O)NCCC[C@@H](C)CO)CC2)c(OC)c1	ZINC000875429424	FD	On-Demand	Clean	ADRA1D	30	41
COc1ccc(N2CCN(C(=O)NCCC[C@@H](C)CO)CC2)c(OC)c1	ZINC000875429424	FD	On-Demand	Clean	HTR1B	16	43
COc1ccc(N2CCN(C(=O)NCCC[C@@H](C)CO)CC2)c(OC)c1	ZINC000875429424	FD	On-Demand	Clean	ADRA1A	29	41
COc1ccc(N2CCN(C(=O)NCCC[C@@H](C)CO)CC2)c(OC)c1	ZINC000875429424	FD	On-Demand	Clean	DRD3	59	43
C[C@H](CO)CCCNC(=O)NCC1(c2ccccc2)CCN(C)CC1	ZINC000875429443	EE	On-Demand	Anodyne	KCNA3	45	36
C[C@H](CO)CCCNC(=O)NCC1(c2ccccc2)CCN(C)CC1	ZINC000875429443	EE	On-Demand	Anodyne	SOAT1	18	46
C[C@@H](CO)CCCNC(=O)NCC1(c2ccccc2)CCN(C)CC1	ZINC000875429444	EE	On-Demand	Anodyne	KCNA3	45	36
C[C@@H](CO)CCCNC(=O)NCC1(c2ccccc2)CCN(C)CC1	ZINC000875429444	EE	On-Demand	Anodyne	SOAT1	18	46
Cn1cc(-c2ccccc2CNC(=O)N2CCC[C@H](OC3CCC3)CC2)cn1	ZINC000875429472	GH	On-Demand	Anodyne	EPHX2	21	43
Cn1cc(-c2ccccc2CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)cn1	ZINC000875429473	GH	On-Demand	Anodyne	EPHX2	21	43
CN(C(=O)Cc1csc(C2CC2)n1)c1ccc(-c2ccccc2)nn1	ZINC000875429486	FH	On-Demand	Anodyne	SLC12A5	23	42
CC[C@H](C[C@H](C)O)NC(=O)NCCCc1cc(OC)ccc1OC	ZINC000875429543	EE	On-Demand	Anodyne	MTNR1A	63	55
CC[C@H](C[C@H](C)O)NC(=O)NCCCc1cc(OC)ccc1OC	ZINC000875429543	EE	On-Demand	Anodyne	MTNR1B	51	60
COC(=O)N(C)NC(=O)NCCCc1cc(OC)ccc1OC	ZINC000875429550	ED	On-Demand	Reactive	NQO2	27	40
COC(=O)N(C)NC(=O)NCCCc1cc(OC)ccc1OC	ZINC000875429550	ED	On-Demand	Reactive	MTNR1A	110	58
COC(=O)N(C)NC(=O)NCCCc1cc(OC)ccc1OC	ZINC000875429550	ED	On-Demand	Reactive	MTNR1B	88	66
COC(=O)N(C)NC(=O)NCCCc1cc(OC)ccc1OC	ZINC000875429550	ED	On-Demand	Reactive	MT-ND1	18	42
CCOC(=O)[C@@H]1CC[C@H](C(=O)N(C)c2ccc(-c3ccccc3)nn2)C1	ZINC000875429599	FG	On-Demand	Anodyne	FASN	35	44
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCc3cc(OC)ccc3OC)C[C@@H]1C2	ZINC000875429606	GE	On-Demand	Anodyne	MTNR1A	43	48
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCc3cc(OC)ccc3OC)C[C@@H]1C2	ZINC000875429606	GE	On-Demand	Anodyne	MTNR1B	34	54
CN(C(=O)c1nc(C(C)(C)C)cs1)c1ccc(-c2ccccc2)nn1	ZINC000875429659	FI	On-Demand	Anodyne	SLC12A5	20	40
C[C@@H](CO)CCCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875429665	FF	On-Demand	Anodyne	DRD2	23	46
C[C@@H](CO)CCCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875429665	FF	On-Demand	Anodyne	DRD4	49	45
C[C@@H](CO)CCCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875429665	FF	On-Demand	Anodyne	ACHE	65	61
C[C@@H](CO)CCCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875429665	FF	On-Demand	Anodyne	HRH2	26	41
C[C@@H](CO)CCCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875429665	FF	On-Demand	Anodyne	DRD3	19	45
C[C@@H](CO)CCCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875429665	FF	On-Demand	Anodyne	SLC6A3	26	50
C[C@@H](CO)CCCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875429665	FF	On-Demand	Anodyne	HTR4	31	44
C[C@@H](CO)CCCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875429665	FF	On-Demand	Anodyne	SIGMAR1	60	44
C[C@@H](CO)CCCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875429665	FF	On-Demand	Anodyne	BCHE	19	50
C[C@@H](CO)CCCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875429665	FF	On-Demand	Anodyne	CCR3	61	46
C[C@@H](CO)CCCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875429665	FF	On-Demand	Anodyne	NPFFR2	40	35
C[C@@H](CO)CCCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875429665	FF	On-Demand	Anodyne	MCHR1	30	43
C[C@@H](CO)CCCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875429665	FF	On-Demand	Anodyne	CACNA1G	34	41
C[C@@H](CO)CCCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875429665	FF	On-Demand	Anodyne	CACNA1I	46	36
C[C@@H](CO)CCCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875429665	FF	On-Demand	Anodyne	NPFFR1	51	42
C[C@H](CO)CCCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875429666	FF	On-Demand	Anodyne	DRD2	23	46
C[C@H](CO)CCCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875429666	FF	On-Demand	Anodyne	DRD4	49	45
C[C@H](CO)CCCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875429666	FF	On-Demand	Anodyne	ACHE	65	61
C[C@H](CO)CCCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875429666	FF	On-Demand	Anodyne	HRH2	26	41
C[C@H](CO)CCCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875429666	FF	On-Demand	Anodyne	DRD3	19	45
C[C@H](CO)CCCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875429666	FF	On-Demand	Anodyne	SLC6A3	26	50
C[C@H](CO)CCCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875429666	FF	On-Demand	Anodyne	HTR4	31	44
C[C@H](CO)CCCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875429666	FF	On-Demand	Anodyne	SIGMAR1	60	44
C[C@H](CO)CCCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875429666	FF	On-Demand	Anodyne	BCHE	19	50
C[C@H](CO)CCCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875429666	FF	On-Demand	Anodyne	CCR3	61	46
C[C@H](CO)CCCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875429666	FF	On-Demand	Anodyne	NPFFR2	40	35
C[C@H](CO)CCCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875429666	FF	On-Demand	Anodyne	MCHR1	30	43
C[C@H](CO)CCCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875429666	FF	On-Demand	Anodyne	CACNA1G	34	41
C[C@H](CO)CCCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875429666	FF	On-Demand	Anodyne	CACNA1I	46	36
C[C@H](CO)CCCNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875429666	FF	On-Demand	Anodyne	NPFFR1	51	42
C[C@H](CO)CCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875429679	DE	On-Demand	Anodyne	ACE	41	40
C[C@H](CO)CCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875429679	DE	On-Demand	Anodyne	TRY1_BOVIN	50	37
C[C@H](CO)CCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875429679	DE	On-Demand	Anodyne	C3AR1	45	33
C[C@H](CO)CCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875429680	DE	On-Demand	Anodyne	ACE	41	40
C[C@H](CO)CCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875429680	DE	On-Demand	Anodyne	TRY1_BOVIN	50	37
C[C@H](CO)CCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875429680	DE	On-Demand	Anodyne	C3AR1	45	33
C[C@H](CO)CCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875429681	DE	On-Demand	Anodyne	ACE	41	40
C[C@H](CO)CCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875429681	DE	On-Demand	Anodyne	TRY1_BOVIN	50	37
C[C@H](CO)CCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875429681	DE	On-Demand	Anodyne	C3AR1	45	33
C[C@H](CO)CCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875429682	DE	On-Demand	Anodyne	ACE	41	40
C[C@H](CO)CCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875429682	DE	On-Demand	Anodyne	TRY1_BOVIN	50	37
C[C@H](CO)CCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875429682	DE	On-Demand	Anodyne	C3AR1	45	33
CN(C(=O)[C@@H]1OCC[C@@H]1NC(=O)OC(C)(C)C)c1ccc(-c2ccccc2)nn1	ZINC000875429710	GF	On-Demand	Anodyne	REN	40	35
C[C@H](CO)CCCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875429745	EF	On-Demand	Anodyne	FKBP1A	31	41
C[C@H](CO)CCCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875429746	EF	On-Demand	Anodyne	FKBP1A	31	41
C[C@H](CO)CCCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875429747	EF	On-Demand	Anodyne	FKBP1A	31	41
C[C@H](CO)CCCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875429748	EF	On-Demand	Anodyne	FKBP1A	31	41
C[C@@H](CC(=O)N(C)c1ccc(-c2ccccc2)nn1)NC(=O)OC(C)(C)C	ZINC000875429761	FG	On-Demand	Anodyne	CTSK	17	41
C[C@@H](CC(=O)N(C)c1ccc(-c2ccccc2)nn1)NC(=O)OC(C)(C)C	ZINC000875429761	FG	On-Demand	Anodyne	REN	47	36
C[C@@H](CC(=O)N(C)c1ccc(-c2ccccc2)nn1)NC(=O)OC(C)(C)C	ZINC000875429761	FG	On-Demand	Anodyne	FPR1	48	38
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCc2cc(OC)ccc2OC)C1	ZINC000875429790	GE	On-Demand	Anodyne	MTNR1A	61	51
CCOC(=O)[C@H](C)C1CN(C(=O)NCCCc2cc(OC)ccc2OC)C1	ZINC000875429790	GE	On-Demand	Anodyne	MTNR1B	53	54
Cn1cc(-c2ccccc2CNC(=O)N2CC[C@H](C(C)(C)O)C2)cn1	ZINC000875429795	EE	On-Demand	Anodyne	EPHX2	15	42
Cn1cc(-c2ccccc2CNC(=O)N2CC[C@@H](C(C)(C)O)C2)cn1	ZINC000875429796	EE	On-Demand	Anodyne	EPHX2	15	42
COCCN(CC1CCN(C)CC1)C(=O)NCCc1cccc([N+](=O)[O-])c1	ZINC000875429849	GE	On-Demand	Bother	CACNA1C	51	37
COCCN(CC1CCN(C)CC1)C(=O)NCCc1cccc([N+](=O)[O-])c1	ZINC000875429849	GE	On-Demand	Bother	CACNA1D	76	37
O=C(NCCc1cccc([N+](=O)[O-])c1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875429938	GG	On-Demand	Bother	CACNA1C	45	37
O=C(NCCc1cccc([N+](=O)[O-])c1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875429938	GG	On-Demand	Bother	CACNA1D	67	37
O=C(NCCc1cccc([N+](=O)[O-])c1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875429938	GG	On-Demand	Bother	LUXR	16	43
CN1CC[C@H](NC(=O)N2CCC(C(=O)NCCO)CC2)[C@@H]1c1ccccc1	ZINC000875429944	FC	On-Demand	Anodyne	EPHX2	37	41
CN1CC[C@H](NC(=O)N2CCC(C(=O)NCCO)CC2)[C@H]1c1ccccc1	ZINC000875429946	FC	On-Demand	Anodyne	EPHX2	37	41
CC[C@@H](NC(=O)NCCN1CCC(N(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000875430018	FD	On-Demand	Anodyne	OPRD1	16	41
CC[C@@H](NC(=O)NCCN1CCC(N(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000875430018	FD	On-Demand	Anodyne	CCR5	63	45
CC[C@@H](NC(=O)NCCN1CCC(N(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000875430018	FD	On-Demand	Anodyne	PLD1	45	34
CC[C@@H](NC(=O)NCCN1CCC(N(C)C)CC1)[C@@H](O)c1ccccc1	ZINC000875430018	FD	On-Demand	Anodyne	PLD2	43	34
CC[C@@H](NC(=O)NCCN1CCC(N(C)C)CC1)[C@H](O)c1ccccc1	ZINC000875430021	FD	On-Demand	Anodyne	OPRD1	16	41
CC[C@@H](NC(=O)NCCN1CCC(N(C)C)CC1)[C@H](O)c1ccccc1	ZINC000875430021	FD	On-Demand	Anodyne	CCR5	63	45
CC[C@@H](NC(=O)NCCN1CCC(N(C)C)CC1)[C@H](O)c1ccccc1	ZINC000875430021	FD	On-Demand	Anodyne	PLD1	45	34
CC[C@@H](NC(=O)NCCN1CCC(N(C)C)CC1)[C@H](O)c1ccccc1	ZINC000875430021	FD	On-Demand	Anodyne	PLD2	43	34
CCO[C@H](C(=O)N(C)c1ccc(-c2ccccc2)nn1)C1CCCC1	ZINC000875430025	EH	On-Demand	Anodyne	AMY2	46	31
CCO[C@@H](C(=O)N(C)c1ccc(-c2ccccc2)nn1)C1CCCC1	ZINC000875430026	EH	On-Demand	Anodyne	AMY2	46	31
C[C@@H](O)C1CCN(C(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)CC1	ZINC000875430069	EE	On-Demand	Anodyne	EPHX2	25	44
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)CC1	ZINC000875430070	EE	On-Demand	Anodyne	EPHX2	25	44
C[C@@H](CO)CCCNC(=O)NCc1cccc2ncccc12	ZINC000875430090	DE	On-Demand	Anodyne	MTNR1A	20	41
C[C@@H](CO)CCCNC(=O)NCc1cccc2ncccc12	ZINC000875430090	DE	On-Demand	Anodyne	MTNR1B	20	41
C[C@H](CO)CCCNC(=O)NCc1cccc2ncccc12	ZINC000875430091	DE	On-Demand	Anodyne	MTNR1A	20	41
C[C@H](CO)CCCNC(=O)NCc1cccc2ncccc12	ZINC000875430091	DE	On-Demand	Anodyne	MTNR1B	20	41
C[C@H](NC(=O)NCCC[C@@H](C)CO)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875430157	FF	On-Demand	Anodyne	GPR119	23	41
C[C@H](CO)CCCNC(=O)N[C@@H](C)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875430158	FF	On-Demand	Anodyne	GPR119	23	41
C[C@@H](CO)CCCNC(=O)N[C@H](C)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875430159	FF	On-Demand	Anodyne	GPR119	23	41
C[C@H](CO)CCCNC(=O)N[C@H](C)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875430160	FF	On-Demand	Anodyne	GPR119	23	41
CN1CC[C@H](NC(=O)N2CCC[C@H](C(C)(C)O)C2)[C@@H]1c1ccccc1	ZINC000875430161	EF	On-Demand	Anodyne	EPHX2	21	42
CN1CC[C@H](NC(=O)N2CCC[C@@H](C(C)(C)O)C2)[C@H]1c1ccccc1	ZINC000875430162	EF	On-Demand	Anodyne	EPHX2	21	42
CN1CC[C@H](NC(=O)N2CCC[C@H](C(C)(C)O)C2)[C@H]1c1ccccc1	ZINC000875430163	EF	On-Demand	Anodyne	EPHX2	21	42
CN1CC[C@H](NC(=O)N2CCC[C@@H](C(C)(C)O)C2)[C@@H]1c1ccccc1	ZINC000875430164	EF	On-Demand	Anodyne	EPHX2	21	42
CN1CC[C@H](NC(=O)N2CCC[C@H](OC3CCC3)CC2)[C@@H]1c1ccccc1	ZINC000875430165	FH	On-Demand	Anodyne	EPHX2	33	52
CN1CC[C@H](NC(=O)N2CCC[C@@H](OC3CCC3)CC2)[C@@H]1c1ccccc1	ZINC000875430166	FH	On-Demand	Anodyne	EPHX2	33	52
CN1CC[C@H](NC(=O)N2CCC[C@H](OC3CCC3)CC2)[C@H]1c1ccccc1	ZINC000875430167	FH	On-Demand	Anodyne	EPHX2	33	52
CN1CC[C@H](NC(=O)N2CCC[C@@H](OC3CCC3)CC2)[C@H]1c1ccccc1	ZINC000875430168	FH	On-Demand	Anodyne	EPHX2	33	52
CN1CC[C@H](NC(=O)N2CCCCCCNC(=O)CC2)[C@H]1c1ccccc1	ZINC000875430173	FF	On-Demand	Anodyne	EPHX2	20	45
CN1CC[C@H](NC(=O)N2CCCCCCNC(=O)CC2)[C@@H]1c1ccccc1	ZINC000875430174	FF	On-Demand	Anodyne	EPHX2	20	45
COCCN(CC1CCN(C)CC1)C(=O)NC[C@H](C)Cc1ccc(OC)cc1	ZINC000875430182	GF	On-Demand	Anodyne	MMP1	16	41
COCCN(CC1CCN(C)CC1)C(=O)NC[C@H](C)Cc1ccc(OC)cc1	ZINC000875430182	GF	On-Demand	Anodyne	PSMB8	46	33
COCCN(CC1CCN(C)CC1)C(=O)NC[C@@H](C)Cc1ccc(OC)cc1	ZINC000875430183	GF	On-Demand	Anodyne	MMP1	16	41
COCCN(CC1CCN(C)CC1)C(=O)NC[C@@H](C)Cc1ccc(OC)cc1	ZINC000875430183	GF	On-Demand	Anodyne	PSMB8	46	33
C[C@@H](CO)CCCNC(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875430184	EF	On-Demand	Anodyne	C3AR1	46	37
C[C@H](CO)CCCNC(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875430185	EF	On-Demand	Anodyne	C3AR1	46	37
C[C@@H](CO)CCCNC(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875430186	EF	On-Demand	Anodyne	C3AR1	46	37
C[C@H](CO)CCCNC(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875430187	EF	On-Demand	Anodyne	C3AR1	46	37
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H](C)Cc2ccc(OC)cc2)C1	ZINC000875430207	FF	On-Demand	Anodyne	PSMB8	44	31
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H](C)Cc2ccc(OC)cc2)C1	ZINC000875430208	FF	On-Demand	Anodyne	PSMB8	44	31
C[C@@H](CO)CCCNC(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875430218	DF	On-Demand	Anodyne	OXTR	48	36
C[C@@H](CO)CCCNC(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875430218	DF	On-Demand	Anodyne	GHRHR	48	42
C[C@@H](CO)CCCNC(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875430219	DF	On-Demand	Anodyne	OXTR	48	36
C[C@@H](CO)CCCNC(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875430219	DF	On-Demand	Anodyne	GHRHR	48	42
C[C@H](CO)CCCNC(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875430220	DF	On-Demand	Anodyne	OXTR	48	36
C[C@H](CO)CCCNC(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875430220	DF	On-Demand	Anodyne	GHRHR	48	42
C[C@H](CO)CCCNC(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875430221	DF	On-Demand	Anodyne	OXTR	48	36
C[C@H](CO)CCCNC(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875430221	DF	On-Demand	Anodyne	GHRHR	48	42
N#Cc1ccc(N2CCN(C(=O)N[C@H](c3cccnc3)C3CC3)CC2)cn1	ZINC000875430227	FE	On-Demand	Mild	PTAFR	18	46
N#Cc1ccc(N2CCN(C(=O)N[C@@H](c3cccnc3)C3CC3)CC2)cn1	ZINC000875430228	FE	On-Demand	Mild	PTAFR	18	46
COC(=O)C1(O)CN(C(=O)NCc2cncc(C)c2)C1	ZINC000875430265	CB	On-Demand	Anodyne	NAMPT	15	42
C[C@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430286	GE	On-Demand	Anodyne	ACE	22	45
C[C@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430286	GE	On-Demand	Anodyne	KLK3	84	35
C[C@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430286	GE	On-Demand	Anodyne	CTSB	53	51
C[C@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430286	GE	On-Demand	Anodyne	PAPA1_CARPA	43	32
C[C@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430286	GE	On-Demand	Anodyne	CTSK	37	51
C[C@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430286	GE	On-Demand	Anodyne	CTSL	41	51
C[C@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430286	GE	On-Demand	Anodyne	C3AR1	59	35
C[C@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430286	GE	On-Demand	Anodyne	CAPNS1	58	35
C[C@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430286	GE	On-Demand	Anodyne	CTSS	19	41
C[C@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430286	GE	On-Demand	Anodyne	CAPN1	67	40
C[C@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430286	GE	On-Demand	Anodyne	CAPN2	117	40
C[C@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430286	GE	On-Demand	Anodyne	TGM2	40	43
C[C@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430286	GE	On-Demand	Anodyne	TPSAB1	21	40
C[C@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430286	GE	On-Demand	Anodyne	NPR	62	36
C[C@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430286	GE	On-Demand	Anodyne	F13A1	20	42
C[C@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430286	GE	On-Demand	Anodyne	NAAA	51	36
C[C@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430286	GE	On-Demand	Anodyne	BIRC2	28	45
C[C@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430286	GE	On-Demand	Anodyne	Q6PRC7_IXORI	49	35
C[C@@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430288	GE	On-Demand	Anodyne	ACE	22	45
C[C@@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430288	GE	On-Demand	Anodyne	KLK3	84	35
C[C@@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430288	GE	On-Demand	Anodyne	CTSB	53	51
C[C@@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430288	GE	On-Demand	Anodyne	PAPA1_CARPA	43	32
C[C@@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430288	GE	On-Demand	Anodyne	CTSK	37	51
C[C@@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430288	GE	On-Demand	Anodyne	CTSL	41	51
C[C@@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430288	GE	On-Demand	Anodyne	C3AR1	59	35
C[C@@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430288	GE	On-Demand	Anodyne	CAPNS1	58	35
C[C@@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430288	GE	On-Demand	Anodyne	CTSS	19	41
C[C@@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430288	GE	On-Demand	Anodyne	CAPN1	67	40
C[C@@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430288	GE	On-Demand	Anodyne	CAPN2	117	40
C[C@@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430288	GE	On-Demand	Anodyne	TGM2	40	43
C[C@@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430288	GE	On-Demand	Anodyne	TPSAB1	21	40
C[C@@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430288	GE	On-Demand	Anodyne	NPR	62	36
C[C@@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430288	GE	On-Demand	Anodyne	F13A1	20	42
C[C@@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430288	GE	On-Demand	Anodyne	NAAA	51	36
C[C@@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430288	GE	On-Demand	Anodyne	BIRC2	28	45
C[C@@H](CO)CCCNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875430288	GE	On-Demand	Anodyne	Q6PRC7_IXORI	49	35
O=C(N[C@H](c1cccnc1)C1CC1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875430298	DF	On-Demand	Anodyne	PTAFR	15	42
O=C(N[C@H](c1cccnc1)C1CC1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875430299	DF	On-Demand	Anodyne	PTAFR	15	42
O=C(N[C@H](c1cccnc1)C1CC1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875430300	DF	On-Demand	Anodyne	PTAFR	15	42
O=C(N[C@H](c1cccnc1)C1CC1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875430301	DF	On-Demand	Anodyne	PTAFR	15	42
O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875430331	DE	On-Demand	Bother	CACNA1D	57	33
O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875430331	DE	On-Demand	Bother	LUXR	16	42
O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875430332	DE	On-Demand	Bother	CACNA1D	57	33
O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875430332	DE	On-Demand	Bother	LUXR	16	42
O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875430334	DE	On-Demand	Bother	CACNA1D	57	33
O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875430334	DE	On-Demand	Bother	LUXR	16	42
O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875430336	DE	On-Demand	Bother	CACNA1D	57	33
O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875430336	DE	On-Demand	Bother	LUXR	16	42
C[C@@H](CO)CCCNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875430352	EE	On-Demand	Anodyne	KLK3	77	33
C[C@@H](CO)CCCNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875430352	EE	On-Demand	Anodyne	PAPA1_CARPA	43	36
C[C@@H](CO)CCCNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875430352	EE	On-Demand	Anodyne	CAPNS1	52	32
C[C@@H](CO)CCCNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875430352	EE	On-Demand	Anodyne	CAPN1	50	37
C[C@@H](CO)CCCNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875430352	EE	On-Demand	Anodyne	CAPN2	84	37
C[C@@H](CO)CCCNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875430352	EE	On-Demand	Anodyne	EPHX2	15	43
C[C@@H](CO)CCCNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875430352	EE	On-Demand	Anodyne	NPR	61	35
C[C@@H](CO)CCCNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875430352	EE	On-Demand	Anodyne	NPFFR1	49	34
C[C@H](CO)CCCNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875430354	EE	On-Demand	Anodyne	KLK3	77	33
C[C@H](CO)CCCNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875430354	EE	On-Demand	Anodyne	PAPA1_CARPA	43	36
C[C@H](CO)CCCNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875430354	EE	On-Demand	Anodyne	CAPNS1	52	32
C[C@H](CO)CCCNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875430354	EE	On-Demand	Anodyne	CAPN1	50	37
C[C@H](CO)CCCNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875430354	EE	On-Demand	Anodyne	CAPN2	84	37
C[C@H](CO)CCCNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875430354	EE	On-Demand	Anodyne	EPHX2	15	43
C[C@H](CO)CCCNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875430354	EE	On-Demand	Anodyne	NPR	61	35
C[C@H](CO)CCCNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875430354	EE	On-Demand	Anodyne	NPFFR1	49	34
CN1CCC(CNC(=O)N[C@H](c2cccnc2)C2CC2)(c2ccccc2)CC1	ZINC000875430365	GG	On-Demand	Anodyne	KCNA3	45	35
C[C@@H](CO)CCCNC(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875430367	EE	On-Demand	Anodyne	ADRA1B	15	40
C[C@@H](CO)CCCNC(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875430367	EE	On-Demand	Anodyne	NPY2R	57	39
CN1CCC(CNC(=O)N[C@@H](c2cccnc2)C2CC2)(c2ccccc2)CC1	ZINC000875430368	GG	On-Demand	Anodyne	KCNA3	45	35
C[C@H](CO)CCCNC(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875430369	EE	On-Demand	Anodyne	ADRA1B	15	40
C[C@H](CO)CCCNC(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875430369	EE	On-Demand	Anodyne	NPY2R	57	39
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCCC[C@H](C)CO)CC2	ZINC000875430374	FF	On-Demand	Anodyne	SLC18A2	56	41
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCCC[C@@H](C)CO)CC2	ZINC000875430376	FF	On-Demand	Anodyne	SLC18A2	56	41
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCCC[C@H](C)CO)CC2	ZINC000875430378	FF	On-Demand	Anodyne	SLC18A2	56	41
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCCC[C@@H](C)CO)CC2	ZINC000875430379	FF	On-Demand	Anodyne	SLC18A2	56	41
CN1CC[C@H](NC(=O)N2CCCN(C=O)CC2)[C@H]1c1ccccc1	ZINC000875430380	ED	On-Demand	Anodyne	EPHX2	22	45
CN1CC[C@H](NC(=O)N2CCCN(C=O)CC2)[C@@H]1c1ccccc1	ZINC000875430382	ED	On-Demand	Anodyne	EPHX2	22	45
CN1CCN(C(=O)NCCc2cccc([N+](=O)[O-])c2)CCC1(C)C	ZINC000875430413	EE	On-Demand	Bother	CACNA1C	46	37
CN1CCN(C(=O)NCCc2cccc([N+](=O)[O-])c2)CCC1(C)C	ZINC000875430413	EE	On-Demand	Bother	CACNA1D	69	34
CN(C)C[C@@H]1CN(C(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)C[C@H]1CN(C)C	ZINC000875430423	GD	On-Demand	Anodyne	EPHX2	23	40
CN(C)C[C@@H]1CN(C(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)C[C@H]1CN(C)C	ZINC000875430424	GD	On-Demand	Anodyne	EPHX2	23	40
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)C[C@H]1CN(C)C	ZINC000875430425	GD	On-Demand	Anodyne	EPHX2	23	40
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)C[C@H]1CN(C)C	ZINC000875430426	GD	On-Demand	Anodyne	EPHX2	23	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)c1nc(-c2ccccc2)no1	ZINC000875430433	GF	On-Demand	Anodyne	SLC6A3	37	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)c1nc(-c2ccccc2)no1	ZINC000875430434	GF	On-Demand	Anodyne	SLC6A3	37	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)c1nc(-c2ccccc2)no1	ZINC000875430435	GF	On-Demand	Anodyne	SLC6A3	37	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)c1nc(-c2ccccc2)no1	ZINC000875430436	GF	On-Demand	Anodyne	SLC6A3	37	40
O=C(N[C@H](c1cccnc1)C1CC1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875430458	FH	On-Demand	Anodyne	CPT1A	67	38
O=C(N[C@H](c1cccnc1)C1CC1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875430459	FH	On-Demand	Anodyne	CPT1A	67	38
O=C(N[C@H](c1cccnc1)C1CC1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875430460	FH	On-Demand	Anodyne	CPT1A	67	38
O=C(N[C@H](c1cccnc1)C1CC1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875430462	FH	On-Demand	Anodyne	CPT1A	67	38
CC[C@@H]1COCCN1CCNC(=O)NCCc1cccc([N+](=O)[O-])c1	ZINC000875430566	FD	On-Demand	Bother	CACNA1D	56	32
O=C(N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1)C1(F)CCOCC1	ZINC000875430607	FG	On-Demand	Anodyne	PRCP	53	43
O=C(N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1)C1(F)CCOCC1	ZINC000875430608	FG	On-Demand	Anodyne	PRCP	53	43
COC(=O)C1(O)CN(C(=O)NC[C@H](C)Cc2ccc(OC)cc2)C1	ZINC000875430611	EC	On-Demand	Anodyne	PSMB8	45	33
COC(=O)C1(O)CN(C(=O)NC[C@@H](C)Cc2ccc(OC)cc2)C1	ZINC000875430612	EC	On-Demand	Anodyne	PSMB8	45	33
C[C@@H](CO)CCCNC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875430621	EE	On-Demand	Anodyne	ROCK1	27	43
C[C@@H](CO)CCCNC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875430621	EE	On-Demand	Anodyne	ROCK2	19	43
C[C@@H](CO)CCCNC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875430621	EE	On-Demand	Anodyne	PKN1	23	40
C[C@H](CO)CCCNC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875430622	EE	On-Demand	Anodyne	ROCK1	27	43
C[C@H](CO)CCCNC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875430622	EE	On-Demand	Anodyne	ROCK2	19	43
C[C@H](CO)CCCNC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875430622	EE	On-Demand	Anodyne	PKN1	23	40
C[C@@H](CO)CCCNC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875430623	FF	On-Demand	Anodyne	SMO	39	44
C[C@@H](CO)CCCNC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875430623	FF	On-Demand	Anodyne	ETHR	55	47
C[C@H](CO)CCCNC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875430624	FF	On-Demand	Anodyne	SMO	39	44
C[C@H](CO)CCCNC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875430624	FF	On-Demand	Anodyne	ETHR	55	47
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H](C)c2nc(-c3ccccc3)no2)C1	ZINC000875430627	GF	On-Demand	Anodyne	P2RY12	58	35
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H](C)c2nc(-c3ccccc3)no2)C1	ZINC000875430628	GF	On-Demand	Anodyne	P2RY12	58	35
Cc1cncc(CNC(=O)N2Cc3cccc(O)c3C2)c1	ZINC000875430629	CE	On-Demand	Clean	NAMPT	31	42
O=C1C[C@H](CNC(=O)N2CCC[C@H](OC3CCC3)CC2)CN1Cc1ccccc1	ZINC000875430630	GG	On-Demand	Anodyne	EPHX2	19	40
O=C1C[C@@H](CNC(=O)N2CCC[C@H](OC3CCC3)CC2)CN1Cc1ccccc1	ZINC000875430631	GG	On-Demand	Anodyne	EPHX2	19	40
O=C1C[C@@H](CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)CN1Cc1ccccc1	ZINC000875430632	GG	On-Demand	Anodyne	EPHX2	19	40
O=C1C[C@H](CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)CN1Cc1ccccc1	ZINC000875430633	GG	On-Demand	Anodyne	EPHX2	19	40
CN1CCN(C(=O)N[C@H](c2cccnc2)C2CC2)CCC1(C)C	ZINC000875430649	DF	On-Demand	Anodyne	PTAFR	15	43
CN1CCN(C(=O)N[C@@H](c2cccnc2)C2CC2)CCC1(C)C	ZINC000875430650	DF	On-Demand	Anodyne	PTAFR	15	43
Cc1cncc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875430653	EF	On-Demand	Anodyne	PREP	50	43
Cc1cncc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875430654	EF	On-Demand	Anodyne	PREP	50	43
Cc1cncc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875430655	EF	On-Demand	Anodyne	PREP	50	43
Cc1cncc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875430656	EF	On-Demand	Anodyne	PREP	50	43
Cc1cncc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875430709	CD	On-Demand	Anodyne	NAMPT	22	40
Cc1cncc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875430711	CD	On-Demand	Anodyne	NAMPT	22	40
N#Cc1cc(F)ccc1N1CCN(C(=O)N[C@H](c2cccnc2)C2CC2)CC1	ZINC000875430717	GG	On-Demand	Mild	PTAFR	17	45
N#Cc1cc(F)ccc1N1CCN(C(=O)N[C@H](c2cccnc2)C2CC2)CC1	ZINC000875430717	GG	On-Demand	Mild	NPY2R	31	42
N#Cc1cc(F)ccc1N1CCN(C(=O)N[C@@H](c2cccnc2)C2CC2)CC1	ZINC000875430719	GG	On-Demand	Mild	PTAFR	17	45
N#Cc1cc(F)ccc1N1CCN(C(=O)N[C@@H](c2cccnc2)C2CC2)CC1	ZINC000875430719	GG	On-Demand	Mild	NPY2R	31	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000875430725	FE	On-Demand	Anodyne	SLC6A4	29	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000875430725	FE	On-Demand	Anodyne	SLC6A3	63	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000875430726	FE	On-Demand	Anodyne	SLC6A4	29	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1	ZINC000875430726	FE	On-Demand	Anodyne	SLC6A3	63	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000875430728	FE	On-Demand	Anodyne	SLC6A4	29	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1	ZINC000875430728	FE	On-Demand	Anodyne	SLC6A3	63	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000875430729	FE	On-Demand	Anodyne	SLC6A4	29	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1	ZINC000875430729	FE	On-Demand	Anodyne	SLC6A3	63	45
COC(=O)N(C)NC(=O)NC[C@H](C)Cc1ccc(OC)cc1	ZINC000875430755	DD	On-Demand	Reactive	PSMB8	46	32
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)N[C@@H](c1cccnc1)C1CC1	ZINC000875430756	FI	On-Demand	Anodyne	C3AR1	45	43
COC(=O)N(C)NC(=O)NC[C@@H](C)Cc1ccc(OC)cc1	ZINC000875430757	DD	On-Demand	Reactive	PSMB8	46	32
O=C(N[C@H](Cc1cccnc1)C1CCCC1)N[C@@H](c1cccnc1)C1CC1	ZINC000875430759	FI	On-Demand	Anodyne	C3AR1	45	43
O=C(N[C@H](c1cccnc1)C1CC1)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875430761	FI	On-Demand	Anodyne	C3AR1	45	43
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)N[C@H](c1cccnc1)C1CC1	ZINC000875430763	FI	On-Demand	Anodyne	C3AR1	45	43
CN1CC[C@H](NC(=O)N2CCC(CO)(CO)CC2)[C@H]1c1ccccc1	ZINC000875430816	ED	On-Demand	Anodyne	EPHX2	28	43
CN1CC[C@H](NC(=O)N2CCC(CO)(CO)CC2)[C@@H]1c1ccccc1	ZINC000875430818	ED	On-Demand	Anodyne	EPHX2	28	43
Cc1cncc(CNC(=O)N2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000875430837	DE	On-Demand	Anodyne	NAMPT	18	41
Cc1cncc(CNC(=O)N2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000875430838	DE	On-Demand	Anodyne	NAMPT	18	41
Cc1cncc(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000875430841	EE	On-Demand	Anodyne	NAMPT	23	47
Cc1cncc(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000875430842	EE	On-Demand	Anodyne	NAMPT	23	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	ACE	52	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	OPRM1	49	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	OPRD1	44	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	CELA1	24	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	MME	100	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	ANPEP	67	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	TACR1	22	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	CTSD	16	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	CMA1	61	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	CTRA_BOVIN	58	50
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	FCER2	92	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	CASP3	21	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	KLK3	82	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	CTSB	84	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	PAPA1_CARPA	88	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	CYSP_TRYCR	67	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	CCKAR	52	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	CTSK	38	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	CTSL	72	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	TIMP3	93	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	HDAC8	15	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	CAPNS1	69	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	GRIA1	46	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	HLA-DRB1	106	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	CELA2A	52	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	REN	44	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	MMP11	50	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	CTSS	33	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	CAPN1	118	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	MMP9	25	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	CTRC	43	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	CAPN2	129	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	ACE2	72	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	FPR1	67	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	CTRB_BOVIN	50	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	BLA1_STEMA	42	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	PSMB8	58	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)c(OC)cc1OC	ZINC000875430844	GG	On-Demand	Anodyne	GPR142	57	40
O=C(N[C@H](c1cccnc1)C1CC1)N1CCC(CO)(CO)CC1	ZINC000875430847	DD	On-Demand	Anodyne	PTAFR	18	45
O=C(N[C@H](c1cccnc1)C1CC1)N1CCC(CO)(CO)CC1	ZINC000875430847	DD	On-Demand	Anodyne	C3AR1	39	40
O=C(N[C@@H](c1cccnc1)C1CC1)N1CCC(CO)(CO)CC1	ZINC000875430848	DD	On-Demand	Anodyne	PTAFR	18	45
O=C(N[C@@H](c1cccnc1)C1CC1)N1CCC(CO)(CO)CC1	ZINC000875430848	DD	On-Demand	Anodyne	C3AR1	39	40
COc1ccc([C@@H]2CN(C(=O)N[C@H](c3cccnc3)C3CC3)CCO2)cc1	ZINC000875430849	FG	On-Demand	Anodyne	PTAFR	19	40
COc1ccc([C@@H]2CN(C(=O)N[C@H](c3cccnc3)C3CC3)CCO2)cc1	ZINC000875430849	FG	On-Demand	Anodyne	C3AR1	21	40
COc1ccc([C@@H]2CN(C(=O)N[C@@H](c3cccnc3)C3CC3)CCO2)cc1	ZINC000875430851	FG	On-Demand	Anodyne	PTAFR	19	40
COc1ccc([C@@H]2CN(C(=O)N[C@@H](c3cccnc3)C3CC3)CCO2)cc1	ZINC000875430851	FG	On-Demand	Anodyne	C3AR1	21	40
Cc1cncc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)c1	ZINC000875430859	EE	On-Demand	Anodyne	SIGMAR1	15	41
Cc1cncc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)c1	ZINC000875430859	EE	On-Demand	Anodyne	FAAH	18	43
Cc1cncc(CNC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)c1	ZINC000875430859	EE	On-Demand	Anodyne	NAMPT	35	48
CN(C)C[C@@H]1CN(C(=O)NCCc2cccc([N+](=O)[O-])c2)C[C@H]1CN(C)C	ZINC000875430872	GD	On-Demand	Bother	CACNA1C	47	35
CN(C)C[C@@H]1CN(C(=O)NCCc2cccc([N+](=O)[O-])c2)C[C@H]1CN(C)C	ZINC000875430872	GD	On-Demand	Bother	CACNA1D	74	35
COC(=O)N(C)NC(=O)N[C@@H](c1cccnc1)C1CC1	ZINC000875430891	CD	On-Demand	Reactive	KCNA5	21	42
COC(=O)N(C)NC(=O)N[C@H](c1cccnc1)C1CC1	ZINC000875430893	CD	On-Demand	Reactive	KCNA5	21	42
O=C(N[C@H](c1cccnc1)C1CC1)N1CCC2(CCNC2=O)CC1	ZINC000875430903	ED	On-Demand	Anodyne	CACNA1H	43	36
O=C(N[C@@H](c1cccnc1)C1CC1)N1CCC2(CCNC2=O)CC1	ZINC000875430905	ED	On-Demand	Anodyne	CACNA1H	43	36
C[C@@H](CNC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1nc(-c2ccccc2)no1	ZINC000875430950	FG	On-Demand	Anodyne	BMP1	43	41
C[C@@H](CNC(=O)N1CCC[C@H](C(C)(C)O)C1)c1nc(-c2ccccc2)no1	ZINC000875430952	FG	On-Demand	Anodyne	BMP1	43	41
CN1CC[C@H](NC(=O)N2CCO[C@@H](C(F)(F)F)CC2)[C@H]1c1ccccc1	ZINC000875430955	FF	On-Demand	Anodyne	EPHX2	24	42
O=C(N[C@@H](c1cccnc1)C1CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875430956	FG	On-Demand	Anodyne	PTAFR	15	43
CN1CC[C@H](NC(=O)N2CCO[C@H](C(F)(F)F)CC2)[C@H]1c1ccccc1	ZINC000875430957	FF	On-Demand	Anodyne	EPHX2	24	42
O=C(N[C@H](c1cccnc1)C1CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875430958	FG	On-Demand	Anodyne	PTAFR	15	43
CN1CC[C@H](NC(=O)N2CCO[C@H](C(F)(F)F)CC2)[C@@H]1c1ccccc1	ZINC000875430959	FF	On-Demand	Anodyne	EPHX2	24	42
O=C(N[C@H](c1cccnc1)C1CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875430960	FG	On-Demand	Anodyne	PTAFR	15	43
CN1CC[C@H](NC(=O)N2CCO[C@@H](C(F)(F)F)CC2)[C@@H]1c1ccccc1	ZINC000875430961	FF	On-Demand	Anodyne	EPHX2	24	42
O=C(N[C@@H](c1cccnc1)C1CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875430963	FG	On-Demand	Anodyne	PTAFR	15	43
O=C(NCCc1cccc([N+](=O)[O-])c1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875431008	EF	On-Demand	Bother	CACNA1D	50	34
O=C(NCCc1cccc([N+](=O)[O-])c1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875431008	EF	On-Demand	Bother	LUXR	17	43
O=C(NCCc1cccc([N+](=O)[O-])c1)NC1([C@H]2CCCCO2)CCC1	ZINC000875431009	EF	On-Demand	Bother	CACNA1D	50	34
O=C(NCCc1cccc([N+](=O)[O-])c1)NC1([C@H]2CCCCO2)CCC1	ZINC000875431009	EF	On-Demand	Bother	LUXR	17	43
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)C1	ZINC000875431012	EC	On-Demand	Anodyne	EPHX2	22	41
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)C1	ZINC000875431013	EC	On-Demand	Anodyne	EPHX2	22	41
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)C1	ZINC000875431014	EC	On-Demand	Anodyne	EPHX2	22	41
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)C1	ZINC000875431015	EC	On-Demand	Anodyne	EPHX2	22	41
O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875431019	FG	On-Demand	Bother	CACNA1D	50	35
O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000875431019	FG	On-Demand	Bother	LUXR	20	42
C[C@@H](CNC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1nc(-c2ccccc2)no1	ZINC000875431027	GG	On-Demand	Anodyne	SMO	40	39
C[C@@H](CNC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1nc(-c2ccccc2)no1	ZINC000875431027	GG	On-Demand	Anodyne	ETHR	54	44
C[C@@H](CNC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1nc(-c2ccccc2)no1	ZINC000875431028	GG	On-Demand	Anodyne	SMO	40	39
C[C@@H](CNC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1nc(-c2ccccc2)no1	ZINC000875431028	GG	On-Demand	Anodyne	ETHR	54	44
Cc1cncc(CNC(=O)N2CCCN(C=O)CC2)c1	ZINC000875431034	CC	On-Demand	Anodyne	NAMPT	17	40
CCC1(CC)CCCN1C(=O)NC[C@H]1CC(=O)N(Cc2ccccc2)C1	ZINC000875431043	FG	On-Demand	Anodyne	SLC12A5	49	34
CCC1(CC)CCCN1C(=O)NC[C@@H]1CC(=O)N(Cc2ccccc2)C1	ZINC000875431044	FG	On-Demand	Anodyne	SLC12A5	49	34
O=C(NCc1ccc(O)c(Cl)c1)N[C@H](c1cccnc1)C1CC1	ZINC000875431071	EG	On-Demand	Anodyne	NAMPT	46	36
O=C(NCc1ccc(O)c(Cl)c1)N[C@@H](c1cccnc1)C1CC1	ZINC000875431072	EG	On-Demand	Anodyne	NAMPT	46	36
CN1CC[C@H](NC(=O)N2CC[C@@H](C(C)(C)O)C2)[C@@H]1c1ccccc1	ZINC000875431077	EE	On-Demand	Anodyne	EPHX2	23	42
CN1CC[C@H](NC(=O)N2CC[C@@H](C(C)(C)O)C2)[C@H]1c1ccccc1	ZINC000875431079	EE	On-Demand	Anodyne	EPHX2	23	42
CN1CC[C@H](NC(=O)N2CC[C@H](C(C)(C)O)C2)[C@@H]1c1ccccc1	ZINC000875431081	EE	On-Demand	Anodyne	EPHX2	23	42
CN1CC[C@H](NC(=O)N2CC[C@H](C(C)(C)O)C2)[C@H]1c1ccccc1	ZINC000875431083	EE	On-Demand	Anodyne	EPHX2	23	42
COc1ccc(N2CCN(C(=O)N[C@H](c3cccnc3)C3CC3)CC2)c(OC)c1	ZINC000875431086	GG	On-Demand	Clean	HTR1A	23	40
COc1ccc(N2CCN(C(=O)N[C@H](c3cccnc3)C3CC3)CC2)c(OC)c1	ZINC000875431086	GG	On-Demand	Clean	DRD2	15	40
COc1ccc(N2CCN(C(=O)N[C@H](c3cccnc3)C3CC3)CC2)c(OC)c1	ZINC000875431086	GG	On-Demand	Clean	DRD4	40	32
COc1ccc(N2CCN(C(=O)N[C@H](c3cccnc3)C3CC3)CC2)c(OC)c1	ZINC000875431086	GG	On-Demand	Clean	PDGFRB	36	41
COc1ccc(N2CCN(C(=O)N[C@@H](c3cccnc3)C3CC3)CC2)c(OC)c1	ZINC000875431088	GG	On-Demand	Clean	HTR1A	23	40
COc1ccc(N2CCN(C(=O)N[C@@H](c3cccnc3)C3CC3)CC2)c(OC)c1	ZINC000875431088	GG	On-Demand	Clean	DRD2	15	40
COc1ccc(N2CCN(C(=O)N[C@@H](c3cccnc3)C3CC3)CC2)c(OC)c1	ZINC000875431088	GG	On-Demand	Clean	DRD4	40	32
COc1ccc(N2CCN(C(=O)N[C@@H](c3cccnc3)C3CC3)CC2)c(OC)c1	ZINC000875431088	GG	On-Demand	Clean	PDGFRB	36	41
CN1CC[C@H](NC(=O)N2CCN(C)C(C)(C)CC2)[C@@H]1c1ccccc1	ZINC000875431136	EF	On-Demand	Anodyne	EPHX2	25	44
CN1CC[C@H](NC(=O)N2CCN(C)C(C)(C)CC2)[C@H]1c1ccccc1	ZINC000875431138	EF	On-Demand	Anodyne	EPHX2	25	44
CCC1(CC)CCCN1C(=O)NCc1cncc(C)c1	ZINC000875431143	CG	On-Demand	Anodyne	NAMPT	19	45
CN1CC[C@H](NC(=O)N2Cc3cccc(O)c3C2)[C@@H]1c1ccccc1	ZINC000875431167	EF	On-Demand	Clean	EPHX2	22	41
CCOC(=O)CC[C@@H](C)NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875431168	ED	On-Demand	Anodyne	GHRHR	48	35
CN1CC[C@H](NC(=O)N2Cc3cccc(O)c3C2)[C@H]1c1ccccc1	ZINC000875431174	EF	On-Demand	Clean	EPHX2	22	41
CCOC(=O)CC[C@H](C)NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875431175	ED	On-Demand	Anodyne	GHRHR	48	35
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1cccnc1)C1CC1	ZINC000875431194	EE	On-Demand	Anodyne	SLC6A4	18	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1cccnc1)C1CC1	ZINC000875431194	EE	On-Demand	Anodyne	SLC6A3	37	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1cccnc1)C1CC1	ZINC000875431194	EE	On-Demand	Anodyne	GLRA1	20	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1cccnc1)C1CC1	ZINC000875431198	EE	On-Demand	Anodyne	SLC6A4	18	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1cccnc1)C1CC1	ZINC000875431198	EE	On-Demand	Anodyne	SLC6A3	37	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1cccnc1)C1CC1	ZINC000875431198	EE	On-Demand	Anodyne	GLRA1	20	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1cccnc1)C1CC1	ZINC000875431203	EE	On-Demand	Anodyne	SLC6A4	18	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1cccnc1)C1CC1	ZINC000875431203	EE	On-Demand	Anodyne	SLC6A3	37	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1cccnc1)C1CC1	ZINC000875431203	EE	On-Demand	Anodyne	GLRA1	20	40
O=C(NCCc1cccc([N+](=O)[O-])c1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875431206	FF	On-Demand	Bother	LUXR	20	43
O=C(NCCc1cccc([N+](=O)[O-])c1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875431209	FF	On-Demand	Bother	LUXR	20	43
O=C(NCCc1cccc([N+](=O)[O-])c1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875431213	EE	On-Demand	Bother	CACNA1D	45	34
C[C@H](CO)CCCNC(=O)NCc1ccc(O)c(Cl)c1	ZINC000875431241	DE	On-Demand	Anodyne	NCE103	16	49
C[C@@H](CO)CCCNC(=O)NCc1ccc(O)c(Cl)c1	ZINC000875431243	DE	On-Demand	Anodyne	NCE103	16	49
C[C@@H](O)C1CCN(C(=O)N[C@H]2CCN(C)[C@H]2c2ccc(Cl)cc2)CC1	ZINC000875431272	FF	On-Demand	Anodyne	CACNA1H	41	38
C[C@@H](O)C1CCN(C(=O)N[C@H]2CCN(C)[C@H]2c2ccc(Cl)cc2)CC1	ZINC000875431272	FF	On-Demand	Anodyne	CCR1	55	39
C[C@@H](O)C1CCN(C(=O)N[C@H]2CCN(C)[C@H]2c2ccc(Cl)cc2)CC1	ZINC000875431272	FF	On-Demand	Anodyne	EPHX2	18	41
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccc(Cl)cc2)CC1	ZINC000875431274	FF	On-Demand	Anodyne	CACNA1H	41	38
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccc(Cl)cc2)CC1	ZINC000875431274	FF	On-Demand	Anodyne	CCR1	55	39
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccc(Cl)cc2)CC1	ZINC000875431274	FF	On-Demand	Anodyne	EPHX2	18	41
CCOC(=O)CC[C@H](C)NC(=O)N1CCN(c2ccc(C#N)cc2)CC1	ZINC000875431302	FE	On-Demand	Mild	P2RY12	34	41
CCOC(=O)CC[C@@H](C)NC(=O)N1CCN(c2ccc(C#N)cc2)CC1	ZINC000875431303	FE	On-Demand	Mild	P2RY12	34	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1cccnc1)C1CC1	ZINC000875431327	EE	On-Demand	Anodyne	SLC6A4	18	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1cccnc1)C1CC1	ZINC000875431327	EE	On-Demand	Anodyne	SLC6A3	37	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1cccnc1)C1CC1	ZINC000875431327	EE	On-Demand	Anodyne	GLRA1	20	40
C[C@@H](CNC(=O)N1CCC[C@H](OC2CCC2)CC1)c1nc(-c2ccccc2)no1	ZINC000875431345	GH	On-Demand	Anodyne	SMO	44	43
C[C@@H](CNC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1nc(-c2ccccc2)no1	ZINC000875431346	GH	On-Demand	Anodyne	SMO	44	43
Cc1cncc(CNC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)c1	ZINC000875431354	FG	On-Demand	Anodyne	NAMPT	18	46
Cc1cncc(CNC(=O)N2CCC(c3nccc(-c4cccnc4)n3)CC2)c1	ZINC000875431372	GG	On-Demand	Anodyne	NAMPT	55	35
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H](C)Cc1ccc(OC)cc1	ZINC000875431414	DF	On-Demand	Anodyne	MMP1	17	41
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H](C)Cc1ccc(OC)cc1	ZINC000875431415	DF	On-Demand	Anodyne	MMP1	17	41
Cc1cncc(CNC(=O)N2CC[C@@H](C(F)(F)F)O[C@@H](C)C2)c1	ZINC000875431424	EF	On-Demand	Anodyne	NAMPT	25	41
Cc1cncc(CNC(=O)N2CC[C@H](C(F)(F)F)O[C@H](C)C2)c1	ZINC000875431426	EF	On-Demand	Anodyne	NAMPT	25	41
Cc1cncc(CNC(=O)N2CC[C@H](C(F)(F)F)O[C@@H](C)C2)c1	ZINC000875431427	EF	On-Demand	Anodyne	NAMPT	25	41
Cc1cncc(CNC(=O)N2CC[C@@H](C(F)(F)F)O[C@H](C)C2)c1	ZINC000875431428	EF	On-Demand	Anodyne	NAMPT	25	41
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CN(C(=O)N[C@H](c1cccnc1)C1CC1)C2	ZINC000875431442	GG	On-Demand	Anodyne	GPR119	23	42
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CN(C(=O)N[C@@H](c1cccnc1)C1CC1)C2	ZINC000875431444	GG	On-Demand	Anodyne	GPR119	23	42
Cc1cncc(CNC(=O)N2Cc3cccnc3N3CCC[C@H]3C2)c1	ZINC000875431446	EE	On-Demand	Anodyne	NAMPT	36	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc[nH]1	ZINC000875431574	CD	On-Demand	Anodyne	SLC6A4	23	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc[nH]1	ZINC000875431574	CD	On-Demand	Anodyne	SLC6A3	47	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc[nH]1	ZINC000875431575	CD	On-Demand	Anodyne	SLC6A4	23	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1ccc[nH]1	ZINC000875431575	CD	On-Demand	Anodyne	SLC6A3	47	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc[nH]1	ZINC000875431576	CD	On-Demand	Anodyne	SLC6A4	23	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc[nH]1	ZINC000875431576	CD	On-Demand	Anodyne	SLC6A3	47	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc[nH]1	ZINC000875431577	CD	On-Demand	Anodyne	SLC6A4	23	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1ccc[nH]1	ZINC000875431577	CD	On-Demand	Anodyne	SLC6A3	47	40
Cc1cncc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c1	ZINC000875431628	DG	On-Demand	Anodyne	EPHX2	17	40
Cc1cncc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c1	ZINC000875431631	DG	On-Demand	Anodyne	EPHX2	17	40
CCCN(C(=O)c1cnc(C2CCN(C(=O)OC(C)(C)C)CC2)o1)C(C)(C)C	ZINC000875431634	GI	On-Demand	Anodyne	GPR119	46	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCCC[C@H](C)CO)CC1	ZINC000875431649	EG	On-Demand	Anodyne	DRD2	23	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCCC[C@@H](C)CO)CC1	ZINC000875431651	EG	On-Demand	Anodyne	DRD2	23	42
COc1ccccc1[C@H]1CCCN(C(=O)NCCC[C@H](C)CO)CC1	ZINC000875431652	EG	On-Demand	Anodyne	DRD2	23	42
COc1ccccc1[C@H]1CCCN(C(=O)NCCC[C@@H](C)CO)CC1	ZINC000875431654	EG	On-Demand	Anodyne	DRD2	23	42
O=C(NCCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875431673	FG	On-Demand	Bother	CACNA1C	43	36
O=C(NCCc1cccc([N+](=O)[O-])c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875431673	FG	On-Demand	Bother	CACNA1D	64	36
O=C(NCCc1cccc([N+](=O)[O-])c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875431674	FG	On-Demand	Bother	CACNA1C	43	36
O=C(NCCc1cccc([N+](=O)[O-])c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875431674	FG	On-Demand	Bother	CACNA1D	64	36
O=C(N[C@@H](c1cccnc1)C1CC1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875431708	EH	On-Demand	Anodyne	OXTR	44	42
O=C(N[C@@H](c1cccnc1)C1CC1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875431710	EH	On-Demand	Anodyne	OXTR	44	42
O=C(N[C@H](c1cccnc1)C1CC1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875431711	EH	On-Demand	Anodyne	OXTR	44	42
O=C(N[C@H](c1cccnc1)C1CC1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875431712	EH	On-Demand	Anodyne	OXTR	44	42
Cc1cncc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875431723	EG	On-Demand	Anodyne	FKBP1A	40	38
Cc1cncc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875431723	EG	On-Demand	Anodyne	CPT1A	42	36
Cc1cncc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875431723	EG	On-Demand	Anodyne	PREP	35	40
Cc1cncc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000875431723	EG	On-Demand	Anodyne	NAMPT	19	43
Cc1cncc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875431724	EG	On-Demand	Anodyne	FKBP1A	40	38
Cc1cncc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875431724	EG	On-Demand	Anodyne	CPT1A	42	36
Cc1cncc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875431724	EG	On-Demand	Anodyne	PREP	35	40
Cc1cncc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000875431724	EG	On-Demand	Anodyne	NAMPT	19	43
CC(=O)C1CCN(C(=O)NCc2ccc(S(=O)(=O)NCC(C)C)cc2)CC1	ZINC000875431725	GE	On-Demand	Anodyne	SFRP1	87	35
CC(=O)C1CCN(C(=O)NCc2ccc(S(=O)(=O)NCC(C)C)cc2)CC1	ZINC000875431725	GE	On-Demand	Anodyne	WNT3	64	35
CC(=O)C1CCN(C(=O)NCc2ccc(S(=O)(=O)NCC(C)C)cc2)CC1	ZINC000875431725	GE	On-Demand	Anodyne	NAMPT	83	46
Cc1cncc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875431726	EG	On-Demand	Anodyne	FKBP1A	40	38
Cc1cncc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875431726	EG	On-Demand	Anodyne	CPT1A	42	36
Cc1cncc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875431726	EG	On-Demand	Anodyne	PREP	35	40
Cc1cncc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000875431726	EG	On-Demand	Anodyne	NAMPT	19	43
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(S(=O)(=O)NCC(C)C)cc2)C1	ZINC000875431727	GE	On-Demand	Anodyne	DPP7	40	33
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(S(=O)(=O)NCC(C)C)cc2)C1	ZINC000875431727	GE	On-Demand	Anodyne	SFRP1	80	33
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(S(=O)(=O)NCC(C)C)cc2)C1	ZINC000875431727	GE	On-Demand	Anodyne	WNT3	63	33
CC(=O)[C@H]1CCCN(C(=O)NCc2ccc(S(=O)(=O)NCC(C)C)cc2)C1	ZINC000875431727	GE	On-Demand	Anodyne	NAMPT	61	44
Cc1cncc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875431728	EG	On-Demand	Anodyne	FKBP1A	40	38
Cc1cncc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875431728	EG	On-Demand	Anodyne	CPT1A	42	36
Cc1cncc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875431728	EG	On-Demand	Anodyne	PREP	35	40
Cc1cncc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000875431728	EG	On-Demand	Anodyne	NAMPT	19	43
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(S(=O)(=O)NCC(C)C)cc2)C1	ZINC000875431729	GE	On-Demand	Anodyne	DPP7	40	33
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(S(=O)(=O)NCC(C)C)cc2)C1	ZINC000875431729	GE	On-Demand	Anodyne	SFRP1	80	33
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(S(=O)(=O)NCC(C)C)cc2)C1	ZINC000875431729	GE	On-Demand	Anodyne	WNT3	63	33
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccc(S(=O)(=O)NCC(C)C)cc2)C1	ZINC000875431729	GE	On-Demand	Anodyne	NAMPT	61	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)Cc1ccc(OC)cc1	ZINC000875431745	FF	On-Demand	Anodyne	SLC6A4	23	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)Cc1ccc(OC)cc1	ZINC000875431745	FF	On-Demand	Anodyne	SLC6A3	48	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)Cc1ccc(OC)cc1	ZINC000875431746	FF	On-Demand	Anodyne	SLC6A4	23	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)Cc1ccc(OC)cc1	ZINC000875431746	FF	On-Demand	Anodyne	SLC6A3	48	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)Cc1ccc(OC)cc1	ZINC000875431747	FF	On-Demand	Anodyne	SLC6A4	23	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)Cc1ccc(OC)cc1	ZINC000875431747	FF	On-Demand	Anodyne	SLC6A3	48	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)Cc1ccc(OC)cc1	ZINC000875431749	FF	On-Demand	Anodyne	SLC6A4	23	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)Cc1ccc(OC)cc1	ZINC000875431749	FF	On-Demand	Anodyne	SLC6A3	48	43
CN1CC[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)[C@@H]1c1ccccc1	ZINC000875431759	FD	On-Demand	Anodyne	DRD4	23	41
CN1CC[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)[C@H]1c1ccccc1	ZINC000875431763	FD	On-Demand	Anodyne	DRD4	23	41
Cc1cncc(CNC(=O)N2CC3(CCN(C(=O)OC(C)(C)C)CC3)C2)c1	ZINC000875431776	FF	On-Demand	Anodyne	GPR119	27	41
CC(=O)C1CCN(C(=O)N[C@H](c2cccnc2)C2CC2)CC1	ZINC000875431787	DF	On-Demand	Anodyne	PTAFR	19	46
CC(=O)C1CCN(C(=O)N[C@@H](c2cccnc2)C2CC2)CC1	ZINC000875431789	DF	On-Demand	Anodyne	PTAFR	19	46
O=C(N[C@@H](c1cccnc1)C1CC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875431794	GH	On-Demand	Anodyne	SMO	42	42
O=C(N[C@@H](c1cccnc1)C1CC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875431794	GH	On-Demand	Anodyne	ETHR	63	43
O=C(N[C@H](c1cccnc1)C1CC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875431796	GH	On-Demand	Anodyne	SMO	42	42
O=C(N[C@H](c1cccnc1)C1CC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875431796	GH	On-Demand	Anodyne	ETHR	63	43
CCCN(C(=O)c1cn2cc(C)ccc2n1)C(C)(C)C	ZINC000875431805	CG	On-Demand	Anodyne	MAP3K5	31	41
CN1CCN(C2CCN(C(=O)N[C@H](c3cccnc3)C3CC3)CC2)CC1	ZINC000875431806	FD	On-Demand	Anodyne	L3MBTL3	70	41
C[C@H](CO)CCCNC(=O)NCc1cccc(OC(C)(C)C)c1	ZINC000875431807	DG	On-Demand	Anodyne	HRH2	25	42
C[C@H](CO)CCCNC(=O)NCc1cccc(OC(C)(C)C)c1	ZINC000875431807	DG	On-Demand	Anodyne	FURIN	47	34
C[C@H](CO)CCCNC(=O)NCc1cccc(OC(C)(C)C)c1	ZINC000875431807	DG	On-Demand	Anodyne	PDS	59	36
CN1CCN(C2CCN(C(=O)N[C@@H](c3cccnc3)C3CC3)CC2)CC1	ZINC000875431808	FD	On-Demand	Anodyne	L3MBTL3	70	41
C[C@@H](CO)CCCNC(=O)NCc1cccc(OC(C)(C)C)c1	ZINC000875431809	DG	On-Demand	Anodyne	HRH2	25	42
C[C@@H](CO)CCCNC(=O)NCc1cccc(OC(C)(C)C)c1	ZINC000875431809	DG	On-Demand	Anodyne	FURIN	47	34
C[C@@H](CO)CCCNC(=O)NCc1cccc(OC(C)(C)C)c1	ZINC000875431809	DG	On-Demand	Anodyne	PDS	59	36
CN1CC[C@H](NC(=O)N2CCC(CO)(CO)CC2)[C@H]1c1ccc(Cl)cc1	ZINC000875431886	GD	On-Demand	Anodyne	CACNA1H	58	40
CN1CC[C@H](NC(=O)N2CCC(CO)(CO)CC2)[C@H]1c1ccc(Cl)cc1	ZINC000875431886	GD	On-Demand	Anodyne	CCR1	53	36
CN1CC[C@H](NC(=O)N2CCC(CO)(CO)CC2)[C@H]1c1ccc(Cl)cc1	ZINC000875431886	GD	On-Demand	Anodyne	EPHX2	29	41
CN1CC[C@H](NC(=O)N2CCC(CO)(CO)CC2)[C@@H]1c1ccc(Cl)cc1	ZINC000875431888	GD	On-Demand	Anodyne	CACNA1H	58	40
CN1CC[C@H](NC(=O)N2CCC(CO)(CO)CC2)[C@@H]1c1ccc(Cl)cc1	ZINC000875431888	GD	On-Demand	Anodyne	CCR1	53	36
CN1CC[C@H](NC(=O)N2CCC(CO)(CO)CC2)[C@@H]1c1ccc(Cl)cc1	ZINC000875431888	GD	On-Demand	Anodyne	EPHX2	29	41
CCOC(=O)CC[C@@H](C)NC(=O)N1CCN(C)c2ncccc2C1	ZINC000875431926	ED	On-Demand	Anodyne	P2RY12	50	39
CCOC(=O)CC[C@H](C)NC(=O)N1CCN(C)c2ncccc2C1	ZINC000875431927	ED	On-Demand	Anodyne	P2RY12	50	39
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@@H](c1cccnc1)C1CC1)CC2	ZINC000875431954	GH	On-Demand	Anodyne	MTNR1B	15	49
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@H](c1cccnc1)C1CC1)CC2	ZINC000875431955	GH	On-Demand	Anodyne	MTNR1B	15	49
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)N[C@@H](c1cccnc1)C1CC1)CC2	ZINC000875431956	GH	On-Demand	Anodyne	MTNR1B	15	49
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)N[C@H](c1cccnc1)C1CC1)CC2	ZINC000875431957	GH	On-Demand	Anodyne	MTNR1B	15	49
O=C(N[C@H](c1cccnc1)C1CC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875431966	FF	On-Demand	Anodyne	ETHR	48	34
O=C(N[C@H](c1cccnc1)C1CC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875431967	FF	On-Demand	Anodyne	ETHR	48	34
O=C(N[C@@H](c1cccnc1)C1CC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875431968	FF	On-Demand	Anodyne	ETHR	48	34
O=C(N[C@@H](c1cccnc1)C1CC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875431969	FF	On-Demand	Anodyne	ETHR	48	34
Cc1cncc(CNC(=O)N2CCC(CO)(CO)CC2)c1	ZINC000875431987	CC	On-Demand	Anodyne	NAMPT	25	47
N#Cc1ccc(N2CCN(C(=O)N[C@H](c3cccnc3)C3CC3)CC2)cc1	ZINC000875431988	FF	On-Demand	Mild	PTAFR	18	48
N#Cc1ccc(N2CCN(C(=O)N[C@@H](c3cccnc3)C3CC3)CC2)cc1	ZINC000875431989	FF	On-Demand	Mild	PTAFR	18	48
CC[C@@H]1COCCN1CCNC(=O)NC[C@H](C)c1nc(-c2ccccc2)no1	ZINC000875431994	GE	On-Demand	Anodyne	MTOR	41	38
CC[C@@H]1COCCN1CCNC(=O)NC[C@@H](C)c1nc(-c2ccccc2)no1	ZINC000875431995	GE	On-Demand	Anodyne	MTOR	41	38
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cncc(C)c2)CC1	ZINC000875432003	FH	On-Demand	Anodyne	GRIN2B	17	54
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cncc(C)c2)CC1	ZINC000875432003	FH	On-Demand	Anodyne	EPHX2	16	42
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cncc(C)c2)CC1	ZINC000875432004	FH	On-Demand	Anodyne	GRIN2B	17	54
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cncc(C)c2)CC1	ZINC000875432004	FH	On-Demand	Anodyne	EPHX2	16	42
O=C(N[C@H](c1cccnc1)C1CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875432022	FH	On-Demand	Anodyne	EPHX2	22	44
O=C(N[C@H](c1cccnc1)C1CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875432022	FH	On-Demand	Anodyne	TTK	18	45
O=C(N[C@@H](c1cccnc1)C1CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875432023	FH	On-Demand	Anodyne	EPHX2	22	44
O=C(N[C@@H](c1cccnc1)C1CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875432023	FH	On-Demand	Anodyne	TTK	18	45
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](c2cccnc2)C2CC2)C1	ZINC000875432032	DF	On-Demand	Anodyne	PTAFR	18	42
CC(=O)[C@H]1CCCN(C(=O)N[C@H](c2cccnc2)C2CC2)C1	ZINC000875432033	DF	On-Demand	Anodyne	PTAFR	18	42
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](c2cccnc2)C2CC2)C1	ZINC000875432034	DF	On-Demand	Anodyne	PTAFR	18	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(c3ccccc3F)C2=O)C1	ZINC000875432036	GE	On-Demand	Anodyne	ACE	41	46
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(c3ccccc3F)C2=O)C1	ZINC000875432036	GE	On-Demand	Anodyne	BIRC2	57	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(c3ccccc3F)C2=O)C1	ZINC000875432037	GE	On-Demand	Anodyne	ACE	41	46
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(c3ccccc3F)C2=O)C1	ZINC000875432037	GE	On-Demand	Anodyne	BIRC2	57	37
O=C(NC1CCC(F)(F)CC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875432042	FF	On-Demand	Anodyne	SMO	34	53
O=C(NC1CCC(F)(F)CC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875432042	FF	On-Demand	Anodyne	ETHR	53	37
O=C(NC1CCC(F)(F)CC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875432043	FF	On-Demand	Anodyne	SMO	34	53
O=C(NC1CCC(F)(F)CC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875432043	FF	On-Demand	Anodyne	ETHR	53	37
CONC(=O)C1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432052	GD	On-Demand	Anodyne	F2	27	40
CONC(=O)C1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432052	GD	On-Demand	Anodyne	ACE	39	43
CONC(=O)C1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432052	GD	On-Demand	Anodyne	FKBP1A	42	37
CONC(=O)C1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432052	GD	On-Demand	Anodyne	F10	23	40
CONC(=O)C1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432052	GD	On-Demand	Anodyne	MME	22	43
CONC(=O)C1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432052	GD	On-Demand	Anodyne	SIGMAR1	16	42
CONC(=O)C1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432052	GD	On-Demand	Anodyne	APP	17	41
CONC(=O)C1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432052	GD	On-Demand	Anodyne	TMPRSS11D	40	32
CONC(=O)C1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432053	GD	On-Demand	Anodyne	F2	27	40
CONC(=O)C1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432053	GD	On-Demand	Anodyne	ACE	39	43
CONC(=O)C1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432053	GD	On-Demand	Anodyne	FKBP1A	42	37
CONC(=O)C1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432053	GD	On-Demand	Anodyne	F10	23	40
CONC(=O)C1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432053	GD	On-Demand	Anodyne	MME	22	43
CONC(=O)C1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432053	GD	On-Demand	Anodyne	SIGMAR1	16	42
CONC(=O)C1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432053	GD	On-Demand	Anodyne	APP	17	41
CONC(=O)C1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432053	GD	On-Demand	Anodyne	TMPRSS11D	40	32
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1C[C@@H](CO)[C@H](C(F)(F)F)C1	ZINC000875432054	GD	On-Demand	Anodyne	ACE	31	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1C[C@@H](CO)[C@H](C(F)(F)F)C1	ZINC000875432054	GD	On-Demand	Anodyne	MME	18	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1C[C@@H](CO)[C@H](C(F)(F)F)C1	ZINC000875432055	GD	On-Demand	Anodyne	ACE	31	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1C[C@@H](CO)[C@H](C(F)(F)F)C1	ZINC000875432055	GD	On-Demand	Anodyne	MME	18	40
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCCN(Cc4ccccc4)C3=O)C[C@@H]1C2	ZINC000875432065	GD	On-Demand	Anodyne	ACE	26	40
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H]3CCCN(Cc4ccccc4)C3=O)C[C@@H]1C2	ZINC000875432065	GD	On-Demand	Anodyne	MME	17	40
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCCN(Cc4ccccc4)C3=O)C[C@@H]1C2	ZINC000875432066	GD	On-Demand	Anodyne	ACE	26	40
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H]3CCCN(Cc4ccccc4)C3=O)C[C@@H]1C2	ZINC000875432066	GD	On-Demand	Anodyne	MME	17	40
CCC[C@@H](CCO)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432067	EE	On-Demand	Anodyne	ACE	54	43
CCC[C@@H](CCO)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432067	EE	On-Demand	Anodyne	MME	31	43
CCC[C@@H](CCO)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432067	EE	On-Demand	Anodyne	NPY1R	25	40
CCC[C@@H](CCO)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432067	EE	On-Demand	Anodyne	APP	15	47
CCC[C@@H](CCO)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432067	EE	On-Demand	Anodyne	BIRC2	47	38
CCC[C@@H](CCO)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432067	EE	On-Demand	Anodyne	BIRC8	41	31
CCC[C@H](CCO)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432068	EE	On-Demand	Anodyne	ACE	54	43
CCC[C@H](CCO)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432068	EE	On-Demand	Anodyne	MME	31	43
CCC[C@H](CCO)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432068	EE	On-Demand	Anodyne	NPY1R	25	40
CCC[C@H](CCO)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432068	EE	On-Demand	Anodyne	APP	15	47
CCC[C@H](CCO)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432068	EE	On-Demand	Anodyne	BIRC2	47	38
CCC[C@H](CCO)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432068	EE	On-Demand	Anodyne	BIRC8	41	31
CCC[C@@H](CCO)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432069	EE	On-Demand	Anodyne	ACE	54	43
CCC[C@@H](CCO)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432069	EE	On-Demand	Anodyne	MME	31	43
CCC[C@@H](CCO)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432069	EE	On-Demand	Anodyne	NPY1R	25	40
CCC[C@@H](CCO)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432069	EE	On-Demand	Anodyne	APP	15	47
CCC[C@@H](CCO)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432069	EE	On-Demand	Anodyne	BIRC2	47	38
CCC[C@@H](CCO)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432069	EE	On-Demand	Anodyne	BIRC8	41	31
CCC[C@H](CCO)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432070	EE	On-Demand	Anodyne	ACE	54	43
CCC[C@H](CCO)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432070	EE	On-Demand	Anodyne	MME	31	43
CCC[C@H](CCO)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432070	EE	On-Demand	Anodyne	NPY1R	25	40
CCC[C@H](CCO)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432070	EE	On-Demand	Anodyne	APP	15	47
CCC[C@H](CCO)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432070	EE	On-Demand	Anodyne	BIRC2	47	38
CCC[C@H](CCO)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432070	EE	On-Demand	Anodyne	BIRC8	41	31
COC(=O)N(C)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432084	ED	On-Demand	Reactive	ACE	47	43
COC(=O)N(C)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432084	ED	On-Demand	Reactive	MME	29	43
COC(=O)N(C)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432085	ED	On-Demand	Reactive	ACE	47	43
COC(=O)N(C)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432085	ED	On-Demand	Reactive	MME	29	43
O=C1[C@H](NC(=O)N2C[C@@H](O)C[C@H]2C2CC2)CCCN1Cc1ccccc1	ZINC000875432092	FD	On-Demand	Anodyne	ACE	40	42
O=C1[C@H](NC(=O)N2C[C@@H](O)C[C@H]2C2CC2)CCCN1Cc1ccccc1	ZINC000875432092	FD	On-Demand	Anodyne	MME	21	42
O=C1[C@H](NC(=O)N2C[C@@H](O)C[C@H]2C2CC2)CCCN1Cc1ccccc1	ZINC000875432092	FD	On-Demand	Anodyne	BIRC2	49	41
O=C1[C@H](NC(=O)N2C[C@H](O)C[C@H]2C2CC2)CCCN1Cc1ccccc1	ZINC000875432093	FD	On-Demand	Anodyne	ACE	40	42
O=C1[C@H](NC(=O)N2C[C@H](O)C[C@H]2C2CC2)CCCN1Cc1ccccc1	ZINC000875432093	FD	On-Demand	Anodyne	MME	21	42
O=C1[C@H](NC(=O)N2C[C@H](O)C[C@H]2C2CC2)CCCN1Cc1ccccc1	ZINC000875432093	FD	On-Demand	Anodyne	BIRC2	49	41
O=C1[C@H](NC(=O)N2C[C@H](O)C[C@@H]2C2CC2)CCCN1Cc1ccccc1	ZINC000875432094	FD	On-Demand	Anodyne	ACE	40	42
O=C1[C@H](NC(=O)N2C[C@H](O)C[C@@H]2C2CC2)CCCN1Cc1ccccc1	ZINC000875432094	FD	On-Demand	Anodyne	MME	21	42
O=C1[C@H](NC(=O)N2C[C@H](O)C[C@@H]2C2CC2)CCCN1Cc1ccccc1	ZINC000875432094	FD	On-Demand	Anodyne	BIRC2	49	41
O=C1[C@H](NC(=O)N2C[C@@H](O)C[C@@H]2C2CC2)CCCN1Cc1ccccc1	ZINC000875432095	FD	On-Demand	Anodyne	ACE	40	42
O=C1[C@H](NC(=O)N2C[C@@H](O)C[C@@H]2C2CC2)CCCN1Cc1ccccc1	ZINC000875432095	FD	On-Demand	Anodyne	MME	21	42
O=C1[C@H](NC(=O)N2C[C@@H](O)C[C@@H]2C2CC2)CCCN1Cc1ccccc1	ZINC000875432095	FD	On-Demand	Anodyne	BIRC2	49	41
CC(=O)C1CCN(C(=O)NC2CCC(F)(F)CC2)CC1	ZINC000875432113	CF	On-Demand	Anodyne	EPHX2	17	65
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC2(CCNC2=O)CC1	ZINC000875432125	GD	On-Demand	Anodyne	ACE	29	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC2(CCNC2=O)CC1	ZINC000875432125	GD	On-Demand	Anodyne	MME	19	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC2(CCNC2=O)CC1	ZINC000875432125	GD	On-Demand	Anodyne	CALCRL	26	53
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC2(CCNC2=O)CC1	ZINC000875432127	GD	On-Demand	Anodyne	ACE	29	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC2(CCNC2=O)CC1	ZINC000875432127	GD	On-Demand	Anodyne	MME	19	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC2(CCNC2=O)CC1	ZINC000875432127	GD	On-Demand	Anodyne	CALCRL	26	53
Cc1cncc([C@@H]2CCCN2C(=O)NC2CCC(F)(F)CC2)c1	ZINC000875432145	DH	On-Demand	Anodyne	SSTR5	29	40
Cc1cncc([C@H]2CCCN2C(=O)NC2CCC(F)(F)CC2)c1	ZINC000875432146	DH	On-Demand	Anodyne	SSTR5	29	40
C[C@H](NC(=O)Nc1cnn(C2CCN(C)CC2)c1)c1ccc[nH]1	ZINC000875432155	DE	On-Demand	Anodyne	HTR1F	40	35
CCOC(=O)CC[C@@H](C)NC(=O)NCc1cccc2ncccc12	ZINC000875432194	EF	On-Demand	Anodyne	ANPEP	15	41
CCOC(=O)CC[C@H](C)NC(=O)NCc1cccc2ncccc12	ZINC000875432195	EF	On-Demand	Anodyne	ANPEP	15	41
C[C@H](NC(=O)C(=O)NCc1cc(Cl)ccc1Br)c1ccnn1C	ZINC000875432223	GE	On-Demand	Anodyne	P2RX7	20	44
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](c2cccnc2)C2CC2)C1	ZINC000875432235	DF	On-Demand	Anodyne	PTAFR	18	42
Cc1cncc(CNC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875432254	DE	On-Demand	Anodyne	NAMPT	29	44
Cc1cncc(CNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)c1	ZINC000875432259	EF	On-Demand	Anodyne	NAMPT	27	45
Cc1cncc(CNC(=O)N2CCC[C@](O)(c3ccccc3)C2)c1	ZINC000875432260	EF	On-Demand	Anodyne	NAMPT	27	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CC(=O)N(Cc2ccccc2)C1	ZINC000875432263	GD	On-Demand	Anodyne	SLC6A3	38	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CC(=O)N(Cc2ccccc2)C1	ZINC000875432264	GD	On-Demand	Anodyne	SLC6A3	38	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H]1CC(=O)N(Cc2ccccc2)C1	ZINC000875432265	GD	On-Demand	Anodyne	SLC6A3	38	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H]1CC(=O)N(Cc2ccccc2)C1	ZINC000875432266	GD	On-Demand	Anodyne	SLC6A3	38	41
C[C@@H]1CN(C(=O)N[C@@H](c2cccnc2)C2CC2)Cc2ccccc21	ZINC000875432318	DH	On-Demand	Anodyne	PTAFR	15	40
C[C@H]1CN(C(=O)N[C@@H](c2cccnc2)C2CC2)Cc2ccccc21	ZINC000875432319	DH	On-Demand	Anodyne	PTAFR	15	40
C[C@@H]1CN(C(=O)N[C@H](c2cccnc2)C2CC2)Cc2ccccc21	ZINC000875432320	DH	On-Demand	Anodyne	PTAFR	15	40
C[C@H]1CN(C(=O)N[C@H](c2cccnc2)C2CC2)Cc2ccccc21	ZINC000875432321	DH	On-Demand	Anodyne	PTAFR	15	40
O=C(NC1CCC(F)(F)CC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875432335	FH	On-Demand	Anodyne	SMO	41	59
O=C(NC1CCC(F)(F)CC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875432335	FH	On-Demand	Anodyne	ETHR	62	52
CC[C@]1(C(=O)Nc2cccc3ccncc23)CCNC1=O	ZINC000875432336	CE	On-Demand	Anodyne	TRPV1	21	44
CC[C@]1(C(=O)Nc2cccc3ccncc23)CCNC1=O	ZINC000875432336	CE	On-Demand	Anodyne	CDK5	26	44
N#C[C@@]1(C(=O)Nc2cccc3ccncc23)CCCOC1	ZINC000875432346	CE	On-Demand	Mild	TRPV1	19	42
N#C[C@@]1(C(=O)Nc2cccc3ccncc23)CCCOC1	ZINC000875432346	CE	On-Demand	Mild	CDK5	27	42
N#C[C@]1(C(=O)Nc2cccc3ccncc23)CCCOC1	ZINC000875432347	CE	On-Demand	Mild	TRPV1	19	42
N#C[C@]1(C(=O)Nc2cccc3ccncc23)CCCOC1	ZINC000875432347	CE	On-Demand	Mild	CDK5	27	42
O=C(NCc1ccc(O)c(Cl)c1)NC1CCC(F)(F)CC1	ZINC000875432353	DG	On-Demand	Anodyne	EPHX2	15	40
O=C(NCc1ccc(O)c(Cl)c1)NC1CCC(F)(F)CC1	ZINC000875432353	DG	On-Demand	Anodyne	NCE103	15	48
O=C1[C@@H](NC(=O)N2O[C@H]3C=C[C@H]2CC3)CCCN1Cc1ccccc1	ZINC000875432354	EE	On-Demand	Anodyne	ACE	45	42
O=C1[C@@H](NC(=O)N2O[C@H]3C=C[C@H]2CC3)CCCN1Cc1ccccc1	ZINC000875432354	EE	On-Demand	Anodyne	MME	28	42
O=C1[C@H](NC(=O)N2O[C@H]3C=C[C@H]2CC3)CCCN1Cc1ccccc1	ZINC000875432355	EE	On-Demand	Anodyne	ACE	45	42
O=C1[C@H](NC(=O)N2O[C@H]3C=C[C@H]2CC3)CCCN1Cc1ccccc1	ZINC000875432355	EE	On-Demand	Anodyne	MME	28	42
C[C@H](NC(=O)NC1CCC(F)(F)CC1)c1ccccc1O	ZINC000875432375	CG	On-Demand	Clean	EPHX2	23	49
C[C@@H](NC(=O)NC1CCC(F)(F)CC1)c1ccccc1O	ZINC000875432376	CG	On-Demand	Clean	EPHX2	23	49
C[C@@H]1C[C@]1(C(=O)Nc1cccc2ccncc12)C(=O)OC(C)(C)C	ZINC000875432385	EH	On-Demand	Anodyne	TRPV1	26	44
C[C@@H]1C[C@]1(C(=O)Nc1cccc2ccncc12)C(=O)OC(C)(C)C	ZINC000875432385	EH	On-Demand	Anodyne	CDK5	26	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1Cc2cccc(O)c2C1	ZINC000875432388	FF	On-Demand	Clean	ACE	39	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1Cc2cccc(O)c2C1	ZINC000875432388	FF	On-Demand	Clean	MME	23	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1Cc2cccc(O)c2C1	ZINC000875432388	FF	On-Demand	Clean	PREP	52	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1Cc2cccc(O)c2C1	ZINC000875432388	FF	On-Demand	Clean	TMPRSS11D	45	32
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1Cc2cccc(O)c2C1	ZINC000875432389	FF	On-Demand	Clean	ACE	39	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1Cc2cccc(O)c2C1	ZINC000875432389	FF	On-Demand	Clean	MME	23	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1Cc2cccc(O)c2C1	ZINC000875432389	FF	On-Demand	Clean	PREP	52	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1Cc2cccc(O)c2C1	ZINC000875432389	FF	On-Demand	Clean	TMPRSS11D	45	32
O=C(NC1CCC(F)(F)CC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875432394	EI	On-Demand	Anodyne	EPHX2	26	41
O=C(NC1CCC(F)(F)CC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875432394	EI	On-Demand	Anodyne	RBP4	50	31
O=C(N[C@H]1CCCN(c2ccccc2F)C1=O)N1CCC2(CCNC2=O)CC1	ZINC000875432395	GD	On-Demand	Anodyne	CALCRL	31	55
O=C(N[C@@H]1CCCN(c2ccccc2F)C1=O)N1CCC2(CCNC2=O)CC1	ZINC000875432396	GD	On-Demand	Anodyne	CALCRL	31	55
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432405	FE	On-Demand	Anodyne	F2	19	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432405	FE	On-Demand	Anodyne	ACE	59	47
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432405	FE	On-Demand	Anodyne	SLC6A1	42	31
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432405	FE	On-Demand	Anodyne	F10	26	42
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432405	FE	On-Demand	Anodyne	MME	29	45
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432405	FE	On-Demand	Anodyne	SIGMAR1	20	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432405	FE	On-Demand	Anodyne	PREP	49	37
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432405	FE	On-Demand	Anodyne	DPP7	46	37
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432405	FE	On-Demand	Anodyne	BIRC2	58	38
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432405	FE	On-Demand	Anodyne	BIRC8	40	31
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432405	FE	On-Demand	Anodyne	SAP2	37	46
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432406	FE	On-Demand	Anodyne	F2	19	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432406	FE	On-Demand	Anodyne	ACE	59	47
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432406	FE	On-Demand	Anodyne	SLC6A1	42	31
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432406	FE	On-Demand	Anodyne	F10	26	42
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432406	FE	On-Demand	Anodyne	MME	29	45
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432406	FE	On-Demand	Anodyne	SIGMAR1	20	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432406	FE	On-Demand	Anodyne	PREP	49	37
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432406	FE	On-Demand	Anodyne	DPP7	46	37
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432406	FE	On-Demand	Anodyne	BIRC2	58	38
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432406	FE	On-Demand	Anodyne	BIRC8	40	31
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432406	FE	On-Demand	Anodyne	SAP2	37	46
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432407	FE	On-Demand	Anodyne	F2	19	40
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432407	FE	On-Demand	Anodyne	ACE	59	47
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432407	FE	On-Demand	Anodyne	SLC6A1	42	31
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432407	FE	On-Demand	Anodyne	F10	26	42
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432407	FE	On-Demand	Anodyne	MME	29	45
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432407	FE	On-Demand	Anodyne	SIGMAR1	20	40
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432407	FE	On-Demand	Anodyne	PREP	49	37
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432407	FE	On-Demand	Anodyne	DPP7	46	37
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432407	FE	On-Demand	Anodyne	BIRC2	58	38
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432407	FE	On-Demand	Anodyne	BIRC8	40	31
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432407	FE	On-Demand	Anodyne	SAP2	37	46
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432408	FE	On-Demand	Anodyne	F2	19	40
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432408	FE	On-Demand	Anodyne	ACE	59	47
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432408	FE	On-Demand	Anodyne	SLC6A1	42	31
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432408	FE	On-Demand	Anodyne	F10	26	42
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432408	FE	On-Demand	Anodyne	MME	29	45
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432408	FE	On-Demand	Anodyne	SIGMAR1	20	40
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432408	FE	On-Demand	Anodyne	PREP	49	37
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432408	FE	On-Demand	Anodyne	DPP7	46	37
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432408	FE	On-Demand	Anodyne	BIRC2	58	38
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432408	FE	On-Demand	Anodyne	BIRC8	40	31
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432408	FE	On-Demand	Anodyne	SAP2	37	46
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432420	GD	On-Demand	Anodyne	SLC6A3	40	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432420	GD	On-Demand	Anodyne	BIRC2	52	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432421	GD	On-Demand	Anodyne	SLC6A3	40	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432421	GD	On-Demand	Anodyne	BIRC2	52	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432422	GD	On-Demand	Anodyne	SLC6A3	40	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432422	GD	On-Demand	Anodyne	BIRC2	52	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432423	GD	On-Demand	Anodyne	SLC6A3	40	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432423	GD	On-Demand	Anodyne	BIRC2	52	39
N#Cc1ccc(Cn2cc(NC(=O)NC3CCC(F)(F)CC3)cn2)cc1	ZINC000875432434	FH	On-Demand	Mild	ITK	17	49
N#Cc1ccc(Cn2cc(NC(=O)NC3CCC(F)(F)CC3)cn2)cc1	ZINC000875432434	FH	On-Demand	Mild	PANC	54	37
CCOC(=O)CC[C@@H](C)NC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875432470	EE	On-Demand	Anodyne	P2RY12	44	35
CCOC(=O)CC[C@@H](C)NC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875432471	EE	On-Demand	Anodyne	P2RY12	44	35
CCOC(=O)CC[C@H](C)NC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875432472	EE	On-Demand	Anodyne	P2RY12	44	35
CCOC(=O)CC[C@H](C)NC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875432473	EE	On-Demand	Anodyne	P2RY12	44	35
CCOC(=O)CC[C@H](C)NC(=O)NCc1ccc(O)c(Cl)c1	ZINC000875432512	EF	On-Demand	Anodyne	NCE103	15	42
CCOC(=O)CC[C@@H](C)NC(=O)NCc1ccc(O)c(Cl)c1	ZINC000875432514	EF	On-Demand	Anodyne	NCE103	15	42
Cn1cnc(-c2nnc3n2CCN(C(=O)N[C@H](c2cccnc2)C2CC2)C3)c1	ZINC000875432573	GD	On-Demand	Anodyne	P2RX7	19	42
Cn1cnc(-c2nnc3n2CCN(C(=O)N[C@@H](c2cccnc2)C2CC2)C3)c1	ZINC000875432574	GD	On-Demand	Anodyne	P2RX7	19	42
C[C@@H](CNC(=O)N1CC[C@@H](C(C)(C)O)C1)c1nc(-c2ccccc2)no1	ZINC000875432583	FF	On-Demand	Anodyne	BMP1	34	40
C[C@@H](CNC(=O)N1CC[C@@H](C(C)(C)O)C1)c1nc(-c2ccccc2)no1	ZINC000875432583	FF	On-Demand	Anodyne	ETHR	42	41
C[C@@H](CNC(=O)N1CC[C@H](C(C)(C)O)C1)c1nc(-c2ccccc2)no1	ZINC000875432586	FF	On-Demand	Anodyne	BMP1	34	40
C[C@@H](CNC(=O)N1CC[C@H](C(C)(C)O)C1)c1nc(-c2ccccc2)no1	ZINC000875432586	FF	On-Demand	Anodyne	ETHR	42	41
O=C(N[C@H](c1cccnc1)C1CC1)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875432598	CG	On-Demand	Anodyne	PTAFR	15	42
O=C(N[C@@H](c1cccnc1)C1CC1)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875432599	CG	On-Demand	Anodyne	PTAFR	15	42
COc1ccccc1[C@@H](NC(=O)N[C@H]1CCN(CC(C)(C)O)C1)c1ccccn1	ZINC000875432602	GE	On-Demand	Anodyne	BIRC2	28	41
Cc1cncc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875432626	CE	On-Demand	Anodyne	NAMPT	23	40
Cc1cncc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875432627	CE	On-Demand	Anodyne	NAMPT	23	40
CCC1(N(C)C)CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432645	GF	On-Demand	Anodyne	ACE	36	41
CCC1(N(C)C)CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432645	GF	On-Demand	Anodyne	MME	23	41
CCC1(N(C)C)CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432646	GF	On-Demand	Anodyne	ACE	36	41
CCC1(N(C)C)CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432646	GF	On-Demand	Anodyne	MME	23	41
O=CN1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432663	FD	On-Demand	Anodyne	ACE	42	43
O=CN1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432663	FD	On-Demand	Anodyne	MME	25	43
O=CN1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432664	FD	On-Demand	Anodyne	ACE	42	43
O=CN1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432664	FD	On-Demand	Anodyne	MME	25	43
O=C1[C@H](NC(=O)N2CC[C@@H]3CC[C@@H](O)[C@@H]32)CCCN1Cc1ccccc1	ZINC000875432685	FD	On-Demand	Anodyne	PRSS1	16	41
O=C1[C@H](NC(=O)N2CC[C@@H]3CC[C@@H](O)[C@@H]32)CCCN1Cc1ccccc1	ZINC000875432685	FD	On-Demand	Anodyne	ACE	45	44
O=C1[C@H](NC(=O)N2CC[C@@H]3CC[C@@H](O)[C@@H]32)CCCN1Cc1ccccc1	ZINC000875432685	FD	On-Demand	Anodyne	F10	16	40
O=C1[C@H](NC(=O)N2CC[C@@H]3CC[C@@H](O)[C@@H]32)CCCN1Cc1ccccc1	ZINC000875432685	FD	On-Demand	Anodyne	MME	27	44
O=C1[C@H](NC(=O)N2CC[C@@H]3CC[C@@H](O)[C@@H]32)CCCN1Cc1ccccc1	ZINC000875432685	FD	On-Demand	Anodyne	BIRC2	47	39
O=C1[C@@H](NC(=O)N2CC[C@@H]3CC[C@@H](O)[C@@H]32)CCCN1Cc1ccccc1	ZINC000875432686	FD	On-Demand	Anodyne	PRSS1	16	41
O=C1[C@@H](NC(=O)N2CC[C@@H]3CC[C@@H](O)[C@@H]32)CCCN1Cc1ccccc1	ZINC000875432686	FD	On-Demand	Anodyne	ACE	45	44
O=C1[C@@H](NC(=O)N2CC[C@@H]3CC[C@@H](O)[C@@H]32)CCCN1Cc1ccccc1	ZINC000875432686	FD	On-Demand	Anodyne	F10	16	40
O=C1[C@@H](NC(=O)N2CC[C@@H]3CC[C@@H](O)[C@@H]32)CCCN1Cc1ccccc1	ZINC000875432686	FD	On-Demand	Anodyne	MME	27	44
O=C1[C@@H](NC(=O)N2CC[C@@H]3CC[C@@H](O)[C@@H]32)CCCN1Cc1ccccc1	ZINC000875432686	FD	On-Demand	Anodyne	BIRC2	47	39
CC(=O)[C@@H]1CCCN(C(=O)NC2CCC(F)(F)CC2)C1	ZINC000875432689	CF	On-Demand	Anodyne	EPHX2	17	55
CC(=O)[C@H]1CCCN(C(=O)NC2CCC(F)(F)CC2)C1	ZINC000875432690	CF	On-Demand	Anodyne	EPHX2	17	55
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875432697	GD	On-Demand	Anodyne	ACE	47	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875432697	GD	On-Demand	Anodyne	MME	26	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875432697	GD	On-Demand	Anodyne	APP	16	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875432697	GD	On-Demand	Anodyne	CALCRL	43	37
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875432698	GD	On-Demand	Anodyne	ACE	47	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875432698	GD	On-Demand	Anodyne	MME	26	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875432698	GD	On-Demand	Anodyne	APP	16	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875432698	GD	On-Demand	Anodyne	CALCRL	43	37
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875432699	GD	On-Demand	Anodyne	ACE	47	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875432699	GD	On-Demand	Anodyne	MME	26	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875432699	GD	On-Demand	Anodyne	APP	16	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000875432699	GD	On-Demand	Anodyne	CALCRL	43	37
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875432700	GD	On-Demand	Anodyne	ACE	47	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875432700	GD	On-Demand	Anodyne	MME	26	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875432700	GD	On-Demand	Anodyne	APP	16	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000875432700	GD	On-Demand	Anodyne	CALCRL	43	37
O=C(Nc1cccc2ccncc12)C1([C@H]2CCCCO2)CCOCC1	ZINC000875432702	EH	On-Demand	Anodyne	CDK5	30	47
O=C(Nc1cccc2ccncc12)C1([C@@H]2CCCCO2)CCOCC1	ZINC000875432703	EH	On-Demand	Anodyne	CDK5	30	47
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432704	GD	On-Demand	Anodyne	F2	23	43
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432704	GD	On-Demand	Anodyne	PRSS1	24	43
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432704	GD	On-Demand	Anodyne	ACE	44	41
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432704	GD	On-Demand	Anodyne	F10	25	42
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432704	GD	On-Demand	Anodyne	MME	23	41
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432704	GD	On-Demand	Anodyne	BIRC2	49	38
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432704	GD	On-Demand	Anodyne	TMPRSS11D	62	35
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432707	GD	On-Demand	Anodyne	F2	23	43
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432707	GD	On-Demand	Anodyne	PRSS1	24	43
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432707	GD	On-Demand	Anodyne	ACE	44	41
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432707	GD	On-Demand	Anodyne	F10	25	42
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432707	GD	On-Demand	Anodyne	MME	23	41
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432707	GD	On-Demand	Anodyne	BIRC2	49	38
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432707	GD	On-Demand	Anodyne	TMPRSS11D	62	35
N#CCCN1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432713	FD	On-Demand	Mild	ACE	31	41
N#CCCN1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432713	FD	On-Demand	Mild	MME	20	41
N#CCCN1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432713	FD	On-Demand	Mild	DPP4	15	41
N#CCCN1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432714	FD	On-Demand	Mild	ACE	31	41
N#CCCN1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432714	FD	On-Demand	Mild	MME	20	41
N#CCCN1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875432714	FD	On-Demand	Mild	DPP4	15	41
CC(=O)NC[C@@H]1CCCCN1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432716	GD	On-Demand	Anodyne	F2	20	41
CC(=O)NC[C@@H]1CCCCN1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432716	GD	On-Demand	Anodyne	PRSS1	19	41
CC(=O)NC[C@@H]1CCCCN1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432716	GD	On-Demand	Anodyne	ACE	42	45
CC(=O)NC[C@@H]1CCCCN1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432716	GD	On-Demand	Anodyne	FKBP1A	31	41
CC(=O)NC[C@@H]1CCCCN1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432716	GD	On-Demand	Anodyne	F10	20	45
CC(=O)NC[C@@H]1CCCCN1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432716	GD	On-Demand	Anodyne	MME	24	45
CC(=O)NC[C@@H]1CCCCN1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432717	GD	On-Demand	Anodyne	F2	20	41
CC(=O)NC[C@@H]1CCCCN1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432717	GD	On-Demand	Anodyne	PRSS1	19	41
CC(=O)NC[C@@H]1CCCCN1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432717	GD	On-Demand	Anodyne	ACE	42	45
CC(=O)NC[C@@H]1CCCCN1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432717	GD	On-Demand	Anodyne	FKBP1A	31	41
CC(=O)NC[C@@H]1CCCCN1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432717	GD	On-Demand	Anodyne	F10	20	45
CC(=O)NC[C@@H]1CCCCN1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432717	GD	On-Demand	Anodyne	MME	24	45
CC(C)(C)OC(=O)NC[C@H](NC(=O)NCC1COC1)c1ccc2ccccc2c1	ZINC000875432719	GG	On-Demand	Anodyne	PAPA1_CARPA	24	41
CC(C)(C)OC(=O)NC[C@@H](NC(=O)NCC1COC1)c1ccc2ccccc2c1	ZINC000875432720	GG	On-Demand	Anodyne	PAPA1_CARPA	24	41
COC(=O)[C@@]1(OC)CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432722	GD	On-Demand	Anodyne	FKBP1A	22	40
COC(=O)[C@@]1(OC)CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432722	GD	On-Demand	Anodyne	SLC12A5	45	34
COC(=O)[C@@]1(OC)CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432723	GD	On-Demand	Anodyne	FKBP1A	22	40
COC(=O)[C@@]1(OC)CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432723	GD	On-Demand	Anodyne	SLC12A5	45	34
C[C@@H](NC(=O)N1CC2(CCN(C(=O)OC(C)(C)C)CC2)C1)c1ccc[nH]1	ZINC000875432737	FG	On-Demand	Anodyne	GPR119	27	41
O=C(NC[C@H](O)Cc1cccc(Cl)c1)N[C@H](c1cccnc1)C1CC1	ZINC000875432782	FG	On-Demand	Anodyne	C3AR1	31	40
O=C(NC[C@H](O)Cc1cccc(Cl)c1)N[C@@H](c1cccnc1)C1CC1	ZINC000875432784	FG	On-Demand	Anodyne	C3AR1	31	40
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)N[C@H](c1cccnc1)C1CC1	ZINC000875432787	FG	On-Demand	Anodyne	C3AR1	31	40
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)N[C@@H](c1cccnc1)C1CC1	ZINC000875432789	FG	On-Demand	Anodyne	C3AR1	31	40
CC(=O)N(C)c1ccc(CNC(=O)N[C@H](c2cccnc2)C2CC2)cc1	ZINC000875432818	FG	On-Demand	Anodyne	KCNA5	19	44
CC(=O)N(C)c1ccc(CNC(=O)N[C@H](c2cccnc2)C2CC2)cc1	ZINC000875432818	FG	On-Demand	Anodyne	NAMPT	52	37
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H](c2cccnc2)C2CC2)cc1	ZINC000875432820	FG	On-Demand	Anodyne	KCNA5	19	44
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H](c2cccnc2)C2CC2)cc1	ZINC000875432820	FG	On-Demand	Anodyne	NAMPT	52	37
C[C@@H](NC(=O)N1CC[C@H](c2ccc(O)cc2)C1)c1ccc[nH]1	ZINC000875432891	CF	On-Demand	Anodyne	CCR1	33	40
C[C@@H](NC(=O)N1CC[C@@H](c2ccc(O)cc2)C1)c1ccc[nH]1	ZINC000875432893	CF	On-Demand	Anodyne	CCR1	33	40
CCOC(=O)CC[C@H](C)NC(=O)NC1CCN(c2ccccc2C#N)CC1	ZINC000875432895	FF	On-Demand	Mild	P2RY12	37	41
CCOC(=O)CC[C@@H](C)NC(=O)NC1CCN(c2ccccc2C#N)CC1	ZINC000875432896	FF	On-Demand	Mild	P2RY12	37	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cncc(C)c1	ZINC000875432903	DD	On-Demand	Anodyne	SLC6A3	44	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cncc(C)c1	ZINC000875432905	DD	On-Demand	Anodyne	SLC6A3	44	38
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@H](c1cccnc1)C1CC1)CC2	ZINC000875432934	FG	On-Demand	Anodyne	MAPK1	41	35
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NC1CCC(F)(F)CC1	ZINC000875432939	EG	On-Demand	Anodyne	EPHX2	15	46
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NC1CCC(F)(F)CC1	ZINC000875432940	EG	On-Demand	Anodyne	EPHX2	15	46
C=CC[C@@H]1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432947	EF	On-Demand	Mild	F2	17	41
C=CC[C@@H]1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432947	EF	On-Demand	Mild	ACE	36	41
C=CC[C@@H]1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432947	EF	On-Demand	Mild	MME	21	41
C=CC[C@H]1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432948	EF	On-Demand	Mild	F2	17	41
C=CC[C@H]1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432948	EF	On-Demand	Mild	ACE	36	41
C=CC[C@H]1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432948	EF	On-Demand	Mild	MME	21	41
C=CC[C@@H]1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432949	EF	On-Demand	Mild	F2	17	41
C=CC[C@@H]1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432949	EF	On-Demand	Mild	ACE	36	41
C=CC[C@@H]1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432949	EF	On-Demand	Mild	MME	21	41
C=CC[C@H]1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432950	EF	On-Demand	Mild	F2	17	41
C=CC[C@H]1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432950	EF	On-Demand	Mild	ACE	36	41
C=CC[C@H]1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875432950	EF	On-Demand	Mild	MME	21	41
O=C(Nc1cccc2ccncc12)C1([C@@H]2CCCCO2)CCC1	ZINC000875432960	DH	On-Demand	Anodyne	CDK5	38	50
O=C(Nc1cccc2ccncc12)C1([C@H]2CCCCO2)CCC1	ZINC000875432961	DH	On-Demand	Anodyne	CDK5	38	50
COCCN(CC1CCN(C)CC1)C(=O)NCC1(c2ccc(F)cc2F)CC1	ZINC000875432966	GF	On-Demand	Anodyne	ACKR3	46	34
O=C(NCC[C@H](O)C(F)F)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432979	FD	On-Demand	Anodyne	ACE	42	43
O=C(NCC[C@H](O)C(F)F)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432979	FD	On-Demand	Anodyne	MME	25	43
O=C(NCC[C@H](O)C(F)F)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432979	FD	On-Demand	Anodyne	BIRC2	41	38
O=C(NCC[C@H](O)C(F)F)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432980	FD	On-Demand	Anodyne	ACE	42	43
O=C(NCC[C@H](O)C(F)F)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432980	FD	On-Demand	Anodyne	MME	25	43
O=C(NCC[C@H](O)C(F)F)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432980	FD	On-Demand	Anodyne	BIRC2	41	38
O=C(NCC[C@@H](O)C(F)F)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432981	FD	On-Demand	Anodyne	ACE	42	43
O=C(NCC[C@@H](O)C(F)F)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432981	FD	On-Demand	Anodyne	MME	25	43
O=C(NCC[C@@H](O)C(F)F)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432981	FD	On-Demand	Anodyne	BIRC2	41	38
O=C(NCC[C@@H](O)C(F)F)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432982	FD	On-Demand	Anodyne	ACE	42	43
O=C(NCC[C@@H](O)C(F)F)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432982	FD	On-Demand	Anodyne	MME	25	43
O=C(NCC[C@@H](O)C(F)F)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875432982	FD	On-Demand	Anodyne	BIRC2	41	38
O=C(Nc1cccc2ccncc12)C1(F)CCOCC1	ZINC000875432995	CF	On-Demand	Anodyne	TRPV1	31	44
O=C(Nc1cccc2ccncc12)C1(F)CCOCC1	ZINC000875432995	CF	On-Demand	Anodyne	CDK5	28	44
O=C(NC1CCN(C(=O)NC2CCC(F)(F)CC2)CC1)OCc1ccccc1	ZINC000875433011	GH	On-Demand	Anodyne	CHRM1	22	43
O=C(NC1CCN(C(=O)NC2CCC(F)(F)CC2)CC1)OCc1ccccc1	ZINC000875433011	GH	On-Demand	Anodyne	FKBP1A	16	40
O=C(NC1CCN(C(=O)NC2CCC(F)(F)CC2)CC1)OCc1ccccc1	ZINC000875433011	GH	On-Demand	Anodyne	DRD4	17	42
O=C(NC1CCN(C(=O)NC2CCC(F)(F)CC2)CC1)OCc1ccccc1	ZINC000875433011	GH	On-Demand	Anodyne	CHRM3	20	43
O=C(NC1CCN(C(=O)NC2CCC(F)(F)CC2)CC1)OCc1ccccc1	ZINC000875433011	GH	On-Demand	Anodyne	GRIN2B	41	42
O=C(NC1CCN(C(=O)NC2CCC(F)(F)CC2)CC1)OCc1ccccc1	ZINC000875433011	GH	On-Demand	Anodyne	CTRA_BOVIN	47	32
O=C(NC1CCN(C(=O)NC2CCC(F)(F)CC2)CC1)OCc1ccccc1	ZINC000875433011	GH	On-Demand	Anodyne	SIGMAR1	20	42
O=C(NC1CCN(C(=O)NC2CCC(F)(F)CC2)CC1)OCc1ccccc1	ZINC000875433011	GH	On-Demand	Anodyne	CTSB	34	57
O=C(NC1CCN(C(=O)NC2CCC(F)(F)CC2)CC1)OCc1ccccc1	ZINC000875433011	GH	On-Demand	Anodyne	CTSK	34	57
O=C(NC1CCN(C(=O)NC2CCC(F)(F)CC2)CC1)OCc1ccccc1	ZINC000875433011	GH	On-Demand	Anodyne	CTSL	39	57
O=C(NC1CCN(C(=O)NC2CCC(F)(F)CC2)CC1)OCc1ccccc1	ZINC000875433011	GH	On-Demand	Anodyne	CCR3	19	42
O=C(NC1CCN(C(=O)NC2CCC(F)(F)CC2)CC1)OCc1ccccc1	ZINC000875433011	GH	On-Demand	Anodyne	C3AR1	35	45
O=C(NC1CCN(C(=O)NC2CCC(F)(F)CC2)CC1)OCc1ccccc1	ZINC000875433011	GH	On-Demand	Anodyne	PREP	27	42
O=C(NC1CCN(C(=O)NC2CCC(F)(F)CC2)CC1)OCc1ccccc1	ZINC000875433011	GH	On-Demand	Anodyne	CAPNS1	57	33
O=C(NC1CCN(C(=O)NC2CCC(F)(F)CC2)CC1)OCc1ccccc1	ZINC000875433011	GH	On-Demand	Anodyne	CELA2A	40	32
O=C(NC1CCN(C(=O)NC2CCC(F)(F)CC2)CC1)OCc1ccccc1	ZINC000875433011	GH	On-Demand	Anodyne	TGM1	24	43
O=C(NC1CCN(C(=O)NC2CCC(F)(F)CC2)CC1)OCc1ccccc1	ZINC000875433011	GH	On-Demand	Anodyne	CTSS	17	43
O=C(NC1CCN(C(=O)NC2CCC(F)(F)CC2)CC1)OCc1ccccc1	ZINC000875433011	GH	On-Demand	Anodyne	CAPN1	50	36
O=C(NC1CCN(C(=O)NC2CCC(F)(F)CC2)CC1)OCc1ccccc1	ZINC000875433011	GH	On-Demand	Anodyne	CAPN2	79	35
O=C(NC1CCN(C(=O)NC2CCC(F)(F)CC2)CC1)OCc1ccccc1	ZINC000875433011	GH	On-Demand	Anodyne	EPHX2	64	50
O=C(NC1CCN(C(=O)NC2CCC(F)(F)CC2)CC1)OCc1ccccc1	ZINC000875433011	GH	On-Demand	Anodyne	TGM2	41	48
O=C(NC1CCN(C(=O)NC2CCC(F)(F)CC2)CC1)OCc1ccccc1	ZINC000875433011	GH	On-Demand	Anodyne	NPR	51	31
O=C(NC1CCN(C(=O)NC2CCC(F)(F)CC2)CC1)OCc1ccccc1	ZINC000875433011	GH	On-Demand	Anodyne	MCHR1	15	41
O=C(NC1CCN(C(=O)NC2CCC(F)(F)CC2)CC1)OCc1ccccc1	ZINC000875433011	GH	On-Demand	Anodyne	F13A1	27	48
O=C(NC1CCN(C(=O)NC2CCC(F)(F)CC2)CC1)OCc1ccccc1	ZINC000875433011	GH	On-Demand	Anodyne	NAAA	51	47
O=C(NC1CCN(C(=O)NC2CCC(F)(F)CC2)CC1)OCc1ccccc1	ZINC000875433011	GH	On-Demand	Anodyne	BIRC2	19	43
O=C(NC1CCN(C(=O)NC2CCC(F)(F)CC2)CC1)OCc1ccccc1	ZINC000875433011	GH	On-Demand	Anodyne	SLC12A5	72	39
O=C1C[C@H](C(F)(F)F)[C@H](C(=O)Nc2cccc3ccncc23)CN1	ZINC000875433012	EE	On-Demand	Anodyne	TRPV1	30	42
O=C1C[C@H](C(F)(F)F)[C@H](C(=O)Nc2cccc3ccncc23)CN1	ZINC000875433012	EE	On-Demand	Anodyne	CDK5	27	43
O=C1C[C@@H](C(F)(F)F)[C@@H](C(=O)Nc2cccc3ccncc23)CN1	ZINC000875433013	EE	On-Demand	Anodyne	TRPV1	30	42
O=C1C[C@@H](C(F)(F)F)[C@@H](C(=O)Nc2cccc3ccncc23)CN1	ZINC000875433013	EE	On-Demand	Anodyne	CDK5	27	43
O=C1C[C@H](C(F)(F)F)[C@@H](C(=O)Nc2cccc3ccncc23)CN1	ZINC000875433014	EE	On-Demand	Anodyne	TRPV1	30	42
O=C1C[C@H](C(F)(F)F)[C@@H](C(=O)Nc2cccc3ccncc23)CN1	ZINC000875433014	EE	On-Demand	Anodyne	CDK5	27	43
O=C1C[C@@H](C(F)(F)F)[C@H](C(=O)Nc2cccc3ccncc23)CN1	ZINC000875433015	EE	On-Demand	Anodyne	TRPV1	30	42
O=C1C[C@@H](C(F)(F)F)[C@H](C(=O)Nc2cccc3ccncc23)CN1	ZINC000875433015	EE	On-Demand	Anodyne	CDK5	27	43
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2CC[C@@H](C1)S2	ZINC000875433016	FF	On-Demand	Anodyne	ACE	52	43
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2CC[C@@H](C1)S2	ZINC000875433016	FF	On-Demand	Anodyne	MME	29	43
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2CC[C@@H](C1)S2	ZINC000875433017	FF	On-Demand	Anodyne	ACE	52	43
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2CC[C@@H](C1)S2	ZINC000875433017	FF	On-Demand	Anodyne	MME	29	43
C[C@@]1(CO)CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C[C@]1(C)CO	ZINC000875433018	GD	On-Demand	Anodyne	ACE	48	44
C[C@@]1(CO)CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C[C@]1(C)CO	ZINC000875433018	GD	On-Demand	Anodyne	MME	28	44
C[C@@]1(CO)CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C[C@]1(C)CO	ZINC000875433018	GD	On-Demand	Anodyne	PREP	53	40
C[C@@]1(CO)CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C[C@]1(C)CO	ZINC000875433018	GD	On-Demand	Anodyne	BIRC2	41	37
C[C@@]1(CO)CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C[C@]1(C)CO	ZINC000875433018	GD	On-Demand	Anodyne	SAP2	33	40
C[C@@]1(CO)CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C[C@]1(C)CO	ZINC000875433019	GD	On-Demand	Anodyne	ACE	48	44
C[C@@]1(CO)CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C[C@]1(C)CO	ZINC000875433019	GD	On-Demand	Anodyne	MME	28	44
C[C@@]1(CO)CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C[C@]1(C)CO	ZINC000875433019	GD	On-Demand	Anodyne	PREP	53	40
C[C@@]1(CO)CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C[C@]1(C)CO	ZINC000875433019	GD	On-Demand	Anodyne	BIRC2	41	37
C[C@@]1(CO)CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C[C@]1(C)CO	ZINC000875433019	GD	On-Demand	Anodyne	SAP2	33	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCO[C@@H](CCF)C1	ZINC000875433026	FD	On-Demand	Anodyne	ACE	31	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCO[C@@H](CCF)C1	ZINC000875433026	FD	On-Demand	Anodyne	MME	15	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCO[C@H](CCF)C1	ZINC000875433027	FD	On-Demand	Anodyne	ACE	31	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCO[C@H](CCF)C1	ZINC000875433027	FD	On-Demand	Anodyne	MME	15	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCO[C@@H](CCF)C1	ZINC000875433028	FD	On-Demand	Anodyne	ACE	31	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCO[C@@H](CCF)C1	ZINC000875433028	FD	On-Demand	Anodyne	MME	15	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCO[C@H](CCF)C1	ZINC000875433029	FD	On-Demand	Anodyne	ACE	31	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCO[C@H](CCF)C1	ZINC000875433029	FD	On-Demand	Anodyne	MME	15	40
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@@H](c1cccnc1)C1CC1)CC2	ZINC000875433035	FG	On-Demand	Anodyne	MAPK1	41	35
Cc1cncc(CNC(=O)N2CCN(C)C(C)(C)CC2)c1	ZINC000875433040	CE	On-Demand	Anodyne	NAMPT	15	42
O=CN1CCCN(C(=O)N[C@H](c2cccnc2)C2CC2)CC1	ZINC000875433042	DD	On-Demand	Anodyne	PTAFR	18	47
O=CN1CCCN(C(=O)N[C@H](c2cccnc2)C2CC2)CC1	ZINC000875433042	DD	On-Demand	Anodyne	C3AR1	38	41
O=CN1CCCN(C(=O)N[C@@H](c2cccnc2)C2CC2)CC1	ZINC000875433043	DD	On-Demand	Anodyne	PTAFR	18	47
O=CN1CCCN(C(=O)N[C@@H](c2cccnc2)C2CC2)CC1	ZINC000875433043	DD	On-Demand	Anodyne	C3AR1	38	41
Cc1cncc(CNC(=O)NC2CC(Nc3ccccc3)C2)c1	ZINC000875433048	DF	On-Demand	Anodyne	NAMPT	33	53
C[S@](=N)(=O)N1CCN(C(=O)N[C@H](c2cccnc2)C2CC2)CC1	ZINC000875433066	ED	On-Demand	Anodyne	PTAFR	16	43
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H](c2cccnc2)C2CC2)CC1	ZINC000875433068	ED	On-Demand	Anodyne	PTAFR	16	43
CN1CC[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)[C@@H]1c1ccc(Cl)cc1	ZINC000875433089	GE	On-Demand	Anodyne	CACNA1H	20	42
CN1CC[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)[C@@H]1c1ccc(Cl)cc1	ZINC000875433089	GE	On-Demand	Anodyne	DRD4	18	42
CN1CC[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)[C@@H]1c1ccc(Cl)cc1	ZINC000875433089	GE	On-Demand	Anodyne	MCHR1	15	40
CN1CC[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)[C@H]1c1ccc(Cl)cc1	ZINC000875433091	GE	On-Demand	Anodyne	CACNA1H	20	42
CN1CC[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)[C@H]1c1ccc(Cl)cc1	ZINC000875433091	GE	On-Demand	Anodyne	DRD4	18	42
CN1CC[C@H](NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)[C@H]1c1ccc(Cl)cc1	ZINC000875433091	GE	On-Demand	Anodyne	MCHR1	15	40
CCOC(=O)CC[C@H](C)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875433099	EF	On-Demand	Anodyne	ACE	53	43
CCOC(=O)CC[C@H](C)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875433099	EF	On-Demand	Anodyne	TRY1_BOVIN	40	35
CCOC(=O)CC[C@H](C)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875433099	EF	On-Demand	Anodyne	XIAP	41	38
CCOC(=O)CC[C@H](C)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875433100	EF	On-Demand	Anodyne	ACE	53	43
CCOC(=O)CC[C@H](C)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875433100	EF	On-Demand	Anodyne	TRY1_BOVIN	40	35
CCOC(=O)CC[C@H](C)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875433100	EF	On-Demand	Anodyne	XIAP	41	38
CCOC(=O)CC[C@H](C)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875433101	EF	On-Demand	Anodyne	ACE	53	43
CCOC(=O)CC[C@H](C)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875433101	EF	On-Demand	Anodyne	TRY1_BOVIN	40	35
CCOC(=O)CC[C@H](C)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875433101	EF	On-Demand	Anodyne	XIAP	41	38
CCOC(=O)CC[C@H](C)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875433102	EF	On-Demand	Anodyne	ACE	53	43
CCOC(=O)CC[C@H](C)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875433102	EF	On-Demand	Anodyne	TRY1_BOVIN	40	35
CCOC(=O)CC[C@H](C)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875433102	EF	On-Demand	Anodyne	XIAP	41	38
CCOC(=O)CC[C@H](C)NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1	ZINC000875433131	GF	On-Demand	Anodyne	DRD4	20	43
CCOC(=O)CC[C@H](C)NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1	ZINC000875433131	GF	On-Demand	Anodyne	P2RY12	58	35
CCOC(=O)CC[C@H](C)NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1	ZINC000875433131	GF	On-Demand	Anodyne	SSTR5	45	38
CCOC(=O)CC[C@H](C)NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1	ZINC000875433131	GF	On-Demand	Anodyne	EPHX2	19	44
CCOC(=O)CC[C@H](C)NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1	ZINC000875433131	GF	On-Demand	Anodyne	CCR8	38	42
CCOC(=O)CC[C@H](C)NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1	ZINC000875433131	GF	On-Demand	Anodyne	KCNK3	45	34
CCOC(=O)CC[C@@H](C)NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1	ZINC000875433132	GF	On-Demand	Anodyne	DRD4	20	43
CCOC(=O)CC[C@@H](C)NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1	ZINC000875433132	GF	On-Demand	Anodyne	P2RY12	58	35
CCOC(=O)CC[C@@H](C)NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1	ZINC000875433132	GF	On-Demand	Anodyne	SSTR5	45	38
CCOC(=O)CC[C@@H](C)NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1	ZINC000875433132	GF	On-Demand	Anodyne	EPHX2	19	44
CCOC(=O)CC[C@@H](C)NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1	ZINC000875433132	GF	On-Demand	Anodyne	CCR8	38	42
CCOC(=O)CC[C@@H](C)NC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1	ZINC000875433132	GF	On-Demand	Anodyne	KCNK3	45	34
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC(Cc2ccco2)C1	ZINC000875433146	FF	On-Demand	Anodyne	ACE	31	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC(Cc2ccco2)C1	ZINC000875433146	FF	On-Demand	Anodyne	MME	16	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC(Cc2ccco2)C1	ZINC000875433146	FF	On-Demand	Anodyne	SAP2	33	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC(Cc2ccco2)C1	ZINC000875433149	FF	On-Demand	Anodyne	ACE	31	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC(Cc2ccco2)C1	ZINC000875433149	FF	On-Demand	Anodyne	MME	16	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC(Cc2ccco2)C1	ZINC000875433149	FF	On-Demand	Anodyne	SAP2	33	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccn1)c1ccccc1OC	ZINC000875433166	GF	On-Demand	Anodyne	SLC6A3	33	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccn1)c1ccccc1OC	ZINC000875433170	GF	On-Demand	Anodyne	SLC6A3	33	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccn1)c1ccccc1OC	ZINC000875433174	GF	On-Demand	Anodyne	SLC6A3	33	40
CC(=O)C1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875433176	FE	On-Demand	Anodyne	F2	16	41
CC(=O)C1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875433176	FE	On-Demand	Anodyne	PRSS1	18	40
CC(=O)C1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875433176	FE	On-Demand	Anodyne	ACE	50	46
CC(=O)C1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875433176	FE	On-Demand	Anodyne	F10	24	40
CC(=O)C1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875433176	FE	On-Demand	Anodyne	MME	28	46
CC(=O)C1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875433176	FE	On-Demand	Anodyne	SIGMAR1	21	41
CC(=O)C1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875433176	FE	On-Demand	Anodyne	PREP	41	36
CC(=O)C1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875433176	FE	On-Demand	Anodyne	BIRC2	44	37
CC(=O)C1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875433176	FE	On-Demand	Anodyne	SAP2	33	40
CC(=O)C1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875433177	FE	On-Demand	Anodyne	F2	16	41
CC(=O)C1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875433177	FE	On-Demand	Anodyne	PRSS1	18	40
CC(=O)C1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875433177	FE	On-Demand	Anodyne	ACE	50	46
CC(=O)C1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875433177	FE	On-Demand	Anodyne	F10	24	40
CC(=O)C1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875433177	FE	On-Demand	Anodyne	MME	28	46
CC(=O)C1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875433177	FE	On-Demand	Anodyne	SIGMAR1	21	41
CC(=O)C1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875433177	FE	On-Demand	Anodyne	PREP	41	36
CC(=O)C1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875433177	FE	On-Demand	Anodyne	BIRC2	44	37
CC(=O)C1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875433177	FE	On-Demand	Anodyne	SAP2	33	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccn1)c1ccccc1OC	ZINC000875433180	GF	On-Demand	Anodyne	SLC6A3	33	40
O=C1[C@H](NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)CCCN1Cc1ccccc1	ZINC000875433188	GF	On-Demand	Anodyne	ACE	29	41
O=C1[C@H](NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)CCCN1Cc1ccccc1	ZINC000875433188	GF	On-Demand	Anodyne	MME	20	41
O=C1[C@H](NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)CCCN1Cc1ccccc1	ZINC000875433188	GF	On-Demand	Anodyne	BIRC2	48	38
O=C1[C@@H](NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)CCCN1Cc1ccccc1	ZINC000875433189	GF	On-Demand	Anodyne	ACE	29	41
O=C1[C@@H](NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)CCCN1Cc1ccccc1	ZINC000875433189	GF	On-Demand	Anodyne	MME	20	41
O=C1[C@@H](NC(=O)N2[C@H]3CC[C@H]2CC(CCO)C3)CCCN1Cc1ccccc1	ZINC000875433189	GF	On-Demand	Anodyne	BIRC2	48	38
O=C1[C@@H](NC(=O)N(C2CC2)C2CC2)CCCN1Cc1ccccc1	ZINC000875433191	EF	On-Demand	Anodyne	F2	18	41
O=C1[C@@H](NC(=O)N(C2CC2)C2CC2)CCCN1Cc1ccccc1	ZINC000875433191	EF	On-Demand	Anodyne	PRSS1	20	41
O=C1[C@@H](NC(=O)N(C2CC2)C2CC2)CCCN1Cc1ccccc1	ZINC000875433191	EF	On-Demand	Anodyne	ACE	56	47
O=C1[C@@H](NC(=O)N(C2CC2)C2CC2)CCCN1Cc1ccccc1	ZINC000875433191	EF	On-Demand	Anodyne	F10	19	40
O=C1[C@@H](NC(=O)N(C2CC2)C2CC2)CCCN1Cc1ccccc1	ZINC000875433191	EF	On-Demand	Anodyne	MME	32	47
O=C1[C@@H](NC(=O)N(C2CC2)C2CC2)CCCN1Cc1ccccc1	ZINC000875433191	EF	On-Demand	Anodyne	SIGMAR1	27	40
O=C1[C@@H](NC(=O)N(C2CC2)C2CC2)CCCN1Cc1ccccc1	ZINC000875433191	EF	On-Demand	Anodyne	SAP2	33	40
O=C1[C@H](NC(=O)N(C2CC2)C2CC2)CCCN1Cc1ccccc1	ZINC000875433192	EF	On-Demand	Anodyne	F2	18	41
O=C1[C@H](NC(=O)N(C2CC2)C2CC2)CCCN1Cc1ccccc1	ZINC000875433192	EF	On-Demand	Anodyne	PRSS1	20	41
O=C1[C@H](NC(=O)N(C2CC2)C2CC2)CCCN1Cc1ccccc1	ZINC000875433192	EF	On-Demand	Anodyne	ACE	56	47
O=C1[C@H](NC(=O)N(C2CC2)C2CC2)CCCN1Cc1ccccc1	ZINC000875433192	EF	On-Demand	Anodyne	F10	19	40
O=C1[C@H](NC(=O)N(C2CC2)C2CC2)CCCN1Cc1ccccc1	ZINC000875433192	EF	On-Demand	Anodyne	MME	32	47
O=C1[C@H](NC(=O)N(C2CC2)C2CC2)CCCN1Cc1ccccc1	ZINC000875433192	EF	On-Demand	Anodyne	SIGMAR1	27	40
O=C1[C@H](NC(=O)N(C2CC2)C2CC2)CCCN1Cc1ccccc1	ZINC000875433192	EF	On-Demand	Anodyne	SAP2	33	40
CCOC[C@H]1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CCO1	ZINC000875433206	GD	On-Demand	Anodyne	PRSS1	15	40
CCOC[C@H]1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CCO1	ZINC000875433207	GD	On-Demand	Anodyne	PRSS1	15	40
O=C(Nc1cccc2ccncc12)[C@@]12CCCC[C@@H]1C2	ZINC000875433217	CH	On-Demand	Anodyne	TRPV1	21	41
O=C(Nc1cccc2ccncc12)[C@@]12CCCC[C@@H]1C2	ZINC000875433217	CH	On-Demand	Anodyne	CDK5	37	48
O=C(Nc1cccc2ccncc12)[C@]12CCCC[C@@H]1C2	ZINC000875433218	CH	On-Demand	Anodyne	TRPV1	21	41
O=C(Nc1cccc2ccncc12)[C@]12CCCC[C@@H]1C2	ZINC000875433218	CH	On-Demand	Anodyne	CDK5	37	48
O=C(Nc1cccc2ccncc12)[C@]12CCCC[C@H]1C2	ZINC000875433219	CH	On-Demand	Anodyne	TRPV1	21	41
O=C(Nc1cccc2ccncc12)[C@]12CCCC[C@H]1C2	ZINC000875433219	CH	On-Demand	Anodyne	CDK5	37	48
O=C(Nc1cccc2ccncc12)[C@@]12CCCC[C@H]1C2	ZINC000875433220	CH	On-Demand	Anodyne	TRPV1	21	41
O=C(Nc1cccc2ccncc12)[C@@]12CCCC[C@H]1C2	ZINC000875433220	CH	On-Demand	Anodyne	CDK5	37	48
O=C(NC[C@H](O)[C@@H]1CCCO1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433223	FD	On-Demand	Anodyne	ACE	28	41
O=C(NC[C@H](O)[C@@H]1CCCO1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433223	FD	On-Demand	Anodyne	MME	19	41
O=C(NC[C@H](O)[C@H]1CCCO1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433224	FD	On-Demand	Anodyne	ACE	28	41
O=C(NC[C@H](O)[C@H]1CCCO1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433224	FD	On-Demand	Anodyne	MME	19	41
O=C(NC[C@H](O)[C@@H]1CCCO1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433225	FD	On-Demand	Anodyne	ACE	28	41
O=C(NC[C@H](O)[C@@H]1CCCO1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433225	FD	On-Demand	Anodyne	MME	19	41
O=C(NC[C@H](O)[C@H]1CCCO1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433226	FD	On-Demand	Anodyne	ACE	28	41
O=C(NC[C@H](O)[C@H]1CCCO1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433226	FD	On-Demand	Anodyne	MME	19	41
O=C(NCCN1CC[C@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433238	FC	On-Demand	Anodyne	ACE	28	41
O=C(NCCN1CC[C@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433238	FC	On-Demand	Anodyne	ACHE	23	41
O=C(NCCN1CC[C@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433238	FC	On-Demand	Anodyne	SLC6A1	56	32
O=C(NCCN1CC[C@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433238	FC	On-Demand	Anodyne	MME	20	41
O=C(NCCN1CC[C@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433238	FC	On-Demand	Anodyne	BIRC2	40	38
O=C(NCCN1CC[C@@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433239	FC	On-Demand	Anodyne	ACE	28	41
O=C(NCCN1CC[C@@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433239	FC	On-Demand	Anodyne	ACHE	23	41
O=C(NCCN1CC[C@@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433239	FC	On-Demand	Anodyne	SLC6A1	56	32
O=C(NCCN1CC[C@@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433239	FC	On-Demand	Anodyne	MME	20	41
O=C(NCCN1CC[C@@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433239	FC	On-Demand	Anodyne	BIRC2	40	38
O=C(NCCN1CC[C@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433240	FC	On-Demand	Anodyne	ACE	28	41
O=C(NCCN1CC[C@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433240	FC	On-Demand	Anodyne	ACHE	23	41
O=C(NCCN1CC[C@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433240	FC	On-Demand	Anodyne	SLC6A1	56	32
O=C(NCCN1CC[C@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433240	FC	On-Demand	Anodyne	MME	20	41
O=C(NCCN1CC[C@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433240	FC	On-Demand	Anodyne	BIRC2	40	38
O=C(NCCN1CC[C@@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433241	FC	On-Demand	Anodyne	ACE	28	41
O=C(NCCN1CC[C@@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433241	FC	On-Demand	Anodyne	ACHE	23	41
O=C(NCCN1CC[C@@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433241	FC	On-Demand	Anodyne	SLC6A1	56	32
O=C(NCCN1CC[C@@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433241	FC	On-Demand	Anodyne	MME	20	41
O=C(NCCN1CC[C@@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433241	FC	On-Demand	Anodyne	BIRC2	40	38
CN1CCCC[C@H](N(C)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1=O	ZINC000875433254	GD	On-Demand	Anodyne	PRSS1	17	40
CN1CCCC[C@H](N(C)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1=O	ZINC000875433254	GD	On-Demand	Anodyne	ACE	37	45
CN1CCCC[C@H](N(C)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1=O	ZINC000875433254	GD	On-Demand	Anodyne	F10	19	40
CN1CCCC[C@H](N(C)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1=O	ZINC000875433254	GD	On-Demand	Anodyne	MME	22	45
CN1CCCC[C@@H](N(C)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1=O	ZINC000875433255	GD	On-Demand	Anodyne	PRSS1	17	40
CN1CCCC[C@@H](N(C)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1=O	ZINC000875433255	GD	On-Demand	Anodyne	ACE	37	45
CN1CCCC[C@@H](N(C)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1=O	ZINC000875433255	GD	On-Demand	Anodyne	F10	19	40
CN1CCCC[C@@H](N(C)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1=O	ZINC000875433255	GD	On-Demand	Anodyne	MME	22	45
CN1CCCC[C@H](N(C)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1=O	ZINC000875433256	GD	On-Demand	Anodyne	PRSS1	17	40
CN1CCCC[C@H](N(C)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1=O	ZINC000875433256	GD	On-Demand	Anodyne	ACE	37	45
CN1CCCC[C@H](N(C)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1=O	ZINC000875433256	GD	On-Demand	Anodyne	F10	19	40
CN1CCCC[C@H](N(C)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1=O	ZINC000875433256	GD	On-Demand	Anodyne	MME	22	45
CN1CCCC[C@@H](N(C)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1=O	ZINC000875433257	GD	On-Demand	Anodyne	PRSS1	17	40
CN1CCCC[C@@H](N(C)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1=O	ZINC000875433257	GD	On-Demand	Anodyne	ACE	37	45
CN1CCCC[C@@H](N(C)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1=O	ZINC000875433257	GD	On-Demand	Anodyne	F10	19	40
CN1CCCC[C@@H](N(C)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1=O	ZINC000875433257	GD	On-Demand	Anodyne	MME	22	45
CCCCCCCNC(=O)C(=O)NCc1ccc(CC#N)cc1	ZINC000875433265	DE	On-Demand	Mild	S1PR2	49	40
CCCCCCCNC(=O)C(=O)NCc1ccc(CC#N)cc1	ZINC000875433265	DE	On-Demand	Mild	ASAH1	87	37
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC(CO)(CO)CC1	ZINC000875433266	GC	On-Demand	Anodyne	ACE	44	44
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC(CO)(CO)CC1	ZINC000875433266	GC	On-Demand	Anodyne	MME	26	44
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC(CO)(CO)CC1	ZINC000875433267	GC	On-Demand	Anodyne	ACE	44	44
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC(CO)(CO)CC1	ZINC000875433267	GC	On-Demand	Anodyne	MME	26	44
Cc1csc([C@H]2CCN(C(=O)N[C@H]3CCCN(Cc4ccccc4)C3=O)C2)n1	ZINC000875433270	GG	On-Demand	Anodyne	ACE	36	40
CN1CCN(C2CCN(C(=O)NC3CCC(F)(F)CC3)CC2)CC1	ZINC000875433277	ED	On-Demand	Anodyne	L3MBTL3	39	40
C[C@@H](C[C@H](C)NC(=O)C(=O)N1CCC(CCF)CC1)NC(=O)OC(C)(C)C	ZINC000875433278	GE	On-Demand	Anodyne	POLG_HCV1	24	40
C[C@H](C[C@@H](C)NC(=O)C(=O)N1CCC(CCF)CC1)NC(=O)OC(C)(C)C	ZINC000875433281	GE	On-Demand	Anodyne	POLG_HCV1	24	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC=CC1	ZINC000875433284	CD	On-Demand	Anodyne	F2	17	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC=CC1	ZINC000875433284	CD	On-Demand	Anodyne	PRSS1	18	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC=CC1	ZINC000875433284	CD	On-Demand	Anodyne	ACE	59	47
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC=CC1	ZINC000875433284	CD	On-Demand	Anodyne	F10	23	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC=CC1	ZINC000875433284	CD	On-Demand	Anodyne	MME	31	47
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC=CC1	ZINC000875433284	CD	On-Demand	Anodyne	SIGMAR1	25	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC=CC1	ZINC000875433284	CD	On-Demand	Anodyne	PREP	45	38
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC=CC1	ZINC000875433284	CD	On-Demand	Anodyne	SAP2	33	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC=CC1	ZINC000875433285	CD	On-Demand	Anodyne	F2	17	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC=CC1	ZINC000875433285	CD	On-Demand	Anodyne	PRSS1	18	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC=CC1	ZINC000875433285	CD	On-Demand	Anodyne	ACE	59	47
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC=CC1	ZINC000875433285	CD	On-Demand	Anodyne	F10	23	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC=CC1	ZINC000875433285	CD	On-Demand	Anodyne	MME	31	47
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC=CC1	ZINC000875433285	CD	On-Demand	Anodyne	SIGMAR1	25	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC=CC1	ZINC000875433285	CD	On-Demand	Anodyne	PREP	45	38
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC=CC1	ZINC000875433285	CD	On-Demand	Anodyne	SAP2	33	40
C[C@@H]1CC(F)(F)CCN1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433286	FG	On-Demand	Anodyne	ACE	41	41
C[C@@H]1CC(F)(F)CCN1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433286	FG	On-Demand	Anodyne	MME	23	41
C[C@H]1CC(F)(F)CCN1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433287	FG	On-Demand	Anodyne	ACE	41	41
C[C@H]1CC(F)(F)CCN1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433287	FG	On-Demand	Anodyne	MME	23	41
C[C@H]1CC(F)(F)CCN1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433288	FG	On-Demand	Anodyne	ACE	41	41
C[C@H]1CC(F)(F)CCN1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433288	FG	On-Demand	Anodyne	MME	23	41
C[C@@H]1CC(F)(F)CCN1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433289	FG	On-Demand	Anodyne	ACE	41	41
C[C@@H]1CC(F)(F)CCN1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433289	FG	On-Demand	Anodyne	MME	23	41
O=C1[C@@H](NC(=O)N2[C@H]3CC[C@H]2CC(F)(F)C3)CCCN1Cc1ccccc1	ZINC000875433290	GG	On-Demand	Anodyne	ACE	41	42
O=C1[C@@H](NC(=O)N2[C@H]3CC[C@H]2CC(F)(F)C3)CCCN1Cc1ccccc1	ZINC000875433290	GG	On-Demand	Anodyne	MME	26	42
O=C1[C@@H](NC(=O)N2[C@H]3CC[C@H]2CC(F)(F)C3)CCCN1Cc1ccccc1	ZINC000875433290	GG	On-Demand	Anodyne	BIRC2	60	38
O=C1[C@@H](NC(=O)N2[C@H]3CC[C@H]2CC(F)(F)C3)CCCN1Cc1ccccc1	ZINC000875433290	GG	On-Demand	Anodyne	BIRC8	40	32
O=C1[C@H](NC(=O)N2[C@H]3CC[C@H]2CC(F)(F)C3)CCCN1Cc1ccccc1	ZINC000875433291	GG	On-Demand	Anodyne	ACE	41	42
O=C1[C@H](NC(=O)N2[C@H]3CC[C@H]2CC(F)(F)C3)CCCN1Cc1ccccc1	ZINC000875433291	GG	On-Demand	Anodyne	MME	26	42
O=C1[C@H](NC(=O)N2[C@H]3CC[C@H]2CC(F)(F)C3)CCCN1Cc1ccccc1	ZINC000875433291	GG	On-Demand	Anodyne	BIRC2	60	38
O=C1[C@H](NC(=O)N2[C@H]3CC[C@H]2CC(F)(F)C3)CCCN1Cc1ccccc1	ZINC000875433291	GG	On-Demand	Anodyne	BIRC8	40	32
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCCN(c2ccccc2F)C1=O	ZINC000875433308	FE	On-Demand	Anodyne	KCNQ2	48	37
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCCN(c2ccccc2F)C1=O	ZINC000875433308	FE	On-Demand	Anodyne	NPY1R	25	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCCN(c2ccccc2F)C1=O	ZINC000875433308	FE	On-Demand	Anodyne	RIR1_HHV11	15	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCCN(c2ccccc2F)C1=O	ZINC000875433308	FE	On-Demand	Anodyne	XIAP	40	36
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCCN(c2ccccc2F)C1=O	ZINC000875433310	FE	On-Demand	Anodyne	KCNQ2	48	37
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCCN(c2ccccc2F)C1=O	ZINC000875433310	FE	On-Demand	Anodyne	NPY1R	25	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCCN(c2ccccc2F)C1=O	ZINC000875433310	FE	On-Demand	Anodyne	RIR1_HHV11	15	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCCN(c2ccccc2F)C1=O	ZINC000875433310	FE	On-Demand	Anodyne	XIAP	40	36
CN1CC[C@H](NC(=O)N2CCCN(C=O)CC2)[C@H]1c1ccc(Cl)cc1	ZINC000875433313	FD	On-Demand	Anodyne	EPHX2	18	40
CN1CC[C@H](NC(=O)N2CCCN(C=O)CC2)[C@@H]1c1ccc(Cl)cc1	ZINC000875433317	FD	On-Demand	Anodyne	EPHX2	18	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCO[C@H](C(F)F)CC1	ZINC000875433324	GE	On-Demand	Anodyne	ACE	42	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCO[C@H](C(F)F)CC1	ZINC000875433324	GE	On-Demand	Anodyne	MME	23	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCO[C@H](C(F)F)CC1	ZINC000875433326	GE	On-Demand	Anodyne	ACE	42	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCO[C@H](C(F)F)CC1	ZINC000875433326	GE	On-Demand	Anodyne	MME	23	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCO[C@@H](C(F)F)CC1	ZINC000875433328	GE	On-Demand	Anodyne	ACE	42	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCO[C@@H](C(F)F)CC1	ZINC000875433328	GE	On-Demand	Anodyne	MME	23	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCO[C@@H](C(F)F)CC1	ZINC000875433330	GE	On-Demand	Anodyne	ACE	42	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCO[C@@H](C(F)F)CC1	ZINC000875433330	GE	On-Demand	Anodyne	MME	23	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1COCC[C@H]1O	ZINC000875433354	EC	On-Demand	Anodyne	PRSS1	16	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1COCC[C@H]1O	ZINC000875433354	EC	On-Demand	Anodyne	ACE	34	43
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1COCC[C@H]1O	ZINC000875433354	EC	On-Demand	Anodyne	MME	22	43
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1COCC[C@H]1O	ZINC000875433356	EC	On-Demand	Anodyne	PRSS1	16	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1COCC[C@H]1O	ZINC000875433356	EC	On-Demand	Anodyne	ACE	34	43
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1COCC[C@H]1O	ZINC000875433356	EC	On-Demand	Anodyne	MME	22	43
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875433358	GG	On-Demand	Anodyne	ACE	41	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875433358	GG	On-Demand	Anodyne	MME	24	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875433358	GG	On-Demand	Anodyne	EPHX2	25	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875433360	GG	On-Demand	Anodyne	ACE	41	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875433360	GG	On-Demand	Anodyne	MME	24	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875433360	GG	On-Demand	Anodyne	EPHX2	25	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875433362	GG	On-Demand	Anodyne	ACE	41	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875433362	GG	On-Demand	Anodyne	MME	24	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875433362	GG	On-Demand	Anodyne	EPHX2	25	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875433364	GG	On-Demand	Anodyne	ACE	41	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875433364	GG	On-Demand	Anodyne	MME	24	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@H](OC2CCC2)CC1	ZINC000875433364	GG	On-Demand	Anodyne	EPHX2	25	40
O=C(N[C@H]1COC[C@H]1O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433372	EC	On-Demand	Anodyne	PRSS1	18	42
O=C(N[C@H]1COC[C@H]1O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433372	EC	On-Demand	Anodyne	ACE	38	44
O=C(N[C@H]1COC[C@H]1O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433372	EC	On-Demand	Anodyne	F10	15	41
O=C(N[C@H]1COC[C@H]1O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433372	EC	On-Demand	Anodyne	MME	25	44
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N[C@H]1COC[C@H]1O	ZINC000875433383	EC	On-Demand	Anodyne	PRSS1	18	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N[C@H]1COC[C@H]1O	ZINC000875433383	EC	On-Demand	Anodyne	ACE	38	44
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N[C@H]1COC[C@H]1O	ZINC000875433383	EC	On-Demand	Anodyne	F10	15	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N[C@H]1COC[C@H]1O	ZINC000875433383	EC	On-Demand	Anodyne	MME	25	44
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N[C@]12CCCC[C@@H]1C2	ZINC000875433386	EF	On-Demand	Anodyne	ACE	25	43
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N[C@]12CCCC[C@@H]1C2	ZINC000875433386	EF	On-Demand	Anodyne	MME	19	43
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N[C@@]12CCCC[C@@H]1C2	ZINC000875433387	EF	On-Demand	Anodyne	ACE	25	43
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N[C@@]12CCCC[C@@H]1C2	ZINC000875433387	EF	On-Demand	Anodyne	MME	19	43
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N[C@]12CCCC[C@H]1C2	ZINC000875433388	EF	On-Demand	Anodyne	ACE	25	43
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N[C@]12CCCC[C@H]1C2	ZINC000875433388	EF	On-Demand	Anodyne	MME	19	43
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N[C@@]12CCCC[C@H]1C2	ZINC000875433389	EF	On-Demand	Anodyne	ACE	25	43
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N[C@@]12CCCC[C@H]1C2	ZINC000875433389	EF	On-Demand	Anodyne	MME	19	43
CCOC(=O)CC[C@H](C)NC(=O)N1CCCN(C(=O)CC(C)C)CC1	ZINC000875433410	FE	On-Demand	Anodyne	RIR1_HHV11	45	32
CCOC(=O)CC[C@@H](C)NC(=O)N1CCCN(C(=O)CC(C)C)CC1	ZINC000875433412	FE	On-Demand	Anodyne	RIR1_HHV11	45	32
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875433438	FF	On-Demand	Anodyne	ACE	45	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875433438	FF	On-Demand	Anodyne	MME	23	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875433438	FF	On-Demand	Anodyne	XIAP	18	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875433438	FF	On-Demand	Anodyne	BIRC2	55	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875433440	FF	On-Demand	Anodyne	ACE	45	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875433440	FF	On-Demand	Anodyne	MME	23	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875433440	FF	On-Demand	Anodyne	XIAP	18	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875433440	FF	On-Demand	Anodyne	BIRC2	55	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875433441	FF	On-Demand	Anodyne	ACE	45	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875433441	FF	On-Demand	Anodyne	MME	23	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875433441	FF	On-Demand	Anodyne	XIAP	18	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875433441	FF	On-Demand	Anodyne	BIRC2	55	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875433442	FF	On-Demand	Anodyne	ACE	45	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875433442	FF	On-Demand	Anodyne	MME	23	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875433442	FF	On-Demand	Anodyne	XIAP	18	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875433442	FF	On-Demand	Anodyne	BIRC2	55	41
CN(C[C@@H]1C[C@H](O)C1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433447	ED	On-Demand	Anodyne	ACE	37	41
CN(C[C@@H]1C[C@H](O)C1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433447	ED	On-Demand	Anodyne	MME	23	41
CN(C[C@@H]1C[C@H](O)C1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433449	ED	On-Demand	Anodyne	ACE	37	41
CN(C[C@@H]1C[C@H](O)C1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433449	ED	On-Demand	Anodyne	MME	23	41
O=C1[C@@H](NC(=O)N2CCO[C@@H]3CCC[C@@H]32)CCCN1Cc1ccccc1	ZINC000875433489	FE	On-Demand	Anodyne	ACE	40	44
O=C1[C@@H](NC(=O)N2CCO[C@@H]3CCC[C@@H]32)CCCN1Cc1ccccc1	ZINC000875433489	FE	On-Demand	Anodyne	MME	27	44
O=C1[C@@H](NC(=O)N2CCO[C@@H]3CCC[C@@H]32)CCCN1Cc1ccccc1	ZINC000875433489	FE	On-Demand	Anodyne	BIRC2	40	39
O=C(NC1CCC(F)(F)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875433491	EG	On-Demand	Anodyne	EPHX2	30	47
O=C(NC1CCC(F)(F)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875433492	EG	On-Demand	Anodyne	EPHX2	30	47
COc1cccc([C@H](O)C2CCN(C(=O)NC3CCC(F)(F)CC3)CC2)c1	ZINC000875433495	GH	On-Demand	Anodyne	C3AR1	31	41
COc1cccc([C@H](O)C2CCN(C(=O)NC3CCC(F)(F)CC3)CC2)c1	ZINC000875433495	GH	On-Demand	Anodyne	EPHX2	20	42
CN(CCNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)CC(F)F	ZINC000875433501	FD	On-Demand	Anodyne	ACE	41	41
CN(CCNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)CC(F)F	ZINC000875433501	FD	On-Demand	Anodyne	MME	25	41
CN(CCNC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O)CC(F)F	ZINC000875433502	FD	On-Demand	Anodyne	ACE	41	41
CN(CCNC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O)CC(F)F	ZINC000875433502	FD	On-Demand	Anodyne	MME	25	41
COCC(C)(C)CCNC(=O)C(=O)NCc1ccc2c(c1)OC(F)(F)O2	ZINC000875433514	FD	On-Demand	Anodyne	KIT	22	40
COCC(C)(C)CCNC(=O)C(=O)NCc1ccc2c(c1)OC(F)(F)O2	ZINC000875433514	FD	On-Demand	Anodyne	BRAF	18	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCCC(F)(F)CC1	ZINC000875433528	FG	On-Demand	Anodyne	ACE	41	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCCC(F)(F)CC1	ZINC000875433528	FG	On-Demand	Anodyne	MME	23	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCCC(F)(F)CC1	ZINC000875433529	FG	On-Demand	Anodyne	ACE	41	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCCC(F)(F)CC1	ZINC000875433529	FG	On-Demand	Anodyne	MME	23	42
O=C(NC1CCC(F)(F)CC1)N1CC2(CC(=O)N2Cc2ccccc2)C1	ZINC000875433534	FF	On-Demand	Anodyne	DRD4	15	40
O=C(NC1CCC(F)(F)CC1)N1CC2(CC(=O)N2Cc2ccccc2)C1	ZINC000875433534	FF	On-Demand	Anodyne	CHRM3	15	42
O=C(NC1CCC(F)(F)CC1)N1CC2(CC(=O)N2Cc2ccccc2)C1	ZINC000875433534	FF	On-Demand	Anodyne	SIGMAR1	18	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC(OCC(F)F)C1	ZINC000875433536	FD	On-Demand	Anodyne	ACE	57	43
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC(OCC(F)F)C1	ZINC000875433536	FD	On-Demand	Anodyne	MME	28	43
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC(OCC(F)F)C1	ZINC000875433536	FD	On-Demand	Anodyne	BIRC2	40	36
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC(OCC(F)F)C1	ZINC000875433537	FD	On-Demand	Anodyne	ACE	57	43
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC(OCC(F)F)C1	ZINC000875433537	FD	On-Demand	Anodyne	MME	28	43
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC(OCC(F)F)C1	ZINC000875433537	FD	On-Demand	Anodyne	BIRC2	40	36
Cn1nnnc1C1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875433538	GD	On-Demand	Anodyne	ACE	33	41
Cn1nnnc1C1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875433538	GD	On-Demand	Anodyne	MME	21	41
Cn1nnnc1C1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875433539	GD	On-Demand	Anodyne	ACE	33	41
Cn1nnnc1C1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000875433539	GD	On-Demand	Anodyne	MME	21	41
O=C(N[C@H]1CCOC[C@H]1O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433542	EC	On-Demand	Anodyne	PRSS1	16	40
O=C(N[C@H]1CCOC[C@H]1O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433542	EC	On-Demand	Anodyne	ACE	30	42
O=C(N[C@H]1CCOC[C@H]1O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433542	EC	On-Demand	Anodyne	MME	21	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1CCOC[C@H]1O	ZINC000875433543	EC	On-Demand	Anodyne	PRSS1	16	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1CCOC[C@H]1O	ZINC000875433543	EC	On-Demand	Anodyne	ACE	30	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1CCOC[C@H]1O	ZINC000875433543	EC	On-Demand	Anodyne	MME	21	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1CCOC[C@@H]1O	ZINC000875433544	EC	On-Demand	Anodyne	PRSS1	16	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1CCOC[C@@H]1O	ZINC000875433544	EC	On-Demand	Anodyne	ACE	30	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1CCOC[C@@H]1O	ZINC000875433544	EC	On-Demand	Anodyne	MME	21	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1CCOC[C@H]1O	ZINC000875433545	EC	On-Demand	Anodyne	PRSS1	16	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1CCOC[C@H]1O	ZINC000875433545	EC	On-Demand	Anodyne	ACE	30	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1CCOC[C@H]1O	ZINC000875433545	EC	On-Demand	Anodyne	MME	21	42
O=C(N[C@H]1CCOC[C@@H]1O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433546	EC	On-Demand	Anodyne	PRSS1	16	40
O=C(N[C@H]1CCOC[C@@H]1O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433546	EC	On-Demand	Anodyne	ACE	30	42
O=C(N[C@H]1CCOC[C@@H]1O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433546	EC	On-Demand	Anodyne	MME	21	42
O=C1[C@@H](NC(=O)N2C[C@H]3C[C@H](O)C[C@H]2C3)CCCN1Cc1ccccc1	ZINC000875433547	FD	On-Demand	Anodyne	ACE	39	41
O=C1[C@@H](NC(=O)N2C[C@H]3C[C@H](O)C[C@H]2C3)CCCN1Cc1ccccc1	ZINC000875433547	FD	On-Demand	Anodyne	MME	23	41
O=C1[C@@H](NC(=O)N2C[C@H]3C[C@H](O)C[C@H]2C3)CCCN1Cc1ccccc1	ZINC000875433547	FD	On-Demand	Anodyne	BIRC2	49	40
O=C1[C@H](NC(=O)N2C[C@H]3C[C@@H](O)C[C@H]2C3)CCCN1Cc1ccccc1	ZINC000875433548	FD	On-Demand	Anodyne	ACE	39	41
O=C1[C@H](NC(=O)N2C[C@H]3C[C@@H](O)C[C@H]2C3)CCCN1Cc1ccccc1	ZINC000875433548	FD	On-Demand	Anodyne	MME	23	41
O=C1[C@H](NC(=O)N2C[C@H]3C[C@@H](O)C[C@H]2C3)CCCN1Cc1ccccc1	ZINC000875433548	FD	On-Demand	Anodyne	BIRC2	49	40
O=C1[C@@H](NC(=O)N2C[C@H]3C[C@@H](O)C[C@H]2C3)CCCN1Cc1ccccc1	ZINC000875433549	FD	On-Demand	Anodyne	ACE	39	41
O=C1[C@@H](NC(=O)N2C[C@H]3C[C@@H](O)C[C@H]2C3)CCCN1Cc1ccccc1	ZINC000875433549	FD	On-Demand	Anodyne	MME	23	41
O=C1[C@@H](NC(=O)N2C[C@H]3C[C@@H](O)C[C@H]2C3)CCCN1Cc1ccccc1	ZINC000875433549	FD	On-Demand	Anodyne	BIRC2	49	40
O=C1[C@H](NC(=O)N2C[C@H]3C[C@H](O)C[C@H]2C3)CCCN1Cc1ccccc1	ZINC000875433550	FD	On-Demand	Anodyne	ACE	39	41
O=C1[C@H](NC(=O)N2C[C@H]3C[C@H](O)C[C@H]2C3)CCCN1Cc1ccccc1	ZINC000875433550	FD	On-Demand	Anodyne	MME	23	41
O=C1[C@H](NC(=O)N2C[C@H]3C[C@H](O)C[C@H]2C3)CCCN1Cc1ccccc1	ZINC000875433550	FD	On-Demand	Anodyne	BIRC2	49	40
CC[C@@H]1CN(C)c2ccccc2CN1C(=O)[C@@H](NC=O)C(C)C	ZINC000875433568	DE	On-Demand	Anodyne	TPP2	44	31
CCOC(=O)CC[C@@H](C)NC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875433611	FF	On-Demand	Anodyne	ROCK1	25	45
CCOC(=O)CC[C@@H](C)NC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875433611	FF	On-Demand	Anodyne	ROCK2	18	45
CCOC(=O)CC[C@H](C)NC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875433612	FF	On-Demand	Anodyne	ROCK1	25	45
CCOC(=O)CC[C@H](C)NC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875433612	FF	On-Demand	Anodyne	ROCK2	18	45
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433674	EE	On-Demand	Anodyne	ACE	50	43
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433674	EE	On-Demand	Anodyne	MME	34	43
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433674	EE	On-Demand	Anodyne	NPY1R	26	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433674	EE	On-Demand	Anodyne	RIR1_HHV11	16	43
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433674	EE	On-Demand	Anodyne	XIAP	52	36
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433674	EE	On-Demand	Anodyne	BIRC2	54	38
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433674	EE	On-Demand	Anodyne	BIRC8	42	33
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433675	EE	On-Demand	Anodyne	ACE	50	43
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433675	EE	On-Demand	Anodyne	MME	34	43
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433675	EE	On-Demand	Anodyne	NPY1R	26	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433675	EE	On-Demand	Anodyne	RIR1_HHV11	16	43
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433675	EE	On-Demand	Anodyne	XIAP	52	36
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433675	EE	On-Demand	Anodyne	BIRC2	54	38
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433675	EE	On-Demand	Anodyne	BIRC8	42	33
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433676	GE	On-Demand	Anodyne	ACE	80	46
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433676	GE	On-Demand	Anodyne	MME	30	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433676	GE	On-Demand	Anodyne	APP	16	48
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433676	GE	On-Demand	Anodyne	XIAP	55	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433676	GE	On-Demand	Anodyne	BIRC2	68	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433676	GE	On-Demand	Anodyne	BIRC8	41	32
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433676	GE	On-Demand	Anodyne	SAP2	40	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433676	GE	On-Demand	Anodyne	TMPRSS11D	50	33
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433678	GE	On-Demand	Anodyne	ACE	80	46
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433678	GE	On-Demand	Anodyne	MME	30	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433678	GE	On-Demand	Anodyne	APP	16	48
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433678	GE	On-Demand	Anodyne	XIAP	55	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433678	GE	On-Demand	Anodyne	BIRC2	68	39
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433678	GE	On-Demand	Anodyne	BIRC8	41	32
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433678	GE	On-Demand	Anodyne	SAP2	40	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433678	GE	On-Demand	Anodyne	TMPRSS11D	50	33
C[C@H](C[C@@H](C)NC(=O)C(=O)NCC1CC=CC1)NC(=O)OC(C)(C)C	ZINC000875433689	FD	On-Demand	Anodyne	CTSD	18	41
C[C@H](C[C@@H](C)NC(=O)C(=O)NCC1CC=CC1)NC(=O)OC(C)(C)C	ZINC000875433689	FD	On-Demand	Anodyne	ECE1	30	41
C[C@@H](C[C@H](C)NC(=O)C(=O)NCC1CC=CC1)NC(=O)OC(C)(C)C	ZINC000875433692	FD	On-Demand	Anodyne	CTSD	18	41
C[C@@H](C[C@H](C)NC(=O)C(=O)NCC1CC=CC1)NC(=O)OC(C)(C)C	ZINC000875433692	FD	On-Demand	Anodyne	ECE1	30	41
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NC2CCC(F)(F)CC2)C1	ZINC000875433715	GE	On-Demand	Anodyne	EPHX2	20	40
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NC2CCC(F)(F)CC2)C1	ZINC000875433716	GE	On-Demand	Anodyne	EPHX2	20	40
O=C(N[C@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NC2CCC(F)(F)CC2)C1	ZINC000875433717	GE	On-Demand	Anodyne	EPHX2	20	40
O=C(N[C@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NC2CCC(F)(F)CC2)C1	ZINC000875433718	GE	On-Demand	Anodyne	EPHX2	20	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1C[C@H]2COC[C@H]2C1	ZINC000875433724	ED	On-Demand	Anodyne	ACE	55	46
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1C[C@H]2COC[C@H]2C1	ZINC000875433724	ED	On-Demand	Anodyne	MME	27	44
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1C[C@H]2COC[C@H]2C1	ZINC000875433724	ED	On-Demand	Anodyne	APP	15	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1C[C@H]2COC[C@H]2C1	ZINC000875433724	ED	On-Demand	Anodyne	BIRC2	47	39
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1C[C@H]2COC[C@H]2C1	ZINC000875433724	ED	On-Demand	Anodyne	SAP2	35	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1C[C@H]2COC[C@H]2C1	ZINC000875433725	ED	On-Demand	Anodyne	ACE	55	46
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1C[C@H]2COC[C@H]2C1	ZINC000875433725	ED	On-Demand	Anodyne	MME	27	44
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1C[C@H]2COC[C@H]2C1	ZINC000875433725	ED	On-Demand	Anodyne	APP	15	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1C[C@H]2COC[C@H]2C1	ZINC000875433725	ED	On-Demand	Anodyne	BIRC2	47	39
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1C[C@H]2COC[C@H]2C1	ZINC000875433725	ED	On-Demand	Anodyne	SAP2	35	42
COC(=O)C1(O)CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433741	FC	On-Demand	Anodyne	ACE	41	41
COC(=O)C1(O)CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433741	FC	On-Demand	Anodyne	MME	23	41
COC(=O)C1(O)CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433741	FC	On-Demand	Anodyne	PREP	43	35
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433742	FC	On-Demand	Anodyne	ACE	41	41
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433742	FC	On-Demand	Anodyne	MME	23	41
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433742	FC	On-Demand	Anodyne	PREP	43	35
CN1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)Cc2cccnc21	ZINC000875433747	GE	On-Demand	Anodyne	CALCRL	42	37
CN1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)Cc2cccnc21	ZINC000875433748	GE	On-Demand	Anodyne	CALCRL	42	37
O=C1[C@@H](NC(=O)N2OC3CCC2CC3)CCCN1Cc1ccccc1	ZINC000875433759	EE	On-Demand	Anodyne	F2	18	43
O=C1[C@@H](NC(=O)N2OC3CCC2CC3)CCCN1Cc1ccccc1	ZINC000875433759	EE	On-Demand	Anodyne	PRSS1	21	43
O=C1[C@@H](NC(=O)N2OC3CCC2CC3)CCCN1Cc1ccccc1	ZINC000875433759	EE	On-Demand	Anodyne	ACE	62	47
O=C1[C@@H](NC(=O)N2OC3CCC2CC3)CCCN1Cc1ccccc1	ZINC000875433759	EE	On-Demand	Anodyne	F10	23	43
O=C1[C@@H](NC(=O)N2OC3CCC2CC3)CCCN1Cc1ccccc1	ZINC000875433759	EE	On-Demand	Anodyne	MME	36	47
O=C1[C@@H](NC(=O)N2OC3CCC2CC3)CCCN1Cc1ccccc1	ZINC000875433759	EE	On-Demand	Anodyne	SIGMAR1	31	42
O=C1[C@@H](NC(=O)N2OC3CCC2CC3)CCCN1Cc1ccccc1	ZINC000875433759	EE	On-Demand	Anodyne	PREP	42	38
O=C1[C@@H](NC(=O)N2OC3CCC2CC3)CCCN1Cc1ccccc1	ZINC000875433759	EE	On-Demand	Anodyne	BIRC2	53	39
O=C1[C@@H](NC(=O)N2OC3CCC2CC3)CCCN1Cc1ccccc1	ZINC000875433759	EE	On-Demand	Anodyne	BIRC8	42	33
O=C1[C@@H](NC(=O)N2OC3CCC2CC3)CCCN1Cc1ccccc1	ZINC000875433759	EE	On-Demand	Anodyne	SAP2	33	40
O=C1[C@H](NC(=O)N2OC3CCC2CC3)CCCN1Cc1ccccc1	ZINC000875433760	EE	On-Demand	Anodyne	F2	18	43
O=C1[C@H](NC(=O)N2OC3CCC2CC3)CCCN1Cc1ccccc1	ZINC000875433760	EE	On-Demand	Anodyne	PRSS1	21	43
O=C1[C@H](NC(=O)N2OC3CCC2CC3)CCCN1Cc1ccccc1	ZINC000875433760	EE	On-Demand	Anodyne	ACE	62	47
O=C1[C@H](NC(=O)N2OC3CCC2CC3)CCCN1Cc1ccccc1	ZINC000875433760	EE	On-Demand	Anodyne	F10	23	43
O=C1[C@H](NC(=O)N2OC3CCC2CC3)CCCN1Cc1ccccc1	ZINC000875433760	EE	On-Demand	Anodyne	MME	36	47
O=C1[C@H](NC(=O)N2OC3CCC2CC3)CCCN1Cc1ccccc1	ZINC000875433760	EE	On-Demand	Anodyne	SIGMAR1	31	42
O=C1[C@H](NC(=O)N2OC3CCC2CC3)CCCN1Cc1ccccc1	ZINC000875433760	EE	On-Demand	Anodyne	PREP	42	38
O=C1[C@H](NC(=O)N2OC3CCC2CC3)CCCN1Cc1ccccc1	ZINC000875433760	EE	On-Demand	Anodyne	BIRC2	53	39
O=C1[C@H](NC(=O)N2OC3CCC2CC3)CCCN1Cc1ccccc1	ZINC000875433760	EE	On-Demand	Anodyne	BIRC8	42	33
O=C1[C@H](NC(=O)N2OC3CCC2CC3)CCCN1Cc1ccccc1	ZINC000875433760	EE	On-Demand	Anodyne	SAP2	33	40
CS(=O)(=O)NC1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433763	GC	On-Demand	Anodyne	F2	23	43
CS(=O)(=O)NC1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433763	GC	On-Demand	Anodyne	PRSS1	23	43
CS(=O)(=O)NC1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433763	GC	On-Demand	Anodyne	ACE	49	41
CS(=O)(=O)NC1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433763	GC	On-Demand	Anodyne	F10	26	42
CS(=O)(=O)NC1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433763	GC	On-Demand	Anodyne	MME	24	41
CS(=O)(=O)NC1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433763	GC	On-Demand	Anodyne	APP	15	40
CS(=O)(=O)NC1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433763	GC	On-Demand	Anodyne	BIRC2	41	37
CS(=O)(=O)NC1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433763	GC	On-Demand	Anodyne	TMPRSS11D	62	34
CS(=O)(=O)NC1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433764	GC	On-Demand	Anodyne	F2	23	43
CS(=O)(=O)NC1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433764	GC	On-Demand	Anodyne	PRSS1	23	43
CS(=O)(=O)NC1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433764	GC	On-Demand	Anodyne	ACE	49	41
CS(=O)(=O)NC1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433764	GC	On-Demand	Anodyne	F10	26	42
CS(=O)(=O)NC1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433764	GC	On-Demand	Anodyne	MME	24	41
CS(=O)(=O)NC1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433764	GC	On-Demand	Anodyne	APP	15	40
CS(=O)(=O)NC1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433764	GC	On-Demand	Anodyne	BIRC2	41	37
CS(=O)(=O)NC1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000875433764	GC	On-Demand	Anodyne	TMPRSS11D	62	34
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC2(CCCO2)C1	ZINC000875433767	ED	On-Demand	Anodyne	ACE	25	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC2(CCCO2)C1	ZINC000875433767	ED	On-Demand	Anodyne	MME	17	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC2(CCCO2)C1	ZINC000875433767	ED	On-Demand	Anodyne	SAP2	33	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC2(CCCO2)C1	ZINC000875433768	ED	On-Demand	Anodyne	ACE	25	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC2(CCCO2)C1	ZINC000875433768	ED	On-Demand	Anodyne	MME	17	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC2(CCCO2)C1	ZINC000875433768	ED	On-Demand	Anodyne	SAP2	33	41
C[C@@H](NC(=O)NCC[C@@H](O)COCc1ccccc1)c1ccc[nH]1	ZINC000875433786	EE	On-Demand	Anodyne	CAPN2	56	33
O=C(N[C@H]1Cc2ccccc2NC1=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433870	GE	On-Demand	Anodyne	ACE	35	42
O=C(N[C@H]1Cc2ccccc2NC1=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433870	GE	On-Demand	Anodyne	MME	26	42
O=C(N[C@H]1Cc2ccccc2NC1=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433870	GE	On-Demand	Anodyne	PYGL	16	43
O=C(N[C@H]1Cc2ccccc2NC1=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433870	GE	On-Demand	Anodyne	PYGM	20	43
O=C(N[C@H]1Cc2ccccc2NC1=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433871	GE	On-Demand	Anodyne	ACE	35	42
O=C(N[C@H]1Cc2ccccc2NC1=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433871	GE	On-Demand	Anodyne	MME	26	42
O=C(N[C@H]1Cc2ccccc2NC1=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433871	GE	On-Demand	Anodyne	PYGL	16	43
O=C(N[C@H]1Cc2ccccc2NC1=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433871	GE	On-Demand	Anodyne	PYGM	20	43
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1Cc2ccccc2NC1=O	ZINC000875433872	GE	On-Demand	Anodyne	ACE	35	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1Cc2ccccc2NC1=O	ZINC000875433872	GE	On-Demand	Anodyne	MME	26	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1Cc2ccccc2NC1=O	ZINC000875433872	GE	On-Demand	Anodyne	PYGL	16	43
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1Cc2ccccc2NC1=O	ZINC000875433872	GE	On-Demand	Anodyne	PYGM	20	43
O=C(N[C@@H]1Cc2ccccc2NC1=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433873	GE	On-Demand	Anodyne	ACE	35	42
O=C(N[C@@H]1Cc2ccccc2NC1=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433873	GE	On-Demand	Anodyne	MME	26	42
O=C(N[C@@H]1Cc2ccccc2NC1=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433873	GE	On-Demand	Anodyne	PYGL	16	43
O=C(N[C@@H]1Cc2ccccc2NC1=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433873	GE	On-Demand	Anodyne	PYGM	20	43
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCN(c2nccnn2)CC1	ZINC000875433876	GC	On-Demand	Anodyne	TMPRSS11D	36	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCN(c2nccnn2)CC1	ZINC000875433877	GC	On-Demand	Anodyne	TMPRSS11D	36	40
O=C(NC1CCC(F)(F)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875433882	EH	On-Demand	Anodyne	CCR3	25	40
O=C(NC1CCC(F)(F)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875433882	EH	On-Demand	Anodyne	MLNR	15	41
O=C(NC1CCC(F)(F)CC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875433882	EH	On-Demand	Anodyne	EPHX2	54	51
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433894	FE	On-Demand	Anodyne	PRSS1	16	40
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433894	FE	On-Demand	Anodyne	ACE	36	41
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433894	FE	On-Demand	Anodyne	MME	22	41
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433894	FE	On-Demand	Anodyne	BIRC3	43	36
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433894	FE	On-Demand	Anodyne	BIRC2	61	40
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433894	FE	On-Demand	Anodyne	BIRC8	41	32
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433895	FE	On-Demand	Anodyne	PRSS1	16	40
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433895	FE	On-Demand	Anodyne	ACE	36	41
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433895	FE	On-Demand	Anodyne	MME	22	41
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433895	FE	On-Demand	Anodyne	BIRC3	43	36
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433895	FE	On-Demand	Anodyne	BIRC2	61	40
C[C@H]1C(=O)C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433895	FE	On-Demand	Anodyne	BIRC8	41	32
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433900	ED	On-Demand	Anodyne	PRSS1	18	41
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433900	ED	On-Demand	Anodyne	ACE	31	45
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433900	ED	On-Demand	Anodyne	MME	21	45
O=C(NCC1CC(O)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433901	ED	On-Demand	Anodyne	PRSS1	18	41
O=C(NCC1CC(O)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433901	ED	On-Demand	Anodyne	ACE	31	45
O=C(NCC1CC(O)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433901	ED	On-Demand	Anodyne	MME	21	45
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433902	ED	On-Demand	Anodyne	PRSS1	18	41
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433902	ED	On-Demand	Anodyne	ACE	31	45
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433902	ED	On-Demand	Anodyne	MME	21	45
O=C(NC[C@@H]1C[C@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433903	ED	On-Demand	Anodyne	PRSS1	18	41
O=C(NC[C@@H]1C[C@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433903	ED	On-Demand	Anodyne	ACE	31	45
O=C(NC[C@@H]1C[C@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433903	ED	On-Demand	Anodyne	MME	21	45
O=C(NCC1CC(O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433904	ED	On-Demand	Anodyne	PRSS1	18	41
O=C(NCC1CC(O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433904	ED	On-Demand	Anodyne	ACE	31	45
O=C(NCC1CC(O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433904	ED	On-Demand	Anodyne	MME	21	45
O=C(NC[C@@H]1C[C@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433905	ED	On-Demand	Anodyne	PRSS1	18	41
O=C(NC[C@@H]1C[C@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433905	ED	On-Demand	Anodyne	ACE	31	45
O=C(NC[C@@H]1C[C@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433905	ED	On-Demand	Anodyne	MME	21	45
O=C1OC[C@H]2CN(C(=O)N[C@@H]3CCCN(Cc4ccccc4)C3=O)C[C@@H]12	ZINC000875433936	FC	On-Demand	Anodyne	ACE	31	40
O=C1OC[C@H]2CN(C(=O)N[C@@H]3CCCN(Cc4ccccc4)C3=O)C[C@@H]12	ZINC000875433936	FC	On-Demand	Anodyne	MME	17	40
O=C1OC[C@H]2CN(C(=O)N[C@H]3CCCN(Cc4ccccc4)C3=O)C[C@@H]12	ZINC000875433937	FC	On-Demand	Anodyne	ACE	31	40
O=C1OC[C@H]2CN(C(=O)N[C@H]3CCCN(Cc4ccccc4)C3=O)C[C@@H]12	ZINC000875433937	FC	On-Demand	Anodyne	MME	17	40
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433941	FE	On-Demand	Anodyne	PRSS1	17	40
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433941	FE	On-Demand	Anodyne	ACE	33	41
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433941	FE	On-Demand	Anodyne	MME	20	41
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433941	FE	On-Demand	Anodyne	BIRC2	56	40
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433943	FE	On-Demand	Anodyne	PRSS1	17	40
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433943	FE	On-Demand	Anodyne	ACE	33	41
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433943	FE	On-Demand	Anodyne	MME	20	41
C[C@@H]1[C@@H](O)C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433943	FE	On-Demand	Anodyne	BIRC2	56	40
O=C(N[C@H]1CCCN(c2ccccc2F)C1=O)N1CCC(CO)(CO)CC1	ZINC000875433961	GD	On-Demand	Anodyne	CALCRL	43	41
O=C(N[C@@H]1CCCN(c2ccccc2F)C1=O)N1CCC(CO)(CO)CC1	ZINC000875433962	GD	On-Demand	Anodyne	CALCRL	43	41
CN(CC1(C)COC1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433967	ED	On-Demand	Anodyne	ACE	36	41
CN(CC1(C)COC1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433967	ED	On-Demand	Anodyne	MME	22	41
CN(CC1(C)COC1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433968	ED	On-Demand	Anodyne	ACE	36	41
CN(CC1(C)COC1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000875433968	ED	On-Demand	Anodyne	MME	22	41
O=C(NCCO)C1CCN(C(=O)NCC2(c3ccc(F)cc3F)CC2)CC1	ZINC000875433974	GD	On-Demand	Anodyne	CACNA1G	34	40
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NC2CCC(F)(F)CC2)[C@H](O)C1	ZINC000875433978	GE	On-Demand	Anodyne	EPHX2	21	40
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NC2CCC(F)(F)CC2)[C@@H](O)C1	ZINC000875433979	GE	On-Demand	Anodyne	EPHX2	21	40
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NC2CCC(F)(F)CC2)[C@H](O)C1	ZINC000875433980	GE	On-Demand	Anodyne	EPHX2	21	40
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NC2CCC(F)(F)CC2)[C@@H](O)C1	ZINC000875433981	GE	On-Demand	Anodyne	EPHX2	21	40
O=C1[C@H](NC(=O)N2CC[C@H](O)[C@H]3CCCC[C@H]32)CCCN1Cc1ccccc1	ZINC000875433987	GF	On-Demand	Anodyne	F2	16	42
O=C1[C@H](NC(=O)N2CC[C@H](O)[C@H]3CCCC[C@H]32)CCCN1Cc1ccccc1	ZINC000875433987	GF	On-Demand	Anodyne	PRSS1	22	42
O=C1[C@H](NC(=O)N2CC[C@H](O)[C@H]3CCCC[C@H]32)CCCN1Cc1ccccc1	ZINC000875433987	GF	On-Demand	Anodyne	ACE	48	47
O=C1[C@H](NC(=O)N2CC[C@H](O)[C@H]3CCCC[C@H]32)CCCN1Cc1ccccc1	ZINC000875433987	GF	On-Demand	Anodyne	F10	19	42
O=C1[C@H](NC(=O)N2CC[C@H](O)[C@H]3CCCC[C@H]32)CCCN1Cc1ccccc1	ZINC000875433987	GF	On-Demand	Anodyne	MME	27	47
O=C1[C@H](NC(=O)N2CC[C@H](O)[C@@H]3CCCC[C@H]32)CCCN1Cc1ccccc1	ZINC000875433988	GF	On-Demand	Anodyne	F2	16	42
O=C1[C@H](NC(=O)N2CC[C@H](O)[C@@H]3CCCC[C@H]32)CCCN1Cc1ccccc1	ZINC000875433988	GF	On-Demand	Anodyne	PRSS1	22	42
O=C1[C@H](NC(=O)N2CC[C@H](O)[C@@H]3CCCC[C@H]32)CCCN1Cc1ccccc1	ZINC000875433988	GF	On-Demand	Anodyne	ACE	48	47
O=C1[C@H](NC(=O)N2CC[C@H](O)[C@@H]3CCCC[C@H]32)CCCN1Cc1ccccc1	ZINC000875433988	GF	On-Demand	Anodyne	F10	19	42
O=C1[C@H](NC(=O)N2CC[C@H](O)[C@@H]3CCCC[C@H]32)CCCN1Cc1ccccc1	ZINC000875433988	GF	On-Demand	Anodyne	MME	27	47
O=C1[C@H](NC(=O)N2CC[C@H](O)[C@H]3CCCC[C@@H]32)CCCN1Cc1ccccc1	ZINC000875433989	GF	On-Demand	Anodyne	F2	16	42
O=C1[C@H](NC(=O)N2CC[C@H](O)[C@H]3CCCC[C@@H]32)CCCN1Cc1ccccc1	ZINC000875433989	GF	On-Demand	Anodyne	PRSS1	22	42
O=C1[C@H](NC(=O)N2CC[C@H](O)[C@H]3CCCC[C@@H]32)CCCN1Cc1ccccc1	ZINC000875433989	GF	On-Demand	Anodyne	ACE	48	47
O=C1[C@H](NC(=O)N2CC[C@H](O)[C@H]3CCCC[C@@H]32)CCCN1Cc1ccccc1	ZINC000875433989	GF	On-Demand	Anodyne	F10	19	42
O=C1[C@H](NC(=O)N2CC[C@H](O)[C@H]3CCCC[C@@H]32)CCCN1Cc1ccccc1	ZINC000875433989	GF	On-Demand	Anodyne	MME	27	47
O=C1[C@H](NC(=O)N2CC[C@H](O)[C@@H]3CCCC[C@@H]32)CCCN1Cc1ccccc1	ZINC000875433990	GF	On-Demand	Anodyne	F2	16	42
O=C1[C@H](NC(=O)N2CC[C@H](O)[C@@H]3CCCC[C@@H]32)CCCN1Cc1ccccc1	ZINC000875433990	GF	On-Demand	Anodyne	PRSS1	22	42
O=C1[C@H](NC(=O)N2CC[C@H](O)[C@@H]3CCCC[C@@H]32)CCCN1Cc1ccccc1	ZINC000875433990	GF	On-Demand	Anodyne	ACE	48	47
O=C1[C@H](NC(=O)N2CC[C@H](O)[C@@H]3CCCC[C@@H]32)CCCN1Cc1ccccc1	ZINC000875433990	GF	On-Demand	Anodyne	F10	19	42
O=C1[C@H](NC(=O)N2CC[C@H](O)[C@@H]3CCCC[C@@H]32)CCCN1Cc1ccccc1	ZINC000875433990	GF	On-Demand	Anodyne	MME	27	47
CC(C)(C)OC(=O)N1CC(CNC(=O)N2CC[C@@H]3CC[C@@H](O)[C@@H]32)C1	ZINC000875434098	ED	On-Demand	Anodyne	CACNA1I	45	32
CC(C)(C)OC(=O)N1CC(CNC(=O)N2CC[C@@H]3CC[C@@H](O)[C@@H]32)C1	ZINC000875434098	ED	On-Demand	Anodyne	GPR119	24	40
C[C@@H](NC(=O)N1CCc2nc(C3CC3)ncc2C1)c1ccc[nH]1	ZINC000875434121	DF	On-Demand	Anodyne	MAPK1	53	42
CN1CC[C@H](NC(=O)NC[C@H]2C[C@H](O)C2)[C@@H]1c1ccc(Cl)cc1	ZINC000875434245	EE	On-Demand	Anodyne	SLC6A3	21	40
CN1CC[C@H](NC(=O)NC[C@H]2C[C@H](O)C2)[C@@H]1c1ccc(Cl)cc1	ZINC000875434245	EE	On-Demand	Anodyne	CACNA1I	61	35
CN1CC[C@H](NC(=O)NC[C@H]2C[C@H](O)C2)[C@H]1c1ccc(Cl)cc1	ZINC000875434250	EE	On-Demand	Anodyne	SLC6A3	21	40
CN1CC[C@H](NC(=O)NC[C@H]2C[C@H](O)C2)[C@H]1c1ccc(Cl)cc1	ZINC000875434250	EE	On-Demand	Anodyne	CACNA1I	61	35
CC(C)(C)OC(=O)N1CC(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875434281	ED	On-Demand	Anodyne	CACNA1I	61	35
CC(C)(C)OC(=O)N1CC(CNC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875434283	ED	On-Demand	Anodyne	CACNA1I	61	35
C[C@@H](O)C1CCN(C(=O)NC[C@@H]2CCN(C)[C@H]2c2ccc(Cl)c(F)c2)CC1	ZINC000875434314	GG	On-Demand	Anodyne	CACNA1H	43	33
C[C@@H](O)C1CCN(C(=O)NC[C@H]2CCN(C)[C@H]2c2ccc(Cl)c(F)c2)CC1	ZINC000875434317	GG	On-Demand	Anodyne	CACNA1H	43	33
CCOC(=O)CC[C@@H](C)NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875434361	GF	On-Demand	Anodyne	ETHR	64	50
CCOC(=O)CC[C@H](C)NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875434363	GF	On-Demand	Anodyne	ETHR	64	50
CC(C)(C)OC(=O)N1CC(CNC(=O)N2CC[C@H]3CC[C@@H](C2)S3(=O)=O)C1	ZINC000875434376	GD	On-Demand	Anodyne	CACNA1I	52	33
C[C@H]1CCc2ccccc2[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875434406	EE	On-Demand	Anodyne	DRD4	21	40
CCOC(=O)CC[C@H](C)NC(=O)N(CC)[C@H](C)[C@H](O)c1ccccc1	ZINC000875434407	FF	On-Demand	Anodyne	NPY5R	22	41
CCOC(=O)CC[C@H](C)NC(=O)N(CC)[C@H](C)[C@H](O)c1ccccc1	ZINC000875434407	FF	On-Demand	Anodyne	NPR	44	32
CCOC(=O)CC[C@H](C)NC(=O)N(CC)[C@H](C)[C@@H](O)c1ccccc1	ZINC000875434409	FF	On-Demand	Anodyne	NPY5R	22	41
CCOC(=O)CC[C@H](C)NC(=O)N(CC)[C@H](C)[C@@H](O)c1ccccc1	ZINC000875434409	FF	On-Demand	Anodyne	NPR	44	32
C[C@H]1CCc2ccccc2[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875434410	EE	On-Demand	Anodyne	DRD4	21	40
CCOC(=O)CC[C@H](C)NC(=O)N(CC)[C@@H](C)[C@H](O)c1ccccc1	ZINC000875434411	FF	On-Demand	Anodyne	NPY5R	22	41
CCOC(=O)CC[C@H](C)NC(=O)N(CC)[C@@H](C)[C@H](O)c1ccccc1	ZINC000875434411	FF	On-Demand	Anodyne	NPR	44	32
CCOC(=O)CC[C@H](C)NC(=O)N(CC)[C@@H](C)[C@@H](O)c1ccccc1	ZINC000875434412	FF	On-Demand	Anodyne	NPY5R	22	41
CCOC(=O)CC[C@H](C)NC(=O)N(CC)[C@@H](C)[C@@H](O)c1ccccc1	ZINC000875434412	FF	On-Demand	Anodyne	NPR	44	32
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2c3ccccc3CC[C@H]2C)C1	ZINC000875434424	EG	On-Demand	Anodyne	ACE	26	46
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2c3ccccc3CC[C@@H]2C)C1	ZINC000875434426	EG	On-Demand	Anodyne	ACE	26	46
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2c3ccccc3CC[C@H]2C)C1	ZINC000875434428	EG	On-Demand	Anodyne	ACE	26	46
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2c3ccccc3CC[C@@H]2C)C1	ZINC000875434430	EG	On-Demand	Anodyne	ACE	26	46
C[C@@H](C[C@H](C)NC(=O)C(=O)NCc1cccc(F)c1F)NC(=O)OC(C)(C)C	ZINC000875434432	GE	On-Demand	Anodyne	PAPA1_CARPA	36	45
C[C@@H](C[C@H](C)NC(=O)C(=O)NCc1cccc(F)c1F)NC(=O)OC(C)(C)C	ZINC000875434432	GE	On-Demand	Anodyne	FPR1	46	36
C[C@H](C[C@@H](C)NC(=O)C(=O)NCc1cccc(F)c1F)NC(=O)OC(C)(C)C	ZINC000875434433	GE	On-Demand	Anodyne	PAPA1_CARPA	36	45
C[C@H](C[C@@H](C)NC(=O)C(=O)NCc1cccc(F)c1F)NC(=O)OC(C)(C)C	ZINC000875434433	GE	On-Demand	Anodyne	FPR1	46	36
CCOC(=O)CC[C@H](C)NC(=O)N1CCN(c2ccc(C#N)nc2)CC1	ZINC000875434490	FD	On-Demand	Mild	P2RY12	42	40
CCOC(=O)CC[C@@H](C)NC(=O)N1CCN(c2ccc(C#N)nc2)CC1	ZINC000875434491	FD	On-Demand	Mild	P2RY12	42	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nnc2cc(C)ccn12	ZINC000875434566	FE	On-Demand	Anodyne	MME	67	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nnc2cc(C)ccn12	ZINC000875434566	FE	On-Demand	Anodyne	ANPEP	55	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nnc2cc(C)ccn12	ZINC000875434566	FE	On-Demand	Anodyne	CTRA_BOVIN	29	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nnc2cc(C)ccn12	ZINC000875434566	FE	On-Demand	Anodyne	FCER2	106	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nnc2cc(C)ccn12	ZINC000875434566	FE	On-Demand	Anodyne	BMP1	21	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nnc2cc(C)ccn12	ZINC000875434566	FE	On-Demand	Anodyne	KLK3	71	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nnc2cc(C)ccn12	ZINC000875434566	FE	On-Demand	Anodyne	CTSB	74	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nnc2cc(C)ccn12	ZINC000875434566	FE	On-Demand	Anodyne	PAPA1_CARPA	78	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nnc2cc(C)ccn12	ZINC000875434566	FE	On-Demand	Anodyne	CYSP_TRYCR	67	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nnc2cc(C)ccn12	ZINC000875434566	FE	On-Demand	Anodyne	CTSK	30	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nnc2cc(C)ccn12	ZINC000875434566	FE	On-Demand	Anodyne	CTSL	66	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nnc2cc(C)ccn12	ZINC000875434566	FE	On-Demand	Anodyne	TIMP3	80	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nnc2cc(C)ccn12	ZINC000875434566	FE	On-Demand	Anodyne	CAPNS1	70	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nnc2cc(C)ccn12	ZINC000875434566	FE	On-Demand	Anodyne	HLA-DRB1	103	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nnc2cc(C)ccn12	ZINC000875434566	FE	On-Demand	Anodyne	REN	32	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nnc2cc(C)ccn12	ZINC000875434566	FE	On-Demand	Anodyne	CTSS	27	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nnc2cc(C)ccn12	ZINC000875434566	FE	On-Demand	Anodyne	CAPN1	89	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nnc2cc(C)ccn12	ZINC000875434566	FE	On-Demand	Anodyne	CTRC	40	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nnc2cc(C)ccn12	ZINC000875434566	FE	On-Demand	Anodyne	CAPN2	118	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nnc2cc(C)ccn12	ZINC000875434566	FE	On-Demand	Anodyne	ACE2	44	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nnc2cc(C)ccn12	ZINC000875434566	FE	On-Demand	Anodyne	FPR1	60	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nnc2cc(C)ccn12	ZINC000875434566	FE	On-Demand	Anodyne	CTRB_BOVIN	48	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1nnc2cc(C)ccn12	ZINC000875434566	FE	On-Demand	Anodyne	GPR142	55	41
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCCN(c3ccccc3F)C2)CC1	ZINC000875434567	GD	On-Demand	Anodyne	KCNQ2	42	34
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCCN(c3ccccc3F)C2)CC1	ZINC000875434567	GD	On-Demand	Anodyne	EPHX2	19	44
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCCN(c3ccccc3F)C2)CC1	ZINC000875434567	GD	On-Demand	Anodyne	GPBAR1	17	40
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCCN(c3ccccc3F)C2)CC1	ZINC000875434568	GD	On-Demand	Anodyne	KCNQ2	42	34
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCCN(c3ccccc3F)C2)CC1	ZINC000875434568	GD	On-Demand	Anodyne	EPHX2	19	44
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCCN(c3ccccc3F)C2)CC1	ZINC000875434568	GD	On-Demand	Anodyne	GPBAR1	17	40
C[C@H]1CCc2ccccc2[C@@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875434579	EE	On-Demand	Anodyne	GHRHR	43	32
C[C@H]1CCc2ccccc2[C@@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875434579	EE	On-Demand	Anodyne	EPHX2	17	46
C[C@H]1CCc2ccccc2[C@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875434580	EE	On-Demand	Anodyne	GHRHR	43	32
C[C@H]1CCc2ccccc2[C@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875434580	EE	On-Demand	Anodyne	EPHX2	17	46
COC(=O)N(C)NC(=O)NC[C@H](C)Cc1ccc(OC)c(OC)c1	ZINC000875434604	ED	On-Demand	Reactive	MT-ND1	23	41
COC(=O)N(C)NC(=O)NC[C@@H](C)Cc1ccc(OC)c(OC)c1	ZINC000875434605	ED	On-Demand	Reactive	MT-ND1	23	41
CONC(=O)C1CCN(C(=O)N[C@H]2CCCN(c3ccccc3F)C2)CC1	ZINC000875434623	GD	On-Demand	Anodyne	KCNQ2	44	34
CONC(=O)C1CCN(C(=O)N[C@H]2CCCN(c3ccccc3F)C2)CC1	ZINC000875434623	GD	On-Demand	Anodyne	EPHX2	23	44
CONC(=O)C1CCN(C(=O)N[C@@H]2CCCN(c3ccccc3F)C2)CC1	ZINC000875434624	GD	On-Demand	Anodyne	KCNQ2	44	34
CONC(=O)C1CCN(C(=O)N[C@@H]2CCCN(c3ccccc3F)C2)CC1	ZINC000875434624	GD	On-Demand	Anodyne	EPHX2	23	44
O=C(N[C@H]1CCCN(c2ccccc2F)C1)N1CCC(CO)(CO)CC1	ZINC000875434675	FD	On-Demand	Anodyne	KCNQ2	45	34
O=C(N[C@@H]1CCCN(c2ccccc2F)C1)N1CCC(CO)(CO)CC1	ZINC000875434676	FD	On-Demand	Anodyne	KCNQ2	45	34
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)Cc1ccc(OC)c(OC)c1	ZINC000875434734	GF	On-Demand	Anodyne	SLC6A4	19	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)Cc1ccc(OC)c(OC)c1	ZINC000875434735	GF	On-Demand	Anodyne	SLC6A4	19	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)Cc1ccc(OC)c(OC)c1	ZINC000875434736	GF	On-Demand	Anodyne	SLC6A4	19	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)Cc1ccc(OC)c(OC)c1	ZINC000875434737	GF	On-Demand	Anodyne	SLC6A4	19	43
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H](C3CCCC3)C3CCC3)CC2)CC1	ZINC000875434760	GD	On-Demand	Anodyne	L3MBTL3	49	41
CN1CCN(C2CCN(C(=O)C(=O)N[C@H](C3CCCC3)C3CCC3)CC2)CC1	ZINC000875434761	GD	On-Demand	Anodyne	L3MBTL3	49	41
CC(C)(C)OC(=O)N1CC(CNC(=O)NCCN2CC[C@@H](O)C2)C1	ZINC000875434911	EC	On-Demand	Anodyne	CACNA1H	18	43
CC(C)(C)OC(=O)N1CC(CNC(=O)NCCN2CC[C@@H](O)C2)C1	ZINC000875434911	EC	On-Demand	Anodyne	CACNA1I	55	39
CC(C)(C)OC(=O)N1CC(CNC(=O)NCCN2CC[C@H](O)C2)C1	ZINC000875434912	EC	On-Demand	Anodyne	CACNA1H	18	43
CC(C)(C)OC(=O)N1CC(CNC(=O)NCCN2CC[C@H](O)C2)C1	ZINC000875434912	EC	On-Demand	Anodyne	CACNA1I	55	39
CN1CC[C@H](CNC(=O)NC[C@H]2C[C@H](O)C2)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000875434932	FF	On-Demand	Anodyne	CACNA1I	57	37
CN1CC[C@H](CNC(=O)NC[C@H]2C[C@H](O)C2)[C@H]1c1ccc(Cl)c(F)c1	ZINC000875434933	FF	On-Demand	Anodyne	CACNA1I	57	37
CN1CC[C@@H](CNC(=O)NC[C@H]2C[C@H](O)C2)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000875434934	FF	On-Demand	Anodyne	CACNA1I	57	37
CN1CC[C@@H](CNC(=O)NC[C@H]2C[C@H](O)C2)[C@H]1c1ccc(Cl)c(F)c1	ZINC000875434935	FF	On-Demand	Anodyne	CACNA1I	57	37
CN1CCCC[C@H](N(C)C(=O)NCC2CN(C(=O)OC(C)(C)C)C2)C1=O	ZINC000875434991	FD	On-Demand	Anodyne	CACNA1I	40	32
CN1CCCC[C@@H](N(C)C(=O)NCC2CN(C(=O)OC(C)(C)C)C2)C1=O	ZINC000875434992	FD	On-Demand	Anodyne	CACNA1I	40	32
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCCN(c3ccccc3F)C2)C1	ZINC000875435005	EF	On-Demand	Anodyne	SLC6A1	46	34
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCCN(c3ccccc3F)C2)C1	ZINC000875435005	EF	On-Demand	Anodyne	KCNQ2	57	37
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCCN(c3ccccc3F)C2)C1	ZINC000875435006	EF	On-Demand	Anodyne	SLC6A1	46	34
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCCN(c3ccccc3F)C2)C1	ZINC000875435006	EF	On-Demand	Anodyne	KCNQ2	57	37
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(c3ccccc3F)C2)C1	ZINC000875435007	EF	On-Demand	Anodyne	SLC6A1	46	34
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(c3ccccc3F)C2)C1	ZINC000875435007	EF	On-Demand	Anodyne	KCNQ2	57	37
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCCN(c3ccccc3F)C2)C1	ZINC000875435008	EF	On-Demand	Anodyne	SLC6A1	46	34
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCCN(c3ccccc3F)C2)C1	ZINC000875435008	EF	On-Demand	Anodyne	KCNQ2	57	37
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CC[C@@H]4SCCS[C@@H]43)cn2)cc1	ZINC000875435047	GG	On-Demand	Mild	ITK	15	47
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CC[C@@H]4SCCS[C@@H]43)cn2)cc1	ZINC000875435047	GG	On-Demand	Mild	PANC	40	34
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CC[C@H]4SCCS[C@@H]34)cn2)cc1	ZINC000875435048	GG	On-Demand	Mild	ITK	15	47
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CC[C@H]4SCCS[C@@H]34)cn2)cc1	ZINC000875435048	GG	On-Demand	Mild	PANC	40	34
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CC[C@H]4SCCS[C@H]34)cn2)cc1	ZINC000875435049	GG	On-Demand	Mild	ITK	15	47
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CC[C@H]4SCCS[C@H]34)cn2)cc1	ZINC000875435049	GG	On-Demand	Mild	PANC	40	34
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CC[C@@H]4SCCS[C@H]43)cn2)cc1	ZINC000875435050	GG	On-Demand	Mild	ITK	15	47
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CC[C@@H]4SCCS[C@H]43)cn2)cc1	ZINC000875435050	GG	On-Demand	Mild	PANC	40	34
CC(C)(C)OC(=O)N1CC(CNC(=O)N2CC(c3ccccc3)C2)C1	ZINC000875435071	EF	On-Demand	Anodyne	CACNA1I	40	31
COCCN(CC1CCN(C)CC1)C(=O)NCC1CN(C(=O)OC(C)(C)C)C1	ZINC000875435097	GD	On-Demand	Anodyne	CACNA1I	57	37
CC(C)(C)OC(=O)N1CC(CNC(=O)NC2CN(c3ccncn3)C2)C1	ZINC000875435105	FC	On-Demand	Anodyne	GPR119	34	54
CC(C)(C)OC(=O)N1CC(CNC(=O)N2CC[C@H](c3ccc(O)cc3)C2)C1	ZINC000875435127	GF	On-Demand	Anodyne	CACNA1I	56	33
CC(C)(C)OC(=O)N1CC(CNC(=O)N2CC[C@H](c3ccc(O)cc3)C2)C1	ZINC000875435127	GF	On-Demand	Anodyne	GPR119	44	45
CC(C)(C)OC(=O)N1CC(CNC(=O)N2CC[C@@H](c3ccc(O)cc3)C2)C1	ZINC000875435128	GF	On-Demand	Anodyne	CACNA1I	56	33
CC(C)(C)OC(=O)N1CC(CNC(=O)N2CC[C@@H](c3ccc(O)cc3)C2)C1	ZINC000875435128	GF	On-Demand	Anodyne	GPR119	44	45
CC(C)(C)OC(=O)N1CC(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875435154	FE	On-Demand	Anodyne	CACNA1I	60	34
CC(C)(C)OC(=O)N1CC(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875435155	FE	On-Demand	Anodyne	CACNA1I	60	34
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCCN(c2ccccc2F)C1	ZINC000875435175	EF	On-Demand	Anodyne	KCNQ2	65	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCCN(c2ccccc2F)C1	ZINC000875435176	EF	On-Demand	Anodyne	KCNQ2	65	40
COC(=O)[C@@]1(NC(=O)c2sccc2CC#N)CCCN(Cc2ccccc2)C1	ZINC000875435183	GF	On-Demand	Mild	SIGMAR1	31	40
CC(C)(C)OC(=O)N1CC(CNC(=O)N2CCCC[C@@H]2[C@@H]2CCCC[C@@H]2O)C1	ZINC000875435184	GF	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CC(CNC(=O)N2CCCC[C@@H]2[C@H]2CCCC[C@@H]2O)C1	ZINC000875435185	GF	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CC(CNC(=O)N2CCCC[C@@H]2[C@H]2CCCC[C@H]2O)C1	ZINC000875435186	GF	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CC(CNC(=O)N2CCCC[C@@H]2[C@@H]2CCCC[C@H]2O)C1	ZINC000875435187	GF	On-Demand	Anodyne	CACNA1I	41	32
C[C@H]1CCc2ccccc2[C@@H]1NC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875435199	FF	On-Demand	Anodyne	L3MBTL3	76	41
C[C@H]1CCc2ccccc2[C@H]1NC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875435201	FF	On-Demand	Anodyne	L3MBTL3	76	41
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)N[C@@H](C1CCCC1)C1CCC1	ZINC000875435242	GG	On-Demand	Anodyne	ROCK1	24	40
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)N[C@@H](C1CCCC1)C1CCC1	ZINC000875435242	GG	On-Demand	Anodyne	ROCK2	16	40
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)N[C@H](C1CCCC1)C1CCC1	ZINC000875435243	GG	On-Demand	Anodyne	ROCK1	24	40
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)N[C@H](C1CCCC1)C1CCC1	ZINC000875435243	GG	On-Demand	Anodyne	ROCK2	16	40
COC(=O)N(C)NC(=O)N[C@@H]1CCCN(c2ccccc2F)C1	ZINC000875435311	DD	On-Demand	Reactive	KCNQ2	42	34
COC(=O)N(C)NC(=O)N[C@H]1CCCN(c2ccccc2F)C1	ZINC000875435312	DD	On-Demand	Reactive	KCNQ2	42	34
CC(C)(C)OC(=O)N1CC(CNC(=O)N[C@H]2CCC[C@@H]2O)C1	ZINC000875435331	DD	On-Demand	Anodyne	CACNA1I	46	33
C[C@H]1CCc2ccccc2[C@@H]1NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875435375	EF	On-Demand	Anodyne	GHRHR	64	32
C[C@H]1CCc2ccccc2[C@@H]1NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875435375	EF	On-Demand	Anodyne	CALCRL	18	47
C[C@H]1CCc2ccccc2[C@H]1NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875435376	EF	On-Demand	Anodyne	GHRHR	64	32
C[C@H]1CCc2ccccc2[C@H]1NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875435376	EF	On-Demand	Anodyne	CALCRL	18	47
CC(=O)C1CCN(C(=O)N[C@H]2CCCN(c3ccccc3F)C2)CC1	ZINC000875435402	EF	On-Demand	Anodyne	KCNQ2	57	37
CC(=O)C1CCN(C(=O)N[C@H]2CCCN(c3ccccc3F)C2)CC1	ZINC000875435402	EF	On-Demand	Anodyne	EPHX2	20	43
CC(=O)C1CCN(C(=O)N[C@@H]2CCCN(c3ccccc3F)C2)CC1	ZINC000875435403	EF	On-Demand	Anodyne	KCNQ2	57	37
CC(=O)C1CCN(C(=O)N[C@@H]2CCCN(c3ccccc3F)C2)CC1	ZINC000875435403	EF	On-Demand	Anodyne	EPHX2	20	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(c3ccccc3F)C2)C1	ZINC000875435461	GF	On-Demand	Anodyne	KCNQ2	56	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(c3ccccc3F)C2)C1	ZINC000875435461	GF	On-Demand	Anodyne	BIRC2	38	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(c3ccccc3F)C2)C1	ZINC000875435464	GF	On-Demand	Anodyne	KCNQ2	56	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(c3ccccc3F)C2)C1	ZINC000875435464	GF	On-Demand	Anodyne	BIRC2	38	40
CC(C)c1ccc2c(c1)[C@@H](NC(=O)N1CCC(N3CCN(C)CC3)CC1)CCC2	ZINC000875435537	GH	On-Demand	Anodyne	L3MBTL3	67	42
O=C(N[C@H]1CCCN(c2ccccc2F)C1)N1CCC2(CCNC2=O)CC1	ZINC000875435558	FE	On-Demand	Anodyne	CALCRL	24	49
O=C(N[C@@H]1CCCN(c2ccccc2F)C1)N1CCC2(CCNC2=O)CC1	ZINC000875435559	FE	On-Demand	Anodyne	CALCRL	24	49
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCC[C@H](c3nc4ccccc4[nH]3)C2)CC1	ZINC000875435568	GF	On-Demand	Anodyne	SMO	15	53
CC(=O)C1CCN(C(=O)C(=O)N[C@@H]2CCC[C@@H](c3nc4ccccc4[nH]3)C2)CC1	ZINC000875435570	GF	On-Demand	Anodyne	SMO	15	53
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCC[C@H](c3nc4ccccc4[nH]3)C2)CC1	ZINC000875435572	GF	On-Demand	Anodyne	SMO	15	53
CC(=O)C1CCN(C(=O)C(=O)N[C@H]2CCC[C@@H](c3nc4ccccc4[nH]3)C2)CC1	ZINC000875435574	GF	On-Demand	Anodyne	SMO	15	53
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2CCCN(c3ccccc3F)C2)CC1	ZINC000875435594	GD	On-Demand	Anodyne	EPHX2	15	44
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2CCCN(c3ccccc3F)C2)CC1	ZINC000875435598	GD	On-Demand	Anodyne	EPHX2	15	44
O=C(NCc1noc(C2CC2)n1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875435611	EE	On-Demand	Anodyne	EPHX2	18	41
O=C(NCc1noc(C2CC2)n1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875435611	EE	On-Demand	Anodyne	SMO	45	49
O=C(NCc1noc(C2CC2)n1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875435611	EE	On-Demand	Anodyne	ETHR	53	37
O=C(NCc1noc(C2CC2)n1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875435612	EE	On-Demand	Anodyne	EPHX2	18	41
O=C(NCc1noc(C2CC2)n1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875435612	EE	On-Demand	Anodyne	SMO	45	49
O=C(NCc1noc(C2CC2)n1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875435612	EE	On-Demand	Anodyne	ETHR	53	37
O=C(NCc1noc(C2CC2)n1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875435613	FF	On-Demand	Anodyne	SMO	38	41
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)nc1	ZINC000875435652	GE	On-Demand	Anodyne	DRD2	22	42
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)nc1	ZINC000875435652	GE	On-Demand	Anodyne	DRD4	50	41
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)nc1	ZINC000875435652	GE	On-Demand	Anodyne	ACHE	64	62
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)nc1	ZINC000875435652	GE	On-Demand	Anodyne	DRD3	18	41
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)nc1	ZINC000875435652	GE	On-Demand	Anodyne	CHRM3	15	40
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)nc1	ZINC000875435652	GE	On-Demand	Anodyne	SIGMAR1	52	42
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)nc1	ZINC000875435652	GE	On-Demand	Anodyne	SSTR5	43	37
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)nc1	ZINC000875435652	GE	On-Demand	Anodyne	BCHE	18	49
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)nc1	ZINC000875435652	GE	On-Demand	Anodyne	SCN5A	29	43
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)nc1	ZINC000875435652	GE	On-Demand	Anodyne	MCHR1	33	43
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)nc1	ZINC000875435652	GE	On-Demand	Anodyne	CACNA1I	26	40
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)nc1	ZINC000875435652	GE	On-Demand	Anodyne	SIRT3	52	32
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)nc1	ZINC000875435652	GE	On-Demand	Anodyne	SIRT2	53	34
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)nc1	ZINC000875435652	GE	On-Demand	Anodyne	SIRT1	52	39
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(Cc3ccccc3)CC2)nc1	ZINC000875435652	GE	On-Demand	Anodyne	MGEA5	33	40
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccc(C)cn3)CC2)c(OC)c1	ZINC000875435694	GD	On-Demand	Clean	HTR1A	33	43
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccc(C)cn3)CC2)c(OC)c1	ZINC000875435694	GD	On-Demand	Clean	DRD2	24	40
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccc(C)cn3)CC2)c(OC)c1	ZINC000875435694	GD	On-Demand	Clean	ADRA1D	19	42
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccc(C)cn3)CC2)c(OC)c1	ZINC000875435694	GD	On-Demand	Clean	ADRA1A	18	42
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccc(C)cn3)CC2)c(OC)c1	ZINC000875435694	GD	On-Demand	Clean	PDGFRB	49	39
COc1ccc(N2CCN(C(=O)C(=O)NCc3ccc(C)cn3)CC2)c(OC)c1	ZINC000875435694	GD	On-Demand	Clean	NPBWR1	41	40
Cc1ccc(CNC(=O)C(=O)N2CCN(c3ccc(F)cc3F)CC2)nc1	ZINC000875435708	FD	On-Demand	Anodyne	NPY2R	45	34
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccc(C)cn2)C1	ZINC000875435740	DD	On-Demand	Anodyne	HCRTR1	19	40
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCc2ccc(C)cn2)C1	ZINC000875435740	DD	On-Demand	Anodyne	HCRTR2	25	40
O=C(NCCO)C1CCN(C(=O)NCC2(c3ccccc3Cl)CC2)CC1	ZINC000875435782	GD	On-Demand	Anodyne	EPHX2	19	44
O=C(NCCO)C1CCN(C(=O)NCC2(c3ccccc3Cl)CC2)CC1	ZINC000875435782	GD	On-Demand	Anodyne	CACNA1G	15	40
CC[C@@H](NC(=O)NCc1ccnc(OCCN(C)C)c1)[C@@H](O)c1ccccc1	ZINC000875435865	GE	On-Demand	Anodyne	TACR3	26	43
CC[C@@H](NC(=O)NCc1ccnc(OCCN(C)C)c1)[C@H](O)c1ccccc1	ZINC000875435866	GE	On-Demand	Anodyne	TACR3	26	43
Cc1ccc(CNC(=O)C(=O)N2CCN(c3ccc(F)cc3C#N)CC2)nc1	ZINC000875435944	GD	On-Demand	Mild	P2RY12	15	40
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCc1ccc(C)cn1)CC2	ZINC000875436007	GE	On-Demand	Anodyne	HCRTR1	15	45
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCc1ccc(C)cn1)CC2	ZINC000875436008	GE	On-Demand	Anodyne	HCRTR1	15	45
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc([N+](=O)[O-])c2ccccc12	ZINC000875436058	EG	On-Demand	Reactive	COLA	72	31
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc([N+](=O)[O-])c2ccccc12	ZINC000875436058	EG	On-Demand	Reactive	CAPNS1	56	31
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc([N+](=O)[O-])c2ccccc12	ZINC000875436058	EG	On-Demand	Reactive	HLA-DRB1	41	33
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc([N+](=O)[O-])c2ccccc12	ZINC000875436058	EG	On-Demand	Reactive	CAPN1	51	41
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc([N+](=O)[O-])c2ccccc12	ZINC000875436058	EG	On-Demand	Reactive	CAPN2	60	33
CC(=O)N[C@H](CC(C)C)C(=O)Oc1ccc([N+](=O)[O-])c2ccccc12	ZINC000875436058	EG	On-Demand	Reactive	NPR	64	43
O=C(NCCc1cccc(OCc2ccccc2)c1)N1CCC(CO)(CO)CC1	ZINC000875436156	GF	On-Demand	Anodyne	HRH2	27	40
O=C(NCCc1cccc(OCc2ccccc2)c1)N1CCC(CO)(CO)CC1	ZINC000875436156	GF	On-Demand	Anodyne	FFAR1	28	44
O=C(NCCc1cccc(OCc2ccccc2)c1)N1CCC(CO)(CO)CC1	ZINC000875436156	GF	On-Demand	Anodyne	CRTM	49	35
O=C(NCCc1cccc(OCc2ccccc2)c1)N1CCC(CO)(CO)CC1	ZINC000875436156	GF	On-Demand	Anodyne	PDS	41	35
O=C(NCc1noc(C2CC2)n1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875436189	EE	On-Demand	Anodyne	CPT1A	43	40
O=C(NCc1noc(C2CC2)n1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875436189	EE	On-Demand	Anodyne	SMO	36	40
O=C(NCc1noc(C2CC2)n1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875436190	EE	On-Demand	Anodyne	CPT1A	43	40
O=C(NCc1noc(C2CC2)n1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875436190	EE	On-Demand	Anodyne	SMO	36	40
O=C(NCc1noc(C2CC2)n1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875436191	EE	On-Demand	Anodyne	CPT1A	43	40
O=C(NCc1noc(C2CC2)n1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875436191	EE	On-Demand	Anodyne	SMO	36	40
O=C(NCc1noc(C2CC2)n1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875436192	EE	On-Demand	Anodyne	CPT1A	43	40
O=C(NCc1noc(C2CC2)n1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875436192	EE	On-Demand	Anodyne	SMO	36	40
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CCO[C@@H]2C)CC1	ZINC000875436251	EG	On-Demand	Anodyne	EPHX2	20	45
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CCO[C@@H]2C)CC1	ZINC000875436251	EG	On-Demand	Anodyne	RBP4	35	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2CCO[C@@H]2C)CC1	ZINC000875436252	EG	On-Demand	Anodyne	EPHX2	20	45
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2CCO[C@@H]2C)CC1	ZINC000875436252	EG	On-Demand	Anodyne	RBP4	35	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2CCO[C@H]2C)CC1	ZINC000875436253	EG	On-Demand	Anodyne	EPHX2	20	45
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2CCO[C@H]2C)CC1	ZINC000875436253	EG	On-Demand	Anodyne	RBP4	35	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CCO[C@H]2C)CC1	ZINC000875436254	EG	On-Demand	Anodyne	EPHX2	20	45
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CCO[C@H]2C)CC1	ZINC000875436254	EG	On-Demand	Anodyne	RBP4	35	41
Cc1ccc(CNC(=O)C(=O)NC[C@H]2CN(Cc3ccccc3C)CCO2)nc1	ZINC000875436273	GD	On-Demand	Anodyne	PDE8B	43	33
Cc1ccc(CNC(=O)C(=O)NC[C@@H]2CN(Cc3ccccc3C)CCO2)nc1	ZINC000875436274	GD	On-Demand	Anodyne	PDE8B	43	33
O=CN1CCCN(C(=O)NCCc2cccc(OCc3ccccc3)c2)CC1	ZINC000875436349	GF	On-Demand	Anodyne	FAAH	25	40
O=CN1CCCN(C(=O)NCCc2cccc(OCc3ccccc3)c2)CC1	ZINC000875436349	GF	On-Demand	Anodyne	DPP7	21	41
O=CN1CCCN(C(=O)NCCc2cccc(OCc3ccccc3)c2)CC1	ZINC000875436349	GF	On-Demand	Anodyne	FFAR1	21	42
Cc1ccc(CNC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)nc1	ZINC000875436515	FE	On-Demand	Anodyne	C3AR1	37	43
Cc1ccc(CNC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)nc1	ZINC000875436516	FE	On-Demand	Anodyne	C3AR1	37	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)COc1ccccc1OC	ZINC000875436517	GE	On-Demand	Anodyne	SLC6A3	43	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)COc1ccccc1OC	ZINC000875436518	GE	On-Demand	Anodyne	SLC6A3	43	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)COc1ccccc1OC	ZINC000875436519	GE	On-Demand	Anodyne	SLC6A3	43	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)COc1ccccc1OC	ZINC000875436520	GE	On-Demand	Anodyne	SLC6A3	43	39
O=C(N[C@@H]1CC[C@@H]2C[C@H]2C1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875436587	FF	On-Demand	Anodyne	CHRNA7	40	36
O=C(N[C@@H]1CC[C@@H]2C[C@H]2C1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875436587	FF	On-Demand	Anodyne	C3AR1	40	41
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H]1CC[C@@H]2C[C@H]2C1	ZINC000875436588	FF	On-Demand	Anodyne	CHRNA7	40	36
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H]1CC[C@@H]2C[C@H]2C1	ZINC000875436588	FF	On-Demand	Anodyne	C3AR1	40	41
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H]1CC[C@@H]2C[C@@H]2C1	ZINC000875436589	FF	On-Demand	Anodyne	CHRNA7	40	36
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H]1CC[C@@H]2C[C@@H]2C1	ZINC000875436589	FF	On-Demand	Anodyne	C3AR1	40	41
O=C(N[C@@H]1CC[C@@H]2C[C@@H]2C1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875436590	FF	On-Demand	Anodyne	CHRNA7	40	36
O=C(N[C@@H]1CC[C@@H]2C[C@@H]2C1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875436590	FF	On-Demand	Anodyne	C3AR1	40	41
COc1cccc(C(C)(C)C(=O)N2CCN(c3nccnc3C#N)C[C@@H]2C)c1	ZINC000875436628	GE	On-Demand	Mild	DRD4	40	30
COc1cccc(C(C)(C)C(=O)N2CCN(c3nccnc3C#N)C[C@@H]2C)c1	ZINC000875436628	GE	On-Demand	Mild	LIMK2	65	41
COc1cccc(C(C)(C)C(=O)N2CCN(c3nccnc3C#N)C[C@H]2C)c1	ZINC000875436630	GE	On-Demand	Mild	DRD4	40	30
COc1cccc(C(C)(C)C(=O)N2CCN(c3nccnc3C#N)C[C@H]2C)c1	ZINC000875436630	GE	On-Demand	Mild	LIMK2	65	41
O=C(NCCCCCCc1ccccc1)C(=O)NCc1ncc2c(n1)CCOC2	ZINC000875436708	GE	On-Demand	Anodyne	FAAH	56	36
O=C(NCCCCCCc1ccccc1)C(=O)NCc1ncc2c(n1)CCOC2	ZINC000875436708	GE	On-Demand	Anodyne	CES1	59	34
O=C(NCCCCCCc1ccccc1)C(=O)NCc1ncc2c(n1)CCOC2	ZINC000875436708	GE	On-Demand	Anodyne	CES1D	43	31
Cc1nnc(NNC(=O)NCCc2cccc(OCc3ccccc3)c2)n1C	ZINC000875436751	GF	On-Demand	Reactive	FFAR1	32	41
Cc1nnc(NNC(=O)NCCc2cccc(OCc3ccccc3)c2)n1C	ZINC000875436751	GF	On-Demand	Reactive	CRTM	41	35
Cc1nnc(NNC(=O)NCCc2cccc(OCc3ccccc3)c2)n1C	ZINC000875436751	GF	On-Demand	Reactive	PDS	42	35
Cc1ccc(CNC(=O)C(=O)NC[C@H]2CN(Cc3cccc(C)c3)CCO2)nc1	ZINC000875436804	GD	On-Demand	Anodyne	PDE8B	54	32
Cc1ccc(CNC(=O)C(=O)NC[C@@H]2CN(Cc3cccc(C)c3)CCO2)nc1	ZINC000875436805	GD	On-Demand	Anodyne	PDE8B	54	32
CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875436932	ED	On-Demand	Anodyne	EPHX2	26	52
CNC(=O)[C@@H]1CCC[C@H]1NC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875436934	ED	On-Demand	Anodyne	EPHX2	26	52
CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875436936	ED	On-Demand	Anodyne	EPHX2	26	52
CNC(=O)[C@@H]1CCC[C@H]1NC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875436938	ED	On-Demand	Anodyne	EPHX2	26	52
O=C(NCCc1cccc(OCc2ccccc2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875436974	FF	On-Demand	Anodyne	HRH2	26	41
O=C(NCCc1cccc(OCc2ccccc2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875436974	FF	On-Demand	Anodyne	FAAH	17	40
O=C(NCCc1cccc(OCc2ccccc2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875436974	FF	On-Demand	Anodyne	FFAR1	28	45
O=C(NCCc1cccc(OCc2ccccc2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875436974	FF	On-Demand	Anodyne	CRTM	46	36
O=C(NCCc1cccc(OCc2ccccc2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875436974	FF	On-Demand	Anodyne	PDS	53	37
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ccn(C)n2)CC1	ZINC000875437029	EF	On-Demand	Anodyne	DRD2	19	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ccn(C)n2)CC1	ZINC000875437031	EF	On-Demand	Anodyne	DRD2	19	43
CN(c1ccccc1NC(=O)c1cccn(C2CC2)c1=O)S(C)(=O)=O	ZINC000875437040	FD	On-Demand	Anodyne	CCR8	57	35
O=C(N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1=O)N1CCC(CO)(CO)CC1	ZINC000875437131	GD	On-Demand	Anodyne	CACNA1H	48	33
O=C(N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1=O)N1CCC(CO)(CO)CC1	ZINC000875437132	GD	On-Demand	Anodyne	CACNA1H	48	33
CCOC1CC2(C1)C[C@H]2C(=O)Nc1c(SC)cnn1-c1ccccc1	ZINC000875437170	FH	On-Demand	Anodyne	TIMP3	52	30
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cn1ncc2ccccc2c1=O	ZINC000875437237	GD	On-Demand	Anodyne	SLC6A3	42	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)Cn1ncc2ccccc2c1=O	ZINC000875437240	GD	On-Demand	Anodyne	SLC6A3	42	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cn1ncc2ccccc2c1=O	ZINC000875437243	GD	On-Demand	Anodyne	SLC6A3	42	36
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(C)[C@H]2c2ccc(F)c(F)c2)C1	ZINC000875437250	FC	On-Demand	Anodyne	ADRA1A	47	34
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccc(F)c(F)c2)C1	ZINC000875437252	FC	On-Demand	Anodyne	ADRA1A	47	34
COC(=O)C1(O)CN(C(=O)N[C@H]2CCN(C)[C@@H]2c2ccc(F)c(F)c2)C1	ZINC000875437253	FC	On-Demand	Anodyne	ADRA1A	47	34
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccc(F)c(F)c2)C1	ZINC000875437255	FC	On-Demand	Anodyne	ADRA1A	47	34
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)Cn1ncc2ccccc2c1=O	ZINC000875437385	GD	On-Demand	Anodyne	SLC6A3	42	36
CCCCCCCNC(=O)C(=O)NCc1ccc(C)cn1	ZINC000875437415	CE	On-Demand	Mild	ASAH1	86	36
CN1CC[C@H](NC(=O)N2CCC(CO)(CO)CC2)[C@H]1c1ccc(F)c(F)c1	ZINC000875437491	GD	On-Demand	Anodyne	CACNA1H	63	39
CN1CC[C@H](NC(=O)N2CCC(CO)(CO)CC2)[C@H]1c1ccc(F)c(F)c1	ZINC000875437491	GD	On-Demand	Anodyne	ADRA1A	48	35
CN1CC[C@H](NC(=O)N2CCC(CO)(CO)CC2)[C@@H]1c1ccc(F)c(F)c1	ZINC000875437493	GD	On-Demand	Anodyne	CACNA1H	63	39
CN1CC[C@H](NC(=O)N2CCC(CO)(CO)CC2)[C@@H]1c1ccc(F)c(F)c1	ZINC000875437493	GD	On-Demand	Anodyne	ADRA1A	48	35
CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875437542	GF	On-Demand	Reactive	LTA4H	41	42
CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875437542	GF	On-Demand	Reactive	ADAM17	38	55
CNC(=O)[C@@H]1CCC[C@H]1NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875437549	GF	On-Demand	Reactive	LTA4H	41	42
CNC(=O)[C@@H]1CCC[C@H]1NC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875437549	GF	On-Demand	Reactive	ADAM17	38	55
CCO[C@@H](C(=O)Nc1ccccc1N(C)S(C)(=O)=O)C1CCCC1	ZINC000875437599	FF	On-Demand	Anodyne	AMY2	43	31
CN(c1ccccc1NC(=O)c1noc2c1CC(C)(C)CC2)S(C)(=O)=O	ZINC000875437662	GF	On-Demand	Anodyne	PANC	49	33
Cc1ccc(CNC(=O)C(=O)NCc2cc(C(F)(F)F)cc(Cl)n2)nc1	ZINC000875437699	GE	On-Demand	Anodyne	ATF1	53	34
Cc1ccc(CNC(=O)C(=O)NCc2cc(C(F)(F)F)cc(Cl)n2)nc1	ZINC000875437699	GE	On-Demand	Anodyne	NFKB1	49	34
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)nc1	ZINC000875437713	ED	On-Demand	Anodyne	SIRT3	54	33
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)nc1	ZINC000875437713	ED	On-Demand	Anodyne	SIRT2	55	36
Cc1ccc(CNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)nc1	ZINC000875437713	ED	On-Demand	Anodyne	SIRT1	54	37
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)N[C@@H]3CC[C@@H]4C[C@H]4C3)C2)c1	ZINC000875437789	GD	On-Demand	Anodyne	DRD4	28	41
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)N[C@@H]3CC[C@H]4C[C@@H]4C3)C2)c1	ZINC000875437790	GD	On-Demand	Anodyne	DRD4	28	41
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)N[C@@H]3CC[C@@H]4C[C@@H]4C3)C2)c1	ZINC000875437791	GD	On-Demand	Anodyne	DRD4	28	41
Cc1cccc(CN2CCO[C@H](CNC(=O)C(=O)N[C@@H]3CC[C@H]4C[C@H]4C3)C2)c1	ZINC000875437792	GD	On-Demand	Anodyne	DRD4	28	41
O=C(NC1(C(=O)N2CCC[C@H]3COCC[C@H]32)CC1)OCc1ccccc1	ZINC000875437816	FE	On-Demand	Anodyne	ACE	20	41
O=C(NC1(C(=O)N2CCC[C@H]3COCC[C@H]32)CC1)OCc1ccccc1	ZINC000875437816	FE	On-Demand	Anodyne	CTRA_BOVIN	65	34
O=C(NC1(C(=O)N2CCC[C@H]3COCC[C@H]32)CC1)OCc1ccccc1	ZINC000875437816	FE	On-Demand	Anodyne	CTSG	45	34
O=C(NC1(C(=O)N2CCC[C@H]3COCC[C@H]32)CC1)OCc1ccccc1	ZINC000875437816	FE	On-Demand	Anodyne	CTSK	18	44
O=C(NC1(C(=O)N2CCC[C@H]3COCC[C@H]32)CC1)OCc1ccccc1	ZINC000875437816	FE	On-Demand	Anodyne	CTSL	23	44
O=C(NC1(C(=O)N2CCC[C@H]3COCC[C@H]32)CC1)OCc1ccccc1	ZINC000875437816	FE	On-Demand	Anodyne	PREP	43	41
O=C(NC1(C(=O)N2CCC[C@H]3COCC[C@H]32)CC1)OCc1ccccc1	ZINC000875437816	FE	On-Demand	Anodyne	CELA2A	53	34
O=C(NC1(C(=O)N2CCC[C@H]3COCC[C@H]32)CC1)OCc1ccccc1	ZINC000875437816	FE	On-Demand	Anodyne	KLK5	40	40
O=C(NC1(C(=O)N2CCC[C@H]3COCC[C@H]32)CC1)OCc1ccccc1	ZINC000875437816	FE	On-Demand	Anodyne	SLC12A5	68	37
O=C(NC1(C(=O)N2CCC[C@@H]3COCC[C@H]32)CC1)OCc1ccccc1	ZINC000875437817	FE	On-Demand	Anodyne	ACE	20	41
O=C(NC1(C(=O)N2CCC[C@@H]3COCC[C@H]32)CC1)OCc1ccccc1	ZINC000875437817	FE	On-Demand	Anodyne	CTRA_BOVIN	65	34
O=C(NC1(C(=O)N2CCC[C@@H]3COCC[C@H]32)CC1)OCc1ccccc1	ZINC000875437817	FE	On-Demand	Anodyne	CTSG	45	34
O=C(NC1(C(=O)N2CCC[C@@H]3COCC[C@H]32)CC1)OCc1ccccc1	ZINC000875437817	FE	On-Demand	Anodyne	CTSK	18	44
O=C(NC1(C(=O)N2CCC[C@@H]3COCC[C@H]32)CC1)OCc1ccccc1	ZINC000875437817	FE	On-Demand	Anodyne	CTSL	23	44
O=C(NC1(C(=O)N2CCC[C@@H]3COCC[C@H]32)CC1)OCc1ccccc1	ZINC000875437817	FE	On-Demand	Anodyne	PREP	43	41
O=C(NC1(C(=O)N2CCC[C@@H]3COCC[C@H]32)CC1)OCc1ccccc1	ZINC000875437817	FE	On-Demand	Anodyne	CELA2A	53	34
O=C(NC1(C(=O)N2CCC[C@@H]3COCC[C@H]32)CC1)OCc1ccccc1	ZINC000875437817	FE	On-Demand	Anodyne	KLK5	40	40
O=C(NC1(C(=O)N2CCC[C@@H]3COCC[C@H]32)CC1)OCc1ccccc1	ZINC000875437817	FE	On-Demand	Anodyne	SLC12A5	68	37
O=C(NC1(C(=O)N2CCC[C@H]3COCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875437818	FE	On-Demand	Anodyne	ACE	20	41
O=C(NC1(C(=O)N2CCC[C@H]3COCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875437818	FE	On-Demand	Anodyne	CTRA_BOVIN	65	34
O=C(NC1(C(=O)N2CCC[C@H]3COCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875437818	FE	On-Demand	Anodyne	CTSG	45	34
O=C(NC1(C(=O)N2CCC[C@H]3COCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875437818	FE	On-Demand	Anodyne	CTSK	18	44
O=C(NC1(C(=O)N2CCC[C@H]3COCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875437818	FE	On-Demand	Anodyne	CTSL	23	44
O=C(NC1(C(=O)N2CCC[C@H]3COCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875437818	FE	On-Demand	Anodyne	PREP	43	41
O=C(NC1(C(=O)N2CCC[C@H]3COCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875437818	FE	On-Demand	Anodyne	CELA2A	53	34
O=C(NC1(C(=O)N2CCC[C@H]3COCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875437818	FE	On-Demand	Anodyne	KLK5	40	40
O=C(NC1(C(=O)N2CCC[C@H]3COCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875437818	FE	On-Demand	Anodyne	SLC12A5	68	37
O=C(NC1(C(=O)N2CCC[C@@H]3COCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875437819	FE	On-Demand	Anodyne	ACE	20	41
O=C(NC1(C(=O)N2CCC[C@@H]3COCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875437819	FE	On-Demand	Anodyne	CTRA_BOVIN	65	34
O=C(NC1(C(=O)N2CCC[C@@H]3COCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875437819	FE	On-Demand	Anodyne	CTSG	45	34
O=C(NC1(C(=O)N2CCC[C@@H]3COCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875437819	FE	On-Demand	Anodyne	CTSK	18	44
O=C(NC1(C(=O)N2CCC[C@@H]3COCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875437819	FE	On-Demand	Anodyne	CTSL	23	44
O=C(NC1(C(=O)N2CCC[C@@H]3COCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875437819	FE	On-Demand	Anodyne	PREP	43	41
O=C(NC1(C(=O)N2CCC[C@@H]3COCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875437819	FE	On-Demand	Anodyne	CELA2A	53	34
O=C(NC1(C(=O)N2CCC[C@@H]3COCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875437819	FE	On-Demand	Anodyne	KLK5	40	40
O=C(NC1(C(=O)N2CCC[C@@H]3COCC[C@@H]32)CC1)OCc1ccccc1	ZINC000875437819	FE	On-Demand	Anodyne	SLC12A5	68	37
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3CC[C@H]4C[C@@H]4C3)CC2)CC1	ZINC000875437834	EC	On-Demand	Anodyne	L3MBTL3	53	41
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3CC[C@@H]4C[C@@H]4C3)CC2)CC1	ZINC000875437835	EC	On-Demand	Anodyne	L3MBTL3	53	41
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3CC[C@H]4C[C@H]4C3)CC2)CC1	ZINC000875437836	EC	On-Demand	Anodyne	L3MBTL3	53	41
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3CC[C@@H]4C[C@H]4C3)CC2)CC1	ZINC000875437837	EC	On-Demand	Anodyne	L3MBTL3	53	41
CC(=O)N1CCC[C@@H]1C(=O)Nc1sc2c(c1C(N)=O)CCC(C)(C)C2	ZINC000875437937	FE	On-Demand	Anodyne	LGMN	52	35
Cc1ccc(CNC(=O)C(=O)N2C[C@@H]3CC[C@H](C2)N3C(=O)OC(C)(C)C)nc1	ZINC000875438016	GD	On-Demand	Anodyne	GPR119	31	41
CC(C)c1ccc2c(c1)[C@H](NC(=O)N1CCC(N3CCN(C)CC3)CC1)CCC2	ZINC000875438027	GH	On-Demand	Anodyne	L3MBTL3	67	42
O=C(NCc1noc(C2CC2)n1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875438041	FF	On-Demand	Anodyne	CPT1A	78	44
O=C(NCc1noc(C2CC2)n1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875438041	FF	On-Demand	Anodyne	SMO	37	41
O=C(NCc1noc(C2CC2)n1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875438042	FF	On-Demand	Anodyne	CPT1A	78	44
O=C(NCc1noc(C2CC2)n1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875438042	FF	On-Demand	Anodyne	SMO	37	41
O=C(NCc1noc(C2CC2)n1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875438043	FF	On-Demand	Anodyne	CPT1A	78	44
O=C(NCc1noc(C2CC2)n1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875438043	FF	On-Demand	Anodyne	SMO	37	41
O=C(NCc1noc(C2CC2)n1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875438044	FF	On-Demand	Anodyne	CPT1A	78	44
O=C(NCc1noc(C2CC2)n1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875438044	FF	On-Demand	Anodyne	SMO	37	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	F2	59	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	PLG	38	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	PRSS1	22	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	ACE	96	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	OPRM1	47	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	OPRD1	35	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	P2RY12	48	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	CELA1	34	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	ELANE	35	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	MME	71	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	TACR1	21	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	TRHR	51	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	PGC	54	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	CMA1	63	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	CTRA_BOVIN	84	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	PRCP	15	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	CTSB	45	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	PAPA1_CARPA	47	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	TRY1_BOVIN	90	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	CYSP_TRYCR	62	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	NTSR1	97	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	NTSR2	67	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	CTSG	56	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	CTSK	42	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	CTSL	43	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	NPFFR2	53	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	TIMP3	79	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	DPP4	15	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	PREP	41	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	CAPNS1	77	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	HLA-DRB1	73	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	CELA2A	76	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	REN	89	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	REN1	47	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	CTSS	25	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	CAPN1	96	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	CTRC	31	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	CAPN2	98	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	CTSE	62	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	ACE2	87	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	PGA5	43	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	KLK5	40	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	KLK1	27	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	FPR1	42	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	XIAP	44	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	Q9N6S8_PLAFA	15	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	BRCA1	70	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@@H]21	ZINC000875438073	FE	On-Demand	Anodyne	TMPRSS11D	55	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	F2	59	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	PLG	38	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	PRSS1	22	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	ACE	96	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	OPRM1	47	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	OPRD1	35	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	P2RY12	48	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	CELA1	34	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	ELANE	35	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	MME	71	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	TACR1	21	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	TRHR	51	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	PGC	54	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	CMA1	63	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	CTRA_BOVIN	84	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	PRCP	15	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	CTSB	45	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	PAPA1_CARPA	47	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	TRY1_BOVIN	90	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	CYSP_TRYCR	62	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	NTSR1	97	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	NTSR2	67	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	CTSG	56	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	CTSK	42	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	CTSL	43	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	NPFFR2	53	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	TIMP3	79	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	DPP4	15	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	PREP	41	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	CAPNS1	77	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	HLA-DRB1	73	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	CELA2A	76	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	REN	89	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	REN1	47	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	CTSS	25	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	CAPN1	96	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	CTRC	31	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	CAPN2	98	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	CTSE	62	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	ACE2	87	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	PGA5	43	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	KLK5	40	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	KLK1	27	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	FPR1	42	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	XIAP	44	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	Q9N6S8_PLAFA	15	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	BRCA1	70	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@@H]21	ZINC000875438074	FE	On-Demand	Anodyne	TMPRSS11D	55	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	F2	59	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	PLG	38	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	PRSS1	22	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	ACE	96	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	OPRM1	47	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	OPRD1	35	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	P2RY12	48	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	CELA1	34	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	ELANE	35	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	MME	71	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	TACR1	21	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	TRHR	51	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	PGC	54	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	CMA1	63	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	CTRA_BOVIN	84	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	PRCP	15	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	CTSB	45	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	PAPA1_CARPA	47	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	TRY1_BOVIN	90	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	CYSP_TRYCR	62	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	NTSR1	97	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	NTSR2	67	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	CTSG	56	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	CTSK	42	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	CTSL	43	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	NPFFR2	53	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	TIMP3	79	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	DPP4	15	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	PREP	41	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	CAPNS1	77	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	HLA-DRB1	73	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	CELA2A	76	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	REN	89	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	REN1	47	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	CTSS	25	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	CAPN1	96	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	CTRC	31	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	CAPN2	98	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	CTSE	62	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	ACE2	87	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	PGA5	43	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	KLK5	40	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	KLK1	27	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	FPR1	42	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	XIAP	44	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	Q9N6S8_PLAFA	15	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	BRCA1	70	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2COCC[C@H]21	ZINC000875438075	FE	On-Demand	Anodyne	TMPRSS11D	55	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	F2	59	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	PLG	38	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	PRSS1	22	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	ACE	96	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	OPRM1	47	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	OPRD1	35	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	P2RY12	48	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	CELA1	34	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	ELANE	35	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	MME	71	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	TACR1	21	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	TRHR	51	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	PGC	54	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	CMA1	63	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	CTRA_BOVIN	84	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	PRCP	15	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	CTSB	45	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	PAPA1_CARPA	47	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	TRY1_BOVIN	90	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	CYSP_TRYCR	62	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	NTSR1	97	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	NTSR2	67	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	CTSG	56	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	CTSK	42	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	CTSL	43	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	NPFFR2	53	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	TIMP3	79	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	DPP4	15	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	PREP	41	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	CAPNS1	77	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	HLA-DRB1	73	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	CELA2A	76	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	REN	89	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	REN1	47	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	CTSS	25	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	CAPN1	96	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	CTRC	31	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	CAPN2	98	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	CTSE	62	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	ACE2	87	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	PGA5	43	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	KLK5	40	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	KLK1	27	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	FPR1	42	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	XIAP	44	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	Q9N6S8_PLAFA	15	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	BRCA1	70	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2COCC[C@H]21	ZINC000875438077	FE	On-Demand	Anodyne	TMPRSS11D	55	37
O=C(NCc1cccnc1OCC(F)F)N1CCC[C@H](OC2CCC2)CC1	ZINC000875438079	GG	On-Demand	Anodyne	EPHX2	20	50
O=C(NCc1cccnc1OCC(F)F)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875438080	GG	On-Demand	Anodyne	EPHX2	20	50
CN(C[C@H](O)COc1cc(Cl)cc(Cl)c1)C(=O)NCc1ccn(C)n1	ZINC000875438169	GE	On-Demand	Anodyne	UL54	42	30
CN(C[C@@H](O)COc1cc(Cl)cc(Cl)c1)C(=O)NCc1ccn(C)n1	ZINC000875438171	GE	On-Demand	Anodyne	UL54	42	30
CC[C@@H]1CCC[C@@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438179	EG	On-Demand	Anodyne	CTSK	30	55
CC[C@@H]1CCC[C@@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438179	EG	On-Demand	Anodyne	CTSL	28	40
CC[C@@H]1CCC[C@@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438179	EG	On-Demand	Anodyne	TIMP3	48	36
CC[C@@H]1CCC[C@@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438179	EG	On-Demand	Anodyne	CAPNS1	43	35
CC[C@@H]1CCC[C@@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438179	EG	On-Demand	Anodyne	CTSS	15	54
CC[C@@H]1CCC[C@@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438179	EG	On-Demand	Anodyne	CAPN2	70	35
CC[C@@H]1CCC[C@@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438179	EG	On-Demand	Anodyne	NPR	40	31
CC[C@@H]1CCC[C@@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438179	EG	On-Demand	Anodyne	NAAA	53	38
CC[C@@H]1CCC[C@@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438179	EG	On-Demand	Anodyne	SLC12A5	68	36
CC[C@H]1CCC[C@@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438181	EG	On-Demand	Anodyne	CTSK	30	55
CC[C@H]1CCC[C@@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438181	EG	On-Demand	Anodyne	CTSL	28	40
CC[C@H]1CCC[C@@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438181	EG	On-Demand	Anodyne	TIMP3	48	36
CC[C@H]1CCC[C@@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438181	EG	On-Demand	Anodyne	CAPNS1	43	35
CC[C@H]1CCC[C@@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438181	EG	On-Demand	Anodyne	CTSS	15	54
CC[C@H]1CCC[C@@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438181	EG	On-Demand	Anodyne	CAPN2	70	35
CC[C@H]1CCC[C@@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438181	EG	On-Demand	Anodyne	NPR	40	31
CC[C@H]1CCC[C@@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438181	EG	On-Demand	Anodyne	NAAA	53	38
CC[C@H]1CCC[C@@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438181	EG	On-Demand	Anodyne	SLC12A5	68	36
CC[C@@H]1CCC[C@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438183	EG	On-Demand	Anodyne	CTSK	30	55
CC[C@@H]1CCC[C@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438183	EG	On-Demand	Anodyne	CTSL	28	40
CC[C@@H]1CCC[C@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438183	EG	On-Demand	Anodyne	TIMP3	48	36
CC[C@@H]1CCC[C@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438183	EG	On-Demand	Anodyne	CAPNS1	43	35
CC[C@@H]1CCC[C@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438183	EG	On-Demand	Anodyne	CTSS	15	54
CC[C@@H]1CCC[C@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438183	EG	On-Demand	Anodyne	CAPN2	70	35
CC[C@@H]1CCC[C@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438183	EG	On-Demand	Anodyne	NPR	40	31
CC[C@@H]1CCC[C@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438183	EG	On-Demand	Anodyne	NAAA	53	38
CC[C@@H]1CCC[C@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438183	EG	On-Demand	Anodyne	SLC12A5	68	36
CC[C@H]1CCC[C@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438185	EG	On-Demand	Anodyne	CTSK	30	55
CC[C@H]1CCC[C@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438185	EG	On-Demand	Anodyne	CTSL	28	40
CC[C@H]1CCC[C@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438185	EG	On-Demand	Anodyne	TIMP3	48	36
CC[C@H]1CCC[C@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438185	EG	On-Demand	Anodyne	CAPNS1	43	35
CC[C@H]1CCC[C@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438185	EG	On-Demand	Anodyne	CTSS	15	54
CC[C@H]1CCC[C@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438185	EG	On-Demand	Anodyne	CAPN2	70	35
CC[C@H]1CCC[C@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438185	EG	On-Demand	Anodyne	NPR	40	31
CC[C@H]1CCC[C@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438185	EG	On-Demand	Anodyne	NAAA	53	38
CC[C@H]1CCC[C@H]1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875438185	EG	On-Demand	Anodyne	SLC12A5	68	36
O=C(N[C@@H](C1CCOCC1)C1CC1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875438272	GE	On-Demand	Anodyne	OXTR	46	35
O=C(N[C@H](C1CCOCC1)C1CC1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875438277	GE	On-Demand	Anodyne	OXTR	46	35
O=C(N[C@@H](C1CCOCC1)C1CC1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875438279	GE	On-Demand	Anodyne	OXTR	46	35
O=C(N[C@H](C1CCOCC1)C1CC1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875438280	GE	On-Demand	Anodyne	OXTR	46	35
Cc1cc(C(F)(F)F)nc(C(=O)Nc2ccccc2N(C)S(C)(=O)=O)n1	ZINC000875438444	GE	On-Demand	Anodyne	PTK2	44	36
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccn(C)n1	ZINC000875438494	CC	On-Demand	Anodyne	SLC6A3	64	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccn(C)n1	ZINC000875438495	CC	On-Demand	Anodyne	SLC6A3	64	38
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1	ZINC000875438584	GE	On-Demand	Anodyne	SLC6A4	33	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1	ZINC000875438584	GE	On-Demand	Anodyne	SLC6A3	67	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1	ZINC000875438585	GE	On-Demand	Anodyne	SLC6A4	33	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1	ZINC000875438585	GE	On-Demand	Anodyne	SLC6A3	67	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1	ZINC000875438587	GE	On-Demand	Anodyne	SLC6A4	33	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1	ZINC000875438587	GE	On-Demand	Anodyne	SLC6A3	67	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1	ZINC000875438590	GE	On-Demand	Anodyne	SLC6A4	33	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1	ZINC000875438590	GE	On-Demand	Anodyne	SLC6A3	67	43
C[C@@H](O)C1CCN(C(=O)N[C@H](c2ccc(Cl)cc2)[C@H]2CN(C)CCO2)CC1	ZINC000875438609	GF	On-Demand	Anodyne	CCR1	47	36
C[C@@H](O)C1CCN(C(=O)N[C@@H](c2ccc(Cl)cc2)[C@H]2CN(C)CCO2)CC1	ZINC000875438611	GF	On-Demand	Anodyne	CCR1	47	36
O=C(CCCOC1CCOCC1)N1CCSc2ccc(C(F)(F)F)cc21	ZINC000875438641	GI	On-Demand	Anodyne	LIPG	53	43
O=C(c1cccn(C2CC2)c1=O)N1CCSc2ccc(C(F)(F)F)cc21	ZINC000875438667	GH	On-Demand	Anodyne	LIPG	41	31
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@@H](c2cccc(F)c2)c2ccccn2)C1	ZINC000875438703	FH	On-Demand	Anodyne	HCRTR1	19	40
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@@H](c2cccc(F)c2)c2ccccn2)C1	ZINC000875438703	FH	On-Demand	Anodyne	HCRTR2	33	40
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@H](c2cccc(F)c2)c2ccccn2)C1	ZINC000875438710	FH	On-Demand	Anodyne	HCRTR1	19	40
CO[C@@H]1CC[C@@H](C)N(C(=O)N[C@H](c2cccc(F)c2)c2ccccn2)C1	ZINC000875438710	FH	On-Demand	Anodyne	HCRTR2	33	40
CC[C@@H]1CCC[C@@H]1NC(=O)C1(c2ccnc3ccccc23)CC1	ZINC000875438840	DH	On-Demand	Anodyne	ADAM17	45	40
CC[C@@H]1CCC[C@H]1NC(=O)C1(c2ccnc3ccccc23)CC1	ZINC000875438841	DH	On-Demand	Anodyne	ADAM17	45	40
CC[C@H]1CCC[C@H]1NC(=O)C1(c2ccnc3ccccc23)CC1	ZINC000875438842	DH	On-Demand	Anodyne	ADAM17	45	40
CC[C@H]1CCC[C@@H]1NC(=O)C1(c2ccnc3ccccc23)CC1	ZINC000875438843	DH	On-Demand	Anodyne	ADAM17	45	40
O=C(NCCO)C1CCN(C(=O)NCC2(c3ccc(F)cc3Cl)CC2)CC1	ZINC000875438853	GE	On-Demand	Anodyne	EPHX2	17	43
O=C(NCCO)C1CCN(C(=O)NCC2(c3ccc(F)cc3Cl)CC2)CC1	ZINC000875438853	GE	On-Demand	Anodyne	CACNA1G	35	41
C[C@]1(C(F)(F)F)CCN(C(=O)N[C@H](c2cccc(F)c2)c2ccccn2)C1	ZINC000875438908	GI	On-Demand	Anodyne	CACNA1H	43	33
C[C@]1(C(F)(F)F)CCN(C(=O)N[C@@H](c2cccc(F)c2)c2ccccn2)C1	ZINC000875438911	GI	On-Demand	Anodyne	CACNA1H	43	33
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1O2	ZINC000875438957	GD	On-Demand	Anodyne	DRD2	18	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1O2	ZINC000875438957	GD	On-Demand	Anodyne	DRD4	35	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1O2	ZINC000875438957	GD	On-Demand	Anodyne	ACHE	56	56
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1O2	ZINC000875438957	GD	On-Demand	Anodyne	DRD3	15	43
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1O2	ZINC000875438957	GD	On-Demand	Anodyne	SIGMAR1	50	44
O=C(N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1)N1CCC(CO)(CO)CC1	ZINC000875439052	GD	On-Demand	Anodyne	CACNA1H	42	33
O=C(N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1)N1CCC(CO)(CO)CC1	ZINC000875439053	GD	On-Demand	Anodyne	CACNA1H	42	33
O=C(N[C@H](c1cccc(F)c1)c1ccccn1)N1CCC(CO)(CO)CC1	ZINC000875439110	FE	On-Demand	Anodyne	CACNA1H	49	35
O=C(N[C@@H](c1cccc(F)c1)c1ccccn1)N1CCC(CO)(CO)CC1	ZINC000875439111	FE	On-Demand	Anodyne	CACNA1H	49	35
CCCCCCCNC(=O)C(=O)N[C@@H]1CC[C@H]2C[C@@H]2C1	ZINC000875439161	CE	On-Demand	Mild	EPHX2	19	48
CCCCCCCNC(=O)C(=O)N[C@@H]1CC[C@H]2C[C@@H]2C1	ZINC000875439161	CE	On-Demand	Mild	ASAH1	79	34
CCCCCCCNC(=O)C(=O)N[C@@H]1CC[C@H]2C[C@@H]2C1	ZINC000875439161	CE	On-Demand	Mild	LASR	46	33
CCCCCCCNC(=O)C(=O)N[C@@H]1CC[C@@H]2C[C@H]2C1	ZINC000875439162	CE	On-Demand	Mild	EPHX2	19	48
CCCCCCCNC(=O)C(=O)N[C@@H]1CC[C@@H]2C[C@H]2C1	ZINC000875439162	CE	On-Demand	Mild	ASAH1	79	34
CCCCCCCNC(=O)C(=O)N[C@@H]1CC[C@@H]2C[C@H]2C1	ZINC000875439162	CE	On-Demand	Mild	LASR	46	33
CCCCCCCNC(=O)C(=O)N[C@@H]1CC[C@H]2C[C@H]2C1	ZINC000875439163	CE	On-Demand	Mild	EPHX2	19	48
CCCCCCCNC(=O)C(=O)N[C@@H]1CC[C@H]2C[C@H]2C1	ZINC000875439163	CE	On-Demand	Mild	ASAH1	79	34
CCCCCCCNC(=O)C(=O)N[C@@H]1CC[C@H]2C[C@H]2C1	ZINC000875439163	CE	On-Demand	Mild	LASR	46	33
CCCCCCCNC(=O)C(=O)N[C@@H]1CC[C@@H]2C[C@@H]2C1	ZINC000875439164	CE	On-Demand	Mild	EPHX2	19	48
CCCCCCCNC(=O)C(=O)N[C@@H]1CC[C@@H]2C[C@@H]2C1	ZINC000875439164	CE	On-Demand	Mild	ASAH1	79	34
CCCCCCCNC(=O)C(=O)N[C@@H]1CC[C@@H]2C[C@@H]2C1	ZINC000875439164	CE	On-Demand	Mild	LASR	46	33
COc1cccc(C(C)(C)C(=O)N2CCC[C@@H]3COCC[C@@H]32)c1	ZINC000875439167	DG	On-Demand	Anodyne	DRD4	40	30
COc1cccc(C(C)(C)C(=O)N2CCC[C@@H]3COCC[C@H]32)c1	ZINC000875439168	DG	On-Demand	Anodyne	DRD4	40	30
COc1cccc(C(C)(C)C(=O)N2CCC[C@H]3COCC[C@H]32)c1	ZINC000875439169	DG	On-Demand	Anodyne	DRD4	40	30
COc1cccc(C(C)(C)C(=O)N2CCC[C@H]3COCC[C@@H]32)c1	ZINC000875439170	DG	On-Demand	Anodyne	DRD4	40	30
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)C(=O)N[C@@H]2CC[C@@H]3C[C@@H]3C2)C1	ZINC000875439234	FD	On-Demand	Anodyne	GPR119	27	41
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)C(=O)N[C@@H]2CC[C@H]3C[C@H]3C2)C1	ZINC000875439235	FD	On-Demand	Anodyne	GPR119	27	41
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)C(=O)N[C@@H]2CC[C@H]3C[C@@H]3C2)C1	ZINC000875439236	FD	On-Demand	Anodyne	GPR119	27	41
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)C(=O)N[C@@H]2CC[C@@H]3C[C@H]3C2)C1	ZINC000875439237	FD	On-Demand	Anodyne	GPR119	27	41
O=C(N[C@@H]1C[C@H]2CC[C@@H]1O2)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875439261	ED	On-Demand	Anodyne	OXTR	59	39
O=C(N[C@@H]1C[C@H]2CC[C@@H]1O2)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875439262	ED	On-Demand	Anodyne	OXTR	59	39
Cc1nnc(NNC(=O)NCC2(c3ccc(F)cc3Cl)CC2)n1C	ZINC000875439331	FE	On-Demand	Reactive	P2RX7	40	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@@H]1C[C@H]3CC[C@@H]1O3)CC2	ZINC000875439335	FD	On-Demand	Anodyne	SLC18A2	45	33
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H]1C[C@H]3CC[C@@H]1O3)CC2	ZINC000875439336	FD	On-Demand	Anodyne	SLC18A2	45	33
O=C(N[C@@H]1CC[C@H]2C[C@@H]2C1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875439433	FE	On-Demand	Anodyne	ETHR	54	48
O=C(N[C@@H]1CC[C@@H]2C[C@@H]2C1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875439434	FE	On-Demand	Anodyne	ETHR	54	48
O=C(N[C@@H]1CC[C@H]2C[C@H]2C1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875439435	FE	On-Demand	Anodyne	ETHR	54	48
O=C(N[C@@H]1CC[C@@H]2C[C@H]2C1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875439436	FE	On-Demand	Anodyne	ETHR	54	48
O=C(NCC1(c2ccc(F)cc2Cl)CC1)N1CCC(CO)(CO)CC1	ZINC000875439492	FE	On-Demand	Anodyne	CACNA1H	43	33
C[C@@H](NC(=O)N1CCCN(C=O)CC1)[C@H](C)c1ccccc1C(F)(F)F	ZINC000875439545	FG	On-Demand	Anodyne	RBP4	79	40
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H]3CC[C@H]4C[C@@H]4C3)CC2)c(OC)c1	ZINC000875439606	GD	On-Demand	Clean	ADRA1D	16	43
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H]3CC[C@H]4C[C@@H]4C3)CC2)c(OC)c1	ZINC000875439606	GD	On-Demand	Clean	SSTR1	46	34
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H]3CC[C@H]4C[C@@H]4C3)CC2)c(OC)c1	ZINC000875439606	GD	On-Demand	Clean	NPBWR1	53	32
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H]3CC[C@@H]4C[C@@H]4C3)CC2)c(OC)c1	ZINC000875439607	GD	On-Demand	Clean	ADRA1D	16	43
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H]3CC[C@@H]4C[C@@H]4C3)CC2)c(OC)c1	ZINC000875439607	GD	On-Demand	Clean	SSTR1	46	34
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H]3CC[C@@H]4C[C@@H]4C3)CC2)c(OC)c1	ZINC000875439607	GD	On-Demand	Clean	NPBWR1	53	32
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H]3CC[C@H]4C[C@H]4C3)CC2)c(OC)c1	ZINC000875439608	GD	On-Demand	Clean	ADRA1D	16	43
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H]3CC[C@H]4C[C@H]4C3)CC2)c(OC)c1	ZINC000875439608	GD	On-Demand	Clean	SSTR1	46	34
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H]3CC[C@H]4C[C@H]4C3)CC2)c(OC)c1	ZINC000875439608	GD	On-Demand	Clean	NPBWR1	53	32
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H]3CC[C@@H]4C[C@H]4C3)CC2)c(OC)c1	ZINC000875439609	GD	On-Demand	Clean	ADRA1D	16	43
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H]3CC[C@@H]4C[C@H]4C3)CC2)c(OC)c1	ZINC000875439609	GD	On-Demand	Clean	SSTR1	46	34
COc1ccc(N2CCN(C(=O)C(=O)N[C@@H]3CC[C@@H]4C[C@H]4C3)CC2)c(OC)c1	ZINC000875439609	GD	On-Demand	Clean	NPBWR1	53	32
O=C(N[C@@H]1CC[C@@H]2C[C@@H]2C1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875439661	EE	On-Demand	Anodyne	OXTR	59	39
O=C(N[C@@H]1CC[C@@H]2C[C@H]2C1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875439662	EE	On-Demand	Anodyne	OXTR	59	39
O=C(N[C@@H]1CC[C@@H]2C[C@@H]2C1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875439663	EE	On-Demand	Anodyne	OXTR	59	39
O=C(N[C@@H]1CC[C@@H]2C[C@H]2C1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875439664	EE	On-Demand	Anodyne	OXTR	59	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccnc1OCC(F)F	ZINC000875439690	FD	On-Demand	Anodyne	SLC6A3	49	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccnc1OCC(F)F	ZINC000875439691	FD	On-Demand	Anodyne	SLC6A3	49	39
CN1CCN(C(=O)N[C@@H](c2cccc(F)c2)c2ccccn2)CCC1(C)C	ZINC000875439704	FG	On-Demand	Anodyne	CACNA1H	43	35
CN1CCN(C(=O)N[C@H](c2cccc(F)c2)c2ccccn2)CCC1(C)C	ZINC000875439705	FG	On-Demand	Anodyne	CACNA1H	43	35
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1cccc(F)c1)c1ccccn1	ZINC000875439728	GG	On-Demand	Anodyne	SLC6A3	32	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1cccc(F)c1)c1ccccn1	ZINC000875439729	GG	On-Demand	Anodyne	SLC6A3	32	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1cccc(F)c1)c1ccccn1	ZINC000875439730	GG	On-Demand	Anodyne	SLC6A3	32	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1cccc(F)c1)c1ccccn1	ZINC000875439731	GG	On-Demand	Anodyne	SLC6A3	32	43
CNC(=O)[C@@H]1CCC[C@H]1NC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875439748	FF	On-Demand	Anodyne	EPHX2	18	45
CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875439749	FF	On-Demand	Anodyne	EPHX2	18	45
CNC(=O)[C@@H]1CCC[C@H]1NC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875439750	FF	On-Demand	Anodyne	EPHX2	18	45
CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875439751	FF	On-Demand	Anodyne	EPHX2	18	45
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1O2	ZINC000875439796	EE	On-Demand	Anodyne	CES1	44	33
O=C(NCCCCCCc1ccccc1)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1O2	ZINC000875439796	EE	On-Demand	Anodyne	AMP1_PLAFQ	22	44
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)[C@H](C)c1ccccc1C(F)(F)F	ZINC000875439815	GF	On-Demand	Anodyne	RBP4	90	44
O=C(N[C@@H]1C[C@H]2CC[C@@H]1O2)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875439818	FD	On-Demand	Anodyne	ETHR	42	45
O=C(N[C@H](c1cccc(F)c1)c1ccccn1)N1CCC2(CCNC2=O)CC1	ZINC000875439895	GF	On-Demand	Anodyne	CACNA1H	56	43
O=C(N[C@@H](c1cccc(F)c1)c1ccccn1)N1CCC2(CCNC2=O)CC1	ZINC000875439896	GF	On-Demand	Anodyne	CACNA1H	56	43
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H](C1CCOCC1)C1CC1	ZINC000875440038	GF	On-Demand	Anodyne	C3AR1	40	41
O=C(N[C@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H](C1CCOCC1)C1CC1	ZINC000875440039	GF	On-Demand	Anodyne	C3AR1	40	41
O=C(N[C@H](C1CCOCC1)C1CC1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875440040	GF	On-Demand	Anodyne	C3AR1	40	41
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@H](C1CCOCC1)C1CC1	ZINC000875440041	GF	On-Demand	Anodyne	C3AR1	40	41
CCCCCCCNC(=O)C(=O)NCC[C@]1(C)C[C@@]1(F)Cl	ZINC000875440194	DF	On-Demand	Mild	ASAH1	75	32
CCCCCCCNC(=O)C(=O)NCC[C@@]1(C)C[C@@]1(F)Cl	ZINC000875440195	DF	On-Demand	Mild	ASAH1	75	32
CCCCCCCNC(=O)C(=O)NCC[C@]1(C)C[C@]1(F)Cl	ZINC000875440196	DF	On-Demand	Mild	ASAH1	75	32
CCCCCCCNC(=O)C(=O)NCC[C@@]1(C)C[C@]1(F)Cl	ZINC000875440197	DF	On-Demand	Mild	ASAH1	75	32
CN(C)[C@@H]1CN(C(=O)N[C@H]2CCCc3cc(F)ccc32)C[C@@H]1n1ccnn1	ZINC000875440366	FD	On-Demand	Anodyne	BDKRB1	42	35
CN(C)[C@@H]1CN(C(=O)N[C@@H]2CCCc3cc(F)ccc32)C[C@@H]1n1ccnn1	ZINC000875440367	FD	On-Demand	Anodyne	BDKRB1	42	35
O=C(N[C@@H]1CCCc2cc(F)ccc21)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875440408	EH	On-Demand	Anodyne	BDKRB1	56	36
O=C(N[C@H]1CCCc2cc(F)ccc21)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875440409	EH	On-Demand	Anodyne	BDKRB1	56	36
O=C(N[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1)N1CCC(CO)(CO)CC1	ZINC000875440444	GD	On-Demand	Anodyne	CACNA1H	50	33
O=C(N[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1)N1CCC(CO)(CO)CC1	ZINC000875440445	GD	On-Demand	Anodyne	CACNA1H	50	33
CN(C)C[C@@H]1CN(C(=O)N[C@H]2CCCc3cc(F)ccc32)C[C@H]1CN(C)C	ZINC000875440463	GF	On-Demand	Anodyne	BDKRB1	55	37
CN(C)C[C@@H]1CN(C(=O)N[C@@H]2CCCc3cc(F)ccc32)C[C@H]1CN(C)C	ZINC000875440464	GF	On-Demand	Anodyne	BDKRB1	55	37
CONC(=O)C1CCN(C(=O)N[C@H]2CCCc3cc(F)ccc32)CC1	ZINC000875440465	EE	On-Demand	Anodyne	BDKRB1	55	37
CONC(=O)C1CCN(C(=O)N[C@@H]2CCCc3cc(F)ccc32)CC1	ZINC000875440466	EE	On-Demand	Anodyne	BDKRB1	55	37
O=CN1CCCN(C(=O)N[C@H]2CCCc3cc(F)ccc32)CC1	ZINC000875440482	DE	On-Demand	Anodyne	BDKRB1	57	37
O=CN1CCCN(C(=O)N[C@@H]2CCCc3cc(F)ccc32)CC1	ZINC000875440483	DE	On-Demand	Anodyne	BDKRB1	57	37
CN1CCN(C2CCN(C(=O)N[C@H]3CCCc4cc(F)ccc43)CC2)CC1	ZINC000875440505	FF	On-Demand	Anodyne	BDKRB1	53	36
CN1CCN(C2CCN(C(=O)N[C@H]3CCCc4cc(F)ccc43)CC2)CC1	ZINC000875440505	FF	On-Demand	Anodyne	L3MBTL3	73	41
CN1CCN(C2CCN(C(=O)N[C@@H]3CCCc4cc(F)ccc43)CC2)CC1	ZINC000875440506	FF	On-Demand	Anodyne	BDKRB1	53	36
CN1CCN(C2CCN(C(=O)N[C@@H]3CCCc4cc(F)ccc43)CC2)CC1	ZINC000875440506	FF	On-Demand	Anodyne	L3MBTL3	73	41
Cc1nnc(NNC(=O)N[C@@H]2CCCc3cc(F)ccc32)n1C	ZINC000875440518	DD	On-Demand	Reactive	BDKRB1	41	34
Cc1nnc(NNC(=O)N[C@H]2CCCc3cc(F)ccc32)n1C	ZINC000875440519	DD	On-Demand	Reactive	BDKRB1	41	34
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1CCCc2cc(F)ccc21	ZINC000875440549	GG	On-Demand	Anodyne	BDKRB1	60	41
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1CCCc2cc(F)ccc21	ZINC000875440549	GG	On-Demand	Anodyne	ACKR3	46	33
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1CCCc2cc(F)ccc21	ZINC000875440550	GG	On-Demand	Anodyne	BDKRB1	60	41
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1CCCc2cc(F)ccc21	ZINC000875440550	GG	On-Demand	Anodyne	ACKR3	46	33
O=C(N[C@H]1CCCc2cc(F)ccc21)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875440551	FF	On-Demand	Anodyne	BDKRB1	46	36
O=C(N[C@@H]1CCCc2cc(F)ccc21)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875440552	FF	On-Demand	Anodyne	BDKRB1	46	36
C[C@H](NC(=O)C(=O)NCCN1CCCC1=O)c1ccc(C(F)(F)F)nc1	ZINC000875440555	FD	On-Demand	Anodyne	TRPV1	43	35
NC(=O)Cc1cccc2c1CCN(C(=O)N[C@H]1CCCc3cc(F)ccc31)C2	ZINC000875440564	GF	On-Demand	Anodyne	BDKRB1	54	40
NC(=O)Cc1cccc2c1CCN(C(=O)N[C@@H]1CCCc3cc(F)ccc31)C2	ZINC000875440565	GF	On-Demand	Anodyne	BDKRB1	54	40
O=C(NCCN1CCCC1=O)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875440593	FC	On-Demand	Anodyne	FKBP1A	19	41
O=C(NCCN1CCCC1=O)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875440594	FC	On-Demand	Anodyne	FKBP1A	19	41
O=C(NCCN1CCCC1=O)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875440595	FC	On-Demand	Anodyne	FKBP1A	19	41
O=C(NCCN1CCCC1=O)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875440596	FC	On-Demand	Anodyne	FKBP1A	19	41
COc1ccc(CN(C)C(=O)c2ccccc2NC(=O)c2cccs2)cc1OC	ZINC000875440627	HI	On-Demand	Anodyne	MT-ND1	15	43
COC(=O)c1ccc(C(=O)NNC(=O)c2ccc(COc3ccc(Cl)cc3)cc2)cn1	ZINC000875440638	IG	On-Demand	Reactive	F10	21	41
COC(=O)c1ccc(C(=O)NNC(=O)c2ccc(COc3ccc(Cl)cc3)cc2)cn1	ZINC000875440638	IG	On-Demand	Reactive	SLC6A5	34	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCCc2cc(F)ccc21	ZINC000875440642	EF	On-Demand	Anodyne	SLC6A3	29	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCCc2cc(F)ccc21	ZINC000875440643	EF	On-Demand	Anodyne	SLC6A3	29	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCCc2cc(F)ccc21	ZINC000875440644	EF	On-Demand	Anodyne	SLC6A3	29	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCCc2cc(F)ccc21	ZINC000875440645	EF	On-Demand	Anodyne	SLC6A3	29	40
CCOc1ccc(NS(=O)(=O)c2cc(NC(=O)c3ccc(-n4cccn4)nc3)ccc2OC)cc1	ZINC000875440655	JH	On-Demand	Anodyne	CPT1A	64	42
CCOc1ccc(NS(=O)(=O)c2cc(NC(=O)c3ccc(-n4cccn4)nc3)ccc2OC)cc1	ZINC000875440655	JH	On-Demand	Anodyne	CPT2	45	35
CCOc1ccc(NS(=O)(=O)c2cc(NC(=O)c3ccc(-n4cccn4)nc3)ccc2OC)cc1	ZINC000875440655	JH	On-Demand	Anodyne	PRNP	16	40
CCOc1ccc(NS(=O)(=O)c2cc(NC(=O)c3ccc(-n4cccn4)nc3)ccc2OC)cc1	ZINC000875440655	JH	On-Demand	Anodyne	CPT1B	45	42
CCOc1ccc(NS(=O)(=O)c2cc(NC(=O)c3ccc(-n4cccn4)nc3)ccc2OC)cc1	ZINC000875440655	JH	On-Demand	Anodyne	ENPP1	65	35
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cccc(F)c1F	ZINC000875440672	EF	On-Demand	Anodyne	SLC6A3	49	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cccc(F)c1F	ZINC000875440673	EF	On-Demand	Anodyne	SLC6A3	49	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cccc(F)c1F	ZINC000875440674	EF	On-Demand	Anodyne	SLC6A3	49	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cccc(F)c1F	ZINC000875440675	EF	On-Demand	Anodyne	SLC6A3	49	39
C[S@](=N)(=O)N1CCN(C(=O)N[C@H]2CCCc3cc(F)ccc32)CC1	ZINC000875440691	FE	On-Demand	Anodyne	BDKRB1	61	38
C[S@](=N)(=O)N1CCN(C(=O)N[C@@H]2CCCc3cc(F)ccc32)CC1	ZINC000875440694	FE	On-Demand	Anodyne	BDKRB1	61	38
C#CCCCCNC(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875440716	EH	On-Demand	Mild	DRD4	41	32
O=C(NCCN1CCCC1=O)C(=O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000875440731	GD	On-Demand	Anodyne	TYRO3	17	45
O=C(N[C@H]1CCCc2cc(F)ccc21)N1Cc2cccc(O)c2C1	ZINC000875440736	EH	On-Demand	Clean	BDKRB1	53	40
O=C(N[C@@H]1CCCc2cc(F)ccc21)N1Cc2cccc(O)c2C1	ZINC000875440737	EH	On-Demand	Clean	BDKRB1	53	40
C[C@@H](NC(=O)N1CCN(C)C(C)(C)CC1)c1cccc(F)c1F	ZINC000875440836	EG	On-Demand	Anodyne	CACNA1H	44	37
CCCCCCCNC(=O)C(=O)NCCN1CCCC1=O	ZINC000875440842	CC	On-Demand	Mild	ASAH1	97	39
CC(=O)C1CCN(C(=O)N[C@H]2CCCc3cc(F)ccc32)CC1	ZINC000875440884	DG	On-Demand	Anodyne	BDKRB1	60	40
CC(=O)C1CCN(C(=O)N[C@@H]2CCCc3cc(F)ccc32)CC1	ZINC000875440885	DG	On-Demand	Anodyne	BDKRB1	60	40
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1cccc(F)c1F	ZINC000875440898	ED	On-Demand	Anodyne	CACNA1H	46	40
CC(=O)N(C)c1ccc(CNC(=O)N[C@H]2CCCc3cc(F)ccc32)cc1	ZINC000875440915	FH	On-Demand	Anodyne	BDKRB1	55	38
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H]2CCCc3cc(F)ccc32)cc1	ZINC000875440916	FH	On-Demand	Anodyne	BDKRB1	55	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCc3cc(F)ccc32)C1	ZINC000875440961	EG	On-Demand	Anodyne	BDKRB1	50	37
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCc3cc(F)ccc32)C1	ZINC000875440963	EG	On-Demand	Anodyne	BDKRB1	50	37
O=C(NCCN1CCCC1=O)C(=O)NCC1(c2cccc(Cl)c2)CCC1	ZINC000875440977	GD	On-Demand	Anodyne	TYRO3	17	43
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCCc3cc(F)ccc32)C1	ZINC000875440989	DG	On-Demand	Anodyne	BDKRB1	60	40
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCCc3cc(F)ccc32)C1	ZINC000875440990	DG	On-Demand	Anodyne	BDKRB1	60	40
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCCc3cc(F)ccc32)C1	ZINC000875440991	DG	On-Demand	Anodyne	BDKRB1	60	40
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCCc3cc(F)ccc32)C1	ZINC000875440992	DG	On-Demand	Anodyne	BDKRB1	60	40
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1cccc(F)c1F	ZINC000875441010	FH	On-Demand	Anodyne	CACNA1H	47	38
O=C(NCCN1CCCC1=O)C(=O)NCc1ncc(Cl)s1	ZINC000875441013	EC	On-Demand	Anodyne	TYRO3	18	40
O=C(N[C@H]1CCCc2cc(F)ccc21)N1CCC(CO)(CO)CC1	ZINC000875441033	ED	On-Demand	Anodyne	BDKRB1	59	39
O=C(N[C@@H]1CCCc2cc(F)ccc21)N1CCC(CO)(CO)CC1	ZINC000875441034	ED	On-Demand	Anodyne	BDKRB1	59	39
O=C(N[C@H]1CCCc2cc(F)ccc21)N1CCC2(CCNC2=O)CC1	ZINC000875441055	EF	On-Demand	Anodyne	CACNA1H	48	35
O=C(N[C@H]1CCCc2cc(F)ccc21)N1CCC2(CCNC2=O)CC1	ZINC000875441055	EF	On-Demand	Anodyne	BDKRB1	51	38
O=C(N[C@H]1CCCc2cc(F)ccc21)N1CCC2(CCNC2=O)CC1	ZINC000875441055	EF	On-Demand	Anodyne	CALCRL	19	49
O=C(N[C@@H]1CCCc2cc(F)ccc21)N1CCC2(CCNC2=O)CC1	ZINC000875441056	EF	On-Demand	Anodyne	CACNA1H	48	35
O=C(N[C@@H]1CCCc2cc(F)ccc21)N1CCC2(CCNC2=O)CC1	ZINC000875441056	EF	On-Demand	Anodyne	BDKRB1	51	38
O=C(N[C@@H]1CCCc2cc(F)ccc21)N1CCC2(CCNC2=O)CC1	ZINC000875441056	EF	On-Demand	Anodyne	CALCRL	19	49
O=C1OC[C@H]2CN(C(=O)N[C@H]3CCCc4cc(F)ccc43)C[C@@H]12	ZINC000875441063	DE	On-Demand	Anodyne	BDKRB1	43	38
O=C1OC[C@H]2CN(C(=O)N[C@@H]3CCCc4cc(F)ccc43)C[C@@H]12	ZINC000875441064	DE	On-Demand	Anodyne	BDKRB1	43	38
CCCCCCCNC(=O)C(=O)NC[C@H]1CC(=O)N(CC)C1	ZINC000875441084	DD	On-Demand	Mild	ASAH1	91	37
CCCCCCCNC(=O)C(=O)NC[C@@H]1CC(=O)N(CC)C1	ZINC000875441085	DD	On-Demand	Mild	ASAH1	91	37
O=C(N[C@@H]1CCCc2cc(F)ccc21)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875441092	FE	On-Demand	Anodyne	BDKRB1	54	38
O=C(N[C@@H]1CCCc2cc(F)ccc21)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875441093	FE	On-Demand	Anodyne	BDKRB1	54	38
O=C(N[C@@H]1CCCc2cc(F)ccc21)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875441094	FE	On-Demand	Anodyne	BDKRB1	54	38
O=C(N[C@@H]1CCCc2cc(F)ccc21)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875441095	FE	On-Demand	Anodyne	BDKRB1	54	38
C[C@@H](NC(=O)N1Cc2cccnc2N2CCC[C@H]2C1)c1cccc(F)c1F	ZINC000875441115	FH	On-Demand	Anodyne	CALCRL	42	34
C[C@H](NC(=O)N1Cc2cccnc2N2CCC[C@H]2C1)c1cccc(F)c1F	ZINC000875441116	FH	On-Demand	Anodyne	CALCRL	42	34
Cn1cnc(-c2nnc3n2CCN(C(=O)N[C@H]2CCCc4cc(F)ccc42)C3)c1	ZINC000875441117	GE	On-Demand	Anodyne	P2RX7	23	41
Cn1cnc(-c2nnc3n2CCN(C(=O)N[C@@H]2CCCc4cc(F)ccc42)C3)c1	ZINC000875441118	GE	On-Demand	Anodyne	P2RX7	23	41
COC(=O)C1(O)CN(C(=O)N[C@@H]2CCCc3cc(F)ccc32)C1	ZINC000875441121	DD	On-Demand	Anodyne	BDKRB1	48	36
COC(=O)C1(O)CN(C(=O)N[C@H]2CCCc3cc(F)ccc32)C1	ZINC000875441122	DD	On-Demand	Anodyne	BDKRB1	48	36
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCCc2cc(F)ccc21	ZINC000875441128	CE	On-Demand	Anodyne	BDKRB1	49	36
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCCc2cc(F)ccc21	ZINC000875441129	CE	On-Demand	Anodyne	BDKRB1	49	36
Cn1nnnc1C1CCN(C(=O)N[C@H]2CCCc3cc(F)ccc32)CC1	ZINC000875441142	FE	On-Demand	Anodyne	PRCP	18	40
Cn1nnnc1C1CCN(C(=O)N[C@H]2CCCc3cc(F)ccc32)CC1	ZINC000875441142	FE	On-Demand	Anodyne	CCR3	40	31
Cn1nnnc1C1CCN(C(=O)N[C@H]2CCCc3cc(F)ccc32)CC1	ZINC000875441142	FE	On-Demand	Anodyne	BDKRB1	44	35
Cn1nnnc1C1CCN(C(=O)N[C@@H]2CCCc3cc(F)ccc32)CC1	ZINC000875441143	FE	On-Demand	Anodyne	PRCP	18	40
Cn1nnnc1C1CCN(C(=O)N[C@@H]2CCCc3cc(F)ccc32)CC1	ZINC000875441143	FE	On-Demand	Anodyne	CCR3	40	31
Cn1nnnc1C1CCN(C(=O)N[C@@H]2CCCc3cc(F)ccc32)CC1	ZINC000875441143	FE	On-Demand	Anodyne	BDKRB1	44	35
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCCc2cc(F)ccc21	ZINC000875441164	DG	On-Demand	Anodyne	BDKRB1	44	35
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCCc2cc(F)ccc21	ZINC000875441165	DG	On-Demand	Anodyne	BDKRB1	44	35
O=C(NCCN1CCCC1=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875441204	FD	On-Demand	Anodyne	TYRO3	19	40
O=C(NCCN1CCCC1=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875441205	FD	On-Demand	Anodyne	TYRO3	19	40
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCCc3cc(F)ccc32)CC1	ZINC000875441218	FD	On-Demand	Anodyne	BDKRB1	57	39
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCCc3cc(F)ccc32)CC1	ZINC000875441219	FD	On-Demand	Anodyne	BDKRB1	57	39
CCn1ncc(CNC(=O)N[C@H]2COc3cc(OC)ccc3C2)n1	ZINC000875441221	ED	On-Demand	Anodyne	MTNR1A	15	41
CCn1ncc(CNC(=O)N[C@@H]2COc3cc(OC)ccc3C2)n1	ZINC000875441222	ED	On-Demand	Anodyne	MTNR1A	15	41
COC(=O)N(C)NC(=O)N[C@@H]1CCCc2cc(F)ccc21	ZINC000875441226	CE	On-Demand	Reactive	BDKRB1	45	36
COC(=O)N(C)NC(=O)N[C@H]1CCCc2cc(F)ccc21	ZINC000875441227	CE	On-Demand	Reactive	BDKRB1	45	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCN1CCCC1=O)CC2	ZINC000875441241	GC	On-Demand	Anodyne	SLC18A2	47	36
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NCCN1CCCC1=O)CC2	ZINC000875441241	GC	On-Demand	Anodyne	TYRO3	15	40
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCN1CCCC1=O)CC2	ZINC000875441242	GC	On-Demand	Anodyne	SLC18A2	47	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NCCN1CCCC1=O)CC2	ZINC000875441242	GC	On-Demand	Anodyne	TYRO3	15	40
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)c1cccc(F)c1F	ZINC000875441292	GI	On-Demand	Anodyne	OPRL1	26	46
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)c1cccc(F)c1F	ZINC000875441293	GI	On-Demand	Anodyne	OPRL1	26	46
C#CC[C@@H](COC)NC(=O)C(=O)NCc1cccc(CC)c1	ZINC000875441332	DD	On-Demand	Mild	PDS	48	33
C#CC[C@H](COC)NC(=O)C(=O)NCc1cccc(CC)c1	ZINC000875441333	DD	On-Demand	Mild	PDS	48	33
N#Cc1cccc(CN2CCC(NC(=O)C(=O)NCCCCC3CC3)CC2)c1	ZINC000875441366	GE	On-Demand	Mild	DRD2	22	42
N#Cc1cccc(CN2CCC(NC(=O)C(=O)NCCCCC3CC3)CC2)c1	ZINC000875441366	GE	On-Demand	Mild	DRD4	30	43
N#Cc1cccc(CN2CCC(NC(=O)C(=O)NCCCCC3CC3)CC2)c1	ZINC000875441366	GE	On-Demand	Mild	ACHE	39	42
N#Cc1cccc(CN2CCC(NC(=O)C(=O)NCCCCC3CC3)CC2)c1	ZINC000875441366	GE	On-Demand	Mild	HRH2	34	42
N#Cc1cccc(CN2CCC(NC(=O)C(=O)NCCCCC3CC3)CC2)c1	ZINC000875441366	GE	On-Demand	Mild	DRD3	29	42
N#Cc1cccc(CN2CCC(NC(=O)C(=O)NCCCCC3CC3)CC2)c1	ZINC000875441366	GE	On-Demand	Mild	CHRM3	19	42
N#Cc1cccc(CN2CCC(NC(=O)C(=O)NCCCCC3CC3)CC2)c1	ZINC000875441366	GE	On-Demand	Mild	SIGMAR1	26	47
N#Cc1cccc(CN2CCC(NC(=O)C(=O)NCCCCC3CC3)CC2)c1	ZINC000875441366	GE	On-Demand	Mild	CCR3	43	48
N#Cc1cccc(CN2CCC(NC(=O)C(=O)NCCCCC3CC3)CC2)c1	ZINC000875441366	GE	On-Demand	Mild	MCHR1	56	49
C[C@@H]1CC(NC(=O)N2CC3(CN(Cc4ccccc4)C3)C2)C[C@@H](C)O1	ZINC000875441390	EE	On-Demand	Anodyne	SIGMAR1	33	41
N#Cc1cccc(CN2CCC(NC(=O)C(=O)NCCC[C@@H]3C=CCC3)CC2)c1	ZINC000875441397	GF	On-Demand	Mild	SIGMAR1	17	43
N#Cc1cccc(CN2CCC(NC(=O)C(=O)NCCC[C@@H]3C=CCC3)CC2)c1	ZINC000875441397	GF	On-Demand	Mild	CCR3	25	43
N#Cc1cccc(CN2CCC(NC(=O)C(=O)NCCC[C@@H]3C=CCC3)CC2)c1	ZINC000875441397	GF	On-Demand	Mild	MCHR1	34	45
N#Cc1cccc(CN2CCC(NC(=O)C(=O)NCCC[C@H]3C=CCC3)CC2)c1	ZINC000875441398	GF	On-Demand	Mild	SIGMAR1	17	43
N#Cc1cccc(CN2CCC(NC(=O)C(=O)NCCC[C@H]3C=CCC3)CC2)c1	ZINC000875441398	GF	On-Demand	Mild	CCR3	25	43
N#Cc1cccc(CN2CCC(NC(=O)C(=O)NCCC[C@H]3C=CCC3)CC2)c1	ZINC000875441398	GF	On-Demand	Mild	MCHR1	34	45
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(Cc3cccc(C#N)c3)CC2)CC1	ZINC000875441405	GD	On-Demand	Mild	DRD4	26	44
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(Cc3cccc(C#N)c3)CC2)CC1	ZINC000875441405	GD	On-Demand	Mild	CHRM3	21	42
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(Cc3cccc(C#N)c3)CC2)CC1	ZINC000875441405	GD	On-Demand	Mild	SIGMAR1	25	46
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(Cc3cccc(C#N)c3)CC2)CC1	ZINC000875441405	GD	On-Demand	Mild	SSTR5	41	35
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(Cc3cccc(C#N)c3)CC2)CC1	ZINC000875441405	GD	On-Demand	Mild	CCR3	42	46
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(Cc3cccc(C#N)c3)CC2)CC1	ZINC000875441405	GD	On-Demand	Mild	MLNR	37	49
CC(=O)C1CCN(C(=O)C(=O)NC2CCN(Cc3cccc(C#N)c3)CC2)CC1	ZINC000875441405	GD	On-Demand	Mild	MCHR1	52	51
N#Cc1cccc(CN2CCC(NC(=O)C(=O)N[C@@H]3CC34CCC4)CC2)c1	ZINC000875441443	FD	On-Demand	Mild	DRD4	23	42
N#Cc1cccc(CN2CCC(NC(=O)C(=O)N[C@@H]3CC34CCC4)CC2)c1	ZINC000875441443	FD	On-Demand	Mild	CHRM3	20	44
N#Cc1cccc(CN2CCC(NC(=O)C(=O)N[C@@H]3CC34CCC4)CC2)c1	ZINC000875441443	FD	On-Demand	Mild	SIGMAR1	24	48
N#Cc1cccc(CN2CCC(NC(=O)C(=O)N[C@@H]3CC34CCC4)CC2)c1	ZINC000875441443	FD	On-Demand	Mild	CCR3	33	46
N#Cc1cccc(CN2CCC(NC(=O)C(=O)N[C@@H]3CC34CCC4)CC2)c1	ZINC000875441443	FD	On-Demand	Mild	MCHR1	58	49
N#Cc1cccc(CN2CCC(NC(=O)C(=O)N[C@H]3CC34CCC4)CC2)c1	ZINC000875441444	FD	On-Demand	Mild	DRD4	23	42
N#Cc1cccc(CN2CCC(NC(=O)C(=O)N[C@H]3CC34CCC4)CC2)c1	ZINC000875441444	FD	On-Demand	Mild	CHRM3	20	44
N#Cc1cccc(CN2CCC(NC(=O)C(=O)N[C@H]3CC34CCC4)CC2)c1	ZINC000875441444	FD	On-Demand	Mild	SIGMAR1	24	48
N#Cc1cccc(CN2CCC(NC(=O)C(=O)N[C@H]3CC34CCC4)CC2)c1	ZINC000875441444	FD	On-Demand	Mild	CCR3	33	46
N#Cc1cccc(CN2CCC(NC(=O)C(=O)N[C@H]3CC34CCC4)CC2)c1	ZINC000875441444	FD	On-Demand	Mild	MCHR1	58	49
CC(C)(C)OC(=O)N1CCC(CCNC(=O)C(=O)N[C@H]2CC23CCC3)CC1	ZINC000875441481	GE	On-Demand	Anodyne	GPR119	26	41
CC(C)(C)OC(=O)N1CCC(CCNC(=O)C(=O)N[C@@H]2CC23CCC3)CC1	ZINC000875441482	GE	On-Demand	Anodyne	GPR119	26	41
CCCCCCCNC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875441492	GF	On-Demand	Mild	DRD2	22	42
CCCCCCCNC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875441492	GF	On-Demand	Mild	DRD4	38	43
CCCCCCCNC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875441492	GF	On-Demand	Mild	HRH2	36	42
CCCCCCCNC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875441492	GF	On-Demand	Mild	DRD3	26	42
CCCCCCCNC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875441492	GF	On-Demand	Mild	CHRM3	23	45
CCCCCCCNC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875441492	GF	On-Demand	Mild	SIGMAR1	25	47
CCCCCCCNC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875441492	GF	On-Demand	Mild	SSTR5	59	38
CCCCCCCNC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875441492	GF	On-Demand	Mild	CCR3	44	46
CCCCCCCNC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875441492	GF	On-Demand	Mild	MLNR	24	43
CCCCCCCNC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875441492	GF	On-Demand	Mild	MCHR1	56	51
CCOC(=O)c1nnc(NC(=O)c2cccc(OC(C)(C)C)c2)s1	ZINC000875441498	EG	On-Demand	Anodyne	ACR	41	36
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3cccc(C#N)c3)CC2)C1	ZINC000875441518	GD	On-Demand	Mild	DRD4	24	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3cccc(C#N)c3)CC2)C1	ZINC000875441518	GD	On-Demand	Mild	CHRM3	19	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3cccc(C#N)c3)CC2)C1	ZINC000875441518	GD	On-Demand	Mild	SIGMAR1	21	43
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3cccc(C#N)c3)CC2)C1	ZINC000875441518	GD	On-Demand	Mild	CCR3	45	44
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3cccc(C#N)c3)CC2)C1	ZINC000875441518	GD	On-Demand	Mild	MLNR	39	49
CC(=O)[C@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3cccc(C#N)c3)CC2)C1	ZINC000875441518	GD	On-Demand	Mild	MCHR1	43	48
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3cccc(C#N)c3)CC2)C1	ZINC000875441519	GD	On-Demand	Mild	DRD4	24	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3cccc(C#N)c3)CC2)C1	ZINC000875441519	GD	On-Demand	Mild	CHRM3	19	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3cccc(C#N)c3)CC2)C1	ZINC000875441519	GD	On-Demand	Mild	SIGMAR1	21	43
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3cccc(C#N)c3)CC2)C1	ZINC000875441519	GD	On-Demand	Mild	CCR3	45	44
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3cccc(C#N)c3)CC2)C1	ZINC000875441519	GD	On-Demand	Mild	MLNR	39	49
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NC2CCN(Cc3cccc(C#N)c3)CC2)C1	ZINC000875441519	GD	On-Demand	Mild	MCHR1	43	48
CC(C)(C)OC(=O)N1CCC(CCNC(=O)C(=O)NCC2CC=CC2)CC1	ZINC000875441522	GE	On-Demand	Anodyne	CACNA1I	48	34
CC(C)(C)OC(=O)N1CCC(CCNC(=O)C(=O)NCC2CC=CC2)CC1	ZINC000875441522	GE	On-Demand	Anodyne	GPR119	43	46
C[C@H](C(=O)Nc1ccsc1C(N)=O)n1ccc(C(F)(F)F)n1	ZINC000875441553	EE	On-Demand	Anodyne	CARM1	41	34
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccsc1C(N)=O	ZINC000875441559	CC	On-Demand	Anodyne	TRY1_BOVIN	54	37
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccsc1C(N)=O	ZINC000875441559	CC	On-Demand	Anodyne	LGMN	106	38
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccsc1C(N)=O	ZINC000875441559	CC	On-Demand	Anodyne	XIAP	42	37
COC(=O)c1cnc(N(C)C(=O)C(C)(C)c2cccc(OC)c2)s1	ZINC000875441581	EF	On-Demand	Anodyne	HSD17B2	25	40
C[C@H]1C[C@H](NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C[C@@H](C)O1	ZINC000875441653	FF	On-Demand	Mild	ITK	16	49
C[C@H]1C[C@H](NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C[C@@H](C)O1	ZINC000875441653	FF	On-Demand	Mild	PANC	55	37
C[C@@H]1CC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C[C@@H](C)O1	ZINC000875441654	FF	On-Demand	Mild	ITK	16	49
C[C@@H]1CC(NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)C[C@@H](C)O1	ZINC000875441654	FF	On-Demand	Mild	PANC	55	37
COC(=O)N(C)NC(=O)N[C@@H]1COc2cc(OC)ccc2C1	ZINC000875441690	DC	On-Demand	Reactive	MTNR1A	27	49
COC(=O)N(C)NC(=O)N[C@H]1COc2cc(OC)ccc2C1	ZINC000875441691	DC	On-Demand	Reactive	MTNR1A	27	49
CCOC1CC2(C1)C[C@H]2C(=O)N(C)[C@@H](c1ccc(Cl)cc1)C(F)(F)F	ZINC000875441729	GJ	On-Demand	Anodyne	UTS2	42	33
CCOC1CC2(C1)C[C@H]2C(=O)N(C)[C@H](c1ccc(Cl)cc1)C(F)(F)F	ZINC000875441780	GJ	On-Demand	Anodyne	UTS2	42	33
CCCCCCCNC(=O)C(=O)NC[C@@H]1C[C@H](N(C)C)C1	ZINC000875441802	CD	On-Demand	Mild	ASAH1	59	33
C[C@@H]1CC(NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)C[C@@H](C)O1	ZINC000875441830	EF	On-Demand	Anodyne	EPHX2	26	49
C[C@@H]1CC(NC(=O)N2CCC[C@](O)(c3ccccc3)C2)C[C@@H](C)O1	ZINC000875441836	EF	On-Demand	Anodyne	EPHX2	26	49
CCOC(=O)c1nnc(NC(=O)c2cc(Cl)nc(C(C)(C)C)c2)s1	ZINC000875441940	FG	On-Demand	Anodyne	DHODH	15	40
Cc1nonc1CNC(=O)C(=O)NCCCc1c(Cl)cccc1Cl	ZINC000875441943	FE	On-Demand	Anodyne	P2RX7	23	47
COc1cccc(C(C)(C)C(=O)N(C)C2CCN(S(C)(=O)=O)CC2)c1	ZINC000875441957	FD	On-Demand	Anodyne	CACNA1B	40	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)c1ncc(C(=O)OC)s1	ZINC000875442034	GE	On-Demand	Anodyne	CTRA_BOVIN	32	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)c1ncc(C(=O)OC)s1	ZINC000875442034	GE	On-Demand	Anodyne	CTSB	43	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)c1ncc(C(=O)OC)s1	ZINC000875442034	GE	On-Demand	Anodyne	PAPA1_CARPA	67	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)c1ncc(C(=O)OC)s1	ZINC000875442034	GE	On-Demand	Anodyne	CYSP_TRYCR	57	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)c1ncc(C(=O)OC)s1	ZINC000875442034	GE	On-Demand	Anodyne	CTSK	23	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)c1ncc(C(=O)OC)s1	ZINC000875442034	GE	On-Demand	Anodyne	CTSL	36	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)c1ncc(C(=O)OC)s1	ZINC000875442034	GE	On-Demand	Anodyne	TIMP3	40	31
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)c1ncc(C(=O)OC)s1	ZINC000875442034	GE	On-Demand	Anodyne	CAPNS1	61	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)c1ncc(C(=O)OC)s1	ZINC000875442034	GE	On-Demand	Anodyne	HLA-DRB1	82	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)c1ncc(C(=O)OC)s1	ZINC000875442034	GE	On-Demand	Anodyne	CAPN1	71	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)c1ncc(C(=O)OC)s1	ZINC000875442034	GE	On-Demand	Anodyne	CAPN2	94	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)c1ncc(C(=O)OC)s1	ZINC000875442034	GE	On-Demand	Anodyne	PSMB8	22	42
O=CN1CCCN(C(=O)N[C@@H](Cc2ccc(Cl)cc2)c2ccccn2)CC1	ZINC000875442128	GF	On-Demand	Anodyne	MC4R	51	35
O=CN1CCCN(C(=O)N[C@H](Cc2ccc(Cl)cc2)c2ccccn2)CC1	ZINC000875442129	GF	On-Demand	Anodyne	MC4R	51	35
NC(=O)c1sccc1NC(=O)[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875442137	EG	On-Demand	Anodyne	C3AR1	41	41
NC(=O)c1sccc1NC(=O)[C@H](Cc1cccnc1)C1CCCC1	ZINC000875442138	EG	On-Demand	Anodyne	C3AR1	41	41
Cc1cnc(CCNC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)c(C)c1	ZINC000875442189	GF	On-Demand	Anodyne	C3AR1	40	43
Cc1cnc(CCNC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)c(C)c1	ZINC000875442190	GF	On-Demand	Anodyne	C3AR1	40	43
COc1ccc(NC(=O)c2ccc(-n3cccn3)nc2)cc1S(=O)(=O)Nc1ccc(Cl)cc1	ZINC000875442259	JH	On-Demand	Anodyne	CPT1A	100	49
COc1ccc(NC(=O)c2ccc(-n3cccn3)nc2)cc1S(=O)(=O)Nc1ccc(Cl)cc1	ZINC000875442259	JH	On-Demand	Anodyne	CPT2	55	41
COc1ccc(NC(=O)c2ccc(-n3cccn3)nc2)cc1S(=O)(=O)Nc1ccc(Cl)cc1	ZINC000875442259	JH	On-Demand	Anodyne	GRM4	32	41
COc1ccc(NC(=O)c2ccc(-n3cccn3)nc2)cc1S(=O)(=O)Nc1ccc(Cl)cc1	ZINC000875442259	JH	On-Demand	Anodyne	CPT1B	90	49
COc1ccc(NC(=O)c2ccc(-n3cccn3)nc2)cc1S(=O)(=O)Nc1ccc(Cl)cc1	ZINC000875442259	JH	On-Demand	Anodyne	SGK1	45	33
COc1ccc(NC(=O)c2ccc(-n3cccn3)nc2)cc1S(=O)(=O)Nc1ccc(Cl)cc1	ZINC000875442259	JH	On-Demand	Anodyne	ENPP1	64	38
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(Cc3cccc(C#N)c3)CC2)C1	ZINC000875442271	GD	On-Demand	Mild	DRD4	28	41
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(Cc3cccc(C#N)c3)CC2)C1	ZINC000875442271	GD	On-Demand	Mild	CHRM3	15	44
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(Cc3cccc(C#N)c3)CC2)C1	ZINC000875442271	GD	On-Demand	Mild	SIGMAR1	21	42
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(Cc3cccc(C#N)c3)CC2)C1	ZINC000875442271	GD	On-Demand	Mild	SSTR5	67	36
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(Cc3cccc(C#N)c3)CC2)C1	ZINC000875442271	GD	On-Demand	Mild	CCR3	35	43
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(Cc3cccc(C#N)c3)CC2)C1	ZINC000875442271	GD	On-Demand	Mild	MLNR	35	46
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NC2CCN(Cc3cccc(C#N)c3)CC2)C1	ZINC000875442271	GD	On-Demand	Mild	MCHR1	46	47
C=CC(C)(C)CCCNC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875442273	GF	On-Demand	Mild	DRD4	24	40
C=CC(C)(C)CCCNC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875442273	GF	On-Demand	Mild	CHRM3	17	40
C=CC(C)(C)CCCNC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875442273	GF	On-Demand	Mild	SIGMAR1	17	43
C=CC(C)(C)CCCNC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875442273	GF	On-Demand	Mild	CCR3	33	42
C=CC(C)(C)CCCNC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875442273	GF	On-Demand	Mild	MLNR	20	41
C=CC(C)(C)CCCNC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875442273	GF	On-Demand	Mild	MCHR1	37	47
COc1ccccc1[C@@H]1CCCN(C(=O)NC2C[C@@H](C)O[C@H](C)C2)CC1	ZINC000875442278	FH	On-Demand	Anodyne	EPHX2	22	42
COc1ccccc1[C@@H]1CCCN(C(=O)NC2C[C@@H](C)O[C@H](C)C2)CC1	ZINC000875442278	FH	On-Demand	Anodyne	RBP4	33	40
COc1ccccc1[C@H]1CCCN(C(=O)N[C@H]2C[C@H](C)O[C@H](C)C2)CC1	ZINC000875442279	FH	On-Demand	Anodyne	EPHX2	22	42
COc1ccccc1[C@H]1CCCN(C(=O)N[C@H]2C[C@H](C)O[C@H](C)C2)CC1	ZINC000875442279	FH	On-Demand	Anodyne	RBP4	33	40
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2C[C@H](C)O[C@H](C)C2)CC1	ZINC000875442280	FH	On-Demand	Anodyne	EPHX2	22	42
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2C[C@H](C)O[C@H](C)C2)CC1	ZINC000875442280	FH	On-Demand	Anodyne	RBP4	33	40
COc1ccccc1[C@@H]1CCCN(C(=O)NC2C[C@H](C)O[C@@H](C)C2)CC1	ZINC000875442281	FH	On-Demand	Anodyne	EPHX2	22	42
COc1ccccc1[C@@H]1CCCN(C(=O)NC2C[C@H](C)O[C@@H](C)C2)CC1	ZINC000875442281	FH	On-Demand	Anodyne	RBP4	33	40
CCN(CCNC(=O)OC(C)(C)C)C(=O)C(=O)N[C@H](C)C(C)(C)C	ZINC000875442326	ED	On-Demand	Anodyne	CTSK	16	41
Cc1nonc1CNC(=O)C(=O)NCc1cccc(Br)c1C	ZINC000875442333	FD	On-Demand	Anodyne	P2RX7	17	46
Cc1cnc(CCNC(=O)C(=O)NCc2nc(-c3ccncc3)cs2)c(C)c1	ZINC000875442334	GE	On-Demand	Anodyne	ROCK1	21	41
Cc1cnc(CCNC(=O)C(=O)NCc2nc(-c3ccncc3)cs2)c(C)c1	ZINC000875442334	GE	On-Demand	Anodyne	ROCK2	15	41
CCCCCCCNC(=O)C(=O)NCCc1ncc(C)cc1C	ZINC000875442361	DE	On-Demand	Mild	ASAH1	80	33
CC(=O)CC(C)(C)CC(=O)Nc1ccsc1C(N)=O	ZINC000875442422	CE	On-Demand	Anodyne	FAS	31	41
Cc1ccnn1CC(=O)N(C)[C@@H](c1ccc(Cl)cc1)C(F)(F)F	ZINC000875442457	EH	On-Demand	Anodyne	UTS2	41	32
Cc1ccnn1CC(=O)N(C)[C@H](c1ccc(Cl)cc1)C(F)(F)F	ZINC000875442458	EH	On-Demand	Anodyne	UTS2	41	32
COCC1CC(NC(=O)N[C@@H]2COc3cc(OC)ccc3C2)C1	ZINC000875442459	DD	On-Demand	Anodyne	MTNR1A	31	51
COCC1CC(NC(=O)N[C@H]2COc3cc(OC)ccc3C2)C1	ZINC000875442460	DD	On-Demand	Anodyne	MTNR1A	31	51
CC(=O)[C@H]1CCCN(C(=O)N[C@H](Cc2ccc(Cl)cc2)c2ccccn2)C1	ZINC000875442474	GI	On-Demand	Anodyne	MC4R	75	38
CC(=O)[C@H]1CCCN(C(=O)N[C@H](Cc2ccc(Cl)cc2)c2ccccn2)C1	ZINC000875442474	GI	On-Demand	Anodyne	DPP7	52	39
CC(=O)[C@H]1CCCN(C(=O)N[C@H](Cc2ccc(Cl)cc2)c2ccccn2)C1	ZINC000875442474	GI	On-Demand	Anodyne	CALCRL	26	42
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](Cc2ccc(Cl)cc2)c2ccccn2)C1	ZINC000875442475	GI	On-Demand	Anodyne	MC4R	75	38
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](Cc2ccc(Cl)cc2)c2ccccn2)C1	ZINC000875442475	GI	On-Demand	Anodyne	DPP7	52	39
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](Cc2ccc(Cl)cc2)c2ccccn2)C1	ZINC000875442475	GI	On-Demand	Anodyne	CALCRL	26	42
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](Cc2ccc(Cl)cc2)c2ccccn2)C1	ZINC000875442476	GI	On-Demand	Anodyne	MC4R	75	38
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](Cc2ccc(Cl)cc2)c2ccccn2)C1	ZINC000875442476	GI	On-Demand	Anodyne	DPP7	52	39
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](Cc2ccc(Cl)cc2)c2ccccn2)C1	ZINC000875442476	GI	On-Demand	Anodyne	CALCRL	26	42
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](Cc2ccc(Cl)cc2)c2ccccn2)C1	ZINC000875442477	GI	On-Demand	Anodyne	MC4R	75	38
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](Cc2ccc(Cl)cc2)c2ccccn2)C1	ZINC000875442477	GI	On-Demand	Anodyne	DPP7	52	39
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](Cc2ccc(Cl)cc2)c2ccccn2)C1	ZINC000875442477	GI	On-Demand	Anodyne	CALCRL	26	42
CONC(=O)C1CCN(C(=O)N[C@@H]2COc3cc(OC)ccc3C2)CC1	ZINC000875442487	FD	On-Demand	Anodyne	MTNR1A	19	42
CONC(=O)C1CCN(C(=O)N[C@H]2COc3cc(OC)ccc3C2)CC1	ZINC000875442488	FD	On-Demand	Anodyne	MTNR1A	19	42
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875442516	GD	On-Demand	Mild	DRD4	28	43
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875442516	GD	On-Demand	Mild	CHRM3	18	45
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875442516	GD	On-Demand	Mild	SIGMAR1	21	43
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875442516	GD	On-Demand	Mild	SSTR5	41	35
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875442516	GD	On-Demand	Mild	CCR3	32	42
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875442516	GD	On-Demand	Mild	MLNR	16	43
C#CC[C@@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875442516	GD	On-Demand	Mild	MCHR1	46	45
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875442517	GD	On-Demand	Mild	DRD4	28	43
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875442517	GD	On-Demand	Mild	CHRM3	18	45
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875442517	GD	On-Demand	Mild	SIGMAR1	21	43
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875442517	GD	On-Demand	Mild	SSTR5	41	35
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875442517	GD	On-Demand	Mild	CCR3	32	42
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875442517	GD	On-Demand	Mild	MLNR	16	43
C#CC[C@H](CCOC)NC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875442517	GD	On-Demand	Mild	MCHR1	46	45
CC(=O)C1CCN(C(=O)N[C@@H](Cc2ccc(Cl)cc2)c2ccccn2)CC1	ZINC000875442641	GI	On-Demand	Anodyne	MC4R	75	36
CC(=O)C1CCN(C(=O)N[C@@H](Cc2ccc(Cl)cc2)c2ccccn2)CC1	ZINC000875442641	GI	On-Demand	Anodyne	CCR1	40	36
CC(=O)C1CCN(C(=O)N[C@@H](Cc2ccc(Cl)cc2)c2ccccn2)CC1	ZINC000875442641	GI	On-Demand	Anodyne	CALCRL	27	45
CC(=O)C1CCN(C(=O)N[C@H](Cc2ccc(Cl)cc2)c2ccccn2)CC1	ZINC000875442642	GI	On-Demand	Anodyne	MC4R	75	36
CC(=O)C1CCN(C(=O)N[C@H](Cc2ccc(Cl)cc2)c2ccccn2)CC1	ZINC000875442642	GI	On-Demand	Anodyne	CCR1	40	36
CC(=O)C1CCN(C(=O)N[C@H](Cc2ccc(Cl)cc2)c2ccccn2)CC1	ZINC000875442642	GI	On-Demand	Anodyne	CALCRL	27	45
CCOC(=O)c1nnc(NC(=O)C(C)(C)c2cccc(OC)c2)s1	ZINC000875442645	EF	On-Demand	Anodyne	DHODH	18	40
CCCCCCCNC(=O)C(=O)NCc1cc(=O)n2ccccc2n1	ZINC000875442699	ED	On-Demand	Mild	ASAH1	91	40
CCCCCCCNC(=O)C(=O)NCc1cc(=O)n2ccccc2n1	ZINC000875442699	ED	On-Demand	Mild	POLR1A	64	35
Cc1cnc(CCNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)c(C)c1	ZINC000875442750	FD	On-Demand	Anodyne	SIRT3	51	31
Cc1cnc(CCNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)c(C)c1	ZINC000875442750	FD	On-Demand	Anodyne	SIRT2	53	36
Cc1cnc(CCNC(=O)C(=O)NCCC2CCN(C(C)C)CC2)c(C)c1	ZINC000875442750	FD	On-Demand	Anodyne	SIRT1	52	36
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H](C3CC3)[C@H]3CCCCO3)CC2)CC1	ZINC000875442774	GC	On-Demand	Anodyne	L3MBTL3	52	40
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H](C3CC3)[C@@H]3CCCCO3)CC2)CC1	ZINC000875442775	GC	On-Demand	Anodyne	L3MBTL3	52	40
CN1CCN(C2CCN(C(=O)C(=O)N[C@H](C3CC3)[C@@H]3CCCCO3)CC2)CC1	ZINC000875442776	GC	On-Demand	Anodyne	L3MBTL3	52	40
CN1CCN(C2CCN(C(=O)C(=O)N[C@H](C3CC3)[C@H]3CCCCO3)CC2)CC1	ZINC000875442777	GC	On-Demand	Anodyne	L3MBTL3	52	40
CCCCCCCNC(=O)C(=O)N[C@H]1CCCc2c1ccc(=O)n2C	ZINC000875442787	ED	On-Demand	Mild	ASAH1	88	43
CCCCCCCNC(=O)C(=O)N[C@@H]1CCCc2c1ccc(=O)n2C	ZINC000875442788	ED	On-Demand	Mild	ASAH1	88	43
COCC(C)(C)CCNC(=O)N[C@@H]1COc2cc(OC)ccc2C1	ZINC000875442830	EE	On-Demand	Anodyne	MTNR1A	26	44
COCC(C)(C)CCNC(=O)N[C@H]1COc2cc(OC)ccc2C1	ZINC000875442831	EE	On-Demand	Anodyne	MTNR1A	26	44
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875442844	GC	On-Demand	Mild	DRD4	23	41
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875442844	GC	On-Demand	Mild	CHRM3	16	44
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875442844	GC	On-Demand	Mild	SIGMAR1	22	43
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875442844	GC	On-Demand	Mild	SSTR5	40	34
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875442844	GC	On-Demand	Mild	CCR3	29	43
C#CC[C@@H](COC)NC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875442844	GC	On-Demand	Mild	MCHR1	40	45
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875442845	GC	On-Demand	Mild	DRD4	23	41
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875442845	GC	On-Demand	Mild	CHRM3	16	44
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875442845	GC	On-Demand	Mild	SIGMAR1	22	43
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875442845	GC	On-Demand	Mild	SSTR5	40	34
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875442845	GC	On-Demand	Mild	CCR3	29	43
C#CC[C@H](COC)NC(=O)C(=O)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000875442845	GC	On-Demand	Mild	MCHR1	40	45
C#CC[C@@H](COC)NC(=O)C(=O)NCCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875442877	GD	On-Demand	Mild	GPR119	26	40
C#CC[C@H](COC)NC(=O)C(=O)NCCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875442878	GD	On-Demand	Mild	GPR119	26	40
O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)N[C@H]1CCC[C@@H]1O	ZINC000875442933	FD	On-Demand	Clean	CCR3	55	37
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCCCc2cccs2)C1	ZINC000875442961	GF	On-Demand	Anodyne	DPP7	18	41
O=C(N[C@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCCCc2cccs2)C1	ZINC000875442962	GF	On-Demand	Anodyne	DPP7	18	41
O=C(N[C@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCCCc2cccs2)C1	ZINC000875442963	GF	On-Demand	Anodyne	DPP7	18	41
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCCCc2cccs2)C1	ZINC000875442964	GF	On-Demand	Anodyne	DPP7	18	41
CCC[C@@H]1CCc2ccccc2N1C(=O)[C@@H](OCC)[C@@H]1CCOC1	ZINC000875442977	EH	On-Demand	Anodyne	TPP2	51	32
CCC[C@@H]1CCc2ccccc2N1C(=O)[C@@H](OCC)[C@H]1CCOC1	ZINC000875442979	EH	On-Demand	Anodyne	TPP2	51	32
CCC[C@@H]1CCc2ccccc2N1C(=O)[C@H](OCC)[C@H]1CCOC1	ZINC000875442981	EH	On-Demand	Anodyne	TPP2	51	32
CCC[C@@H]1CCc2ccccc2N1C(=O)[C@H](OCC)[C@@H]1CCOC1	ZINC000875442982	EH	On-Demand	Anodyne	TPP2	51	32
CCC[C@@H]1CCc2ccccc2N1C(=O)CC[C@@H]1CC[C@H](C(N)=O)O1	ZINC000875443017	EF	On-Demand	Anodyne	TPP2	51	32
CCC[C@H]1CCc2ccccc2N1C(=O)CC[C@@H]1CC[C@H](C(N)=O)O1	ZINC000875443018	EF	On-Demand	Anodyne	TPP2	51	32
O=C(NCCCCC1CC1)C(=O)NCc1noc2ccccc12	ZINC000875443020	DE	On-Demand	Anodyne	ACHE	16	47
COC(=O)c1ccc(C(=O)NNC(=S)Nc2cccc(Cl)c2)cn1	ZINC000875443027	FE	On-Demand	Reactive	GRM4	15	45
COC(=O)c1ccc(C(=O)NNC(=S)Nc2cccc(Cl)c2)cn1	ZINC000875443027	FE	On-Demand	Reactive	TAAR1	16	45
COC(=O)c1ccc(C(=O)NNC(=S)Nc2cccc(Cl)c2)cn1	ZINC000875443027	FE	On-Demand	Reactive	KCNK3	65	41
COC(=O)c1ccc(C(=O)NNC(=S)Nc2cccc(Cl)c2)cn1	ZINC000875443027	FE	On-Demand	Reactive	KCNK9	45	41
COC(=O)c1cnc(N(C)C(=O)C2(NC(=O)OCc3ccccc3)CC2)s1	ZINC000875443048	GE	On-Demand	Anodyne	NPR	51	33
O=C(COc1ccc(Br)cc1)NNC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000875443112	JH	On-Demand	Reactive	FAS	23	46
COc1cccc(C2(NC(=O)c3c(Cl)nn(C)c3Cl)CC2)c1	ZINC000875443192	EG	On-Demand	Anodyne	DRD4	46	36
C#C[C@@H]1CC[C@@H](NC(=O)N[C@@H]2COc3cc(OC)ccc3C2)CC1	ZINC000875443220	EE	On-Demand	Mild	MTNR1A	18	44
C#C[C@@H]1CC[C@@H](NC(=O)N[C@H]2COc3cc(OC)ccc3C2)CC1	ZINC000875443221	EE	On-Demand	Mild	MTNR1A	18	44
CCC[C@H]1CCc2ccccc2N1C(=O)Cc1ccc(C(N)=O)nc1	ZINC000875443260	EF	On-Demand	Anodyne	TPP2	57	34
CCC[C@@H]1CCc2ccccc2N1C(=O)Cc1ccc(C(N)=O)nc1	ZINC000875443261	EF	On-Demand	Anodyne	TPP2	57	34
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3noc4ccccc34)C2)cc1	ZINC000875443270	GE	On-Demand	Anodyne	DRD2	18	44
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3noc4ccccc34)C2)cc1	ZINC000875443270	GE	On-Demand	Anodyne	DRD4	48	50
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3noc4ccccc34)C2)cc1	ZINC000875443270	GE	On-Demand	Anodyne	ACHE	22	46
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3noc4ccccc34)C2)cc1	ZINC000875443270	GE	On-Demand	Anodyne	CHRM3	18	46
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3noc4ccccc34)C2)cc1	ZINC000875443270	GE	On-Demand	Anodyne	SIGMAR1	27	48
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3noc4ccccc34)C2)cc1	ZINC000875443270	GE	On-Demand	Anodyne	SSTR5	52	35
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3noc4ccccc34)C2)cc1	ZINC000875443270	GE	On-Demand	Anodyne	CCR2	16	44
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCc3noc4ccccc34)C2)cc1	ZINC000875443270	GE	On-Demand	Anodyne	MCHR1	42	47
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3noc4ccccc34)C2)cc1	ZINC000875443271	GE	On-Demand	Anodyne	DRD2	18	44
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3noc4ccccc34)C2)cc1	ZINC000875443271	GE	On-Demand	Anodyne	DRD4	48	50
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3noc4ccccc34)C2)cc1	ZINC000875443271	GE	On-Demand	Anodyne	ACHE	22	46
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3noc4ccccc34)C2)cc1	ZINC000875443271	GE	On-Demand	Anodyne	CHRM3	18	46
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3noc4ccccc34)C2)cc1	ZINC000875443271	GE	On-Demand	Anodyne	SIGMAR1	27	48
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3noc4ccccc34)C2)cc1	ZINC000875443271	GE	On-Demand	Anodyne	SSTR5	52	35
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3noc4ccccc34)C2)cc1	ZINC000875443271	GE	On-Demand	Anodyne	CCR2	16	44
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCc3noc4ccccc34)C2)cc1	ZINC000875443271	GE	On-Demand	Anodyne	MCHR1	42	47
NC(=O)c1sccc1NC(=O)CCCOC1CCOCC1	ZINC000875443332	DD	On-Demand	Anodyne	FAS	26	40
O=C(NCc1noc2ccccc12)C(=O)N[C@H]1CCCc2ccc(Cl)cc21	ZINC000875443362	GG	On-Demand	Anodyne	HTR2A	22	40
O=C(NCc1noc2ccccc12)C(=O)N[C@@H]1CCCc2ccc(Cl)cc21	ZINC000875443364	GG	On-Demand	Anodyne	HTR2A	22	40
CN(C[C@@H]1C[C@H](O)C1)C(=O)C(=O)NCCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875443466	GD	On-Demand	Anodyne	GPR119	28	41
O=C(NCCCCC1CC1)C(=O)NCc1cc(=O)n2ccccc2n1	ZINC000875443472	ED	On-Demand	Anodyne	POLR1A	45	32
N#Cc1cccc(CN2CCC(NC(=O)C(=O)N3C[C@H]4CC=CC[C@H]4C3)CC2)c1	ZINC000875443483	GE	On-Demand	Mild	DRD4	24	42
N#Cc1cccc(CN2CCC(NC(=O)C(=O)N3C[C@H]4CC=CC[C@H]4C3)CC2)c1	ZINC000875443483	GE	On-Demand	Mild	CHRM3	16	42
N#Cc1cccc(CN2CCC(NC(=O)C(=O)N3C[C@H]4CC=CC[C@H]4C3)CC2)c1	ZINC000875443483	GE	On-Demand	Mild	SIGMAR1	22	46
N#Cc1cccc(CN2CCC(NC(=O)C(=O)N3C[C@H]4CC=CC[C@H]4C3)CC2)c1	ZINC000875443483	GE	On-Demand	Mild	CCR3	38	46
N#Cc1cccc(CN2CCC(NC(=O)C(=O)N3C[C@H]4CC=CC[C@H]4C3)CC2)c1	ZINC000875443483	GE	On-Demand	Mild	MLNR	28	45
N#Cc1cccc(CN2CCC(NC(=O)C(=O)N3C[C@H]4CC=CC[C@H]4C3)CC2)c1	ZINC000875443483	GE	On-Demand	Mild	MCHR1	50	51
O=C(N[C@H]1CCC[C@H]1c1ccccc1C(F)(F)F)N[C@@H]1CCOC[C@H]1O	ZINC000875443564	FF	On-Demand	Anodyne	RBP4	61	38
O=C(N[C@@H]1CCOC[C@H]1O)N[C@@H]1CCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000875443565	FF	On-Demand	Anodyne	RBP4	61	38
O=C(N[C@@H]1CCOC[C@H]1O)N[C@@H]1CCC[C@H]1c1ccccc1C(F)(F)F	ZINC000875443566	FF	On-Demand	Anodyne	RBP4	61	38
O=C(N[C@H]1CCC[C@@H]1c1ccccc1C(F)(F)F)N[C@@H]1CCOC[C@H]1O	ZINC000875443567	FF	On-Demand	Anodyne	RBP4	61	38
CCC[C@@H]1CCc2ccccc2N1C(=O)c1cc(C(F)(F)F)ncn1	ZINC000875443670	EI	On-Demand	Anodyne	TPP2	56	33
CCC[C@H]1CCc2ccccc2N1C(=O)c1cc(C(F)(F)F)ncn1	ZINC000875443671	EI	On-Demand	Anodyne	TPP2	56	33
COc1cccc(OC)c1CNC(=O)C(=O)NC1CCC(C)(N(C)C)CC1	ZINC000875443687	GD	On-Demand	Anodyne	KCNA3	40	41
C#C[C@@H]1CC[C@@H](NC(=O)NC2CCC(Oc3ccc(C#N)cn3)CC2)CC1	ZINC000875443697	FG	On-Demand	Mild	EPHX2	27	40
C#C[C@@H]1CC[C@@H](NC(=O)NC2CCC(Oc3ccc(C#N)cn3)CC2)CC1	ZINC000875443697	FG	On-Demand	Mild	DGAT1	27	43
COc1cccc(OC)c1CNC(=O)C(=O)NCCCCC1CC1	ZINC000875443725	EE	On-Demand	Anodyne	HTR1A	24	42
COc1cccc(OC)c1CNC(=O)C(=O)NCCCCC1CC1	ZINC000875443725	EE	On-Demand	Anodyne	DRD2	27	42
COc1cccc(OC)c1CNC(=O)C(=O)NCCCCC1CC1	ZINC000875443725	EE	On-Demand	Anodyne	DRD4	17	40
COc1cccc(OC)c1CNC(=O)C(=O)NCCCCC1CC1	ZINC000875443725	EE	On-Demand	Anodyne	DRD3	43	42
COC(=O)c1cccc(CCNC(=O)N2CC[C@@H]3CS(=O)(=O)C[C@@H]3C2)c1	ZINC000875443741	GD	On-Demand	Anodyne	ST14	62	32
COC(=O)c1cccc(CCNC(=O)N2CC[C@H]3CS(=O)(=O)C[C@@H]3C2)c1	ZINC000875443742	GD	On-Demand	Anodyne	ST14	62	32
COC(=O)c1cccc(CCNC(=O)N2CC[C@@H]3CS(=O)(=O)C[C@H]3C2)c1	ZINC000875443743	GD	On-Demand	Anodyne	ST14	62	32
COC(=O)c1cccc(CCNC(=O)N2CC[C@H]3CS(=O)(=O)C[C@H]3C2)c1	ZINC000875443744	GD	On-Demand	Anodyne	ST14	62	32
COC(=O)c1cccc(CCNC(=O)N2C[C@H]3C(=O)N(C)C(=O)[C@H]3C2)c1	ZINC000875443796	FC	On-Demand	Anodyne	DRD4	40	31
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)N[C@H]1CCCN2CCCC[C@H]12	ZINC000875443809	GD	On-Demand	Anodyne	CPT1A	16	40
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)N[C@@H]1CCCN2CCCC[C@H]12	ZINC000875443810	GD	On-Demand	Anodyne	CPT1A	16	40
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)N[C@H]1CCCN2CCCC[C@@H]12	ZINC000875443811	GD	On-Demand	Anodyne	CPT1A	16	40
O=C(NCc1nc(-c2ccncc2)cs1)C(=O)N[C@@H]1CCCN2CCCC[C@@H]12	ZINC000875443812	GD	On-Demand	Anodyne	CPT1A	16	40
CC(=O)C1CCN(C(=O)NC2CCC(Oc3ccc(C#N)cn3)CC2)CC1	ZINC000875443860	FF	On-Demand	Mild	DGAT1	18	40
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCC[C@H]1c1ccccc1C(F)(F)F	ZINC000875443888	FG	On-Demand	Anodyne	RBP4	68	36
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCC[C@H]1c1ccccc1C(F)(F)F	ZINC000875443890	FG	On-Demand	Anodyne	RBP4	68	36
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000875443894	FG	On-Demand	Anodyne	RBP4	68	36
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000875443895	FG	On-Demand	Anodyne	RBP4	68	36
COC(=O)c1cccc(CCNC(=O)N2CCC[C@H]2c2cncc(C)c2)c1	ZINC000875443906	FG	On-Demand	Anodyne	PREP	45	35
COC(=O)c1cccc(CCNC(=O)N2CCC[C@@H]2c2cncc(C)c2)c1	ZINC000875443907	FG	On-Demand	Anodyne	PREP	45	35
CO[C@@H]1CC[C@@H](C)N(C(=O)NC2CCC(Oc3ccc(C#N)cn3)CC2)C1	ZINC000875443956	FF	On-Demand	Mild	HCRTR2	22	41
COC(=O)c1cccc(CCNC(=O)N2CCC(C(C)=O)CC2)c1	ZINC000875443987	EE	On-Demand	Anodyne	EPHX2	16	41
CS[C@@H]1C[C@@H](NC(=O)NC2CCC(Oc3ccc(C#N)cn3)CC2)C1	ZINC000875443998	FF	On-Demand	Mild	DGAT1	20	40
COC(=O)c1cccc(CCNC(=O)N2CCC[C@H](C(C)=O)C2)c1	ZINC000875444018	EE	On-Demand	Anodyne	PREP	36	40
COC(=O)c1cccc(CCNC(=O)N2CCC[C@@H](C(C)=O)C2)c1	ZINC000875444019	EE	On-Demand	Anodyne	PREP	36	40
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ncn(C)n2)CC1	ZINC000875444044	EE	On-Demand	Anodyne	DRD2	24	45
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ncn(C)n2)CC1	ZINC000875444044	EE	On-Demand	Anodyne	EPHX2	17	42
COc1ccccc1[C@H]1CCCN(C(=O)NCc2ncn(C)n2)CC1	ZINC000875444044	EE	On-Demand	Anodyne	ACKR3	62	32
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ncn(C)n2)CC1	ZINC000875444045	EE	On-Demand	Anodyne	DRD2	24	45
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ncn(C)n2)CC1	ZINC000875444045	EE	On-Demand	Anodyne	EPHX2	17	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2ncn(C)n2)CC1	ZINC000875444045	EE	On-Demand	Anodyne	ACKR3	62	32
CN1CCN(C2CCN(C(=O)NCC(C)(C)c3ccncc3)CC2)CC1	ZINC000875444051	FD	On-Demand	Anodyne	L3MBTL3	66	42
CCCCCCCNC(=O)C(=O)N[C@H]1CCOc2c(OC)cccc21	ZINC000875444069	EF	On-Demand	Mild	HTR1A	21	45
CCCCCCCNC(=O)C(=O)N[C@H]1CCOc2c(OC)cccc21	ZINC000875444069	EF	On-Demand	Mild	DRD2	23	45
CCCCCCCNC(=O)C(=O)N[C@H]1CCOc2c(OC)cccc21	ZINC000875444069	EF	On-Demand	Mild	LASR	48	38
CCCCCCCNC(=O)C(=O)N[C@@H]1CCOc2c(OC)cccc21	ZINC000875444070	EF	On-Demand	Mild	HTR1A	21	45
CCCCCCCNC(=O)C(=O)N[C@@H]1CCOc2c(OC)cccc21	ZINC000875444070	EF	On-Demand	Mild	DRD2	23	45
CCCCCCCNC(=O)C(=O)N[C@@H]1CCOc2c(OC)cccc21	ZINC000875444070	EF	On-Demand	Mild	LASR	48	38
CC(=O)C1CCN(C(=O)NCc2ccc(N3CCN(CC4CC4)CC3)cc2)CC1	ZINC000875444072	GF	On-Demand	Clean	NAMPT	24	40
CCOC1CC2(C1)C[C@H]2NC(=O)NC1CCC(Oc2ccc(C#N)cn2)CC1	ZINC000875444082	GF	On-Demand	Mild	EPHX2	22	43
CCOC1CC2(C1)C[C@@H]2NC(=O)NC1CCC(Oc2ccc(C#N)cn2)CC1	ZINC000875444083	GF	On-Demand	Mild	EPHX2	22	43
COCCN(CC1CCN(C)CC1)C(=O)NCc1cc(F)cc(OC)c1	ZINC000875444136	FE	On-Demand	Anodyne	ACKR3	45	31
COc1ccc(N2CCN(C(=O)NCC(C)(C)c3ccncc3)CC2)c(OC)c1	ZINC000875444231	GF	On-Demand	Clean	HTR1A	32	43
COc1ccc(N2CCN(C(=O)NCC(C)(C)c3ccncc3)CC2)c(OC)c1	ZINC000875444231	GF	On-Demand	Clean	DRD2	27	41
COc1ccc(N2CCN(C(=O)NCC(C)(C)c3ccncc3)CC2)c(OC)c1	ZINC000875444231	GF	On-Demand	Clean	DRD4	40	32
COc1ccc(N2CCN(C(=O)NCC(C)(C)c3ccncc3)CC2)c(OC)c1	ZINC000875444231	GF	On-Demand	Clean	HTR1B	17	43
COc1ccc(N2CCN(C(=O)NCC(C)(C)c3ccncc3)CC2)c(OC)c1	ZINC000875444231	GF	On-Demand	Clean	DRD3	43	37
COc1ccc(N2CCN(C(=O)NCC(C)(C)c3ccncc3)CC2)c(OC)c1	ZINC000875444231	GF	On-Demand	Clean	PDGFRB	44	40
Cn1cnc(CNC(=O)N2CCC[C@@](O)(c3ccccc3)C2)n1	ZINC000875444247	DD	On-Demand	Anodyne	EPHX2	15	48
Cn1cnc(CNC(=O)N2CCC[C@](O)(c3ccccc3)C2)n1	ZINC000875444248	DD	On-Demand	Anodyne	EPHX2	15	48
COC(=O)c1cccc(CCNC(=O)N2CC[C@@H]3[C@@H](CCN3C)C2)c1	ZINC000875444270	ED	On-Demand	Anodyne	DRD4	41	32
COC(=O)c1cccc(CCNC(=O)N2CC[C@@H]3[C@H](CCN3C)C2)c1	ZINC000875444271	ED	On-Demand	Anodyne	DRD4	41	32
COC(=O)c1cccc(CCNC(=O)N2CC[C@H]3[C@@H](CCN3C)C2)c1	ZINC000875444272	ED	On-Demand	Anodyne	DRD4	41	32
COC(=O)c1cccc(CCNC(=O)N2CC[C@H]3[C@H](CCN3C)C2)c1	ZINC000875444273	ED	On-Demand	Anodyne	DRD4	41	32
COc1cccc(OC)c1CNC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875444274	GD	On-Demand	Anodyne	DRD2	26	42
COc1cccc(OC)c1CNC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875444274	GD	On-Demand	Anodyne	SIRT3	40	31
COc1cccc(OC)c1CNC(=O)C(=O)NCCC1CCN(C(C)C)CC1	ZINC000875444274	GD	On-Demand	Anodyne	SIRT1	40	31
CCCCCCCNC(=O)C(=O)NCc1noc2ccccc12	ZINC000875444278	DF	On-Demand	Mild	TSPO	16	40
CCCCCCCNC(=O)C(=O)NCc1noc2ccccc12	ZINC000875444278	DF	On-Demand	Mild	ASAH1	80	34
O=CN1CCCN(C(=O)N[C@@H]2CCC[C@H]2c2ccccc2C(F)(F)F)CC1	ZINC000875444301	GG	On-Demand	Anodyne	EPHX2	15	45
O=CN1CCCN(C(=O)N[C@@H]2CCC[C@H]2c2ccccc2C(F)(F)F)CC1	ZINC000875444301	GG	On-Demand	Anodyne	RBP4	95	44
O=CN1CCCN(C(=O)N[C@@H]2CCC[C@@H]2c2ccccc2C(F)(F)F)CC1	ZINC000875444302	GG	On-Demand	Anodyne	EPHX2	15	45
O=CN1CCCN(C(=O)N[C@@H]2CCC[C@@H]2c2ccccc2C(F)(F)F)CC1	ZINC000875444302	GG	On-Demand	Anodyne	RBP4	95	44
O=CN1CCCN(C(=O)N[C@H]2CCC[C@H]2c2ccccc2C(F)(F)F)CC1	ZINC000875444303	GG	On-Demand	Anodyne	EPHX2	15	45
O=CN1CCCN(C(=O)N[C@H]2CCC[C@H]2c2ccccc2C(F)(F)F)CC1	ZINC000875444303	GG	On-Demand	Anodyne	RBP4	95	44
O=CN1CCCN(C(=O)N[C@H]2CCC[C@@H]2c2ccccc2C(F)(F)F)CC1	ZINC000875444304	GG	On-Demand	Anodyne	EPHX2	15	45
O=CN1CCCN(C(=O)N[C@H]2CCC[C@@H]2c2ccccc2C(F)(F)F)CC1	ZINC000875444304	GG	On-Demand	Anodyne	RBP4	95	44
COC(=O)c1cccc(CCNC(=O)N2CCN(c3ccc(C#N)nc3)CC2)c1	ZINC000875444311	GD	On-Demand	Mild	DRD4	43	35
COC(=O)c1cccc(CCNC(=O)N2CCN(c3ccc(C#N)nc3)CC2)c1	ZINC000875444311	GD	On-Demand	Mild	P2RY12	16	45
COC(=O)c1cccc(CCNC(=O)N2CCN(c3ccc(C#N)nc3)CC2)c1	ZINC000875444311	GD	On-Demand	Mild	CTSK	25	42
COC(=O)c1cccc(CCNC(=O)N2CCN(c3ccc(C#N)nc3)CC2)c1	ZINC000875444311	GD	On-Demand	Mild	CTSL	18	42
CCC[C@H]1CCc2ccccc2N1C(=O)[C@H]1CCC(=O)O1	ZINC000875444356	CF	On-Demand	Anodyne	ACE	21	41
CCC[C@H]1CCc2ccccc2N1C(=O)[C@H]1CCC(=O)O1	ZINC000875444356	CF	On-Demand	Anodyne	TPP2	55	33
CCC[C@@H]1CCc2ccccc2N1C(=O)[C@H]1CCC(=O)O1	ZINC000875444357	CF	On-Demand	Anodyne	ACE	21	41
CCC[C@@H]1CCc2ccccc2N1C(=O)[C@H]1CCC(=O)O1	ZINC000875444357	CF	On-Demand	Anodyne	TPP2	55	33
Cc1cncc([C@H]2CCCN2C(=O)NCC(C)(C)c2ccncc2)c1	ZINC000875444415	EH	On-Demand	Anodyne	PREP	25	40
Cc1cncc([C@@H]2CCCN2C(=O)NCC(C)(C)c2ccncc2)c1	ZINC000875444416	EH	On-Demand	Anodyne	PREP	25	40
COC(=O)c1cccc(CCNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875444433	FD	On-Demand	Anodyne	DRD4	25	43
COC(=O)c1cccc(CCNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875444433	FD	On-Demand	Anodyne	SSTR5	40	34
COC(=O)c1cccc(CCNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875444433	FD	On-Demand	Anodyne	CCR2	25	41
COC(=O)c1cccc(CCNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875444433	FD	On-Demand	Anodyne	MCHR1	20	42
COC(=O)c1cccc(CCNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c1	ZINC000875444433	FD	On-Demand	Anodyne	BIRC2	27	41
COC(=O)c1cccc(CCNC(=O)N2CC[C@](C)(C(F)(F)F)C2)c1	ZINC000875444461	FF	On-Demand	Anodyne	EPHX2	23	41
COC(=O)c1cccc(CCNC(=O)N2CC[C@@](C)(C(F)(F)F)C2)c1	ZINC000875444462	FF	On-Demand	Anodyne	EPHX2	23	41
COC(=O)c1cccc(CCNC(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)OC)C3)c1	ZINC000875444483	FD	On-Demand	Anodyne	SLC6A3	45	39
COC(=O)c1cccc(CCNC(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)OC)C3)c1	ZINC000875444484	FD	On-Demand	Anodyne	SLC6A3	45	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCc1cccs1	ZINC000875444485	DE	On-Demand	Anodyne	SLC6A3	38	42
COc1cccc(OC)c1CNC(=O)C(=O)NC[C@H]1c2ccccc2CN1C	ZINC000875444542	GD	On-Demand	Anodyne	DRD3	41	36
COc1cccc(OC)c1CNC(=O)C(=O)NC[C@H]1c2ccccc2CN1C	ZINC000875444542	GD	On-Demand	Anodyne	SSTR1	48	35
COc1cccc(OC)c1CNC(=O)C(=O)NC[C@@H]1c2ccccc2CN1C	ZINC000875444543	GD	On-Demand	Anodyne	DRD3	41	36
COc1cccc(OC)c1CNC(=O)C(=O)NC[C@@H]1c2ccccc2CN1C	ZINC000875444543	GD	On-Demand	Anodyne	SSTR1	48	35
O=C(NCCC1CCS(=O)(=O)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875444587	GD	On-Demand	Anodyne	EPHX2	15	44
O=C(NCCC1CCS(=O)(=O)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875444588	GD	On-Demand	Anodyne	EPHX2	15	44
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCC(C)(C)c1ccncc1)CC2	ZINC000875444616	GH	On-Demand	Anodyne	SLC18A2	47	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCC(C)(C)c1ccncc1)CC2	ZINC000875444616	GH	On-Demand	Anodyne	MTNR1B	15	47
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCC(C)(C)c1ccncc1)CC2	ZINC000875444617	GH	On-Demand	Anodyne	SLC18A2	47	34
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCC(C)(C)c1ccncc1)CC2	ZINC000875444617	GH	On-Demand	Anodyne	MTNR1B	15	47
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3CCCN4CCCC[C@@H]34)CC2)CC1	ZINC000875444642	GC	On-Demand	Anodyne	L3MBTL3	89	48
CN1CCN(C2CCN(C(=O)C(=O)N[C@H]3CCCN4CCCC[C@@H]34)CC2)CC1	ZINC000875444643	GC	On-Demand	Anodyne	L3MBTL3	89	48
CN1CCN(C2CCN(C(=O)C(=O)N[C@H]3CCCN4CCCC[C@H]34)CC2)CC1	ZINC000875444644	GC	On-Demand	Anodyne	L3MBTL3	89	48
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3CCCN4CCCC[C@H]34)CC2)CC1	ZINC000875444645	GC	On-Demand	Anodyne	L3MBTL3	89	48
COC(=O)c1cccc(CCNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875444659	ED	On-Demand	Anodyne	DRD4	40	30
COC(=O)c1cccc(CCNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875444659	ED	On-Demand	Anodyne	ST14	56	34
COC(=O)c1cccc(CCNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875444660	ED	On-Demand	Anodyne	DRD4	40	30
COC(=O)c1cccc(CCNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875444660	ED	On-Demand	Anodyne	ST14	56	34
CCC[C@H]1CCc2ccccc2N1C(=O)c1cn2c(n1)C[C@H](OC)CC2	ZINC000875444700	FH	On-Demand	Anodyne	TPP2	49	38
CCC[C@@H]1CCc2ccccc2N1C(=O)c1cn2c(n1)C[C@H](OC)CC2	ZINC000875444701	FH	On-Demand	Anodyne	TPP2	49	38
CCC[C@H]1CCc2ccccc2N1C(=O)c1cn2c(n1)C[C@@H](OC)CC2	ZINC000875444702	FH	On-Demand	Anodyne	TPP2	49	38
CCC[C@@H]1CCc2ccccc2N1C(=O)c1cn2c(n1)C[C@@H](OC)CC2	ZINC000875444703	FH	On-Demand	Anodyne	TPP2	49	38
CONC(=O)C1CCN(C(=O)NCCc2cccc(C(=O)OC)c2)CC1	ZINC000875444712	FD	On-Demand	Anodyne	MTNR1B	15	40
CONC(=O)C1CCN(C(=O)NCCc2cccc(C(=O)OC)c2)CC1	ZINC000875444712	FD	On-Demand	Anodyne	EPHX2	15	41
CONC(=O)C1CCN(C(=O)NCCc2cccc(C(=O)OC)c2)CC1	ZINC000875444712	FD	On-Demand	Anodyne	ST14	42	32
O=C(NCc1ccc(N2CCN(CC3CC3)CC2)cc1)N1C[C@H]2COC[C@H]2C1	ZINC000875444720	GE	On-Demand	Clean	NAMPT	28	40
COC(=O)c1cccc(CCNC(=O)N2CCc3ccc(NC(C)=O)cc3C2)c1	ZINC000875444724	GF	On-Demand	Anodyne	P2RY14	44	33
O=C1CCN(C(=O)NCCCc2cccs2)CCCCCCN1	ZINC000875444742	EF	On-Demand	Anodyne	DPP7	18	41
CC[C@@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)[C@@H]1CCCCO1	ZINC000875444751	GC	On-Demand	Anodyne	L3MBTL3	48	40
CC[C@@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)[C@H]1CCCCO1	ZINC000875444752	GC	On-Demand	Anodyne	L3MBTL3	48	40
Cn1cnc(CNC(=O)N2CCC[C@@]2(C)Cc2ccc(F)c(C(F)(F)F)c2)n1	ZINC000875444764	GG	On-Demand	Anodyne	SLC12A5	23	47
Cn1cnc(CNC(=O)N2CCC[C@]2(C)Cc2ccc(F)c(C(F)(F)F)c2)n1	ZINC000875444765	GG	On-Demand	Anodyne	SLC12A5	23	47
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CC(F)(F)F)c1ccc(F)cc1	ZINC000875444785	GH	On-Demand	Anodyne	SLC6A4	25	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CC(F)(F)F)c1ccc(F)cc1	ZINC000875444785	GH	On-Demand	Anodyne	SLC6A3	65	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CC(F)(F)F)c1ccc(F)cc1	ZINC000875444786	GH	On-Demand	Anodyne	SLC6A4	25	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CC(F)(F)F)c1ccc(F)cc1	ZINC000875444786	GH	On-Demand	Anodyne	SLC6A3	65	47
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CC(F)(F)F)c1ccc(F)cc1	ZINC000875444787	GH	On-Demand	Anodyne	SLC6A4	25	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CC(F)(F)F)c1ccc(F)cc1	ZINC000875444787	GH	On-Demand	Anodyne	SLC6A3	65	47
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CC(F)(F)F)c1ccc(F)cc1	ZINC000875444788	GH	On-Demand	Anodyne	SLC6A4	25	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CC(F)(F)F)c1ccc(F)cc1	ZINC000875444788	GH	On-Demand	Anodyne	SLC6A3	65	47
COCCN(CC1CCN(C)CC1)C(=O)NCCc1cccc(C(=O)OC)c1	ZINC000875444883	GE	On-Demand	Anodyne	ACKR3	51	33
O=C(N[C@@H](CC(F)(F)F)c1ccc(F)cc1)N1CCC2(CCNC2=O)CC1	ZINC000875444886	GG	On-Demand	Anodyne	CACNA1H	44	39
O=C(N[C@H](CC(F)(F)F)c1ccc(F)cc1)N1CCC2(CCNC2=O)CC1	ZINC000875444887	GG	On-Demand	Anodyne	CACNA1H	44	39
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NCc1ncn(C)n1	ZINC000875444931	FE	On-Demand	Anodyne	LTA4H	17	43
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NCc1ncn(C)n1	ZINC000875444931	FE	On-Demand	Anodyne	ACKR3	46	31
CC(=O)[C@H]1CCCN(C(=O)N[C@H](CC(F)(F)F)c2ccc(F)cc2)C1	ZINC000875444941	FH	On-Demand	Anodyne	CCR5	17	41
CC(=O)[C@H]1CCCN(C(=O)N[C@H](CC(F)(F)F)c2ccc(F)cc2)C1	ZINC000875444941	FH	On-Demand	Anodyne	DPP7	49	34
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](CC(F)(F)F)c2ccc(F)cc2)C1	ZINC000875444942	FH	On-Demand	Anodyne	CCR5	17	41
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](CC(F)(F)F)c2ccc(F)cc2)C1	ZINC000875444942	FH	On-Demand	Anodyne	DPP7	49	34
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](CC(F)(F)F)c2ccc(F)cc2)C1	ZINC000875444943	FH	On-Demand	Anodyne	CCR5	17	41
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](CC(F)(F)F)c2ccc(F)cc2)C1	ZINC000875444943	FH	On-Demand	Anodyne	DPP7	49	34
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](CC(F)(F)F)c2ccc(F)cc2)C1	ZINC000875444944	FH	On-Demand	Anodyne	CCR5	17	41
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](CC(F)(F)F)c2ccc(F)cc2)C1	ZINC000875444944	FH	On-Demand	Anodyne	DPP7	49	34
Cn1cnc(CNC(=O)N2CCC[C@@]2(C)Cc2ccc(F)c(Cl)c2)n1	ZINC000875444945	FF	On-Demand	Anodyne	MAPK1	19	40
Cn1cnc(CNC(=O)N2CCC[C@]2(C)Cc2ccc(F)c(Cl)c2)n1	ZINC000875444946	FF	On-Demand	Anodyne	MAPK1	19	40
O=C(N[C@H]1CCCN2CCCC[C@@H]12)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875444964	GE	On-Demand	Anodyne	CHRNA7	46	36
O=C(N[C@H]1CCCN2CCCC[C@@H]12)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875444964	GE	On-Demand	Anodyne	C3AR1	44	43
O=C(N[C@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H]1CCCN2CCCC[C@H]12	ZINC000875444965	GE	On-Demand	Anodyne	CHRNA7	46	36
O=C(N[C@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H]1CCCN2CCCC[C@H]12	ZINC000875444965	GE	On-Demand	Anodyne	C3AR1	44	43
O=C(N[C@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H]1CCCN2CCCC[C@@H]12	ZINC000875444966	GE	On-Demand	Anodyne	CHRNA7	46	36
O=C(N[C@H](Cc1cccnc1)C1CCCC1)C(=O)N[C@@H]1CCCN2CCCC[C@@H]12	ZINC000875444966	GE	On-Demand	Anodyne	C3AR1	44	43
O=C(N[C@H]1CCCN2CCCC[C@H]12)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875444967	GE	On-Demand	Anodyne	CHRNA7	46	36
O=C(N[C@H]1CCCN2CCCC[C@H]12)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875444967	GE	On-Demand	Anodyne	C3AR1	44	43
COC(=O)c1cccc(CCNC(=O)N2CCC(N3CCN(C)CC3)CC2)c1	ZINC000875444968	GD	On-Demand	Anodyne	L3MBTL3	81	41
COC(=O)c1cccc(CCNC(=O)N2CCc3cccc(NC(C)=O)c3C2)c1	ZINC000875444983	GF	On-Demand	Anodyne	P2RY14	42	32
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)cc2)CC1	ZINC000875445077	GE	On-Demand	Anodyne	CACNA1H	44	41
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)cc2)CC1	ZINC000875445077	GE	On-Demand	Anodyne	CCR1	46	36
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)cc2)CC1	ZINC000875445077	GE	On-Demand	Anodyne	EPHX2	16	40
C[C@@H](O)C1CCN(C(=O)N[C@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)cc2)CC1	ZINC000875445078	GE	On-Demand	Anodyne	CACNA1H	44	41
C[C@@H](O)C1CCN(C(=O)N[C@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)cc2)CC1	ZINC000875445078	GE	On-Demand	Anodyne	CCR1	46	36
C[C@@H](O)C1CCN(C(=O)N[C@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)cc2)CC1	ZINC000875445078	GE	On-Demand	Anodyne	EPHX2	16	40
Cn1cnc(CNC(=O)N2CC[C@@H](c3cccc(Cl)c3)C2(C)C)n1	ZINC000875445137	EF	On-Demand	Anodyne	MDM2	68	33
Cn1cnc(CNC(=O)N2CC[C@H](c3cccc(Cl)c3)C2(C)C)n1	ZINC000875445138	EF	On-Demand	Anodyne	MDM2	68	33
NC(=O)c1sccc1NC(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875445159	EE	On-Demand	Anodyne	DRD4	37	44
NC(=O)c1sccc1NC(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875445159	EE	On-Demand	Anodyne	SLC6A1	42	38
NC(=O)c1sccc1NC(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875445159	EE	On-Demand	Anodyne	LTA4H	15	42
NC(=O)c1sccc1NC(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875445159	EE	On-Demand	Anodyne	SIGMAR1	48	53
NC(=O)c1sccc1NC(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875445160	EE	On-Demand	Anodyne	DRD4	37	44
NC(=O)c1sccc1NC(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875445160	EE	On-Demand	Anodyne	SLC6A1	42	38
NC(=O)c1sccc1NC(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875445160	EE	On-Demand	Anodyne	LTA4H	15	42
NC(=O)c1sccc1NC(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875445160	EE	On-Demand	Anodyne	SIGMAR1	48	53
Cn1cnc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)n1	ZINC000875445165	ED	On-Demand	Anodyne	CPT1A	75	35
Cn1cnc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)n1	ZINC000875445166	ED	On-Demand	Anodyne	CPT1A	75	35
Cn1cnc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)n1	ZINC000875445167	ED	On-Demand	Anodyne	CPT1A	75	35
Cn1cnc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)n1	ZINC000875445168	ED	On-Demand	Anodyne	CPT1A	75	35
NC(=O)c1sccc1NC(=O)COCC(F)F	ZINC000875445193	CD	On-Demand	Anodyne	FAS	31	42
Cn1cnc(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)n1	ZINC000875445207	DC	On-Demand	Anodyne	CTSV	32	41
Cn1cnc(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)n1	ZINC000875445208	DC	On-Demand	Anodyne	CTSV	32	41
CC(=O)C1CCN(C(=O)NCC(C)(C)c2ccncc2)CC1	ZINC000875445225	DE	On-Demand	Anodyne	CACNA1G	25	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ncn(C)n1	ZINC000875445266	CC	On-Demand	Anodyne	SLC6A3	49	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ncn(C)n1	ZINC000875445267	CC	On-Demand	Anodyne	SLC6A3	49	39
Cn1cnc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)n1	ZINC000875445294	DD	On-Demand	Anodyne	EPHX2	18	40
Cn1cnc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)n1	ZINC000875445295	DD	On-Demand	Anodyne	EPHX2	18	40
COC(=O)c1cccc(CCNC(=O)N2CCC3(CCN(C)CC3)CC2)c1	ZINC000875445399	FF	On-Demand	Anodyne	DRD4	41	31
O=C(N[C@H](c1cccc(C(F)(F)F)c1)C1CC1)N1CCC2(CCNC2=O)CC1	ZINC000875445406	GG	On-Demand	Anodyne	CACNA1H	45	41
O=C(N[C@H](c1cccc(C(F)(F)F)c1)C1CC1)N1CCC2(CCNC2=O)CC1	ZINC000875445406	GG	On-Demand	Anodyne	CCR2	44	35
O=C(N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1)N1CCC2(CCNC2=O)CC1	ZINC000875445407	GG	On-Demand	Anodyne	CACNA1H	45	41
O=C(N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1)N1CCC2(CCNC2=O)CC1	ZINC000875445407	GG	On-Demand	Anodyne	CCR2	44	35
COC[C@@H](C)NC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875445444	DE	On-Demand	Anodyne	ACE	32	41
COC[C@@H](C)NC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875445444	DE	On-Demand	Anodyne	FKBP1A	51	38
COC[C@@H](C)NC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875445444	DE	On-Demand	Anodyne	SLC6A3	17	46
COC[C@@H](C)NC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875445444	DE	On-Demand	Anodyne	CPT1A	90	36
COC[C@@H](C)NC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875445444	DE	On-Demand	Anodyne	CPT2	44	35
COC[C@@H](C)NC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875445445	DE	On-Demand	Anodyne	ACE	32	41
COC[C@@H](C)NC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875445445	DE	On-Demand	Anodyne	FKBP1A	51	38
COC[C@@H](C)NC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875445445	DE	On-Demand	Anodyne	SLC6A3	17	46
COC[C@@H](C)NC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875445445	DE	On-Demand	Anodyne	CPT1A	90	36
COC[C@@H](C)NC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875445445	DE	On-Demand	Anodyne	CPT2	44	35
COC[C@@H](C)NC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875445446	DE	On-Demand	Anodyne	ACE	32	41
COC[C@@H](C)NC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875445446	DE	On-Demand	Anodyne	FKBP1A	51	38
COC[C@@H](C)NC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875445446	DE	On-Demand	Anodyne	SLC6A3	17	46
COC[C@@H](C)NC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875445446	DE	On-Demand	Anodyne	CPT1A	90	36
COC[C@@H](C)NC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875445446	DE	On-Demand	Anodyne	CPT2	44	35
COC[C@@H](C)NC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875445447	DE	On-Demand	Anodyne	ACE	32	41
COC[C@@H](C)NC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875445447	DE	On-Demand	Anodyne	FKBP1A	51	38
COC[C@@H](C)NC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875445447	DE	On-Demand	Anodyne	SLC6A3	17	46
COC[C@@H](C)NC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875445447	DE	On-Demand	Anodyne	CPT1A	90	36
COC[C@@H](C)NC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875445447	DE	On-Demand	Anodyne	CPT2	44	35
CC[C@@H](NC(=O)NCc1cc(F)cc(OC)c1)[C@@H](O)c1ccccc1	ZINC000875445514	EG	On-Demand	Anodyne	BACE1	31	44
CC[C@@H](NC(=O)NCc1cc(F)cc(OC)c1)[C@@H](O)c1ccccc1	ZINC000875445514	EG	On-Demand	Anodyne	PDS	47	39
CC[C@@H](NC(=O)NCc1cc(F)cc(OC)c1)[C@H](O)c1ccccc1	ZINC000875445515	EG	On-Demand	Anodyne	BACE1	31	44
CC[C@@H](NC(=O)NCc1cc(F)cc(OC)c1)[C@H](O)c1ccccc1	ZINC000875445515	EG	On-Demand	Anodyne	PDS	47	39
COC(=O)C1(O)CN(C(=O)N[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)C1	ZINC000875445588	FE	On-Demand	Anodyne	CACNA1B	45	32
COC(=O)C1(O)CN(C(=O)N[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)C1	ZINC000875445588	FE	On-Demand	Anodyne	CCR2	48	35
COC(=O)C1(O)CN(C(=O)N[C@H](c2cccc(C(F)(F)F)c2)C2CC2)C1	ZINC000875445589	FE	On-Demand	Anodyne	CACNA1B	45	32
COC(=O)C1(O)CN(C(=O)N[C@H](c2cccc(C(F)(F)F)c2)C2CC2)C1	ZINC000875445589	FE	On-Demand	Anodyne	CCR2	48	35
CONC(=O)C1CCN(C(=O)N[C@H](c2cccc(C(F)(F)F)c2)C2CC2)CC1	ZINC000875445605	GG	On-Demand	Anodyne	CACNA1B	41	35
CONC(=O)C1CCN(C(=O)N[C@H](c2cccc(C(F)(F)F)c2)C2CC2)CC1	ZINC000875445605	GG	On-Demand	Anodyne	CCR2	51	36
CONC(=O)C1CCN(C(=O)N[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)CC1	ZINC000875445606	GG	On-Demand	Anodyne	CACNA1B	41	35
CONC(=O)C1CCN(C(=O)N[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)CC1	ZINC000875445606	GG	On-Demand	Anodyne	CCR2	51	36
CC(=O)C1CCN(C(=O)N[C@H](c2cccc(C(F)(F)F)c2)C2CC2)CC1	ZINC000875445617	FI	On-Demand	Anodyne	CCR2	54	37
CC(=O)C1CCN(C(=O)N[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)CC1	ZINC000875445618	FI	On-Demand	Anodyne	CCR2	54	37
C[C@H]1C[C@H](NC(=O)NNc2ccc(OCc3ccccc3)cc2)CCO1	ZINC000875445685	FG	On-Demand	Reactive	LTA4H	32	43
C[C@H]1C[C@H](NC(=O)NNc2ccc(OCc3ccccc3)cc2)CCO1	ZINC000875445685	FG	On-Demand	Reactive	ADAM17	21	44
C[C@H]1C[C@H](NC(=O)NNc2ccc(OCc3ccccc3)cc2)CCO1	ZINC000875445685	FG	On-Demand	Reactive	EPHX2	15	44
C[C@H]1C[C@H](NC(=O)NNc2ccc(OCc3ccccc3)cc2)CCO1	ZINC000875445685	FG	On-Demand	Reactive	NAAA	19	44
CO[C@@](C)(CNC(=O)C(=O)N[C@H](C)c1ccnn1C)COCc1ccccc1	ZINC000875445719	GD	On-Demand	Anodyne	CTSV	40	33
CO[C@@](C)(CNC(=O)C(=O)N[C@@H](C)c1ccnn1C)COCc1ccccc1	ZINC000875445720	GD	On-Demand	Anodyne	CTSV	40	33
COCC(C)(C)CCNC(=O)C(=O)NCCc1ccnc2ccccc12	ZINC000875445760	FE	On-Demand	Anodyne	MTNR1A	33	47
COCC(C)(C)CCNC(=O)C(=O)NCCc1ccnc2ccccc12	ZINC000875445760	FE	On-Demand	Anodyne	MTNR1B	23	47
C#CC[C@@H](COC)NC(=O)C(=O)NCCc1ccnc2ccccc12	ZINC000875445835	ED	On-Demand	Mild	MTNR1A	22	43
C#CC[C@H](COC)NC(=O)C(=O)NCCc1ccnc2ccccc12	ZINC000875445836	ED	On-Demand	Mild	MTNR1A	22	43
CC(=O)N1CCC[C@@H]1C(=O)Nc1cc(Br)cnc1Br	ZINC000875445838	GF	On-Demand	Anodyne	LGMN	57	35
O=C(NCCCCC1CC1)C(=O)NCCc1ccnc2ccccc12	ZINC000875445867	EF	On-Demand	Anodyne	MTNR1A	32	41
O=C(NCCCCC1CC1)C(=O)NCCc1ccnc2ccccc12	ZINC000875445867	EF	On-Demand	Anodyne	MTNR1B	28	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CCO[C@H](C)C2)CC1	ZINC000875445886	EH	On-Demand	Anodyne	EPHX2	19	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CCO[C@@H](C)C2)CC1	ZINC000875445887	EH	On-Demand	Anodyne	EPHX2	19	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2CCO[C@H](C)C2)CC1	ZINC000875445888	EH	On-Demand	Anodyne	EPHX2	19	41
COC[C@@H](C)NC(=O)N[C@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875445890	ED	On-Demand	Anodyne	MTNR1A	30	41
COC[C@@H](C)NC(=O)N[C@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875445890	ED	On-Demand	Anodyne	MTNR1B	29	41
COC[C@@H](C)NC(=O)N[C@@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875445891	ED	On-Demand	Anodyne	MTNR1A	30	41
COC[C@@H](C)NC(=O)N[C@@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875445891	ED	On-Demand	Anodyne	MTNR1B	29	41
COC[C@@H](C)NC(=O)N[C@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875445892	ED	On-Demand	Anodyne	MTNR1A	30	41
COC[C@@H](C)NC(=O)N[C@H](C)[C@@H](O)c1cc(OC)ccc1OC	ZINC000875445892	ED	On-Demand	Anodyne	MTNR1B	29	41
COC[C@@H](C)NC(=O)N[C@@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875445893	ED	On-Demand	Anodyne	MTNR1A	30	41
COC[C@@H](C)NC(=O)N[C@@H](C)[C@H](O)c1cc(OC)ccc1OC	ZINC000875445893	ED	On-Demand	Anodyne	MTNR1B	29	41
CC1(C)CC[C@@H](CNC(=O)N2CCC(CO)(CO)CC2)c2ccccc21	ZINC000875445926	FF	On-Demand	Anodyne	GHRHR	62	34
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(F)cc(OC)c1	ZINC000875445955	EE	On-Demand	Anodyne	SLC6A3	41	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cc(F)cc(OC)c1	ZINC000875445956	EE	On-Demand	Anodyne	SLC6A3	41	38
C[C@H](NC(=O)C(=O)NCCc1ccnc2ccccc12)c1ccnn1C	ZINC000875445997	FD	On-Demand	Anodyne	MTNR1A	16	40
CCCCCCCNC(=O)C(=O)NCCc1ccnc2ccccc12	ZINC000875446080	EF	On-Demand	Mild	TSPO	17	43
CCCCCCCNC(=O)C(=O)NCCc1ccnc2ccccc12	ZINC000875446080	EF	On-Demand	Mild	MTNR1A	60	48
CCCCCCCNC(=O)C(=O)NCCc1ccnc2ccccc12	ZINC000875446080	EF	On-Demand	Mild	MTNR1B	46	48
CCCCCCCNC(=O)C(=O)NCCc1ccnc2ccccc12	ZINC000875446080	EF	On-Demand	Mild	HNMT	47	38
CCCCCCCNC(=O)C(=O)NCCc1ccnc2ccccc12	ZINC000875446080	EF	On-Demand	Mild	ASAH1	84	34
COC[C@@H](C)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875446087	CD	On-Demand	Anodyne	ACE	42	44
COC[C@@H](C)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875446087	CD	On-Demand	Anodyne	SLC6A3	16	42
COC[C@@H](C)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875446087	CD	On-Demand	Anodyne	XIAP	42	38
COC[C@@H](C)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875446087	CD	On-Demand	Anodyne	BRCA1	44	33
COC[C@@H](C)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875446088	CD	On-Demand	Anodyne	ACE	42	44
COC[C@@H](C)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875446088	CD	On-Demand	Anodyne	SLC6A3	16	42
COC[C@@H](C)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875446088	CD	On-Demand	Anodyne	XIAP	42	38
COC[C@@H](C)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875446088	CD	On-Demand	Anodyne	BRCA1	44	33
COC[C@@H](C)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875446089	CD	On-Demand	Anodyne	ACE	42	44
COC[C@@H](C)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875446089	CD	On-Demand	Anodyne	SLC6A3	16	42
COC[C@@H](C)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875446089	CD	On-Demand	Anodyne	XIAP	42	38
COC[C@@H](C)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875446089	CD	On-Demand	Anodyne	BRCA1	44	33
COC[C@@H](C)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875446090	CD	On-Demand	Anodyne	ACE	42	44
COC[C@@H](C)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875446090	CD	On-Demand	Anodyne	SLC6A3	16	42
COC[C@@H](C)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875446090	CD	On-Demand	Anodyne	XIAP	42	38
COC[C@@H](C)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875446090	CD	On-Demand	Anodyne	BRCA1	44	33
C#CC[C@@H](CCOC)NC(=O)C(=O)NCCc1ccnc2ccccc12	ZINC000875446128	FD	On-Demand	Mild	MTNR1A	17	42
C#CC[C@H](CCOC)NC(=O)C(=O)NCCc1ccnc2ccccc12	ZINC000875446129	FD	On-Demand	Mild	MTNR1A	17	42
C[C@H]1C[C@H](NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CCO1	ZINC000875446180	EE	On-Demand	Mild	ITK	17	47
C[C@H]1C[C@H](NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CCO1	ZINC000875446180	EE	On-Demand	Mild	PANC	55	39
CCCCCCCNC(=O)C(=O)NCCc1cnccc1C	ZINC000875446191	DE	On-Demand	Mild	FAAH	15	41
CCCCCCCNC(=O)C(=O)NCCc1cnccc1C	ZINC000875446191	DE	On-Demand	Mild	ASAH1	86	35
O=C(N[C@H](c1cccc(C(F)(F)F)c1)C1CC1)N1CCC(CO)(CO)CC1	ZINC000875446212	GF	On-Demand	Anodyne	CCR2	70	38
O=C(N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1)N1CCC(CO)(CO)CC1	ZINC000875446213	GF	On-Demand	Anodyne	CCR2	70	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1(C)Cc2ccccc2C1	ZINC000875446285	EF	On-Demand	Anodyne	SLC6A4	24	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1(C)Cc2ccccc2C1	ZINC000875446285	EF	On-Demand	Anodyne	SLC6A3	48	40
COc1ccc(NC(=O)[C@H]2CCCN(S(C)(=O)=O)C2)c(Cl)n1	ZINC000875446323	ED	On-Demand	Anodyne	MMP7	17	41
Cc1ccncc1[C@H](C)NC(=O)N[C@@H](C)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875446378	FG	On-Demand	Anodyne	GPR119	18	41
Cc1ccncc1[C@H](C)NC(=O)N[C@H](C)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875446379	FG	On-Demand	Anodyne	GPR119	18	41
Cc1ccncc1[C@@H](C)NC(=O)N[C@@H](C)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875446380	FG	On-Demand	Anodyne	GPR119	18	41
Cc1ccncc1[C@@H](C)NC(=O)N[C@H](C)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875446381	FG	On-Demand	Anodyne	GPR119	18	41
C=CC(C)(C)CCCNC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875446426	GF	On-Demand	Mild	ACHE	33	46
C=CC(C)(C)CCCNC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875446426	GF	On-Demand	Mild	SIGMAR1	17	40
C=CC(C)(C)CCCNC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875446426	GF	On-Demand	Mild	CACNA1I	68	40
COc1ccc(NC(=O)c2ccc(C(=O)N3CCOCC3)cc2)c(Cl)n1	ZINC000875446454	GE	On-Demand	Anodyne	F10	15	42
COc1ccc(NC(=O)c2ccc(C(=O)N3CCOCC3)cc2)c(Cl)n1	ZINC000875446454	GE	On-Demand	Anodyne	BTK	42	42
COc1ccc(NC(=O)c2ccc(C(=O)N3CCOCC3)cc2)c(Cl)n1	ZINC000875446454	GE	On-Demand	Anodyne	LRRK2	36	49
COc1ccc(NC(=O)[C@H]2CCCN2C(C)=O)c(Cl)n1	ZINC000875446463	CD	On-Demand	Anodyne	CELA1	22	40
COc1ccc(NC(=O)[C@H]2CCCN2C(C)=O)c(Cl)n1	ZINC000875446463	CD	On-Demand	Anodyne	ELANE	45	36
COc1ccc(NC(=O)[C@H]2CCCN2C(C)=O)c(Cl)n1	ZINC000875446463	CD	On-Demand	Anodyne	LGMN	65	36
COc1ccc(NC(=O)[C@H](C)n2ccc(C(F)(F)F)n2)c(Cl)n1	ZINC000875446465	EG	On-Demand	Anodyne	TRPV1	48	36
Cc1ccncc1[C@H](C)NC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C	ZINC000875446473	FG	On-Demand	Anodyne	GPR119	27	43
Cc1ccncc1[C@@H](C)NC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C	ZINC000875446474	FG	On-Demand	Anodyne	GPR119	27	43
Cc1ccncc1[C@H](C)NC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875446478	FH	On-Demand	Anodyne	CPT1A	46	35
Cc1ccncc1[C@H](C)NC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875446479	FH	On-Demand	Anodyne	CPT1A	46	35
Cc1ccncc1[C@H](C)NC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875446480	FH	On-Demand	Anodyne	CPT1A	46	35
Cc1ccncc1[C@H](C)NC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875446481	FH	On-Demand	Anodyne	CPT1A	46	35
O=C(N[C@H]1CCO[C@@]2(CCOC2)C1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875446488	FF	On-Demand	Anodyne	EPHX2	19	40
O=C(N[C@@H]1CCO[C@]2(CCOC2)C1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875446489	FF	On-Demand	Anodyne	EPHX2	19	40
O=C(N[C@H]1CCO[C@]2(CCOC2)C1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875446490	FF	On-Demand	Anodyne	EPHX2	19	40
O=C(N[C@@H]1CCO[C@@]2(CCOC2)C1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875446491	FF	On-Demand	Anodyne	EPHX2	19	40
COc1ccc(NC(=O)c2cc(C)cc(OC)c2C)c(Cl)n1	ZINC000875446543	DH	On-Demand	Anodyne	KCNMA1	34	43
O=C(NCCC[C@@H]1C=CCC1)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875446544	GE	On-Demand	Anodyne	ACHE	29	47
O=C(NCCC[C@@H]1C=CCC1)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875446544	GE	On-Demand	Anodyne	SIGMAR1	15	41
O=C(NCCC[C@@H]1C=CCC1)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875446544	GE	On-Demand	Anodyne	CACNA1I	47	38
O=C(NCCC[C@H]1C=CCC1)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875446545	GE	On-Demand	Anodyne	ACHE	29	47
O=C(NCCC[C@H]1C=CCC1)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875446545	GE	On-Demand	Anodyne	SIGMAR1	15	41
O=C(NCCC[C@H]1C=CCC1)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875446545	GE	On-Demand	Anodyne	CACNA1I	47	38
C#CC[C@H](COC)NC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875446554	FC	On-Demand	Mild	ACHE	20	43
C#CC[C@H](COC)NC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875446554	FC	On-Demand	Mild	HTR4	28	41
C#CC[C@H](COC)NC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875446554	FC	On-Demand	Mild	SIGMAR1	15	40
C#CC[C@H](COC)NC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875446554	FC	On-Demand	Mild	CACNA1I	51	39
C#CC[C@@H](COC)NC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875446555	FC	On-Demand	Mild	ACHE	20	43
C#CC[C@@H](COC)NC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875446555	FC	On-Demand	Mild	HTR4	28	41
C#CC[C@@H](COC)NC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875446555	FC	On-Demand	Mild	SIGMAR1	15	40
C#CC[C@@H](COC)NC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875446555	FC	On-Demand	Mild	CACNA1I	51	39
CN1CC[C@H]2CN(C(=O)C(=O)NCC3CCN(Cc4ccncc4)CC3)CC[C@@H]21	ZINC000875446592	GC	On-Demand	Anodyne	ACHE	23	43
CN1CC[C@H]2CN(C(=O)C(=O)NCC3CCN(Cc4ccncc4)CC3)CC[C@@H]21	ZINC000875446592	GC	On-Demand	Anodyne	CCR3	15	40
CN1CC[C@H]2CN(C(=O)C(=O)NCC3CCN(Cc4ccncc4)CC3)CC[C@@H]21	ZINC000875446592	GC	On-Demand	Anodyne	CACNA1I	64	41
CN1CC[C@H]2CN(C(=O)C(=O)NCC3CCN(Cc4ccncc4)CC3)CC[C@H]21	ZINC000875446594	GC	On-Demand	Anodyne	ACHE	23	43
CN1CC[C@H]2CN(C(=O)C(=O)NCC3CCN(Cc4ccncc4)CC3)CC[C@H]21	ZINC000875446594	GC	On-Demand	Anodyne	CCR3	15	40
CN1CC[C@H]2CN(C(=O)C(=O)NCC3CCN(Cc4ccncc4)CC3)CC[C@H]21	ZINC000875446594	GC	On-Demand	Anodyne	CACNA1I	64	41
CO[C@@H](c1ccc(F)cc1)[C@H](C)NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875446686	GG	On-Demand	Anodyne	CACNA1H	45	39
CO[C@@H](c1ccc(F)cc1)[C@@H](C)NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875446687	GG	On-Demand	Anodyne	CACNA1H	45	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1OC	ZINC000875446740	GG	On-Demand	Anodyne	OPRM1	42	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1OC	ZINC000875446740	GG	On-Demand	Anodyne	MME	87	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1OC	ZINC000875446740	GG	On-Demand	Anodyne	ANPEP	67	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1OC	ZINC000875446740	GG	On-Demand	Anodyne	TACR1	17	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1OC	ZINC000875446740	GG	On-Demand	Anodyne	CMA1	45	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1OC	ZINC000875446740	GG	On-Demand	Anodyne	CTRA_BOVIN	44	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1OC	ZINC000875446740	GG	On-Demand	Anodyne	FCER2	92	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1OC	ZINC000875446740	GG	On-Demand	Anodyne	CASP3	15	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1OC	ZINC000875446740	GG	On-Demand	Anodyne	KLK3	79	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1OC	ZINC000875446740	GG	On-Demand	Anodyne	CTSB	79	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1OC	ZINC000875446740	GG	On-Demand	Anodyne	PAPA1_CARPA	88	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1OC	ZINC000875446740	GG	On-Demand	Anodyne	CYSP_TRYCR	69	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1OC	ZINC000875446740	GG	On-Demand	Anodyne	CCKAR	48	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1OC	ZINC000875446740	GG	On-Demand	Anodyne	CTSK	33	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1OC	ZINC000875446740	GG	On-Demand	Anodyne	CTSL	69	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1OC	ZINC000875446740	GG	On-Demand	Anodyne	TIMP3	85	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1OC	ZINC000875446740	GG	On-Demand	Anodyne	CAPNS1	64	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1OC	ZINC000875446740	GG	On-Demand	Anodyne	GRIA1	48	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1OC	ZINC000875446740	GG	On-Demand	Anodyne	HLA-DRB1	105	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1OC	ZINC000875446740	GG	On-Demand	Anodyne	REN	36	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1OC	ZINC000875446740	GG	On-Demand	Anodyne	MMP11	49	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1OC	ZINC000875446740	GG	On-Demand	Anodyne	CTSS	31	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1OC	ZINC000875446740	GG	On-Demand	Anodyne	CAPN1	99	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1OC	ZINC000875446740	GG	On-Demand	Anodyne	CTRC	42	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1OC	ZINC000875446740	GG	On-Demand	Anodyne	CAPN2	124	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1OC	ZINC000875446740	GG	On-Demand	Anodyne	ACE2	60	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1OC	ZINC000875446740	GG	On-Demand	Anodyne	FPR1	64	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1OC	ZINC000875446740	GG	On-Demand	Anodyne	NPR	49	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1OC	ZINC000875446740	GG	On-Demand	Anodyne	PSMB8	51	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(F)cc(F)c1OC	ZINC000875446740	GG	On-Demand	Anodyne	GPR142	53	38
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875446745	GC	On-Demand	Mild	ACHE	20	45
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875446745	GC	On-Demand	Mild	HTR4	36	42
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875446745	GC	On-Demand	Mild	CACNA1I	60	41
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875446746	GC	On-Demand	Mild	ACHE	20	45
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875446746	GC	On-Demand	Mild	HTR4	36	42
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875446746	GC	On-Demand	Mild	CACNA1I	60	41
COC[C@@H](NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)c1cccc(OC)c1	ZINC000875446750	FD	On-Demand	Anodyne	DRD4	40	30
COC[C@@H](NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)c1cccc(OC)c1	ZINC000875446751	FD	On-Demand	Anodyne	DRD4	40	30
COC[C@H](NC(=O)C(=O)N1CC[C@H](C(C)(C)O)C1)c1cccc(OC)c1	ZINC000875446752	FD	On-Demand	Anodyne	DRD4	40	30
COC[C@H](NC(=O)C(=O)N1CC[C@@H](C(C)(C)O)C1)c1cccc(OC)c1	ZINC000875446753	FD	On-Demand	Anodyne	DRD4	40	30
CC(=O)Nc1cccc2c1CN(C(=O)N[C@@H](C)c1cnccc1C)CC2	ZINC000875446794	FG	On-Demand	Anodyne	P2RY14	48	38
CC(=O)Nc1cccc2c1CN(C(=O)N[C@H](C)c1cnccc1C)CC2	ZINC000875446795	FG	On-Demand	Anodyne	P2RY14	48	38
COc1ccc(NC(=O)[C@H]2CCN(Cc3ccccc3)C2)c(Cl)n1	ZINC000875446824	EG	On-Demand	Anodyne	DRD2	18	51
COc1ccc(NC(=O)[C@H]2CCN(Cc3ccccc3)C2)c(Cl)n1	ZINC000875446824	EG	On-Demand	Anodyne	DRD4	54	51
COc1ccc(NC(=O)[C@H]2CCN(Cc3ccccc3)C2)c(Cl)n1	ZINC000875446824	EG	On-Demand	Anodyne	ACHE	55	47
COc1ccc(NC(=O)[C@H]2CCN(Cc3ccccc3)C2)c(Cl)n1	ZINC000875446824	EG	On-Demand	Anodyne	HRH1	15	40
COc1ccc(NC(=O)[C@H]2CCN(Cc3ccccc3)C2)c(Cl)n1	ZINC000875446824	EG	On-Demand	Anodyne	DRD3	19	51
COc1ccc(NC(=O)[C@H]2CCN(Cc3ccccc3)C2)c(Cl)n1	ZINC000875446824	EG	On-Demand	Anodyne	HTR4	18	40
COc1ccc(NC(=O)[C@H]2CCN(Cc3ccccc3)C2)c(Cl)n1	ZINC000875446824	EG	On-Demand	Anodyne	LTA4H	17	42
COc1ccc(NC(=O)[C@H]2CCN(Cc3ccccc3)C2)c(Cl)n1	ZINC000875446824	EG	On-Demand	Anodyne	SIGMAR1	48	50
COc1ccc(NC(=O)[C@H]2CCN(Cc3ccccc3)C2)c(Cl)n1	ZINC000875446824	EG	On-Demand	Anodyne	CCR3	46	41
COc1ccc(NC(=O)[C@H]2CCN(Cc3ccccc3)C2)c(Cl)n1	ZINC000875446824	EG	On-Demand	Anodyne	SLC18A3	25	48
COc1ccc(NC(=O)[C@H]2CCN(Cc3ccccc3)C2)c(Cl)n1	ZINC000875446824	EG	On-Demand	Anodyne	MCHR1	28	41
COc1ccc(NC(=O)[C@H]2CCN(Cc3ccccc3)C2)c(Cl)n1	ZINC000875446824	EG	On-Demand	Anodyne	CACNA1G	39	40
COc1ccc(NC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c(Cl)n1	ZINC000875446825	EG	On-Demand	Anodyne	DRD2	18	51
COc1ccc(NC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c(Cl)n1	ZINC000875446825	EG	On-Demand	Anodyne	DRD4	54	51
COc1ccc(NC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c(Cl)n1	ZINC000875446825	EG	On-Demand	Anodyne	ACHE	55	47
COc1ccc(NC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c(Cl)n1	ZINC000875446825	EG	On-Demand	Anodyne	HRH1	15	40
COc1ccc(NC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c(Cl)n1	ZINC000875446825	EG	On-Demand	Anodyne	DRD3	19	51
COc1ccc(NC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c(Cl)n1	ZINC000875446825	EG	On-Demand	Anodyne	HTR4	18	40
COc1ccc(NC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c(Cl)n1	ZINC000875446825	EG	On-Demand	Anodyne	LTA4H	17	42
COc1ccc(NC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c(Cl)n1	ZINC000875446825	EG	On-Demand	Anodyne	SIGMAR1	48	50
COc1ccc(NC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c(Cl)n1	ZINC000875446825	EG	On-Demand	Anodyne	CCR3	46	41
COc1ccc(NC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c(Cl)n1	ZINC000875446825	EG	On-Demand	Anodyne	SLC18A3	25	48
COc1ccc(NC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c(Cl)n1	ZINC000875446825	EG	On-Demand	Anodyne	MCHR1	28	41
COc1ccc(NC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c(Cl)n1	ZINC000875446825	EG	On-Demand	Anodyne	CACNA1G	39	40
Cc1ccncc1[C@H](C)NC(=O)N1CCC(C)(N2CCCCC2)CC1	ZINC000875446838	EH	On-Demand	Anodyne	CCR5	28	43
Cc1ccncc1[C@@H](C)NC(=O)N1CCC(C)(N2CCCCC2)CC1	ZINC000875446840	EH	On-Demand	Anodyne	CCR5	28	43
COC[C@H](NC(=O)C(=O)NCc1nn(C)cc1C(F)F)c1cccc(OC)c1	ZINC000875446892	GD	On-Demand	Anodyne	DRD4	40	31
COC[C@@H](NC(=O)C(=O)NCc1nn(C)cc1C(F)F)c1cccc(OC)c1	ZINC000875446893	GD	On-Demand	Anodyne	DRD4	40	31
O=C(NCC1CCN(Cc2ccncc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875446894	FD	On-Demand	Anodyne	ACHE	23	44
O=C(NCC1CCN(Cc2ccncc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875446894	FD	On-Demand	Anodyne	SIGMAR1	23	40
O=C(NCC1CCN(Cc2ccncc2)CC1)C(=O)N[C@H]1CC12CCC2	ZINC000875446894	FD	On-Demand	Anodyne	CACNA1I	55	39
O=C(NCC1CCN(Cc2ccncc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875446895	FD	On-Demand	Anodyne	ACHE	23	44
O=C(NCC1CCN(Cc2ccncc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875446895	FD	On-Demand	Anodyne	SIGMAR1	23	40
O=C(NCC1CCN(Cc2ccncc2)CC1)C(=O)N[C@@H]1CC12CCC2	ZINC000875446895	FD	On-Demand	Anodyne	CACNA1I	55	39
Cc1ccncc1[C@H](C)NC(=O)N1CCc2c(CC(N)=O)cccc2C1	ZINC000875446900	FE	On-Demand	Anodyne	P2RY14	47	35
Cc1ccncc1[C@@H](C)NC(=O)N1CCc2c(CC(N)=O)cccc2C1	ZINC000875446901	FE	On-Demand	Anodyne	P2RY14	47	35
Cc1ccncc1[C@@H](C)NC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875446948	EG	On-Demand	Anodyne	EPHX2	21	43
Cc1ccncc1[C@H](C)NC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875446949	EG	On-Demand	Anodyne	EPHX2	21	43
COC[C@H](NC(=O)C(=O)N1CCN(C)C(C)(C)CC1)c1cccc(OC)c1	ZINC000875446954	GD	On-Demand	Anodyne	DRD4	40	30
COC[C@@H](NC(=O)C(=O)N1CCN(C)C(C)(C)CC1)c1cccc(OC)c1	ZINC000875446956	GD	On-Demand	Anodyne	DRD4	40	30
O=C(NCCCCC1CC1)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875447073	FE	On-Demand	Anodyne	ACHE	49	54
O=C(NCCCCC1CC1)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875447073	FE	On-Demand	Anodyne	HTR4	33	42
O=C(NCCCCC1CC1)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875447073	FE	On-Demand	Anodyne	SIGMAR1	28	43
O=C(NCCCCC1CC1)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875447073	FE	On-Demand	Anodyne	CACNA1I	68	42
Cc1ccncc1[C@H](C)NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875447131	FH	On-Demand	Anodyne	SMO	39	41
Cc1ccncc1[C@H](C)NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875447131	FH	On-Demand	Anodyne	ETHR	60	43
Cc1ccncc1[C@@H](C)NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875447132	FH	On-Demand	Anodyne	SMO	39	41
Cc1ccncc1[C@@H](C)NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875447132	FH	On-Demand	Anodyne	ETHR	60	43
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@H](C)c1cscn1)CC2	ZINC000875447147	GE	On-Demand	Anodyne	SLC18A2	46	33
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@@H](C)c1cscn1)CC2	ZINC000875447148	GE	On-Demand	Anodyne	SLC18A2	46	33
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)N[C@@H](C)c1cscn1)CC2	ZINC000875447149	GE	On-Demand	Anodyne	SLC18A2	46	33
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)N[C@H](C)c1cscn1)CC2	ZINC000875447150	GE	On-Demand	Anodyne	SLC18A2	46	33
C[C@H](NC(=O)C(=O)N1CCN(c2ccc(F)cc2F)CC1)c1cscn1	ZINC000875447152	GD	On-Demand	Anodyne	NPY2R	63	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cnccc1C	ZINC000875447158	DE	On-Demand	Anodyne	SLC6A4	20	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cnccc1C	ZINC000875447158	DE	On-Demand	Anodyne	SLC6A3	43	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cnccc1C	ZINC000875447159	DE	On-Demand	Anodyne	SLC6A4	20	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cnccc1C	ZINC000875447159	DE	On-Demand	Anodyne	SLC6A3	43	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cnccc1C	ZINC000875447160	DE	On-Demand	Anodyne	SLC6A4	20	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cnccc1C	ZINC000875447160	DE	On-Demand	Anodyne	SLC6A3	43	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cnccc1C	ZINC000875447161	DE	On-Demand	Anodyne	SLC6A4	20	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cnccc1C	ZINC000875447161	DE	On-Demand	Anodyne	SLC6A3	43	40
Cc1ccncc1[C@H](C)NC(=O)NCc1cccc(OC(C)(C)C)c1	ZINC000875447189	EI	On-Demand	Anodyne	ROCK1	24	42
Cc1ccncc1[C@H](C)NC(=O)NCc1cccc(OC(C)(C)C)c1	ZINC000875447189	EI	On-Demand	Anodyne	ROCK2	30	44
Cc1ccncc1[C@H](C)NC(=O)NCc1cccc(OC(C)(C)C)c1	ZINC000875447189	EI	On-Demand	Anodyne	PDS	41	32
Cc1ccncc1[C@@H](C)NC(=O)NCc1cccc(OC(C)(C)C)c1	ZINC000875447190	EI	On-Demand	Anodyne	ROCK1	24	42
Cc1ccncc1[C@@H](C)NC(=O)NCc1cccc(OC(C)(C)C)c1	ZINC000875447190	EI	On-Demand	Anodyne	ROCK2	30	44
Cc1ccncc1[C@@H](C)NC(=O)NCc1cccc(OC(C)(C)C)c1	ZINC000875447190	EI	On-Demand	Anodyne	PDS	41	32
Cc1ccncc1[C@H](C)NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875447193	GH	On-Demand	Anodyne	GRIN2B	27	43
Cc1ccncc1[C@H](C)NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875447193	GH	On-Demand	Anodyne	CTSB	49	47
Cc1ccncc1[C@H](C)NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875447193	GH	On-Demand	Anodyne	CYSP_TRYCR	57	37
Cc1ccncc1[C@H](C)NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875447193	GH	On-Demand	Anodyne	CTSK	38	47
Cc1ccncc1[C@H](C)NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875447193	GH	On-Demand	Anodyne	CTSL	42	47
Cc1ccncc1[C@H](C)NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875447193	GH	On-Demand	Anodyne	C3AR1	44	42
Cc1ccncc1[C@H](C)NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875447193	GH	On-Demand	Anodyne	PREP	23	42
Cc1ccncc1[C@H](C)NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875447193	GH	On-Demand	Anodyne	CAPNS1	58	32
Cc1ccncc1[C@H](C)NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875447193	GH	On-Demand	Anodyne	TGM1	23	41
Cc1ccncc1[C@H](C)NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875447193	GH	On-Demand	Anodyne	CAPN1	70	36
Cc1ccncc1[C@H](C)NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875447193	GH	On-Demand	Anodyne	CAPN2	115	36
Cc1ccncc1[C@H](C)NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875447193	GH	On-Demand	Anodyne	TGM2	39	43
Cc1ccncc1[C@H](C)NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875447193	GH	On-Demand	Anodyne	NPR	52	31
Cc1ccncc1[C@H](C)NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875447193	GH	On-Demand	Anodyne	F13A1	23	43
Cc1ccncc1[C@H](C)NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875447193	GH	On-Demand	Anodyne	BIRC2	20	42
Cc1ccncc1[C@H](C)NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875447193	GH	On-Demand	Anodyne	Q6PRC7_IXORI	52	34
Cc1ccncc1[C@@H](C)NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875447194	GH	On-Demand	Anodyne	GRIN2B	27	43
Cc1ccncc1[C@@H](C)NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875447194	GH	On-Demand	Anodyne	CTSB	49	47
Cc1ccncc1[C@@H](C)NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875447194	GH	On-Demand	Anodyne	CYSP_TRYCR	57	37
Cc1ccncc1[C@@H](C)NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875447194	GH	On-Demand	Anodyne	CTSK	38	47
Cc1ccncc1[C@@H](C)NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875447194	GH	On-Demand	Anodyne	CTSL	42	47
Cc1ccncc1[C@@H](C)NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875447194	GH	On-Demand	Anodyne	C3AR1	44	42
Cc1ccncc1[C@@H](C)NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875447194	GH	On-Demand	Anodyne	PREP	23	42
Cc1ccncc1[C@@H](C)NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875447194	GH	On-Demand	Anodyne	CAPNS1	58	32
Cc1ccncc1[C@@H](C)NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875447194	GH	On-Demand	Anodyne	TGM1	23	41
Cc1ccncc1[C@@H](C)NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875447194	GH	On-Demand	Anodyne	CAPN1	70	36
Cc1ccncc1[C@@H](C)NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875447194	GH	On-Demand	Anodyne	CAPN2	115	36
Cc1ccncc1[C@@H](C)NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875447194	GH	On-Demand	Anodyne	TGM2	39	43
Cc1ccncc1[C@@H](C)NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875447194	GH	On-Demand	Anodyne	NPR	52	31
Cc1ccncc1[C@@H](C)NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875447194	GH	On-Demand	Anodyne	F13A1	23	43
Cc1ccncc1[C@@H](C)NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875447194	GH	On-Demand	Anodyne	BIRC2	20	42
Cc1ccncc1[C@@H](C)NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875447194	GH	On-Demand	Anodyne	Q6PRC7_IXORI	52	34
O=C(N[C@@H]1CCO[C@@]2(CCOC2)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875447249	FE	On-Demand	Anodyne	EPHX2	19	40
O=C(N[C@@H]1CCO[C@]2(CCOC2)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875447250	FE	On-Demand	Anodyne	EPHX2	19	40
O=C(N[C@@H]1CCO[C@]2(CCOC2)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875447251	FE	On-Demand	Anodyne	EPHX2	19	40
O=C(N[C@@H]1CCO[C@@]2(CCOC2)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875447252	FE	On-Demand	Anodyne	EPHX2	19	40
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCC2CCN(Cc3ccncc3)CC2)C1	ZINC000875447267	GD	On-Demand	Anodyne	ACHE	26	42
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCC2CCN(Cc3ccncc3)CC2)C1	ZINC000875447267	GD	On-Demand	Anodyne	CACNA1I	60	40
Cc1ccncc1[C@@H](C)NC(=O)NCC1(c2ccccc2)CCN(C)CC1	ZINC000875447276	FG	On-Demand	Anodyne	KCNA3	40	36
Cc1ccncc1[C@@H](C)NC(=O)NCC1(c2ccccc2)CCN(C)CC1	ZINC000875447276	FG	On-Demand	Anodyne	SOAT1	19	45
Cc1ccncc1[C@H](C)NC(=O)NCC1(c2ccccc2)CCN(C)CC1	ZINC000875447277	FG	On-Demand	Anodyne	KCNA3	40	36
Cc1ccncc1[C@H](C)NC(=O)NCC1(c2ccccc2)CCN(C)CC1	ZINC000875447277	FG	On-Demand	Anodyne	SOAT1	19	45
O=C(NCC1CCN(Cc2ccncc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875447289	GD	On-Demand	Anodyne	ACHE	24	45
O=C(NCC1CCN(Cc2ccncc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875447289	GD	On-Demand	Anodyne	SIGMAR1	26	42
O=C(NCC1CCN(Cc2ccncc2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875447289	GD	On-Demand	Anodyne	CACNA1I	61	41
COc1ccc(NC(=O)[C@@H]2COc3cc(F)ccc3C2)c(Cl)n1	ZINC000875447294	EG	On-Demand	Anodyne	ROCK2	33	53
COc1ccc(NC(=O)[C@H]2COc3cc(F)ccc3C2)c(Cl)n1	ZINC000875447295	EG	On-Demand	Anodyne	ROCK2	33	53
CCCCCCCNC(=O)C(=O)N[C@H](C)c1cscn1	ZINC000875447359	CE	On-Demand	Mild	ASAH1	83	34
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1cscn1	ZINC000875447360	CE	On-Demand	Mild	ASAH1	83	34
CO[C@@H](c1ccc(F)cc1)[C@@H](C)NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1	ZINC000875447362	GE	On-Demand	Anodyne	LEF	27	40
CO[C@@H](c1ccc(F)cc1)[C@H](C)NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1	ZINC000875447367	GE	On-Demand	Anodyne	LEF	27	40
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@@H](C)c1cnccc1C)CC2	ZINC000875447448	FG	On-Demand	Anodyne	MAPK1	46	42
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@H](C)c1cnccc1C)CC2	ZINC000875447449	FG	On-Demand	Anodyne	MAPK1	46	42
COC[C@H](NC(=O)C(=O)NC[C@H]1c2ccccc2CN1C)c1cccc(OC)c1	ZINC000875447463	GD	On-Demand	Anodyne	DRD4	43	34
COC[C@H](NC(=O)C(=O)NC[C@H]1c2ccccc2CN1C)c1cccc(OC)c1	ZINC000875447463	GD	On-Demand	Anodyne	MTNR1B	30	40
COC[C@@H](NC(=O)C(=O)NC[C@H]1c2ccccc2CN1C)c1cccc(OC)c1	ZINC000875447465	GD	On-Demand	Anodyne	DRD4	43	34
COC[C@@H](NC(=O)C(=O)NC[C@H]1c2ccccc2CN1C)c1cccc(OC)c1	ZINC000875447465	GD	On-Demand	Anodyne	MTNR1B	30	40
COC[C@H](NC(=O)C(=O)NC[C@@H]1c2ccccc2CN1C)c1cccc(OC)c1	ZINC000875447468	GD	On-Demand	Anodyne	DRD4	43	34
COC[C@H](NC(=O)C(=O)NC[C@@H]1c2ccccc2CN1C)c1cccc(OC)c1	ZINC000875447468	GD	On-Demand	Anodyne	MTNR1B	30	40
COC[C@@H](NC(=O)C(=O)NC[C@@H]1c2ccccc2CN1C)c1cccc(OC)c1	ZINC000875447470	GD	On-Demand	Anodyne	DRD4	43	34
COC[C@@H](NC(=O)C(=O)NC[C@@H]1c2ccccc2CN1C)c1cccc(OC)c1	ZINC000875447470	GD	On-Demand	Anodyne	MTNR1B	30	40
COc1ccc(NC(=O)[C@@H]2C[C@H]2c2ccsc2)c(Cl)n1	ZINC000875447487	DH	On-Demand	Anodyne	NPBWR1	97	38
COC[C@H](NC(=O)C(=O)N1CC[C@@H]2[C@H](CCN2C)C1)c1cccc(OC)c1	ZINC000875447540	GD	On-Demand	Anodyne	DRD4	42	32
COC[C@H](NC(=O)C(=O)N1CC[C@H]2[C@H](CCN2C)C1)c1cccc(OC)c1	ZINC000875447541	GD	On-Demand	Anodyne	DRD4	42	32
COC[C@H](NC(=O)C(=O)N1CC[C@@H]2[C@@H](CCN2C)C1)c1cccc(OC)c1	ZINC000875447542	GD	On-Demand	Anodyne	DRD4	42	32
COC[C@H](NC(=O)C(=O)N1CC[C@H]2[C@@H](CCN2C)C1)c1cccc(OC)c1	ZINC000875447543	GD	On-Demand	Anodyne	DRD4	42	32
COc1ccc(N2CCN(C(=O)N[C@@H](C)c3cnccc3C)CC2)c(OC)c1	ZINC000875447557	GG	On-Demand	Clean	HTR1A	17	43
COc1ccc(N2CCN(C(=O)N[C@@H](C)c3cnccc3C)CC2)c(OC)c1	ZINC000875447557	GG	On-Demand	Clean	HTR1B	15	43
COc1ccc(N2CCN(C(=O)N[C@@H](C)c3cnccc3C)CC2)c(OC)c1	ZINC000875447557	GG	On-Demand	Clean	PDGFRB	41	42
COc1ccc(N2CCN(C(=O)N[C@H](C)c3cnccc3C)CC2)c(OC)c1	ZINC000875447558	GG	On-Demand	Clean	HTR1A	17	43
COc1ccc(N2CCN(C(=O)N[C@H](C)c3cnccc3C)CC2)c(OC)c1	ZINC000875447558	GG	On-Demand	Clean	HTR1B	15	43
COc1ccc(N2CCN(C(=O)N[C@H](C)c3cnccc3C)CC2)c(OC)c1	ZINC000875447558	GG	On-Demand	Clean	PDGFRB	41	42
Cc1ccncc1[C@@H](C)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875447609	FH	On-Demand	Anodyne	OPRL1	17	52
Cc1ccncc1[C@H](C)NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875447610	FH	On-Demand	Anodyne	OPRL1	17	52
COC[C@H](NC(=O)C(=O)N1CCC(C(C)=O)CC1)c1cccc(OC)c1	ZINC000875447616	FD	On-Demand	Anodyne	DRD4	40	31
COC[C@@H](NC(=O)C(=O)N1CCC(C(C)=O)CC1)c1cccc(OC)c1	ZINC000875447618	FD	On-Demand	Anodyne	DRD4	40	31
CO[C@@H](c1ccc(F)cc1)[C@@H](C)NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875447653	FG	On-Demand	Anodyne	SLC6A3	24	42
CO[C@@H](c1ccc(F)cc1)[C@H](C)NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875447654	FG	On-Demand	Anodyne	SLC6A3	24	42
C[C@H](NC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1)c1ccnn1C	ZINC000875447724	GD	On-Demand	Anodyne	ACHE	34	44
C[C@H](NC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1)c1ccnn1C	ZINC000875447724	GD	On-Demand	Anodyne	HTR4	54	44
C[C@H](NC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1)c1ccnn1C	ZINC000875447724	GD	On-Demand	Anodyne	CCR3	16	42
C[C@H](NC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1)c1ccnn1C	ZINC000875447724	GD	On-Demand	Anodyne	CACNA1I	64	40
C#CC[C@H](COC)NC(=O)C(=O)N[C@H](COC)c1cccc(OC)c1	ZINC000875447797	EC	On-Demand	Mild	MTNR1B	29	41
C#CC[C@@H](COC)NC(=O)C(=O)N[C@H](COC)c1cccc(OC)c1	ZINC000875447798	EC	On-Demand	Mild	MTNR1B	29	41
C#CC[C@@H](COC)NC(=O)C(=O)N[C@@H](COC)c1cccc(OC)c1	ZINC000875447799	EC	On-Demand	Mild	MTNR1B	29	41
C#CC[C@H](COC)NC(=O)C(=O)N[C@@H](COC)c1cccc(OC)c1	ZINC000875447800	EC	On-Demand	Mild	MTNR1B	29	41
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1cscn1	ZINC000875447891	FG	On-Demand	Anodyne	FAAH	57	41
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1cscn1	ZINC000875447891	FG	On-Demand	Anodyne	CES1	58	35
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1cscn1	ZINC000875447891	FG	On-Demand	Anodyne	CAPN2	46	39
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1cscn1	ZINC000875447891	FG	On-Demand	Anodyne	AMP1_PLAFQ	25	45
C[C@H](NC(=O)C(=O)NCCCCCCc1ccccc1)c1cscn1	ZINC000875447891	FG	On-Demand	Anodyne	CES1D	45	33
Cc1ccncc1[C@H](C)NC(=O)N1CC2(CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000875447939	GG	On-Demand	Anodyne	GPR119	26	42
Cc1ccncc1[C@@H](C)NC(=O)N1CC2(CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000875447941	GG	On-Demand	Anodyne	GPR119	26	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccncc3)CC2)C1	ZINC000875447958	GD	On-Demand	Anodyne	ACHE	23	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccncc3)CC2)C1	ZINC000875447958	GD	On-Demand	Anodyne	HTR4	34	40
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccncc3)CC2)C1	ZINC000875447958	GD	On-Demand	Anodyne	SIGMAR1	22	41
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccncc3)CC2)C1	ZINC000875447958	GD	On-Demand	Anodyne	CCR3	16	42
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccncc3)CC2)C1	ZINC000875447958	GD	On-Demand	Anodyne	CACNA1I	64	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccncc3)CC2)C1	ZINC000875447959	GD	On-Demand	Anodyne	ACHE	23	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccncc3)CC2)C1	ZINC000875447959	GD	On-Demand	Anodyne	HTR4	34	40
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccncc3)CC2)C1	ZINC000875447959	GD	On-Demand	Anodyne	SIGMAR1	22	41
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccncc3)CC2)C1	ZINC000875447959	GD	On-Demand	Anodyne	CCR3	16	42
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2CCN(Cc3ccncc3)CC2)C1	ZINC000875447959	GD	On-Demand	Anodyne	CACNA1I	64	40
COc1ccc(NC(=O)[C@@H]2CCN(C(=O)c3ccccc3)C2)c(Cl)n1	ZINC000875447997	FF	On-Demand	Anodyne	SLC18A3	23	47
COc1ccc(NC(=O)[C@@H]2CCN(C(=O)c3ccccc3)C2)c(Cl)n1	ZINC000875447997	FF	On-Demand	Anodyne	L3MBTL3	41	33
COc1ccc(NC(=O)[C@H]2CCN(C(=O)c3ccccc3)C2)c(Cl)n1	ZINC000875447998	FF	On-Demand	Anodyne	SLC18A3	23	47
COc1ccc(NC(=O)[C@H]2CCN(C(=O)c3ccccc3)C2)c(Cl)n1	ZINC000875447998	FF	On-Demand	Anodyne	L3MBTL3	41	33
CC(=O)C1CCN(C(=O)C(=O)NCC2CCN(Cc3ccncc3)CC2)CC1	ZINC000875448020	GD	On-Demand	Anodyne	ACHE	30	45
CC(=O)C1CCN(C(=O)C(=O)NCC2CCN(Cc3ccncc3)CC2)CC1	ZINC000875448020	GD	On-Demand	Anodyne	HTR4	35	43
CC(=O)C1CCN(C(=O)C(=O)NCC2CCN(Cc3ccncc3)CC2)CC1	ZINC000875448020	GD	On-Demand	Anodyne	HRH3	15	53
CC(=O)C1CCN(C(=O)C(=O)NCC2CCN(Cc3ccncc3)CC2)CC1	ZINC000875448020	GD	On-Demand	Anodyne	SIGMAR1	29	46
CC(=O)C1CCN(C(=O)C(=O)NCC2CCN(Cc3ccncc3)CC2)CC1	ZINC000875448020	GD	On-Demand	Anodyne	CACNA1I	67	43
O=C(NCC[C@@H]1CCSC1)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875448030	GD	On-Demand	Anodyne	ACHE	33	53
O=C(NCC[C@@H]1CCSC1)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875448030	GD	On-Demand	Anodyne	SIGMAR1	18	40
O=C(NCC[C@@H]1CCSC1)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875448030	GD	On-Demand	Anodyne	CACNA1I	52	40
O=C(NCC[C@H]1CCSC1)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875448031	GD	On-Demand	Anodyne	ACHE	33	53
O=C(NCC[C@H]1CCSC1)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875448031	GD	On-Demand	Anodyne	SIGMAR1	18	40
O=C(NCC[C@H]1CCSC1)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875448031	GD	On-Demand	Anodyne	CACNA1I	52	40
COCC(C)(C)CCNC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875448079	GD	On-Demand	Anodyne	DRD4	15	41
COCC(C)(C)CCNC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875448079	GD	On-Demand	Anodyne	ACHE	41	48
COCC(C)(C)CCNC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875448079	GD	On-Demand	Anodyne	HTR4	37	41
COCC(C)(C)CCNC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875448079	GD	On-Demand	Anodyne	SIGMAR1	23	40
COCC(C)(C)CCNC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875448079	GD	On-Demand	Anodyne	SSTR5	41	33
COCC(C)(C)CCNC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000875448079	GD	On-Demand	Anodyne	CACNA1I	71	42
N#CCOc1cc(F)ccc1NC(=O)[C@H](c1cccnc1)C1CCCCC1	ZINC000875448098	FI	On-Demand	Mild	C3AR1	42	44
N#CCOc1cc(F)ccc1NC(=O)[C@@H](c1cccnc1)C1CCCCC1	ZINC000875448099	FI	On-Demand	Mild	C3AR1	42	44
Cc1ccncc1[C@@H](C)NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875448137	DD	On-Demand	Anodyne	CACNA1H	40	40
Cc1ccncc1[C@H](C)NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875448138	DD	On-Demand	Anodyne	CACNA1H	40	40
Cc1ccncc1[C@H](C)NC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875448162	ED	On-Demand	Anodyne	L3MBTL3	64	43
Cc1ccncc1[C@@H](C)NC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875448163	ED	On-Demand	Anodyne	L3MBTL3	64	43
Cc1ccncc1[C@H](C)NC(=O)N1CCN(c2ccc(F)cc2C#N)CC1	ZINC000875448207	FF	On-Demand	Mild	NPY2R	28	42
Cc1ccncc1[C@@H](C)NC(=O)N1CCN(c2ccc(F)cc2C#N)CC1	ZINC000875448208	FF	On-Demand	Mild	NPY2R	28	42
C[C@H]1C[C@H](CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CCO1	ZINC000875448227	FF	On-Demand	Mild	ITK	22	47
C[C@H]1C[C@H](CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CCO1	ZINC000875448227	FF	On-Demand	Mild	PANC	55	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@H](C)c1cnccc1C)CC2	ZINC000875448254	FH	On-Demand	Anodyne	SLC18A2	48	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)N[C@@H](C)c1cnccc1C)CC2	ZINC000875448255	FH	On-Demand	Anodyne	SLC18A2	48	34
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)N[C@H](C)c1cnccc1C)CC2	ZINC000875448256	FH	On-Demand	Anodyne	SLC18A2	48	34
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)N[C@@H](C)c1cnccc1C)CC2	ZINC000875448257	FH	On-Demand	Anodyne	SLC18A2	48	34
COC(=O)N(C)NC(=O)N[C@H](C)[C@@H](OC)c1ccc(F)cc1	ZINC000875448279	DD	On-Demand	Reactive	LEF	28	40
COC(=O)N(C)NC(=O)N[C@@H](C)[C@H](OC)c1ccc(F)cc1	ZINC000875448280	DD	On-Demand	Reactive	LEF	28	40
COC(=O)N(C)NC(=O)N[C@@H](C)[C@@H](OC)c1ccc(F)cc1	ZINC000875448281	DD	On-Demand	Reactive	LEF	28	40
COC(=O)N(C)NC(=O)N[C@H](C)[C@H](OC)c1ccc(F)cc1	ZINC000875448282	DD	On-Demand	Reactive	LEF	28	40
Cc1ccncc1[C@@H](C)NC(=O)NCc1ccc(O)c(Cl)c1	ZINC000875448316	DG	On-Demand	Anodyne	NCE103	15	43
Cc1ccncc1[C@H](C)NC(=O)NCc1ccc(O)c(Cl)c1	ZINC000875448317	DG	On-Demand	Anodyne	NCE103	15	43
Cc1ccncc1[C@H](C)NC(=O)N[C@H](C)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875448327	GH	On-Demand	Anodyne	GPR119	55	44
Cc1ccncc1[C@H](C)NC(=O)N[C@@H](C)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875448328	GH	On-Demand	Anodyne	GPR119	55	44
Cc1ccncc1[C@@H](C)NC(=O)N[C@H](C)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875448329	GH	On-Demand	Anodyne	GPR119	55	44
Cc1ccncc1[C@@H](C)NC(=O)N[C@@H](C)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875448330	GH	On-Demand	Anodyne	GPR119	55	44
O=C(NCCO)C1CCN(C(=O)NCC2(Cc3ccc(F)cc3)CC2)CC1	ZINC000875448353	GD	On-Demand	Anodyne	CACNA1G	42	43
CO[C@@H](c1ccc(F)cc1)[C@@H](C)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875448392	FD	On-Demand	Anodyne	CACNA1H	42	41
CO[C@@H](c1ccc(F)cc1)[C@H](C)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875448393	FD	On-Demand	Anodyne	CACNA1H	42	41
CO[C@@H](c1ccc(F)cc1)[C@H](C)NC(=O)N(C)CCN1CC2(CCOCC2)C1	ZINC000875448562	GF	On-Demand	Anodyne	LEF	17	40
CO[C@@H](c1ccc(F)cc1)[C@@H](C)NC(=O)N(C)CCN1CC2(CCOCC2)C1	ZINC000875448563	GF	On-Demand	Anodyne	LEF	17	40
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(F)cc1OCC#N	ZINC000875448574	DE	On-Demand	Mild	ANPEP	17	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](c2ccccc2)[C@H]2CCOC2)C1	ZINC000875448582	FF	On-Demand	Anodyne	Q6PRC7_IXORI	46	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](c2ccccc2)[C@@H]2CCOC2)C1	ZINC000875448583	FF	On-Demand	Anodyne	Q6PRC7_IXORI	46	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](c2ccccc2)[C@@H]2CCOC2)C1	ZINC000875448584	FF	On-Demand	Anodyne	Q6PRC7_IXORI	46	34
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](c2ccccc2)[C@H]2CCOC2)C1	ZINC000875448585	FF	On-Demand	Anodyne	Q6PRC7_IXORI	46	34
CN1CCC(CNC(=O)N[C@@H]2CCO[C@]3(CCOC3)C2)(c2ccccc2)CC1	ZINC000875448605	GE	On-Demand	Anodyne	KCNA3	46	39
CN1CCC(CNC(=O)N[C@@H]2CCO[C@@]3(CCOC3)C2)(c2ccccc2)CC1	ZINC000875448606	GE	On-Demand	Anodyne	KCNA3	46	39
CN1CCC(CNC(=O)N[C@H]2CCO[C@]3(CCOC3)C2)(c2ccccc2)CC1	ZINC000875448607	GE	On-Demand	Anodyne	KCNA3	46	39
CN1CCC(CNC(=O)N[C@H]2CCO[C@@]3(CCOC3)C2)(c2ccccc2)CC1	ZINC000875448608	GE	On-Demand	Anodyne	KCNA3	46	39
O=C(N1CCOc2ccc(C(F)(F)F)cc21)C1([C@@H]2CCCCO2)CCOCC1	ZINC000875448631	GH	On-Demand	Anodyne	CCR2	19	41
O=C(N1CCOc2ccc(C(F)(F)F)cc21)C1([C@H]2CCCCO2)CCOCC1	ZINC000875448632	GH	On-Demand	Anodyne	CCR2	19	41
Cc1ccncc1[C@@H](C)NC(=O)N1CCn2c(nnc2-c2cn(C)cn2)C1	ZINC000875448670	FD	On-Demand	Anodyne	P2RX7	22	42
Cc1ccncc1[C@H](C)NC(=O)N1CCn2c(nnc2-c2cn(C)cn2)C1	ZINC000875448672	FD	On-Demand	Anodyne	P2RX7	22	42
Cc1ccncc1[C@H](C)NC(=O)N1CCCN(C(=O)CC(C)C)CC1	ZINC000875448754	EF	On-Demand	Anodyne	PTAFR	26	42
Cc1ccncc1[C@@H](C)NC(=O)N1CCCN(C(=O)CC(C)C)CC1	ZINC000875448755	EF	On-Demand	Anodyne	PTAFR	26	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)[C@H](OC)c1ccc(F)cc1	ZINC000875448910	FF	On-Demand	Anodyne	SLC6A4	23	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)[C@H](OC)c1ccc(F)cc1	ZINC000875448910	FF	On-Demand	Anodyne	SLC6A3	56	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)[C@@H](OC)c1ccc(F)cc1	ZINC000875448911	FF	On-Demand	Anodyne	SLC6A4	23	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)[C@@H](OC)c1ccc(F)cc1	ZINC000875448911	FF	On-Demand	Anodyne	SLC6A3	56	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)[C@@H](OC)c1ccc(F)cc1	ZINC000875448912	FF	On-Demand	Anodyne	SLC6A4	23	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)[C@@H](OC)c1ccc(F)cc1	ZINC000875448912	FF	On-Demand	Anodyne	SLC6A3	56	48
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)[C@H](OC)c1ccc(F)cc1	ZINC000875448913	FF	On-Demand	Anodyne	SLC6A4	23	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)[C@H](OC)c1ccc(F)cc1	ZINC000875448913	FF	On-Demand	Anodyne	SLC6A3	56	48
Cc1ccncc1[C@H](C)NC(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875448920	EH	On-Demand	Anodyne	GHRHR	17	40
Cc1ccncc1[C@H](C)NC(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875448920	EH	On-Demand	Anodyne	NPY5R	23	40
Cc1ccncc1[C@@H](C)NC(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875448921	EH	On-Demand	Anodyne	GHRHR	17	40
Cc1ccncc1[C@@H](C)NC(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875448921	EH	On-Demand	Anodyne	NPY5R	23	40
Cc1ccncc1[C@@H](C)NC(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875448922	EH	On-Demand	Anodyne	GHRHR	17	40
Cc1ccncc1[C@@H](C)NC(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875448922	EH	On-Demand	Anodyne	NPY5R	23	40
Cc1ccncc1[C@H](C)NC(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875448923	EH	On-Demand	Anodyne	GHRHR	17	40
Cc1ccncc1[C@H](C)NC(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875448923	EH	On-Demand	Anodyne	NPY5R	23	40
Cc1ccncc1[C@H](C)NC(=O)NCc1ccc(CN2CCNC2=O)cc1	ZINC000875448944	FE	On-Demand	Anodyne	NAMPT	52	37
Cc1ccncc1[C@@H](C)NC(=O)NCc1ccc(CN2CCNC2=O)cc1	ZINC000875448945	FE	On-Demand	Anodyne	NAMPT	52	37
C[C@H](NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)c1cscn1	ZINC000875448952	FE	On-Demand	Anodyne	GHRHR	27	40
C[C@H](NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)c1cscn1	ZINC000875448953	FE	On-Demand	Anodyne	GHRHR	27	40
C[C@@]1(C(=O)N2CCCc3cc(-c4ccccc4)ccc32)CCC(=O)N1	ZINC000875448962	EG	On-Demand	Anodyne	CYP11B2	29	45
C[C@@]1(C(=O)N2CCCc3cc(-c4ccccc4)ccc32)CCC(=O)N1	ZINC000875448962	EG	On-Demand	Anodyne	HSD17B3	48	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N=c1nc[nH]n1C	ZINC000875449010	DC	On-Demand	Anodyne	MME	73	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N=c1nc[nH]n1C	ZINC000875449010	DC	On-Demand	Anodyne	PGC	50	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N=c1nc[nH]n1C	ZINC000875449010	DC	On-Demand	Anodyne	CMA1	45	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N=c1nc[nH]n1C	ZINC000875449010	DC	On-Demand	Anodyne	CTRA_BOVIN	59	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N=c1nc[nH]n1C	ZINC000875449010	DC	On-Demand	Anodyne	KLK3	43	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N=c1nc[nH]n1C	ZINC000875449010	DC	On-Demand	Anodyne	CTSB	49	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N=c1nc[nH]n1C	ZINC000875449010	DC	On-Demand	Anodyne	PAPA1_CARPA	63	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N=c1nc[nH]n1C	ZINC000875449010	DC	On-Demand	Anodyne	CYSP_TRYCR	60	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N=c1nc[nH]n1C	ZINC000875449010	DC	On-Demand	Anodyne	CTSK	31	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N=c1nc[nH]n1C	ZINC000875449010	DC	On-Demand	Anodyne	CTSL	46	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N=c1nc[nH]n1C	ZINC000875449010	DC	On-Demand	Anodyne	TIMP3	72	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N=c1nc[nH]n1C	ZINC000875449010	DC	On-Demand	Anodyne	CAPNS1	65	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N=c1nc[nH]n1C	ZINC000875449010	DC	On-Demand	Anodyne	HLA-DRB1	73	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N=c1nc[nH]n1C	ZINC000875449010	DC	On-Demand	Anodyne	REN	56	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N=c1nc[nH]n1C	ZINC000875449010	DC	On-Demand	Anodyne	CTSS	19	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N=c1nc[nH]n1C	ZINC000875449010	DC	On-Demand	Anodyne	CAPN1	79	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N=c1nc[nH]n1C	ZINC000875449010	DC	On-Demand	Anodyne	CTRC	40	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N=c1nc[nH]n1C	ZINC000875449010	DC	On-Demand	Anodyne	CAPN2	110	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N=c1nc[nH]n1C	ZINC000875449010	DC	On-Demand	Anodyne	ACE2	52	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N=c1nc[nH]n1C	ZINC000875449010	DC	On-Demand	Anodyne	MC1R	71	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N=c1nc[nH]n1C	ZINC000875449010	DC	On-Demand	Anodyne	FPR1	49	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N=c1nc[nH]n1C	ZINC000875449010	DC	On-Demand	Anodyne	CTRB_BOVIN	48	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N=c1nc[nH]n1C	ZINC000875449010	DC	On-Demand	Anodyne	BLA1_STEMA	42	32
CCC1(O)CCC(NC(=O)NC2CC(C(=O)OC)C2)CC1	ZINC000875449016	CD	On-Demand	Anodyne	EPHX2	18	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(C)=O)ccc1Cl	ZINC000875449125	GH	On-Demand	Anodyne	OPRM1	43	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(C)=O)ccc1Cl	ZINC000875449125	GH	On-Demand	Anodyne	MME	84	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(C)=O)ccc1Cl	ZINC000875449125	GH	On-Demand	Anodyne	ANPEP	72	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(C)=O)ccc1Cl	ZINC000875449125	GH	On-Demand	Anodyne	TACR1	15	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(C)=O)ccc1Cl	ZINC000875449125	GH	On-Demand	Anodyne	CMA1	48	31
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(C)=O)ccc1Cl	ZINC000875449125	GH	On-Demand	Anodyne	CTRA_BOVIN	45	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(C)=O)ccc1Cl	ZINC000875449125	GH	On-Demand	Anodyne	FCER2	94	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(C)=O)ccc1Cl	ZINC000875449125	GH	On-Demand	Anodyne	KLK3	72	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(C)=O)ccc1Cl	ZINC000875449125	GH	On-Demand	Anodyne	CTSB	81	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(C)=O)ccc1Cl	ZINC000875449125	GH	On-Demand	Anodyne	PAPA1_CARPA	85	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(C)=O)ccc1Cl	ZINC000875449125	GH	On-Demand	Anodyne	CYSP_TRYCR	74	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(C)=O)ccc1Cl	ZINC000875449125	GH	On-Demand	Anodyne	CTSK	33	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(C)=O)ccc1Cl	ZINC000875449125	GH	On-Demand	Anodyne	CTSL	69	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(C)=O)ccc1Cl	ZINC000875449125	GH	On-Demand	Anodyne	TIMP3	84	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(C)=O)ccc1Cl	ZINC000875449125	GH	On-Demand	Anodyne	CAPNS1	69	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(C)=O)ccc1Cl	ZINC000875449125	GH	On-Demand	Anodyne	GRIA1	41	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(C)=O)ccc1Cl	ZINC000875449125	GH	On-Demand	Anodyne	HLA-DRB1	99	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(C)=O)ccc1Cl	ZINC000875449125	GH	On-Demand	Anodyne	REN	29	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(C)=O)ccc1Cl	ZINC000875449125	GH	On-Demand	Anodyne	CTSS	31	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(C)=O)ccc1Cl	ZINC000875449125	GH	On-Demand	Anodyne	CAPN1	101	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(C)=O)ccc1Cl	ZINC000875449125	GH	On-Demand	Anodyne	CAPN2	130	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(C)=O)ccc1Cl	ZINC000875449125	GH	On-Demand	Anodyne	ACE2	57	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(C)=O)ccc1Cl	ZINC000875449125	GH	On-Demand	Anodyne	FPR1	70	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(C)=O)ccc1Cl	ZINC000875449125	GH	On-Demand	Anodyne	CTRB_BOVIN	52	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(C)=O)ccc1Cl	ZINC000875449125	GH	On-Demand	Anodyne	BLA1_STEMA	48	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(C)=O)ccc1Cl	ZINC000875449125	GH	On-Demand	Anodyne	PSMB8	45	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1cc(C(C)=O)ccc1Cl	ZINC000875449125	GH	On-Demand	Anodyne	GPR142	86	42
COc1ccc([C@@H](OC)[C@@H](C)NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875449147	GD	On-Demand	Anodyne	BIRC2	26	42
COc1ccc([C@@H](OC)[C@H](C)NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)cc1	ZINC000875449153	GD	On-Demand	Anodyne	BIRC2	26	42
COC1CC(C(=O)Nc2ccnc(-c3ccccc3)n2)C1	ZINC000875449172	CF	On-Demand	Anodyne	TYK2	44	34
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CC(=O)N(C3CCCCC3)C2)C1	ZINC000875449173	ED	On-Demand	Anodyne	INHA	18	41
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CC(=O)N(C3CCCCC3)C2)C1	ZINC000875449175	ED	On-Demand	Anodyne	INHA	18	41
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CC(=O)N(C3CCCCC3)C2)C1	ZINC000875449177	ED	On-Demand	Anodyne	INHA	18	41
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CC(=O)N(C3CCCCC3)C2)C1	ZINC000875449179	ED	On-Demand	Anodyne	INHA	18	41
O=C(N[C@H](c1ccccc1)[C@@H]1CCOC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875449219	GF	On-Demand	Anodyne	ETHR	47	35
O=C(N[C@H](c1ccccc1)[C@@H]1CCOC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875449220	GF	On-Demand	Anodyne	ETHR	47	35
O=C(N[C@H](c1ccccc1)[C@H]1CCOC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875449221	GF	On-Demand	Anodyne	ETHR	47	35
O=C(N[C@H](c1ccccc1)[C@H]1CCOC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875449222	GF	On-Demand	Anodyne	ETHR	47	35
O=C(N[C@@H]1CCO[C@@]2(CCOC2)C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875449238	FE	On-Demand	Anodyne	EPHX2	27	43
O=C(N[C@@H]1CCO[C@]2(CCOC2)C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875449239	FE	On-Demand	Anodyne	EPHX2	27	43
O=C(N[C@H]1CCO[C@@]2(CCOC2)C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875449240	FE	On-Demand	Anodyne	EPHX2	27	43
O=C(N[C@H]1CCO[C@]2(CCOC2)C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875449241	FE	On-Demand	Anodyne	EPHX2	27	43
N#Cc1ccc(N2CCN(C(=O)N[C@H](c3ccccc3)[C@@H]3CCOC3)CC2)cc1	ZINC000875449250	GG	On-Demand	Mild	CTSS	19	45
N#Cc1ccc(N2CCN(C(=O)N[C@@H](c3ccccc3)[C@@H]3CCOC3)CC2)cc1	ZINC000875449251	GG	On-Demand	Mild	CTSS	19	45
N#Cc1ccc(N2CCN(C(=O)N[C@H](c3ccccc3)[C@H]3CCOC3)CC2)cc1	ZINC000875449252	GG	On-Demand	Mild	CTSS	19	45
N#Cc1ccc(N2CCN(C(=O)N[C@@H](c3ccccc3)[C@H]3CCOC3)CC2)cc1	ZINC000875449253	GG	On-Demand	Mild	CTSS	19	45
CN1CCN(C2CCN(C(=O)N[C@@H](c3ccccc3)[C@@H]3CCOC3)CC2)CC1	ZINC000875449339	GE	On-Demand	Anodyne	L3MBTL3	72	41
CN1CCN(C2CCN(C(=O)N[C@@H](c3ccccc3)[C@H]3CCOC3)CC2)CC1	ZINC000875449342	GE	On-Demand	Anodyne	L3MBTL3	72	41
CN1CCN(C2CCN(C(=O)N[C@H](c3ccccc3)[C@H]3CCOC3)CC2)CC1	ZINC000875449343	GE	On-Demand	Anodyne	L3MBTL3	72	41
CN1CCN(C2CCN(C(=O)N[C@H](c3ccccc3)[C@@H]3CCOC3)CC2)CC1	ZINC000875449344	GE	On-Demand	Anodyne	L3MBTL3	72	41
CCC1(O)CCC(NC(=O)NC2CC(Nc3ccccc3)C2)CC1	ZINC000875449374	EG	On-Demand	Anodyne	EPHX2	35	43
O=C(Cn1nc(C(F)F)cc1C1CC1)Nc1ccnc(-c2ccccc2)n1	ZINC000875449392	FH	On-Demand	Anodyne	PKNB	40	36
COc1ccc([C@@H](OC)[C@H](C)NC(=O)N2CCC3(CCN(C)CC3)CC2)cc1	ZINC000875449399	GG	On-Demand	Anodyne	MMP10	25	41
COc1ccc([C@@H](OC)[C@@H](C)NC(=O)N2CCC3(CCN(C)CC3)CC2)cc1	ZINC000875449400	GG	On-Demand	Anodyne	MMP10	25	41
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@H](c1ccccc1)[C@@H]1CCOC1)CC2	ZINC000875449489	GG	On-Demand	Anodyne	NPY2R	24	40
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@@H](c1ccccc1)[C@@H]1CCOC1)CC2	ZINC000875449490	GG	On-Demand	Anodyne	NPY2R	24	40
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@H](c1ccccc1)[C@H]1CCOC1)CC2	ZINC000875449491	GG	On-Demand	Anodyne	NPY2R	24	40
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@@H](c1ccccc1)[C@H]1CCOC1)CC2	ZINC000875449492	GG	On-Demand	Anodyne	NPY2R	24	40
CC[C@@H](NC(=O)NCc1ccnc(SC)c1)[C@H](O)c1ccccc1	ZINC000875449513	EG	On-Demand	Anodyne	PDS	47	35
CC[C@@H](NC(=O)NCc1ccnc(SC)c1)[C@@H](O)c1ccccc1	ZINC000875449515	EG	On-Demand	Anodyne	PDS	47	35
O=C1NCC[C@]1(C(=O)NC1(Cc2ccccc2)CCC1)C1CCCC1	ZINC000875449530	EF	On-Demand	Anodyne	SLC12A5	43	37
O=C1NCC[C@@]1(C(=O)NC1(Cc2ccccc2)CCC1)C1CCCC1	ZINC000875449531	EF	On-Demand	Anodyne	SLC12A5	43	37
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCOCc1ccc(OC)cc1	ZINC000875449551	FD	On-Demand	Anodyne	SLC6A4	21	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCOCc1ccc(OC)cc1	ZINC000875449551	FD	On-Demand	Anodyne	SLC6A3	39	41
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccnc(-c2ccccc2)n1	ZINC000875449580	DE	On-Demand	Anodyne	F2	53	38
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccnc(-c2ccccc2)n1	ZINC000875449580	DE	On-Demand	Anodyne	OPRM1	24	43
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccnc(-c2ccccc2)n1	ZINC000875449580	DE	On-Demand	Anodyne	ELANE	58	37
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccnc(-c2ccccc2)n1	ZINC000875449580	DE	On-Demand	Anodyne	HCRTR1	24	41
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccnc(-c2ccccc2)n1	ZINC000875449580	DE	On-Demand	Anodyne	TRY1_BOVIN	79	39
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccnc(-c2ccccc2)n1	ZINC000875449580	DE	On-Demand	Anodyne	PREP	64	39
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccnc(-c2ccccc2)n1	ZINC000875449580	DE	On-Demand	Anodyne	LGMN	48	35
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccnc(-c2ccccc2)n1	ZINC000875449580	DE	On-Demand	Anodyne	HCRTR2	19	41
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccnc(-c2ccccc2)n1	ZINC000875449580	DE	On-Demand	Anodyne	XIAP	49	44
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccnc(-c2ccccc2)n1	ZINC000875449580	DE	On-Demand	Anodyne	BRCA1	52	33
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccnc(-c2ccccc2)n1	ZINC000875449580	DE	On-Demand	Anodyne	TMPRSS11D	43	32
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)[C@H](OC)c1ccc(OC)cc1	ZINC000875449581	GF	On-Demand	Anodyne	SLC6A4	20	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)[C@H](OC)c1ccc(OC)cc1	ZINC000875449581	GF	On-Demand	Anodyne	SLC6A3	40	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)[C@H](OC)c1ccc(OC)cc1	ZINC000875449582	GF	On-Demand	Anodyne	SLC6A4	20	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)[C@H](OC)c1ccc(OC)cc1	ZINC000875449582	GF	On-Demand	Anodyne	SLC6A3	40	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)[C@@H](OC)c1ccc(OC)cc1	ZINC000875449583	GF	On-Demand	Anodyne	SLC6A4	20	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)[C@@H](OC)c1ccc(OC)cc1	ZINC000875449583	GF	On-Demand	Anodyne	SLC6A3	40	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)[C@@H](OC)c1ccc(OC)cc1	ZINC000875449584	GF	On-Demand	Anodyne	SLC6A4	20	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)[C@@H](OC)c1ccc(OC)cc1	ZINC000875449584	GF	On-Demand	Anodyne	SLC6A3	40	44
CC(=O)c1ccc(Cl)c(NC(=O)c2noc3c2CC(C)(C)CC3)c1	ZINC000875449596	EI	On-Demand	Anodyne	PANC	51	33
CCO[C@@H](C(=O)Nc1ccnc(-c2ccccc2)n1)C1CC1	ZINC000875449714	CF	On-Demand	Anodyne	TIMP3	40	31
CC(=O)c1ccc(Cl)c(NC(=O)[C@@H](F)[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000875449734	GI	On-Demand	Anodyne	GPR119	32	47
CC(=O)c1ccc(Cl)c(NC(=O)[C@@H](F)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000875449735	GI	On-Demand	Anodyne	GPR119	32	47
CC(=O)c1ccc(Cl)c(NC(=O)[C@H](F)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000875449736	GI	On-Demand	Anodyne	GPR119	32	47
CC(=O)c1ccc(Cl)c(NC(=O)[C@H](F)[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000875449737	GI	On-Demand	Anodyne	GPR119	32	47
C[C@H](NC(=O)C(=O)NCCO[C@@H]1CC1(F)F)c1ccc(C(F)(F)F)nc1	ZINC000875449901	GD	On-Demand	Anodyne	TRPV1	55	34
CSc1cc(CNC(=O)N2Cc3cccc(O)c3C2)ccn1	ZINC000875449914	DF	On-Demand	Clean	NAMPT	23	41
CSc1cc(CNC(=O)N2CCC(C(=O)NCCO)CC2)ccn1	ZINC000875449939	FC	On-Demand	Anodyne	EPHX2	18	43
CCC1(O)CCC(NC(=O)N[C@H]2CCN(CC(C)(C)O)C2)CC1	ZINC000875449955	ED	On-Demand	Anodyne	EPHX2	15	40
C[C@H]1CC(=O)N[C@@H](C(=O)Nc2ccnc(-c3ccccc3)n2)C1	ZINC000875449988	DD	On-Demand	Anodyne	PKNB	44	39
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccnc(-c2ccccc2)n1	ZINC000875449989	EF	On-Demand	Anodyne	FCER2	46	33
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccnc(-c2ccccc2)n1	ZINC000875449989	EF	On-Demand	Anodyne	CTSB	43	39
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccnc(-c2ccccc2)n1	ZINC000875449989	EF	On-Demand	Anodyne	PAPA1_CARPA	45	35
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccnc(-c2ccccc2)n1	ZINC000875449989	EF	On-Demand	Anodyne	CTSK	47	41
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccnc(-c2ccccc2)n1	ZINC000875449989	EF	On-Demand	Anodyne	CTSL	34	40
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccnc(-c2ccccc2)n1	ZINC000875449989	EF	On-Demand	Anodyne	CPA1	24	42
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccnc(-c2ccccc2)n1	ZINC000875449989	EF	On-Demand	Anodyne	CAPNS1	60	34
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccnc(-c2ccccc2)n1	ZINC000875449989	EF	On-Demand	Anodyne	CTSS	21	40
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccnc(-c2ccccc2)n1	ZINC000875449989	EF	On-Demand	Anodyne	CAPN1	86	45
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccnc(-c2ccccc2)n1	ZINC000875449989	EF	On-Demand	Anodyne	CAPN2	110	39
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccnc(-c2ccccc2)n1	ZINC000875449989	EF	On-Demand	Anodyne	ACE2	29	42
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccnc(-c2ccccc2)n1	ZINC000875449989	EF	On-Demand	Anodyne	FPR1	55	38
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccnc(-c2ccccc2)n1	ZINC000875449989	EF	On-Demand	Anodyne	NPR	59	36
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccnc(-c2ccccc2)n1	ZINC000875449989	EF	On-Demand	Anodyne	HPN	80	37
CC(=O)c1ccc(Cl)c(NC(=O)c2cnn(C(C)C)c2Br)c1	ZINC000875449990	GI	On-Demand	Anodyne	EPHB3	43	38
C[C@H](NC(=O)C(=O)NCCO[C@H]1CC1(F)F)c1ccc(C(F)(F)F)nc1	ZINC000875449998	GD	On-Demand	Anodyne	TRPV1	55	34
O=C(N[C@H]1CC(=O)N(C2CCCCC2)C1)N1Cc2cccc(O)c2C1	ZINC000875450050	EE	On-Demand	Clean	INHA	20	43
O=C(N[C@@H]1CC(=O)N(C2CCCCC2)C1)N1Cc2cccc(O)c2C1	ZINC000875450051	EE	On-Demand	Clean	INHA	20	43
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1cc(C(C)=O)ccc1Cl	ZINC000875450107	EI	On-Demand	Anodyne	TAAR1	22	40
CC[C@@H](NC(C)=O)C(=O)Nc1ccnc(-c2ccccc2)n1	ZINC000875450133	CD	On-Demand	Anodyne	ACE2	40	33
CSc1cc(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)ccn1	ZINC000875450151	FF	On-Demand	Anodyne	PDS	66	39
CSc1cc(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)ccn1	ZINC000875450153	FF	On-Demand	Anodyne	PDS	66	39
O=C(N[C@H]1CCO[C@@]2(CCOC2)C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875450173	GF	On-Demand	Anodyne	SMO	33	40
O=C(N[C@H]1CCO[C@@]2(CCOC2)C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875450173	GF	On-Demand	Anodyne	ETHR	48	45
O=C(N[C@H]1CCO[C@]2(CCOC2)C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875450175	GF	On-Demand	Anodyne	SMO	33	40
O=C(N[C@H]1CCO[C@]2(CCOC2)C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875450175	GF	On-Demand	Anodyne	ETHR	48	45
O=C(N[C@@H]1CCO[C@]2(CCOC2)C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875450177	GF	On-Demand	Anodyne	SMO	33	40
O=C(N[C@@H]1CCO[C@]2(CCOC2)C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875450177	GF	On-Demand	Anodyne	ETHR	48	45
O=C(N[C@@H]1CCO[C@@]2(CCOC2)C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875450180	GF	On-Demand	Anodyne	SMO	33	40
O=C(N[C@@H]1CCO[C@@]2(CCOC2)C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875450180	GF	On-Demand	Anodyne	ETHR	48	45
CC(=O)c1ccc(Cl)c(NC(=O)CN2CCCCC(=O)C2=O)c1	ZINC000875450200	EE	On-Demand	Anodyne	HEMY	43	38
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)c1sccc1CC#N	ZINC000875450209	FH	On-Demand	Mild	DRD4	21	41
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)c1sccc1CC#N	ZINC000875450213	FH	On-Demand	Mild	DRD4	21	41
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)c1sccc1CC#N	ZINC000875450214	FH	On-Demand	Mild	DRD4	21	41
O=C(NCc1ccc(Br)cn1)N[C@H]1CC(=O)N(C2CCCCC2)C1	ZINC000875450283	GF	On-Demand	Anodyne	INHA	17	40
O=C(NCc1ccc(Br)cn1)N[C@@H]1CC(=O)N(C2CCCCC2)C1	ZINC000875450303	GF	On-Demand	Anodyne	INHA	17	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)[C@@H]1CCOC1	ZINC000875450346	FE	On-Demand	Anodyne	SLC6A4	18	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)[C@@H]1CCOC1	ZINC000875450346	FE	On-Demand	Anodyne	SLC6A3	39	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)[C@H]1CCOC1	ZINC000875450347	FE	On-Demand	Anodyne	SLC6A4	18	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)[C@H]1CCOC1	ZINC000875450347	FE	On-Demand	Anodyne	SLC6A3	39	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)[C@H]1CCOC1	ZINC000875450348	FE	On-Demand	Anodyne	SLC6A4	18	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](c1ccccc1)[C@H]1CCOC1	ZINC000875450348	FE	On-Demand	Anodyne	SLC6A3	39	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)[C@@H]1CCOC1	ZINC000875450349	FE	On-Demand	Anodyne	SLC6A4	18	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](c1ccccc1)[C@@H]1CCOC1	ZINC000875450349	FE	On-Demand	Anodyne	SLC6A3	39	43
CC(=O)c1ccc(Cl)c(NC(=O)c2cnn(C(C)C)c2Cl)c1	ZINC000875450368	EI	On-Demand	Anodyne	EPHB3	40	39
CC(=O)c1ccc(Cl)c(NC(=O)C2(NC(=O)OCc3ccccc3)CC2)c1	ZINC000875450382	GH	On-Demand	Anodyne	CTSK	15	51
CC(=O)c1ccc(Cl)c(NC(=O)C2(NC(=O)OCc3ccccc3)CC2)c1	ZINC000875450382	GH	On-Demand	Anodyne	CAPN2	46	32
CC(=O)c1ccc(Cl)c(NC(=O)C2(NC(=O)OCc3ccccc3)CC2)c1	ZINC000875450382	GH	On-Demand	Anodyne	SLC12A5	63	36
CCC1(O)CCC(NC(=O)N2CCC[C@](O)(c3ccccc3)C2)CC1	ZINC000875450383	EF	On-Demand	Anodyne	EPHX2	28	46
CCC1(O)CCC(NC(=O)N2CCC[C@](O)(c3ccccc3)C2)CC1	ZINC000875450383	EF	On-Demand	Anodyne	SLC12A5	60	34
CCC1(O)CCC(NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)CC1	ZINC000875450385	EF	On-Demand	Anodyne	EPHX2	28	46
CCC1(O)CCC(NC(=O)N2CCC[C@@](O)(c3ccccc3)C2)CC1	ZINC000875450385	EF	On-Demand	Anodyne	SLC12A5	60	34
CCC1(O)CCC(NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccccc2)C3)CC1	ZINC000875450390	FG	On-Demand	Anodyne	OPRL1	15	43
CCOC1CC2(C1)C[C@H]2C(=O)Nc1ccnc(-c2ccccc2)n1	ZINC000875450451	DG	On-Demand	Anodyne	TIMP3	66	36
CC(=O)c1ccc(Cl)c(NC(=O)[C@@H]2CCC(=O)N2C(C)C)c1	ZINC000875450469	DF	On-Demand	Anodyne	P2RX7	26	53
CN1CCN(C2CCN(C(=O)N[C@H]3CC(=O)N(C4CCCCC4)C3)CC2)CC1	ZINC000875450529	GD	On-Demand	Anodyne	L3MBTL3	45	39
CN1CCN(C2CCN(C(=O)N[C@@H]3CC(=O)N(C4CCCCC4)C3)CC2)CC1	ZINC000875450530	GD	On-Demand	Anodyne	L3MBTL3	45	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccnc(SC)c1	ZINC000875450622	EE	On-Demand	Anodyne	SLC6A3	40	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccnc(SC)c1	ZINC000875450623	EE	On-Demand	Anodyne	SLC6A3	40	37
COc1ccc([C@@H](OC)[C@H](C)NC(=O)N2CCC([C@H](C)O)CC2)cc1	ZINC000875450651	FF	On-Demand	Anodyne	MMP13	16	42
COc1ccc([C@@H](OC)[C@@H](C)NC(=O)N2CCC([C@H](C)O)CC2)cc1	ZINC000875450652	FF	On-Demand	Anodyne	MMP13	16	42
COc1ccc([C@@H](OC)[C@H](C)NC(=O)N2CCC([C@@H](C)O)CC2)cc1	ZINC000875450653	FF	On-Demand	Anodyne	MMP13	16	42
COc1ccc([C@@H](OC)[C@@H](C)NC(=O)N2CCC([C@@H](C)O)CC2)cc1	ZINC000875450654	FF	On-Demand	Anodyne	MMP13	16	42
CSc1cc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)ccn1	ZINC000875450670	EG	On-Demand	Anodyne	EPHX2	18	42
CSc1cc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)ccn1	ZINC000875450671	EG	On-Demand	Anodyne	EPHX2	18	42
COc1cccc(C(C)(C)C(=O)Nc2cc(C(C)=O)ccc2Cl)c1	ZINC000875450691	EI	On-Demand	Anodyne	TAAR1	32	48
COc1cccc(C(C)(C)C(=O)Nc2cc(C(C)=O)ccc2Cl)c1	ZINC000875450691	EI	On-Demand	Anodyne	IMDH_CRYPV	46	39
CC(=O)C1CCN(C(=O)N[C@H]2CC(=O)N(C3CCCCC3)C2)CC1	ZINC000875450723	ED	On-Demand	Anodyne	INHA	16	40
CC(=O)C1CCN(C(=O)N[C@@H]2CC(=O)N(C3CCCCC3)C2)CC1	ZINC000875450724	ED	On-Demand	Anodyne	INHA	16	40
Cc1ncsc1NC(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875450848	EI	On-Demand	Anodyne	KCNK3	44	34
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875451076	GH	On-Demand	Anodyne	DRD4	30	41
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875451077	GH	On-Demand	Anodyne	DRD4	30	41
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)c1c(Cl)nn(C)c1Cl	ZINC000875451078	GH	On-Demand	Anodyne	DRD4	30	41
COC(=O)N(C)NC(=O)NCCOCc1ccc(OC)cc1	ZINC000875451116	DD	On-Demand	Reactive	MTNR1A	42	39
Cc1cccc(CN2CCO[C@@H](CNC(=O)NCC(C)(C)CCCO)C2)c1	ZINC000875451231	GE	On-Demand	Anodyne	DRD4	16	40
Cc1cccc(CN2CCO[C@H](CNC(=O)NCC(C)(C)CCCO)C2)c1	ZINC000875451232	GE	On-Demand	Anodyne	DRD4	16	40
Cn1cnc(-c2nnc3n2CCN(C(=O)Nc2cnn(C)c2)C3)c1	ZINC000875451233	EC	On-Demand	Anodyne	P2RX7	21	40
O=C(NCC1CCN(c2ccncc2)CC1)NC[C@H]1C[C@H](O)C1	ZINC000875451356	DD	On-Demand	Anodyne	CACNA1I	45	33
C[S@](=N)(=O)N1CCN(C(=O)NCC2CCN(c3ccncc3)CC2)CC1	ZINC000875451379	GD	On-Demand	Anodyne	F10	15	46
C[C@H](NC(=O)NCC(C)(C)CCCO)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875451444	GG	On-Demand	Anodyne	GPR119	23	41
C[C@@H](NC(=O)NCC(C)(C)CCCO)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875451445	GG	On-Demand	Anodyne	GPR119	23	41
C[C@H](NC(=O)Nc1cnn(C)c1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875451459	FF	On-Demand	Anodyne	GPR119	45	42
COc1cccc([C@H](O)C2CCN(C(=O)NCC(C)(C)CCCO)CC2)c1	ZINC000875451467	GF	On-Demand	Anodyne	DRD4	41	32
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCC(C)(C)CCCO)CC2	ZINC000875451477	FG	On-Demand	Anodyne	SLC18A2	48	37
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCC(C)(C)CCCO)CC2	ZINC000875451478	FG	On-Demand	Anodyne	SLC18A2	48	37
CN1CCN(C2CCN(C(=O)Nc3cnn(C)c3)CC2)CC1	ZINC000875451507	DC	On-Demand	Anodyne	L3MBTL3	71	43
O=C(NCC1CCN(c2ccncc2)CC1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875451532	GD	On-Demand	Anodyne	CACNA1I	48	32
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1COC2(CCC2)C1	ZINC000875451566	GE	On-Demand	Anodyne	CHRM2	15	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1COC2(CCC2)C1	ZINC000875451566	GE	On-Demand	Anodyne	DRD2	21	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1COC2(CCC2)C1	ZINC000875451566	GE	On-Demand	Anodyne	DRD4	35	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1COC2(CCC2)C1	ZINC000875451566	GE	On-Demand	Anodyne	ACHE	56	54
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1COC2(CCC2)C1	ZINC000875451566	GE	On-Demand	Anodyne	DRD3	17	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1COC2(CCC2)C1	ZINC000875451566	GE	On-Demand	Anodyne	CHRM3	20	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1COC2(CCC2)C1	ZINC000875451566	GE	On-Demand	Anodyne	SIGMAR1	60	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@@H]1COC2(CCC2)C1	ZINC000875451566	GE	On-Demand	Anodyne	CACNA1G	16	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1COC2(CCC2)C1	ZINC000875451567	GE	On-Demand	Anodyne	CHRM2	15	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1COC2(CCC2)C1	ZINC000875451567	GE	On-Demand	Anodyne	DRD2	21	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1COC2(CCC2)C1	ZINC000875451567	GE	On-Demand	Anodyne	DRD4	35	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1COC2(CCC2)C1	ZINC000875451567	GE	On-Demand	Anodyne	ACHE	56	54
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1COC2(CCC2)C1	ZINC000875451567	GE	On-Demand	Anodyne	DRD3	17	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1COC2(CCC2)C1	ZINC000875451567	GE	On-Demand	Anodyne	CHRM3	20	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1COC2(CCC2)C1	ZINC000875451567	GE	On-Demand	Anodyne	SIGMAR1	60	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)C(=O)N[C@H]1COC2(CCC2)C1	ZINC000875451567	GE	On-Demand	Anodyne	CACNA1G	16	42
CONC(=O)C1CCN(C(=O)NCC2CCN(c3ccncc3)CC2)CC1	ZINC000875451578	GD	On-Demand	Anodyne	F10	15	48
CC(=O)C1CCN(C(=O)NCC2CCN(c3ccncc3)CC2)CC1	ZINC000875451579	EE	On-Demand	Anodyne	F10	15	49
COC(=O)CN(C(=O)c1c(Cl)nn(C)c1Cl)C1CCCC1	ZINC000875451593	EE	On-Demand	Anodyne	ACE	47	36
COc1ccc(N2CCN(C(=O)NCC(C)(C)CCCO)CC2)c(OC)c1	ZINC000875451708	GE	On-Demand	Clean	HTR1A	39	43
COc1ccc(N2CCN(C(=O)NCC(C)(C)CCCO)CC2)c(OC)c1	ZINC000875451708	GE	On-Demand	Clean	DRD2	33	40
COc1ccc(N2CCN(C(=O)NCC(C)(C)CCCO)CC2)c(OC)c1	ZINC000875451708	GE	On-Demand	Clean	DRD4	43	34
COc1ccc(N2CCN(C(=O)NCC(C)(C)CCCO)CC2)c(OC)c1	ZINC000875451708	GE	On-Demand	Clean	HTR1B	17	43
COc1ccc(N2CCN(C(=O)NCC(C)(C)CCCO)CC2)c(OC)c1	ZINC000875451708	GE	On-Demand	Clean	DRD3	52	40
CN1CCC(CNC(=O)NCC(C)(C)CCCO)(c2ccccc2)CC1	ZINC000875451735	FF	On-Demand	Anodyne	KCNA3	53	36
CN1CCC(CNC(=O)NCC(C)(C)CCCO)(c2ccccc2)CC1	ZINC000875451735	FF	On-Demand	Anodyne	SOAT1	15	41
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N[C@@H]3COC4(CCC4)C3)C2)cc1	ZINC000875451759	FD	On-Demand	Anodyne	DRD4	30	45
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N[C@@H]3COC4(CCC4)C3)C2)cc1	ZINC000875451759	FD	On-Demand	Anodyne	CHRM3	15	43
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N[C@@H]3COC4(CCC4)C3)C2)cc1	ZINC000875451759	FD	On-Demand	Anodyne	CCR3	24	40
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N[C@@H]3COC4(CCC4)C3)C2)cc1	ZINC000875451759	FD	On-Demand	Anodyne	MCHR1	30	45
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N[C@H]3COC4(CCC4)C3)C2)cc1	ZINC000875451760	FD	On-Demand	Anodyne	DRD4	30	45
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N[C@H]3COC4(CCC4)C3)C2)cc1	ZINC000875451760	FD	On-Demand	Anodyne	CHRM3	15	43
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N[C@H]3COC4(CCC4)C3)C2)cc1	ZINC000875451760	FD	On-Demand	Anodyne	CCR3	24	40
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)N[C@H]3COC4(CCC4)C3)C2)cc1	ZINC000875451760	FD	On-Demand	Anodyne	MCHR1	30	45
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N[C@@H]3COC4(CCC4)C3)C2)cc1	ZINC000875451761	FD	On-Demand	Anodyne	DRD4	30	45
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N[C@@H]3COC4(CCC4)C3)C2)cc1	ZINC000875451761	FD	On-Demand	Anodyne	CHRM3	15	43
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N[C@@H]3COC4(CCC4)C3)C2)cc1	ZINC000875451761	FD	On-Demand	Anodyne	CCR3	24	40
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N[C@@H]3COC4(CCC4)C3)C2)cc1	ZINC000875451761	FD	On-Demand	Anodyne	MCHR1	30	45
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N[C@H]3COC4(CCC4)C3)C2)cc1	ZINC000875451762	FD	On-Demand	Anodyne	DRD4	30	45
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N[C@H]3COC4(CCC4)C3)C2)cc1	ZINC000875451762	FD	On-Demand	Anodyne	CHRM3	15	43
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N[C@H]3COC4(CCC4)C3)C2)cc1	ZINC000875451762	FD	On-Demand	Anodyne	CCR3	24	40
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)N[C@H]3COC4(CCC4)C3)C2)cc1	ZINC000875451762	FD	On-Demand	Anodyne	MCHR1	30	45
O=C(N[C@@H]1COC2(CCC2)C1)C(=O)N[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1	ZINC000875451777	GE	On-Demand	Anodyne	ENV	48	43
O=C(N[C@H]1COC2(CCC2)C1)C(=O)N[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1	ZINC000875451778	GE	On-Demand	Anodyne	ENV	48	43
CC(=O)Nc1ccc2c(c1)CN(C(=O)Nc1cnn(C)c1)CC2	ZINC000875451828	DD	On-Demand	Anodyne	MAPK1	23	43
CC(=O)Nc1ccc2c(c1)CN(C(=O)Nc1cnn(C)c1)CC2	ZINC000875451828	DD	On-Demand	Anodyne	P2RY14	47	33
CN(CCCCCCNC(=O)OC(C)(C)C)C(=O)Nc1cnn(C)c1	ZINC000875451837	FF	On-Demand	Anodyne	PANC	40	32
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)Nc1cnn(C)c1)CC2	ZINC000875451871	EF	On-Demand	Anodyne	SLC18A2	47	34
COc1cc2c(cc1OC)[C@H](C)N(C(=O)Nc1cnn(C)c1)CC2	ZINC000875451872	EF	On-Demand	Anodyne	SLC18A2	47	34
COc1ccccc1[C@H]1CCCN(C(=O)NCC(C)(C)CCCO)CC1	ZINC000875451906	FH	On-Demand	Anodyne	RBP4	31	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCC(C)(C)CCCO)CC1	ZINC000875451907	FH	On-Demand	Anodyne	RBP4	31	42
Cc1ccc(CN2CCO[C@H](CNC(=O)Nc3cnn(C)c3)C2)cc1	ZINC000875451932	ED	On-Demand	Anodyne	CCR3	26	49
Cc1ccc(CN2CCO[C@H](CNC(=O)Nc3cnn(C)c3)C2)cc1	ZINC000875451932	ED	On-Demand	Anodyne	PANC	44	35
O=C(NC1(C(=O)Nc2ccccc2OCC(F)F)CC1)OCc1ccccc1	ZINC000875451987	GH	On-Demand	Anodyne	CTSK	18	47
O=C(NCc1ccc(O)c(Cl)c1)NCC1CCN(c2ccncc2)CC1	ZINC000875451991	FG	On-Demand	Anodyne	F10	15	52
O=C(NCc1ccc(O)c(Cl)c1)NCC1CCN(c2ccncc2)CC1	ZINC000875451991	FG	On-Demand	Anodyne	CACNA1I	58	36
O=C(NCC1CCN(c2ccncc2)CC1)N1Cc2cccc(O)c2C1	ZINC000875451992	FF	On-Demand	Clean	F10	15	48
C[C@H](NC(=O)NCC1CCN(c2ccncc2)CC1)c1ccccc1O	ZINC000875452005	FG	On-Demand	Clean	CACNA1I	49	33
C[C@@H](NC(=O)NCC1CCN(c2ccncc2)CC1)c1ccccc1O	ZINC000875452006	FG	On-Demand	Clean	CACNA1I	49	33
COc1ccc(OC)c([C@H](O)[C@H](C)NC(=O)Nc2cnn(C)c2)c1	ZINC000875452048	ED	On-Demand	Anodyne	HTR2A	18	40
COc1ccc(OC)c([C@H](O)[C@H](C)NC(=O)Nc2cnn(C)c2)c1	ZINC000875452048	ED	On-Demand	Anodyne	PDGFRB	26	43
COc1ccc(OC)c([C@H](O)[C@H](C)NC(=O)Nc2cnn(C)c2)c1	ZINC000875452048	ED	On-Demand	Anodyne	FLT4	17	42
CN(Cc1ccc2cc[nH]c2c1)C(=O)NCC(C)(C)CCCO	ZINC000875452065	DG	On-Demand	Anodyne	FFAR2	23	40
COc1ccc(N2CCN(C(=O)Nc3cnn(C)c3)CC2)c(OC)c1	ZINC000875452104	ED	On-Demand	Clean	HTR1A	48	52
COc1ccc(N2CCN(C(=O)Nc3cnn(C)c3)CC2)c(OC)c1	ZINC000875452104	ED	On-Demand	Clean	DRD2	37	42
COc1ccc(N2CCN(C(=O)Nc3cnn(C)c3)CC2)c(OC)c1	ZINC000875452104	ED	On-Demand	Clean	DRD4	40	32
COc1ccc(N2CCN(C(=O)Nc3cnn(C)c3)CC2)c(OC)c1	ZINC000875452104	ED	On-Demand	Clean	HTR1D	17	52
COc1ccc(N2CCN(C(=O)Nc3cnn(C)c3)CC2)c(OC)c1	ZINC000875452104	ED	On-Demand	Clean	HTR1B	23	52
COc1ccc(N2CCN(C(=O)Nc3cnn(C)c3)CC2)c(OC)c1	ZINC000875452104	ED	On-Demand	Clean	DRD3	53	39
COc1ccc(N2CCN(C(=O)Nc3cnn(C)c3)CC2)c(OC)c1	ZINC000875452104	ED	On-Demand	Clean	PDGFRB	82	50
COc1ccc(N2CCN(C(=O)Nc3cnn(C)c3)CC2)c(OC)c1	ZINC000875452104	ED	On-Demand	Clean	HTR7	40	47
COc1ccc(N2CCN(C(=O)Nc3cnn(C)c3)CC2)c(OC)c1	ZINC000875452104	ED	On-Demand	Clean	FLT4	21	44
COc1ccc(N2CCN(C(=O)Nc3cnn(C)c3)CC2)c(OC)c1	ZINC000875452104	ED	On-Demand	Clean	FLT3	17	44
COc1ccc(N2CCN(C(=O)Nc3cnn(C)c3)CC2)c(OC)c1	ZINC000875452104	ED	On-Demand	Clean	CSF1R	18	46
COc1ccc(N2CCN(C(=O)Nc3cnn(C)c3)CC2)c(OC)c1	ZINC000875452104	ED	On-Demand	Clean	RBP4	17	42
C=C(C)COCCNC(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875452108	EG	On-Demand	Mild	DRD4	40	30
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)Nc1cnn(C)c1	ZINC000875452277	CC	On-Demand	Anodyne	SLC6A3	42	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)Nc1cnn(C)c1	ZINC000875452278	CC	On-Demand	Anodyne	SLC6A3	42	38
COC(=O)c1ccc(OC)c2c1CCN(C(=O)Nc1cnn(C)c1)C2	ZINC000875452284	ED	On-Demand	Anodyne	P2RY14	44	34
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)Nc1cnn(C)c1	ZINC000875452350	EF	On-Demand	Anodyne	LTA4H	16	46
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)Nc1cnn(C)c1	ZINC000875452350	EF	On-Demand	Anodyne	SIGMAR1	16	45
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)Nc1cnn(C)c1	ZINC000875452350	EF	On-Demand	Anodyne	PANC	48	38
Cc1cccc(CN2CCO[C@@H](CNC(=O)Nc3cnn(C)c3)C2)c1	ZINC000875452432	ED	On-Demand	Anodyne	CCR3	36	47
Cc1cccc(CN2CCO[C@@H](CNC(=O)Nc3cnn(C)c3)C2)c1	ZINC000875452432	ED	On-Demand	Anodyne	PANC	41	32
Cc1cccc(CN2CCO[C@H](CNC(=O)Nc3cnn(C)c3)C2)c1	ZINC000875452433	ED	On-Demand	Anodyne	CCR3	36	47
Cc1cccc(CN2CCO[C@H](CNC(=O)Nc3cnn(C)c3)C2)c1	ZINC000875452433	ED	On-Demand	Anodyne	PANC	41	32
COc1ccccc1[C@H]1CCCN(C(=O)Nc2cnn(C)c2)CC1	ZINC000875452434	EG	On-Demand	Anodyne	HTR1A	19	44
COc1ccccc1[C@H]1CCCN(C(=O)Nc2cnn(C)c2)CC1	ZINC000875452434	EG	On-Demand	Anodyne	HTR1D	15	44
COc1ccccc1[C@H]1CCCN(C(=O)Nc2cnn(C)c2)CC1	ZINC000875452434	EG	On-Demand	Anodyne	HTR1B	16	44
COc1ccccc1[C@H]1CCCN(C(=O)Nc2cnn(C)c2)CC1	ZINC000875452434	EG	On-Demand	Anodyne	RBP4	55	44
COc1ccccc1[C@@H]1CCCN(C(=O)Nc2cnn(C)c2)CC1	ZINC000875452435	EG	On-Demand	Anodyne	HTR1A	19	44
COc1ccccc1[C@@H]1CCCN(C(=O)Nc2cnn(C)c2)CC1	ZINC000875452435	EG	On-Demand	Anodyne	HTR1D	15	44
COc1ccccc1[C@@H]1CCCN(C(=O)Nc2cnn(C)c2)CC1	ZINC000875452435	EG	On-Demand	Anodyne	HTR1B	16	44
COc1ccccc1[C@@H]1CCCN(C(=O)Nc2cnn(C)c2)CC1	ZINC000875452435	EG	On-Demand	Anodyne	RBP4	55	44
COc1cccc(C(C)(C)C(=O)Nc2ccccc2OCC(F)F)c1	ZINC000875452499	EI	On-Demand	Anodyne	MTNR1B	26	43
COc1cccc(C(C)(C)C(=O)Nc2ccccc2OCC(F)F)c1	ZINC000875452499	EI	On-Demand	Anodyne	PDS	56	39
C[C@@H](NC(=O)c1ccccc1NC(=O)c1cccs1)c1ccc(Br)cc1	ZINC000875452579	IK	On-Demand	Anodyne	STK33	26	42
C[C@H](NC(=O)c1ccccc1NC(=O)c1cccs1)c1ccc(Br)cc1	ZINC000875452580	IK	On-Demand	Anodyne	STK33	26	42
O=C(NCC1CCN(c2ccncc2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875452587	GG	On-Demand	Anodyne	EPHX2	17	42
O=C(NCC1CCN(c2ccncc2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875452588	GG	On-Demand	Anodyne	EPHX2	17	42
COC(=O)CN(C(=O)c1c(C(F)(F)F)coc1C)C1CCCC1	ZINC000875452605	EG	On-Demand	Anodyne	ACE	53	38
O=C(NCC1CCN(c2ccncc2)CC1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875452629	GD	On-Demand	Anodyne	F10	15	47
O=C(NCC1CCN(c2ccncc2)CC1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875452629	GD	On-Demand	Anodyne	GRIN2B	16	40
O=C(NCC1CCN(c2ccncc2)CC1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875452630	GD	On-Demand	Anodyne	F10	15	47
O=C(NCC1CCN(c2ccncc2)CC1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875452630	GD	On-Demand	Anodyne	GRIN2B	16	40
O=C(NCC1CCN(c2ccncc2)CC1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875452631	GD	On-Demand	Anodyne	F10	15	47
O=C(NCC1CCN(c2ccncc2)CC1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875452631	GD	On-Demand	Anodyne	GRIN2B	16	40
O=C(NCC1CCN(c2ccncc2)CC1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875452632	GD	On-Demand	Anodyne	F10	15	47
O=C(NCC1CCN(c2ccncc2)CC1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875452632	GD	On-Demand	Anodyne	GRIN2B	16	40
O=C(NCC1CCN(c2ccncc2)CC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875452736	GG	On-Demand	Anodyne	F2	19	47
O=C(NCC1CCN(c2ccncc2)CC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875452737	GG	On-Demand	Anodyne	F2	19	47
O=C(NCC1CCN(c2ccncc2)CC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875452738	GG	On-Demand	Anodyne	F2	19	47
O=C(NCC1CCN(c2ccncc2)CC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875452739	GG	On-Demand	Anodyne	F2	19	47
O=C(NCC1CCN(c2ccncc2)CC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875452756	GF	On-Demand	Anodyne	EPHX2	16	42
O=C(NCC1CCN(c2ccncc2)CC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875452757	GF	On-Demand	Anodyne	EPHX2	16	42
O=C(NCCCCCCc1ccccc1)N[C@H]1CCCS(=O)(=O)C1	ZINC000875453018	FF	On-Demand	Anodyne	CES1	42	34
O=C(NCCCCCCc1ccccc1)N[C@H]1CCCS(=O)(=O)C1	ZINC000875453018	FF	On-Demand	Anodyne	EPHX2	19	57
O=C(NCCCCCCc1ccccc1)N[C@@H]1CCCS(=O)(=O)C1	ZINC000875453020	FF	On-Demand	Anodyne	CES1	42	34
O=C(NCCCCCCc1ccccc1)N[C@@H]1CCCS(=O)(=O)C1	ZINC000875453020	FF	On-Demand	Anodyne	EPHX2	19	57
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000875453055	FE	On-Demand	Anodyne	SLC6A3	46	37
Cc1cncc([C@@H]2CCCN2C(=O)N[C@H](CS(C)(=O)=O)c2ccccc2)c1	ZINC000875453080	GG	On-Demand	Anodyne	WNT3	40	31
Cc1cncc([C@@H]2CCCN2C(=O)N[C@@H](CS(C)(=O)=O)c2ccccc2)c1	ZINC000875453082	GG	On-Demand	Anodyne	WNT3	40	31
O=C(N[C@@H]1COC2(CCC2)C1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875453083	GD	On-Demand	Anodyne	ETHR	32	45
Cc1cncc([C@H]2CCCN2C(=O)N[C@@H](CS(C)(=O)=O)c2ccccc2)c1	ZINC000875453084	GG	On-Demand	Anodyne	WNT3	40	31
Cc1cncc([C@H]2CCCN2C(=O)N[C@H](CS(C)(=O)=O)c2ccccc2)c1	ZINC000875453085	GG	On-Demand	Anodyne	WNT3	40	31
O=C(N[C@H]1COC2(CCC2)C1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875453086	GD	On-Demand	Anodyne	ETHR	32	45
O=C(N[C@H]1CCCS(=O)(=O)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875453089	FD	On-Demand	Anodyne	SIGMAR1	23	42
O=C(N[C@@H]1CCCS(=O)(=O)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875453091	FD	On-Demand	Anodyne	SIGMAR1	23	42
COC(=O)CN(C(=O)c1sccc1CC#N)C1CCCC1	ZINC000875453133	DE	On-Demand	Mild	ACE	55	35
CC(C)[C@H]1C[C@@H](NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CCO1	ZINC000875453166	FG	On-Demand	Mild	ITK	17	45
CC(C)[C@H]1C[C@@H](NC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CCO1	ZINC000875453166	FG	On-Demand	Mild	PANC	54	38
O=C(N[C@H]1COC2(CCC2)C1)C(=O)N[C@@H](c1ccccn1)C1CCC1	ZINC000875453212	ED	On-Demand	Anodyne	TTK	20	42
O=C(N[C@@H]1COC2(CCC2)C1)C(=O)N[C@@H](c1ccccn1)C1CCC1	ZINC000875453214	ED	On-Demand	Anodyne	TTK	20	42
O=C(N[C@@H]1COC2(CCC2)C1)C(=O)N[C@H](c1ccccn1)C1CCC1	ZINC000875453216	ED	On-Demand	Anodyne	TTK	20	42
O=C(N[C@H](c1ccccn1)C1CCC1)C(=O)N[C@H]1COC2(CCC2)C1	ZINC000875453219	ED	On-Demand	Anodyne	TTK	20	42
COc1ccc(N2CCN(C(=O)N[C@H]3CCCS(=O)(=O)C3)CC2)c(OC)c1	ZINC000875453231	GD	On-Demand	Clean	HTR1A	17	41
COc1ccc(N2CCN(C(=O)N[C@H]3CCCS(=O)(=O)C3)CC2)c(OC)c1	ZINC000875453231	GD	On-Demand	Clean	DRD2	15	42
COc1ccc(N2CCN(C(=O)N[C@H]3CCCS(=O)(=O)C3)CC2)c(OC)c1	ZINC000875453231	GD	On-Demand	Clean	ADRA1D	18	42
COc1ccc(N2CCN(C(=O)N[C@H]3CCCS(=O)(=O)C3)CC2)c(OC)c1	ZINC000875453231	GD	On-Demand	Clean	ADRA1A	15	42
COc1ccc(N2CCN(C(=O)N[C@@H]3CCCS(=O)(=O)C3)CC2)c(OC)c1	ZINC000875453234	GD	On-Demand	Clean	HTR1A	17	41
COc1ccc(N2CCN(C(=O)N[C@@H]3CCCS(=O)(=O)C3)CC2)c(OC)c1	ZINC000875453234	GD	On-Demand	Clean	DRD2	15	42
COc1ccc(N2CCN(C(=O)N[C@@H]3CCCS(=O)(=O)C3)CC2)c(OC)c1	ZINC000875453234	GD	On-Demand	Clean	ADRA1D	18	42
COc1ccc(N2CCN(C(=O)N[C@@H]3CCCS(=O)(=O)C3)CC2)c(OC)c1	ZINC000875453234	GD	On-Demand	Clean	ADRA1A	15	42
COc1ccnc(N(C)C(=O)[C@@H](Cc2cccnc2)C2CCCC2)n1	ZINC000875453251	EF	On-Demand	Anodyne	C3AR1	36	42
COc1ccnc(N(C)C(=O)[C@H](Cc2cccnc2)C2CCCC2)n1	ZINC000875453253	EF	On-Demand	Anodyne	C3AR1	36	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@H]1CCCS(=O)(=O)C1	ZINC000875453258	GE	On-Demand	Anodyne	CHRM2	18	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@H]1CCCS(=O)(=O)C1	ZINC000875453258	GE	On-Demand	Anodyne	DRD2	18	48
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@H]1CCCS(=O)(=O)C1	ZINC000875453258	GE	On-Demand	Anodyne	DRD4	37	48
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@H]1CCCS(=O)(=O)C1	ZINC000875453258	GE	On-Demand	Anodyne	ACHE	58	60
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@H]1CCCS(=O)(=O)C1	ZINC000875453258	GE	On-Demand	Anodyne	HRH2	25	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@H]1CCCS(=O)(=O)C1	ZINC000875453258	GE	On-Demand	Anodyne	CHRM3	22	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@H]1CCCS(=O)(=O)C1	ZINC000875453258	GE	On-Demand	Anodyne	SIGMAR1	49	46
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@H]1CCCS(=O)(=O)C1	ZINC000875453258	GE	On-Demand	Anodyne	SSTR5	41	35
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@H]1CCCS(=O)(=O)C1	ZINC000875453258	GE	On-Demand	Anodyne	CCR3	43	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@H]1CCCS(=O)(=O)C1	ZINC000875453258	GE	On-Demand	Anodyne	SLC6A5	16	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@H]1CCCS(=O)(=O)C1	ZINC000875453258	GE	On-Demand	Anodyne	MCHR1	28	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@H]1CCCS(=O)(=O)C1	ZINC000875453258	GE	On-Demand	Anodyne	CACNA1G	17	40
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@@H]1CCCS(=O)(=O)C1	ZINC000875453259	GE	On-Demand	Anodyne	CHRM2	18	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@@H]1CCCS(=O)(=O)C1	ZINC000875453259	GE	On-Demand	Anodyne	DRD2	18	48
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@@H]1CCCS(=O)(=O)C1	ZINC000875453259	GE	On-Demand	Anodyne	DRD4	37	48
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@@H]1CCCS(=O)(=O)C1	ZINC000875453259	GE	On-Demand	Anodyne	ACHE	58	60
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@@H]1CCCS(=O)(=O)C1	ZINC000875453259	GE	On-Demand	Anodyne	HRH2	25	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@@H]1CCCS(=O)(=O)C1	ZINC000875453259	GE	On-Demand	Anodyne	CHRM3	22	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@@H]1CCCS(=O)(=O)C1	ZINC000875453259	GE	On-Demand	Anodyne	SIGMAR1	49	46
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@@H]1CCCS(=O)(=O)C1	ZINC000875453259	GE	On-Demand	Anodyne	SSTR5	41	35
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@@H]1CCCS(=O)(=O)C1	ZINC000875453259	GE	On-Demand	Anodyne	CCR3	43	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@@H]1CCCS(=O)(=O)C1	ZINC000875453259	GE	On-Demand	Anodyne	SLC6A5	16	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@@H]1CCCS(=O)(=O)C1	ZINC000875453259	GE	On-Demand	Anodyne	MCHR1	28	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)N[C@@H]1CCCS(=O)(=O)C1	ZINC000875453259	GE	On-Demand	Anodyne	CACNA1G	17	40
O=C(N[C@H]1CCN(c2ccc(Cl)cc2F)C1)C(=O)N[C@@H]1COC2(CCC2)C1	ZINC000875453278	GE	On-Demand	Anodyne	ENV	40	36
O=C(N[C@@H]1COC2(CCC2)C1)C(=O)N[C@@H]1CCN(c2ccc(Cl)cc2F)C1	ZINC000875453281	GE	On-Demand	Anodyne	ENV	40	36
O=C(N[C@H]1CCN(c2ccc(Cl)cc2F)C1)C(=O)N[C@H]1COC2(CCC2)C1	ZINC000875453283	GE	On-Demand	Anodyne	ENV	40	36
O=C(N[C@@H]1CCN(c2ccc(Cl)cc2F)C1)C(=O)N[C@H]1COC2(CCC2)C1	ZINC000875453285	GE	On-Demand	Anodyne	ENV	40	36
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@@H](CS(C)(=O)=O)c1ccccc1	ZINC000875453393	FE	On-Demand	Anodyne	TIMP3	77	36
CCOC1CC2(C1)C[C@@H]2NC(=O)N[C@H](CS(C)(=O)=O)c1ccccc1	ZINC000875453394	FE	On-Demand	Anodyne	TIMP3	77	36
COc1ccnc(N(C)C(=O)COc2cc(Cl)ccc2C)n1	ZINC000875453406	DE	On-Demand	Anodyne	PTGDR2	16	42
CN1CCC(CNC(=O)N[C@H]2CCCS(=O)(=O)C2)(c2ccccc2)CC1	ZINC000875453411	GD	On-Demand	Anodyne	KCNA3	49	42
CN1CCC(CNC(=O)N[C@H]2CCCS(=O)(=O)C2)(c2ccccc2)CC1	ZINC000875453411	GD	On-Demand	Anodyne	SOAT1	16	47
CN1CCC(CNC(=O)N[C@@H]2CCCS(=O)(=O)C2)(c2ccccc2)CC1	ZINC000875453412	GD	On-Demand	Anodyne	KCNA3	49	42
CN1CCC(CNC(=O)N[C@@H]2CCCS(=O)(=O)C2)(c2ccccc2)CC1	ZINC000875453412	GD	On-Demand	Anodyne	SOAT1	16	47
CN1CCC(CNC(=O)Nc2cnn(C)c2)(c2ccccc2)CC1	ZINC000875453477	EE	On-Demand	Anodyne	KCNA3	46	37
CN1CCC(CNC(=O)Nc2cnn(C)c2)(c2ccccc2)CC1	ZINC000875453477	EE	On-Demand	Anodyne	SOAT1	18	47
CN1CCC(CNC(=O)Nc2cnn(C)c2)(c2ccccc2)CC1	ZINC000875453477	EE	On-Demand	Anodyne	EPHX2	15	44
COc1ccnc(N(C)C(=O)[C@@H](F)[C@H]2CCN(C(=O)OC(C)(C)C)C2)n1	ZINC000875453534	FE	On-Demand	Anodyne	GPR119	50	41
COc1ccnc(N(C)C(=O)[C@H](F)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)n1	ZINC000875453535	FE	On-Demand	Anodyne	GPR119	50	41
COc1ccnc(N(C)C(=O)[C@H](F)[C@H]2CCN(C(=O)OC(C)(C)C)C2)n1	ZINC000875453536	FE	On-Demand	Anodyne	GPR119	50	41
COc1ccnc(N(C)C(=O)[C@@H](F)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)n1	ZINC000875453537	FE	On-Demand	Anodyne	GPR119	50	41
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)N[C@H]1CCCS(=O)(=O)C1	ZINC000875453562	GE	On-Demand	Anodyne	SIGMAR1	17	45
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)N[C@@H]1CCCS(=O)(=O)C1	ZINC000875453563	GE	On-Demand	Anodyne	SIGMAR1	17	45
CN1CCN(C(=O)N[C@@H](CS(C)(=O)=O)c2ccccc2)Cc2cccnc21	ZINC000875453651	GD	On-Demand	Anodyne	PTAFR	23	42
CN1CCN(C(=O)N[C@H](CS(C)(=O)=O)c2ccccc2)Cc2cccnc21	ZINC000875453652	GD	On-Demand	Anodyne	PTAFR	23	42
Cc1csc([C@H]2CCN(C(=O)N[C@H](CS(C)(=O)=O)c3ccccc3)C2)n1	ZINC000875453667	GF	On-Demand	Anodyne	CCR5	31	40
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCCS(=O)(=O)C1	ZINC000875453784	GE	On-Demand	Reactive	LTA4H	29	44
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCCS(=O)(=O)C1	ZINC000875453785	GE	On-Demand	Reactive	LTA4H	29	44
O=C(N[C@H]1CCCS(=O)(=O)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875453798	FD	On-Demand	Anodyne	EPHX2	17	43
O=C(N[C@@H]1CCCS(=O)(=O)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875453799	FD	On-Demand	Anodyne	EPHX2	17	43
O=C(N[C@H]1CCCS(=O)(=O)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875453800	FD	On-Demand	Anodyne	EPHX2	17	43
O=C(N[C@@H]1CCCS(=O)(=O)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875453801	FD	On-Demand	Anodyne	EPHX2	17	43
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](CS(C)(=O)=O)c2ccccc2)C1	ZINC000875453814	FD	On-Demand	Anodyne	SLC6A1	42	38
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H](CS(C)(=O)=O)c2ccccc2)C1	ZINC000875453814	FD	On-Demand	Anodyne	CCR5	47	46
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](CS(C)(=O)=O)c2ccccc2)C1	ZINC000875453815	FD	On-Demand	Anodyne	SLC6A1	42	38
CC(=O)[C@H]1CCCN(C(=O)N[C@@H](CS(C)(=O)=O)c2ccccc2)C1	ZINC000875453815	FD	On-Demand	Anodyne	CCR5	47	46
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](CS(C)(=O)=O)c2ccccc2)C1	ZINC000875453816	FD	On-Demand	Anodyne	SLC6A1	42	38
CC(=O)[C@@H]1CCCN(C(=O)N[C@H](CS(C)(=O)=O)c2ccccc2)C1	ZINC000875453816	FD	On-Demand	Anodyne	CCR5	47	46
CC(=O)[C@H]1CCCN(C(=O)N[C@H](CS(C)(=O)=O)c2ccccc2)C1	ZINC000875453817	FD	On-Demand	Anodyne	SLC6A1	42	38
CC(=O)[C@H]1CCCN(C(=O)N[C@H](CS(C)(=O)=O)c2ccccc2)C1	ZINC000875453817	FD	On-Demand	Anodyne	CCR5	47	46
O=C(N[C@H]1CCCS(=O)(=O)C1)N1CCC[C@](F)(c2ccccc2)C1	ZINC000875453838	FE	On-Demand	Anodyne	EPHX2	17	43
O=C(N[C@@H]1CCCS(=O)(=O)C1)N1CCC[C@](F)(c2ccccc2)C1	ZINC000875453839	FE	On-Demand	Anodyne	EPHX2	17	43
O=C(N[C@H]1CCCS(=O)(=O)C1)N1CCC[C@@](F)(c2ccccc2)C1	ZINC000875453840	FE	On-Demand	Anodyne	EPHX2	17	43
O=C(N[C@@H]1CCCS(=O)(=O)C1)N1CCC[C@@](F)(c2ccccc2)C1	ZINC000875453841	FE	On-Demand	Anodyne	EPHX2	17	43
O=C(N[C@H]1CCCS(=O)(=O)C1)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875453859	FE	On-Demand	Anodyne	C3AR1	39	40
O=C(N[C@@H]1CCCS(=O)(=O)C1)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875453860	FE	On-Demand	Anodyne	C3AR1	39	40
O=C(N[C@H]1CCCS(=O)(=O)C1)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875453861	FE	On-Demand	Anodyne	C3AR1	39	40
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)N[C@@H]1CCCS(=O)(=O)C1	ZINC000875453862	FE	On-Demand	Anodyne	C3AR1	39	40
COc1ccnc(N(C)C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)n1	ZINC000875453984	GF	On-Demand	Anodyne	ELANE	24	41
COc1ccnc(N(C)C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)n1	ZINC000875453984	GF	On-Demand	Anodyne	KLK3	79	37
COc1ccnc(N(C)C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)n1	ZINC000875453984	GF	On-Demand	Anodyne	CTSB	58	43
COc1ccnc(N(C)C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)n1	ZINC000875453984	GF	On-Demand	Anodyne	PAPA1_CARPA	77	43
COc1ccnc(N(C)C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)n1	ZINC000875453984	GF	On-Demand	Anodyne	CYSP_TRYCR	51	37
COc1ccnc(N(C)C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)n1	ZINC000875453984	GF	On-Demand	Anodyne	CTSK	34	46
COc1ccnc(N(C)C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)n1	ZINC000875453984	GF	On-Demand	Anodyne	CTSL	41	46
COc1ccnc(N(C)C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)n1	ZINC000875453984	GF	On-Demand	Anodyne	CAPNS1	61	36
COc1ccnc(N(C)C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)n1	ZINC000875453984	GF	On-Demand	Anodyne	CAPN1	69	50
COc1ccnc(N(C)C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)n1	ZINC000875453984	GF	On-Demand	Anodyne	CAPN2	101	40
COc1ccnc(N(C)C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)n1	ZINC000875453984	GF	On-Demand	Anodyne	NPR	62	39
COc1ccnc(N(C)C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)n1	ZINC000875453985	GF	On-Demand	Anodyne	ELANE	24	41
COc1ccnc(N(C)C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)n1	ZINC000875453985	GF	On-Demand	Anodyne	KLK3	79	37
COc1ccnc(N(C)C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)n1	ZINC000875453985	GF	On-Demand	Anodyne	CTSB	58	43
COc1ccnc(N(C)C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)n1	ZINC000875453985	GF	On-Demand	Anodyne	PAPA1_CARPA	77	43
COc1ccnc(N(C)C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)n1	ZINC000875453985	GF	On-Demand	Anodyne	CYSP_TRYCR	51	37
COc1ccnc(N(C)C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)n1	ZINC000875453985	GF	On-Demand	Anodyne	CTSK	34	46
COc1ccnc(N(C)C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)n1	ZINC000875453985	GF	On-Demand	Anodyne	CTSL	41	46
COc1ccnc(N(C)C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)n1	ZINC000875453985	GF	On-Demand	Anodyne	CAPNS1	61	36
COc1ccnc(N(C)C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)n1	ZINC000875453985	GF	On-Demand	Anodyne	CAPN1	69	50
COc1ccnc(N(C)C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)n1	ZINC000875453985	GF	On-Demand	Anodyne	CAPN2	101	40
COc1ccnc(N(C)C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)n1	ZINC000875453985	GF	On-Demand	Anodyne	NPR	62	39
COc1ccnc(N(C)C(=O)c2cccc(OC(C)(C)C)c2)n1	ZINC000875454014	DF	On-Demand	Anodyne	HSD17B2	15	41
Cn1nc(Cl)c(C(=O)N[C@](C)(C#N)CCc2ccccc2)c1Cl	ZINC000875454015	FG	On-Demand	Mild	CTSV	40	31
Cn1nc(Cl)c(C(=O)N[C@@](C)(C#N)CCc2ccccc2)c1Cl	ZINC000875454016	FG	On-Demand	Mild	CTSV	40	31
O=C(NCCc1ccoc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875454058	GE	On-Demand	Anodyne	DRD2	21	43
O=C(NCCc1ccoc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875454058	GE	On-Demand	Anodyne	DRD4	46	42
O=C(NCCc1ccoc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875454058	GE	On-Demand	Anodyne	ACHE	64	62
O=C(NCCc1ccoc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875454058	GE	On-Demand	Anodyne	DRD3	15	42
O=C(NCCc1ccoc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875454058	GE	On-Demand	Anodyne	SLC6A3	15	49
O=C(NCCc1ccoc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875454058	GE	On-Demand	Anodyne	CHRM3	16	46
O=C(NCCc1ccoc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875454058	GE	On-Demand	Anodyne	SIGMAR1	69	45
O=C(NCCc1ccoc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875454058	GE	On-Demand	Anodyne	BCHE	18	52
O=C(NCCc1ccoc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875454058	GE	On-Demand	Anodyne	CCR3	26	42
O=C(NCCc1ccoc1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875454058	GE	On-Demand	Anodyne	CACNA1G	23	40
CCO[C@H](C(=O)N(C)c1ccccc1C#N)C1CCCC1	ZINC000875454089	CG	On-Demand	Mild	AMY2	44	30
CCO[C@@H](C(=O)N(C)c1ccccc1C#N)C1CCCC1	ZINC000875454091	CG	On-Demand	Mild	AMY2	44	30
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CS(C)(=O)=O)c1ccccc1	ZINC000875454109	GD	On-Demand	Anodyne	SLC6A4	24	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CS(C)(=O)=O)c1ccccc1	ZINC000875454109	GD	On-Demand	Anodyne	SLC6A3	56	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CS(C)(=O)=O)c1ccccc1	ZINC000875454111	GD	On-Demand	Anodyne	SLC6A4	24	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CS(C)(=O)=O)c1ccccc1	ZINC000875454111	GD	On-Demand	Anodyne	SLC6A3	56	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CS(C)(=O)=O)c1ccccc1	ZINC000875454113	GD	On-Demand	Anodyne	SLC6A4	24	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](CS(C)(=O)=O)c1ccccc1	ZINC000875454113	GD	On-Demand	Anodyne	SLC6A3	56	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CS(C)(=O)=O)c1ccccc1	ZINC000875454115	GD	On-Demand	Anodyne	SLC6A4	24	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](CS(C)(=O)=O)c1ccccc1	ZINC000875454115	GD	On-Demand	Anodyne	SLC6A3	56	42
CC[C@@H](C(=O)Nc1ncc(C)cn1)c1ccc(Br)cc1	ZINC000875454123	EH	On-Demand	Anodyne	KCNQ2	40	36
N#CCc1ccsc1C(=O)N1CCCC[C@H]1c1nc2ccccc2o1	ZINC000875454308	FI	On-Demand	Mild	CPT1A	55	36
N#CCc1ccsc1C(=O)N1CCCC[C@@H]1c1nc2ccccc2o1	ZINC000875454309	FI	On-Demand	Mild	CPT1A	55	36
CC(=O)C1CCN(C(=O)N[C@@H](CS(C)(=O)=O)c2ccccc2)CC1	ZINC000875454317	FD	On-Demand	Anodyne	CCR5	43	42
CC(=O)C1CCN(C(=O)N[C@H](CS(C)(=O)=O)c2ccccc2)CC1	ZINC000875454318	FD	On-Demand	Anodyne	CCR5	43	42
O=C(N[C@@H]1CCCS(=O)(=O)C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875454532	FD	On-Demand	Anodyne	EPHX2	27	46
O=C(N[C@H]1CCCS(=O)(=O)C1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875454534	FD	On-Demand	Anodyne	EPHX2	27	46
COCC(C)(C)CCNC(=O)C(=O)NCc1ccc(Cl)c(Cl)c1	ZINC000875454562	FF	On-Demand	Anodyne	TRPV1	15	40
COCC(C)(C)CCNC(=O)C(=O)NCc1ccc(Cl)c(Cl)c1	ZINC000875454562	FF	On-Demand	Anodyne	DNAE	69	34
CC(=O)Nc1cccc2c1CN(C(=O)Nc1cnn(C)c1)CC2	ZINC000875454601	DD	On-Demand	Anodyne	P2RY14	51	35
CCCCCCCNC(=O)C(=O)NCCc1ccoc1	ZINC000875454684	CE	On-Demand	Mild	S1PR2	45	37
CCCCCCCNC(=O)C(=O)NCCc1ccoc1	ZINC000875454684	CE	On-Demand	Mild	ASAH1	101	41
C[C@@H](CC(=O)N(C)c1ccccc1C#N)NC(=O)OC(C)(C)C	ZINC000875454686	DF	On-Demand	Mild	CTSB	32	41
C[C@@H](CC(=O)N(C)c1ccccc1C#N)NC(=O)OC(C)(C)C	ZINC000875454686	DF	On-Demand	Mild	PAPA1_CARPA	53	45
C[C@@H](CC(=O)N(C)c1ccccc1C#N)NC(=O)OC(C)(C)C	ZINC000875454686	DF	On-Demand	Mild	FPR1	47	37
C[C@@H](CC(=O)N(C)c1ccccc1C#N)NC(=O)OC(C)(C)C	ZINC000875454686	DF	On-Demand	Mild	CTRB_BOVIN	56	37
COc1ccc(CC(=O)Nc2ncc(C)cn2)cc1OC(F)F	ZINC000875454736	DF	On-Demand	Anodyne	ENPP1	45	31
CC(C)(C)OC(=O)CCCCNC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875454797	DD	On-Demand	Anodyne	EPHX2	26	57
O=C(NCCc1ccoc1)C(=O)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875454891	FE	On-Demand	Anodyne	C3AR1	40	40
O=C(NCCc1ccoc1)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875454892	FE	On-Demand	Anodyne	C3AR1	40	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	ACE	57	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	OPRM1	37	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	OPRD1	36	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	CELA1	17	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	MME	130	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	ANPEP	89	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	TACR1	15	51
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	PGC	51	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	CMA1	56	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	CTRA_BOVIN	57	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	FCER2	102	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	BMP1	23	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	KLK3	83	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	CTSB	99	50
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	PAPA1_CARPA	99	49
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	CYSP_TRYCR	81	51
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	CTSG	19	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	CTSK	53	49
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	CTSL	79	49
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	CPA1	24	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	PGA	46	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	TIMP3	96	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	CTRB1	23	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	TACR3	28	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	CAPNS1	80	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	MMP2	23	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	MMP3	40	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	MMP8	25	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	GRIA1	46	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	HLA-DRB1	111	52
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	REN	93	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	CTSS	36	49
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	CAPN1	121	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	MMP9	28	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	CTRC	52	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	CAPN2	146	50
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	ACE2	91	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	MC1R	60	31
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	PLAU	18	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	LAP3	51	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	MMP1	37	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	FPR1	78	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	CTRB_BOVIN	52	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	NPR	61	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	PSMB5	48	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	BLA1_STEMA	52	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	PSMB8	37	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	NPFFR1	45	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ncc(C)cn1	ZINC000875454910	EE	On-Demand	Anodyne	GPR142	96	44
CC(=O)N1CCC[C@@H]1C(=O)Nc1ncc(C)cn1	ZINC000875454944	BC	On-Demand	Anodyne	CELA1	23	41
CC(=O)N1CCC[C@@H]1C(=O)Nc1ncc(C)cn1	ZINC000875454944	BC	On-Demand	Anodyne	TRHR	40	31
CC(=O)N1CCC[C@@H]1C(=O)Nc1ncc(C)cn1	ZINC000875454944	BC	On-Demand	Anodyne	PREP	40	34
CC(=O)N1CCC[C@@H]1C(=O)Nc1ncc(C)cn1	ZINC000875454944	BC	On-Demand	Anodyne	LGMN	44	37
C#CC[C@H](COC)NC(=O)C(=O)NCc1ccc(Cl)c(Cl)c1	ZINC000875454957	ED	On-Demand	Mild	DNAE	43	33
C#CC[C@@H](COC)NC(=O)C(=O)NCc1ccc(Cl)c(Cl)c1	ZINC000875454958	ED	On-Demand	Mild	DNAE	43	33
CN(C(=O)[C@H](F)[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccccc1C#N	ZINC000875455068	FG	On-Demand	Mild	GPR119	31	42
CN(C(=O)[C@H](F)[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccccc1C#N	ZINC000875455069	FG	On-Demand	Mild	GPR119	31	42
COc1ccccc1C[C@@](C)(CO)NC(=O)NC[C@@H]1COC2(CCCC2)O1	ZINC000875455181	GD	On-Demand	Anodyne	ADRA1D	15	44
COc1ccccc1C[C@@](C)(CO)NC(=O)NC[C@@H]1COC2(CCCC2)O1	ZINC000875455181	GD	On-Demand	Anodyne	ADRA1B	15	44
COc1ccccc1C[C@@](C)(CO)NC(=O)NC[C@H]1COC2(CCCC2)O1	ZINC000875455182	GD	On-Demand	Anodyne	ADRA1D	15	44
COc1ccccc1C[C@@](C)(CO)NC(=O)NC[C@H]1COC2(CCCC2)O1	ZINC000875455182	GD	On-Demand	Anodyne	ADRA1B	15	44
COc1ccccc1C[C@](C)(CO)NC(=O)NC[C@H]1COC2(CCCC2)O1	ZINC000875455183	GD	On-Demand	Anodyne	ADRA1D	15	44
COc1ccccc1C[C@](C)(CO)NC(=O)NC[C@H]1COC2(CCCC2)O1	ZINC000875455183	GD	On-Demand	Anodyne	ADRA1B	15	44
COc1ccccc1C[C@](C)(CO)NC(=O)NC[C@@H]1COC2(CCCC2)O1	ZINC000875455184	GD	On-Demand	Anodyne	ADRA1D	15	44
COc1ccccc1C[C@](C)(CO)NC(=O)NC[C@@H]1COC2(CCCC2)O1	ZINC000875455184	GD	On-Demand	Anodyne	ADRA1B	15	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	F2	41	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	PLG	34	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	ACE	125	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	OPRM1	71	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	OPRD1	66	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	GHRHR	67	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	P2RY12	173	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	CELA1	26	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	MME	122	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	ANPEP	57	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	TACR1	29	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	TRHR	19	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	PGC	53	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	MC4R	85	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	CMA1	39	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	CTRA_BOVIN	62	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	FCER2	68	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	KLK3	84	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	CTSB	87	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	TRY2_BOVIN	63	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	PAPA1_CARPA	87	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	TRY1_BOVIN	59	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	CYSP_TRYCR	79	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	CCKAR	30	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	NTSR1	58	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	CTSG	46	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	CTSK	60	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	CTSL	68	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	CPA1	23	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	NPFFR2	72	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	TIMP3	82	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	PREP	15	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	MC3R	56	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	CAPNS1	88	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	HLA-DRB1	97	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	CELA2A	66	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	REN	86	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	REN1	54	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	PLAT	15	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	CTSS	36	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	CAPN1	123	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	CTRC	16	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	CAPN2	137	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	ACE2	96	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	MC1R	58	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	TGM2	26	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	FPR1	75	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	CTRB_BOVIN	51	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	GAG-PRO	73	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	XIAP	34	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	BLA1_STEMA	55	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	PSMB8	49	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	BRCA1	66	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@H]1C	ZINC000875455192	FD	On-Demand	Anodyne	NPFFR1	68	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	F2	41	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	PLG	34	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	ACE	125	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	OPRM1	71	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	OPRD1	66	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	GHRHR	67	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	P2RY12	173	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	CELA1	26	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	MME	122	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	ANPEP	57	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	TACR1	29	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	TRHR	19	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	PGC	53	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	MC4R	85	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	CMA1	39	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	CTRA_BOVIN	62	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	FCER2	68	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	KLK3	84	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	CTSB	87	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	TRY2_BOVIN	63	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	PAPA1_CARPA	87	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	TRY1_BOVIN	59	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	CYSP_TRYCR	79	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	CCKAR	30	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	NTSR1	58	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	CTSG	46	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	CTSK	60	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	CTSL	68	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	CPA1	23	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	NPFFR2	72	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	TIMP3	82	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	PREP	15	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	MC3R	56	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	CAPNS1	88	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	HLA-DRB1	97	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	CELA2A	66	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	REN	86	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	REN1	54	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	PLAT	15	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	CTSS	36	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	CAPN1	123	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	CTRC	16	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	CAPN2	137	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	ACE2	96	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	MC1R	58	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	TGM2	26	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	FPR1	75	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	CTRB_BOVIN	51	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	GAG-PRO	73	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	XIAP	34	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	BLA1_STEMA	55	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	PSMB8	49	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	BRCA1	66	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(C(C)=O)C[C@@H]1C	ZINC000875455193	FD	On-Demand	Anodyne	NPFFR1	68	34
O=C(NCc1ccc(Cl)c(Cl)c1)C(=O)N[C@@H]1CC12CCC2	ZINC000875455238	EF	On-Demand	Anodyne	SSTR3	17	44
O=C(NCc1ccc(Cl)c(Cl)c1)C(=O)N[C@H]1CC12CCC2	ZINC000875455239	EF	On-Demand	Anodyne	SSTR3	17	44
CC(C)(C)OC(=O)CCCCNC(=O)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21	ZINC000875455250	DF	On-Demand	Anodyne	EPHX2	17	53
CC(C)(C)OC(=O)CCCCNC(=O)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12	ZINC000875455257	DF	On-Demand	Anodyne	EPHX2	17	53
CC(C)(C)OC(=O)CCCCNC(=O)N[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12	ZINC000875455258	DF	On-Demand	Anodyne	EPHX2	17	53
CC(C)(C)OC(=O)CCCCNC(=O)N[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@@H]21	ZINC000875455259	DF	On-Demand	Anodyne	EPHX2	17	53
CC(=O)N1CCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@@H](C)C1	ZINC000875455284	FD	On-Demand	Anodyne	CTSB	35	44
CC(=O)N1CCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@@H](C)C1	ZINC000875455284	FD	On-Demand	Anodyne	CTSK	32	44
CC(=O)N1CCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@@H](C)C1	ZINC000875455284	FD	On-Demand	Anodyne	CAPNS1	57	33
CC(=O)N1CCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@@H](C)C1	ZINC000875455284	FD	On-Demand	Anodyne	CAPN1	44	35
CC(=O)N1CCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@@H](C)C1	ZINC000875455284	FD	On-Demand	Anodyne	CAPN2	70	34
CC(=O)N1CCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@@H](C)C1	ZINC000875455284	FD	On-Demand	Anodyne	NPR	53	32
CC(=O)N1CCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@@H](C)C1	ZINC000875455284	FD	On-Demand	Anodyne	NAAA	52	38
CC(=O)N1CCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@@H](C)C1	ZINC000875455284	FD	On-Demand	Anodyne	SLC12A5	78	40
CC(=O)N1CCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@H](C)C1	ZINC000875455285	FD	On-Demand	Anodyne	CTSB	35	44
CC(=O)N1CCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@H](C)C1	ZINC000875455285	FD	On-Demand	Anodyne	CTSK	32	44
CC(=O)N1CCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@H](C)C1	ZINC000875455285	FD	On-Demand	Anodyne	CAPNS1	57	33
CC(=O)N1CCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@H](C)C1	ZINC000875455285	FD	On-Demand	Anodyne	CAPN1	44	35
CC(=O)N1CCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@H](C)C1	ZINC000875455285	FD	On-Demand	Anodyne	CAPN2	70	34
CC(=O)N1CCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@H](C)C1	ZINC000875455285	FD	On-Demand	Anodyne	NPR	53	32
CC(=O)N1CCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@H](C)C1	ZINC000875455285	FD	On-Demand	Anodyne	NAAA	52	38
CC(=O)N1CCN(C(=O)C2(NC(=O)OCc3ccccc3)CC2)[C@H](C)C1	ZINC000875455285	FD	On-Demand	Anodyne	SLC12A5	78	40
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1ncc(C)cn1	ZINC000875455422	CE	On-Demand	Anodyne	NQO2	25	40
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1ncc(C)cn1	ZINC000875455422	CE	On-Demand	Anodyne	PPARD	46	42
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1ncc(C)cn1	ZINC000875455422	CE	On-Demand	Anodyne	MTNR1A	19	41
O=C(NC[C@H]1COC2(CCCC2)O1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875455458	FE	On-Demand	Anodyne	ADRA1D	15	42
O=C(NC[C@@H]1COC2(CCCC2)O1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875455459	FE	On-Demand	Anodyne	ADRA1D	15	42
O=C(NC[C@@H]1COC2(CCCC2)O1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875455460	FE	On-Demand	Anodyne	ADRA1D	15	42
O=C(NC[C@H]1COC2(CCCC2)O1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875455461	FE	On-Demand	Anodyne	ADRA1D	15	42
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455528	GE	On-Demand	Anodyne	ACE	51	43
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455528	GE	On-Demand	Anodyne	FKBP1A	23	40
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455528	GE	On-Demand	Anodyne	GHRHR	59	34
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455528	GE	On-Demand	Anodyne	CELA1	31	43
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455528	GE	On-Demand	Anodyne	ELANE	41	44
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455528	GE	On-Demand	Anodyne	CTRA_BOVIN	63	34
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455528	GE	On-Demand	Anodyne	CASP3	17	48
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455528	GE	On-Demand	Anodyne	KLK3	81	37
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455528	GE	On-Demand	Anodyne	CTSB	70	44
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455528	GE	On-Demand	Anodyne	PAPA1_CARPA	77	40
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455528	GE	On-Demand	Anodyne	TRY1_BOVIN	42	34
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455528	GE	On-Demand	Anodyne	CYSP_TRYCR	63	42
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455528	GE	On-Demand	Anodyne	CTSG	43	34
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455528	GE	On-Demand	Anodyne	CTSK	48	47
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455528	GE	On-Demand	Anodyne	CTSL	52	45
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455528	GE	On-Demand	Anodyne	PREP	25	45
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455528	GE	On-Demand	Anodyne	CAPNS1	66	38
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455528	GE	On-Demand	Anodyne	CELA2A	51	34
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455528	GE	On-Demand	Anodyne	MMP11	46	31
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455528	GE	On-Demand	Anodyne	CTSS	28	47
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455528	GE	On-Demand	Anodyne	CAPN1	84	49
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455528	GE	On-Demand	Anodyne	CAPN2	127	40
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455528	GE	On-Demand	Anodyne	TGM2	39	42
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455528	GE	On-Demand	Anodyne	NPR	66	40
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455528	GE	On-Demand	Anodyne	GAG-PRO	52	32
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455528	GE	On-Demand	Anodyne	XIAP	41	41
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455528	GE	On-Demand	Anodyne	CASP10	37	48
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455528	GE	On-Demand	Anodyne	NAAA	49	35
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455528	GE	On-Demand	Anodyne	PSMB5	44	38
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455528	GE	On-Demand	Anodyne	BIRC2	45	37
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455528	GE	On-Demand	Anodyne	Q82323_9DELA	58	31
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455528	GE	On-Demand	Anodyne	Q6PRC7_IXORI	44	36
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455528	GE	On-Demand	Anodyne	SLC12A5	64	36
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455529	GE	On-Demand	Anodyne	ACE	51	43
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455529	GE	On-Demand	Anodyne	FKBP1A	23	40
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455529	GE	On-Demand	Anodyne	GHRHR	59	34
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455529	GE	On-Demand	Anodyne	CELA1	31	43
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455529	GE	On-Demand	Anodyne	ELANE	41	44
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455529	GE	On-Demand	Anodyne	CTRA_BOVIN	63	34
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455529	GE	On-Demand	Anodyne	CASP3	17	48
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455529	GE	On-Demand	Anodyne	KLK3	81	37
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455529	GE	On-Demand	Anodyne	CTSB	70	44
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455529	GE	On-Demand	Anodyne	PAPA1_CARPA	77	40
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455529	GE	On-Demand	Anodyne	TRY1_BOVIN	42	34
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455529	GE	On-Demand	Anodyne	CYSP_TRYCR	63	42
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455529	GE	On-Demand	Anodyne	CTSG	43	34
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455529	GE	On-Demand	Anodyne	CTSK	48	47
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455529	GE	On-Demand	Anodyne	CTSL	52	45
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455529	GE	On-Demand	Anodyne	PREP	25	45
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455529	GE	On-Demand	Anodyne	CAPNS1	66	38
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455529	GE	On-Demand	Anodyne	CELA2A	51	34
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455529	GE	On-Demand	Anodyne	MMP11	46	31
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455529	GE	On-Demand	Anodyne	CTSS	28	47
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455529	GE	On-Demand	Anodyne	CAPN1	84	49
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455529	GE	On-Demand	Anodyne	CAPN2	127	40
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455529	GE	On-Demand	Anodyne	TGM2	39	42
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455529	GE	On-Demand	Anodyne	NPR	66	40
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455529	GE	On-Demand	Anodyne	GAG-PRO	52	32
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455529	GE	On-Demand	Anodyne	XIAP	41	41
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455529	GE	On-Demand	Anodyne	CASP10	37	48
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455529	GE	On-Demand	Anodyne	NAAA	49	35
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455529	GE	On-Demand	Anodyne	PSMB5	44	38
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455529	GE	On-Demand	Anodyne	BIRC2	45	37
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455529	GE	On-Demand	Anodyne	Q82323_9DELA	58	31
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455529	GE	On-Demand	Anodyne	Q6PRC7_IXORI	44	36
CC(=O)N1CCN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455529	GE	On-Demand	Anodyne	SLC12A5	64	36
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455530	GE	On-Demand	Anodyne	ACE	51	43
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455530	GE	On-Demand	Anodyne	FKBP1A	23	40
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455530	GE	On-Demand	Anodyne	GHRHR	59	34
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455530	GE	On-Demand	Anodyne	CELA1	31	43
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455530	GE	On-Demand	Anodyne	ELANE	41	44
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455530	GE	On-Demand	Anodyne	CTRA_BOVIN	63	34
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455530	GE	On-Demand	Anodyne	CASP3	17	48
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455530	GE	On-Demand	Anodyne	KLK3	81	37
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455530	GE	On-Demand	Anodyne	CTSB	70	44
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455530	GE	On-Demand	Anodyne	PAPA1_CARPA	77	40
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455530	GE	On-Demand	Anodyne	TRY1_BOVIN	42	34
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455530	GE	On-Demand	Anodyne	CYSP_TRYCR	63	42
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455530	GE	On-Demand	Anodyne	CTSG	43	34
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455530	GE	On-Demand	Anodyne	CTSK	48	47
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455530	GE	On-Demand	Anodyne	CTSL	52	45
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455530	GE	On-Demand	Anodyne	PREP	25	45
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455530	GE	On-Demand	Anodyne	CAPNS1	66	38
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455530	GE	On-Demand	Anodyne	CELA2A	51	34
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455530	GE	On-Demand	Anodyne	MMP11	46	31
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455530	GE	On-Demand	Anodyne	CTSS	28	47
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455530	GE	On-Demand	Anodyne	CAPN1	84	49
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455530	GE	On-Demand	Anodyne	CAPN2	127	40
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455530	GE	On-Demand	Anodyne	TGM2	39	42
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455530	GE	On-Demand	Anodyne	NPR	66	40
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455530	GE	On-Demand	Anodyne	GAG-PRO	52	32
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455530	GE	On-Demand	Anodyne	XIAP	41	41
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455530	GE	On-Demand	Anodyne	CASP10	37	48
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455530	GE	On-Demand	Anodyne	NAAA	49	35
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455530	GE	On-Demand	Anodyne	PSMB5	44	38
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455530	GE	On-Demand	Anodyne	BIRC2	45	37
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455530	GE	On-Demand	Anodyne	Q82323_9DELA	58	31
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455530	GE	On-Demand	Anodyne	Q6PRC7_IXORI	44	36
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@H](C)C1	ZINC000875455530	GE	On-Demand	Anodyne	SLC12A5	64	36
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455531	GE	On-Demand	Anodyne	ACE	51	43
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455531	GE	On-Demand	Anodyne	FKBP1A	23	40
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455531	GE	On-Demand	Anodyne	GHRHR	59	34
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455531	GE	On-Demand	Anodyne	CELA1	31	43
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455531	GE	On-Demand	Anodyne	ELANE	41	44
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455531	GE	On-Demand	Anodyne	CTRA_BOVIN	63	34
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455531	GE	On-Demand	Anodyne	CASP3	17	48
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455531	GE	On-Demand	Anodyne	KLK3	81	37
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455531	GE	On-Demand	Anodyne	CTSB	70	44
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455531	GE	On-Demand	Anodyne	PAPA1_CARPA	77	40
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455531	GE	On-Demand	Anodyne	TRY1_BOVIN	42	34
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455531	GE	On-Demand	Anodyne	CYSP_TRYCR	63	42
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455531	GE	On-Demand	Anodyne	CTSG	43	34
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455531	GE	On-Demand	Anodyne	CTSK	48	47
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455531	GE	On-Demand	Anodyne	CTSL	52	45
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455531	GE	On-Demand	Anodyne	PREP	25	45
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455531	GE	On-Demand	Anodyne	CAPNS1	66	38
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455531	GE	On-Demand	Anodyne	CELA2A	51	34
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455531	GE	On-Demand	Anodyne	MMP11	46	31
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455531	GE	On-Demand	Anodyne	CTSS	28	47
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455531	GE	On-Demand	Anodyne	CAPN1	84	49
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455531	GE	On-Demand	Anodyne	CAPN2	127	40
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455531	GE	On-Demand	Anodyne	TGM2	39	42
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455531	GE	On-Demand	Anodyne	NPR	66	40
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455531	GE	On-Demand	Anodyne	GAG-PRO	52	32
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455531	GE	On-Demand	Anodyne	XIAP	41	41
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455531	GE	On-Demand	Anodyne	CASP10	37	48
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455531	GE	On-Demand	Anodyne	NAAA	49	35
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455531	GE	On-Demand	Anodyne	PSMB5	44	38
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455531	GE	On-Demand	Anodyne	BIRC2	45	37
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455531	GE	On-Demand	Anodyne	Q82323_9DELA	58	31
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455531	GE	On-Demand	Anodyne	Q6PRC7_IXORI	44	36
CC(=O)N1CCN(C(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)[C@@H](C)C1	ZINC000875455531	GE	On-Demand	Anodyne	SLC12A5	64	36
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)Nc2ncc(C)cn2)C1	ZINC000875455583	GF	On-Demand	Anodyne	SLC12A5	63	38
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)Nc2ncc(C)cn2)C1	ZINC000875455584	GF	On-Demand	Anodyne	SLC12A5	63	38
CO[C@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)Nc2ncc(C)cn2)C1	ZINC000875455585	GF	On-Demand	Anodyne	SLC12A5	63	38
CO[C@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)Nc2ncc(C)cn2)C1	ZINC000875455586	GF	On-Demand	Anodyne	SLC12A5	63	38
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)OC(C)(C)C)c1Cl	ZINC000875455644	GG	On-Demand	Anodyne	OPRD1	15	40
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)OC(C)(C)C)c1Cl	ZINC000875455644	GG	On-Demand	Anodyne	MME	58	36
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)OC(C)(C)C)c1Cl	ZINC000875455644	GG	On-Demand	Anodyne	ANPEP	42	33
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)OC(C)(C)C)c1Cl	ZINC000875455644	GG	On-Demand	Anodyne	PGC	53	33
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)OC(C)(C)C)c1Cl	ZINC000875455644	GG	On-Demand	Anodyne	PAPA1_CARPA	60	42
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)OC(C)(C)C)c1Cl	ZINC000875455644	GG	On-Demand	Anodyne	CYSP_TRYCR	54	37
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)OC(C)(C)C)c1Cl	ZINC000875455644	GG	On-Demand	Anodyne	CTSL	42	42
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)OC(C)(C)C)c1Cl	ZINC000875455644	GG	On-Demand	Anodyne	CACNA1B	24	42
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)OC(C)(C)C)c1Cl	ZINC000875455644	GG	On-Demand	Anodyne	CAPNS1	52	32
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)OC(C)(C)C)c1Cl	ZINC000875455644	GG	On-Demand	Anodyne	REN	59	38
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)OC(C)(C)C)c1Cl	ZINC000875455644	GG	On-Demand	Anodyne	CTSS	19	42
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)OC(C)(C)C)c1Cl	ZINC000875455644	GG	On-Demand	Anodyne	CAPN1	49	45
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)OC(C)(C)C)c1Cl	ZINC000875455644	GG	On-Demand	Anodyne	ACE2	42	34
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)OC(C)(C)C)c1Cl	ZINC000875455644	GG	On-Demand	Anodyne	CTSV	47	40
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)OC(C)(C)C)c1Cl	ZINC000875455644	GG	On-Demand	Anodyne	FPR1	62	41
Cn1nc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)OC(C)(C)C)c1Cl	ZINC000875455644	GG	On-Demand	Anodyne	CTRB_BOVIN	59	41
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCCC(=O)OC(C)(C)C)C[C@@H]1C2	ZINC000875455670	FE	On-Demand	Anodyne	EPHX2	24	55
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ncc(C)cn1	ZINC000875455835	CD	On-Demand	Anodyne	ANPEP	31	45
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ncc(C)cn1	ZINC000875455835	CD	On-Demand	Anodyne	CTSB	19	42
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ncc(C)cn1	ZINC000875455835	CD	On-Demand	Anodyne	CPA1	22	40
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ncc(C)cn1	ZINC000875455835	CD	On-Demand	Anodyne	CAPN1	49	45
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ncc(C)cn1	ZINC000875455835	CD	On-Demand	Anodyne	CAPN2	54	37
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ncc(C)cn1	ZINC000875455835	CD	On-Demand	Anodyne	HPN	73	38
CC(C)(C)OC(=O)CCCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875455906	GG	On-Demand	Anodyne	FKBP1A	31	41
CC(C)(C)OC(=O)CCCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875455906	GG	On-Demand	Anodyne	PREP	26	41
CC(C)(C)OC(=O)CCCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875455907	GG	On-Demand	Anodyne	FKBP1A	31	41
CC(C)(C)OC(=O)CCCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875455907	GG	On-Demand	Anodyne	PREP	26	41
CC(C)(C)OC(=O)CCCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875455908	GG	On-Demand	Anodyne	FKBP1A	31	41
CC(C)(C)OC(=O)CCCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875455908	GG	On-Demand	Anodyne	PREP	26	41
CC(C)(C)OC(=O)CCCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875455909	GG	On-Demand	Anodyne	FKBP1A	31	41
CC(C)(C)OC(=O)CCCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875455909	GG	On-Demand	Anodyne	PREP	26	41
COc1cccc(C(C)(C)C(=O)Nc2ncc(C)cn2)c1	ZINC000875455964	CF	On-Demand	Anodyne	TUBB2B	19	40
CCC[C@@H]1CN(Cc2ccccc2)C[C@H]1C(=O)Nc1ncc(C)cn1	ZINC000875455975	EG	On-Demand	Anodyne	DRD4	20	42
CC(C)(C)OC(=O)CCCCNC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875456146	GG	On-Demand	Anodyne	EPHX2	17	45
CC(C)(C)OC(=O)CCCCNC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875456147	GG	On-Demand	Anodyne	EPHX2	17	45
C[C@@H]1N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)CCOC1(C)C	ZINC000875456161	EE	On-Demand	Anodyne	CTRA_BOVIN	62	33
C[C@@H]1N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)CCOC1(C)C	ZINC000875456161	EE	On-Demand	Anodyne	CTSG	42	33
C[C@@H]1N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)CCOC1(C)C	ZINC000875456161	EE	On-Demand	Anodyne	CTSK	21	44
C[C@@H]1N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)CCOC1(C)C	ZINC000875456161	EE	On-Demand	Anodyne	CELA2A	50	33
C[C@@H]1N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)CCOC1(C)C	ZINC000875456161	EE	On-Demand	Anodyne	NAAA	51	37
C[C@@H]1N(C(=O)C2(NC(=O)OCc3ccccc3)CC2)CCOC1(C)C	ZINC000875456161	EE	On-Demand	Anodyne	SLC12A5	70	37
COC[C@@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccc(F)c(F)c1	ZINC000875456322	GE	On-Demand	Anodyne	MAPK1	27	42
COC[C@@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccc(F)c(F)c1	ZINC000875456322	GE	On-Demand	Anodyne	UTS2	48	32
COC[C@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccc(F)c(F)c1	ZINC000875456323	GE	On-Demand	Anodyne	MAPK1	27	42
COC[C@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccc(F)c(F)c1	ZINC000875456323	GE	On-Demand	Anodyne	UTS2	48	32
COC[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1ccc(F)c(F)c1	ZINC000875456351	GG	On-Demand	Anodyne	CACNA1H	53	38
COC[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1ccc(F)c(F)c1	ZINC000875456351	GG	On-Demand	Anodyne	MAPK1	33	45
COC[C@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1ccc(F)c(F)c1	ZINC000875456352	GG	On-Demand	Anodyne	CACNA1H	53	38
COC[C@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1ccc(F)c(F)c1	ZINC000875456352	GG	On-Demand	Anodyne	MAPK1	33	45
CC[C@@H](NC(=O)C(=O)N[C@@H]1CC[C@@H](NC(=O)OC(C)(C)C)CC1)C1CC1	ZINC000875456427	FE	On-Demand	Anodyne	CTSK	15	43
CC[C@@H](NC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1)C1CC1	ZINC000875456460	GD	On-Demand	Clean	DRD2	21	41
CC[C@@H](NC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1)C1CC1	ZINC000875456460	GD	On-Demand	Clean	ADRA1D	23	40
CC[C@@H](NC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1)C1CC1	ZINC000875456460	GD	On-Demand	Clean	ADRA1A	20	40
CC[C@@H](NC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1)C1CC1	ZINC000875456460	GD	On-Demand	Clean	ADRA1B	15	40
CC[C@@H](NC(=O)C(=O)N1CCN(c2ccc(OC)cc2OC)CC1)C1CC1	ZINC000875456460	GD	On-Demand	Clean	MTNR1B	20	41
COC[C@H](NC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1ccc(F)c(F)c1	ZINC000875456461	GG	On-Demand	Anodyne	MAPK1	29	40
COC[C@@H](NC(=O)N1CCO[C@H](C(F)(F)F)CC1)c1ccc(F)c(F)c1	ZINC000875456462	GG	On-Demand	Anodyne	MAPK1	29	40
COC[C@H](NC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1ccc(F)c(F)c1	ZINC000875456463	GG	On-Demand	Anodyne	MAPK1	29	40
COC[C@@H](NC(=O)N1CCO[C@@H](C(F)(F)F)CC1)c1ccc(F)c(F)c1	ZINC000875456464	GG	On-Demand	Anodyne	MAPK1	29	40
COC[C@H](NC(=O)N1Cc2cccc(O)c2C1)c1ccc(F)c(F)c1	ZINC000875456488	EG	On-Demand	Clean	MAPK1	30	44
COC[C@@H](NC(=O)N1Cc2cccc(O)c2C1)c1ccc(F)c(F)c1	ZINC000875456489	EG	On-Demand	Clean	MAPK1	30	44
COC(=O)c1ccc(CC(=O)N(c2cccc(C(F)(F)F)c2)C(C)C)cn1	ZINC000875456495	GH	On-Demand	Anodyne	NR1H4	16	41
CCCCCCCNC(=O)C(=O)N[C@H](CC)C1CC1	ZINC000875456534	CE	On-Demand	Mild	EPHX2	15	43
CCCCCCCNC(=O)C(=O)N[C@H](CC)C1CC1	ZINC000875456534	CE	On-Demand	Mild	ASAH1	57	33
CCCCCCCNC(=O)C(=O)N[C@H](CC)C1CC1	ZINC000875456534	CE	On-Demand	Mild	CQSS	40	31
CCCCCCCNC(=O)C(=O)N[C@@H](CC)C1CC1	ZINC000875456535	CE	On-Demand	Mild	EPHX2	15	43
CCCCCCCNC(=O)C(=O)N[C@@H](CC)C1CC1	ZINC000875456535	CE	On-Demand	Mild	ASAH1	57	33
CCCCCCCNC(=O)C(=O)N[C@@H](CC)C1CC1	ZINC000875456535	CE	On-Demand	Mild	CQSS	40	31
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)N[C@H]1CCN(C2CCCCC2)C1	ZINC000875456540	GD	On-Demand	Anodyne	SLC6A5	17	42
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)N[C@H]1CCN(C2CCCCC2)C1	ZINC000875456541	GD	On-Demand	Anodyne	SLC6A5	17	42
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)N[C@@H]1CCN(C2CCCCC2)C1	ZINC000875456542	GD	On-Demand	Anodyne	SLC6A5	17	42
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)N[C@@H]1CCN(C2CCCCC2)C1	ZINC000875456543	GD	On-Demand	Anodyne	SLC6A5	17	42
COC[C@@H](NC(=O)N1CCC[C@H](CCC(=O)OC)C1)c1ccc(F)c(F)c1	ZINC000875456544	GG	On-Demand	Anodyne	MAPK1	24	42
COC[C@H](NC(=O)N1CCC[C@H](CCC(=O)OC)C1)c1ccc(F)c(F)c1	ZINC000875456545	GG	On-Demand	Anodyne	MAPK1	24	42
COC[C@H](NC(=O)N1CCC[C@@H](CCC(=O)OC)C1)c1ccc(F)c(F)c1	ZINC000875456546	GG	On-Demand	Anodyne	MAPK1	24	42
COC[C@@H](NC(=O)N1CCC[C@@H](CCC(=O)OC)C1)c1ccc(F)c(F)c1	ZINC000875456547	GG	On-Demand	Anodyne	MAPK1	24	42
CC[C@@H](NC(=O)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1)C1CC1	ZINC000875456571	FE	On-Demand	Anodyne	ETHR	62	49
COC[C@H](NC(=O)N1CCCN(C=O)CC1)c1ccc(F)c(F)c1	ZINC000875456594	ED	On-Demand	Anodyne	MAPK1	29	45
COC[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccc(F)c(F)c1	ZINC000875456595	ED	On-Demand	Anodyne	MAPK1	29	45
CC[C@@H](NC(=O)C(=O)N1CCC(N2CCN(C)CC2)CC1)C1CC1	ZINC000875456643	EC	On-Demand	Anodyne	L3MBTL3	23	40
COC[C@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccc(F)c(F)c1	ZINC000875456645	GD	On-Demand	Anodyne	MAPK1	26	41
COC[C@@H](NC(=O)N1CCC(C(=O)NCCO)CC1)c1ccc(F)c(F)c1	ZINC000875456646	GD	On-Demand	Anodyne	MAPK1	26	41
COC[C@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(F)c(F)c1	ZINC000875456672	EE	On-Demand	Anodyne	MAPK1	30	43
COC[C@@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)c1ccc(F)c(F)c1	ZINC000875456673	EE	On-Demand	Anodyne	MAPK1	30	43
COC[C@@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(F)c(F)c1	ZINC000875456674	EE	On-Demand	Anodyne	MAPK1	30	43
COC[C@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)c1ccc(F)c(F)c1	ZINC000875456675	EE	On-Demand	Anodyne	MAPK1	30	43
COC[C@@H](NC(=O)N1CC[C@@]2(CC(C(=O)OC)=NO2)C1)c1ccc(F)c(F)c1	ZINC000875456676	GD	On-Demand	Anodyne	MAPK1	25	41
COC[C@H](NC(=O)N1CC[C@@]2(CC(C(=O)OC)=NO2)C1)c1ccc(F)c(F)c1	ZINC000875456677	GD	On-Demand	Anodyne	MAPK1	25	41
COC[C@@H](NC(=O)N1CC[C@]2(CC(C(=O)OC)=NO2)C1)c1ccc(F)c(F)c1	ZINC000875456678	GD	On-Demand	Anodyne	MAPK1	25	41
COC[C@H](NC(=O)N1CC[C@]2(CC(C(=O)OC)=NO2)C1)c1ccc(F)c(F)c1	ZINC000875456679	GD	On-Demand	Anodyne	MAPK1	25	41
COC[C@@H](NC(=O)N1CC(CNC(=O)C(F)(F)F)C1)c1ccc(F)c(F)c1	ZINC000875456698	GD	On-Demand	Anodyne	MAPK1	17	40
COC[C@H](NC(=O)N1CC(CNC(=O)C(F)(F)F)C1)c1ccc(F)c(F)c1	ZINC000875456699	GD	On-Demand	Anodyne	MAPK1	17	40
CC[C@@H](NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)C1CC1	ZINC000875456712	EE	On-Demand	Anodyne	OXTR	66	41
CC[C@@H](NC(=O)C(=O)N1CC[C@@]2(CCc3ccccc32)C1)C1CC1	ZINC000875456712	EE	On-Demand	Anodyne	GHRHR	59	41
CC[C@@H](NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)C1CC1	ZINC000875456713	EE	On-Demand	Anodyne	OXTR	66	41
CC[C@@H](NC(=O)C(=O)N1CC[C@]2(CCc3ccccc32)C1)C1CC1	ZINC000875456713	EE	On-Demand	Anodyne	GHRHR	59	41
O=C(NCCc1cnccn1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875456738	ED	On-Demand	Anodyne	EPHX2	15	53
O=C(NCCc1cnccn1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875456739	ED	On-Demand	Anodyne	EPHX2	15	53
C[C@@H](NC(=O)NCCc1cnccn1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000875456774	ED	On-Demand	Anodyne	GPR119	21	42
CN1C[C@@H](CNC(=O)C(=O)N2CCN(c3ccc(F)cc3F)CC2)CC1=O	ZINC000875456801	GC	On-Demand	Anodyne	NPY2R	55	37
COC[C@H](NC(=O)N1CCN(C)C(C)(C)CC1)c1ccc(F)c(F)c1	ZINC000875456875	FF	On-Demand	Anodyne	CACNA1H	50	37
COC[C@H](NC(=O)N1CCN(C)C(C)(C)CC1)c1ccc(F)c(F)c1	ZINC000875456875	FF	On-Demand	Anodyne	MAPK1	25	43
COC[C@@H](NC(=O)N1CCN(C)C(C)(C)CC1)c1ccc(F)c(F)c1	ZINC000875456876	FF	On-Demand	Anodyne	CACNA1H	50	37
COC[C@@H](NC(=O)N1CCN(C)C(C)(C)CC1)c1ccc(F)c(F)c1	ZINC000875456876	FF	On-Demand	Anodyne	MAPK1	25	43
CCCCCCCNC(=O)C(=O)NCc1nccc(OC)c1F	ZINC000875456880	ED	On-Demand	Mild	ASAH1	87	38
CC1(C)[C@@H](c2cccc(F)c2)CCN1C(=O)NCCc1cnccn1	ZINC000875456935	EG	On-Demand	Anodyne	CCR5	54	33
CN1C[C@@H](CNC(=O)C(=O)N2CCC(Cc3ccccc3Cl)CC2)CC1=O	ZINC000875456994	GD	On-Demand	Anodyne	P2RX7	24	42
COC[C@H](NC(=O)N1CCCCCCNC(=O)CC1)c1ccc(F)c(F)c1	ZINC000875457034	GF	On-Demand	Anodyne	MAPK1	35	48
COC[C@@H](NC(=O)N1CCCCCCNC(=O)CC1)c1ccc(F)c(F)c1	ZINC000875457035	GF	On-Demand	Anodyne	MAPK1	35	48
COC[C@H](NC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccc(F)c(F)c1	ZINC000875457074	GH	On-Demand	Anodyne	MAPK1	27	44
COC[C@H](NC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccc(F)c(F)c1	ZINC000875457075	GH	On-Demand	Anodyne	MAPK1	27	44
COC[C@@H](NC(=O)N1CCC[C@H](OC2CCC2)CC1)c1ccc(F)c(F)c1	ZINC000875457076	GH	On-Demand	Anodyne	MAPK1	27	44
COC[C@@H](NC(=O)N1CCC[C@@H](OC2CCC2)CC1)c1ccc(F)c(F)c1	ZINC000875457077	GH	On-Demand	Anodyne	MAPK1	27	44
COC[C@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(F)c(F)c1	ZINC000875457125	FD	On-Demand	Anodyne	CACNA1H	53	40
COC[C@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(F)c(F)c1	ZINC000875457125	FD	On-Demand	Anodyne	MAPK1	31	44
COC[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(F)c(F)c1	ZINC000875457126	FD	On-Demand	Anodyne	CACNA1H	53	40
COC[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(F)c(F)c1	ZINC000875457126	FD	On-Demand	Anodyne	MAPK1	31	44
CN1C[C@@H](CNC(=O)C(=O)NCc2cccc3ncccc23)CC1=O	ZINC000875457162	EC	On-Demand	Anodyne	P2RX7	41	38
CC(C)(C)OC(=O)N1C[C@@H]2CN(C(=O)NCCc3cnccn3)C[C@]2(C)C1	ZINC000875457182	GD	On-Demand	Anodyne	GPR119	18	41
O=CN1CCCN(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)CC1	ZINC000875457185	GD	On-Demand	Anodyne	ESR1	66	38
O=CN1CCCN(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)CC1	ZINC000875457185	GD	On-Demand	Anodyne	HRH2	27	46
O=CN1CCCN(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)CC1	ZINC000875457185	GD	On-Demand	Anodyne	ESR2	46	38
O=CN1CCCN(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)CC1	ZINC000875457185	GD	On-Demand	Anodyne	LTA4H	69	51
O=CN1CCCN(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)CC1	ZINC000875457185	GD	On-Demand	Anodyne	HRH3	60	45
O=CN1CCCN(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)CC1	ZINC000875457185	GD	On-Demand	Anodyne	PSMB2	45	45
O=CN1CCCN(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)CC1	ZINC000875457185	GD	On-Demand	Anodyne	PSMB1	49	45
COC(=O)C1(O)CN(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)C1	ZINC000875457186	GC	On-Demand	Anodyne	ESR1	68	38
COC(=O)C1(O)CN(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)C1	ZINC000875457186	GC	On-Demand	Anodyne	HRH2	30	44
COC(=O)C1(O)CN(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)C1	ZINC000875457186	GC	On-Demand	Anodyne	KCNH2	15	40
COC(=O)C1(O)CN(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)C1	ZINC000875457186	GC	On-Demand	Anodyne	ESR2	47	36
COC(=O)C1(O)CN(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)C1	ZINC000875457186	GC	On-Demand	Anodyne	LTA4H	62	48
COC(=O)C1(O)CN(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)C1	ZINC000875457186	GC	On-Demand	Anodyne	HRH3	67	47
COC(=O)C1(O)CN(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)C1	ZINC000875457186	GC	On-Demand	Anodyne	PSMB2	45	45
COC(=O)C1(O)CN(C(=O)NCCc2ccc(OCCN3CCCC3)cc2)C1	ZINC000875457186	GC	On-Demand	Anodyne	PSMB1	48	45
CN1C[C@@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)CC1=O	ZINC000875457204	FD	On-Demand	Anodyne	ACE	44	36
CN1C[C@@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)CC1=O	ZINC000875457204	FD	On-Demand	Anodyne	DRD2	16	40
CN1C[C@@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)CC1=O	ZINC000875457204	FD	On-Demand	Anodyne	FKBP1A	23	42
CN1C[C@@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)CC1=O	ZINC000875457204	FD	On-Demand	Anodyne	DRD3	27	40
CN1C[C@@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)CC1=O	ZINC000875457204	FD	On-Demand	Anodyne	SSTR4	40	36
CN1C[C@@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)CC1=O	ZINC000875457204	FD	On-Demand	Anodyne	SIGMAR1	24	40
CN1C[C@@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)CC1=O	ZINC000875457204	FD	On-Demand	Anodyne	SCN2A	20	40
CN1C[C@@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)CC1=O	ZINC000875457204	FD	On-Demand	Anodyne	FAAH	74	39
CN1C[C@@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)CC1=O	ZINC000875457204	FD	On-Demand	Anodyne	CES1	69	36
CN1C[C@@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)CC1=O	ZINC000875457204	FD	On-Demand	Anodyne	AMP1_PLAFQ	23	44
CN1C[C@@H](CNC(=O)C(=O)NCCCCCCc2ccccc2)CC1=O	ZINC000875457204	FD	On-Demand	Anodyne	CES1D	55	34
CCCCCCCNC(=O)C(=O)N[C@H]1CCc2ccc(O)cc21	ZINC000875457226	DF	On-Demand	Mild	NQO2	18	41
CCCCCCCNC(=O)C(=O)N[C@H]1CCc2ccc(O)cc21	ZINC000875457226	DF	On-Demand	Mild	GRIA1	54	34
CCCCCCCNC(=O)C(=O)N[C@H]1CCc2ccc(O)cc21	ZINC000875457226	DF	On-Demand	Mild	ASAH1	70	36
CCCCCCCNC(=O)C(=O)N[C@H]1CCc2ccc(O)cc21	ZINC000875457226	DF	On-Demand	Mild	LASR	40	33
CCCCCCCNC(=O)C(=O)N[C@@H]1CCc2ccc(O)cc21	ZINC000875457227	DF	On-Demand	Mild	NQO2	18	41
CCCCCCCNC(=O)C(=O)N[C@@H]1CCc2ccc(O)cc21	ZINC000875457227	DF	On-Demand	Mild	GRIA1	54	34
CCCCCCCNC(=O)C(=O)N[C@@H]1CCc2ccc(O)cc21	ZINC000875457227	DF	On-Demand	Mild	ASAH1	70	36
CCCCCCCNC(=O)C(=O)N[C@@H]1CCc2ccc(O)cc21	ZINC000875457227	DF	On-Demand	Mild	LASR	40	33
COC[C@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccc(F)c(F)c1	ZINC000875457238	FF	On-Demand	Anodyne	MAPK1	28	44
COC[C@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccc(F)c(F)c1	ZINC000875457238	FF	On-Demand	Anodyne	REN	18	46
COC[C@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccc(F)c(F)c1	ZINC000875457239	FF	On-Demand	Anodyne	MAPK1	28	44
COC[C@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccc(F)c(F)c1	ZINC000875457239	FF	On-Demand	Anodyne	REN	18	46
COC[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccc(F)c(F)c1	ZINC000875457240	FF	On-Demand	Anodyne	MAPK1	28	44
COC[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccc(F)c(F)c1	ZINC000875457240	FF	On-Demand	Anodyne	REN	18	46
COC[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccc(F)c(F)c1	ZINC000875457241	FF	On-Demand	Anodyne	MAPK1	28	44
COC[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccc(F)c(F)c1	ZINC000875457241	FF	On-Demand	Anodyne	REN	18	46
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](COC)c2ccc(F)c(F)c2)C1	ZINC000875457268	FE	On-Demand	Anodyne	MAPK1	24	42
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](COC)c2ccc(F)c(F)c2)C1	ZINC000875457269	FE	On-Demand	Anodyne	MAPK1	24	42
CCCCCCCNC(=O)C(=O)N[C@@H]1CCC[C@H]1Cc1cnn(C)c1	ZINC000875457272	EE	On-Demand	Mild	ASAH1	73	33
CCCCCCCNC(=O)C(=O)N[C@@H]1CCC[C@@H]1Cc1cnn(C)c1	ZINC000875457273	EE	On-Demand	Mild	ASAH1	73	33
CCCCCCCNC(=O)C(=O)N[C@H]1CCC[C@H]1Cc1cnn(C)c1	ZINC000875457274	EE	On-Demand	Mild	ASAH1	73	33
CCCCCCCNC(=O)C(=O)N[C@H]1CCC[C@@H]1Cc1cnn(C)c1	ZINC000875457275	EE	On-Demand	Mild	ASAH1	73	33
COC[C@@H](NC(=O)N1CC(O)(C(=O)OC)C1)c1ccc(F)c(F)c1	ZINC000875457319	EC	On-Demand	Anodyne	MAPK1	35	47
COC[C@H](NC(=O)N1CC(O)(C(=O)OC)C1)c1ccc(F)c(F)c1	ZINC000875457320	EC	On-Demand	Anodyne	MAPK1	35	47
COc1ccccc1[C@H]1CCCN(C(=O)NCCc2cnccn2)CC1	ZINC000875457345	FG	On-Demand	Anodyne	ACKR3	60	31
COc1ccccc1[C@@H]1CCCN(C(=O)NCCc2cnccn2)CC1	ZINC000875457346	FG	On-Demand	Anodyne	ACKR3	60	31
O=C(NCCc1cnccn1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875457347	ED	On-Demand	Anodyne	PREP	46	35
O=C(NCCc1cnccn1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875457348	ED	On-Demand	Anodyne	PREP	46	35
O=C(NCCc1cnccn1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875457349	ED	On-Demand	Anodyne	PREP	46	35
O=C(NCCc1cnccn1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875457350	ED	On-Demand	Anodyne	PREP	46	35
CC[C@@H](NC(=O)C(=O)NC[C@H]1CN(Cc2ccc(C)cc2)CCO1)C1CC1	ZINC000875457487	FD	On-Demand	Anodyne	DRD4	15	41
CC[C@@H](NC(=O)C(=O)NC[C@@H]1CN(Cc2ccc(C)cc2)CCO1)C1CC1	ZINC000875457488	FD	On-Demand	Anodyne	DRD4	15	41
COC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccc(F)c(F)c1	ZINC000875457522	FE	On-Demand	Anodyne	SLC6A4	23	41
COC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccc(F)c(F)c1	ZINC000875457522	FE	On-Demand	Anodyne	SLC6A3	53	40
COC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccc(F)c(F)c1	ZINC000875457523	FE	On-Demand	Anodyne	SLC6A4	23	41
COC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccc(F)c(F)c1	ZINC000875457523	FE	On-Demand	Anodyne	SLC6A3	53	40
COC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccc(F)c(F)c1	ZINC000875457524	FE	On-Demand	Anodyne	SLC6A4	23	41
COC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccc(F)c(F)c1	ZINC000875457524	FE	On-Demand	Anodyne	SLC6A3	53	40
COC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccc(F)c(F)c1	ZINC000875457525	FE	On-Demand	Anodyne	SLC6A4	23	41
COC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccc(F)c(F)c1	ZINC000875457525	FE	On-Demand	Anodyne	SLC6A3	53	40
CC[C@@H](NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1)C1CC1	ZINC000875457527	EF	On-Demand	Anodyne	PTAFR	17	40
CC[C@@H](NC(=O)C(=O)N[C@@H](Cc1cccnc1)C1CCCC1)C1CC1	ZINC000875457527	EF	On-Demand	Anodyne	C3AR1	42	42
COC(=O)N(C)NC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000875457552	FD	On-Demand	Reactive	ESR1	76	39
COC(=O)N(C)NC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000875457552	FD	On-Demand	Reactive	KCNH2	17	40
COC(=O)N(C)NC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000875457552	FD	On-Demand	Reactive	ESR2	53	39
COC(=O)N(C)NC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000875457552	FD	On-Demand	Reactive	LTA4H	75	49
COC(=O)N(C)NC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000875457552	FD	On-Demand	Reactive	HRH3	69	54
COC(=O)N(C)NC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000875457552	FD	On-Demand	Reactive	PSMB2	45	46
COC(=O)N(C)NC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000875457552	FD	On-Demand	Reactive	PSMB1	49	46
O=C(NCCc1cnccn1)N[C@@H](CCO)c1ccc(Cl)c(F)c1	ZINC000875457566	FE	On-Demand	Anodyne	MAPK1	44	34
O=C(NCCc1cnccn1)N[C@H](CCO)c1ccc(Cl)c(F)c1	ZINC000875457567	FE	On-Demand	Anodyne	MAPK1	44	34
CN1C[C@@H](CNC(=O)C(=O)N2CC[C@@H](c3cccc(Cl)c3)C2(C)C)CC1=O	ZINC000875457569	GE	On-Demand	Anodyne	MDM2	62	32
CN1C[C@@H](CNC(=O)C(=O)N2CC[C@H](c3cccc(Cl)c3)C2(C)C)CC1=O	ZINC000875457570	GE	On-Demand	Anodyne	MDM2	62	32
O=C(N[C@H]1CCc2ccc(O)cc21)C(=O)N[C@H]1CC12CCC2	ZINC000875457610	DD	On-Demand	Anodyne	NR1H3	24	41
O=C(N[C@H]1CC12CCC2)C(=O)N[C@@H]1CCc2ccc(O)cc21	ZINC000875457611	DD	On-Demand	Anodyne	NR1H3	24	41
O=C(N[C@H]1CCc2ccc(O)cc21)C(=O)N[C@@H]1CC12CCC2	ZINC000875457612	DD	On-Demand	Anodyne	NR1H3	24	41
O=C(N[C@@H]1CCc2ccc(O)cc21)C(=O)N[C@@H]1CC12CCC2	ZINC000875457613	DD	On-Demand	Anodyne	NR1H3	24	41
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NC[C@H]1CC(=O)N(C)C1)CC2	ZINC000875457621	GC	On-Demand	Anodyne	SLC18A2	50	38
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)C(=O)NC[C@@H]1CC(=O)N(C)C1)CC2	ZINC000875457622	GC	On-Demand	Anodyne	SLC18A2	50	38
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NC[C@H]1CC(=O)N(C)C1)CC2	ZINC000875457623	GC	On-Demand	Anodyne	SLC18A2	50	38
COc1cc2c(cc1OC)[C@H](C)N(C(=O)C(=O)NC[C@@H]1CC(=O)N(C)C1)CC2	ZINC000875457624	GC	On-Demand	Anodyne	SLC18A2	50	38
CC[C@@H](NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1)C1CC1	ZINC000875457628	EF	On-Demand	Anodyne	PTAFR	17	40
CC[C@@H](NC(=O)C(=O)N[C@H](Cc1cccnc1)C1CCCC1)C1CC1	ZINC000875457628	EF	On-Demand	Anodyne	C3AR1	42	42
CC[C@@H](NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1)C1CC1	ZINC000875457684	EE	On-Demand	Anodyne	ROCK1	25	42
CC[C@@H](NC(=O)C(=O)NCc1nc(-c2ccncc2)cs1)C1CC1	ZINC000875457684	EE	On-Demand	Anodyne	ROCK2	16	42
COc1ccccc1[C@H]1CCCN(C(=O)NCCCc2c(C)nn(C)c2C)CC1	ZINC000875457760	GH	On-Demand	Anodyne	DRD2	22	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCc2c(C)nn(C)c2C)CC1	ZINC000875457761	GH	On-Demand	Anodyne	DRD2	22	42
COC[C@H](NC(=O)N1CC[C@@H](C(F)(F)F)O[C@@H](C)C1)c1ccc(F)c(F)c1	ZINC000875457839	GG	On-Demand	Anodyne	MAPK1	26	40
COC[C@H](NC(=O)N1CC[C@H](C(F)(F)F)O[C@@H](C)C1)c1ccc(F)c(F)c1	ZINC000875457840	GG	On-Demand	Anodyne	MAPK1	26	40
COC[C@H](NC(=O)N1CC[C@@H](C(F)(F)F)O[C@H](C)C1)c1ccc(F)c(F)c1	ZINC000875457841	GG	On-Demand	Anodyne	MAPK1	26	40
COC[C@H](NC(=O)N1CC[C@H](C(F)(F)F)O[C@H](C)C1)c1ccc(F)c(F)c1	ZINC000875457842	GG	On-Demand	Anodyne	MAPK1	26	40
N#CCc1ccsc1C(=O)Nc1cc(Br)ccc1N1CCCC1	ZINC000875457921	GI	On-Demand	Mild	KCNQ2	66	37
N#CCc1ccsc1C(=O)Nc1cc(Br)ccc1N1CCCC1	ZINC000875457921	GI	On-Demand	Mild	CSF1R	18	43
CN1CCN(C2CCN(C(=O)C(=O)N[C@H]3CCc4ccc(O)cc43)CC2)CC1	ZINC000875457945	GC	On-Demand	Anodyne	L3MBTL3	65	40
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3CCc4ccc(O)cc43)CC2)CC1	ZINC000875457946	GC	On-Demand	Anodyne	L3MBTL3	65	40
CN1C[C@@H](CNC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1=O	ZINC000875457989	FC	On-Demand	Anodyne	OXTR	59	36
CN1C[C@@H](CNC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1=O	ZINC000875457991	FC	On-Demand	Anodyne	OXTR	59	36
Cc1nnc(NNC(=O)NCCc2ccc(OCCN3CCCC3)cc2)n1C	ZINC000875458000	GD	On-Demand	Reactive	ESR1	69	39
Cc1nnc(NNC(=O)NCCc2ccc(OCCN3CCCC3)cc2)n1C	ZINC000875458000	GD	On-Demand	Reactive	ESR2	47	37
Cc1nnc(NNC(=O)NCCc2ccc(OCCN3CCCC3)cc2)n1C	ZINC000875458000	GD	On-Demand	Reactive	LTA4H	54	45
Cc1nnc(NNC(=O)NCCc2ccc(OCCN3CCCC3)cc2)n1C	ZINC000875458000	GD	On-Demand	Reactive	HRH3	53	47
Cc1nnc(NNC(=O)NCCc2ccc(OCCN3CCCC3)cc2)n1C	ZINC000875458000	GD	On-Demand	Reactive	PSMB2	42	42
Cc1nnc(NNC(=O)NCCc2ccc(OCCN3CCCC3)cc2)n1C	ZINC000875458000	GD	On-Demand	Reactive	PSMB1	45	42
O=C(NCCc1cnccn1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875458042	EE	On-Demand	Anodyne	CPT1A	85	39
O=C(NCCc1cnccn1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875458043	EE	On-Demand	Anodyne	CPT1A	85	39
O=C(NCCc1cnccn1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875458044	EE	On-Demand	Anodyne	CPT1A	85	39
O=C(NCCc1cnccn1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875458045	EE	On-Demand	Anodyne	CPT1A	85	39
CCCCCCCNC(=O)C(=O)NC[C@H]1CC(=O)N(C)C1	ZINC000875458071	CC	On-Demand	Mild	ASAH1	94	38
CCCCCCCNC(=O)C(=O)NC[C@H]1CC(=O)N(C)C1	ZINC000875458071	CC	On-Demand	Mild	LASR	45	33
CCCCCCCNC(=O)C(=O)NC[C@@H]1CC(=O)N(C)C1	ZINC000875458072	CC	On-Demand	Mild	ASAH1	94	38
CCCCCCCNC(=O)C(=O)NC[C@@H]1CC(=O)N(C)C1	ZINC000875458072	CC	On-Demand	Mild	LASR	45	33
C[C@@H](NC(=O)NCCc1cnccn1)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000875458109	GG	On-Demand	Anodyne	PRCP	24	54
CN1C[C@@H](CNC(=O)C(=O)NCc2ccc(OC(F)F)cc2F)CC1=O	ZINC000875458223	FC	On-Demand	Anodyne	P2RX7	45	44
N#CC1(CNC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)CCCCC1	ZINC000875458279	GF	On-Demand	Mild	C3AR1	38	40
N#CC1(CNC(=O)C(=O)N[C@@H](Cc2cccnc2)C2CCCC2)CCCCC1	ZINC000875458279	GF	On-Demand	Mild	CTSS	20	41
N#CC1(CNC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)CCCCC1	ZINC000875458280	GF	On-Demand	Mild	C3AR1	38	40
N#CC1(CNC(=O)C(=O)N[C@H](Cc2cccnc2)C2CCCC2)CCCCC1	ZINC000875458280	GF	On-Demand	Mild	CTSS	20	41
CC(C)(C)OC(=O)N1CC[C@H]2[C@H]1CCCN2C(=O)NCCc1cnccn1	ZINC000875458324	GE	On-Demand	Anodyne	GPR119	16	42
CC(C)(C)OC(=O)N1CC[C@H]2[C@@H]1CCCN2C(=O)NCCc1cnccn1	ZINC000875458326	GE	On-Demand	Anodyne	GPR119	16	42
CC(C)(C)OC(=O)N1CC[C@@H]2[C@H]1CCCN2C(=O)NCCc1cnccn1	ZINC000875458329	GE	On-Demand	Anodyne	GPR119	16	42
CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H]1CCCN2C(=O)NCCc1cnccn1	ZINC000875458331	GE	On-Demand	Anodyne	GPR119	16	42
O=C(NCCc1ccc(OCCN2CCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875458361	FD	On-Demand	Anodyne	ESR1	80	37
O=C(NCCc1ccc(OCCN2CCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875458361	FD	On-Demand	Anodyne	ESR2	54	37
O=C(NCCc1ccc(OCCN2CCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875458361	FD	On-Demand	Anodyne	LTA4H	69	49
O=C(NCCc1ccc(OCCN2CCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875458361	FD	On-Demand	Anodyne	HRH3	58	46
O=C(NCCc1ccc(OCCN2CCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875458361	FD	On-Demand	Anodyne	CCR3	15	40
O=C(NCCc1ccc(OCCN2CCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875458361	FD	On-Demand	Anodyne	PSMB2	44	46
O=C(NCCc1ccc(OCCN2CCCC2)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875458361	FD	On-Demand	Anodyne	PSMB1	48	46
O=C(NCCc1cnccn1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875458605	ED	On-Demand	Anodyne	FAAH	24	46
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cnccn1	ZINC000875458621	DC	On-Demand	Anodyne	SLC6A4	18	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1cnccn1	ZINC000875458622	DC	On-Demand	Anodyne	SLC6A4	18	41
COc1ccccc1[C@H]1CN(C(=O)C(=O)NCC2(C#N)CCCCC2)CCO1	ZINC000875458660	GE	On-Demand	Mild	HCN1	52	34
COc1ccccc1[C@H]1CN(C(=O)C(=O)NCC2(C#N)CCCCC2)CCO1	ZINC000875458660	GE	On-Demand	Mild	HCN4	50	34
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NCC2(C#N)CCCCC2)CCO1	ZINC000875458661	GE	On-Demand	Mild	HCN1	52	34
COc1ccccc1[C@@H]1CN(C(=O)C(=O)NCC2(C#N)CCCCC2)CCO1	ZINC000875458661	GE	On-Demand	Mild	HCN4	50	34
C[C@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccccc1[N+](=O)[O-]	ZINC000875458724	GE	On-Demand	Bother	COLA	99	35
C[C@@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)c1ccccc1[N+](=O)[O-]	ZINC000875458725	GE	On-Demand	Bother	COLA	99	35
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccccc1[N+](=O)[O-]	ZINC000875458770	DD	On-Demand	Bother	COLA	41	30
N#CC1(CNC(=O)C(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)CCCCC1	ZINC000875458824	FE	On-Demand	Mild	DPP4	19	40
N#CC1(CNC(=O)C(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)CCCCC1	ZINC000875458825	FE	On-Demand	Mild	DPP4	19	40
N#CC1(CNC(=O)C(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)CCCCC1	ZINC000875458826	FE	On-Demand	Mild	DPP4	19	40
N#CC1(CNC(=O)C(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)CCCCC1	ZINC000875458827	FE	On-Demand	Mild	DPP4	19	40
CO[C@H]1CCC[C@@H]1CNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875458828	FF	On-Demand	Mild	ITK	21	47
CO[C@H]1CCC[C@@H]1CNC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875458828	FF	On-Demand	Mild	PANC	56	38
C[C@@H](NC(=O)N(C)OCC(F)(F)F)c1ccccc1[N+](=O)[O-]	ZINC000875458837	DF	On-Demand	Bother	COLA	113	39
COC(=O)c1ccc(C(=O)NNC(=S)Nc2cccc(Br)c2)cn1	ZINC000875458861	HE	On-Demand	Reactive	KCNK3	58	35
COC(=O)c1ccc(C(=O)NNC(=S)Nc2cccc(Br)c2)cn1	ZINC000875458861	HE	On-Demand	Reactive	KCNK9	43	33
C[C@@H](NC(=O)NC1(C)CC(F)(F)C1)c1ccccc1[N+](=O)[O-]	ZINC000875459034	DG	On-Demand	Bother	COLA	77	32
C[C@H](NC(=O)NC1(C)CC(F)(F)C1)c1ccccc1[N+](=O)[O-]	ZINC000875459035	DG	On-Demand	Bother	COLA	77	32
CCCCCCCNC(=O)C(=O)NCCc1cncc(C)n1	ZINC000875459124	DD	On-Demand	Mild	ASAH1	81	36
CO[C@H]1CCC[C@@H]1CNC(=O)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875459183	GG	On-Demand	Anodyne	SMO	28	40
CSc1ccc(C)c(C(=O)NNC(=S)Nc2cccc(Br)c2)c1	ZINC000875459226	HI	On-Demand	Reactive	KCNK3	48	36
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)c1ccccc1[N+](=O)[O-]	ZINC000875459231	FG	On-Demand	Bother	COLA	83	32
C[C@H](NC(=O)Nc1ccccc1)C(=O)NNC(=S)Nc1cccc(Br)c1	ZINC000875459256	IF	On-Demand	Reactive	FPR1	15	41
O=C(NC[C@@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875459350	GE	On-Demand	Anodyne	L3MBTL3	47	33
O=C(NC[C@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875459353	GE	On-Demand	Anodyne	L3MBTL3	47	33
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)c1ccccc1[N+](=O)[O-]	ZINC000875459403	GH	On-Demand	Bother	OPRL1	17	46
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)c1ccccc1[N+](=O)[O-]	ZINC000875459403	GH	On-Demand	Bother	COLA	40	31
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)c1ccccc1[N+](=O)[O-]	ZINC000875459405	GH	On-Demand	Bother	OPRL1	17	46
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)c1ccccc1[N+](=O)[O-]	ZINC000875459405	GH	On-Demand	Bother	COLA	40	31
O=C(NCc1ccc(Cl)cn1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875459407	EF	On-Demand	Anodyne	CCR1	50	36
O=C(NCc1ccc(Cl)cn1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875459407	EF	On-Demand	Anodyne	EPHX2	23	52
O=C(NCc1ccc(Cl)cn1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875459409	EF	On-Demand	Anodyne	CCR1	50	36
O=C(NCc1ccc(Cl)cn1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875459409	EF	On-Demand	Anodyne	EPHX2	23	52
C[C@@H](NC(=O)N(C)CCN1CC2(CCOCC2)C1)c1ccccc1[N+](=O)[O-]	ZINC000875459421	GE	On-Demand	Bother	COLA	70	33
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCN(C)C(=O)OC	ZINC000875459462	ED	On-Demand	Anodyne	CAPN2	74	38
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCN(C)C(=O)OC	ZINC000875459462	ED	On-Demand	Anodyne	NPR	45	35
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCN(C)C(=O)OC	ZINC000875459463	ED	On-Demand	Anodyne	CAPN2	74	38
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCN(C)C(=O)OC	ZINC000875459463	ED	On-Demand	Anodyne	NPR	45	35
O=C(NCc1ccc(Cl)cn1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875459631	FH	On-Demand	Anodyne	F2	28	41
O=C(NCc1ccc(Cl)cn1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875459631	FH	On-Demand	Anodyne	CPT1A	66	36
O=C(NCc1ccc(Cl)cn1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875459632	FH	On-Demand	Anodyne	F2	28	41
O=C(NCc1ccc(Cl)cn1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875459632	FH	On-Demand	Anodyne	CPT1A	66	36
O=C(NCc1ccc(Cl)cn1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875459633	FH	On-Demand	Anodyne	F2	28	41
O=C(NCc1ccc(Cl)cn1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875459633	FH	On-Demand	Anodyne	CPT1A	66	36
O=C(NCc1ccc(Cl)cn1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875459634	FH	On-Demand	Anodyne	F2	28	41
O=C(NCc1ccc(Cl)cn1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875459634	FH	On-Demand	Anodyne	CPT1A	66	36
O=C(NOC1CCCC1)NC1CC(Nc2ccccc2)C1	ZINC000875459635	CF	On-Demand	Anodyne	EPHX2	24	48
O=C(NOC1CCCC1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875459697	FG	On-Demand	Anodyne	CPT1A	25	41
O=C(NOC1CCCC1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875459697	FG	On-Demand	Anodyne	PRKD1	46	35
O=C(Nc1cncnc1-n1cccn1)[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875459746	FG	On-Demand	Anodyne	C3AR1	46	44
O=C(Nc1cncnc1-n1cccn1)[C@H](Cc1cccnc1)C1CCCC1	ZINC000875459747	FG	On-Demand	Anodyne	C3AR1	46	44
CC(=O)C1CCN(C(=O)NC[C@H]2CN(C(=O)c3ccccc3)[C@H]3CCN2C3)CC1	ZINC000875459754	GD	On-Demand	Anodyne	L3MBTL3	73	35
CC(=O)C1CCN(C(=O)NC[C@@H]2CN(C(=O)c3ccccc3)[C@H]3CCN2C3)CC1	ZINC000875459755	GD	On-Demand	Anodyne	L3MBTL3	73	35
O=CN1CCCN(C(=O)NCc2ccc(Cl)cn2)CC1	ZINC000875459767	CD	On-Demand	Anodyne	EPHX2	15	42
O=C(NC[C@H](O)Cc1cccc(Cl)c1)NOC1CCCC1	ZINC000875459780	DE	On-Demand	Anodyne	ADRB1	28	45
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)NOC1CCCC1	ZINC000875459781	DE	On-Demand	Anodyne	ADRB1	28	45
O=C(NCc1ccc(Cl)cn1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875459782	EG	On-Demand	Anodyne	F2	37	43
O=C(NCc1ccc(Cl)cn1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875459782	EG	On-Demand	Anodyne	PREP	42	39
O=C(NCc1ccc(Cl)cn1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875459783	EG	On-Demand	Anodyne	F2	37	43
O=C(NCc1ccc(Cl)cn1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875459783	EG	On-Demand	Anodyne	PREP	42	39
O=C(NCc1ccc(Cl)cn1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875459784	EG	On-Demand	Anodyne	F2	37	43
O=C(NCc1ccc(Cl)cn1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875459784	EG	On-Demand	Anodyne	PREP	42	39
O=C(NCc1ccc(Cl)cn1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875459785	EG	On-Demand	Anodyne	F2	37	43
O=C(NCc1ccc(Cl)cn1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875459785	EG	On-Demand	Anodyne	PREP	42	39
O=C(NCCO)C1CCN(C(=O)NCc2ccc(Cl)cn2)CC1	ZINC000875459837	EC	On-Demand	Anodyne	EPHX2	24	52
O=C(NOC1CCCC1)N[C@@H]1Cc2ccccc2NC1=O	ZINC000875459916	CD	On-Demand	Anodyne	PYGM	19	48
O=C(NOC1CCCC1)N[C@H]1Cc2ccccc2NC1=O	ZINC000875459917	CD	On-Demand	Anodyne	PYGM	19	48
CCCCCCCNC(=O)C(=O)NC[C@@H]1CCCO[C@H]1c1ccnn1C	ZINC000875459924	FE	On-Demand	Mild	ASAH1	41	32
N#Cc1ccc(Cn2cc(NC(=O)NOC3CCCC3)cn2)cc1	ZINC000875459967	EF	On-Demand	Mild	ITK	23	53
N#Cc1ccc(Cn2cc(NC(=O)NOC3CCCC3)cn2)cc1	ZINC000875459967	EF	On-Demand	Mild	PANC	56	38
O=C(NCc1ccc(Cl)cn1)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2	ZINC000875459998	FG	On-Demand	Anodyne	OPRL1	19	41
O=C(NCc1ccc(Cl)cn1)N1CCC(CO)(CO)CC1	ZINC000875460020	DD	On-Demand	Anodyne	CACNA1H	42	31
O=C(NCc1ccc(Cl)cn1)N1CCC(CO)(CO)CC1	ZINC000875460020	DD	On-Demand	Anodyne	EPHX2	17	45
O=C(NOC1CCCC1)N1CC(Cc2cccs2)C1	ZINC000875460048	CF	On-Demand	Anodyne	CTSC	25	40
O=C(NOC1CCCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875460076	DF	On-Demand	Anodyne	CHRM4	27	40
O=C(NOC1CCCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875460076	DF	On-Demand	Anodyne	CHRM5	33	40
O=C(NOC1CCCC1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875460076	DF	On-Demand	Anodyne	PREP	52	40
O=C(NOC1CCCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875460077	DF	On-Demand	Anodyne	CHRM4	27	40
O=C(NOC1CCCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875460077	DF	On-Demand	Anodyne	CHRM5	33	40
O=C(NOC1CCCC1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875460077	DF	On-Demand	Anodyne	PREP	52	40
O=C(NOC1CCCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875460078	DF	On-Demand	Anodyne	CHRM4	27	40
O=C(NOC1CCCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875460078	DF	On-Demand	Anodyne	CHRM5	33	40
O=C(NOC1CCCC1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875460078	DF	On-Demand	Anodyne	PREP	52	40
O=C(NOC1CCCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875460079	DF	On-Demand	Anodyne	CHRM4	27	40
O=C(NOC1CCCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875460079	DF	On-Demand	Anodyne	CHRM5	33	40
O=C(NOC1CCCC1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875460079	DF	On-Demand	Anodyne	PREP	52	40
COCCN(CC1CCN(C)CC1)C(=O)NCc1ccc(Cl)cn1	ZINC000875460096	FE	On-Demand	Anodyne	CACNA1I	50	34
CC(C)(C)OC(=O)N1CC[C@H]2[C@H]1CCCN2C(=O)NCc1ccc(Cl)cn1	ZINC000875460118	GG	On-Demand	Anodyne	UL80	43	36
CC(C)(C)OC(=O)N1CC[C@H]2[C@@H]1CCCN2C(=O)NCc1ccc(Cl)cn1	ZINC000875460119	GG	On-Demand	Anodyne	UL80	43	36
CC(C)(C)OC(=O)N1CC[C@@H]2[C@H]1CCCN2C(=O)NCc1ccc(Cl)cn1	ZINC000875460120	GG	On-Demand	Anodyne	UL80	43	36
CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H]1CCCN2C(=O)NCc1ccc(Cl)cn1	ZINC000875460121	GG	On-Demand	Anodyne	UL80	43	36
O=CN1CCCN(C(=O)NC[C@H]2CN(C(=O)c3ccccc3)[C@H]3CCN2C3)CC1	ZINC000875460122	GC	On-Demand	Anodyne	L3MBTL3	48	34
O=CN1CCCN(C(=O)NC[C@@H]2CN(C(=O)c3ccccc3)[C@H]3CCN2C3)CC1	ZINC000875460123	GC	On-Demand	Anodyne	L3MBTL3	48	34
CN1CCN(C(=O)NCc2ccc(Cl)cn2)CCC1(C)C	ZINC000875460167	DE	On-Demand	Anodyne	CCR1	42	35
COc1cccc(C(C)(C)C(=O)N2CCO[C@H](C)[C@H]2C)c1	ZINC000875460180	CF	On-Demand	Anodyne	DRD4	40	31
COc1cccc(C(C)(C)C(=O)N2CCO[C@@H](C)[C@H]2C)c1	ZINC000875460181	CF	On-Demand	Anodyne	DRD4	40	31
COc1cccc(C(C)(C)C(=O)N2CCO[C@H](C)[C@@H]2C)c1	ZINC000875460182	CF	On-Demand	Anodyne	DRD4	40	31
COc1cccc(C(C)(C)C(=O)N2CCO[C@@H](C)[C@@H]2C)c1	ZINC000875460183	CF	On-Demand	Anodyne	DRD4	40	31
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCc2ccc(Cl)cn2)C1	ZINC000875460230	GE	On-Demand	Anodyne	EPHX2	26	41
O=C(N[C@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCc2ccc(Cl)cn2)C1	ZINC000875460231	GE	On-Demand	Anodyne	EPHX2	26	41
O=C(N[C@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NCc2ccc(Cl)cn2)C1	ZINC000875460232	GE	On-Demand	Anodyne	EPHX2	26	41
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NCc2ccc(Cl)cn2)C1	ZINC000875460233	GE	On-Demand	Anodyne	EPHX2	26	41
CC[C@@H](NC(=O)NOC1CCCC1)[C@@H](O)c1ccccc1	ZINC000875460284	CF	On-Demand	Anodyne	AMY2	46	33
CC[C@@H](NC(=O)NOC1CCCC1)[C@H](O)c1ccccc1	ZINC000875460286	CF	On-Demand	Anodyne	AMY2	46	33
CC(C)(C)OC(=O)N1CCC2(CC1)CN(C(=O)NCc1ccc(Cl)cn1)C2	ZINC000875460305	GG	On-Demand	Anodyne	GPR119	35	41
O=C(NCC[C@@H](O)COCc1ccccc1)NOC1CCCC1	ZINC000875460368	DE	On-Demand	Anodyne	ACE	19	40
O=C(NCC[C@@H](O)COCc1ccccc1)NOC1CCCC1	ZINC000875460368	DE	On-Demand	Anodyne	CAPN1	45	37
O=C(NCC[C@@H](O)COCc1ccccc1)NOC1CCCC1	ZINC000875460368	DE	On-Demand	Anodyne	CAPN2	68	36
O=C(NCC[C@@H](O)COCc1ccccc1)NOC1CCCC1	ZINC000875460368	DE	On-Demand	Anodyne	NPR	49	35
O=C(NCc1ccc(Cl)cn1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875460380	EG	On-Demand	Anodyne	EPHX2	27	50
O=C(NCc1ccc(Cl)cn1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875460381	EG	On-Demand	Anodyne	EPHX2	27	50
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cl)cn1	ZINC000875460386	DD	On-Demand	Anodyne	SLC6A4	35	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cl)cn1	ZINC000875460386	DD	On-Demand	Anodyne	SLC6A3	65	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cl)cn1	ZINC000875460387	DD	On-Demand	Anodyne	SLC6A4	35	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cl)cn1	ZINC000875460387	DD	On-Demand	Anodyne	SLC6A3	65	42
CC(C)(C)OC(=O)N1CCC2(CC1)CN(C(=O)NOC1CCCC1)C2	ZINC000875460397	FF	On-Demand	Anodyne	GPR119	29	40
O=C(N[C@H]1CCCOc2cc(Cl)ccc21)N1CCC(CO)(CO)CC1	ZINC000875460438	FE	On-Demand	Anodyne	CACNA1H	41	32
O=C(N[C@@H]1CCCOc2cc(Cl)ccc21)N1CCC(CO)(CO)CC1	ZINC000875460439	FE	On-Demand	Anodyne	CACNA1H	41	32
CN(C)c1nccc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)n1	ZINC000875460456	FE	On-Demand	Anodyne	CPT1A	66	33
CN(C)c1nccc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)n1	ZINC000875460457	FE	On-Demand	Anodyne	CPT1A	66	33
CN(C)c1nccc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)n1	ZINC000875460458	FE	On-Demand	Anodyne	CPT1A	66	33
CN(C)c1nccc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)n1	ZINC000875460459	FE	On-Demand	Anodyne	CPT1A	66	33
O=C(NOC1CCCC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875460502	DF	On-Demand	Anodyne	EPHX2	18	42
O=C(NOC1CCCC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875460502	DF	On-Demand	Anodyne	SLC12A5	49	37
O=C(NOC1CCCC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875460504	DF	On-Demand	Anodyne	EPHX2	18	42
O=C(NOC1CCCC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875460504	DF	On-Demand	Anodyne	SLC12A5	49	37
O=C(NCC1=CCCC1)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875460535	EE	On-Demand	Anodyne	ROCK1	22	40
O=C(NCC1=CCCC1)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875460535	EE	On-Demand	Anodyne	ROCK2	15	40
CCOC(=O)[C@@H]1CN(C(=O)NCc2ccc(Cl)cn2)CCC1(F)F	ZINC000875460537	FE	On-Demand	Anodyne	CACNA1H	51	34
CC(=O)[C@@H]1CCCN(C(=O)NC[C@H]2CN(C(=O)c3ccccc3)[C@H]3CCN2C3)C1	ZINC000875460592	GD	On-Demand	Anodyne	PREP	36	42
CC(=O)[C@@H]1CCCN(C(=O)NC[C@H]2CN(C(=O)c3ccccc3)[C@H]3CCN2C3)C1	ZINC000875460592	GD	On-Demand	Anodyne	L3MBTL3	68	37
CC(=O)[C@@H]1CCCN(C(=O)NC[C@@H]2CN(C(=O)c3ccccc3)[C@H]3CCN2C3)C1	ZINC000875460593	GD	On-Demand	Anodyne	PREP	36	42
CC(=O)[C@@H]1CCCN(C(=O)NC[C@@H]2CN(C(=O)c3ccccc3)[C@H]3CCN2C3)C1	ZINC000875460593	GD	On-Demand	Anodyne	L3MBTL3	68	37
CC(=O)[C@H]1CCCN(C(=O)NC[C@@H]2CN(C(=O)c3ccccc3)[C@H]3CCN2C3)C1	ZINC000875460594	GD	On-Demand	Anodyne	PREP	36	42
CC(=O)[C@H]1CCCN(C(=O)NC[C@@H]2CN(C(=O)c3ccccc3)[C@H]3CCN2C3)C1	ZINC000875460594	GD	On-Demand	Anodyne	L3MBTL3	68	37
CC(=O)[C@H]1CCCN(C(=O)NC[C@H]2CN(C(=O)c3ccccc3)[C@H]3CCN2C3)C1	ZINC000875460595	GD	On-Demand	Anodyne	PREP	36	42
CC(=O)[C@H]1CCCN(C(=O)NC[C@H]2CN(C(=O)c3ccccc3)[C@H]3CCN2C3)C1	ZINC000875460595	GD	On-Demand	Anodyne	L3MBTL3	68	37
CCCCCCCNC(=O)C(=O)NC[C@@H]1CC(=O)N(C(C)(C)C)C1	ZINC000875460703	ED	On-Demand	Mild	ASAH1	83	36
CCCCCCCNC(=O)C(=O)NC[C@@H]1CC(=O)N(C(C)(C)C)C1	ZINC000875460703	ED	On-Demand	Mild	LASR	45	33
CCCCCCCNC(=O)C(=O)NC[C@H]1CC(=O)N(C(C)(C)C)C1	ZINC000875460704	ED	On-Demand	Mild	ASAH1	83	36
CCCCCCCNC(=O)C(=O)NC[C@H]1CC(=O)N(C(C)(C)C)C1	ZINC000875460704	ED	On-Demand	Mild	LASR	45	33
O=C(NCCCc1ccco1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875460733	GF	On-Demand	Anodyne	DRD2	20	41
O=C(NCCCc1ccco1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875460733	GF	On-Demand	Anodyne	DRD4	38	42
O=C(NCCCc1ccco1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875460733	GF	On-Demand	Anodyne	ACHE	60	58
O=C(NCCCc1ccco1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875460733	GF	On-Demand	Anodyne	HRH2	20	42
O=C(NCCCc1ccco1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875460733	GF	On-Demand	Anodyne	DRD3	16	42
O=C(NCCCc1ccco1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875460733	GF	On-Demand	Anodyne	SIGMAR1	60	43
O=C(NCCCc1ccco1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875460733	GF	On-Demand	Anodyne	BCHE	16	50
O=C(NCCCc1ccco1)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875460733	GF	On-Demand	Anodyne	CCR3	29	42
CC[C@@H](NC(=O)NCc1ccc(S(=O)(=O)CC)cc1)[C@@H](O)c1ccccc1	ZINC000875460774	GF	On-Demand	Anodyne	ANPEP	15	43
CC[C@@H](NC(=O)NCc1ccc(S(=O)(=O)CC)cc1)[C@@H](O)c1ccccc1	ZINC000875460774	GF	On-Demand	Anodyne	NAMPT	32	40
CC[C@@H](NC(=O)NCc1ccc(S(=O)(=O)CC)cc1)[C@@H](O)c1ccccc1	ZINC000875460774	GF	On-Demand	Anodyne	PDS	42	34
CC[C@@H](NC(=O)NCc1ccc(S(=O)(=O)CC)cc1)[C@H](O)c1ccccc1	ZINC000875460777	GF	On-Demand	Anodyne	ANPEP	15	43
CC[C@@H](NC(=O)NCc1ccc(S(=O)(=O)CC)cc1)[C@H](O)c1ccccc1	ZINC000875460777	GF	On-Demand	Anodyne	NAMPT	32	40
CC[C@@H](NC(=O)NCc1ccc(S(=O)(=O)CC)cc1)[C@H](O)c1ccccc1	ZINC000875460777	GF	On-Demand	Anodyne	PDS	42	34
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCCOc2cc(F)ccc21	ZINC000875460942	FF	On-Demand	Anodyne	SLC6A3	24	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCCOc2cc(F)ccc21	ZINC000875460943	FF	On-Demand	Anodyne	SLC6A3	24	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCCOc2cc(F)ccc21	ZINC000875460944	FF	On-Demand	Anodyne	SLC6A3	24	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCCOc2cc(F)ccc21	ZINC000875460945	FF	On-Demand	Anodyne	SLC6A3	24	40
O=C(CNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)N1CCOCC1	ZINC000875460946	FC	On-Demand	Anodyne	NPFFR1	40	35
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCC1SCCS1	ZINC000875460974	FF	On-Demand	Anodyne	ACE	54	39
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCC1SCCS1	ZINC000875460974	FF	On-Demand	Anodyne	MME	51	37
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCC1SCCS1	ZINC000875460974	FF	On-Demand	Anodyne	CAPN2	62	37
CC[C@@H](CCc1ccccc1)NC(=O)C(=O)NCCC1SCCS1	ZINC000875460974	FF	On-Demand	Anodyne	CTSC	19	40
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCC1SCCS1	ZINC000875460975	FF	On-Demand	Anodyne	ACE	54	39
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCC1SCCS1	ZINC000875460975	FF	On-Demand	Anodyne	MME	51	37
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCC1SCCS1	ZINC000875460975	FF	On-Demand	Anodyne	CAPN2	62	37
CC[C@H](CCc1ccccc1)NC(=O)C(=O)NCCC1SCCS1	ZINC000875460975	FF	On-Demand	Anodyne	CTSC	19	40
COc1ccccc1[C@H]1CCCN(C(=O)NCC(=O)N2CCOCC2)CC1	ZINC000875460980	GD	On-Demand	Anodyne	CTSS	32	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCC(=O)N2CCOCC2)CC1	ZINC000875460981	GD	On-Demand	Anodyne	CTSS	32	40
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NCC(=O)N1CCOCC1	ZINC000875460993	GD	On-Demand	Anodyne	CTSS	24	43
CC[C@H](C[C@H](C)O)NC(=O)NCC(=O)N1CCOCC1	ZINC000875461080	CB	On-Demand	Anodyne	RIR1_HHV11	37	41
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCCOc3cc(Cl)ccc32)CC1	ZINC000875461115	GE	On-Demand	Anodyne	EPHX2	21	46
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCCOc3cc(Cl)ccc32)CC1	ZINC000875461116	GE	On-Demand	Anodyne	EPHX2	21	46
CC(C)(C)OC(=O)N1CC[C@H]2[C@H]1CCCN2C(=O)NCC(=O)N1CCOCC1	ZINC000875461119	GD	On-Demand	Anodyne	PREP	21	42
CC(C)(C)OC(=O)N1CC[C@H]2[C@@H]1CCCN2C(=O)NCC(=O)N1CCOCC1	ZINC000875461121	GD	On-Demand	Anodyne	PREP	21	42
CC(C)(C)OC(=O)N1CC[C@@H]2[C@H]1CCCN2C(=O)NCC(=O)N1CCOCC1	ZINC000875461123	GD	On-Demand	Anodyne	PREP	21	42
CN1CCN(C2CCN(C(=O)C(=O)NCC3=CCCC3)CC2)CC1	ZINC000875461125	EC	On-Demand	Anodyne	L3MBTL3	68	42
CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H]1CCCN2C(=O)NCC(=O)N1CCOCC1	ZINC000875461126	GD	On-Demand	Anodyne	PREP	21	42
CCCCCCCNC(=O)C(=O)N[C@H]1CCN(CCC)C1	ZINC000875461177	CD	On-Demand	Mild	HTR4	19	40
CCCCCCCNC(=O)C(=O)N[C@H]1CCN(CCC)C1	ZINC000875461177	CD	On-Demand	Mild	ASAH1	81	35
CCCCCCCNC(=O)C(=O)N[C@@H]1CCN(CCC)C1	ZINC000875461178	CD	On-Demand	Mild	HTR4	19	40
CCCCCCCNC(=O)C(=O)N[C@@H]1CCN(CCC)C1	ZINC000875461178	CD	On-Demand	Mild	ASAH1	81	35
CC(C)(C)N1C[C@H](CNC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1=O	ZINC000875461179	GD	On-Demand	Anodyne	OXTR	51	36
CC(C)(C)N1C[C@@H](CNC(=O)C(=O)N2CC[C@@]3(CCc4ccccc43)C2)CC1=O	ZINC000875461180	GD	On-Demand	Anodyne	OXTR	51	36
CC(C)(C)N1C[C@H](CNC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1=O	ZINC000875461181	GD	On-Demand	Anodyne	OXTR	51	36
CC(C)(C)N1C[C@@H](CNC(=O)C(=O)N2CC[C@]3(CCc4ccccc43)C2)CC1=O	ZINC000875461182	GD	On-Demand	Anodyne	OXTR	51	36
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCC3SCCS3)C2)cc1	ZINC000875461238	GD	On-Demand	Anodyne	DRD4	31	49
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCC3SCCS3)C2)cc1	ZINC000875461238	GD	On-Demand	Anodyne	SIGMAR1	20	41
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCC3SCCS3)C2)cc1	ZINC000875461238	GD	On-Demand	Anodyne	CCR3	24	41
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCC3SCCS3)C2)cc1	ZINC000875461238	GD	On-Demand	Anodyne	CCR2	16	46
Cc1ccc(CN2CC[C@H](NC(=O)C(=O)NCCC3SCCS3)C2)cc1	ZINC000875461238	GD	On-Demand	Anodyne	MCHR1	32	45
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCC3SCCS3)C2)cc1	ZINC000875461239	GD	On-Demand	Anodyne	DRD4	31	49
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCC3SCCS3)C2)cc1	ZINC000875461239	GD	On-Demand	Anodyne	SIGMAR1	20	41
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCC3SCCS3)C2)cc1	ZINC000875461239	GD	On-Demand	Anodyne	CCR3	24	41
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCC3SCCS3)C2)cc1	ZINC000875461239	GD	On-Demand	Anodyne	CCR2	16	46
Cc1ccc(CN2CC[C@@H](NC(=O)C(=O)NCCC3SCCS3)C2)cc1	ZINC000875461239	GD	On-Demand	Anodyne	MCHR1	32	45
O=C(N[C@@H]1CCCOCC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875461265	DE	On-Demand	Anodyne	EPHX2	31	44
O=C(N[C@H]1CCCOCC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875461266	DE	On-Demand	Anodyne	EPHX2	31	44
O=C(N[C@@H]1CCCOCC1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875461268	DE	On-Demand	Anodyne	EPHX2	31	44
O=C(N[C@H]1CCCOCC1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875461270	DE	On-Demand	Anodyne	EPHX2	31	44
O=C(N[C@@H]1CCCOCC1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875461318	GF	On-Demand	Anodyne	C3AR1	41	39
O=C(N[C@@H]1CCCOCC1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875461318	GF	On-Demand	Anodyne	MAPK1	53	33
O=C(N[C@H]1CCCOCC1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875461320	GF	On-Demand	Anodyne	C3AR1	41	39
O=C(N[C@H]1CCCOCC1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875461320	GF	On-Demand	Anodyne	MAPK1	53	33
C=CCCC[C@H](C)NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875461371	DH	On-Demand	Mild	ACE	39	42
C=CCCC[C@H](C)NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875461372	DH	On-Demand	Mild	ACE	39	42
C=CCCC[C@H](C)NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875461373	DH	On-Demand	Mild	ACE	39	42
C=CCCC[C@H](C)NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875461374	DH	On-Demand	Mild	ACE	39	42
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCCOCC1	ZINC000875461375	FG	On-Demand	Reactive	LTA4H	37	45
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCCOCC1	ZINC000875461375	FG	On-Demand	Reactive	ADAM17	20	48
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCCOCC1	ZINC000875461375	FG	On-Demand	Reactive	SLC6A5	30	41
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCCOCC1	ZINC000875461375	FG	On-Demand	Reactive	EPHX2	32	44
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCCOCC1	ZINC000875461375	FG	On-Demand	Reactive	NAAA	18	43
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@H]1CCCOCC1	ZINC000875461375	FG	On-Demand	Reactive	FFAR1	27	42
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCCOCC1	ZINC000875461376	FG	On-Demand	Reactive	LTA4H	37	45
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCCOCC1	ZINC000875461376	FG	On-Demand	Reactive	ADAM17	20	48
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCCOCC1	ZINC000875461376	FG	On-Demand	Reactive	SLC6A5	30	41
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCCOCC1	ZINC000875461376	FG	On-Demand	Reactive	EPHX2	32	44
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCCOCC1	ZINC000875461376	FG	On-Demand	Reactive	NAAA	18	43
O=C(NNc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCCOCC1	ZINC000875461376	FG	On-Demand	Reactive	FFAR1	27	42
O=C(NCC(=O)N1CCOCC1)NNc1ccc(OCc2ccccc2)cc1	ZINC000875461412	GD	On-Demand	Reactive	MAOB	19	40
O=C(NCC(=O)N1CCOCC1)NNc1ccc(OCc2ccccc2)cc1	ZINC000875461412	GD	On-Demand	Reactive	LTA4H	27	44
O=C(NCC(=O)N1CCOCC1)NNc1ccc(OCc2ccccc2)cc1	ZINC000875461412	GD	On-Demand	Reactive	CTSS	26	41
O=C(NCC(=O)N1CCOCC1)NNc1ccc(OCc2ccccc2)cc1	ZINC000875461412	GD	On-Demand	Reactive	EPHX2	22	44
O=C(NCC(=O)N1CCOCC1)NNc1ccc(OCc2ccccc2)cc1	ZINC000875461412	GD	On-Demand	Reactive	TGM2	16	40
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(S(=O)(=O)CC)cc1	ZINC000875461515	ED	On-Demand	Anodyne	ANPEP	15	42
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(S(=O)(=O)CC)cc1	ZINC000875461515	ED	On-Demand	Anodyne	RORC	49	39
CC[C@@H](NC(=O)NCC(=O)N1CCOCC1)[C@H](O)c1ccccc1	ZINC000875461526	EC	On-Demand	Anodyne	CTSS	22	41
CC[C@@H](NC(=O)NCC(=O)N1CCOCC1)[C@@H](O)c1ccccc1	ZINC000875461529	EC	On-Demand	Anodyne	CTSS	22	41
O=C(N[C@H]1CCN(c2ccc(Cl)cc2)C1)N1CCC(CO)(CO)CC1	ZINC000875461580	FD	On-Demand	Anodyne	CACNA1H	49	34
O=C(N[C@@H]1CCN(c2ccc(Cl)cc2)C1)N1CCC(CO)(CO)CC1	ZINC000875461582	FD	On-Demand	Anodyne	CACNA1H	49	34
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)CN(C)Cc1ccccc1	ZINC000875461616	FE	On-Demand	Anodyne	SLC6A4	24	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)CN(C)Cc1ccccc1	ZINC000875461616	FE	On-Demand	Anodyne	SLC6A3	55	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)CN(C)Cc1ccccc1	ZINC000875461618	FE	On-Demand	Anodyne	SLC6A4	24	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)CN(C)Cc1ccccc1	ZINC000875461618	FE	On-Demand	Anodyne	SLC6A3	55	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)CN(C)Cc1ccccc1	ZINC000875461620	FE	On-Demand	Anodyne	SLC6A4	24	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)CN(C)Cc1ccccc1	ZINC000875461620	FE	On-Demand	Anodyne	SLC6A3	55	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)CN(C)Cc1ccccc1	ZINC000875461622	FE	On-Demand	Anodyne	SLC6A4	24	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)CN(C)Cc1ccccc1	ZINC000875461622	FE	On-Demand	Anodyne	SLC6A3	55	44
O=C(NCc1ccc(O)c(Cl)c1)N[C@@H]1CCCOCC1	ZINC000875461657	CE	On-Demand	Anodyne	EPHX2	19	44
O=C(NCc1ccc(O)c(Cl)c1)N[C@@H]1CCCOCC1	ZINC000875461657	CE	On-Demand	Anodyne	NCE103	16	43
O=C(NCc1ccc(O)c(Cl)c1)N[C@H]1CCCOCC1	ZINC000875461658	CE	On-Demand	Anodyne	EPHX2	19	44
O=C(NCc1ccc(O)c(Cl)c1)N[C@H]1CCCOCC1	ZINC000875461658	CE	On-Demand	Anodyne	NCE103	16	43
O=C(N[C@H]1CCCOCC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875461663	DG	On-Demand	Anodyne	EPHX2	26	42
O=C(N[C@@H]1CCCOCC1)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875461665	DG	On-Demand	Anodyne	EPHX2	26	42
COCCN(CC1CCN(C)CC1)C(=O)N[C@H]1CCCOc2cc(F)ccc21	ZINC000875461742	GG	On-Demand	Anodyne	ACKR3	46	32
COCCN(CC1CCN(C)CC1)C(=O)N[C@@H]1CCCOc2cc(F)ccc21	ZINC000875461743	GG	On-Demand	Anodyne	ACKR3	46	32
C[C@H](NC(=O)C(=O)NCCC1SCCS1)c1ccc(C(F)(F)F)nc1	ZINC000875461750	GF	On-Demand	Anodyne	TRPV1	68	33
O=C(CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1)N1CCOCC1	ZINC000875461764	FD	On-Demand	Anodyne	CPT1A	62	40
O=C(CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1)N1CCOCC1	ZINC000875461764	FD	On-Demand	Anodyne	CPT2	44	35
O=C(CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1)N1CCOCC1	ZINC000875461764	FD	On-Demand	Anodyne	PREP	43	37
O=C(CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1)N1CCOCC1	ZINC000875461764	FD	On-Demand	Anodyne	CTSS	28	42
O=C(CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1)N1CCOCC1	ZINC000875461765	FD	On-Demand	Anodyne	CPT1A	62	40
O=C(CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1)N1CCOCC1	ZINC000875461765	FD	On-Demand	Anodyne	CPT2	44	35
O=C(CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1)N1CCOCC1	ZINC000875461765	FD	On-Demand	Anodyne	PREP	43	37
O=C(CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1)N1CCOCC1	ZINC000875461765	FD	On-Demand	Anodyne	CTSS	28	42
O=C(CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1)N1CCOCC1	ZINC000875461766	FD	On-Demand	Anodyne	CPT1A	62	40
O=C(CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1)N1CCOCC1	ZINC000875461766	FD	On-Demand	Anodyne	CPT2	44	35
O=C(CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1)N1CCOCC1	ZINC000875461766	FD	On-Demand	Anodyne	PREP	43	37
O=C(CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1)N1CCOCC1	ZINC000875461766	FD	On-Demand	Anodyne	CTSS	28	42
O=C(CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1)N1CCOCC1	ZINC000875461767	FD	On-Demand	Anodyne	CPT1A	62	40
O=C(CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1)N1CCOCC1	ZINC000875461767	FD	On-Demand	Anodyne	CPT2	44	35
O=C(CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1)N1CCOCC1	ZINC000875461767	FD	On-Demand	Anodyne	PREP	43	37
O=C(CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1)N1CCOCC1	ZINC000875461767	FD	On-Demand	Anodyne	CTSS	28	42
O=C(CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)N1CCOCC1	ZINC000875461768	EC	On-Demand	Anodyne	PREP	50	39
O=C(CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)N1CCOCC1	ZINC000875461768	EC	On-Demand	Anodyne	CTSS	22	41
O=C(CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)N1CCOCC1	ZINC000875461769	EC	On-Demand	Anodyne	PREP	50	39
O=C(CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)N1CCOCC1	ZINC000875461769	EC	On-Demand	Anodyne	CTSS	22	41
O=C(CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)N1CCOCC1	ZINC000875461770	EC	On-Demand	Anodyne	PREP	50	39
O=C(CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)N1CCOCC1	ZINC000875461770	EC	On-Demand	Anodyne	CTSS	22	41
O=C(CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)N1CCOCC1	ZINC000875461771	EC	On-Demand	Anodyne	PREP	50	39
O=C(CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)N1CCOCC1	ZINC000875461771	EC	On-Demand	Anodyne	CTSS	22	41
CO[C@@H](c1ccccc1F)[C@H](C)NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875461836	GG	On-Demand	Anodyne	CACNA1H	44	34
CO[C@@H](c1ccccc1F)[C@@H](C)NC(=O)N1CCC2(CCN(C)CC2)CC1	ZINC000875461837	GG	On-Demand	Anodyne	CACNA1H	44	34
COC(=O)N(C)NC(=O)NCCOCc1ccc(Cl)cc1Cl	ZINC000875461842	FE	On-Demand	Reactive	ALPL	31	43
COc1cccc([C@H](O)C2CCN(C(=O)N[C@@H]3CCCOCC3)CC2)c1	ZINC000875461864	FF	On-Demand	Anodyne	C3AR1	36	40
COc1cccc([C@H](O)C2CCN(C(=O)N[C@@H]3CCCOCC3)CC2)c1	ZINC000875461864	FF	On-Demand	Anodyne	EPHX2	15	41
COc1cccc([C@H](O)C2CCN(C(=O)N[C@H]3CCCOCC3)CC2)c1	ZINC000875461866	FF	On-Demand	Anodyne	C3AR1	36	40
COc1cccc([C@H](O)C2CCN(C(=O)N[C@H]3CCCOCC3)CC2)c1	ZINC000875461866	FF	On-Demand	Anodyne	EPHX2	15	41
O=C(NCCO)C1CCN(C(=O)N[C@H]2CCN(c3ccc(Cl)cc3)C2)CC1	ZINC000875461907	GD	On-Demand	Anodyne	EPHX2	19	44
O=C(NCCO)C1CCN(C(=O)N[C@@H]2CCN(c3ccc(Cl)cc3)C2)CC1	ZINC000875461908	GD	On-Demand	Anodyne	EPHX2	19	44
O=C(NCCOCc1ccc(Cl)cc1Cl)N1CCC(CO)(CO)CC1	ZINC000875461918	GE	On-Demand	Anodyne	EPHX2	19	54
CCCCCCCNC(=O)C(=O)NCCC1SCCS1	ZINC000875462005	DE	On-Demand	Mild	EPHX2	19	43
CCCCCCCNC(=O)C(=O)NCCC1SCCS1	ZINC000875462005	DE	On-Demand	Mild	ASAH1	74	32
CC(C)(C)N1C[C@H](CNC(=O)C(=O)NCc2cccc3ncccc23)CC1=O	ZINC000875462073	GD	On-Demand	Anodyne	P2RX7	42	36
CC(C)(C)N1C[C@@H](CNC(=O)C(=O)NCc2cccc3ncccc23)CC1=O	ZINC000875462074	GD	On-Demand	Anodyne	P2RX7	42	36
COCC1(NC(=O)c2cnn(-c3cccc(F)c3)c2C(F)(F)F)CC1	ZINC000875462100	FF	On-Demand	Anodyne	MST1R	40	39
C[C@H](NC(=O)C(=O)NCc1cc(F)ccc1OC(F)F)c1ccnn1C	ZINC000875462209	FD	On-Demand	Anodyne	P2RX7	20	40
O=C(N[C@H]1CCCOCC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875462232	EF	On-Demand	Anodyne	SMO	39	50
O=C(N[C@H]1CCCOCC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875462232	EF	On-Demand	Anodyne	ETHR	63	52
O=C(N[C@@H]1CCCOCC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875462233	EF	On-Demand	Anodyne	SMO	39	50
O=C(N[C@@H]1CCCOCC1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875462233	EF	On-Demand	Anodyne	ETHR	63	52
COc1ccc(N2CCN(C(=O)N[C@H]3CCCOCC3)CC2)c(OC)c1	ZINC000875462263	FE	On-Demand	Clean	HTR1A	25	40
COc1ccc(N2CCN(C(=O)N[C@H]3CCCOCC3)CC2)c(OC)c1	ZINC000875462263	FE	On-Demand	Clean	DRD2	21	43
COc1ccc(N2CCN(C(=O)N[C@H]3CCCOCC3)CC2)c(OC)c1	ZINC000875462263	FE	On-Demand	Clean	ADRA1D	22	43
COc1ccc(N2CCN(C(=O)N[C@H]3CCCOCC3)CC2)c(OC)c1	ZINC000875462263	FE	On-Demand	Clean	HTR1B	15	40
COc1ccc(N2CCN(C(=O)N[C@H]3CCCOCC3)CC2)c(OC)c1	ZINC000875462263	FE	On-Demand	Clean	ADRA1A	20	43
COc1ccc(N2CCN(C(=O)N[C@H]3CCCOCC3)CC2)c(OC)c1	ZINC000875462263	FE	On-Demand	Clean	PDGFRB	41	41
COc1ccc(N2CCN(C(=O)N[C@H]3CCCOCC3)CC2)c(OC)c1	ZINC000875462263	FE	On-Demand	Clean	HTR7	25	40
COc1ccc(N2CCN(C(=O)N[C@H]3CCCOCC3)CC2)c(OC)c1	ZINC000875462263	FE	On-Demand	Clean	MTNR1B	15	42
COc1ccc(N2CCN(C(=O)N[C@@H]3CCCOCC3)CC2)c(OC)c1	ZINC000875462265	FE	On-Demand	Clean	HTR1A	25	40
COc1ccc(N2CCN(C(=O)N[C@@H]3CCCOCC3)CC2)c(OC)c1	ZINC000875462265	FE	On-Demand	Clean	DRD2	21	43
COc1ccc(N2CCN(C(=O)N[C@@H]3CCCOCC3)CC2)c(OC)c1	ZINC000875462265	FE	On-Demand	Clean	ADRA1D	22	43
COc1ccc(N2CCN(C(=O)N[C@@H]3CCCOCC3)CC2)c(OC)c1	ZINC000875462265	FE	On-Demand	Clean	HTR1B	15	40
COc1ccc(N2CCN(C(=O)N[C@@H]3CCCOCC3)CC2)c(OC)c1	ZINC000875462265	FE	On-Demand	Clean	ADRA1A	20	43
COc1ccc(N2CCN(C(=O)N[C@@H]3CCCOCC3)CC2)c(OC)c1	ZINC000875462265	FE	On-Demand	Clean	PDGFRB	41	41
COc1ccc(N2CCN(C(=O)N[C@@H]3CCCOCC3)CC2)c(OC)c1	ZINC000875462265	FE	On-Demand	Clean	HTR7	25	40
COc1ccc(N2CCN(C(=O)N[C@@H]3CCCOCC3)CC2)c(OC)c1	ZINC000875462265	FE	On-Demand	Clean	MTNR1B	15	42
O=C(NCC(=O)N1CCOCC1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875462301	FC	On-Demand	Anodyne	EPHX2	16	40
O=C(NCC(=O)N1CCOCC1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875462302	FC	On-Demand	Anodyne	EPHX2	16	40
CC[C@@H]1COCCN1CCNC(=O)NCc1ccc(S(=O)(=O)CC)cc1	ZINC000875462321	GD	On-Demand	Anodyne	NAMPT	40	36
CCC1(CC)CCCN1C(=O)NCc1ccc(S(=O)(=O)CC)cc1	ZINC000875462430	FG	On-Demand	Anodyne	SLC12A5	42	36
CCC1(CC)CCCN1C(=O)NCc1ccc(S(=O)(=O)CC)cc1	ZINC000875462430	FG	On-Demand	Anodyne	NAMPT	68	41
O=CN1CCCN(C(=O)NCCOCc2ccc(Cl)cc2Cl)CC1	ZINC000875462439	FE	On-Demand	Anodyne	EPHX2	17	49
O=C(N[C@@H]1CCCOCC1)N1CCC[C@@](F)(c2ccccc2)C1	ZINC000875462440	DG	On-Demand	Anodyne	EPHX2	33	43
O=C(N[C@H]1CCCOCC1)N1CCC[C@](F)(c2ccccc2)C1	ZINC000875462441	DG	On-Demand	Anodyne	EPHX2	33	43
O=C(N[C@@H]1CCCOCC1)N1CCC[C@](F)(c2ccccc2)C1	ZINC000875462442	DG	On-Demand	Anodyne	EPHX2	33	43
O=C(N[C@H]1CCCOCC1)N1CCC[C@@](F)(c2ccccc2)C1	ZINC000875462443	DG	On-Demand	Anodyne	EPHX2	33	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)CN(C)Cc2ccccc2)C1	ZINC000875462474	FE	On-Demand	Anodyne	ACE	31	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)CN(C)Cc2ccccc2)C1	ZINC000875462474	FE	On-Demand	Anodyne	Q6PRC7_IXORI	53	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)CN(C)Cc2ccccc2)C1	ZINC000875462475	FE	On-Demand	Anodyne	ACE	31	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)CN(C)Cc2ccccc2)C1	ZINC000875462475	FE	On-Demand	Anodyne	Q6PRC7_IXORI	53	36
CCCCCCCNC(=O)C(=O)NCC1=CCCC1	ZINC000875462498	CE	On-Demand	Mild	ASAH1	92	35
O=C(NCC1=CCCC1)C(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875462514	FE	On-Demand	Anodyne	ETHR	57	48
CC(=O)C1CCN(C(=O)N[C@@H]2CCCOCC2)CC1	ZINC000875462526	CD	On-Demand	Anodyne	EPHX2	16	43
CC(=O)C1CCN(C(=O)N[C@H]2CCCOCC2)CC1	ZINC000875462528	CD	On-Demand	Anodyne	EPHX2	16	43
CO[C@@H](c1ccccc1F)[C@@H](C)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875462602	FD	On-Demand	Anodyne	CACNA1H	41	35
CO[C@@H](c1ccccc1F)[C@H](C)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875462604	FD	On-Demand	Anodyne	CACNA1H	41	35
O=C(NC[C@H]1C[C@H](O)C1)N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O	ZINC000875462666	GE	On-Demand	Anodyne	CCR2	46	39
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O	ZINC000875462667	GE	On-Demand	Anodyne	CCR2	46	39
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccc(S(=O)(=O)CC)cc2)C1	ZINC000875462677	GD	On-Demand	Anodyne	NAMPT	31	41
O=C(NCC(=O)N1CCOCC1)NC1CC(Nc2ccccc2)C1	ZINC000875462679	EC	On-Demand	Anodyne	ITGAL	42	33
O=C(NCC(=O)N1CCOCC1)NC1CC(Nc2ccccc2)C1	ZINC000875462679	EC	On-Demand	Anodyne	EPHX2	28	43
CCCCCCCNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1	ZINC000875462680	GE	On-Demand	Mild	SPHK1	22	44
CCCCCCCNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1	ZINC000875462680	GE	On-Demand	Mild	AXL	25	40
CCCCCCCNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1	ZINC000875462680	GE	On-Demand	Mild	TYRO3	24	40
CCCCCCCNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1	ZINC000875462680	GE	On-Demand	Mild	MERTK	42	40
CCCCCCCNC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1	ZINC000875462680	GE	On-Demand	Mild	ASAH1	89	38
O=C(N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1=O)N1CCC(CO)(CO)CC1	ZINC000875462684	GD	On-Demand	Anodyne	CACNA1H	59	39
O=C(N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1=O)N1CCC(CO)(CO)CC1	ZINC000875462685	GD	On-Demand	Anodyne	CACNA1H	59	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)[C@H](OC)c1ccccc1F	ZINC000875462835	FF	On-Demand	Anodyne	SLC6A3	42	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)[C@@H](OC)c1ccccc1F	ZINC000875462836	FF	On-Demand	Anodyne	SLC6A3	42	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)[C@@H](OC)c1ccccc1F	ZINC000875462837	FF	On-Demand	Anodyne	SLC6A3	42	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)[C@H](OC)c1ccccc1F	ZINC000875462838	FF	On-Demand	Anodyne	SLC6A3	42	39
CCCCCCCNC(=O)C(=O)N[C@@H]1C[C@@H](N2CCOCC2)C12CCC2	ZINC000875462883	FD	On-Demand	Mild	ASAH1	57	41
CN(C)c1nccc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)n1	ZINC000875462904	EE	On-Demand	Anodyne	EPHX2	18	41
CN(C)c1nccc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)n1	ZINC000875462905	EE	On-Demand	Anodyne	EPHX2	18	41
COc1ccc(N2CCN(C(=O)C(=O)NCC3=CCCC3)CC2)c(OC)c1	ZINC000875462932	FD	On-Demand	Clean	DRD2	25	41
COc1ccc(N2CCN(C(=O)C(=O)NCC3=CCCC3)CC2)c(OC)c1	ZINC000875462932	FD	On-Demand	Clean	DRD4	43	34
O=C(N[C@H]1CCCOCC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875463026	DF	On-Demand	Anodyne	MLNR	15	41
O=C(N[C@H]1CCCOCC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875463026	DF	On-Demand	Anodyne	EPHX2	45	51
O=C(N[C@@H]1CCCOCC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875463027	DF	On-Demand	Anodyne	MLNR	15	41
O=C(N[C@@H]1CCCOCC1)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875463027	DF	On-Demand	Anodyne	EPHX2	45	51
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)N[C@@H]1CCCOCC1	ZINC000875463077	EE	On-Demand	Anodyne	EPHX2	19	49
O=C(NC[C@@H](O)Cc1cccc(Cl)c1)N[C@H]1CCCOCC1	ZINC000875463078	EE	On-Demand	Anodyne	EPHX2	19	49
O=C(NC[C@H](O)Cc1cccc(Cl)c1)N[C@@H]1CCCOCC1	ZINC000875463079	EE	On-Demand	Anodyne	EPHX2	19	49
O=C(NC[C@H](O)Cc1cccc(Cl)c1)N[C@H]1CCCOCC1	ZINC000875463080	EE	On-Demand	Anodyne	EPHX2	19	49
O=C(N[C@@H]1CCCOCC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875463144	ED	On-Demand	Anodyne	SMO	36	46
O=C(N[C@@H]1CCCOCC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875463144	ED	On-Demand	Anodyne	ETHR	49	39
O=C(N[C@@H]1CCCOCC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875463145	ED	On-Demand	Anodyne	SMO	36	46
O=C(N[C@@H]1CCCOCC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875463145	ED	On-Demand	Anodyne	ETHR	49	39
O=C(N[C@H]1CCCOCC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875463146	ED	On-Demand	Anodyne	SMO	36	46
O=C(N[C@H]1CCCOCC1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875463146	ED	On-Demand	Anodyne	ETHR	49	39
O=C(N[C@H]1CCCOCC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875463147	ED	On-Demand	Anodyne	SMO	36	46
O=C(N[C@H]1CCCOCC1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875463147	ED	On-Demand	Anodyne	ETHR	49	39
O=C(N[C@@H](Cc1cccnc1)C1CCCC1)N[C@@H]1CCCOCC1	ZINC000875463158	EG	On-Demand	Anodyne	C3AR1	48	47
O=C(N[C@@H]1CCCOCC1)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875463159	EG	On-Demand	Anodyne	C3AR1	48	47
O=C(N[C@H]1CCCOCC1)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875463160	EG	On-Demand	Anodyne	C3AR1	48	47
O=C(N[C@H]1CCCOCC1)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875463161	EG	On-Demand	Anodyne	C3AR1	48	47
COCC1(NC(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463178	EF	On-Demand	Anodyne	ELANE	32	40
COCC1(NC(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463178	EF	On-Demand	Anodyne	CTRA_BOVIN	48	32
COCC1(NC(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463178	EF	On-Demand	Anodyne	CASP3	19	41
COCC1(NC(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463178	EF	On-Demand	Anodyne	KLK3	77	37
COCC1(NC(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463178	EF	On-Demand	Anodyne	CTSB	75	43
COCC1(NC(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463178	EF	On-Demand	Anodyne	PAPA1_CARPA	78	40
COCC1(NC(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463178	EF	On-Demand	Anodyne	CYSP_TRYCR	57	42
COCC1(NC(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463178	EF	On-Demand	Anodyne	CTSK	49	47
COCC1(NC(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463178	EF	On-Demand	Anodyne	CTSL	49	44
COCC1(NC(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463178	EF	On-Demand	Anodyne	PGA	34	40
COCC1(NC(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463178	EF	On-Demand	Anodyne	CAPNS1	69	41
COCC1(NC(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463178	EF	On-Demand	Anodyne	CELA2A	48	32
COCC1(NC(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463178	EF	On-Demand	Anodyne	CTSS	27	47
COCC1(NC(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463178	EF	On-Demand	Anodyne	CAPN1	88	54
COCC1(NC(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463178	EF	On-Demand	Anodyne	CASP1	24	41
COCC1(NC(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463178	EF	On-Demand	Anodyne	CAPN2	131	42
COCC1(NC(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463178	EF	On-Demand	Anodyne	CASP9	29	41
COCC1(NC(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463178	EF	On-Demand	Anodyne	NPR	77	42
COCC1(NC(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463178	EF	On-Demand	Anodyne	CASP10	34	41
COCC1(NC(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463178	EF	On-Demand	Anodyne	PSMB5	49	40
COCC1(NC(=O)[C@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463178	EF	On-Demand	Anodyne	SLC12A5	60	38
COCC1(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463179	EF	On-Demand	Anodyne	ELANE	32	40
COCC1(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463179	EF	On-Demand	Anodyne	CTRA_BOVIN	48	32
COCC1(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463179	EF	On-Demand	Anodyne	CASP3	19	41
COCC1(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463179	EF	On-Demand	Anodyne	KLK3	77	37
COCC1(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463179	EF	On-Demand	Anodyne	CTSB	75	43
COCC1(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463179	EF	On-Demand	Anodyne	PAPA1_CARPA	78	40
COCC1(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463179	EF	On-Demand	Anodyne	CYSP_TRYCR	57	42
COCC1(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463179	EF	On-Demand	Anodyne	CTSK	49	47
COCC1(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463179	EF	On-Demand	Anodyne	CTSL	49	44
COCC1(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463179	EF	On-Demand	Anodyne	PGA	34	40
COCC1(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463179	EF	On-Demand	Anodyne	CAPNS1	69	41
COCC1(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463179	EF	On-Demand	Anodyne	CELA2A	48	32
COCC1(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463179	EF	On-Demand	Anodyne	CTSS	27	47
COCC1(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463179	EF	On-Demand	Anodyne	CAPN1	88	54
COCC1(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463179	EF	On-Demand	Anodyne	CASP1	24	41
COCC1(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463179	EF	On-Demand	Anodyne	CAPN2	131	42
COCC1(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463179	EF	On-Demand	Anodyne	CASP9	29	41
COCC1(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463179	EF	On-Demand	Anodyne	NPR	77	42
COCC1(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463179	EF	On-Demand	Anodyne	CASP10	34	41
COCC1(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463179	EF	On-Demand	Anodyne	PSMB5	49	40
COCC1(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)(C)C)CC1	ZINC000875463179	EF	On-Demand	Anodyne	SLC12A5	60	38
COCC1(NC(=O)[C@@H]2C[C@@H](OC)CN2C(=O)OCc2ccccc2)CC1	ZINC000875463197	FD	On-Demand	Anodyne	CTRA_BOVIN	41	31
COCC1(NC(=O)[C@@H]2C[C@@H](OC)CN2C(=O)OCc2ccccc2)CC1	ZINC000875463197	FD	On-Demand	Anodyne	PREP	25	40
COCC1(NC(=O)[C@@H]2C[C@@H](OC)CN2C(=O)OCc2ccccc2)CC1	ZINC000875463197	FD	On-Demand	Anodyne	CELA2A	40	31
COCC1(NC(=O)[C@@H]2C[C@@H](OC)CN2C(=O)OCc2ccccc2)CC1	ZINC000875463197	FD	On-Demand	Anodyne	LGMN	72	41
COCC1(NC(=O)[C@@H]2C[C@@H](OC)CN2C(=O)OCc2ccccc2)CC1	ZINC000875463197	FD	On-Demand	Anodyne	SLC12A5	64	38
COCC1(NC(=O)[C@@H]2C[C@@H](OC)CN2C(=O)OCc2ccccc2)CC1	ZINC000875463197	FD	On-Demand	Anodyne	Q9NAW4_PLAFA	41	48
COCC1(NC(=O)[C@H]2C[C@@H](OC)CN2C(=O)OCc2ccccc2)CC1	ZINC000875463198	FD	On-Demand	Anodyne	CTRA_BOVIN	41	31
COCC1(NC(=O)[C@H]2C[C@@H](OC)CN2C(=O)OCc2ccccc2)CC1	ZINC000875463198	FD	On-Demand	Anodyne	PREP	25	40
COCC1(NC(=O)[C@H]2C[C@@H](OC)CN2C(=O)OCc2ccccc2)CC1	ZINC000875463198	FD	On-Demand	Anodyne	CELA2A	40	31
COCC1(NC(=O)[C@H]2C[C@@H](OC)CN2C(=O)OCc2ccccc2)CC1	ZINC000875463198	FD	On-Demand	Anodyne	LGMN	72	41
COCC1(NC(=O)[C@H]2C[C@@H](OC)CN2C(=O)OCc2ccccc2)CC1	ZINC000875463198	FD	On-Demand	Anodyne	SLC12A5	64	38
COCC1(NC(=O)[C@H]2C[C@@H](OC)CN2C(=O)OCc2ccccc2)CC1	ZINC000875463198	FD	On-Demand	Anodyne	Q9NAW4_PLAFA	41	48
COc1ccccc1[C@H]1CCCN(C(=O)N[C@@H]2CCCOCC2)CC1	ZINC000875463270	EH	On-Demand	Anodyne	EPHX2	25	40
COc1ccccc1[C@H]1CCCN(C(=O)N[C@@H]2CCCOCC2)CC1	ZINC000875463270	EH	On-Demand	Anodyne	RBP4	32	40
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CCCOCC2)CC1	ZINC000875463271	EH	On-Demand	Anodyne	EPHX2	25	40
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CCCOCC2)CC1	ZINC000875463271	EH	On-Demand	Anodyne	RBP4	32	40
COc1ccccc1[C@H]1CCCN(C(=O)N[C@H]2CCCOCC2)CC1	ZINC000875463272	EH	On-Demand	Anodyne	EPHX2	25	40
COc1ccccc1[C@H]1CCCN(C(=O)N[C@H]2CCCOCC2)CC1	ZINC000875463272	EH	On-Demand	Anodyne	RBP4	32	40
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2CCCOCC2)CC1	ZINC000875463273	EH	On-Demand	Anodyne	EPHX2	25	40
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2CCCOCC2)CC1	ZINC000875463273	EH	On-Demand	Anodyne	RBP4	32	40
C[C@H](NC(=O)C(=O)NCC1=CCCC1)c1ccc(C(F)(F)F)nc1	ZINC000875463462	EF	On-Demand	Anodyne	TRPV1	56	35
O=C(N[C@H]1CCCOCC1)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875463628	EE	On-Demand	Anodyne	CCR3	15	42
O=C(N[C@@H]1CCCOCC1)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875463629	EE	On-Demand	Anodyne	CCR3	15	42
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCCOCC3)cn2)cc1	ZINC000875463654	EE	On-Demand	Mild	ITK	17	48
N#Cc1ccc(Cn2cc(NC(=O)N[C@H]3CCCOCC3)cn2)cc1	ZINC000875463654	EE	On-Demand	Mild	PANC	54	38
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCCOCC3)cn2)cc1	ZINC000875463655	EE	On-Demand	Mild	ITK	17	48
N#Cc1ccc(Cn2cc(NC(=O)N[C@@H]3CCCOCC3)cn2)cc1	ZINC000875463655	EE	On-Demand	Mild	PANC	54	38
O=C(NC1CC(Nc2ccccc2)C1)N[C@H]1CCCOCC1	ZINC000875463729	DE	On-Demand	Anodyne	EPHX2	23	50
O=C(NC1CC(Nc2ccccc2)C1)N[C@@H]1CCCOCC1	ZINC000875463730	DE	On-Demand	Anodyne	EPHX2	23	50
O=C(N[C@H]1CCCOCC1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875463732	DF	On-Demand	Anodyne	OXTR	45	35
O=C(N[C@H]1CCCOCC1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875463733	DF	On-Demand	Anodyne	OXTR	45	35
O=C(N[C@@H]1CCCOCC1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875463734	DF	On-Demand	Anodyne	OXTR	45	35
O=C(N[C@H]1CCCOCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875463735	EE	On-Demand	Anodyne	DRD4	21	42
O=C(N[C@H]1CCCOCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875463735	EE	On-Demand	Anodyne	ACHE	15	41
O=C(N[C@H]1CCCOCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875463735	EE	On-Demand	Anodyne	SIGMAR1	32	46
O=C(N[C@H]1CCCOCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875463735	EE	On-Demand	Anodyne	CCR3	15	47
O=C(N[C@H]1CCCOCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875463735	EE	On-Demand	Anodyne	EPHX2	19	40
O=C(N[C@@H]1CCCOCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875463736	EE	On-Demand	Anodyne	DRD4	21	42
O=C(N[C@@H]1CCCOCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875463736	EE	On-Demand	Anodyne	ACHE	15	41
O=C(N[C@@H]1CCCOCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875463736	EE	On-Demand	Anodyne	SIGMAR1	32	46
O=C(N[C@@H]1CCCOCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875463736	EE	On-Demand	Anodyne	CCR3	15	47
O=C(N[C@@H]1CCCOCC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875463736	EE	On-Demand	Anodyne	EPHX2	19	40
O=C(NC1CCN(C(=O)N[C@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463884	GF	On-Demand	Anodyne	DRD4	15	40
O=C(NC1CCN(C(=O)N[C@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463884	GF	On-Demand	Anodyne	GRIN2B	36	42
O=C(NC1CCN(C(=O)N[C@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463884	GF	On-Demand	Anodyne	CNR2	15	44
O=C(NC1CCN(C(=O)N[C@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463884	GF	On-Demand	Anodyne	SIGMAR1	17	41
O=C(NC1CCN(C(=O)N[C@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463884	GF	On-Demand	Anodyne	CTSB	26	54
O=C(NC1CCN(C(=O)N[C@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463884	GF	On-Demand	Anodyne	CTSK	27	54
O=C(NC1CCN(C(=O)N[C@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463884	GF	On-Demand	Anodyne	CCR3	18	43
O=C(NC1CCN(C(=O)N[C@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463884	GF	On-Demand	Anodyne	C3AR1	42	41
O=C(NC1CCN(C(=O)N[C@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463884	GF	On-Demand	Anodyne	PREP	43	42
O=C(NC1CCN(C(=O)N[C@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463884	GF	On-Demand	Anodyne	FAAH	28	40
O=C(NC1CCN(C(=O)N[C@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463884	GF	On-Demand	Anodyne	TGM1	23	41
O=C(NC1CCN(C(=O)N[C@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463884	GF	On-Demand	Anodyne	CAPN2	46	37
O=C(NC1CCN(C(=O)N[C@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463884	GF	On-Demand	Anodyne	EPHX2	57	42
O=C(NC1CCN(C(=O)N[C@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463884	GF	On-Demand	Anodyne	TGM2	40	46
O=C(NC1CCN(C(=O)N[C@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463884	GF	On-Demand	Anodyne	KLK5	40	38
O=C(NC1CCN(C(=O)N[C@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463884	GF	On-Demand	Anodyne	F13A1	26	46
O=C(NC1CCN(C(=O)N[C@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463884	GF	On-Demand	Anodyne	NAAA	54	47
O=C(NC1CCN(C(=O)N[C@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463884	GF	On-Demand	Anodyne	BIRC2	18	41
O=C(NC1CCN(C(=O)N[C@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463884	GF	On-Demand	Anodyne	SLC12A5	58	35
O=C(NC1CCN(C(=O)N[C@@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463885	GF	On-Demand	Anodyne	DRD4	15	40
O=C(NC1CCN(C(=O)N[C@@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463885	GF	On-Demand	Anodyne	GRIN2B	36	42
O=C(NC1CCN(C(=O)N[C@@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463885	GF	On-Demand	Anodyne	CNR2	15	44
O=C(NC1CCN(C(=O)N[C@@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463885	GF	On-Demand	Anodyne	SIGMAR1	17	41
O=C(NC1CCN(C(=O)N[C@@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463885	GF	On-Demand	Anodyne	CTSB	26	54
O=C(NC1CCN(C(=O)N[C@@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463885	GF	On-Demand	Anodyne	CTSK	27	54
O=C(NC1CCN(C(=O)N[C@@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463885	GF	On-Demand	Anodyne	CCR3	18	43
O=C(NC1CCN(C(=O)N[C@@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463885	GF	On-Demand	Anodyne	C3AR1	42	41
O=C(NC1CCN(C(=O)N[C@@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463885	GF	On-Demand	Anodyne	PREP	43	42
O=C(NC1CCN(C(=O)N[C@@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463885	GF	On-Demand	Anodyne	FAAH	28	40
O=C(NC1CCN(C(=O)N[C@@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463885	GF	On-Demand	Anodyne	TGM1	23	41
O=C(NC1CCN(C(=O)N[C@@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463885	GF	On-Demand	Anodyne	CAPN2	46	37
O=C(NC1CCN(C(=O)N[C@@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463885	GF	On-Demand	Anodyne	EPHX2	57	42
O=C(NC1CCN(C(=O)N[C@@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463885	GF	On-Demand	Anodyne	TGM2	40	46
O=C(NC1CCN(C(=O)N[C@@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463885	GF	On-Demand	Anodyne	KLK5	40	38
O=C(NC1CCN(C(=O)N[C@@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463885	GF	On-Demand	Anodyne	F13A1	26	46
O=C(NC1CCN(C(=O)N[C@@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463885	GF	On-Demand	Anodyne	NAAA	54	47
O=C(NC1CCN(C(=O)N[C@@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463885	GF	On-Demand	Anodyne	BIRC2	18	41
O=C(NC1CCN(C(=O)N[C@@H]2CCCOCC2)CC1)OCc1ccccc1	ZINC000875463885	GF	On-Demand	Anodyne	SLC12A5	58	35
CN1CCC(CNC(=O)N[C@@H]2CCCOCC2)(c2ccccc2)CC1	ZINC000875463922	EF	On-Demand	Anodyne	KCNA3	52	44
CN1CCC(CNC(=O)N[C@@H]2CCCOCC2)(c2ccccc2)CC1	ZINC000875463922	EF	On-Demand	Anodyne	SOAT1	16	47
CN1CCC(CNC(=O)N[C@@H]2CCCOCC2)(c2ccccc2)CC1	ZINC000875463922	EF	On-Demand	Anodyne	EPHX2	33	40
CN1CCC(CNC(=O)N[C@H]2CCCOCC2)(c2ccccc2)CC1	ZINC000875463923	EF	On-Demand	Anodyne	KCNA3	52	44
CN1CCC(CNC(=O)N[C@H]2CCCOCC2)(c2ccccc2)CC1	ZINC000875463923	EF	On-Demand	Anodyne	SOAT1	16	47
CN1CCC(CNC(=O)N[C@H]2CCCOCC2)(c2ccccc2)CC1	ZINC000875463923	EF	On-Demand	Anodyne	EPHX2	33	40
N#Cc1cc(F)ccc1N1CCN(C(=O)N[C@H]2CCCOCC2)CC1	ZINC000875463924	EE	On-Demand	Mild	SLC6A9	21	41
N#Cc1cc(F)ccc1N1CCN(C(=O)N[C@@H]2CCCOCC2)CC1	ZINC000875463925	EE	On-Demand	Mild	SLC6A9	21	41
O=C(CNC(=O)N1CCC[C@](O)(c2ccccc2)C1)N1CCOCC1	ZINC000875463968	EC	On-Demand	Anodyne	EPHX2	15	52
O=C(CNC(=O)N1CCC[C@@](O)(c2ccccc2)C1)N1CCOCC1	ZINC000875463969	EC	On-Demand	Anodyne	EPHX2	15	52
CCO[C@@H](C(=O)N(c1ccccn1)C1CCCC1)C1CCOCC1	ZINC000875464001	EG	On-Demand	Anodyne	AMY2	43	30
CCO[C@H](C(=O)N(c1ccccn1)C1CCCC1)C1CCOCC1	ZINC000875464002	EG	On-Demand	Anodyne	AMY2	43	30
CO[C@H](C(=O)OC(C)(C)C)C(=O)N(c1ccccn1)C1CCCC1	ZINC000875464003	EF	On-Demand	Anodyne	AMY2	46	31
CC(C)(C)C(=O)NCC(=O)OCCC(=O)N(c1ccccn1)C1CCCC1	ZINC000875464042	GE	On-Demand	Anodyne	AMY2	45	31
C[C@@H](CC(=O)N(c1ccccn1)C1CCCC1)NC(=O)OC(C)(C)C	ZINC000875464055	EH	On-Demand	Anodyne	AMY2	43	30
C[C@@H](CC(=O)N(c1ccccn1)C1CCCC1)NC(=O)OC(C)(C)C	ZINC000875464055	EH	On-Demand	Anodyne	REN	56	38
COc1cc(NC(=O)c2ccccc2NC(=O)c2cccs2)cc(OC)c1OC	ZINC000875464111	HI	On-Demand	Anodyne	GRM4	24	67
COc1cc(NC(=O)c2ccccc2NC(=O)c2cccs2)cc(OC)c1OC	ZINC000875464111	HI	On-Demand	Anodyne	PTK2	27	45
COc1cc(NC(=O)c2ccccc2NC(=O)c2cccs2)cc(OC)c1OC	ZINC000875464111	HI	On-Demand	Anodyne	ABCB1	18	41
COc1cc(NC(=O)c2ccccc2NC(=O)c2cccs2)cc(OC)c1OC	ZINC000875464111	HI	On-Demand	Anodyne	SMO	21	40
COc1cc(NC(=O)c2ccccc2NC(=O)c2cccs2)cc(OC)c1OC	ZINC000875464111	HI	On-Demand	Anodyne	STK33	27	42
COc1cc(NC(=O)c2ccccc2NC(=O)c2cccs2)cc(OC)c1OC	ZINC000875464111	HI	On-Demand	Anodyne	Q25615_ONCVO	28	40
COc1cc(NC(=O)c2ccccc2NC(=O)c2cccs2)cc(OC)c1OC	ZINC000875464111	HI	On-Demand	Anodyne	KCNK3	64	45
COc1cc(NC(=O)c2ccccc2NC(=O)c2cccs2)cc(OC)c1OC	ZINC000875464111	HI	On-Demand	Anodyne	KCNK9	68	45
COC(=O)c1cncc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)c1	ZINC000875464377	GG	On-Demand	Anodyne	CSF1R	15	41
COC(=O)c1cncc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)c1	ZINC000875464377	GG	On-Demand	Anodyne	KCNK3	71	35
CCO[C@@H](C(=O)N(c1ccccn1)C1CCCC1)C1CCCC1	ZINC000875464386	DH	On-Demand	Anodyne	AMY2	46	32
CCO[C@H](C(=O)N(c1ccccn1)C1CCCC1)C1CCCC1	ZINC000875464387	DH	On-Demand	Anodyne	AMY2	46	32
O=C(Cc1ccc2cccnc2c1)N(c1ccccn1)C1CCCC1	ZINC000875464400	EI	On-Demand	Anodyne	CDK5	15	40
COC(=O)N(C)NC(=O)N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O	ZINC000875464412	GE	On-Demand	Reactive	BCL2A1	41	33
COC(=O)N(C)NC(=O)N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O	ZINC000875464428	GE	On-Demand	Reactive	BCL2A1	41	33
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000875464442	FC	On-Demand	Mild	DRD2	21	44
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000875464442	FC	On-Demand	Mild	SIGMAR1	17	43
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000875464444	FC	On-Demand	Mild	DRD2	21	44
C#CC[C@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000875464444	FC	On-Demand	Mild	SIGMAR1	17	43
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000875464446	FC	On-Demand	Mild	DRD2	21	44
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000875464446	FC	On-Demand	Mild	SIGMAR1	17	43
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000875464447	FC	On-Demand	Mild	DRD2	21	44
C#CC[C@@H](CCOC)NC(=O)C(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000875464447	FC	On-Demand	Mild	SIGMAR1	17	43
O=C(N[C@H](CC1CCC1)c1ccccc1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875464541	GH	On-Demand	Anodyne	SMO	37	42
O=C(N[C@H](CC1CCC1)c1ccccc1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875464541	GH	On-Demand	Anodyne	ETHR	53	36
O=C(N[C@@H](CC1CCC1)c1ccccc1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875464543	GH	On-Demand	Anodyne	SMO	37	42
O=C(N[C@@H](CC1CCC1)c1ccccc1)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875464543	GH	On-Demand	Anodyne	ETHR	53	36
O=C(N[C@@H](CC1CCC1)c1ccccc1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875464544	GH	On-Demand	Anodyne	SMO	37	42
O=C(N[C@@H](CC1CCC1)c1ccccc1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875464544	GH	On-Demand	Anodyne	ETHR	53	36
O=C(N[C@H](CC1CCC1)c1ccccc1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875464545	GH	On-Demand	Anodyne	SMO	37	42
O=C(N[C@H](CC1CCC1)c1ccccc1)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875464545	GH	On-Demand	Anodyne	ETHR	53	36
Cn1nc(C(=O)Nc2sc3c(c2C#N)CC[C@@H](C(C)(C)C)C3)c2ccccc2c1=O	ZINC000875464585	HI	On-Demand	Mild	PANC	50	34
Cn1nc(C(=O)Nc2sc3c(c2C#N)CC[C@H](C(C)(C)C)C3)c2ccccc2c1=O	ZINC000875464586	HI	On-Demand	Mild	PANC	50	34
O=C(NCCCCC1CC1)C(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000875464588	EE	On-Demand	Anodyne	ACHE	39	44
O=C(NCCCCC1CC1)C(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000875464588	EE	On-Demand	Anodyne	SIGMAR1	26	41
O=C(NCCCCC1CC1)C(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000875464588	EE	On-Demand	Anodyne	CCR3	16	41
O=C(NCCCCC1CC1)C(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000875464589	EE	On-Demand	Anodyne	ACHE	39	44
O=C(NCCCCC1CC1)C(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000875464589	EE	On-Demand	Anodyne	SIGMAR1	26	41
O=C(NCCCCC1CC1)C(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000875464589	EE	On-Demand	Anodyne	CCR3	16	41
CCOC(=O)c1ncc(NC(=O)c2cccc(OC(C)(C)C)c2)s1	ZINC000875464607	EH	On-Demand	Anodyne	KCNK3	41	36
O=C(NCC1CCN(CC2CC2)CC1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875464658	GE	On-Demand	Anodyne	OXTR	52	36
O=C(NCC1CCN(CC2CC2)CC1)C(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875464658	GE	On-Demand	Anodyne	SIGMAR1	20	51
O=C(NCC1CCN(CC2CC2)CC1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875464660	GE	On-Demand	Anodyne	OXTR	52	36
O=C(NCC1CCN(CC2CC2)CC1)C(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875464660	GE	On-Demand	Anodyne	SIGMAR1	20	51
CN(C)C[C@@H]1CN(C(=O)N[C@@H](CC2CCC2)c2ccccc2)C[C@H]1CN(C)C	ZINC000875464799	GG	On-Demand	Anodyne	UTS2	42	35
CN(C)C[C@@H]1CN(C(=O)N[C@H](CC2CCC2)c2ccccc2)C[C@H]1CN(C)C	ZINC000875464800	GG	On-Demand	Anodyne	UTS2	42	35
COCC(C)(C)CCNC(=O)C(=O)NCC1CCN(CC2CC2)CC1	ZINC000875464805	FD	On-Demand	Anodyne	CACNA1I	63	38
C=CC(C)(C)CCCNC(=O)C(=O)NCC1CCN(CC2CC2)CC1	ZINC000875464855	EE	On-Demand	Mild	CACNA1I	52	35
O=C(N[C@H](CC1CCC1)c1ccccc1)N1CCC2(CCNC2=O)CC1	ZINC000875464865	FG	On-Demand	Anodyne	CACNA1H	30	42
O=C(N[C@@H](CC1CCC1)c1ccccc1)N1CCC2(CCNC2=O)CC1	ZINC000875464867	FG	On-Demand	Anodyne	CACNA1H	30	42
CCOC(=O)c1ncc(NC(=O)C(C)(C)c2cccc(OC)c2)s1	ZINC000875464897	EG	On-Demand	Anodyne	MTNR1A	19	40
CCOC(=O)c1ncc(NC(=O)C(C)(C)c2cccc(OC)c2)s1	ZINC000875464897	EG	On-Demand	Anodyne	MTNR1B	23	40
CC(=O)C1CCN(C(=O)N[C@@H](CC2CCC2)c2ccccc2)CC1	ZINC000875464922	EH	On-Demand	Anodyne	CCR5	33	42
CC(=O)C1CCN(C(=O)N[C@@H](CC2CCC2)c2ccccc2)CC1	ZINC000875464922	EH	On-Demand	Anodyne	REN	26	40
CC(=O)C1CCN(C(=O)N[C@H](CC2CCC2)c2ccccc2)CC1	ZINC000875464925	EH	On-Demand	Anodyne	CCR5	33	42
CC(=O)C1CCN(C(=O)N[C@H](CC2CCC2)c2ccccc2)CC1	ZINC000875464925	EH	On-Demand	Anodyne	REN	26	40
CN1CC[C@H]2CN(C(=O)C(=O)NCC3CCN(CC4CC4)CC3)CC[C@@H]21	ZINC000875464977	FC	On-Demand	Anodyne	CACNA1I	52	37
CN1CC[C@H]2CN(C(=O)C(=O)NCC3CCN(CC4CC4)CC3)CC[C@H]21	ZINC000875464978	FC	On-Demand	Anodyne	CACNA1I	52	37
C[S@](=N)(=O)N1CCN(C(=O)C(=O)NCC2CCN(CC3CC3)CC2)CC1	ZINC000875464987	GB	On-Demand	Anodyne	CACNA1I	41	32
CCOC(=O)c1ncc(NC(=O)c2noc3c2CC(C)(C)CC3)s1	ZINC000875464993	EG	On-Demand	Anodyne	PANC	50	32
CC(=O)C1CCN(C(=O)NC2CCN(S(=O)(=O)CC(C)C)CC2)CC1	ZINC000875465037	FD	On-Demand	Anodyne	EPHX2	19	60
COC(=O)C1(O)CN(C(=O)N[C@@H](CC2CCC2)c2ccccc2)C1	ZINC000875465041	ED	On-Demand	Anodyne	REN	19	40
COC(=O)C1(O)CN(C(=O)N[C@H](CC2CCC2)c2ccccc2)C1	ZINC000875465042	ED	On-Demand	Anodyne	REN	19	40
NC(=O)[C@@H]1CC[C@H](C(=O)Nc2cnc(Cl)c(Br)c2)O1	ZINC000875465043	ED	On-Demand	Anodyne	F13A1	36	43
CCOC(=O)c1ncc(NC(=O)c2ccc(C)c(C(=O)OC)c2)s1	ZINC000875465044	EF	On-Demand	Anodyne	MAPK14	27	42
CCOC(=O)c1ncc(NC(=O)C(C)(C)c2ccc(C#N)cc2)s1	ZINC000875465062	EG	On-Demand	Mild	CTRB_BOVIN	47	35
CC(C)(C)OC(=O)C1CC(NC(=O)C(=O)NCC2CCN(CC3CC3)CC2)C1	ZINC000875465074	GD	On-Demand	Anodyne	CACNA1I	51	34
O=CN1CCCN(C(=O)N[C@H](CC2CCC2)c2ccccc2)CC1	ZINC000875465179	EF	On-Demand	Anodyne	REN	17	41
O=CN1CCCN(C(=O)N[C@H](CC2CCC2)c2ccccc2)CC1	ZINC000875465179	EF	On-Demand	Anodyne	CTSS	15	45
O=CN1CCCN(C(=O)N[C@@H](CC2CCC2)c2ccccc2)CC1	ZINC000875465180	EF	On-Demand	Anodyne	REN	17	41
O=CN1CCCN(C(=O)N[C@@H](CC2CCC2)c2ccccc2)CC1	ZINC000875465180	EF	On-Demand	Anodyne	CTSS	15	45
CC(=O)C1CCN(C(=O)C(=O)NCC2CCN(CC3CC3)CC2)CC1	ZINC000875465230	ED	On-Demand	Anodyne	CACNA1I	54	34
Cc1cncc([C@@H]2CCCN2C(=O)C(=O)NCC2CCN(CC3CC3)CC2)c1	ZINC000875465231	GE	On-Demand	Anodyne	CACNA1I	59	35
Cc1cncc([C@H]2CCCN2C(=O)C(=O)NCC2CCN(CC3CC3)CC2)c1	ZINC000875465232	GE	On-Demand	Anodyne	CACNA1I	59	35
Cc1nnc(NNC(=O)N[C@@H](CC2CCC2)c2ccccc2)n1C	ZINC000875465253	EF	On-Demand	Reactive	CCR5	29	43
Cc1nnc(NNC(=O)N[C@H](CC2CCC2)c2ccccc2)n1C	ZINC000875465254	EF	On-Demand	Reactive	CCR5	29	43
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000875465259	FD	On-Demand	Anodyne	DRD2	23	46
COCC(C)(C)CCNC(=O)C(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000875465259	FD	On-Demand	Anodyne	SIGMAR1	27	44
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000875465260	FD	On-Demand	Anodyne	DRD2	23	46
COCC(C)(C)CCNC(=O)C(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000875465260	FD	On-Demand	Anodyne	SIGMAR1	27	44
O=C(NCc1cccc2ncccc12)C(=O)NCC1CCN(CC2CC2)CC1	ZINC000875465381	GE	On-Demand	Anodyne	HTR4	50	39
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000875465389	EC	On-Demand	Mild	DRD2	15	43
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000875465389	EC	On-Demand	Mild	SIGMAR1	16	42
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000875465390	EC	On-Demand	Mild	DRD2	15	43
C#CC[C@H](COC)NC(=O)C(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000875465390	EC	On-Demand	Mild	SIGMAR1	16	42
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000875465391	EC	On-Demand	Mild	DRD2	15	43
C#CC[C@@H](COC)NC(=O)C(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000875465391	EC	On-Demand	Mild	SIGMAR1	16	42
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000875465392	EC	On-Demand	Mild	DRD2	15	43
C#CC[C@H](COC)NC(=O)C(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000875465392	EC	On-Demand	Mild	SIGMAR1	16	42
CC(=O)[C@H]1CCCN(C(=O)NC2CCN(S(=O)(=O)CC(C)C)CC2)C1	ZINC000875465424	FD	On-Demand	Anodyne	EPHX2	19	59
CC(=O)[C@@H]1CCCN(C(=O)NC2CCN(S(=O)(=O)CC(C)C)CC2)C1	ZINC000875465425	FD	On-Demand	Anodyne	EPHX2	19	59
CC(=O)[C@H]1CCCN(C(=O)C(=O)NCC2CCN(CC3CC3)CC2)C1	ZINC000875465440	ED	On-Demand	Anodyne	CACNA1I	46	32
CC(=O)[C@@H]1CCCN(C(=O)C(=O)NCC2CCN(CC3CC3)CC2)C1	ZINC000875465441	ED	On-Demand	Anodyne	CACNA1I	46	32
O=C(N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1)N1CCC(CO)(CO)CC1	ZINC000875465448	GD	On-Demand	Anodyne	CACNA1H	62	40
O=C(N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1)N1CCC(CO)(CO)CC1	ZINC000875465449	GD	On-Demand	Anodyne	CACNA1H	62	40
O=C(NCC1CCN(CC2CC2)CC1)C(=O)N1CCC(CO)(CO)CC1	ZINC000875465456	FB	On-Demand	Anodyne	CACNA1I	45	32
O=C(Cc1csc(COc2ccccc2)n1)N(c1ccccn1)C1CCCC1	ZINC000875465539	GJ	On-Demand	Anodyne	ALOX5	20	40
O=C(Cc1csc(COc2ccccc2)n1)N(c1ccccn1)C1CCCC1	ZINC000875465539	GJ	On-Demand	Anodyne	CPT1A	26	41
O=C(NCc1ncc(Cl)s1)NCc1ccccc1N1CCCCC1	ZINC000875465546	FH	On-Demand	Anodyne	KCNQ2	70	45
O=C(NCc1ncc(Cl)s1)NCc1ccccc1N1CCCCC1	ZINC000875465546	FH	On-Demand	Anodyne	SCN2A	22	52
O=C(NCc1ncc(Cl)s1)NCc1ccccc1N1CCCCC1	ZINC000875465546	FH	On-Demand	Anodyne	SCN10A	27	52
COCC1CC(NC(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875465565	EF	On-Demand	Anodyne	KCNQ2	73	39
COCC1CC(NC(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875465565	EF	On-Demand	Anodyne	SCN2A	17	42
COCC1CC(NC(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875465565	EF	On-Demand	Anodyne	EPHX2	18	43
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3ccccc3N3CCCCC3)C[C@@H]1C2	ZINC000875465572	FF	On-Demand	Anodyne	KCNQ2	65	37
O=C(NCc1ccccc1N1CCCCC1)NC[C@@]12COCCN1C(=O)OC2	ZINC000875465610	GD	On-Demand	Anodyne	KCNQ2	66	39
O=C(NCc1ccccc1N1CCCCC1)NC[C@]12COCCN1C(=O)OC2	ZINC000875465612	GD	On-Demand	Anodyne	KCNQ2	66	39
CCn1ncc(CNC(=O)NCc2ccccc2N2CCCCC2)n1	ZINC000875465655	EE	On-Demand	Anodyne	KCNQ2	74	39
CCn1ncc(CNC(=O)NCc2ccccc2N2CCCCC2)n1	ZINC000875465655	EE	On-Demand	Anodyne	SCN2A	20	48
CCn1ncc(CNC(=O)NCc2ccccc2N2CCCCC2)n1	ZINC000875465655	EE	On-Demand	Anodyne	SCN10A	25	48
CN1CCN(C2CCN(C(=O)N[C@H](CC3CCC3)c3ccccc3)CC2)CC1	ZINC000875465702	GG	On-Demand	Anodyne	CCR5	31	48
CN1CCN(C2CCN(C(=O)N[C@H](CC3CCC3)c3ccccc3)CC2)CC1	ZINC000875465702	GG	On-Demand	Anodyne	L3MBTL3	77	42
CCOC1CC2(C1)C[C@@H]2NC(=O)NCc1ccccc1N1CCCCC1	ZINC000875465704	FG	On-Demand	Anodyne	KCNQ2	71	37
CCOC1CC2(C1)C[C@@H]2NC(=O)NCc1ccccc1N1CCCCC1	ZINC000875465704	FG	On-Demand	Anodyne	SCN2A	17	40
CCOC1CC2(C1)C[C@@H]2NC(=O)NCc1ccccc1N1CCCCC1	ZINC000875465704	FG	On-Demand	Anodyne	TIMP3	46	32
CN1CCN(C2CCN(C(=O)N[C@@H](CC3CCC3)c3ccccc3)CC2)CC1	ZINC000875465705	GG	On-Demand	Anodyne	CCR5	31	48
CN1CCN(C2CCN(C(=O)N[C@@H](CC3CCC3)c3ccccc3)CC2)CC1	ZINC000875465705	GG	On-Demand	Anodyne	L3MBTL3	77	42
CCOC(=O)c1ncc(NC(=O)[C@@H]2CCc3cc(OC)ccc32)s1	ZINC000875465706	EF	On-Demand	Anodyne	PPARD	47	38
CCOC1CC2(C1)C[C@H]2NC(=O)NCc1ccccc1N1CCCCC1	ZINC000875465707	FG	On-Demand	Anodyne	KCNQ2	71	37
CCOC1CC2(C1)C[C@H]2NC(=O)NCc1ccccc1N1CCCCC1	ZINC000875465707	FG	On-Demand	Anodyne	SCN2A	17	40
CCOC1CC2(C1)C[C@H]2NC(=O)NCc1ccccc1N1CCCCC1	ZINC000875465707	FG	On-Demand	Anodyne	TIMP3	46	32
CCOC(=O)c1ncc(NC(=O)[C@H]2CCc3cc(OC)ccc32)s1	ZINC000875465708	EF	On-Demand	Anodyne	PPARD	47	38
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NC(C)(C)C(C)(C)O	ZINC000875465721	EE	On-Demand	Anodyne	CTSK	15	41
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NC(C)(C)C(C)(C)O	ZINC000875465723	EE	On-Demand	Anodyne	CTSK	15	41
N#CCc1ccsc1C(=O)N1CCC[C@H]1CCCc1ccccc1	ZINC000875465732	EI	On-Demand	Mild	SLC18A2	28	41
N#CCc1ccsc1C(=O)N1CCC[C@H]1CCCc1ccccc1	ZINC000875465732	EI	On-Demand	Mild	PREP	75	42
N#CCc1ccsc1C(=O)N1CCC[C@@H]1CCCc1ccccc1	ZINC000875465734	EI	On-Demand	Mild	SLC18A2	28	41
N#CCc1ccsc1C(=O)N1CCC[C@@H]1CCCc1ccccc1	ZINC000875465734	EI	On-Demand	Mild	PREP	75	42
O=C(NCCO)C1CCN(C(=O)N[C@@H](CC2CCC2)c2ccccc2)CC1	ZINC000875465754	FE	On-Demand	Anodyne	CCR5	21	42
O=C(NCCO)C1CCN(C(=O)N[C@H](CC2CCC2)c2ccccc2)CC1	ZINC000875465755	FE	On-Demand	Anodyne	CCR5	21	42
C[C@H](NC(=O)C(=O)NCC1CCN(CC2CC2)CC1)c1ccnn1C	ZINC000875465774	EC	On-Demand	Anodyne	HTR4	54	41
C[C@H](NC(=O)C(=O)NCC1CCN(CC2CC2)CC1)c1ccnn1C	ZINC000875465774	EC	On-Demand	Anodyne	CACNA1I	60	35
O=C(NCc1ccccc1N1CCCCC1)N1Cc2cccc(O)c2C1	ZINC000875465792	FH	On-Demand	Clean	KCNQ2	69	40
O=C(NCc1ccccc1N1CCCCC1)N1Cc2cccc(O)c2C1	ZINC000875465792	FH	On-Demand	Clean	SCN2A	19	45
O=C(NCc1ccccc1N1CCCCC1)N1Cc2cccc(O)c2C1	ZINC000875465792	FH	On-Demand	Clean	SCN10A	15	45
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1N1CCCCC1	ZINC000875465797	FF	On-Demand	Anodyne	SLC6A3	46	39
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1N1CCCCC1	ZINC000875465797	FF	On-Demand	Anodyne	KCNQ2	65	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1N1CCCCC1	ZINC000875465797	FF	On-Demand	Anodyne	SCN2A	17	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1N1CCCCC1	ZINC000875465798	FF	On-Demand	Anodyne	SLC6A3	46	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1N1CCCCC1	ZINC000875465798	FF	On-Demand	Anodyne	KCNQ2	65	36
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccccc1N1CCCCC1	ZINC000875465798	FF	On-Demand	Anodyne	SCN2A	17	41
O=C(NCc1ccnc(F)c1)NCc1ccccc1N1CCCCC1	ZINC000875465801	EG	On-Demand	Anodyne	KCNQ2	72	41
O=C(NCc1ccnc(F)c1)NCc1ccccc1N1CCCCC1	ZINC000875465801	EG	On-Demand	Anodyne	SCN2A	21	46
O=C(NCc1ccnc(F)c1)NCc1ccccc1N1CCCCC1	ZINC000875465801	EG	On-Demand	Anodyne	SCN10A	17	46
COC(=O)N(C)NC(=O)NCc1ccccc1N1CCCCC1	ZINC000875465845	DE	On-Demand	Reactive	KCNQ2	75	41
COC(=O)N(C)NC(=O)NCc1ccccc1N1CCCCC1	ZINC000875465845	DE	On-Demand	Reactive	SCN2A	18	44
COC(=O)N(C)NC(=O)NCc1ccccc1N1CCCCC1	ZINC000875465845	DE	On-Demand	Reactive	SCN10A	15	44
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N[C@H](C)c1ccccc1O	ZINC000875465865	FG	On-Demand	Clean	FPR1	40	35
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N[C@H](C)c1ccccc1O	ZINC000875465872	FG	On-Demand	Clean	FPR1	40	35
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N[C@@H](C)c1ccccc1O	ZINC000875465875	FG	On-Demand	Clean	FPR1	40	35
O=C(NCc1ccc2oc(O)nc2c1)NCc1ccccc1N1CCCCC1	ZINC000875465878	GH	On-Demand	Anodyne	KCNQ2	64	36
O=C(NCc1ccc2oc(O)nc2c1)NCc1ccccc1N1CCCCC1	ZINC000875465878	GH	On-Demand	Anodyne	SCN2A	18	43
O=C(NCc1ccc2oc(O)nc2c1)NCc1ccccc1N1CCCCC1	ZINC000875465878	GH	On-Demand	Anodyne	SCN10A	15	43
C[C@@H]1[C@H](C(=O)NNC(=O)NCc2ccccc2N2CCCCC2)CCCN1C	ZINC000875465906	GE	On-Demand	Reactive	KCNQ2	65	37
C[C@@H]1[C@H](C(=O)NNC(=O)NCc2ccccc2N2CCCCC2)CCCN1C	ZINC000875465906	GE	On-Demand	Reactive	SCN2A	17	41
C[S@](=N)(=O)N1CCN(C(=O)NCc2ccccc2N2CCCCC2)CC1	ZINC000875465909	GE	On-Demand	Anodyne	KCNQ2	74	40
C[S@](=N)(=O)N1CCN(C(=O)NCc2ccccc2N2CCCCC2)CC1	ZINC000875465909	GE	On-Demand	Anodyne	SCN2A	18	43
C[S@](=N)(=O)N1CCN(C(=O)NCc2ccccc2N2CCCCC2)CC1	ZINC000875465909	GE	On-Demand	Anodyne	SCN10A	15	43
O=C(NC[C@H]1CCN1Cc1ccccc1)C(=O)N[C@H]1CC12CCC2	ZINC000875465967	ED	On-Demand	Anodyne	SIGMAR1	27	41
O=C(NC[C@@H]1CCN1Cc1ccccc1)C(=O)N[C@H]1CC12CCC2	ZINC000875465969	ED	On-Demand	Anodyne	SIGMAR1	27	41
O=C(NC[C@H]1CCN1Cc1ccccc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875465971	ED	On-Demand	Anodyne	SIGMAR1	27	41
O=C(NC[C@@H]1CCN1Cc1ccccc1)C(=O)N[C@@H]1CC12CCC2	ZINC000875465973	ED	On-Demand	Anodyne	SIGMAR1	27	41
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000875466004	GD	On-Demand	Anodyne	DRD2	18	48
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000875466004	GD	On-Demand	Anodyne	SIGMAR1	25	44
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000875466006	GD	On-Demand	Anodyne	DRD2	18	48
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000875466006	GD	On-Demand	Anodyne	SIGMAR1	25	44
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000875466009	GD	On-Demand	Anodyne	DRD2	18	48
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000875466009	GD	On-Demand	Anodyne	SIGMAR1	25	44
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000875466011	GD	On-Demand	Anodyne	DRD2	18	48
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000875466011	GD	On-Demand	Anodyne	SIGMAR1	25	44
O=C(NCc1ncc(Cl)s1)C(=O)NCC1CCN(CC2CC2)CC1	ZINC000875466015	FD	On-Demand	Anodyne	CACNA1I	62	38
Cc1nccnc1[C@H](C)NC(=O)NCc1ccccc1N1CCCCC1	ZINC000875466088	FG	On-Demand	Anodyne	ANPEP	15	40
Cc1nccnc1[C@H](C)NC(=O)NCc1ccccc1N1CCCCC1	ZINC000875466088	FG	On-Demand	Anodyne	KCNQ2	70	38
Cc1nccnc1[C@H](C)NC(=O)NCc1ccccc1N1CCCCC1	ZINC000875466088	FG	On-Demand	Anodyne	SCN2A	20	45
Cc1nccnc1[C@H](C)NC(=O)NCc1ccccc1N1CCCCC1	ZINC000875466088	FG	On-Demand	Anodyne	SCN10A	20	45
Cc1nccnc1[C@@H](C)NC(=O)NCc1ccccc1N1CCCCC1	ZINC000875466089	FG	On-Demand	Anodyne	ANPEP	15	40
Cc1nccnc1[C@@H](C)NC(=O)NCc1ccccc1N1CCCCC1	ZINC000875466089	FG	On-Demand	Anodyne	KCNQ2	70	38
Cc1nccnc1[C@@H](C)NC(=O)NCc1ccccc1N1CCCCC1	ZINC000875466089	FG	On-Demand	Anodyne	SCN2A	20	45
Cc1nccnc1[C@@H](C)NC(=O)NCc1ccccc1N1CCCCC1	ZINC000875466089	FG	On-Demand	Anodyne	SCN10A	20	45
CC(=O)C1CCN(C(=O)NCc2ccccc2N2CCCCC2)CC1	ZINC000875466092	EG	On-Demand	Anodyne	MC4R	21	42
CC(=O)C1CCN(C(=O)NCc2ccccc2N2CCCCC2)CC1	ZINC000875466092	EG	On-Demand	Anodyne	KCNQ2	76	42
CC(=O)C1CCN(C(=O)NCc2ccccc2N2CCCCC2)CC1	ZINC000875466092	EG	On-Demand	Anodyne	SCN2A	20	47
CC(=O)C1CCN(C(=O)NCc2ccccc2N2CCCCC2)CC1	ZINC000875466092	EG	On-Demand	Anodyne	EPHX2	36	46
CC(=O)C1CCN(C(=O)NCc2ccccc2N2CCCCC2)CC1	ZINC000875466092	EG	On-Demand	Anodyne	SCN10A	16	47
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)CCNC(=O)OC(C)(C)C	ZINC000875466100	EE	On-Demand	Anodyne	ECE1	27	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)CCNC(=O)OC(C)(C)C	ZINC000875466102	EE	On-Demand	Anodyne	ECE1	27	40
O=C(NCc1ccccc1N1CCCCC1)N1CCC2(CCNC2=O)CC1	ZINC000875466111	FE	On-Demand	Anodyne	KCNQ2	63	38
O=C(NCc1ccccc1N1CCCCC1)N1CCC2(CCNC2=O)CC1	ZINC000875466111	FE	On-Demand	Anodyne	SCN2A	17	41
CN1CCN(C2CCN(C(=O)NCc3ccccc3N3CCCCC3)CC2)CC1	ZINC000875466121	GF	On-Demand	Anodyne	KCNQ2	72	39
CN1CCN(C2CCN(C(=O)NCc3ccccc3N3CCCCC3)CC2)CC1	ZINC000875466121	GF	On-Demand	Anodyne	SCN2A	25	42
CN1CCN(C2CCN(C(=O)NCc3ccccc3N3CCCCC3)CC2)CC1	ZINC000875466121	GF	On-Demand	Anodyne	EPHX2	26	41
CN1CCN(C2CCN(C(=O)NCc3ccccc3N3CCCCC3)CC2)CC1	ZINC000875466121	GF	On-Demand	Anodyne	L3MBTL3	115	45
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875466122	EG	On-Demand	Anodyne	AVPR2	25	40
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875466122	EG	On-Demand	Anodyne	SLC6A1	76	34
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875466122	EG	On-Demand	Anodyne	MC4R	17	43
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875466122	EG	On-Demand	Anodyne	KCNQ2	75	41
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875466122	EG	On-Demand	Anodyne	SCN2A	18	44
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875466122	EG	On-Demand	Anodyne	EPHX2	21	41
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875466122	EG	On-Demand	Anodyne	DPP7	41	36
CC(=O)[C@@H]1CCCN(C(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875466122	EG	On-Demand	Anodyne	SCN10A	15	44
CC(=O)[C@H]1CCCN(C(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875466123	EG	On-Demand	Anodyne	AVPR2	25	40
CC(=O)[C@H]1CCCN(C(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875466123	EG	On-Demand	Anodyne	SLC6A1	76	34
CC(=O)[C@H]1CCCN(C(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875466123	EG	On-Demand	Anodyne	MC4R	17	43
CC(=O)[C@H]1CCCN(C(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875466123	EG	On-Demand	Anodyne	KCNQ2	75	41
CC(=O)[C@H]1CCCN(C(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875466123	EG	On-Demand	Anodyne	SCN2A	18	44
CC(=O)[C@H]1CCCN(C(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875466123	EG	On-Demand	Anodyne	EPHX2	21	41
CC(=O)[C@H]1CCCN(C(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875466123	EG	On-Demand	Anodyne	DPP7	41	36
CC(=O)[C@H]1CCCN(C(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875466123	EG	On-Demand	Anodyne	SCN10A	15	44
COC(=O)C1(O)CN(C(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875466124	ED	On-Demand	Anodyne	KCNQ2	73	40
COC(=O)C1(O)CN(C(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875466124	ED	On-Demand	Anodyne	SCN2A	19	45
COC(=O)C1(O)CN(C(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875466124	ED	On-Demand	Anodyne	SCN10A	15	45
CO[C@@H]1CC[C@@H](C)N(C(=O)C(=O)NCC2CCN(CC3CC3)CC2)C1	ZINC000875466132	FD	On-Demand	Anodyne	CACNA1I	45	33
O=C(NCc1ccccc1N1CCCCC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875466139	GH	On-Demand	Anodyne	KCNQ2	57	37
O=C(NCc1ccccc1N1CCCCC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875466139	GH	On-Demand	Anodyne	SCN2A	17	41
O=C(NCc1ccccc1N1CCCCC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875466139	GH	On-Demand	Anodyne	EPHX2	22	43
O=C(NCc1ccccc1N1CCCCC1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875466139	GH	On-Demand	Anodyne	SCN10A	15	41
O=C(NCc1ccccc1N1CCCCC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875466140	GH	On-Demand	Anodyne	KCNQ2	57	37
O=C(NCc1ccccc1N1CCCCC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875466140	GH	On-Demand	Anodyne	SCN2A	17	41
O=C(NCc1ccccc1N1CCCCC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875466140	GH	On-Demand	Anodyne	EPHX2	22	43
O=C(NCc1ccccc1N1CCCCC1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875466140	GH	On-Demand	Anodyne	SCN10A	15	41
Cc1nnc(NNC(=O)NCc2ccccc2N2CCCCC2)n1C	ZINC000875466179	ED	On-Demand	Reactive	KCNQ2	64	38
Cc1nnc(NNC(=O)NCc2ccccc2N2CCCCC2)n1C	ZINC000875466179	ED	On-Demand	Reactive	SCN2A	18	43
Cc1nnc(NNC(=O)NCc2ccccc2N2CCCCC2)n1C	ZINC000875466179	ED	On-Demand	Reactive	SCN10A	15	43
O=C(NCc1ccccc1N1CCCCC1)NC[C@@H]1CCO[C@H]1c1cn[nH]c1	ZINC000875466199	GF	On-Demand	Anodyne	SCN2A	17	41
CONC(=O)C1CCN(C(=O)N[C@H](CC2CCC2)c2ccccc2)CC1	ZINC000875466200	FG	On-Demand	Anodyne	CCR5	28	42
CONC(=O)C1CCN(C(=O)N[C@H](CC2CCC2)c2ccccc2)CC1	ZINC000875466200	FG	On-Demand	Anodyne	AMY2	45	31
CONC(=O)C1CCN(C(=O)N[C@H](CC2CCC2)c2ccccc2)CC1	ZINC000875466200	FG	On-Demand	Anodyne	REN	32	43
CONC(=O)C1CCN(C(=O)N[C@@H](CC2CCC2)c2ccccc2)CC1	ZINC000875466202	FG	On-Demand	Anodyne	CCR5	28	42
CONC(=O)C1CCN(C(=O)N[C@@H](CC2CCC2)c2ccccc2)CC1	ZINC000875466202	FG	On-Demand	Anodyne	AMY2	45	31
CONC(=O)C1CCN(C(=O)N[C@@H](CC2CCC2)c2ccccc2)CC1	ZINC000875466202	FG	On-Demand	Anodyne	REN	32	43
CCOC(=O)c1cc(CNC(=O)NCc2ccccc2N2CCCCC2)on1	ZINC000875466203	GF	On-Demand	Anodyne	KCNQ2	68	35
CCOC(=O)c1cc(CNC(=O)NCc2ccccc2N2CCCCC2)on1	ZINC000875466203	GF	On-Demand	Anodyne	SCN2A	18	42
CCOC(=O)c1cc(CNC(=O)NCc2ccccc2N2CCCCC2)on1	ZINC000875466203	GF	On-Demand	Anodyne	SCN10A	19	42
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000875466218	FD	On-Demand	Anodyne	ACHE	20	43
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000875466219	FD	On-Demand	Anodyne	ACHE	20	43
O=C(NCC[C@H]1CCSC1)C(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000875466220	FD	On-Demand	Anodyne	ACHE	20	43
O=C(NCC[C@@H]1CCSC1)C(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000875466221	FD	On-Demand	Anodyne	ACHE	20	43
CCOC(=O)c1ncc(NC(=O)c2nc(C)cc(C(F)(F)F)n2)s1	ZINC000875466233	FF	On-Demand	Anodyne	ATF1	26	41
CCOC(=O)c1ncc(NC(=O)c2nc(C)cc(C(F)(F)F)n2)s1	ZINC000875466233	FF	On-Demand	Anodyne	NFKB1	24	41
O=C(NCc1cccc2ncccc12)C(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000875466254	GE	On-Demand	Anodyne	SIGMAR1	16	41
O=C(NCc1cccc2ncccc12)C(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000875466255	GE	On-Demand	Anodyne	SIGMAR1	16	41
C[C@H](NC(=O)C(=O)NCC1CCN(CC2CC2)CC1)c1cc2cnccc2o1	ZINC000875466265	GE	On-Demand	Anodyne	CACNA1I	65	38
CCOC(=O)c1ncc(NC(=O)c2cc(C(F)(F)F)ncn2)s1	ZINC000875466276	EE	On-Demand	Anodyne	ATF1	26	41
CCOC(=O)c1ncc(NC(=O)c2cc(C(F)(F)F)ncn2)s1	ZINC000875466276	EE	On-Demand	Anodyne	NFKB1	24	41
C#CC[C@@H](COC)NC(=O)NCc1ccccc1N1CCCCC1	ZINC000875466285	EF	On-Demand	Mild	KCNQ2	69	37
C#CC[C@@H](COC)NC(=O)NCc1ccccc1N1CCCCC1	ZINC000875466285	EF	On-Demand	Mild	SCN2A	17	40
C#CC[C@H](COC)NC(=O)NCc1ccccc1N1CCCCC1	ZINC000875466286	EF	On-Demand	Mild	KCNQ2	69	37
C#CC[C@H](COC)NC(=O)NCc1ccccc1N1CCCCC1	ZINC000875466286	EF	On-Demand	Mild	SCN2A	17	40
Cn1nc(C(=O)OC(C)(C)C)cc1C(=O)Oc1ccc(C#N)cc1F	ZINC000875466294	EF	On-Demand	Mild	AR	22	40
CC(C)(C)OC(=O)N1CC[C@@H]([C@H](F)C(=O)Oc2ccc(C#N)cc2F)C1	ZINC000875466305	FG	On-Demand	Mild	GPR119	47	43
CC(C)(C)OC(=O)N1CC[C@@H]([C@@H](F)C(=O)Oc2ccc(C#N)cc2F)C1	ZINC000875466306	FG	On-Demand	Mild	GPR119	47	43
CC(C)(C)OC(=O)N1CC[C@H]([C@@H](F)C(=O)Oc2ccc(C#N)cc2F)C1	ZINC000875466307	FG	On-Demand	Mild	GPR119	47	43
CC(C)(C)OC(=O)N1CC[C@H]([C@H](F)C(=O)Oc2ccc(C#N)cc2F)C1	ZINC000875466308	FG	On-Demand	Mild	GPR119	47	43
O=C(NCC1CCN(CC2CC2)CC1)C(=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875466323	ED	On-Demand	Anodyne	CACNA1I	51	35
N#Cc1ccc(OC(=O)c2ncc3n2CCCC3)c(F)c1	ZINC000875466326	CE	On-Demand	Mild	AR	23	40
O=C(NCc1nc(O)c2c(n1)CCOC2)NCc1ccccc1N1CCCCC1	ZINC000875466338	GE	On-Demand	Anodyne	KCNQ2	51	37
O=C(NCc1nc(O)c2c(n1)CCOC2)NCc1ccccc1N1CCCCC1	ZINC000875466338	GE	On-Demand	Anodyne	SCN2A	18	42
O=C(NCc1nc(O)c2c(n1)CCOC2)NCc1ccccc1N1CCCCC1	ZINC000875466338	GE	On-Demand	Anodyne	SCN10A	15	42
O=C(NCc1nc(O)c2c(n1)CCOC2)NCc1ccccc1N1CCCCC1	ZINC000875466338	GE	On-Demand	Anodyne	WNT3A	52	34
C[C@@]1(Br)C[C@@H]1C(=O)Nc1ccc(C#N)cc1Cl	ZINC000875466348	DG	On-Demand	Mild	ABCC9	44	36
C[C@@]1(Br)C[C@H]1C(=O)Nc1ccc(C#N)cc1Cl	ZINC000875466349	DG	On-Demand	Mild	ABCC9	44	36
O=C(NCc1ccccc1N1CCCCC1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875466365	GE	On-Demand	Anodyne	KCNQ2	69	39
O=C(NCc1ccccc1N1CCCCC1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875466365	GE	On-Demand	Anodyne	SCN2A	18	44
O=C(NCc1ccccc1N1CCCCC1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875466365	GE	On-Demand	Anodyne	EPHX2	18	40
O=C(NCc1ccccc1N1CCCCC1)N1CC[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875466365	GE	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1ccccc1N1CCCCC1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875466366	GE	On-Demand	Anodyne	KCNQ2	69	39
O=C(NCc1ccccc1N1CCCCC1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875466366	GE	On-Demand	Anodyne	SCN2A	18	44
O=C(NCc1ccccc1N1CCCCC1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875466366	GE	On-Demand	Anodyne	EPHX2	18	40
O=C(NCc1ccccc1N1CCCCC1)N1CC[C@@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875466366	GE	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1ccccc1N1CCCCC1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875466367	GE	On-Demand	Anodyne	KCNQ2	69	39
O=C(NCc1ccccc1N1CCCCC1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875466367	GE	On-Demand	Anodyne	SCN2A	18	44
O=C(NCc1ccccc1N1CCCCC1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875466367	GE	On-Demand	Anodyne	EPHX2	18	40
O=C(NCc1ccccc1N1CCCCC1)N1CC[C@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000875466367	GE	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1ccccc1N1CCCCC1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875466368	GE	On-Demand	Anodyne	KCNQ2	69	39
O=C(NCc1ccccc1N1CCCCC1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875466368	GE	On-Demand	Anodyne	SCN2A	18	44
O=C(NCc1ccccc1N1CCCCC1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875466368	GE	On-Demand	Anodyne	EPHX2	18	40
O=C(NCc1ccccc1N1CCCCC1)N1CC[C@H]2CS(=O)(=O)C[C@H]2C1	ZINC000875466368	GE	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1ccccc1N1CCCCC1)N1CCC(CO)(CO)CC1	ZINC000875466398	FD	On-Demand	Anodyne	KCNQ2	74	42
O=C(NCc1ccccc1N1CCCCC1)N1CCC(CO)(CO)CC1	ZINC000875466398	FD	On-Demand	Anodyne	SCN2A	19	44
O=C(NCc1ccccc1N1CCCCC1)N1CCC(CO)(CO)CC1	ZINC000875466398	FD	On-Demand	Anodyne	EPHX2	15	43
O=C(NCc1ccccc1N1CCCCC1)N1CCC(CO)(CO)CC1	ZINC000875466398	FD	On-Demand	Anodyne	SCN10A	15	44
CC(=O)N(C)c1ccc(CNC(=O)NCc2ccccc2N2CCCCC2)cc1	ZINC000875466410	GH	On-Demand	Anodyne	AVPR2	23	41
CC(=O)N(C)c1ccc(CNC(=O)NCc2ccccc2N2CCCCC2)cc1	ZINC000875466410	GH	On-Demand	Anodyne	KCNQ2	73	39
CC(=O)N(C)c1ccc(CNC(=O)NCc2ccccc2N2CCCCC2)cc1	ZINC000875466410	GH	On-Demand	Anodyne	SCN2A	18	42
O=CN1CCCN(C(=O)NCc2ccccc2N2CCCCC2)CC1	ZINC000875466414	EE	On-Demand	Anodyne	KCNQ2	73	42
O=CN1CCCN(C(=O)NCc2ccccc2N2CCCCC2)CC1	ZINC000875466414	EE	On-Demand	Anodyne	SCN2A	19	44
O=CN1CCCN(C(=O)NCc2ccccc2N2CCCCC2)CC1	ZINC000875466414	EE	On-Demand	Anodyne	SCN10A	15	44
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1N1CCCCC1	ZINC000875466452	EG	On-Demand	Anodyne	ANPEP	16	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1N1CCCCC1	ZINC000875466452	EG	On-Demand	Anodyne	KCNQ2	81	42
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccccc1N1CCCCC1	ZINC000875466452	EG	On-Demand	Anodyne	SCN2A	18	42
N#Cc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c(F)c1	ZINC000875466457	DG	On-Demand	Mild	DRD4	38	40
N#Cc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c(F)c1	ZINC000875466457	DG	On-Demand	Mild	ACHE	28	40
N#Cc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c(F)c1	ZINC000875466457	DG	On-Demand	Mild	SLC6A1	69	32
N#Cc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c(F)c1	ZINC000875466457	DG	On-Demand	Mild	SIGMAR1	44	43
N#Cc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c(F)c1	ZINC000875466457	DG	On-Demand	Mild	CCR3	34	41
N#Cc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c(F)c1	ZINC000875466457	DG	On-Demand	Mild	SLC18A3	20	43
N#Cc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c(F)c1	ZINC000875466457	DG	On-Demand	Mild	MLNR	29	43
N#Cc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c(F)c1	ZINC000875466457	DG	On-Demand	Mild	S1PR1	15	40
N#Cc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c(F)c1	ZINC000875466457	DG	On-Demand	Mild	MCHR1	20	41
N#Cc1ccc(OC(=O)[C@H]2CCN(Cc3ccccc3)C2)c(F)c1	ZINC000875466457	DG	On-Demand	Mild	CACNA1G	35	40
N#Cc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c(F)c1	ZINC000875466458	DG	On-Demand	Mild	DRD4	38	40
N#Cc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c(F)c1	ZINC000875466458	DG	On-Demand	Mild	ACHE	28	40
N#Cc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c(F)c1	ZINC000875466458	DG	On-Demand	Mild	SLC6A1	69	32
N#Cc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c(F)c1	ZINC000875466458	DG	On-Demand	Mild	SIGMAR1	44	43
N#Cc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c(F)c1	ZINC000875466458	DG	On-Demand	Mild	CCR3	34	41
N#Cc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c(F)c1	ZINC000875466458	DG	On-Demand	Mild	SLC18A3	20	43
N#Cc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c(F)c1	ZINC000875466458	DG	On-Demand	Mild	MLNR	29	43
N#Cc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c(F)c1	ZINC000875466458	DG	On-Demand	Mild	S1PR1	15	40
N#Cc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c(F)c1	ZINC000875466458	DG	On-Demand	Mild	MCHR1	20	41
N#Cc1ccc(OC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c(F)c1	ZINC000875466458	DG	On-Demand	Mild	CACNA1G	35	40
O=C(NCc1ccccc1N1CCCCC1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875466511	GG	On-Demand	Anodyne	KCNQ2	54	36
O=C(NCc1ccccc1N1CCCCC1)NC[C@@H]1CC(C(F)(F)F)=NO1	ZINC000875466511	GG	On-Demand	Anodyne	SCN2A	17	41
O=C(NCc1ccccc1N1CCCCC1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875466512	GG	On-Demand	Anodyne	KCNQ2	54	36
O=C(NCc1ccccc1N1CCCCC1)NC[C@H]1CC(C(F)(F)F)=NO1	ZINC000875466512	GG	On-Demand	Anodyne	SCN2A	17	41
O=C(NCc1ccccc1N1CCCCC1)N[C@@H]1C[C@H]1C1CCOCC1	ZINC000875466540	FG	On-Demand	Anodyne	KCNQ2	59	37
O=C(NCc1ccccc1N1CCCCC1)N[C@@H]1C[C@H]1C1CCOCC1	ZINC000875466540	FG	On-Demand	Anodyne	SCN2A	17	40
O=C(NCc1ccccc1N1CCCCC1)N[C@@H]1C[C@H]1C1CCOCC1	ZINC000875466540	FG	On-Demand	Anodyne	SCN10A	15	40
O=C(NCc1ccccc1N1CCCCC1)NC[C@H]1C[C@H](O)C1	ZINC000875466541	DE	On-Demand	Anodyne	KCNQ2	74	43
O=C(NCc1ccccc1N1CCCCC1)NC[C@H]1C[C@H](O)C1	ZINC000875466541	DE	On-Demand	Anodyne	SCN2A	19	45
O=C(NCc1ccccc1N1CCCCC1)NC[C@H]1C[C@H](O)C1	ZINC000875466541	DE	On-Demand	Anodyne	SCN10A	15	45
CONC(=O)C1CCN(C(=O)NCc2ccccc2N2CCCCC2)CC1	ZINC000875466575	FE	On-Demand	Anodyne	HTR1A	17	43
CONC(=O)C1CCN(C(=O)NCc2ccccc2N2CCCCC2)CC1	ZINC000875466575	FE	On-Demand	Anodyne	KCNQ2	71	38
CONC(=O)C1CCN(C(=O)NCc2ccccc2N2CCCCC2)CC1	ZINC000875466575	FE	On-Demand	Anodyne	SCN2A	18	43
CONC(=O)C1CCN(C(=O)NCc2ccccc2N2CCCCC2)CC1	ZINC000875466575	FE	On-Demand	Anodyne	EPHX2	37	45
CONC(=O)C1CCN(C(=O)NCc2ccccc2N2CCCCC2)CC1	ZINC000875466575	FE	On-Demand	Anodyne	SCN10A	15	43
O=C1OC[C@H]2CN(C(=O)NCc3ccccc3N3CCCCC3)C[C@@H]12	ZINC000875466577	ED	On-Demand	Anodyne	KCNQ2	59	37
O=C1OC[C@H]2CN(C(=O)NCc3ccccc3N3CCCCC3)C[C@@H]12	ZINC000875466577	ED	On-Demand	Anodyne	SCN2A	17	40
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCC1CCN(CC2CC2)CC1	ZINC000875466603	GD	On-Demand	Anodyne	HTR4	60	38
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCC1CCN(CC2CC2)CC1	ZINC000875466603	GD	On-Demand	Anodyne	CACNA1I	66	38
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCC1CCN(CC2CC2)CC1	ZINC000875466604	GD	On-Demand	Anodyne	HTR4	60	38
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCC1CCN(CC2CC2)CC1	ZINC000875466604	GD	On-Demand	Anodyne	CACNA1I	66	38
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875466629	FE	On-Demand	Anodyne	REN	17	40
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875466630	FE	On-Demand	Anodyne	REN	17	40
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875466631	FE	On-Demand	Anodyne	REN	17	40
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875466632	FE	On-Demand	Anodyne	REN	17	40
C/C=C\CNC(=O)N[C@H](C)CCNC(=O)OC(C)(C)C	ZINC000875466633	CE	On-Demand	Anodyne	CTSK	17	46
C/C=C/CNC(=O)N[C@@H](C)CCNC(=O)OC(C)(C)C	ZINC000875466634	CE	On-Demand	Anodyne	CTSK	17	46
C/C=C/CNC(=O)N[C@H](C)CCNC(=O)OC(C)(C)C	ZINC000875466635	CE	On-Demand	Anodyne	CTSK	17	46
C/C=C\CNC(=O)N[C@@H](C)CCNC(=O)OC(C)(C)C	ZINC000875466636	CE	On-Demand	Anodyne	CTSK	17	46
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CCCN(C=O)CC1	ZINC000875466637	ED	On-Demand	Anodyne	CTSK	15	42
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CCCN(C=O)CC1	ZINC000875466638	ED	On-Demand	Anodyne	CTSK	15	42
O=C(NCCCCC1CC1)C(=O)NCC1CCN(CC2CC2)CC1	ZINC000875466639	ED	On-Demand	Anodyne	CACNA1I	55	40
NC(=O)C1CC(NC(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875466654	ED	On-Demand	Anodyne	KCNQ2	73	42
NC(=O)C1CC(NC(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875466654	ED	On-Demand	Anodyne	SCN2A	19	44
NC(=O)C1CC(NC(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875466654	ED	On-Demand	Anodyne	EPHX2	17	46
NC(=O)C1CC(NC(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875466654	ED	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1ccccc1N1CCCCC1)NC[C@@H]1CC2(CCOCC2)CO1	ZINC000875466658	GG	On-Demand	Anodyne	KCNQ2	67	38
O=C(NCc1ccccc1N1CCCCC1)NC[C@@H]1CC2(CCOCC2)CO1	ZINC000875466658	GG	On-Demand	Anodyne	SCN2A	17	40
O=C(NCc1ccccc1N1CCCCC1)NC[C@@H]1CC2(CCOCC2)CO1	ZINC000875466658	GG	On-Demand	Anodyne	SCN10A	15	40
O=C(NCc1ccccc1N1CCCCC1)NC[C@H]1CC2(CCOCC2)CO1	ZINC000875466659	GG	On-Demand	Anodyne	KCNQ2	67	38
O=C(NCc1ccccc1N1CCCCC1)NC[C@H]1CC2(CCOCC2)CO1	ZINC000875466659	GG	On-Demand	Anodyne	SCN2A	17	40
O=C(NCc1ccccc1N1CCCCC1)NC[C@H]1CC2(CCOCC2)CO1	ZINC000875466659	GG	On-Demand	Anodyne	SCN10A	15	40
O=C(NCc1ccnc(-n2cncn2)c1)NCc1ccccc1N1CCCCC1	ZINC000875466668	GF	On-Demand	Anodyne	KCNQ2	46	35
O=C(NCc1ccnc(-n2cncn2)c1)NCc1ccccc1N1CCCCC1	ZINC000875466668	GF	On-Demand	Anodyne	SCN2A	20	44
O=C(NCc1ccnc(-n2cncn2)c1)NCc1ccccc1N1CCCCC1	ZINC000875466668	GF	On-Demand	Anodyne	NOS2	44	32
O=C(NCc1ccnc(-n2cncn2)c1)NCc1ccccc1N1CCCCC1	ZINC000875466668	GF	On-Demand	Anodyne	SCN10A	16	44
O=C(NCc1ccccc1N1CCCCC1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875466669	GE	On-Demand	Anodyne	KCNQ2	64	38
O=C(NCc1ccccc1N1CCCCC1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875466669	GE	On-Demand	Anodyne	SCN2A	17	41
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N[C@H](C)[C@H](O)C(F)(F)F	ZINC000875466675	FD	On-Demand	Anodyne	CTSK	15	41
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N[C@H](C)[C@@H](O)C(F)(F)F	ZINC000875466677	FD	On-Demand	Anodyne	CTSK	15	41
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2N2CCCCC2)CC1	ZINC000875466685	GD	On-Demand	Anodyne	KCNQ2	67	39
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2N2CCCCC2)CC1	ZINC000875466685	GD	On-Demand	Anodyne	SCN2A	18	44
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2N2CCCCC2)CC1	ZINC000875466685	GD	On-Demand	Anodyne	EPHX2	32	49
O=C(NCCO)C1CCN(C(=O)NCc2ccccc2N2CCCCC2)CC1	ZINC000875466685	GD	On-Demand	Anodyne	SCN10A	15	44
CN1CC[C@H]2CN(C(=O)NCc3ccccc3N3CCCCC3)CC[C@@H]21	ZINC000875466708	FF	On-Demand	Anodyne	KCNQ2	71	38
CN1CC[C@H]2CN(C(=O)NCc3ccccc3N3CCCCC3)CC[C@@H]21	ZINC000875466708	FF	On-Demand	Anodyne	SCN2A	18	43
CN1CC[C@H]2CN(C(=O)NCc3ccccc3N3CCCCC3)CC[C@@H]21	ZINC000875466708	FF	On-Demand	Anodyne	SCN10A	15	43
CN1CC[C@H]2CN(C(=O)NCc3ccccc3N3CCCCC3)CC[C@H]21	ZINC000875466709	FF	On-Demand	Anodyne	KCNQ2	71	38
CN1CC[C@H]2CN(C(=O)NCc3ccccc3N3CCCCC3)CC[C@H]21	ZINC000875466709	FF	On-Demand	Anodyne	SCN2A	18	43
CN1CC[C@H]2CN(C(=O)NCc3ccccc3N3CCCCC3)CC[C@H]21	ZINC000875466709	FF	On-Demand	Anodyne	SCN10A	15	43
O=C(NCc1ccccc1N1CCCCC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875466716	FH	On-Demand	Anodyne	KCNQ2	63	38
O=C(NCc1ccccc1N1CCCCC1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875466716	FH	On-Demand	Anodyne	SCN2A	17	41
Cn1nnnc1C1CCN(C(=O)NCc2ccccc2N2CCCCC2)CC1	ZINC000875466747	GE	On-Demand	Anodyne	KCNQ2	61	35
Cn1nnnc1C1CCN(C(=O)NCc2ccccc2N2CCCCC2)CC1	ZINC000875466747	GE	On-Demand	Anodyne	SCN2A	19	44
Cn1nnnc1C1CCN(C(=O)NCc2ccccc2N2CCCCC2)CC1	ZINC000875466747	GE	On-Demand	Anodyne	EPHX2	21	40
Cn1nnnc1C1CCN(C(=O)NCc2ccccc2N2CCCCC2)CC1	ZINC000875466747	GE	On-Demand	Anodyne	SCN10A	15	44
COCC(C)(C)CCNC(=O)NCc1ccccc1N1CCCCC1	ZINC000875466748	EH	On-Demand	Anodyne	AVPR2	19	40
COCC(C)(C)CCNC(=O)NCc1ccccc1N1CCCCC1	ZINC000875466748	EH	On-Demand	Anodyne	KCNQ2	70	41
COCC(C)(C)CCNC(=O)NCc1ccccc1N1CCCCC1	ZINC000875466748	EH	On-Demand	Anodyne	SCN2A	18	43
COCC(C)(C)CCNC(=O)NCc1ccccc1N1CCCCC1	ZINC000875466748	EH	On-Demand	Anodyne	SCN10A	15	43
O=C(NCC[C@H]1CCSC1)NCc1ccccc1N1CCCCC1	ZINC000875466749	EH	On-Demand	Anodyne	KCNQ2	60	38
O=C(NCC[C@H]1CCSC1)NCc1ccccc1N1CCCCC1	ZINC000875466749	EH	On-Demand	Anodyne	SCN2A	17	41
O=C(NCC[C@@H]1CCSC1)NCc1ccccc1N1CCCCC1	ZINC000875466750	EH	On-Demand	Anodyne	KCNQ2	60	38
O=C(NCC[C@@H]1CCSC1)NCc1ccccc1N1CCCCC1	ZINC000875466750	EH	On-Demand	Anodyne	SCN2A	17	41
CO[C@@H]1CC[C@@H](C)N(C(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875466753	EG	On-Demand	Anodyne	HTR1A	21	40
CO[C@@H]1CC[C@@H](C)N(C(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875466753	EG	On-Demand	Anodyne	AVPR2	24	45
CO[C@@H]1CC[C@@H](C)N(C(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875466753	EG	On-Demand	Anodyne	KCNQ2	68	38
CO[C@@H]1CC[C@@H](C)N(C(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875466753	EG	On-Demand	Anodyne	SCN2A	17	41
C#CC[C@H](CCOC)NC(=O)NCc1ccccc1N1CCCCC1	ZINC000875466756	EF	On-Demand	Mild	KCNQ2	68	37
C#CC[C@H](CCOC)NC(=O)NCc1ccccc1N1CCCCC1	ZINC000875466756	EF	On-Demand	Mild	SCN2A	17	41
C#CC[C@@H](CCOC)NC(=O)NCc1ccccc1N1CCCCC1	ZINC000875466757	EF	On-Demand	Mild	KCNQ2	68	37
C#CC[C@@H](CCOC)NC(=O)NCc1ccccc1N1CCCCC1	ZINC000875466757	EF	On-Demand	Mild	SCN2A	17	41
N#Cc1ccc(OC(=O)CN2CCCCC(=O)C2=O)c(F)c1	ZINC000875466759	DD	On-Demand	Mild	AR	23	40
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NCC(C)(C)F	ZINC000875466790	DE	On-Demand	Anodyne	CTSK	16	41
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NCC(C)(C)F	ZINC000875466791	DE	On-Demand	Anodyne	CTSK	16	41
O=C(NCC1CCN(CC2CC2)CC1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875466792	GD	On-Demand	Anodyne	F2	19	44
O=C(NCC1CCN(CC2CC2)CC1)C(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875466792	GD	On-Demand	Anodyne	CACNA1I	52	33
O=C(NCC1CCN(CC2CC2)CC1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875466793	GD	On-Demand	Anodyne	F2	19	44
O=C(NCC1CCN(CC2CC2)CC1)C(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875466793	GD	On-Demand	Anodyne	CACNA1I	52	33
O=C(NCC1CCN(CC2CC2)CC1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875466794	GD	On-Demand	Anodyne	F2	19	44
O=C(NCC1CCN(CC2CC2)CC1)C(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875466794	GD	On-Demand	Anodyne	CACNA1I	52	33
O=C(NCC1CCN(CC2CC2)CC1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875466795	GD	On-Demand	Anodyne	F2	19	44
O=C(NCC1CCN(CC2CC2)CC1)C(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875466795	GD	On-Demand	Anodyne	CACNA1I	52	33
O=C(NCCC[C@H]1CCOC1=O)NCc1ccccc1N1CCCCC1	ZINC000875466805	FF	On-Demand	Anodyne	KCNQ2	48	37
O=C(NCCC[C@H]1CCOC1=O)NCc1ccccc1N1CCCCC1	ZINC000875466805	FF	On-Demand	Anodyne	SCN2A	17	41
O=C(NCCC[C@H]1CCOC1=O)NCc1ccccc1N1CCCCC1	ZINC000875466805	FF	On-Demand	Anodyne	SCN10A	15	41
O=C(NCCC[C@@H]1CCOC1=O)NCc1ccccc1N1CCCCC1	ZINC000875466806	FF	On-Demand	Anodyne	KCNQ2	48	37
O=C(NCCC[C@@H]1CCOC1=O)NCc1ccccc1N1CCCCC1	ZINC000875466806	FF	On-Demand	Anodyne	SCN2A	17	41
O=C(NCCC[C@@H]1CCOC1=O)NCc1ccccc1N1CCCCC1	ZINC000875466806	FF	On-Demand	Anodyne	SCN10A	15	41
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC(c2ccccc2)C1	ZINC000875466816	EG	On-Demand	Anodyne	ACE	17	44
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC(c2ccccc2)C1	ZINC000875466816	EG	On-Demand	Anodyne	CTSK	23	40
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC(c2ccccc2)C1	ZINC000875466816	EG	On-Demand	Anodyne	REN	42	39
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC(c2ccccc2)C1	ZINC000875466816	EG	On-Demand	Anodyne	FPR1	46	38
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC(c2ccccc2)C1	ZINC000875466817	EG	On-Demand	Anodyne	ACE	17	44
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC(c2ccccc2)C1	ZINC000875466817	EG	On-Demand	Anodyne	CTSK	23	40
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC(c2ccccc2)C1	ZINC000875466817	EG	On-Demand	Anodyne	REN	42	39
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC(c2ccccc2)C1	ZINC000875466817	EG	On-Demand	Anodyne	FPR1	46	38
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)CCc1cccc(C#N)c1	ZINC000875466844	FG	On-Demand	Mild	CTRB_BOVIN	56	36
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)CCc1cccc(C#N)c1	ZINC000875466845	FG	On-Demand	Mild	CTRB_BOVIN	56	36
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875466850	FG	On-Demand	Anodyne	ACE	32	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875466850	FG	On-Demand	Anodyne	KCNQ2	74	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2ccccc2N2CCCCC2)C1	ZINC000875466850	FG	On-Demand	Anodyne	DPP7	41	34
CC(=O)N1CCC[C@@H]1C(=O)Oc1ccc(C#N)cc1F	ZINC000875466857	CD	On-Demand	Mild	LGMN	58	34
C#CC[C@@H](CCOC)NC(=O)C(=O)NCC1CCN(CC2CC2)CC1	ZINC000875466865	EC	On-Demand	Mild	CACNA1I	41	31
C#CC[C@H](CCOC)NC(=O)C(=O)NCC1CCN(CC2CC2)CC1	ZINC000875466866	EC	On-Demand	Mild	CACNA1I	41	31
Cc1cc(OC(=O)C2CCN(C(C)C)CC2)ccc1F	ZINC000875466880	CG	On-Demand	Anodyne	HRH3	16	41
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CCc2nc(C3CC3)ncc2C1	ZINC000875466929	GF	On-Demand	Anodyne	MAPK1	49	37
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CCc2nc(C3CC3)ncc2C1	ZINC000875466930	GF	On-Demand	Anodyne	MAPK1	49	37
CCC(CC)(CNC(=O)C(=O)NCc1nonc1C)c1ccc(F)cc1	ZINC000875466957	FE	On-Demand	Anodyne	CACNA1G	36	41
CCCCCCCNC(=O)C(=O)NCc1cnccc1C(F)(F)F	ZINC000875466958	EF	On-Demand	Mild	ASAH1	86	41
Cc1nc(NC(=O)c2cc3c(Cl)nccc3o2)cc(C2CC2)n1	ZINC000875466966	EH	On-Demand	Anodyne	MAP3K12	41	38
COc1cccc([C@H]2[C@H](NC(=O)NC[C@H]3C[C@H](O)C3)CCN2C2CC2)c1	ZINC000875466985	FE	On-Demand	Anodyne	DRD4	40	31
COc1cccc([C@H]2[C@@H](NC(=O)NC[C@H]3C[C@H](O)C3)CCN2C2CC2)c1	ZINC000875466986	FE	On-Demand	Anodyne	DRD4	40	31
COc1ccccc1[C@H]1CCCN(C(=O)NCC(=O)NCC2CC2)CC1	ZINC000875467000	FF	On-Demand	Anodyne	DRD2	24	45
COc1ccccc1[C@H]1CCCN(C(=O)NCC(=O)NCC2CC2)CC1	ZINC000875467000	FF	On-Demand	Anodyne	RBP4	33	40
COc1ccccc1[C@H]1CCCN(C(=O)NCC(=O)NCC2CC2)CC1	ZINC000875467000	FF	On-Demand	Anodyne	MBTPS1	45	36
COc1ccccc1[C@@H]1CCCN(C(=O)NCC(=O)NCC2CC2)CC1	ZINC000875467001	FF	On-Demand	Anodyne	DRD2	24	45
COc1ccccc1[C@@H]1CCCN(C(=O)NCC(=O)NCC2CC2)CC1	ZINC000875467001	FF	On-Demand	Anodyne	RBP4	33	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCC(=O)NCC2CC2)CC1	ZINC000875467001	FF	On-Demand	Anodyne	MBTPS1	45	36
O=C(CNC(=O)NNc1ccc(OCc2ccccc2)cc1)NCC1CC1	ZINC000875467002	FE	On-Demand	Reactive	GRIN2B	28	41
O=C(CNC(=O)NNc1ccc(OCc2ccccc2)cc1)NCC1CC1	ZINC000875467002	FE	On-Demand	Reactive	LTA4H	38	49
O=C(CNC(=O)NNc1ccc(OCc2ccccc2)cc1)NCC1CC1	ZINC000875467002	FE	On-Demand	Reactive	ADAM17	17	47
O=C(CNC(=O)NNc1ccc(OCc2ccccc2)cc1)NCC1CC1	ZINC000875467002	FE	On-Demand	Reactive	F7	15	48
O=C(CNC(=O)NNc1ccc(OCc2ccccc2)cc1)NCC1CC1	ZINC000875467002	FE	On-Demand	Reactive	FFAR1	19	40
O=C(CNC(=O)NNc1ccc(OCc2ccccc2)cc1)NCC1CC1	ZINC000875467002	FE	On-Demand	Reactive	MBTPS1	18	41
Cc1nc(NC(=O)c2cc3ccnc(Cl)c3s2)cc(C2CC2)n1	ZINC000875467010	EI	On-Demand	Anodyne	TYK2	51	33
CCC(CC)(CNC(=O)C(=O)N[C@@H](C)c1ccnn1C)c1ccc(F)cc1	ZINC000875467023	FF	On-Demand	Anodyne	CACNA1G	36	42
CCC(CC)(CNC(=O)C(=O)N[C@H](C)c1ccnn1C)c1ccc(F)cc1	ZINC000875467024	FF	On-Demand	Anodyne	CACNA1G	36	42
CONC(=O)C1CCN(C(=O)NCCc2c[nH]c3cccc(OC)c23)CC1	ZINC000875467098	FD	On-Demand	Anodyne	MTNR1A	23	44
CONC(=O)C1CCN(C(=O)NCCc2c[nH]c3cccc(OC)c23)CC1	ZINC000875467098	FD	On-Demand	Anodyne	MTNR1B	18	41
CCCCCCCNC(=O)C(=O)NCc1ccnn1CC	ZINC000875467118	CD	On-Demand	Mild	ASAH1	98	39
Cc1nc(NC(=O)Cc2ccc(OCc3ccncc3)cc2)cc(C2CC2)n1	ZINC000875467136	FH	On-Demand	Anodyne	ADAM17	47	39
Cc1nc(NC(=O)Cc2ccc(OCc3ccncc3)cc2)cc(C2CC2)n1	ZINC000875467136	FH	On-Demand	Anodyne	MCHR1	18	42
Cc1ccc2nc(C(=O)Nc3cc(C4CC4)nc(C)n3)cn2c1	ZINC000875467159	DF	On-Demand	Anodyne	MAP3K5	53	45
N#CCc1ccsc1C(=O)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1	ZINC000875467160	GH	On-Demand	Mild	PAPA1_CARPA	47	40
N#CCc1ccsc1C(=O)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1	ZINC000875467160	GH	On-Demand	Mild	CTSK	16	40
N#CCc1ccsc1C(=O)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1	ZINC000875467160	GH	On-Demand	Mild	CTSL	43	40
N#CCc1ccsc1C(=O)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1	ZINC000875467160	GH	On-Demand	Mild	TIMP3	54	33
N#CCc1ccsc1C(=O)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1	ZINC000875467160	GH	On-Demand	Mild	CAPNS1	41	30
N#CCc1ccsc1C(=O)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1	ZINC000875467160	GH	On-Demand	Mild	CTSS	30	41
N#CCc1ccsc1C(=O)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1	ZINC000875467160	GH	On-Demand	Mild	CTSC	46	36
N#CCc1ccsc1C(=O)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1	ZINC000875467160	GH	On-Demand	Mild	CTRB_BOVIN	49	35
Cc1nc(NC(=O)Cc2ccccc2OCc2ccncc2)cc(C2CC2)n1	ZINC000875467161	FH	On-Demand	Anodyne	MAP3K12	40	40
Cc1nc(NC(=O)Cc2ccccc2OCc2ccncc2)cc(C2CC2)n1	ZINC000875467161	FH	On-Demand	Anodyne	GPR142	40	32
CC(C)(C)OC(=O)N1CC[C@H]2[C@H]1CCCN2C(=O)NCC(=O)NCC1CC1	ZINC000875467205	GD	On-Demand	Anodyne	PREP	15	42
CC(C)(C)OC(=O)N1CC[C@H]2[C@H]1CCCN2C(=O)NCC(=O)NCC1CC1	ZINC000875467205	GD	On-Demand	Anodyne	CACNA1I	41	33
CC(C)(C)OC(=O)N1CC[C@H]2[C@@H]1CCCN2C(=O)NCC(=O)NCC1CC1	ZINC000875467206	GD	On-Demand	Anodyne	PREP	15	42
CC(C)(C)OC(=O)N1CC[C@H]2[C@@H]1CCCN2C(=O)NCC(=O)NCC1CC1	ZINC000875467206	GD	On-Demand	Anodyne	CACNA1I	41	33
CC(C)(C)OC(=O)N1CC[C@@H]2[C@H]1CCCN2C(=O)NCC(=O)NCC1CC1	ZINC000875467207	GD	On-Demand	Anodyne	PREP	15	42
CC(C)(C)OC(=O)N1CC[C@@H]2[C@H]1CCCN2C(=O)NCC(=O)NCC1CC1	ZINC000875467207	GD	On-Demand	Anodyne	CACNA1I	41	33
CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H]1CCCN2C(=O)NCC(=O)NCC1CC1	ZINC000875467208	GD	On-Demand	Anodyne	PREP	15	42
CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H]1CCCN2C(=O)NCC(=O)NCC1CC1	ZINC000875467208	GD	On-Demand	Anodyne	CACNA1I	41	33
Cc1nc(NC(=O)C(C)(C)c2ccc(C#N)cc2)cc(C2CC2)n1	ZINC000875467232	DG	On-Demand	Mild	MAP3K12	45	40
COCC[C@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccc(C)o1	ZINC000875467249	EF	On-Demand	Anodyne	REN	15	44
COCC[C@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccc(C)o1	ZINC000875467250	EF	On-Demand	Anodyne	REN	15	44
COCC[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccc(C)o1	ZINC000875467251	EF	On-Demand	Anodyne	REN	15	44
COCC[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccc(C)o1	ZINC000875467252	EF	On-Demand	Anodyne	REN	15	44
Cc1nc(NC(=O)c2noc3c2CC(C)(C)CC3)cc(C2CC2)n1	ZINC000875467263	EG	On-Demand	Anodyne	PANC	53	35
Cc1ccc(-n2nccc2NC(=O)c2noc3c2CC(C)(C)CC3)nn1	ZINC000875467277	FF	On-Demand	Anodyne	PANC	51	33
CCC(CC)(CNC(=O)C(=O)N1CCC(C(C)=O)CC1)c1ccc(F)cc1	ZINC000875467342	GF	On-Demand	Anodyne	CACNA1G	49	58
Cc1ccc(-n2nccc2NC(=O)[C@H](Cc2cccnc2)C2CCCC2)nn1	ZINC000875467347	GG	On-Demand	Anodyne	C3AR1	41	41
Cc1ccc(-n2nccc2NC(=O)[C@@H](Cc2cccnc2)C2CCCC2)nn1	ZINC000875467348	GG	On-Demand	Anodyne	C3AR1	41	41
O=C(CNC(=O)N1CCC[C@](O)(c2ccccc2)C1)NCC1CC1	ZINC000875467429	ED	On-Demand	Anodyne	EPHX2	17	43
O=C(CNC(=O)N1CCC[C@@](O)(c2ccccc2)C1)NCC1CC1	ZINC000875467430	ED	On-Demand	Anodyne	EPHX2	17	43
COc1cccc([C@H]2[C@@H](NC(=O)N3CCCN(C=O)CC3)CCN2C2CC2)c1	ZINC000875467437	GD	On-Demand	Anodyne	HRH3	18	40
COc1cccc([C@H]2[C@@H](NC(=O)N3CCCN(C=O)CC3)CCN2C2CC2)c1	ZINC000875467437	GD	On-Demand	Anodyne	EPHX2	15	47
COc1cccc([C@H]2[C@H](NC(=O)N3CCCN(C=O)CC3)CCN2C2CC2)c1	ZINC000875467438	GD	On-Demand	Anodyne	HRH3	18	40
COc1cccc([C@H]2[C@H](NC(=O)N3CCCN(C=O)CC3)CCN2C2CC2)c1	ZINC000875467438	GD	On-Demand	Anodyne	EPHX2	15	47
C[C@@H](NC(=O)NC1(C)CC(F)(F)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875467453	FG	On-Demand	Anodyne	ACHE	30	40
C[C@@H](NC(=O)NC1(C)CC(F)(F)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875467453	FG	On-Demand	Anodyne	SIGMAR1	41	48
C[C@@H](NC(=O)NC1(C)CC(F)(F)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875467453	FG	On-Demand	Anodyne	BIRC2	23	41
C[C@H](NC(=O)NC1(C)CC(F)(F)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875467454	FG	On-Demand	Anodyne	ACHE	30	40
C[C@H](NC(=O)NC1(C)CC(F)(F)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875467454	FG	On-Demand	Anodyne	SIGMAR1	41	48
C[C@H](NC(=O)NC1(C)CC(F)(F)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875467454	FG	On-Demand	Anodyne	BIRC2	23	41
C[C@H](NC(=O)NC1(C)CC(F)(F)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875467455	FG	On-Demand	Anodyne	ACHE	30	40
C[C@H](NC(=O)NC1(C)CC(F)(F)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875467455	FG	On-Demand	Anodyne	SIGMAR1	41	48
C[C@H](NC(=O)NC1(C)CC(F)(F)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875467455	FG	On-Demand	Anodyne	BIRC2	23	41
C[C@@H](NC(=O)NC1(C)CC(F)(F)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875467456	FG	On-Demand	Anodyne	ACHE	30	40
C[C@@H](NC(=O)NC1(C)CC(F)(F)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875467456	FG	On-Demand	Anodyne	SIGMAR1	41	48
C[C@@H](NC(=O)NC1(C)CC(F)(F)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875467456	FG	On-Demand	Anodyne	BIRC2	23	41
C[C@@H](O)C1CCN(C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875467470	FF	On-Demand	Anodyne	DRD2	21	44
C[C@@H](O)C1CCN(C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875467470	FF	On-Demand	Anodyne	DRD4	52	44
C[C@@H](O)C1CCN(C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875467470	FF	On-Demand	Anodyne	ACHE	39	40
C[C@@H](O)C1CCN(C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875467470	FF	On-Demand	Anodyne	DRD3	15	40
C[C@@H](O)C1CCN(C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875467470	FF	On-Demand	Anodyne	SIGMAR1	51	52
C[C@@H](O)C1CCN(C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875467470	FF	On-Demand	Anodyne	CCR5	49	37
C[C@@H](O)C1CCN(C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875467470	FF	On-Demand	Anodyne	MLNR	45	36
C[C@@H](O)C1CCN(C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875467470	FF	On-Demand	Anodyne	MCHR1	18	42
C[C@@H](O)C1CCN(C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875467470	FF	On-Demand	Anodyne	BIRC2	32	45
C[C@@H](O)C1CCN(C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875467471	FF	On-Demand	Anodyne	DRD2	21	44
C[C@@H](O)C1CCN(C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875467471	FF	On-Demand	Anodyne	DRD4	52	44
C[C@@H](O)C1CCN(C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875467471	FF	On-Demand	Anodyne	ACHE	39	40
C[C@@H](O)C1CCN(C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875467471	FF	On-Demand	Anodyne	DRD3	15	40
C[C@@H](O)C1CCN(C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875467471	FF	On-Demand	Anodyne	SIGMAR1	51	52
C[C@@H](O)C1CCN(C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875467471	FF	On-Demand	Anodyne	CCR5	49	37
C[C@@H](O)C1CCN(C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875467471	FF	On-Demand	Anodyne	MLNR	45	36
C[C@@H](O)C1CCN(C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875467471	FF	On-Demand	Anodyne	MCHR1	18	42
C[C@@H](O)C1CCN(C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000875467471	FF	On-Demand	Anodyne	BIRC2	32	45
Cc1nc(NC(=O)c2ccc(-c3cnn(C)c3)cc2)cc(C2CC2)n1	ZINC000875467554	EG	On-Demand	Anodyne	HTR1F	46	40
Cc1nc(NC(=O)c2ccc(-c3cnn(C)c3)cc2)cc(C2CC2)n1	ZINC000875467554	EG	On-Demand	Anodyne	MCHR1	19	42
Cc1nc(NC(=O)c2ccc(-c3cnn(C)c3)cc2)cc(C2CC2)n1	ZINC000875467554	EG	On-Demand	Anodyne	MAP3K5	46	35
Cc1nc(NC(=O)Cc2ccc(Cl)cn2)cc(C2CC2)n1	ZINC000875467566	DF	On-Demand	Anodyne	F10	48	33
Cc1nc(NC(=O)COCc2ccnc(O)c2)cc(C2CC2)n1	ZINC000875467591	DD	On-Demand	Anodyne	MAP3K12	43	42
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1cc(C2CC2)nc(C)n1	ZINC000875467638	DG	On-Demand	Anodyne	PPARD	33	41
C[C@@](CO)(Cc1ccc(Cl)cc1)NC(=O)NCC(=O)NCC1CC1	ZINC000875467657	FD	On-Demand	Anodyne	CACNA1I	56	37
Cc1nc(NC(=O)C2(c3ccnc4ccccc34)CC2)cc(C2CC2)n1	ZINC000875467682	EH	On-Demand	Anodyne	ADAM17	52	33
Cc1nc(NC(=O)C2(c3ccnc4ccccc34)CC2)cc(C2CC2)n1	ZINC000875467682	EH	On-Demand	Anodyne	MAP3K12	41	39
Cc1nc(NC(=O)Cc2csc(COc3ccccc3)n2)cc(C2CC2)n1	ZINC000875467694	GH	On-Demand	Anodyne	ADAM17	59	35
Cc1nc(NC(=O)Cc2csc(COc3ccccc3)n2)cc(C2CC2)n1	ZINC000875467694	GH	On-Demand	Anodyne	CPT1A	47	35
Cc1nc(NC(=O)Cc2csc(COc3ccccc3)n2)cc(C2CC2)n1	ZINC000875467694	GH	On-Demand	Anodyne	MAP3K12	37	40
Cc1nc(NC(=O)Cn2ncc3cccnc32)cc(C2CC2)n1	ZINC000875467727	DE	On-Demand	Anodyne	MAP3K12	41	40
Cc1nc(NC(=O)C2(NC(=O)OCc3ccccc3)CC2)cc(C2CC2)n1	ZINC000875467766	FG	On-Demand	Anodyne	CTSK	23	49
Cc1nc(NC(=O)C2(NC(=O)OCc3ccccc3)CC2)cc(C2CC2)n1	ZINC000875467766	FG	On-Demand	Anodyne	SLC12A5	65	35
O=C(CNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1)NCC1CC1	ZINC000875467813	ED	On-Demand	Anodyne	CACNA1I	42	37
O=C(CNC(=O)NC[C@H](O)Cc1cccc(Cl)c1)NCC1CC1	ZINC000875467814	ED	On-Demand	Anodyne	CACNA1I	42	37
Cc1nc(NC(=O)c2cc3c(Cl)nccc3s2)cc(C2CC2)n1	ZINC000875467850	EI	On-Demand	Anodyne	TYK2	41	31
O=C(CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)NCC1CC1	ZINC000875467895	ED	On-Demand	Anodyne	F2	35	47
O=C(CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)NCC1CC1	ZINC000875467895	ED	On-Demand	Anodyne	PRSS1	25	47
O=C(CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1)NCC1CC1	ZINC000875467895	ED	On-Demand	Anodyne	PREP	47	39
O=C(CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)NCC1CC1	ZINC000875467896	ED	On-Demand	Anodyne	F2	35	47
O=C(CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)NCC1CC1	ZINC000875467896	ED	On-Demand	Anodyne	PRSS1	25	47
O=C(CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1)NCC1CC1	ZINC000875467896	ED	On-Demand	Anodyne	PREP	47	39
O=C(CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)NCC1CC1	ZINC000875467897	ED	On-Demand	Anodyne	F2	35	47
O=C(CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)NCC1CC1	ZINC000875467897	ED	On-Demand	Anodyne	PRSS1	25	47
O=C(CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1)NCC1CC1	ZINC000875467897	ED	On-Demand	Anodyne	PREP	47	39
O=C(CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)NCC1CC1	ZINC000875467898	ED	On-Demand	Anodyne	F2	35	47
O=C(CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)NCC1CC1	ZINC000875467898	ED	On-Demand	Anodyne	PRSS1	25	47
O=C(CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1)NCC1CC1	ZINC000875467898	ED	On-Demand	Anodyne	PREP	47	39
Cc1nc(NC(=O)Cc2cccc3ncccc23)cc(C2CC2)n1	ZINC000875467905	DG	On-Demand	Anodyne	ADAM17	67	35
Cc1nc(NC(=O)Cc2cccc3ncccc23)cc(C2CC2)n1	ZINC000875467905	DG	On-Demand	Anodyne	MAPK9	15	52
Cc1nc(NC(=O)Cc2cccc3ncccc23)cc(C2CC2)n1	ZINC000875467905	DG	On-Demand	Anodyne	MAPK8	15	52
Cc1nc(NC(=O)Cc2cccc3ncccc23)cc(C2CC2)n1	ZINC000875467905	DG	On-Demand	Anodyne	MAP3K12	40	40
COc1cccc(C(C)(C)C(=O)Nc2cc(C3CC3)nc(C)n2)c1	ZINC000875467906	EH	On-Demand	Anodyne	MAP3K12	39	44
Cc1nc(NC(=O)Cc2ccc3cccnc3c2)cc(C2CC2)n1	ZINC000875467913	DG	On-Demand	Anodyne	CDK5	22	46
Cc1nc(NC(=O)Cc2ccc3cccnc3c2)cc(C2CC2)n1	ZINC000875467913	DG	On-Demand	Anodyne	MAP3K12	41	40
O=C(CNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)NCC1CC1	ZINC000875467918	ED	On-Demand	Anodyne	DRD4	20	40
O=C(CNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)NCC1CC1	ZINC000875467918	ED	On-Demand	Anodyne	ACHE	25	40
O=C(CNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)NCC1CC1	ZINC000875467918	ED	On-Demand	Anodyne	SIGMAR1	34	41
O=C(CNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)NCC1CC1	ZINC000875467918	ED	On-Demand	Anodyne	NPFFR2	35	40
O=C(CNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)NCC1CC1	ZINC000875467918	ED	On-Demand	Anodyne	FAAH	15	40
O=C(CNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)NCC1CC1	ZINC000875467918	ED	On-Demand	Anodyne	NPFFR1	46	40
COc1cccc([C@H]2[C@@H](NC(=O)N3CCC([C@H](C)O)CC3)CCN2C2CC2)c1	ZINC000875467928	GF	On-Demand	Anodyne	EPHX2	16	49
COc1cccc([C@H]2[C@H](NC(=O)N3CCC([C@@H](C)O)CC3)CCN2C2CC2)c1	ZINC000875467929	GF	On-Demand	Anodyne	EPHX2	16	49
COc1cccc([C@H]2[C@@H](NC(=O)N3CCC([C@@H](C)O)CC3)CCN2C2CC2)c1	ZINC000875467930	GF	On-Demand	Anodyne	EPHX2	16	49
COc1cccc([C@H]2[C@H](NC(=O)N3CCC([C@H](C)O)CC3)CCN2C2CC2)c1	ZINC000875467931	GF	On-Demand	Anodyne	EPHX2	16	49
CCC(CC)(CNC(=O)C(=O)N1CCC(CO)(CO)CC1)c1ccc(F)cc1	ZINC000875467959	GD	On-Demand	Anodyne	CACNA1G	42	48
COC(=O)N(C)NC(=O)NCCc1c[nH]c2cccc(OC)c12	ZINC000875468019	DD	On-Demand	Reactive	NQO2	27	47
COC(=O)N(C)NC(=O)NCCc1c[nH]c2cccc(OC)c12	ZINC000875468019	DD	On-Demand	Reactive	MTNR1A	36	44
COC(=O)N(C)NC(=O)NCCc1c[nH]c2cccc(OC)c12	ZINC000875468019	DD	On-Demand	Reactive	MTNR1B	22	41
O=C(NC[C@H]1C[C@H](O)C1)NCC1(Cc2ccccc2)CCCC1	ZINC000875468074	DF	On-Demand	Anodyne	NPFFR2	18	41
O=C(NC[C@H]1C[C@H](O)C1)NCC1(Cc2ccccc2)CCCC1	ZINC000875468074	DF	On-Demand	Anodyne	NPFFR1	17	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468097	EF	On-Demand	Anodyne	DRD4	38	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468097	EF	On-Demand	Anodyne	ACHE	32	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468097	EF	On-Demand	Anodyne	SIGMAR1	39	47
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468097	EF	On-Demand	Anodyne	BIRC2	22	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468098	EF	On-Demand	Anodyne	DRD4	38	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468098	EF	On-Demand	Anodyne	ACHE	32	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468098	EF	On-Demand	Anodyne	SIGMAR1	39	47
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468098	EF	On-Demand	Anodyne	BIRC2	22	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468099	EF	On-Demand	Anodyne	DRD4	38	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468099	EF	On-Demand	Anodyne	ACHE	32	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468099	EF	On-Demand	Anodyne	SIGMAR1	39	47
CC[C@H](C[C@H](C)O)NC(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468099	EF	On-Demand	Anodyne	BIRC2	22	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468100	EF	On-Demand	Anodyne	DRD4	38	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468100	EF	On-Demand	Anodyne	ACHE	32	41
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468100	EF	On-Demand	Anodyne	SIGMAR1	39	47
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468100	EF	On-Demand	Anodyne	BIRC2	22	41
Cc1nnc(NNC(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)n1C	ZINC000875468112	FD	On-Demand	Reactive	SIGMAR1	28	43
Cc1nnc(NNC(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)n1C	ZINC000875468113	FD	On-Demand	Reactive	SIGMAR1	28	43
Cc1nnc(NNC(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)n1C	ZINC000875468114	FD	On-Demand	Reactive	SIGMAR1	28	43
Cc1nnc(NNC(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)n1C	ZINC000875468115	FD	On-Demand	Reactive	SIGMAR1	28	43
COC(=O)C1(O)CN(C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468275	FC	On-Demand	Anodyne	DRD2	15	42
COC(=O)C1(O)CN(C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468275	FC	On-Demand	Anodyne	DRD4	37	42
COC(=O)C1(O)CN(C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468275	FC	On-Demand	Anodyne	SIGMAR1	46	45
COC(=O)C1(O)CN(C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468275	FC	On-Demand	Anodyne	CTSK	15	40
COC(=O)C1(O)CN(C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468275	FC	On-Demand	Anodyne	BIRC2	24	42
COC(=O)C1(O)CN(C(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468276	FC	On-Demand	Anodyne	DRD2	15	42
COC(=O)C1(O)CN(C(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468276	FC	On-Demand	Anodyne	DRD4	37	42
COC(=O)C1(O)CN(C(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468276	FC	On-Demand	Anodyne	SIGMAR1	46	45
COC(=O)C1(O)CN(C(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468276	FC	On-Demand	Anodyne	CTSK	15	40
COC(=O)C1(O)CN(C(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468276	FC	On-Demand	Anodyne	BIRC2	24	42
COC(=O)C1(O)CN(C(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468277	FC	On-Demand	Anodyne	DRD2	15	42
COC(=O)C1(O)CN(C(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468277	FC	On-Demand	Anodyne	DRD4	37	42
COC(=O)C1(O)CN(C(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468277	FC	On-Demand	Anodyne	SIGMAR1	46	45
COC(=O)C1(O)CN(C(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468277	FC	On-Demand	Anodyne	CTSK	15	40
COC(=O)C1(O)CN(C(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468277	FC	On-Demand	Anodyne	BIRC2	24	42
COC(=O)C1(O)CN(C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468278	FC	On-Demand	Anodyne	DRD2	15	42
COC(=O)C1(O)CN(C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468278	FC	On-Demand	Anodyne	DRD4	37	42
COC(=O)C1(O)CN(C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468278	FC	On-Demand	Anodyne	SIGMAR1	46	45
COC(=O)C1(O)CN(C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468278	FC	On-Demand	Anodyne	CTSK	15	40
COC(=O)C1(O)CN(C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468278	FC	On-Demand	Anodyne	BIRC2	24	42
COC(=O)N(C)NC(=O)NCC1(Cc2ccccc2)CCCC1	ZINC000875468284	DF	On-Demand	Reactive	NPFFR2	20	40
COC(=O)N(C)NC(=O)NCC1(Cc2ccccc2)CCCC1	ZINC000875468284	DF	On-Demand	Reactive	NPFFR1	23	40
COC(=O)N(C)NC(=O)NCC1(Cc2ccccc2)CCCC1	ZINC000875468284	DF	On-Demand	Reactive	SLC12A5	46	37
COC(=O)N(C)NC(=O)NCC1(Cc2ccccc2)CCCC1	ZINC000875468284	DF	On-Demand	Reactive	HCN1	49	30
COC(=O)N(C)NC(=O)NCC1(Cc2ccccc2)CCCC1	ZINC000875468284	DF	On-Demand	Reactive	HCN4	47	30
CCC1(N(C)C)CCN(C(=O)NCCc2c[nH]c3cccc(OC)c23)CC1	ZINC000875468299	FG	On-Demand	Anodyne	NQO2	18	44
O=C(NCC1(Cc2ccccc2)CCCC1)N1CCC(CO)(CO)CC1	ZINC000875468368	FF	On-Demand	Anodyne	NPFFR2	23	49
O=C(NCC1(Cc2ccccc2)CCCC1)N1CCC(CO)(CO)CC1	ZINC000875468368	FF	On-Demand	Anodyne	SMO	15	43
O=C(NCC1(Cc2ccccc2)CCCC1)N1CCC(CO)(CO)CC1	ZINC000875468368	FF	On-Demand	Anodyne	NPFFR1	32	49
O=C(NCC1(Cc2ccccc2)CCCC1)N1CCC(CO)(CO)CC1	ZINC000875468368	FF	On-Demand	Anodyne	SLC12A5	48	36
O=C(NCC1(Cc2ccccc2)CCCC1)N1CCC(CO)(CO)CC1	ZINC000875468368	FF	On-Demand	Anodyne	HCN1	49	30
O=C(NCC1(Cc2ccccc2)CCCC1)N1CCC(CO)(CO)CC1	ZINC000875468368	FF	On-Demand	Anodyne	HCN4	47	30
Cc1nnc(NNC(=O)NCC2(Cc3ccccc3)CCCC2)n1C	ZINC000875468378	EF	On-Demand	Reactive	NPFFR2	22	41
Cc1nnc(NNC(=O)NCC2(Cc3ccccc3)CCCC2)n1C	ZINC000875468378	EF	On-Demand	Reactive	NPFFR1	31	41
Cc1nnc(NNC(=O)NCC2(Cc3ccccc3)CCCC2)n1C	ZINC000875468378	EF	On-Demand	Reactive	SLC12A5	45	34
O=CN1CCCN(C(=O)NCC2(Cc3ccccc3)CCCC2)CC1	ZINC000875468524	EF	On-Demand	Anodyne	NPFFR2	18	44
O=CN1CCCN(C(=O)NCC2(Cc3ccccc3)CCCC2)CC1	ZINC000875468524	EF	On-Demand	Anodyne	NPFFR1	25	44
O=CN1CCCN(C(=O)NCC2(Cc3ccccc3)CCCC2)CC1	ZINC000875468524	EF	On-Demand	Anodyne	SLC12A5	43	34
O=C(NCCO)C1CCN(C(=O)NCC2(Cc3ccccc3)CCCC2)CC1	ZINC000875468529	GE	On-Demand	Anodyne	NPFFR2	16	40
O=C(NCCO)C1CCN(C(=O)NCC2(Cc3ccccc3)CCCC2)CC1	ZINC000875468529	GE	On-Demand	Anodyne	EPHX2	15	40
O=C(NCCO)C1CCN(C(=O)NCC2(Cc3ccccc3)CCCC2)CC1	ZINC000875468529	GE	On-Demand	Anodyne	CACNA1G	35	44
O=C(NCCO)C1CCN(C(=O)NCC2(Cc3ccccc3)CCCC2)CC1	ZINC000875468529	GE	On-Demand	Anodyne	SMO	18	42
O=C(NCCO)C1CCN(C(=O)NCC2(Cc3ccccc3)CCCC2)CC1	ZINC000875468529	GE	On-Demand	Anodyne	NPFFR1	21	40
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468533	GG	On-Demand	Anodyne	ACHE	38	41
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468533	GG	On-Demand	Anodyne	SIGMAR1	36	44
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468533	GG	On-Demand	Anodyne	BIRC2	33	45
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468534	GG	On-Demand	Anodyne	ACHE	38	41
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468534	GG	On-Demand	Anodyne	SIGMAR1	36	44
C[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468534	GG	On-Demand	Anodyne	BIRC2	33	45
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468535	GG	On-Demand	Anodyne	ACHE	38	41
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468535	GG	On-Demand	Anodyne	SIGMAR1	36	44
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468535	GG	On-Demand	Anodyne	BIRC2	33	45
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468536	GG	On-Demand	Anodyne	ACHE	38	41
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468536	GG	On-Demand	Anodyne	SIGMAR1	36	44
C[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(CCO)C2)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468536	GG	On-Demand	Anodyne	BIRC2	33	45
CCn1nc(C)c(CN(C)C(=O)NCCc2c[nH]c3cccc(OC)c23)c1C	ZINC000875468539	GG	On-Demand	Anodyne	NQO2	17	41
C[C@H](NC(=O)NC[C@H]1CC(C(F)(F)F)=NO1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468548	GF	On-Demand	Anodyne	SIGMAR1	22	40
C[C@H](NC(=O)NC[C@H]1CC(C(F)(F)F)=NO1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468550	GF	On-Demand	Anodyne	SIGMAR1	22	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468569	GF	On-Demand	Anodyne	SLC6A4	24	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468569	GF	On-Demand	Anodyne	SLC6A3	57	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468569	GF	On-Demand	Anodyne	SIGMAR1	36	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468569	GF	On-Demand	Anodyne	BIRC2	33	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468570	GF	On-Demand	Anodyne	SLC6A4	24	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468570	GF	On-Demand	Anodyne	SLC6A3	57	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468570	GF	On-Demand	Anodyne	SIGMAR1	36	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468570	GF	On-Demand	Anodyne	BIRC2	33	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468571	GF	On-Demand	Anodyne	SLC6A4	24	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468571	GF	On-Demand	Anodyne	SLC6A3	57	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468571	GF	On-Demand	Anodyne	SIGMAR1	36	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468571	GF	On-Demand	Anodyne	BIRC2	33	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468572	GF	On-Demand	Anodyne	SLC6A4	24	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468572	GF	On-Demand	Anodyne	SLC6A3	57	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468572	GF	On-Demand	Anodyne	SIGMAR1	36	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468572	GF	On-Demand	Anodyne	BIRC2	33	42
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H](C)[C@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875468577	GF	On-Demand	Anodyne	DRD4	30	42
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H](C)[C@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875468577	GF	On-Demand	Anodyne	SIGMAR1	36	41
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H](C)[C@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875468577	GF	On-Demand	Anodyne	BIRC2	26	41
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H](C)[C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875468578	GF	On-Demand	Anodyne	DRD4	30	42
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H](C)[C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875468578	GF	On-Demand	Anodyne	SIGMAR1	36	41
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H](C)[C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875468578	GF	On-Demand	Anodyne	BIRC2	26	41
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H](C)[C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875468579	GF	On-Demand	Anodyne	DRD4	30	42
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H](C)[C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875468579	GF	On-Demand	Anodyne	SIGMAR1	36	41
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@H](C)[C@@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875468579	GF	On-Demand	Anodyne	BIRC2	26	41
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H](C)[C@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875468580	GF	On-Demand	Anodyne	DRD4	30	42
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H](C)[C@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875468580	GF	On-Demand	Anodyne	SIGMAR1	36	41
COC(=O)[C@@]12C[C@@H](NC(=O)N[C@@H](C)[C@H]3CCN(Cc4ccccc4)C3)C[C@@H]1C2	ZINC000875468580	GF	On-Demand	Anodyne	BIRC2	26	41
C[C@@H](NC(=O)N1CCCN(C=O)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468646	FD	On-Demand	Anodyne	DRD4	31	41
C[C@@H](NC(=O)N1CCCN(C=O)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468646	FD	On-Demand	Anodyne	SIGMAR1	38	45
C[C@@H](NC(=O)N1CCCN(C=O)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468646	FD	On-Demand	Anodyne	CCR3	15	42
C[C@@H](NC(=O)N1CCCN(C=O)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468646	FD	On-Demand	Anodyne	BIRC2	29	44
C[C@@H](NC(=O)N1CCCN(C=O)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468647	FD	On-Demand	Anodyne	DRD4	31	41
C[C@@H](NC(=O)N1CCCN(C=O)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468647	FD	On-Demand	Anodyne	SIGMAR1	38	45
C[C@@H](NC(=O)N1CCCN(C=O)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468647	FD	On-Demand	Anodyne	CCR3	15	42
C[C@@H](NC(=O)N1CCCN(C=O)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468647	FD	On-Demand	Anodyne	BIRC2	29	44
Cc1ccc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)cn1	ZINC000875468684	EI	On-Demand	Anodyne	MAPK10	15	47
Cc1ccc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)cn1	ZINC000875468684	EI	On-Demand	Anodyne	CSF1R	18	45
Cc1ccc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)cn1	ZINC000875468684	EI	On-Demand	Anodyne	BTK	24	42
Cc1ccc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)cn1	ZINC000875468684	EI	On-Demand	Anodyne	KCNK3	87	39
Cc1ccc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)cn1	ZINC000875468684	EI	On-Demand	Anodyne	KCNK9	48	37
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468701	GG	On-Demand	Anodyne	CHRM2	17	45
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468701	GG	On-Demand	Anodyne	DRD2	15	41
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468701	GG	On-Demand	Anodyne	DRD4	39	41
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468701	GG	On-Demand	Anodyne	GHRHR	53	35
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468701	GG	On-Demand	Anodyne	CHRM3	20	45
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468701	GG	On-Demand	Anodyne	SIGMAR1	53	45
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468701	GG	On-Demand	Anodyne	BIRC2	27	42
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468703	GG	On-Demand	Anodyne	CHRM2	17	45
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468703	GG	On-Demand	Anodyne	DRD2	15	41
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468703	GG	On-Demand	Anodyne	DRD4	39	41
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468703	GG	On-Demand	Anodyne	GHRHR	53	35
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468703	GG	On-Demand	Anodyne	CHRM3	20	45
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468703	GG	On-Demand	Anodyne	SIGMAR1	53	45
C[C@@H](NC(=O)N1CCC2(CCN(C)CC2)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468703	GG	On-Demand	Anodyne	BIRC2	27	42
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468730	ED	On-Demand	Anodyne	DRD2	15	42
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468730	ED	On-Demand	Anodyne	DRD4	36	42
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468730	ED	On-Demand	Anodyne	ACHE	39	44
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468730	ED	On-Demand	Anodyne	HTR4	35	43
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468730	ED	On-Demand	Anodyne	SIGMAR1	42	46
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468730	ED	On-Demand	Anodyne	CACNA1I	40	35
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468730	ED	On-Demand	Anodyne	BIRC2	21	41
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468732	ED	On-Demand	Anodyne	DRD2	15	42
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468732	ED	On-Demand	Anodyne	DRD4	36	42
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468732	ED	On-Demand	Anodyne	ACHE	39	44
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468732	ED	On-Demand	Anodyne	HTR4	35	43
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468732	ED	On-Demand	Anodyne	SIGMAR1	42	46
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468732	ED	On-Demand	Anodyne	CACNA1I	40	35
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468732	ED	On-Demand	Anodyne	BIRC2	21	41
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468733	ED	On-Demand	Anodyne	DRD2	15	42
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468733	ED	On-Demand	Anodyne	DRD4	36	42
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468733	ED	On-Demand	Anodyne	ACHE	39	44
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468733	ED	On-Demand	Anodyne	HTR4	35	43
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468733	ED	On-Demand	Anodyne	SIGMAR1	42	46
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468733	ED	On-Demand	Anodyne	CACNA1I	40	35
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468733	ED	On-Demand	Anodyne	BIRC2	21	41
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468735	ED	On-Demand	Anodyne	DRD2	15	42
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468735	ED	On-Demand	Anodyne	DRD4	36	42
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468735	ED	On-Demand	Anodyne	ACHE	39	44
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468735	ED	On-Demand	Anodyne	HTR4	35	43
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468735	ED	On-Demand	Anodyne	SIGMAR1	42	46
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468735	ED	On-Demand	Anodyne	CACNA1I	40	35
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468735	ED	On-Demand	Anodyne	BIRC2	21	41
C[C@@H](NC(=O)N1Cc2cccc(O)c2C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468748	FG	On-Demand	Clean	DRD2	18	44
C[C@@H](NC(=O)N1Cc2cccc(O)c2C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468748	FG	On-Demand	Clean	DRD4	42	44
C[C@@H](NC(=O)N1Cc2cccc(O)c2C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468748	FG	On-Demand	Clean	ACHE	30	40
C[C@@H](NC(=O)N1Cc2cccc(O)c2C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468748	FG	On-Demand	Clean	SIGMAR1	38	46
C[C@@H](NC(=O)N1Cc2cccc(O)c2C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468748	FG	On-Demand	Clean	BIRC2	24	41
C[C@@H](NC(=O)N1Cc2cccc(O)c2C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468748	FG	On-Demand	Clean	NOD2	40	35
C[C@H](NC(=O)N1Cc2cccc(O)c2C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468749	FG	On-Demand	Clean	DRD2	18	44
C[C@H](NC(=O)N1Cc2cccc(O)c2C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468749	FG	On-Demand	Clean	DRD4	42	44
C[C@H](NC(=O)N1Cc2cccc(O)c2C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468749	FG	On-Demand	Clean	ACHE	30	40
C[C@H](NC(=O)N1Cc2cccc(O)c2C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468749	FG	On-Demand	Clean	SIGMAR1	38	46
C[C@H](NC(=O)N1Cc2cccc(O)c2C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468749	FG	On-Demand	Clean	BIRC2	24	41
C[C@H](NC(=O)N1Cc2cccc(O)c2C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468749	FG	On-Demand	Clean	NOD2	40	35
C[C@@H](NC(=O)N1Cc2cccc(O)c2C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468750	FG	On-Demand	Clean	DRD2	18	44
C[C@@H](NC(=O)N1Cc2cccc(O)c2C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468750	FG	On-Demand	Clean	DRD4	42	44
C[C@@H](NC(=O)N1Cc2cccc(O)c2C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468750	FG	On-Demand	Clean	ACHE	30	40
C[C@@H](NC(=O)N1Cc2cccc(O)c2C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468750	FG	On-Demand	Clean	SIGMAR1	38	46
C[C@@H](NC(=O)N1Cc2cccc(O)c2C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468750	FG	On-Demand	Clean	BIRC2	24	41
C[C@@H](NC(=O)N1Cc2cccc(O)c2C1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468750	FG	On-Demand	Clean	NOD2	40	35
C[C@H](NC(=O)N1Cc2cccc(O)c2C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468751	FG	On-Demand	Clean	DRD2	18	44
C[C@H](NC(=O)N1Cc2cccc(O)c2C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468751	FG	On-Demand	Clean	DRD4	42	44
C[C@H](NC(=O)N1Cc2cccc(O)c2C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468751	FG	On-Demand	Clean	ACHE	30	40
C[C@H](NC(=O)N1Cc2cccc(O)c2C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468751	FG	On-Demand	Clean	SIGMAR1	38	46
C[C@H](NC(=O)N1Cc2cccc(O)c2C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468751	FG	On-Demand	Clean	BIRC2	24	41
C[C@H](NC(=O)N1Cc2cccc(O)c2C1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468751	FG	On-Demand	Clean	NOD2	40	35
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468770	GF	On-Demand	Anodyne	CHRM2	20	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468770	GF	On-Demand	Anodyne	ACE	36	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468770	GF	On-Demand	Anodyne	DRD2	17	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468770	GF	On-Demand	Anodyne	DRD4	43	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468770	GF	On-Demand	Anodyne	ACHE	33	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468770	GF	On-Demand	Anodyne	CHRM3	27	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468770	GF	On-Demand	Anodyne	SIGMAR1	42	48
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468770	GF	On-Demand	Anodyne	CCR5	49	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468770	GF	On-Demand	Anodyne	BIRC2	30	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468771	GF	On-Demand	Anodyne	CHRM2	20	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468771	GF	On-Demand	Anodyne	ACE	36	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468771	GF	On-Demand	Anodyne	DRD2	17	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468771	GF	On-Demand	Anodyne	DRD4	43	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468771	GF	On-Demand	Anodyne	ACHE	33	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468771	GF	On-Demand	Anodyne	CHRM3	27	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468771	GF	On-Demand	Anodyne	SIGMAR1	42	48
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468771	GF	On-Demand	Anodyne	CCR5	49	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468771	GF	On-Demand	Anodyne	BIRC2	30	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468772	GF	On-Demand	Anodyne	CHRM2	20	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468772	GF	On-Demand	Anodyne	ACE	36	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468772	GF	On-Demand	Anodyne	DRD2	17	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468772	GF	On-Demand	Anodyne	DRD4	43	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468772	GF	On-Demand	Anodyne	ACHE	33	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468772	GF	On-Demand	Anodyne	CHRM3	27	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468772	GF	On-Demand	Anodyne	SIGMAR1	42	48
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468772	GF	On-Demand	Anodyne	CCR5	49	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468772	GF	On-Demand	Anodyne	BIRC2	30	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468773	GF	On-Demand	Anodyne	CHRM2	20	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468773	GF	On-Demand	Anodyne	ACE	36	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468773	GF	On-Demand	Anodyne	DRD2	17	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468773	GF	On-Demand	Anodyne	DRD4	43	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468773	GF	On-Demand	Anodyne	ACHE	33	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468773	GF	On-Demand	Anodyne	CHRM3	27	43
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468773	GF	On-Demand	Anodyne	SIGMAR1	42	48
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468773	GF	On-Demand	Anodyne	CCR5	49	38
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H](C)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000875468773	GF	On-Demand	Anodyne	BIRC2	30	43
C[C@@H](NC(=O)N(C)OCC(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468899	FG	On-Demand	Anodyne	DRD4	33	42
C[C@@H](NC(=O)N(C)OCC(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468899	FG	On-Demand	Anodyne	ACHE	33	41
C[C@@H](NC(=O)N(C)OCC(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468899	FG	On-Demand	Anodyne	LTA4H	17	44
C[C@@H](NC(=O)N(C)OCC(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468899	FG	On-Demand	Anodyne	SIGMAR1	37	44
C[C@@H](NC(=O)N(C)OCC(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468899	FG	On-Demand	Anodyne	CCR5	63	39
C[C@@H](NC(=O)N(C)OCC(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468899	FG	On-Demand	Anodyne	MCHR1	26	41
C[C@@H](NC(=O)N(C)OCC(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468900	FG	On-Demand	Anodyne	DRD4	33	42
C[C@@H](NC(=O)N(C)OCC(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468900	FG	On-Demand	Anodyne	ACHE	33	41
C[C@@H](NC(=O)N(C)OCC(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468900	FG	On-Demand	Anodyne	LTA4H	17	44
C[C@@H](NC(=O)N(C)OCC(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468900	FG	On-Demand	Anodyne	SIGMAR1	37	44
C[C@@H](NC(=O)N(C)OCC(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468900	FG	On-Demand	Anodyne	CCR5	63	39
C[C@@H](NC(=O)N(C)OCC(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468900	FG	On-Demand	Anodyne	MCHR1	26	41
COc1ccccc1[C@H]1CCCN(C(=O)N[C@H](C)c2ncc(C)o2)CC1	ZINC000875468909	FI	On-Demand	Anodyne	SMO	22	40
COc1ccccc1[C@H]1CCCN(C(=O)N[C@@H](C)c2ncc(C)o2)CC1	ZINC000875468910	FI	On-Demand	Anodyne	SMO	22	40
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H](C)c2ncc(C)o2)CC1	ZINC000875468911	FI	On-Demand	Anodyne	SMO	22	40
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H](C)c2ncc(C)o2)CC1	ZINC000875468912	FI	On-Demand	Anodyne	SMO	22	40
CCC[C@@H](CCO)NC(=O)NCCc1c[nH]c2cccc(OC)c12	ZINC000875468915	EF	On-Demand	Anodyne	MTNR1A	17	45
CCC[C@H](CCO)NC(=O)NCCc1c[nH]c2cccc(OC)c12	ZINC000875468916	EF	On-Demand	Anodyne	MTNR1A	17	45
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468976	GD	On-Demand	Anodyne	DRD2	15	42
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468976	GD	On-Demand	Anodyne	DRD4	40	42
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468976	GD	On-Demand	Anodyne	GHRHR	54	34
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468976	GD	On-Demand	Anodyne	SIGMAR1	52	47
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468976	GD	On-Demand	Anodyne	TIMP3	50	32
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468976	GD	On-Demand	Anodyne	BIRC2	24	43
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468977	GD	On-Demand	Anodyne	DRD2	15	42
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468977	GD	On-Demand	Anodyne	DRD4	40	42
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468977	GD	On-Demand	Anodyne	GHRHR	54	34
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468977	GD	On-Demand	Anodyne	SIGMAR1	52	47
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468977	GD	On-Demand	Anodyne	TIMP3	50	32
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468977	GD	On-Demand	Anodyne	BIRC2	24	43
COC(=O)N(C)NC(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468983	ED	On-Demand	Reactive	DRD4	43	39
COC(=O)N(C)NC(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468983	ED	On-Demand	Reactive	ACHE	37	40
COC(=O)N(C)NC(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468983	ED	On-Demand	Reactive	LTA4H	19	40
COC(=O)N(C)NC(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468983	ED	On-Demand	Reactive	SIGMAR1	44	46
COC(=O)N(C)NC(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468983	ED	On-Demand	Reactive	CCR5	47	41
COC(=O)N(C)NC(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468983	ED	On-Demand	Reactive	SLC18A3	17	40
COC(=O)N(C)NC(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468983	ED	On-Demand	Reactive	BIRC2	23	41
COC(=O)N(C)NC(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468984	ED	On-Demand	Reactive	DRD4	43	39
COC(=O)N(C)NC(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468984	ED	On-Demand	Reactive	ACHE	37	40
COC(=O)N(C)NC(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468984	ED	On-Demand	Reactive	LTA4H	19	40
COC(=O)N(C)NC(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468984	ED	On-Demand	Reactive	SIGMAR1	44	46
COC(=O)N(C)NC(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468984	ED	On-Demand	Reactive	CCR5	47	41
COC(=O)N(C)NC(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468984	ED	On-Demand	Reactive	SLC18A3	17	40
COC(=O)N(C)NC(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468984	ED	On-Demand	Reactive	BIRC2	23	41
COC(=O)N(C)NC(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468985	ED	On-Demand	Reactive	DRD4	43	39
COC(=O)N(C)NC(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468985	ED	On-Demand	Reactive	ACHE	37	40
COC(=O)N(C)NC(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468985	ED	On-Demand	Reactive	LTA4H	19	40
COC(=O)N(C)NC(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468985	ED	On-Demand	Reactive	SIGMAR1	44	46
COC(=O)N(C)NC(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468985	ED	On-Demand	Reactive	CCR5	47	41
COC(=O)N(C)NC(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468985	ED	On-Demand	Reactive	SLC18A3	17	40
COC(=O)N(C)NC(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875468985	ED	On-Demand	Reactive	BIRC2	23	41
COC(=O)N(C)NC(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468986	ED	On-Demand	Reactive	DRD4	43	39
COC(=O)N(C)NC(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468986	ED	On-Demand	Reactive	ACHE	37	40
COC(=O)N(C)NC(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468986	ED	On-Demand	Reactive	LTA4H	19	40
COC(=O)N(C)NC(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468986	ED	On-Demand	Reactive	SIGMAR1	44	46
COC(=O)N(C)NC(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468986	ED	On-Demand	Reactive	CCR5	47	41
COC(=O)N(C)NC(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468986	ED	On-Demand	Reactive	SLC18A3	17	40
COC(=O)N(C)NC(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875468986	ED	On-Demand	Reactive	BIRC2	23	41
CC[C@H](C[C@H](C)O)NC(=O)NCCc1c[nH]c2cccc(OC)c12	ZINC000875469000	EF	On-Demand	Anodyne	MTNR1A	15	42
CCc1sc(NC(=O)[C@@H](C)n2ccc(C(F)(F)F)n2)c(C(N)=O)c1C	ZINC000875469111	FG	On-Demand	Anodyne	CARM1	42	34
CCc1sc(NC(=O)[C@H](C)n2ccc(C(F)(F)F)n2)c(C(N)=O)c1C	ZINC000875469113	FG	On-Demand	Anodyne	CARM1	42	34
CCc1sc(NC(=O)c2cccc(C(F)F)c2F)c(C(N)=O)c1C	ZINC000875469126	FI	On-Demand	Anodyne	KCNK3	40	32
CC(C)c1nnc2n1C[C@H](NC(=O)NCc1ccc(OC(F)F)cc1F)CC2	ZINC000875469156	GF	On-Demand	Anodyne	TRPV1	47	33
CC(C)c1nnc2n1C[C@H](NC(=O)NCc1ccc(OC(F)F)cc1F)CC2	ZINC000875469156	GF	On-Demand	Anodyne	P2RX7	40	36
CC(C)c1nnc2n1C[C@@H](NC(=O)NCc1ccc(OC(F)F)cc1F)CC2	ZINC000875469158	GF	On-Demand	Anodyne	TRPV1	47	33
CC(C)c1nnc2n1C[C@@H](NC(=O)NCc1ccc(OC(F)F)cc1F)CC2	ZINC000875469158	GF	On-Demand	Anodyne	P2RX7	40	36
CCc1sc(NC(=O)[C@H]2CCCN2C(C)=O)c(C(N)=O)c1C	ZINC000875469192	DD	On-Demand	Anodyne	LGMN	95	43
Cc1nc2c(s1)[C@H](NC(=O)NCc1nc(-c3ccncc3)cs1)CCC2	ZINC000875469196	GH	On-Demand	Anodyne	ROCK1	20	40
C[C@@H](NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)[C@H]1CCCOC1	ZINC000875469449	EE	On-Demand	Anodyne	BIRC2	21	40
C[C@@H](NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)[C@@H]1CCCOC1	ZINC000875469451	EE	On-Demand	Anodyne	BIRC2	21	40
CCc1sc(NC(=O)c2ncccc2OC)c(C(N)=O)c1C	ZINC000875469631	DE	On-Demand	Anodyne	MAP1	85	44
Cc1nc2c(s1)[C@H](NC(=O)Nc1cnn(Cc3ccc(C#N)cc3)c1)CCC2	ZINC000875469832	GH	On-Demand	Mild	ITK	15	44
Cc1nc2c(s1)[C@H](NC(=O)Nc1cnn(Cc3ccc(C#N)cc3)c1)CCC2	ZINC000875469832	GH	On-Demand	Mild	PANC	52	35
Cc1nc2c(s1)[C@@H](NC(=O)Nc1cnn(Cc3ccc(C#N)cc3)c1)CCC2	ZINC000875469833	GH	On-Demand	Mild	ITK	15	44
Cc1nc2c(s1)[C@@H](NC(=O)Nc1cnn(Cc3ccc(C#N)cc3)c1)CCC2	ZINC000875469833	GH	On-Demand	Mild	PANC	52	35
Cc1nc2c(s1)[C@H](NC(=O)NCc1cccc3ncccc13)CCC2	ZINC000875469879	FH	On-Demand	Anodyne	CDK5	24	41
CCc1sc(NC(=O)[C@@H]2C[C@H]2c2ccsc2)c(C(N)=O)c1C	ZINC000875469881	EH	On-Demand	Anodyne	NPBWR1	46	33
O=C(Oc1cc(F)ccc1Br)c1cncc(N2CCCC2)n1	ZINC000875470089	FG	On-Demand	Anodyne	SCD1	17	49
CCc1nnc2n1C[C@H](NC(=O)NCc1cc(Cl)cc(Cl)c1F)CC2	ZINC000875470192	GG	On-Demand	Anodyne	P2RX7	45	35
CCc1nnc2n1C[C@@H](NC(=O)NCc1cc(Cl)cc(Cl)c1F)CC2	ZINC000875470194	GG	On-Demand	Anodyne	P2RX7	45	35
Cn1nc(Cl)c(C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1Cl	ZINC000875470225	FG	On-Demand	Bother	CACNA1D	49	34
Cn1nc(Cl)c(C(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1Cl	ZINC000875470225	FG	On-Demand	Bother	SLC6A9	32	47
Cc1nc2c(s1)[C@H](NC(=O)N[C@H]1Cc3ccccc3NC1=O)CCC2	ZINC000875470258	FF	On-Demand	Anodyne	PYGM	15	41
Cc1nc2c(s1)[C@H](NC(=O)N[C@@H]1Cc3ccccc3NC1=O)CCC2	ZINC000875470262	FF	On-Demand	Anodyne	PYGM	15	41
Cc1nc2c(s1)[C@H](NC(=O)NCc1cccc(F)c1F)CCC2	ZINC000875470406	EH	On-Demand	Anodyne	P2RX7	16	42
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cc(F)ccc1Br	ZINC000875470643	EG	On-Demand	Anodyne	ANPEP	24	41
CC(=O)N[C@H](CC(C)C)C(=O)Oc1cc(F)ccc1Br	ZINC000875470643	EG	On-Demand	Anodyne	HPN	61	33
CC(C)c1nnc2n1C[C@@H](NC(=O)N1CC[C@H](Oc3ccc(F)cc3)C1)CC2	ZINC000875470682	GF	On-Demand	Anodyne	EPHX2	22	44
CC(C)c1nnc2n1C[C@H](NC(=O)N1CC[C@H](Oc3ccc(F)cc3)C1)CC2	ZINC000875470683	GF	On-Demand	Anodyne	EPHX2	22	44
Cc1nc2c(s1)[C@H](NC(=O)N[C@@H]1C[C@H]1c1ccsc1)CCC2	ZINC000875470887	EH	On-Demand	Anodyne	NPBWR1	61	31
Cc1cccc(COC(=O)C2CCN(C(C)C)CC2)n1	ZINC000875470919	CF	On-Demand	Anodyne	PDE6D	50	34
C[C@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)[C@@H]1CCCOC1	ZINC000875471008	FF	On-Demand	Mild	ITK	17	47
C[C@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)[C@@H]1CCCOC1	ZINC000875471008	FF	On-Demand	Mild	PANC	56	37
C[C@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)[C@H]1CCCOC1	ZINC000875471009	FF	On-Demand	Mild	ITK	17	47
C[C@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)[C@H]1CCCOC1	ZINC000875471009	FF	On-Demand	Mild	PANC	56	37
COc1cccc([C@H](O)C2CCN(C(=O)N[C@H]3CCc4nnc(C)n4C3)CC2)c1	ZINC000875471175	GE	On-Demand	Anodyne	DRD4	40	31
COc1cccc([C@H](O)C2CCN(C(=O)N[C@@H]3CCc4nnc(C)n4C3)CC2)c1	ZINC000875471181	GE	On-Demand	Anodyne	DRD4	40	31
CCOC1CC2(C1)C[C@H]2C(=O)N(CC(=O)OC)[C@@H](CC)c1ccccc1	ZINC000875471325	FG	On-Demand	Anodyne	TIMP3	65	32
CCOC1CC2(C1)C[C@H]2C(=O)N(CC(=O)OC)[C@H](CC)c1ccccc1	ZINC000875471326	FG	On-Demand	Anodyne	TIMP3	65	32
Cn1nc(Cl)c(C(=O)Nc2ccc(F)cc2OC2CCCC2)c1Cl	ZINC000875471343	FI	On-Demand	Anodyne	SCD1	29	41
CCc1nnc2n1C[C@H](NC(=O)NCc1ccc(OC(F)F)cc1F)CC2	ZINC000875471386	GE	On-Demand	Anodyne	P2RX7	40	35
CCc1nnc2n1C[C@@H](NC(=O)NCc1ccc(OC(F)F)cc1F)CC2	ZINC000875471387	GE	On-Demand	Anodyne	P2RX7	40	35
C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875471563	EF	On-Demand	Anodyne	SLC16A1	41	33
C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875471564	EF	On-Demand	Anodyne	SLC16A1	41	33
COCC[C@H](NC(=O)NC[C@H](O)Cc1cccc(Cl)c1)c1ccco1	ZINC000875471569	FF	On-Demand	Anodyne	CTSV	33	40
COCC[C@H](NC(=O)NC[C@@H](O)Cc1cccc(Cl)c1)c1ccco1	ZINC000875471570	FF	On-Demand	Anodyne	CTSV	33	40
COCC[C@@H](NC(=O)NC[C@H](O)Cc1cccc(Cl)c1)c1ccco1	ZINC000875471571	FF	On-Demand	Anodyne	CTSV	33	40
COCC[C@@H](NC(=O)NC[C@@H](O)Cc1cccc(Cl)c1)c1ccco1	ZINC000875471572	FF	On-Demand	Anodyne	CTSV	33	40
CCCCCCCNC(=O)C(=O)NCc1ccc(Br)cn1	ZINC000875471644	FF	On-Demand	Mild	ASAH1	85	36
CCc1nnc2n1C[C@@H](NC(=O)N1CC[C@H](Oc3ccc(F)cc3)C1)CC2	ZINC000875471646	FE	On-Demand	Anodyne	MLNR	23	40
CCc1nnc2n1C[C@@H](NC(=O)N1CC[C@H](Oc3ccc(F)cc3)C1)CC2	ZINC000875471646	FE	On-Demand	Anodyne	EPHX2	24	46
CCc1nnc2n1C[C@H](NC(=O)N1CC[C@H](Oc3ccc(F)cc3)C1)CC2	ZINC000875471648	FE	On-Demand	Anodyne	MLNR	23	40
CCc1nnc2n1C[C@H](NC(=O)N1CC[C@H](Oc3ccc(F)cc3)C1)CC2	ZINC000875471648	FE	On-Demand	Anodyne	EPHX2	24	46
CCc1nnc2n1C[C@H](NC(=O)N1CCc3cc(OC)c(OC)cc3[C@@H]1C)CC2	ZINC000875471751	GF	On-Demand	Anodyne	SLC18A2	45	33
CCc1nnc2n1C[C@@H](NC(=O)N1CCc3cc(OC)c(OC)cc3[C@H]1C)CC2	ZINC000875471752	GF	On-Demand	Anodyne	SLC18A2	45	33
CCc1nnc2n1C[C@H](NC(=O)N1CCc3cc(OC)c(OC)cc3[C@H]1C)CC2	ZINC000875471753	GF	On-Demand	Anodyne	SLC18A2	45	33
CCc1nnc2n1C[C@@H](NC(=O)N1CCc3cc(OC)c(OC)cc3[C@@H]1C)CC2	ZINC000875471754	GF	On-Demand	Anodyne	SLC18A2	45	33
O=C(NC[C@@H]1CC(=O)N(C2CC2)C1)NNc1ccc(OCc2ccccc2)cc1	ZINC000875471885	GF	On-Demand	Reactive	LTA4H	23	42
O=C(NC[C@H]1CC(=O)N(C2CC2)C1)NNc1ccc(OCc2ccccc2)cc1	ZINC000875471887	GF	On-Demand	Reactive	LTA4H	23	42
CCCCCCCNC(=O)C(=O)NC[C@H]1c2ccccc2CN1C	ZINC000875471888	EE	On-Demand	Mild	ASAH1	85	37
CCCCCCCNC(=O)C(=O)NC[C@@H]1c2ccccc2CN1C	ZINC000875471891	EE	On-Demand	Mild	ASAH1	85	37
COCC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccco1	ZINC000875471893	EE	On-Demand	Anodyne	SLC6A4	22	41
COCC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccco1	ZINC000875471893	EE	On-Demand	Anodyne	SLC6A3	43	41
COCC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccco1	ZINC000875471895	EE	On-Demand	Anodyne	SLC6A4	22	41
COCC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2)c1ccco1	ZINC000875471895	EE	On-Demand	Anodyne	SLC6A3	43	41
COCC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccco1	ZINC000875471897	EE	On-Demand	Anodyne	SLC6A4	22	41
COCC[C@@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccco1	ZINC000875471897	EE	On-Demand	Anodyne	SLC6A3	43	41
COCC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccco1	ZINC000875471899	EE	On-Demand	Anodyne	SLC6A4	22	41
COCC[C@H](NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2)c1ccco1	ZINC000875471899	EE	On-Demand	Anodyne	SLC6A3	43	41
COc1ccccc1[C@H]1CCCN(C(=O)NCCNC(=O)c2cc[nH]n2)CC1	ZINC000875471907	GE	On-Demand	Anodyne	DRD2	22	43
COc1ccccc1[C@H]1CCCN(C(=O)NCCNC(=O)c2cc[nH]n2)CC1	ZINC000875471907	GE	On-Demand	Anodyne	DRD4	15	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCCNC(=O)c2cc[nH]n2)CC1	ZINC000875471909	GE	On-Demand	Anodyne	DRD2	22	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCCNC(=O)c2cc[nH]n2)CC1	ZINC000875471909	GE	On-Demand	Anodyne	DRD4	15	43
CCCCCCCNC(=O)C(=O)NCc1nn(C)cc1C(F)F	ZINC000875471911	EE	On-Demand	Mild	ASAH1	95	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	F2	68	48
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	PLG	40	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	PRSS1	27	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	ACE	97	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	OPRM1	48	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	OPRD1	36	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	P2RY12	74	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	CELA1	33	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	ELANE	29	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	MME	61	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	TACR1	23	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	TRHR	51	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	PGC	52	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	CMA1	43	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	CTRA_BOVIN	81	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	PRCP	19	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	KLK3	60	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	CTSB	44	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	PAPA1_CARPA	41	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	TRY1_BOVIN	91	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	CYSP_TRYCR	61	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	NTSR1	104	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	NTSR2	57	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	CTSG	53	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	CTSK	44	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	CTSL	45	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	NPFFR2	52	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	TIMP3	78	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	DPP4	15	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	PREP	41	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	CAPNS1	75	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	HLA-DRB1	68	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	CELA2A	73	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	REN	97	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	REN1	50	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	LGMN	47	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	PLAT	15	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	CAPN1	85	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	CTRC	16	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	CAPN2	87	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	CTSE	52	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	ACE2	79	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	TGM2	20	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	KLK1	26	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	FPR1	40	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	CTRB_BOVIN	47	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	GAG-PRO	40	31
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	XIAP	42	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	BRCA1	69	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000875471968	FE	On-Demand	Anodyne	TMPRSS11D	57	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	F2	68	48
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	PLG	40	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	PRSS1	27	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	ACE	97	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	OPRM1	48	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	OPRD1	36	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	P2RY12	74	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	CELA1	33	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	ELANE	29	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	MME	61	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	TACR1	23	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	TRHR	51	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	PGC	52	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	CMA1	43	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	CTRA_BOVIN	81	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	PRCP	19	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	KLK3	60	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	CTSB	44	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	PAPA1_CARPA	41	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	TRY1_BOVIN	91	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	CYSP_TRYCR	61	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	NTSR1	104	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	NTSR2	57	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	CTSG	53	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	CTSK	44	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	CTSL	45	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	NPFFR2	52	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	TIMP3	78	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	DPP4	15	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	PREP	41	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	CAPNS1	75	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	HLA-DRB1	68	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	CELA2A	73	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	REN	97	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	REN1	50	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	LGMN	47	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	PLAT	15	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	CAPN1	85	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	CTRC	16	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	CAPN2	87	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	CTSE	52	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	ACE2	79	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	TGM2	20	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	KLK1	26	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	FPR1	40	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	CTRB_BOVIN	47	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	GAG-PRO	40	31
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	XIAP	42	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	BRCA1	69	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000875471969	FE	On-Demand	Anodyne	TMPRSS11D	57	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	F2	68	48
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	PLG	40	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	PRSS1	27	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	ACE	97	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	OPRM1	48	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	OPRD1	36	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	P2RY12	74	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	CELA1	33	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	ELANE	29	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	MME	61	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	TACR1	23	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	TRHR	51	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	PGC	52	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	CMA1	43	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	CTRA_BOVIN	81	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	PRCP	19	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	KLK3	60	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	CTSB	44	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	PAPA1_CARPA	41	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	TRY1_BOVIN	91	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	CYSP_TRYCR	61	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	NTSR1	104	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	NTSR2	57	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	CTSG	53	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	CTSK	44	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	CTSL	45	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	NPFFR2	52	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	TIMP3	78	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	DPP4	15	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	PREP	41	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	CAPNS1	75	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	HLA-DRB1	68	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	CELA2A	73	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	REN	97	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	REN1	50	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	LGMN	47	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	PLAT	15	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	CAPN1	85	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	CTRC	16	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	CAPN2	87	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	CTSE	52	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	ACE2	79	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	TGM2	20	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	KLK1	26	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	FPR1	40	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	CTRB_BOVIN	47	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	GAG-PRO	40	31
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	XIAP	42	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	BRCA1	69	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000875471970	FE	On-Demand	Anodyne	TMPRSS11D	57	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	F2	68	48
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	PLG	40	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	PRSS1	27	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	ACE	97	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	OPRM1	48	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	OPRD1	36	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	P2RY12	74	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	CELA1	33	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	ELANE	29	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	MME	61	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	TACR1	23	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	TRHR	51	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	PGC	52	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	CMA1	43	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	CTRA_BOVIN	81	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	PRCP	19	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	KLK3	60	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	CTSB	44	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	PAPA1_CARPA	41	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	TRY1_BOVIN	91	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	CYSP_TRYCR	61	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	NTSR1	104	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	NTSR2	57	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	CTSG	53	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	CTSK	44	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	CTSL	45	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	NPFFR2	52	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	TIMP3	78	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	DPP4	15	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	PREP	41	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	CAPNS1	75	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	HLA-DRB1	68	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	CELA2A	73	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	REN	97	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	REN1	50	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	LGMN	47	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	PLAT	15	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	CAPN1	85	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	CTRC	16	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	CAPN2	87	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	CTSE	52	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	ACE2	79	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	TGM2	20	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	KLK1	26	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	FPR1	40	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	CTRB_BOVIN	47	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	GAG-PRO	40	31
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	XIAP	42	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	BRCA1	69	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000875471971	FE	On-Demand	Anodyne	TMPRSS11D	57	36
Cc1cccc(CN2CCO[C@@H](CNC(=O)N[C@@H]3CCc4nnc(C)n4C3)C2)c1	ZINC000875471987	GD	On-Demand	Anodyne	CCR3	18	48
Cc1cccc(CN2CCO[C@@H](CNC(=O)N[C@H]3CCc4nnc(C)n4C3)C2)c1	ZINC000875471988	GD	On-Demand	Anodyne	CCR3	18	48
Cc1cccc(CN2CCO[C@H](CNC(=O)N[C@H]3CCc4nnc(C)n4C3)C2)c1	ZINC000875471989	GD	On-Demand	Anodyne	CCR3	18	48
Cc1cccc(CN2CCO[C@H](CNC(=O)N[C@@H]3CCc4nnc(C)n4C3)C2)c1	ZINC000875471990	GD	On-Demand	Anodyne	CCR3	18	48
CCCCCCCNC(=O)C(=O)NCc1nc(C(F)(F)F)n2c1CCCC2	ZINC000875472117	GF	On-Demand	Mild	ASAH1	51	34
O=C(NCc1cccc2ncccc12)NC[C@H]1CC(=O)N(C2CC2)C1	ZINC000875472151	EE	On-Demand	Anodyne	P2RX7	22	41
O=C(NCc1cccc2ncccc12)NC[C@@H]1CC(=O)N(C2CC2)C1	ZINC000875472152	EE	On-Demand	Anodyne	P2RX7	22	41
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC[C@@H]1CC(=O)N(C2CC2)C1	ZINC000875472184	GF	On-Demand	Anodyne	CHRM2	18	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC[C@@H]1CC(=O)N(C2CC2)C1	ZINC000875472184	GF	On-Demand	Anodyne	DRD2	17	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC[C@@H]1CC(=O)N(C2CC2)C1	ZINC000875472184	GF	On-Demand	Anodyne	DRD4	43	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC[C@@H]1CC(=O)N(C2CC2)C1	ZINC000875472184	GF	On-Demand	Anodyne	ACHE	59	58
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC[C@@H]1CC(=O)N(C2CC2)C1	ZINC000875472184	GF	On-Demand	Anodyne	HTR4	29	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC[C@@H]1CC(=O)N(C2CC2)C1	ZINC000875472184	GF	On-Demand	Anodyne	CHRM3	18	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC[C@@H]1CC(=O)N(C2CC2)C1	ZINC000875472184	GF	On-Demand	Anodyne	SIGMAR1	51	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC[C@@H]1CC(=O)N(C2CC2)C1	ZINC000875472184	GF	On-Demand	Anodyne	CCR3	42	39
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC[C@@H]1CC(=O)N(C2CC2)C1	ZINC000875472184	GF	On-Demand	Anodyne	CACNA1I	48	38
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC[C@H]1CC(=O)N(C2CC2)C1	ZINC000875472185	GF	On-Demand	Anodyne	CHRM2	18	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC[C@H]1CC(=O)N(C2CC2)C1	ZINC000875472185	GF	On-Demand	Anodyne	DRD2	17	44
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC[C@H]1CC(=O)N(C2CC2)C1	ZINC000875472185	GF	On-Demand	Anodyne	DRD4	43	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC[C@H]1CC(=O)N(C2CC2)C1	ZINC000875472185	GF	On-Demand	Anodyne	ACHE	59	58
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC[C@H]1CC(=O)N(C2CC2)C1	ZINC000875472185	GF	On-Demand	Anodyne	HTR4	29	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC[C@H]1CC(=O)N(C2CC2)C1	ZINC000875472185	GF	On-Demand	Anodyne	CHRM3	18	45
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC[C@H]1CC(=O)N(C2CC2)C1	ZINC000875472185	GF	On-Demand	Anodyne	SIGMAR1	51	42
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC[C@H]1CC(=O)N(C2CC2)C1	ZINC000875472185	GF	On-Demand	Anodyne	CCR3	42	39
O=C(NCCC1CCN(Cc2ccccc2)CC1)NC[C@H]1CC(=O)N(C2CC2)C1	ZINC000875472185	GF	On-Demand	Anodyne	CACNA1I	48	38
COC(=O)C1(O)CN(C(=O)N[C@@H](C)Cc2ccccc2C(F)(F)F)C1	ZINC000875472216	FD	On-Demand	Anodyne	RBP4	43	37
COC(=O)C1(O)CN(C(=O)N[C@H](C)Cc2ccccc2C(F)(F)F)C1	ZINC000875472217	FD	On-Demand	Anodyne	RBP4	43	37
CCCCCCCNC(=O)C(=O)NCc1ccc(C)o1	ZINC000875472423	CE	On-Demand	Mild	ASAH1	92	37
O=C(NC[C@H]1CC(=O)N(C2CC2)C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875472487	GE	On-Demand	Anodyne	SMO	36	49
O=C(NC[C@H]1CC(=O)N(C2CC2)C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875472487	GE	On-Demand	Anodyne	ETHR	54	45
O=C(NC[C@@H]1CC(=O)N(C2CC2)C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875472488	GE	On-Demand	Anodyne	SMO	36	49
O=C(NC[C@@H]1CC(=O)N(C2CC2)C1)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875472488	GE	On-Demand	Anodyne	ETHR	54	45
C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875472493	EE	On-Demand	Anodyne	SLC16A1	43	34
CCCCCCCNC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875472504	FF	On-Demand	Mild	ROCK1	24	41
CCCCCCCNC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875472504	FF	On-Demand	Mild	ROCK2	17	41
CCCCCCCNC(=O)C(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875472504	FF	On-Demand	Mild	ASAH1	51	35
CCCCCCCNC(=O)C(=O)NCc1cccc2ncccc12	ZINC000875472520	EF	On-Demand	Mild	MTNR1A	29	41
CCCCCCCNC(=O)C(=O)NCc1cccc2ncccc12	ZINC000875472520	EF	On-Demand	Mild	MTNR1B	26	41
CCCCCCCNC(=O)C(=O)NCc1cccc2ncccc12	ZINC000875472520	EF	On-Demand	Mild	GRIA1	40	31
CCCCCCCNC(=O)C(=O)NCc1cccc2ncccc12	ZINC000875472520	EF	On-Demand	Mild	ASAH1	73	33
O=C(NCc1ccc(O)c(Cl)c1)NC[C@H]1CC(=O)N(C2CC2)C1	ZINC000875472522	ED	On-Demand	Anodyne	P2RX7	20	48
N#CCc1ccsc1C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000875472537	EH	On-Demand	Mild	LUXR	16	42
O=C(NCc1ccc(O)c(Cl)c1)NC[C@@H]1CC(=O)N(C2CC2)C1	ZINC000875472670	ED	On-Demand	Anodyne	P2RX7	20	48
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NC[C@@H]1CC(=O)N(C3CC3)C1)CC2	ZINC000875472719	GE	On-Demand	Anodyne	SLC18A2	48	39
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NC[C@@H]1CC(=O)N(C3CC3)C1)CC2	ZINC000875472720	GE	On-Demand	Anodyne	SLC18A2	48	39
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NC[C@H]1CC(=O)N(C3CC3)C1)CC2	ZINC000875472721	GE	On-Demand	Anodyne	SLC18A2	48	39
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NC[C@H]1CC(=O)N(C3CC3)C1)CC2	ZINC000875472722	GE	On-Demand	Anodyne	SLC18A2	48	39
CN1CCC(CNC(=O)NC[C@@H]2CC(=O)N(C3CC3)C2)(c2ccccc2)CC1	ZINC000875472723	GD	On-Demand	Anodyne	KCNA3	45	35
CN1CCC(CNC(=O)NC[C@@H]2CC(=O)N(C3CC3)C2)(c2ccccc2)CC1	ZINC000875472723	GD	On-Demand	Anodyne	SOAT1	16	40
CN1CCC(CNC(=O)NC[C@H]2CC(=O)N(C3CC3)C2)(c2ccccc2)CC1	ZINC000875472724	GD	On-Demand	Anodyne	KCNA3	45	35
CN1CCC(CNC(=O)NC[C@H]2CC(=O)N(C3CC3)C2)(c2ccccc2)CC1	ZINC000875472724	GD	On-Demand	Anodyne	SOAT1	16	40
CCc1nnc2n1C[C@@H](NC(=O)N1CC[C@]3(CCc4ccccc43)C1)CC2	ZINC000875472827	FE	On-Demand	Anodyne	OXTR	49	36
CCc1nnc2n1C[C@H](NC(=O)N1CC[C@@]3(CCc4ccccc43)C1)CC2	ZINC000875472828	FE	On-Demand	Anodyne	OXTR	49	36
CCc1nnc2n1C[C@H](NC(=O)N1CC[C@]3(CCc4ccccc43)C1)CC2	ZINC000875472829	FE	On-Demand	Anodyne	OXTR	49	36
CCc1nnc2n1C[C@@H](NC(=O)N1CC[C@@]3(CCc4ccccc43)C1)CC2	ZINC000875472830	FE	On-Demand	Anodyne	OXTR	49	36
O=C(NC[C@@H]1CC(=O)N(C2CC2)C1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000875472875	GG	On-Demand	Anodyne	CCR3	32	42
O=C(NC[C@H]1CC(=O)N(C2CC2)C1)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000875472876	GG	On-Demand	Anodyne	CCR3	32	42
CCCCCCCNC(=O)C(=O)NCc1cccc2c1CCOC2	ZINC000875472921	EE	On-Demand	Mild	ASAH1	84	36
Cc1ccc(NC(=O)Cn2cncc2C)c(Br)n1	ZINC000875472968	DE	On-Demand	Anodyne	QPCT	44	33
COc1cccc(C(C)(C)C(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)c1	ZINC000875472993	EF	On-Demand	Anodyne	DRD4	40	31
COc1cccc(C(C)(C)C(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)c1	ZINC000875472993	EF	On-Demand	Anodyne	CHRNA10	31	40
COc1cccc(C(C)(C)C(=O)N2CCC[C@H]3CN(C)CC[C@H]32)c1	ZINC000875472994	EF	On-Demand	Anodyne	DRD4	40	31
COc1cccc(C(C)(C)C(=O)N2CCC[C@H]3CN(C)CC[C@H]32)c1	ZINC000875472994	EF	On-Demand	Anodyne	CHRNA10	31	40
COc1cccc(C(C)(C)C(=O)N2CCC[C@@H]3CN(C)CC[C@@H]32)c1	ZINC000875472995	EF	On-Demand	Anodyne	DRD4	40	31
COc1cccc(C(C)(C)C(=O)N2CCC[C@@H]3CN(C)CC[C@@H]32)c1	ZINC000875472995	EF	On-Demand	Anodyne	CHRNA10	31	40
COc1cccc(C(C)(C)C(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)c1	ZINC000875472996	EF	On-Demand	Anodyne	DRD4	40	31
COc1cccc(C(C)(C)C(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)c1	ZINC000875472996	EF	On-Demand	Anodyne	CHRNA10	31	40
CCc1nnc2n1C[C@H](NC(=O)NCC1(c3ccccc3)CCN(C)CC1)CC2	ZINC000875473067	GE	On-Demand	Anodyne	KCNA3	44	38
CCc1nnc2n1C[C@@H](NC(=O)NCC1(c3ccccc3)CCN(C)CC1)CC2	ZINC000875473068	GE	On-Demand	Anodyne	KCNA3	44	38
O=C(NC[C@@H]1CC(=O)N(C2CC2)C1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875473153	FE	On-Demand	Anodyne	OXTR	57	35
O=C(NC[C@H]1CC(=O)N(C2CC2)C1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875473154	FE	On-Demand	Anodyne	OXTR	57	35
O=C(NC[C@H]1CC(=O)N(C2CC2)C1)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875473155	FE	On-Demand	Anodyne	OXTR	57	35
O=C(NC[C@@H]1CC(=O)N(C2CC2)C1)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875473156	FE	On-Demand	Anodyne	OXTR	57	35
CC(C)(C)OC(=O)CN1CCC(NC(=O)NC[C@@H]2CC(=O)N(C3CC3)C2)CC1	ZINC000875473228	GD	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)CN1CCC(NC(=O)NC[C@H]2CC(=O)N(C3CC3)C2)CC1	ZINC000875473229	GD	On-Demand	Anodyne	CACNA1I	42	33
CCCCCCCNC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875473266	CE	On-Demand	Mild	EPHX2	18	44
CCCCCCCNC(=O)C(=O)N[C@@H]1CC12CCC2	ZINC000875473266	CE	On-Demand	Mild	ASAH1	55	30
CCCCCCCNC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875473267	CE	On-Demand	Mild	EPHX2	18	44
CCCCCCCNC(=O)C(=O)N[C@H]1CC12CCC2	ZINC000875473267	CE	On-Demand	Mild	ASAH1	55	30
CCCCCCCNC(=O)C(=O)NCc1cccc2[nH]ccc12	ZINC000875473270	DF	On-Demand	Mild	MMP8	27	44
CCCCCCCNC(=O)C(=O)NCc1cccc2[nH]ccc12	ZINC000875473270	DF	On-Demand	Mild	GRIA1	49	38
CCCCCCCNC(=O)C(=O)NCc1cccc2[nH]ccc12	ZINC000875473270	DF	On-Demand	Mild	MMP1	15	44
CCCCCCCNC(=O)C(=O)NCc1cccc2[nH]ccc12	ZINC000875473270	DF	On-Demand	Mild	ASAH1	83	36
CCCCCCCNC(=O)C(=O)NCc1cccc2[nH]ccc12	ZINC000875473270	DF	On-Demand	Mild	HPGDS	15	41
O=C1C[C@H](CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)CN1C1CC1	ZINC000875473275	FE	On-Demand	Anodyne	INHA	19	40
O=C1C[C@H](CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)CN1C1CC1	ZINC000875473276	FE	On-Demand	Anodyne	INHA	19	40
O=C1C[C@H](CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)CN1C1CC1	ZINC000875473277	FE	On-Demand	Anodyne	INHA	19	40
O=C1C[C@H](CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)CN1C1CC1	ZINC000875473278	FE	On-Demand	Anodyne	INHA	19	40
COCC[C@@H](NC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F)c1ccco1	ZINC000875473326	GH	On-Demand	Mild	CTSF	41	31
COCC[C@H](NC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F)c1ccco1	ZINC000875473327	GH	On-Demand	Mild	CTSF	41	31
COCC[C@H](NC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F)c1ccco1	ZINC000875473328	GH	On-Demand	Mild	CTSF	41	31
COCC[C@@H](NC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F)c1ccco1	ZINC000875473329	GH	On-Demand	Mild	CTSF	41	31
CCCCCCCNC(=O)C(=O)NCc1nonc1C	ZINC000875473330	CD	On-Demand	Mild	CASP1	40	32
CCCCCCCNC(=O)C(=O)NCc1nonc1C	ZINC000875473330	CD	On-Demand	Mild	CASP7	49	32
CCCCCCCNC(=O)C(=O)NCc1nonc1C	ZINC000875473330	CD	On-Demand	Mild	ASAH1	75	33
Cn1nc(Cl)c(C(=O)NC(C)(C)C(=O)NCC2CCCCC2)c1Cl	ZINC000875473333	GF	On-Demand	Anodyne	CACNA1I	48	35
CCCCCCCNC(=O)C(=O)NCc1ncc(Cl)s1	ZINC000875473334	DE	On-Demand	Mild	ASAH1	82	36
CCCCCCCNC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875473353	CD	On-Demand	Mild	SOAT1	40	34
CCCCCCCNC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875473353	CD	On-Demand	Mild	ASAH1	97	41
CCCCCCCNC(=O)C(=O)N[C@H](C)c1ccnn1C	ZINC000875473353	CD	On-Demand	Mild	NOD1	48	37
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875473354	CD	On-Demand	Mild	SOAT1	40	34
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875473354	CD	On-Demand	Mild	ASAH1	97	41
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1ccnn1C	ZINC000875473354	CD	On-Demand	Mild	NOD1	48	37
COCC[C@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccco1	ZINC000875473355	DF	On-Demand	Anodyne	REN	17	44
COCC[C@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccco1	ZINC000875473356	DF	On-Demand	Anodyne	REN	17	44
COCC[C@@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)c1ccco1	ZINC000875473357	DF	On-Demand	Anodyne	REN	17	44
COCC[C@@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)c1ccco1	ZINC000875473358	DF	On-Demand	Anodyne	REN	17	44
CCCCCCCNC(=O)C(=O)NCc1cccc(F)c1F	ZINC000875473376	DF	On-Demand	Mild	GRIA1	42	33
CCCCCCCNC(=O)C(=O)NCc1cccc(F)c1F	ZINC000875473376	DF	On-Demand	Mild	ASAH1	103	42
O=C(NCCCCCCc1ccccc1)NC[C@H]1CC(=O)N(C2CC2)C1	ZINC000875473397	FG	On-Demand	Anodyne	FKBP1A	17	42
O=C(NCCCCCCc1ccccc1)NC[C@H]1CC(=O)N(C2CC2)C1	ZINC000875473397	FG	On-Demand	Anodyne	CCR3	16	41
O=C(NCCCCCCc1ccccc1)NC[C@@H]1CC(=O)N(C2CC2)C1	ZINC000875473398	FG	On-Demand	Anodyne	FKBP1A	17	42
O=C(NCCCCCCc1ccccc1)NC[C@@H]1CC(=O)N(C2CC2)C1	ZINC000875473398	FG	On-Demand	Anodyne	CCR3	16	41
CCCCCCCNC(=O)C(=O)NCc1ncc(Br)s1	ZINC000875473403	FF	On-Demand	Mild	ASAH1	80	36
O=C(NC[C@H]1CC(=O)N(C2CC2)C1)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875473437	GD	On-Demand	Anodyne	INHA	17	41
O=C(NC[C@@H]1CC(=O)N(C2CC2)C1)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875473438	GD	On-Demand	Anodyne	INHA	17	41
CCCCCCCNC(=O)C(=O)NC1CCC(C)(N(C)C)CC1	ZINC000875473448	EE	On-Demand	Mild	ASAH1	53	33
C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)N1CCCN(C=O)CC1	ZINC000875473449	FF	On-Demand	Anodyne	RBP4	56	37
C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)N1CCCN(C=O)CC1	ZINC000875473449	FF	On-Demand	Anodyne	Q6PRC7_IXORI	43	33
C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)N1CCCN(C=O)CC1	ZINC000875473450	FF	On-Demand	Anodyne	RBP4	56	37
C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)N1CCCN(C=O)CC1	ZINC000875473450	FF	On-Demand	Anodyne	Q6PRC7_IXORI	43	33
C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875473451	FE	On-Demand	Anodyne	RBP4	85	42
C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875473451	FE	On-Demand	Anodyne	SFRP1	64	33
C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875473451	FE	On-Demand	Anodyne	WNT3	45	33
C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875473452	FE	On-Demand	Anodyne	RBP4	85	42
C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875473452	FE	On-Demand	Anodyne	SFRP1	64	33
C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)N1CCC(CO)(CO)CC1	ZINC000875473452	FE	On-Demand	Anodyne	WNT3	45	33
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NC[C@@H]1CC(=O)N(C2CC2)C1	ZINC000875473475	GF	On-Demand	Anodyne	INHA	16	41
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NC[C@@H]1CC(=O)N(C2CC2)C1	ZINC000875473475	GF	On-Demand	Anodyne	SIGMAR1	15	45
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NC[C@H]1CC(=O)N(C2CC2)C1	ZINC000875473476	GF	On-Demand	Anodyne	INHA	16	41
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NC[C@H]1CC(=O)N(C2CC2)C1	ZINC000875473476	GF	On-Demand	Anodyne	SIGMAR1	15	45
CCCCCCCNC(=O)C(=O)N[C@@H]1CCCn2nccc21	ZINC000875473477	DD	On-Demand	Mild	ASAH1	77	35
CCCCCCCNC(=O)C(=O)N[C@@H]1CCCn2nccc21	ZINC000875473477	DD	On-Demand	Mild	LASR	44	32
CCCCCCCNC(=O)C(=O)N[C@H]1CCCn2nccc21	ZINC000875473478	DD	On-Demand	Mild	ASAH1	77	35
CCCCCCCNC(=O)C(=O)N[C@H]1CCCn2nccc21	ZINC000875473478	DD	On-Demand	Mild	LASR	44	32
CCCCCCCNC(=O)C(=O)N[C@@H](CF)c1ccc(F)cc1	ZINC000875473507	EG	On-Demand	Mild	ASAH1	101	38
CCCCCCCNC(=O)C(=O)N[C@H](CF)c1ccc(F)cc1	ZINC000875473508	EG	On-Demand	Mild	ASAH1	101	38
CCCCCCCNC(=O)C(=O)NCc1ccnc(N2CCSCC2)c1	ZINC000875473511	GE	On-Demand	Mild	ASAH1	58	33
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)NC[C@@H]1CC(=O)N(C2CC2)C1	ZINC000875473530	GH	On-Demand	Anodyne	P2RX7	17	45
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)NC[C@@H]1CC(=O)N(C2CC2)C1	ZINC000875473530	GH	On-Demand	Anodyne	MDM2	78	32
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)NC[C@H]1CC(=O)N(C2CC2)C1	ZINC000875473533	GH	On-Demand	Anodyne	P2RX7	17	45
CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)NC[C@H]1CC(=O)N(C2CC2)C1	ZINC000875473533	GH	On-Demand	Anodyne	MDM2	78	32
O=C(NC[C@@H]1CC(=O)N(C2CC2)C1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000875473574	GG	On-Demand	Anodyne	CCR3	16	40
O=C(NC[C@@H]1CC(=O)N(C2CC2)C1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000875473574	GG	On-Demand	Anodyne	EPHX2	15	43
O=C(NC[C@H]1CC(=O)N(C2CC2)C1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000875473575	GG	On-Demand	Anodyne	CCR3	16	40
O=C(NC[C@H]1CC(=O)N(C2CC2)C1)N1CCC(Cc2ccccc2Cl)CC1	ZINC000875473575	GG	On-Demand	Anodyne	EPHX2	15	43
O=C(NC[C@H]1CC(=O)N(C2CC2)C1)NC1CC(Nc2ccccc2)C1	ZINC000875473577	ED	On-Demand	Anodyne	INHA	16	40
O=C(NC[C@@H]1CC(=O)N(C2CC2)C1)NC1CC(Nc2ccccc2)C1	ZINC000875473578	ED	On-Demand	Anodyne	INHA	16	40
Cc1ccc2c(c1)[C@H](NC(=O)N1CCC(N3CCN(C)CC3)CC1)[C@H](C)C2	ZINC000875473586	FF	On-Demand	Anodyne	L3MBTL3	60	40
Cc1ccc2c(c1)[C@H](NC(=O)N1CCC(N3CCN(C)CC3)CC1)[C@@H](C)C2	ZINC000875473587	FF	On-Demand	Anodyne	L3MBTL3	60	40
O=C(NCCNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)c1cc[nH]n1	ZINC000875473597	FC	On-Demand	Anodyne	FAAH	16	40
O=C(NCc1ccc(OC(F)F)cc1F)NC[C@@H]1CC(=O)N(C2CC2)C1	ZINC000875473608	FE	On-Demand	Anodyne	P2RX7	36	47
O=C(NCc1ccc(OC(F)F)cc1F)NC[C@H]1CC(=O)N(C2CC2)C1	ZINC000875473609	FE	On-Demand	Anodyne	P2RX7	36	47
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(C)nc1Br	ZINC000875473610	EF	On-Demand	Anodyne	ANPEP	30	43
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(C)nc1Br	ZINC000875473610	EF	On-Demand	Anodyne	CAPN1	26	42
CC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(C)nc1Br	ZINC000875473610	EF	On-Demand	Anodyne	HPN	50	34
O=C(NCc1nc(-c2ccncc2)cs1)NC[C@H]1CC(=O)N(C2CC2)C1	ZINC000875473614	FE	On-Demand	Anodyne	ROCK1	20	40
O=C(NCc1nc(-c2ccncc2)cs1)NC[C@@H]1CC(=O)N(C2CC2)C1	ZINC000875473615	FE	On-Demand	Anodyne	ROCK1	20	40
COc1cccc(C(C)(C)C(=O)Nc2cccc(C#N)c2C)c1	ZINC000875473669	DH	On-Demand	Mild	TAAR1	24	42
C=CCOCCNC(=O)NNc1ccc(OC)cc1Br	ZINC000875473671	EE	On-Demand	Reactive	MTNR1A	40	37
N#Cc1ccc(Cn2cc(NC(=O)NCC[C@H]3CCCCO3)cn2)cc1	ZINC000875473678	FF	On-Demand	Mild	CCR3	20	41
N#Cc1ccc(Cn2cc(NC(=O)NCC[C@H]3CCCCO3)cn2)cc1	ZINC000875473678	FF	On-Demand	Mild	ITK	25	47
N#Cc1ccc(Cn2cc(NC(=O)NCC[C@H]3CCCCO3)cn2)cc1	ZINC000875473678	FF	On-Demand	Mild	PANC	58	39
N#Cc1ccc(Cn2cc(NC(=O)NCC[C@@H]3CCCCO3)cn2)cc1	ZINC000875473679	FF	On-Demand	Mild	CCR3	20	41
N#Cc1ccc(Cn2cc(NC(=O)NCC[C@@H]3CCCCO3)cn2)cc1	ZINC000875473679	FF	On-Demand	Mild	ITK	25	47
N#Cc1ccc(Cn2cc(NC(=O)NCC[C@@H]3CCCCO3)cn2)cc1	ZINC000875473679	FF	On-Demand	Mild	PANC	58	39
CCCCCCCNC(=O)C(=O)NCCN1CCOCC1(C)C	ZINC000875473680	ED	On-Demand	Mild	ASAH1	57	39
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ncccc1F	ZINC000875473684	FH	On-Demand	Anodyne	ELANE	29	45
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ncccc1F	ZINC000875473684	FH	On-Demand	Anodyne	HRAS	40	39
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ncccc1F	ZINC000875473684	FH	On-Demand	Anodyne	KLK3	82	35
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ncccc1F	ZINC000875473684	FH	On-Demand	Anodyne	CTSB	67	44
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ncccc1F	ZINC000875473684	FH	On-Demand	Anodyne	PAPA1_CARPA	71	44
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ncccc1F	ZINC000875473684	FH	On-Demand	Anodyne	CYSP_TRYCR	52	38
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ncccc1F	ZINC000875473684	FH	On-Demand	Anodyne	CTSK	34	48
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ncccc1F	ZINC000875473684	FH	On-Demand	Anodyne	CTSL	41	48
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ncccc1F	ZINC000875473684	FH	On-Demand	Anodyne	CAPNS1	63	36
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ncccc1F	ZINC000875473684	FH	On-Demand	Anodyne	CTSS	15	48
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ncccc1F	ZINC000875473684	FH	On-Demand	Anodyne	CAPN1	72	47
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ncccc1F	ZINC000875473684	FH	On-Demand	Anodyne	CAPN2	109	38
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ncccc1F	ZINC000875473684	FH	On-Demand	Anodyne	TPSAB1	45	36
CN(C(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C)c1ncccc1F	ZINC000875473684	FH	On-Demand	Anodyne	NPR	63	40
CCCCCCCNC(=O)C(=O)NCc1ccc2cccnc2c1	ZINC000875473697	EF	On-Demand	Mild	ASAH1	58	35
CCCCCCCNC(=O)C(=O)NCc1ccc2cccnc2c1	ZINC000875473697	EF	On-Demand	Mild	SUCNR1	59	38
CCCCCCCNC(=O)C(=O)NCc1cnnn1CC	ZINC000875473707	CD	On-Demand	Mild	ASAH1	99	39
O=C(NCC[C@@H]1CCCCO1)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875473708	EG	On-Demand	Anodyne	CPT1A	55	33
O=C(NCC[C@@H]1CCCCO1)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875473709	EG	On-Demand	Anodyne	CPT1A	55	33
O=C(NCC[C@@H]1CCCCO1)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875473710	EG	On-Demand	Anodyne	CPT1A	55	33
O=C(NCC[C@@H]1CCCCO1)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875473711	EG	On-Demand	Anodyne	CPT1A	55	33
CCCCCCCNC(=O)C(=O)NC(c1nccn1C)c1nccn1C	ZINC000875473728	FD	On-Demand	Mild	ASAH1	92	42
CCCCCCCNC(=O)C(=O)N[C@H]1CCN(C(C)(C)C)C1	ZINC000875473745	DE	On-Demand	Mild	ASAH1	79	34
CCCCCCCNC(=O)C(=O)N[C@@H]1CCN(C(C)(C)C)C1	ZINC000875473746	DE	On-Demand	Mild	ASAH1	79	34
Cc1ccc(NC(=O)c2ccc(C)c(N3CCOCC3)c2)c(Br)n1	ZINC000875473747	GH	On-Demand	Anodyne	MAPK11	18	43
Cc1ccc(NC(=O)c2ccc(C)c(N3CCOCC3)c2)c(Br)n1	ZINC000875473747	GH	On-Demand	Anodyne	MAPK14	31	43
Cc1ccc(NC(=O)c2ccc(C)c(N3CCOCC3)c2)c(Br)n1	ZINC000875473747	GH	On-Demand	Anodyne	CSF1R	20	40
CCCCCCCNC(=O)C(=O)N(C)C[C@](C)(O)c1ccccc1	ZINC000875473753	EE	On-Demand	Mild	AMY2	43	31
CCCCCCCNC(=O)C(=O)N(C)C[C@](C)(O)c1ccccc1	ZINC000875473753	EE	On-Demand	Mild	ASAH1	86	38
CCCCCCCNC(=O)C(=O)N(C)C[C@@](C)(O)c1ccccc1	ZINC000875473754	EE	On-Demand	Mild	AMY2	43	31
CCCCCCCNC(=O)C(=O)N(C)C[C@@](C)(O)c1ccccc1	ZINC000875473754	EE	On-Demand	Mild	ASAH1	86	38
CCCCCCCNC(=O)C(=O)N[C@H](c1ccc(F)cc1)c1cnn(C)c1	ZINC000875473757	FF	On-Demand	Mild	SOAT1	17	40
CCCCCCCNC(=O)C(=O)N[C@H](c1ccc(F)cc1)c1cnn(C)c1	ZINC000875473757	FF	On-Demand	Mild	ASAH1	94	37
CCCCCCCNC(=O)C(=O)N[C@@H](c1ccc(F)cc1)c1cnn(C)c1	ZINC000875473758	FF	On-Demand	Mild	SOAT1	17	40
CCCCCCCNC(=O)C(=O)N[C@@H](c1ccc(F)cc1)c1cnn(C)c1	ZINC000875473758	FF	On-Demand	Mild	ASAH1	94	37
CCCCCCCNC(=O)C(=O)NCC[C@@H]1CCCOC1	ZINC000875473767	CE	On-Demand	Mild	LASR	46	34
CCCCCCCNC(=O)C(=O)NCC[C@H]1CCCOC1	ZINC000875473768	CE	On-Demand	Mild	LASR	46	34
CCCCCCCNC(=O)C(=O)NCC1CC=CC1	ZINC000875473777	CE	On-Demand	Mild	EPHX2	18	45
CCCCCCCNC(=O)C(=O)NCC1CC=CC1	ZINC000875473777	CE	On-Demand	Mild	ASAH1	88	40
CCCCCCCNC(=O)C(=O)NCCN1CCSCC1	ZINC000875473819	DD	On-Demand	Mild	EPHX2	19	41
CCCCCCCNC(=O)C(=O)NCCN1CCSCC1	ZINC000875473819	DD	On-Demand	Mild	ASAH1	82	36
CCCCCCCNC(=O)C(=O)N1CCc2nnc(OC)cc2C1	ZINC000875473847	ED	On-Demand	Mild	ASAH1	53	34
CCCCCCCNC(=O)C(=O)NOC1CCOCC1	ZINC000875473857	CD	On-Demand	Mild	ASAH1	63	37
CCCCCCCNC(=O)C(=O)N[C@H](c1ccccn1)C1CCC1	ZINC000875473901	EG	On-Demand	Mild	SOAT1	18	40
CCCCCCCNC(=O)C(=O)N[C@H](c1ccccn1)C1CCC1	ZINC000875473901	EG	On-Demand	Mild	TTK	27	40
CCCCCCCNC(=O)C(=O)N[C@H](c1ccccn1)C1CCC1	ZINC000875473901	EG	On-Demand	Mild	ASAH1	41	33
CCCCCCCNC(=O)C(=O)N[C@@H](c1ccccn1)C1CCC1	ZINC000875473902	EG	On-Demand	Mild	SOAT1	18	40
CCCCCCCNC(=O)C(=O)N[C@@H](c1ccccn1)C1CCC1	ZINC000875473902	EG	On-Demand	Mild	TTK	27	40
CCCCCCCNC(=O)C(=O)N[C@@H](c1ccccn1)C1CCC1	ZINC000875473902	EG	On-Demand	Mild	ASAH1	41	33
CN(C(=O)[C@H](F)[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1ncccc1F	ZINC000875473904	FF	On-Demand	Anodyne	GPR119	57	46
CN(C(=O)[C@H](F)[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1ncccc1F	ZINC000875473905	FF	On-Demand	Anodyne	GPR119	57	46
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccc(C)nc1Br	ZINC000875473919	EE	On-Demand	Anodyne	LGMN	78	36
CCCCCCCNC(=O)C(=O)N[C@H]1CCNC1=O	ZINC000875473922	CC	On-Demand	Mild	ASAH1	87	38
CCCCCCCNC(=O)C(=O)N[C@H]1CCNC1=O	ZINC000875473922	CC	On-Demand	Mild	LASR	58	37
CCCCCCCNC(=O)C(=O)N[C@@H]1CCNC1=O	ZINC000875473923	CC	On-Demand	Mild	ASAH1	87	38
CCCCCCCNC(=O)C(=O)N[C@@H]1CCNC1=O	ZINC000875473923	CC	On-Demand	Mild	LASR	58	37
CCCCCCCNC(=O)C(=O)NC(c1ccnn1C)c1ccnn1C	ZINC000875473941	FD	On-Demand	Mild	GRIA1	40	34
CCCCCCCNC(=O)C(=O)NC(c1ccnn1C)c1ccnn1C	ZINC000875473941	FD	On-Demand	Mild	ASAH1	98	42
CCCCCCCNC(=O)C(=O)NCc1cccnc1C	ZINC000875473949	CE	On-Demand	Mild	ASAH1	99	38
Cc1ccc(NC(=O)c2cccn(C3CC3)c2=O)c(Br)n1	ZINC000875473952	EF	On-Demand	Anodyne	CCR8	47	32
C=C(Br)CNC(=O)C(=O)NCCCCCCC	ZINC000875473975	DE	On-Demand	Mild	ASAH1	82	35
CCCCCCCNC(=O)C(=O)N[C@H]1CN(C(C)C)C[C@H]1C	ZINC000875473979	DD	On-Demand	Mild	ASAH1	55	30
CCCCCCCNC(=O)C(=O)N[C@H]1CN(C(C)C)C[C@@H]1C	ZINC000875473980	DD	On-Demand	Mild	ASAH1	55	30
CCCCCCCNC(=O)C(=O)N[C@@H]1CN(C(C)C)C[C@H]1C	ZINC000875473981	DD	On-Demand	Mild	ASAH1	55	30
CCCCCCCNC(=O)C(=O)N[C@@H]1CN(C(C)C)C[C@@H]1C	ZINC000875473982	DD	On-Demand	Mild	ASAH1	55	30
CCCCCCCNC(=O)C(=O)NC1CN(S(=O)(=O)N(C)C)C1	ZINC000875474003	EB	On-Demand	Mild	ASAH1	49	30
CCCCCCCNC(=O)C(=O)N[C@H](C)c1ncc(C)o1	ZINC000875474014	CE	On-Demand	Mild	ASAH1	81	34
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1ncc(C)o1	ZINC000875474015	CE	On-Demand	Mild	ASAH1	81	34
CN(C(=O)[C@H](Cc1cccnc1)C1CCCC1)c1ncccc1F	ZINC000875474017	EH	On-Demand	Anodyne	C3AR1	42	40
CCCCCCCNC(=O)C(=O)N1CCC[C@@H]1CN1CCOCC1	ZINC000875474045	ED	On-Demand	Mild	TPP2	21	42
CCCCCCCNC(=O)C(=O)NC[C@H](C)c1ccccn1	ZINC000875474058	DE	On-Demand	Mild	HRH2	15	44
CCCCCCCNC(=O)C(=O)NC[C@H](C)c1ccccn1	ZINC000875474058	DE	On-Demand	Mild	SOAT1	38	44
CCCCCCCNC(=O)C(=O)NC[C@H](C)c1ccccn1	ZINC000875474058	DE	On-Demand	Mild	ASAH1	88	34
CCCCCCCNC(=O)C(=O)NC[C@@H](C)c1ccccn1	ZINC000875474059	DE	On-Demand	Mild	HRH2	15	44
CCCCCCCNC(=O)C(=O)NC[C@@H](C)c1ccccn1	ZINC000875474059	DE	On-Demand	Mild	SOAT1	38	44
CCCCCCCNC(=O)C(=O)NC[C@@H](C)c1ccccn1	ZINC000875474059	DE	On-Demand	Mild	ASAH1	88	34
CCCCCCCNC(=O)C(=O)NCc1cccc(CO)c1	ZINC000875474088	DD	On-Demand	Mild	FAAH	18	45
CCCCCCCNC(=O)C(=O)NCc1cccc(CO)c1	ZINC000875474088	DD	On-Demand	Mild	S1PR2	42	35
CCCCCCCNC(=O)C(=O)NCc1cccc(CO)c1	ZINC000875474088	DD	On-Demand	Mild	ASAH1	92	39
CCCCCCCNC(=O)C(=O)N[C@@H]1CCC[C@@H]1N1CC[C@@H](O)C1	ZINC000875474114	ED	On-Demand	Mild	ASAH1	50	32
CCCCCCCNC(=O)C(=O)N[C@@H]1CCC[C@@H]1N1CC[C@H](O)C1	ZINC000875474115	ED	On-Demand	Mild	ASAH1	50	32
CCCCCCCNC(=O)C(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1C	ZINC000875474123	ED	On-Demand	Mild	ACE	32	41
CCCCCCCNC(=O)C(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1C	ZINC000875474123	ED	On-Demand	Mild	HLA-DRB3	40	32
CCCCCCCNC(=O)C(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1C	ZINC000875474123	ED	On-Demand	Mild	TPP2	30	47
CCCCCCCNC(=O)C(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1C	ZINC000875474124	ED	On-Demand	Mild	ACE	32	41
CCCCCCCNC(=O)C(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1C	ZINC000875474124	ED	On-Demand	Mild	HLA-DRB3	40	32
CCCCCCCNC(=O)C(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1C	ZINC000875474124	ED	On-Demand	Mild	TPP2	30	47
CCCCCCCNC(=O)C(=O)N[C@H](C)C(=O)N1CCCC[C@H]1C	ZINC000875474125	ED	On-Demand	Mild	ACE	32	41
CCCCCCCNC(=O)C(=O)N[C@H](C)C(=O)N1CCCC[C@H]1C	ZINC000875474125	ED	On-Demand	Mild	HLA-DRB3	40	32
CCCCCCCNC(=O)C(=O)N[C@H](C)C(=O)N1CCCC[C@H]1C	ZINC000875474125	ED	On-Demand	Mild	TPP2	30	47
CCCCCCCNC(=O)C(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1C	ZINC000875474126	ED	On-Demand	Mild	ACE	32	41
CCCCCCCNC(=O)C(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1C	ZINC000875474126	ED	On-Demand	Mild	HLA-DRB3	40	32
CCCCCCCNC(=O)C(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1C	ZINC000875474126	ED	On-Demand	Mild	TPP2	30	47
CCCCCCCNC(=O)C(=O)NCC(C)(C)C(=O)N1CCCC1	ZINC000875474170	ED	On-Demand	Mild	ASAH1	71	34
CCCCCCCNC(=O)C(=O)NCc1cnc(C(F)(F)F)nc1	ZINC000875474212	EE	On-Demand	Mild	LPAR2	41	31
CCCCCCCNC(=O)C(=O)NCc1cnc(C(F)(F)F)nc1	ZINC000875474212	EE	On-Demand	Mild	S1PR2	58	31
CCCCCCCNC(=O)C(=O)NCc1cnc(C(F)(F)F)nc1	ZINC000875474212	EE	On-Demand	Mild	ASAH1	92	39
CCCCCCCNC(=O)C(=O)NCc1cccnc1N1CCCC1	ZINC000875474231	EE	On-Demand	Mild	TRPV1	17	45
CCCCCCCNC(=O)C(=O)NCc1cccnc1N1CCCC1	ZINC000875474231	EE	On-Demand	Mild	SCN2A	22	46
CCCCCCCNC(=O)C(=O)NCc1cccnc1N1CCCC1	ZINC000875474231	EE	On-Demand	Mild	SCN10A	23	46
CCCCCCCNC(=O)C(=O)NCc1cccnc1N1CCCC1	ZINC000875474231	EE	On-Demand	Mild	ASAH1	85	34
CCCCCCCNC(=O)C(=O)NCc1ccc2oc(=O)n(C)c2c1	ZINC000875474235	ED	On-Demand	Mild	ASAH1	93	41
O=C(NCC[C@H]1CCCCO1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875474236	EE	On-Demand	Anodyne	ACHE	27	45
O=C(NCC[C@@H]1CCCCO1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875474237	EE	On-Demand	Anodyne	ACHE	27	45
CCCCCCCNC(=O)C(=O)NC[C@@H]1COCCN1C	ZINC000875474268	CC	On-Demand	Mild	ASAH1	50	39
CCCCCCCNC(=O)C(=O)NC[C@H]1COCCN1C	ZINC000875474269	CC	On-Demand	Mild	ASAH1	50	39
CCCCCCCNC(=O)C(=O)N[C@H]1COC(C)(C)C1	ZINC000875474287	CD	On-Demand	Mild	EPHX2	17	44
CCCCCCCNC(=O)C(=O)N[C@@H]1COC(C)(C)C1	ZINC000875474288	CD	On-Demand	Mild	EPHX2	17	44
CCCCCCCNC(=O)C(=O)NC[C@@H]1CCN1C(C)(C)C	ZINC000875474298	DE	On-Demand	Mild	ASAH1	61	33
CCCCCCCNC(=O)C(=O)NC[C@H]1CCN1C(C)(C)C	ZINC000875474299	DE	On-Demand	Mild	ASAH1	61	33
CCCCCCCNC(=O)C(=O)NCc1cnn(CC)n1	ZINC000875474304	CD	On-Demand	Mild	ASAH1	96	37
C=CCOCCNC(=O)N(CC)[C@H](C)[C@@H](O)c1ccccc1	ZINC000875474312	DE	On-Demand	Mild	NPY5R	23	45
C=CCOCCNC(=O)N(CC)[C@@H](C)[C@@H](O)c1ccccc1	ZINC000875474313	DE	On-Demand	Mild	NPY5R	23	45
C=CCOCCNC(=O)N(CC)[C@@H](C)[C@H](O)c1ccccc1	ZINC000875474314	DE	On-Demand	Mild	NPY5R	23	45
C=CCOCCNC(=O)N(CC)[C@H](C)[C@H](O)c1ccccc1	ZINC000875474315	DE	On-Demand	Mild	NPY5R	23	45
CCCCCCCNC(=O)C(=O)NCC[C@@H]1CCSC1	ZINC000875474317	DE	On-Demand	Mild	ASAH1	49	34
CCCCCCCNC(=O)C(=O)NCC[C@H]1CCSC1	ZINC000875474318	DE	On-Demand	Mild	ASAH1	49	34
CCCCCCCNC(=O)C(=O)NOC1CCCCC1	ZINC000875474327	CE	On-Demand	Mild	EPHX2	16	54
CCCCCCCNC(=O)C(=O)NOC1CCCCC1	ZINC000875474327	CE	On-Demand	Mild	ASAH1	67	33
CCCCCCCNC(=O)C(=O)NC[C@@H]1CCCN1CC	ZINC000875474346	CD	On-Demand	Mild	DRD2	34	42
CCCCCCCNC(=O)C(=O)NC[C@@H]1CCCN1CC	ZINC000875474346	CD	On-Demand	Mild	TPP2	17	41
CCCCCCCNC(=O)C(=O)NC[C@@H]1CCCN1CC	ZINC000875474346	CD	On-Demand	Mild	ASAH1	55	33
CCCCCCCNC(=O)C(=O)NC[C@H]1CCCN1CC	ZINC000875474347	CD	On-Demand	Mild	DRD2	34	42
CCCCCCCNC(=O)C(=O)NC[C@H]1CCCN1CC	ZINC000875474347	CD	On-Demand	Mild	TPP2	17	41
CCCCCCCNC(=O)C(=O)NC[C@H]1CCCN1CC	ZINC000875474347	CD	On-Demand	Mild	ASAH1	55	33
C=CCOCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875474348	EG	On-Demand	Mild	DRD2	18	43
C=CCOCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875474349	EG	On-Demand	Mild	DRD2	18	43
COc1ccc2c(c1)CC[C@H]2C(=O)N(C)c1ncccc1F	ZINC000875474354	DF	On-Demand	Anodyne	PPARD	46	41
CCCCCCCNC(=O)C(=O)N[C@H]1C[C@@H](C)n2ncnc21	ZINC000875474355	DD	On-Demand	Mild	ASAH1	79	35
CCCCCCCNC(=O)C(=O)N[C@@H]1C[C@H](C)n2ncnc21	ZINC000875474356	DD	On-Demand	Mild	ASAH1	79	35
CCCCCCCNC(=O)C(=O)N[C@H]1C[C@H](C)n2ncnc21	ZINC000875474357	DD	On-Demand	Mild	ASAH1	79	35
CCCCCCCNC(=O)C(=O)N[C@@H]1C[C@@H](C)n2ncnc21	ZINC000875474358	DD	On-Demand	Mild	ASAH1	79	35
CCCCCCCNC(=O)C(=O)NCCN1CCOC(C)(C)C1	ZINC000875474373	ED	On-Demand	Mild	ASAH1	50	37
CCCCCCCNC(=O)C(=O)N(C)[C@H](C)CO	ZINC000875474394	CC	On-Demand	Mild	ASAH1	75	32
CCCCCCCNC(=O)C(=O)N(C)[C@H](C)CO	ZINC000875474394	CC	On-Demand	Mild	NOD1	40	38
CCCCCCCNC(=O)C(=O)N(C)[C@H](C)CO	ZINC000875474394	CC	On-Demand	Mild	CQSS	50	33
CCCCCCCNC(=O)C(=O)N(C)[C@@H](C)CO	ZINC000875474395	CC	On-Demand	Mild	ASAH1	75	32
CCCCCCCNC(=O)C(=O)N(C)[C@@H](C)CO	ZINC000875474395	CC	On-Demand	Mild	NOD1	40	38
CCCCCCCNC(=O)C(=O)N(C)[C@@H](C)CO	ZINC000875474395	CC	On-Demand	Mild	CQSS	50	33
CCCCCCCNC(=O)C(=O)N[C@@H]1CCO[C@H]1c1ccccc1	ZINC000875474410	EF	On-Demand	Mild	ASAH1	67	35
CCCCCCCNC(=O)C(=O)N[C@H](C)c1cnc(C)s1	ZINC000875474412	DF	On-Demand	Mild	ASAH1	74	33
CCCCCCCNC(=O)C(=O)N[C@@H](C)c1cnc(C)s1	ZINC000875474413	DF	On-Demand	Mild	ASAH1	74	33
CCCCCCCNC(=O)C(=O)NCC(C)(C)c1ccc(C)cn1	ZINC000875474427	EF	On-Demand	Mild	ASAH1	75	33
COC[C@@H](CNC(=O)NCCC1CCN(Cc2ccccc2)CC1)OC	ZINC000875474494	FE	On-Demand	Anodyne	DRD2	22	47
COC[C@@H](CNC(=O)NCCC1CCN(Cc2ccccc2)CC1)OC	ZINC000875474494	FE	On-Demand	Anodyne	DRD4	46	47
COC[C@@H](CNC(=O)NCCC1CCN(Cc2ccccc2)CC1)OC	ZINC000875474494	FE	On-Demand	Anodyne	ACHE	65	59
COC[C@@H](CNC(=O)NCCC1CCN(Cc2ccccc2)CC1)OC	ZINC000875474494	FE	On-Demand	Anodyne	HRH2	26	41
COC[C@@H](CNC(=O)NCCC1CCN(Cc2ccccc2)CC1)OC	ZINC000875474494	FE	On-Demand	Anodyne	DRD3	17	46
COC[C@@H](CNC(=O)NCCC1CCN(Cc2ccccc2)CC1)OC	ZINC000875474494	FE	On-Demand	Anodyne	SLC6A3	32	53
COC[C@@H](CNC(=O)NCCC1CCN(Cc2ccccc2)CC1)OC	ZINC000875474494	FE	On-Demand	Anodyne	HTR4	31	45
COC[C@@H](CNC(=O)NCCC1CCN(Cc2ccccc2)CC1)OC	ZINC000875474494	FE	On-Demand	Anodyne	SIGMAR1	59	47
COC[C@@H](CNC(=O)NCCC1CCN(Cc2ccccc2)CC1)OC	ZINC000875474494	FE	On-Demand	Anodyne	BCHE	18	49
COC[C@@H](CNC(=O)NCCC1CCN(Cc2ccccc2)CC1)OC	ZINC000875474494	FE	On-Demand	Anodyne	CCR3	43	40
COC[C@@H](CNC(=O)NCCC1CCN(Cc2ccccc2)CC1)OC	ZINC000875474494	FE	On-Demand	Anodyne	MCHR1	26	43
COC[C@@H](CNC(=O)NCCC1CCN(Cc2ccccc2)CC1)OC	ZINC000875474494	FE	On-Demand	Anodyne	CACNA1G	32	40
COC[C@@H](CNC(=O)NCCC1CCN(Cc2ccccc2)CC1)OC	ZINC000875474494	FE	On-Demand	Anodyne	CACNA1I	50	37
COC[C@@H](CNC(=O)N1CCC[C@@]1(C)Cc1ccc(F)c(F)c1)OC	ZINC000875474528	FF	On-Demand	Anodyne	SLC12A5	49	38
COC[C@@H](CNC(=O)N1CCC[C@]1(C)Cc1ccc(F)c(F)c1)OC	ZINC000875474530	FF	On-Demand	Anodyne	SLC12A5	49	38
CCCCCCCNC(=O)C(=O)NCc1c(C(F)(F)F)cnn1C	ZINC000875474566	EE	On-Demand	Mild	ASAH1	94	43
CCCCCCCNC(=O)C(=O)N1C[C@H](C(F)(F)F)[C@@H](S(C)(=O)=O)C1	ZINC000875474595	GD	On-Demand	Mild	ASAH1	78	33
CCCCCCCNC(=O)C(=O)NCCN1CCOC[C@@H]1C	ZINC000875474613	DC	On-Demand	Mild	ASAH1	50	39
CCCCCCCNC(=O)C(=O)NCCN1CCOC[C@H]1C	ZINC000875474614	DC	On-Demand	Mild	ASAH1	50	39
CCCCCCCNC(=O)C(=O)NCC(C)(C)C(=O)NC	ZINC000875474623	CC	On-Demand	Mild	ASAH1	75	32
COC[C@@H](CNC(=O)NNc1ccc(OCc2ccccc2)cc1)OC	ZINC000875474665	FF	On-Demand	Reactive	TSHR	50	34
COC[C@@H](CNC(=O)NNc1ccc(OCc2ccccc2)cc1)OC	ZINC000875474665	FF	On-Demand	Reactive	MAOB	22	41
COC[C@@H](CNC(=O)NNc1ccc(OCc2ccccc2)cc1)OC	ZINC000875474665	FF	On-Demand	Reactive	LTA4H	39	47
COC[C@@H](CNC(=O)NNc1ccc(OCc2ccccc2)cc1)OC	ZINC000875474665	FF	On-Demand	Reactive	SCN2A	15	43
COC[C@@H](CNC(=O)NNc1ccc(OCc2ccccc2)cc1)OC	ZINC000875474665	FF	On-Demand	Reactive	FFAR1	34	40
COC[C@@H](CNC(=O)NNc1ccc(OCc2ccccc2)cc1)OC	ZINC000875474665	FF	On-Demand	Reactive	PDS	54	37
COC[C@@H](CNC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1)OC	ZINC000875474730	ED	On-Demand	Anodyne	CCR3	23	41
COC[C@@H](CNC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1)OC	ZINC000875474730	ED	On-Demand	Anodyne	MLNR	17	42
COC[C@@H](CNC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1)OC	ZINC000875474730	ED	On-Demand	Anodyne	EPHX2	28	48
COC[C@@H](CNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1)OC	ZINC000875474737	FD	On-Demand	Anodyne	FKBP1A	21	40
COC[C@@H](CNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1)OC	ZINC000875474737	FD	On-Demand	Anodyne	CAPNS1	56	32
COC[C@@H](CNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1)OC	ZINC000875474737	FD	On-Demand	Anodyne	CAPN1	47	35
COC[C@@H](CNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1)OC	ZINC000875474737	FD	On-Demand	Anodyne	CAPN2	83	35
COC[C@@H](CNC(=O)N1CCN(c2ccc(OC)cc2OC)CC1)OC	ZINC000875474750	FD	On-Demand	Clean	HTR1A	36	45
COC[C@@H](CNC(=O)N1CCN(c2ccc(OC)cc2OC)CC1)OC	ZINC000875474750	FD	On-Demand	Clean	DRD2	32	42
COC[C@@H](CNC(=O)N1CCN(c2ccc(OC)cc2OC)CC1)OC	ZINC000875474750	FD	On-Demand	Clean	DRD4	43	34
COC[C@@H](CNC(=O)N1CCN(c2ccc(OC)cc2OC)CC1)OC	ZINC000875474750	FD	On-Demand	Clean	HTR1D	16	45
COC[C@@H](CNC(=O)N1CCN(c2ccc(OC)cc2OC)CC1)OC	ZINC000875474750	FD	On-Demand	Clean	HTR1B	20	45
COC[C@@H](CNC(=O)N1CCN(c2ccc(OC)cc2OC)CC1)OC	ZINC000875474750	FD	On-Demand	Clean	DRD3	50	39
COC[C@@H](CNC(=O)N1CCN(c2ccc(OC)cc2OC)CC1)OC	ZINC000875474750	FD	On-Demand	Clean	PDGFRB	49	42
COC[C@@H](CNC(=O)N1CCN(c2ccc(OC)cc2OC)CC1)OC	ZINC000875474750	FD	On-Demand	Clean	HTR7	30	40
COC[C@@H](CNC(=O)N1CCN(c2ccc(OC)cc2OC)CC1)OC	ZINC000875474750	FD	On-Demand	Clean	MTNR1B	27	40
CC[C@@H](NC(=O)NCc1ccc(C)nc1N1CCCC1)[C@@H](O)c1ccccc1	ZINC000875474752	GG	On-Demand	Anodyne	KCNQ2	49	36
CC[C@@H](NC(=O)NCc1ccc(C)nc1N1CCCC1)[C@H](O)c1ccccc1	ZINC000875474754	GG	On-Demand	Anodyne	KCNQ2	49	36
CCn1nncc1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875474765	GD	On-Demand	Anodyne	DRD2	15	41
CCn1nncc1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875474765	GD	On-Demand	Anodyne	DRD4	36	40
CCn1nncc1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875474765	GD	On-Demand	Anodyne	ACHE	59	54
CCn1nncc1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875474765	GD	On-Demand	Anodyne	SIGMAR1	40	43
CCn1nncc1CNC(=O)C(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875474765	GD	On-Demand	Anodyne	BCHE	16	45
O=C(NCC[C@@H]1CCCCO1)NC1CC(Nc2ccccc2)C1	ZINC000875474770	DF	On-Demand	Anodyne	EPHX2	15	44
O=C(NCC[C@H]1CCCCO1)NC1CC(Nc2ccccc2)C1	ZINC000875474771	DF	On-Demand	Anodyne	EPHX2	15	44
COC[C@@H](CNC(=O)N(C)C[C@H]1CCCCN1Cc1ccccc1)OC	ZINC000875474782	FE	On-Demand	Anodyne	DRD2	17	42
COC[C@@H](CNC(=O)N(C)C[C@H]1CCCCN1Cc1ccccc1)OC	ZINC000875474782	FE	On-Demand	Anodyne	FKBP1A	40	36
COC[C@@H](CNC(=O)N(C)C[C@H]1CCCCN1Cc1ccccc1)OC	ZINC000875474782	FE	On-Demand	Anodyne	SIGMAR1	17	45
CCCCCCCNC(=O)C(=O)NCc1nncn1-c1ccccc1	ZINC000875474789	ED	On-Demand	Mild	SOAT1	41	40
CCCCCCCNC(=O)C(=O)NCc1nncn1-c1ccccc1	ZINC000875474789	ED	On-Demand	Mild	ASAH1	93	39
COC[C@@H](CNC(=O)N(C)CCc1cccc(C#N)c1)OC	ZINC000875474795	DD	On-Demand	Mild	PDS	17	42
COC[C@@H](CNC(=O)NC[C@@H]1CN(Cc2ccc(C)cc2)CCO1)OC	ZINC000875474857	FD	On-Demand	Anodyne	DRD4	15	42
COC[C@@H](CNC(=O)NC[C@H]1CN(Cc2ccc(C)cc2)CCO1)OC	ZINC000875474859	FD	On-Demand	Anodyne	DRD4	15	42
COC[C@@H](CNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)OC	ZINC000875474867	ED	On-Demand	Anodyne	OPRL1	15	44
CCCN(C(=O)c1ccccc1NC(=O)c1c(Cl)nn(C)c1Cl)C(C)C	ZINC000875474890	GI	On-Demand	Anodyne	G2YM83_BOTF4	58	34
COC[C@@H](CNC(=O)N1CCN(c2ccc(F)cc2F)CC1)OC	ZINC000875474904	ED	On-Demand	Anodyne	NPY2R	62	39
COC[C@@H](CNC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1)OC	ZINC000875474986	FD	On-Demand	Anodyne	DRD4	42	34
COC[C@@H](CNC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1)OC	ZINC000875474986	FD	On-Demand	Anodyne	CTSL	17	40
COC[C@@H](CNC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1)OC	ZINC000875474986	FD	On-Demand	Anodyne	CCR2	25	40
COC[C@@H](CNC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1)OC	ZINC000875474986	FD	On-Demand	Anodyne	EPHX2	19	43
COC[C@@H](CNC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1)OC	ZINC000875474986	FD	On-Demand	Anodyne	CCR8	25	40
COC[C@@H](CNC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1)OC	ZINC000875474986	FD	On-Demand	Anodyne	KCNK3	50	34
COC[C@@H](CNC(=O)N1CCC(NC(=O)c2cccc(C)c2)CC1)OC	ZINC000875474986	FD	On-Demand	Anodyne	KCNK9	40	34
COC[C@@H](CNC(=O)N1CCC(c2nc(C3CCC3)no2)CC1)OC	ZINC000875475068	FD	On-Demand	Anodyne	SMO	41	46
COC[C@@H](CNC(=O)N1CCC(c2nc(C3CCC3)no2)CC1)OC	ZINC000875475068	FD	On-Demand	Anodyne	ETHR	60	48
COC[C@@H](CNC(=O)N[C@H](Cc1cccnc1)C1CCCC1)OC	ZINC000875475150	EE	On-Demand	Anodyne	FKBP1A	15	42
COC[C@@H](CNC(=O)N[C@@H](Cc1cccnc1)C1CCCC1)OC	ZINC000875475152	EE	On-Demand	Anodyne	FKBP1A	15	42
COC[C@@H](CNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1)OC	ZINC000875475155	FF	On-Demand	Anodyne	RBP4	37	40
COC[C@@H](CNC(=O)N1CCC[C@H](c2ccccc2OC)CC1)OC	ZINC000875475156	FF	On-Demand	Anodyne	RBP4	37	40
COC[C@@H](CNC(=O)N1CCC[C@]1(C)Cc1ccc(C)cc1)OC	ZINC000875475198	EF	On-Demand	Anodyne	SLC12A5	61	41
COC[C@@H](CNC(=O)N1CCC[C@@]1(C)Cc1ccc(C)cc1)OC	ZINC000875475199	EF	On-Demand	Anodyne	SLC12A5	61	41
COC[C@@H](CNC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)OC	ZINC000875475206	EC	On-Demand	Anodyne	ETHR	41	35
COC[C@@H](CNC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)OC	ZINC000875475209	EC	On-Demand	Anodyne	ETHR	41	35
COC[C@@H](CNC(=O)NCc1ccc(O)c(Cl)c1)OC	ZINC000875475217	DD	On-Demand	Anodyne	NCE103	16	52
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C)nc1N1CCCC1	ZINC000875475224	FE	On-Demand	Anodyne	SLC6A3	49	36
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C)nc1N1CCCC1	ZINC000875475225	FE	On-Demand	Anodyne	SLC6A3	49	36
COC[C@@H](CNC(=O)N1CCC([C@H](O)c2cccc(OC)c2)CC1)OC	ZINC000875475228	FD	On-Demand	Anodyne	DRD4	42	32
COC[C@@H](CNC(=O)N1CCC([C@@H](O)c2cccc(OC)c2)CC1)OC	ZINC000875475229	FD	On-Demand	Anodyne	DRD4	42	32
C[C@H](NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1)C1=CCN(C)CC1	ZINC000875475242	FF	On-Demand	Mild	ITK	15	45
COC[C@@H](CNC(=O)NCCc1c[nH]c2cc(F)c(C)cc12)OC	ZINC000875475246	EE	On-Demand	Anodyne	MPO	59	37
CCCCCCCNC(=O)C(=O)N[C@@H]1CCCN(C)C1	ZINC000875475277	CD	On-Demand	Mild	TPP2	17	40
CCCCCCCNC(=O)C(=O)N[C@@H]1CCCN(C)C1	ZINC000875475277	CD	On-Demand	Mild	ASAH1	54	35
CCCCCCCNC(=O)C(=O)N[C@H]1CCCN(C)C1	ZINC000875475278	CD	On-Demand	Mild	TPP2	17	40
CCCCCCCNC(=O)C(=O)N[C@H]1CCCN(C)C1	ZINC000875475278	CD	On-Demand	Mild	ASAH1	54	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NC[C@H](C)C#N)CC2	ZINC000875475363	DE	On-Demand	Mild	SLC18A2	53	42
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NC[C@@H](C)C#N)CC2	ZINC000875475364	DE	On-Demand	Mild	SLC18A2	53	42
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NC[C@@H](C)C#N)CC2	ZINC000875475365	DE	On-Demand	Mild	SLC18A2	53	42
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NC[C@H](C)C#N)CC2	ZINC000875475366	DE	On-Demand	Mild	SLC18A2	53	42
C=CCC[C@@H](NC(=O)c1c(Cl)nn(C)c1Cl)c1ccccc1	ZINC000875475387	EI	On-Demand	Mild	TACR3	49	41
C=CCC[C@@H](NC(=O)c1c(Cl)nn(C)c1Cl)c1ccccc1	ZINC000875475387	EI	On-Demand	Mild	UTS2	61	38
C=CCC[C@H](NC(=O)c1c(Cl)nn(C)c1Cl)c1ccccc1	ZINC000875475388	EI	On-Demand	Mild	TACR3	49	41
C=CCC[C@H](NC(=O)c1c(Cl)nn(C)c1Cl)c1ccccc1	ZINC000875475388	EI	On-Demand	Mild	UTS2	61	38
CC(=O)C1CCN(C(=O)NC2CCC(c3ccc(F)cc3)CC2)CC1	ZINC000875475395	EH	On-Demand	Anodyne	CCR1	24	42
CC(=O)C1CCN(C(=O)NC2CCC(c3ccc(F)cc3)CC2)CC1	ZINC000875475395	EH	On-Demand	Anodyne	EPHX2	37	41
C[C@H](C#N)CNC(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875475398	DD	On-Demand	Mild	NPY2R	66	38
O=C(NCc1ccccc1CN1CC[C@@H](O)C1)N1CCC(CO)(CO)CC1	ZINC000875475426	GC	On-Demand	Anodyne	EPHX2	16	41
O=C(NCc1ccccc1CN1CC[C@H](O)C1)N1CCC(CO)(CO)CC1	ZINC000875475428	GC	On-Demand	Anodyne	EPHX2	16	41
O=C(NCc1ccccc1CN1CC[C@H](O)C1)NC1CC(Nc2ccccc2)C1	ZINC000875475537	GF	On-Demand	Anodyne	SIGMAR1	16	41
O=C(NCc1ccccc1CN1CC[C@H](O)C1)NC1CC(Nc2ccccc2)C1	ZINC000875475537	GF	On-Demand	Anodyne	CCR3	30	42
O=C(NCc1ccccc1CN1CC[C@H](O)C1)NC1CC(Nc2ccccc2)C1	ZINC000875475537	GF	On-Demand	Anodyne	MCHR1	15	42
O=C(NCc1ccccc1CN1CC[C@@H](O)C1)NC1CC(Nc2ccccc2)C1	ZINC000875475538	GF	On-Demand	Anodyne	SIGMAR1	16	41
O=C(NCc1ccccc1CN1CC[C@@H](O)C1)NC1CC(Nc2ccccc2)C1	ZINC000875475538	GF	On-Demand	Anodyne	CCR3	30	42
O=C(NCc1ccccc1CN1CC[C@@H](O)C1)NC1CC(Nc2ccccc2)C1	ZINC000875475538	GF	On-Demand	Anodyne	MCHR1	15	42
C[C@H](C#N)CNC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875475543	DE	On-Demand	Mild	SMO	38	43
C[C@H](C#N)CNC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875475543	DE	On-Demand	Mild	ETHR	65	53
C[C@H](C#N)CNC(=O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000875475599	DG	On-Demand	Mild	AVPR1A	17	40
C[C@H](C#N)CNC(=O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000875475599	DG	On-Demand	Mild	GRIN2B	42	39
C[C@H](C#N)CNC(=O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000875475599	DG	On-Demand	Mild	CCR3	38	44
C[C@H](C#N)CNC(=O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000875475599	DG	On-Demand	Mild	CACNA1I	41	33
C[C@H](C#N)CNC(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875475601	CE	On-Demand	Mild	OXTR	42	35
C[C@H](C#N)CNC(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875475601	CE	On-Demand	Mild	GHRHR	17	40
C[C@H](C#N)CNC(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875475602	CE	On-Demand	Mild	OXTR	42	35
C[C@H](C#N)CNC(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875475602	CE	On-Demand	Mild	GHRHR	17	40
O=C(NC1CCC(c2ccc(F)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875475605	FF	On-Demand	Anodyne	CACNA1H	45	38
O=C(NC1CCC(c2ccc(F)cc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875475605	FF	On-Demand	Anodyne	EPHX2	22	40
C[C@H](C#N)CNC(=O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000875475621	DG	On-Demand	Mild	CCR3	19	42
C[C@H](C#N)CNC(=O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000875475621	DG	On-Demand	Mild	CTSS	22	43
C[C@H](C#N)CNC(=O)N1CCC(Cc2ccccc2Cl)CC1	ZINC000875475621	DG	On-Demand	Mild	EPHX2	17	43
COC[C@@H](CNC(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1C)OC	ZINC000875475638	FD	On-Demand	Anodyne	SLC18A2	52	41
COC[C@@H](CNC(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1C)OC	ZINC000875475638	FD	On-Demand	Anodyne	MTNR1B	15	48
COC[C@@H](CNC(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1C)OC	ZINC000875475641	FD	On-Demand	Anodyne	SLC18A2	52	41
COC[C@@H](CNC(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1C)OC	ZINC000875475641	FD	On-Demand	Anodyne	MTNR1B	15	48
COC[C@@H](CNC(=O)NCc1cccc(OC(C)(C)C)c1)OC	ZINC000875475682	DE	On-Demand	Anodyne	ROCK2	21	40
COC[C@@H](CNC(=O)NCc1cccc(OC(C)(C)C)c1)OC	ZINC000875475682	DE	On-Demand	Anodyne	PDS	73	38
COC[C@@H](CNC(=O)N1CC[C@]2(CCc3ccccc32)C1)OC	ZINC000875475689	DD	On-Demand	Anodyne	GHRHR	28	42
COC[C@@H](CNC(=O)N1CC[C@@]2(CCc3ccccc32)C1)OC	ZINC000875475691	DD	On-Demand	Anodyne	GHRHR	28	42
CCCCCCCNC(=O)C(=O)N[C@H](C)C(C)C	ZINC000875475749	CE	On-Demand	Mild	ASAH1	95	38
CCCCCCCNC(=O)C(=O)N[C@H](C)C(C)C	ZINC000875475749	CE	On-Demand	Mild	NOD1	83	42
CCCCCCCNC(=O)C(=O)N[C@H](C)C(C)C	ZINC000875475749	CE	On-Demand	Mild	CQSS	55	37
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1cncc(F)c1	ZINC000875475763	DD	On-Demand	Anodyne	CACNA1H	40	40
C[C@@H](NC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)c1cncc(F)c1	ZINC000875475766	FF	On-Demand	Anodyne	FAAH	15	45
C[C@H](C#N)CNC(=O)N[C@H](C)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875475768	EE	On-Demand	Mild	GPR119	28	45
C[C@H](C#N)CNC(=O)N[C@@H](C)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875475769	EE	On-Demand	Mild	GPR119	28	45
C[C@H](C#N)CNC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875475789	CE	On-Demand	Mild	CCR3	18	41
C[C@H](C#N)CNC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875475789	CE	On-Demand	Mild	MLNR	15	42
C[C@H](C#N)CNC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875475789	CE	On-Demand	Mild	EPHX2	25	48
C[C@H](C#N)CNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875475792	EF	On-Demand	Mild	DRD2	20	46
C[C@H](C#N)CNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875475792	EF	On-Demand	Mild	DRD4	43	43
C[C@H](C#N)CNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875475792	EF	On-Demand	Mild	ACHE	65	61
C[C@H](C#N)CNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875475792	EF	On-Demand	Mild	HRH2	21	41
C[C@H](C#N)CNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875475792	EF	On-Demand	Mild	SLC6A3	20	50
C[C@H](C#N)CNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875475792	EF	On-Demand	Mild	HTR4	32	44
C[C@H](C#N)CNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875475792	EF	On-Demand	Mild	SIGMAR1	57	44
C[C@H](C#N)CNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875475792	EF	On-Demand	Mild	BCHE	18	48
C[C@H](C#N)CNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875475792	EF	On-Demand	Mild	CCR3	51	43
C[C@H](C#N)CNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875475792	EF	On-Demand	Mild	MCHR1	27	43
C[C@H](C#N)CNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875475792	EF	On-Demand	Mild	CACNA1G	29	41
C[C@H](C#N)CNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875475792	EF	On-Demand	Mild	CACNA1I	46	36
O=C(NCC[C@H](O)C1CCCC1)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000875475793	GD	On-Demand	Anodyne	OPRK1	21	41
O=C(NCC[C@H](O)C1CCCC1)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000875475794	GD	On-Demand	Anodyne	OPRK1	21	41
O=C(NCC[C@@H](O)C1CCCC1)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000875475795	GD	On-Demand	Anodyne	OPRK1	21	41
O=C(NCC[C@@H](O)C1CCCC1)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000875475796	GD	On-Demand	Anodyne	OPRK1	21	41
CCCCCCCNC(=O)C(=O)N[C@@H](C)C(C)C	ZINC000875475891	CE	On-Demand	Mild	ASAH1	95	38
CCCCCCCNC(=O)C(=O)N[C@@H](C)C(C)C	ZINC000875475891	CE	On-Demand	Mild	NOD1	83	42
CCCCCCCNC(=O)C(=O)N[C@@H](C)C(C)C	ZINC000875475891	CE	On-Demand	Mild	CQSS	55	37
COC(=O)N(C)NC(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000875475929	EC	On-Demand	Reactive	OPRK1	21	41
COC(=O)N(C)NC(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000875475931	EC	On-Demand	Reactive	OPRK1	21	41
COC[C@@H](CNC(=O)NC1CCN(c2ccccc2C#N)CC1)OC	ZINC000875475952	ED	On-Demand	Mild	DRD2	21	41
COC[C@@H](CNC(=O)NC1CCN(c2ccccc2C#N)CC1)OC	ZINC000875475952	ED	On-Demand	Mild	NPY1R	16	40
COc1cccc([C@H](O)C2CCN(C(=O)NCC(C)(C)C#N)CC2)c1	ZINC000875475959	EF	On-Demand	Mild	DRD4	43	33
COC[C@@H](CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)OC	ZINC000875475985	GD	On-Demand	Anodyne	FKBP1A	28	40
COC[C@@H](CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)OC	ZINC000875475985	GD	On-Demand	Anodyne	ELANE	20	40
COC[C@@H](CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)OC	ZINC000875475985	GD	On-Demand	Anodyne	CTSB	47	50
COC[C@@H](CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)OC	ZINC000875475985	GD	On-Demand	Anodyne	CYSP_TRYCR	42	37
COC[C@@H](CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)OC	ZINC000875475985	GD	On-Demand	Anodyne	CTSK	33	50
COC[C@@H](CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)OC	ZINC000875475985	GD	On-Demand	Anodyne	CTSL	40	36
COC[C@@H](CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)OC	ZINC000875475985	GD	On-Demand	Anodyne	CAPNS1	59	34
COC[C@@H](CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)OC	ZINC000875475985	GD	On-Demand	Anodyne	CTSS	24	41
COC[C@@H](CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)OC	ZINC000875475985	GD	On-Demand	Anodyne	CAPN1	69	38
COC[C@@H](CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)OC	ZINC000875475985	GD	On-Demand	Anodyne	CAPN2	120	38
COC[C@@H](CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)OC	ZINC000875475985	GD	On-Demand	Anodyne	TGM2	38	43
COC[C@@H](CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)OC	ZINC000875475985	GD	On-Demand	Anodyne	NPR	56	34
COC[C@@H](CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)OC	ZINC000875475985	GD	On-Demand	Anodyne	F13A1	22	43
COC[C@@H](CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1)OC	ZINC000875475985	GD	On-Demand	Anodyne	NAAA	43	42
COC[C@@H](CNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)OC	ZINC000875475991	ED	On-Demand	Anodyne	FAAH	19	41
O=C(NCC[C@@H]1CCCCO1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875476023	GG	On-Demand	Anodyne	PDE8B	20	41
C[C@H](C#N)CNC(=O)NCC1(c2ccccc2)CCN(C)CC1	ZINC000875476024	DE	On-Demand	Mild	KCNA3	46	37
C[C@H](C#N)CNC(=O)NCC1(c2ccccc2)CCN(C)CC1	ZINC000875476024	DE	On-Demand	Mild	SOAT1	19	47
C[C@H](C#N)CNC(=O)N[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1	ZINC000875476053	DD	On-Demand	Mild	CTSS	20	42
C[C@H](C#N)CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875476054	DE	On-Demand	Mild	ACE	27	41
C[C@H](C#N)CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875476055	DE	On-Demand	Mild	ACE	27	41
C[C@H](C#N)CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875476056	DE	On-Demand	Mild	ACE	27	41
C[C@H](C#N)CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875476057	DE	On-Demand	Mild	ACE	27	41
C[C@H](C#N)CNC(=O)NC1CCN(c2ccccc2C#N)CC1	ZINC000875476079	DD	On-Demand	Mild	DRD2	18	42
C[C@H](C#N)CNC(=O)NC1CCN(c2ccccc2C#N)CC1	ZINC000875476079	DD	On-Demand	Mild	ADRA1D	32	42
C[C@H](C#N)CNC(=O)NC1CCN(c2ccccc2C#N)CC1	ZINC000875476079	DD	On-Demand	Mild	ADRA1A	27	42
C[C@H](C#N)CNC(=O)NC1CCN(c2ccccc2C#N)CC1	ZINC000875476079	DD	On-Demand	Mild	ADRA1B	22	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cncc(F)c1	ZINC000875476110	DE	On-Demand	Anodyne	SLC6A3	34	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cncc(F)c1	ZINC000875476111	DE	On-Demand	Anodyne	SLC6A3	34	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H](C)c1cncc(F)c1	ZINC000875476112	DE	On-Demand	Anodyne	SLC6A3	34	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H](C)c1cncc(F)c1	ZINC000875476113	DE	On-Demand	Anodyne	SLC6A3	34	40
O=C(NCC[C@H]1CCCCO1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875476124	GG	On-Demand	Anodyne	PDE8B	20	41
O=C(NCC[C@@H]1CCCCO1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875476125	EF	On-Demand	Anodyne	ADRB1	19	40
O=C(NCC[C@@H]1CCCCO1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875476126	EF	On-Demand	Anodyne	ADRB1	19	40
O=C(NCC[C@H]1CCCCO1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875476127	EF	On-Demand	Anodyne	ADRB1	19	40
O=C(NCC[C@H]1CCCCO1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875476128	EF	On-Demand	Anodyne	ADRB1	19	40
COC[C@@H](CNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1)OC	ZINC000875476151	ED	On-Demand	Anodyne	MAOB	17	45
COC[C@@H](CNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1)OC	ZINC000875476151	ED	On-Demand	Anodyne	ADRB3	34	41
COC[C@@H](CNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1)OC	ZINC000875476151	ED	On-Demand	Anodyne	CTSV	29	40
COC[C@@H](CNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1)OC	ZINC000875476151	ED	On-Demand	Anodyne	PDS	75	40
COC[C@@H](CNC(=O)NC[C@H](O)Cc1cccc(Cl)c1)OC	ZINC000875476152	ED	On-Demand	Anodyne	MAOB	17	45
COC[C@@H](CNC(=O)NC[C@H](O)Cc1cccc(Cl)c1)OC	ZINC000875476152	ED	On-Demand	Anodyne	ADRB3	34	41
COC[C@@H](CNC(=O)NC[C@H](O)Cc1cccc(Cl)c1)OC	ZINC000875476152	ED	On-Demand	Anodyne	CTSV	29	40
COC[C@@H](CNC(=O)NC[C@H](O)Cc1cccc(Cl)c1)OC	ZINC000875476152	ED	On-Demand	Anodyne	PDS	75	40
COC[C@@H](CNC(=O)NCC1(c2ccccc2)CCN(C)CC1)OC	ZINC000875476197	ED	On-Demand	Anodyne	KCNA3	50	40
COC[C@@H](CNC(=O)NCC1(c2ccccc2)CCN(C)CC1)OC	ZINC000875476197	ED	On-Demand	Anodyne	SOAT1	19	43
COC[C@@H](CNC(=O)NCc1nc(-c2ccncc2)cs1)OC	ZINC000875476210	ED	On-Demand	Anodyne	ROCK1	26	48
COC[C@@H](CNC(=O)NCc1nc(-c2ccncc2)cs1)OC	ZINC000875476210	ED	On-Demand	Anodyne	ROCK2	19	48
COC[C@@H](CNC(=O)N[C@@H](C)C1CCN(C(=O)OC(C)(C)C)CC1)OC	ZINC000875476263	FD	On-Demand	Anodyne	GPR119	24	43
COC[C@@H](CNC(=O)N[C@H](C)C1CCN(C(=O)OC(C)(C)C)CC1)OC	ZINC000875476267	FD	On-Demand	Anodyne	GPR119	24	43
COc1cccc([C@H](O)C2CCN(C(=O)NC[C@H](C)C#N)CC2)c1	ZINC000875476349	EE	On-Demand	Mild	DRD4	43	34
COc1cccc([C@H](O)C2CCN(C(=O)NC[C@H](C)C#N)CC2)c1	ZINC000875476349	EE	On-Demand	Mild	MTNR1A	22	41
COc1cccc([C@H](O)C2CCN(C(=O)NC[C@H](C)C#N)CC2)c1	ZINC000875476349	EE	On-Demand	Mild	MTNR1B	29	41
COc1cccc([C@H](O)C2CCN(C(=O)NC[C@@H](C)C#N)CC2)c1	ZINC000875476352	EE	On-Demand	Mild	DRD4	43	34
COc1cccc([C@H](O)C2CCN(C(=O)NC[C@@H](C)C#N)CC2)c1	ZINC000875476352	EE	On-Demand	Mild	MTNR1A	22	41
COc1cccc([C@H](O)C2CCN(C(=O)NC[C@@H](C)C#N)CC2)c1	ZINC000875476352	EE	On-Demand	Mild	MTNR1B	29	41
CN1CC[C@H]2CN(C(=O)NCCN3CCNC(=O)C3)CC[C@H]21	ZINC000875476355	DB	On-Demand	Anodyne	PLD1	60	33
CN1CC[C@H]2CN(C(=O)NCCN3CCNC(=O)C3)CC[C@H]21	ZINC000875476355	DB	On-Demand	Anodyne	PLD2	60	33
CN1CC[C@H]2CN(C(=O)NCCN3CCNC(=O)C3)CC[C@@H]21	ZINC000875476356	DB	On-Demand	Anodyne	PLD1	60	33
CN1CC[C@H]2CN(C(=O)NCCN3CCNC(=O)C3)CC[C@@H]21	ZINC000875476356	DB	On-Demand	Anodyne	PLD2	60	33
COc1ccccc1[C@H]1CCCN(C(=O)N[C@H](C)c2cncc(F)c2)CC1	ZINC000875476386	FI	On-Demand	Anodyne	GRIN2B	15	42
COc1ccccc1[C@H]1CCCN(C(=O)N[C@H](C)c2cncc(F)c2)CC1	ZINC000875476386	FI	On-Demand	Anodyne	RBP4	42	41
COc1ccccc1[C@H]1CCCN(C(=O)N[C@@H](C)c2cncc(F)c2)CC1	ZINC000875476388	FI	On-Demand	Anodyne	GRIN2B	15	42
COc1ccccc1[C@H]1CCCN(C(=O)N[C@@H](C)c2cncc(F)c2)CC1	ZINC000875476388	FI	On-Demand	Anodyne	RBP4	42	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H](C)c2cncc(F)c2)CC1	ZINC000875476389	FI	On-Demand	Anodyne	GRIN2B	15	42
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H](C)c2cncc(F)c2)CC1	ZINC000875476389	FI	On-Demand	Anodyne	RBP4	42	41
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H](C)c2cncc(F)c2)CC1	ZINC000875476390	FI	On-Demand	Anodyne	GRIN2B	15	42
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H](C)c2cncc(F)c2)CC1	ZINC000875476390	FI	On-Demand	Anodyne	RBP4	42	41
C[C@H](C#N)CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875476450	DF	On-Demand	Mild	CTSF	68	36
C[C@H](C#N)CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875476450	DF	On-Demand	Mild	CTSL	24	41
C[C@H](C#N)CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875476450	DF	On-Demand	Mild	CTSS	16	41
C[C@H](C#N)CNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875476453	DF	On-Demand	Mild	CTSF	68	36
C[C@H](C#N)CNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875476453	DF	On-Demand	Mild	CTSL	24	41
C[C@H](C#N)CNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875476453	DF	On-Demand	Mild	CTSS	16	41
C[C@H](C#N)CNC(=O)NCC1(c2cccc(Cl)c2)CCC1	ZINC000875476540	DG	On-Demand	Mild	MCHR1	15	44
C[C@H](C#N)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875476575	EE	On-Demand	Mild	ELANE	23	40
C[C@H](C#N)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875476575	EE	On-Demand	Mild	CTSB	60	58
C[C@H](C#N)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875476575	EE	On-Demand	Mild	CTSK	45	58
C[C@H](C#N)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875476575	EE	On-Demand	Mild	CTSL	48	58
C[C@H](C#N)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875476575	EE	On-Demand	Mild	PREP	21	46
C[C@H](C#N)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875476575	EE	On-Demand	Mild	CAPNS1	62	35
C[C@H](C#N)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875476575	EE	On-Demand	Mild	LGMN	72	39
C[C@H](C#N)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875476575	EE	On-Demand	Mild	CTSS	43	40
C[C@H](C#N)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875476575	EE	On-Demand	Mild	CAPN1	77	37
C[C@H](C#N)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875476575	EE	On-Demand	Mild	CAPN2	132	37
C[C@H](C#N)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875476575	EE	On-Demand	Mild	TGM2	37	43
C[C@H](C#N)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875476575	EE	On-Demand	Mild	NPR	61	36
C[C@H](C#N)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875476575	EE	On-Demand	Mild	F13A1	22	43
C[C@H](C#N)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875476575	EE	On-Demand	Mild	NAAA	34	42
C[C@H](C#N)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875476575	EE	On-Demand	Mild	BIRC2	18	44
C[C@H](C#N)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875476575	EE	On-Demand	Mild	Q6PRC7_IXORI	52	34
C[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)[C@H]1CCCN(C2CCC2)C1	ZINC000875476609	GE	On-Demand	Anodyne	L3MBTL3	53	42
C[C@@H](NC(=O)N1CCC(N2CCN(C)CC2)CC1)[C@@H]1CCCN(C2CCC2)C1	ZINC000875476612	GE	On-Demand	Anodyne	L3MBTL3	53	42
O=C(NCCO)C1CCN(C(=O)NC2CCC(c3ccc(F)cc3)CC2)CC1	ZINC000875476667	GE	On-Demand	Anodyne	EPHX2	25	40
C[C@H](C#N)CNC(=O)N[C@@H](C)c1ccc(C(F)(F)F)nc1	ZINC000875476829	DF	On-Demand	Mild	CTSF	46	32
C[C@H](C#N)CNC(=O)N[C@H](C)c1ccc(C(F)(F)F)nc1	ZINC000875476834	DF	On-Demand	Mild	CTSF	46	32
C[C@H](C#N)CNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875476872	CD	On-Demand	Mild	CTSL	20	47
C[C@H](C#N)CNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875476872	CD	On-Demand	Mild	CTSV	41	47
C[C@H](C#N)CNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875476873	CD	On-Demand	Mild	CTSL	20	47
C[C@H](C#N)CNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875476873	CD	On-Demand	Mild	CTSV	41	47
C[C@H](C#N)CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875476874	CE	On-Demand	Mild	ACE	37	40
C[C@H](C#N)CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875476874	CE	On-Demand	Mild	DPP4	26	41
C[C@H](C#N)CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875476874	CE	On-Demand	Mild	PREP	40	38
C[C@H](C#N)CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875476875	CE	On-Demand	Mild	ACE	37	40
C[C@H](C#N)CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875476875	CE	On-Demand	Mild	DPP4	26	41
C[C@H](C#N)CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875476875	CE	On-Demand	Mild	PREP	40	38
C[C@H](C#N)CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875476876	CE	On-Demand	Mild	ACE	37	40
C[C@H](C#N)CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875476876	CE	On-Demand	Mild	DPP4	26	41
C[C@H](C#N)CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875476876	CE	On-Demand	Mild	PREP	40	38
C[C@H](C#N)CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875476877	CE	On-Demand	Mild	ACE	37	40
C[C@H](C#N)CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875476877	CE	On-Demand	Mild	DPP4	26	41
C[C@H](C#N)CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875476877	CE	On-Demand	Mild	PREP	40	38
COc1ccc(N2CCN(C(=O)NC[C@H](C)C#N)CC2)c(OC)c1	ZINC000875476959	ED	On-Demand	Mild	HTR1A	34	43
COc1ccc(N2CCN(C(=O)NC[C@H](C)C#N)CC2)c(OC)c1	ZINC000875476959	ED	On-Demand	Mild	DRD2	33	41
COc1ccc(N2CCN(C(=O)NC[C@H](C)C#N)CC2)c(OC)c1	ZINC000875476959	ED	On-Demand	Mild	DRD4	44	35
COc1ccc(N2CCN(C(=O)NC[C@H](C)C#N)CC2)c(OC)c1	ZINC000875476959	ED	On-Demand	Mild	HTR1B	15	43
COc1ccc(N2CCN(C(=O)NC[C@H](C)C#N)CC2)c(OC)c1	ZINC000875476959	ED	On-Demand	Mild	DRD3	47	40
COc1ccc(N2CCN(C(=O)NC[C@H](C)C#N)CC2)c(OC)c1	ZINC000875476959	ED	On-Demand	Mild	PDGFRB	46	39
CN1CCC(CNC(=O)NCCN2CCNC(=O)C2)(c2ccccc2)CC1	ZINC000875476980	FC	On-Demand	Anodyne	KCNA3	42	43
CN1CCC(CNC(=O)NCCN2CCNC(=O)C2)(c2ccccc2)CC1	ZINC000875476980	FC	On-Demand	Anodyne	PLD2	43	36
COc1ccc(N2CCN(C(=O)NC[C@@H](C)C#N)CC2)c(OC)c1	ZINC000875477041	ED	On-Demand	Mild	HTR1A	34	43
COc1ccc(N2CCN(C(=O)NC[C@@H](C)C#N)CC2)c(OC)c1	ZINC000875477041	ED	On-Demand	Mild	DRD2	33	41
COc1ccc(N2CCN(C(=O)NC[C@@H](C)C#N)CC2)c(OC)c1	ZINC000875477041	ED	On-Demand	Mild	DRD4	44	35
COc1ccc(N2CCN(C(=O)NC[C@@H](C)C#N)CC2)c(OC)c1	ZINC000875477041	ED	On-Demand	Mild	HTR1B	15	43
COc1ccc(N2CCN(C(=O)NC[C@@H](C)C#N)CC2)c(OC)c1	ZINC000875477041	ED	On-Demand	Mild	DRD3	47	40
COc1ccc(N2CCN(C(=O)NC[C@@H](C)C#N)CC2)c(OC)c1	ZINC000875477041	ED	On-Demand	Mild	PDGFRB	46	39
C[C@H](C#N)CNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875477098	DD	On-Demand	Mild	CTSB	38	42
C[C@H](C#N)CNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875477098	DD	On-Demand	Mild	PAPA1_CARPA	42	37
C[C@H](C#N)CNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875477098	DD	On-Demand	Mild	CTSK	34	42
C[C@H](C#N)CNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875477098	DD	On-Demand	Mild	CTSL	36	42
C[C@H](C#N)CNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875477098	DD	On-Demand	Mild	CAPNS1	57	32
C[C@H](C#N)CNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875477098	DD	On-Demand	Mild	CAPN1	55	34
C[C@H](C#N)CNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875477098	DD	On-Demand	Mild	CAPN2	93	33
C[C@H](C#N)CNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875477098	DD	On-Demand	Mild	NPR	60	34
COC(=O)N(C)NC(=O)NC1CCC(c2ccc(F)cc2)CC1	ZINC000875477104	DF	On-Demand	Reactive	EPHX2	16	42
CC(C)(C#N)CNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875477131	EG	On-Demand	Reactive	TSHR	41	33
CC(C)(C#N)CNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875477131	EG	On-Demand	Reactive	MAOB	29	44
CC(C)(C#N)CNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875477131	EG	On-Demand	Reactive	LTA4H	27	46
CC(C)(C#N)CNC(=O)NNc1ccc(OCc2ccccc2)cc1	ZINC000875477131	EG	On-Demand	Reactive	FFAR1	31	40
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@H](C)[C@H]1CCCN(C3CCC3)C1)CC2	ZINC000875477146	GG	On-Demand	Anodyne	L3MBTL3	15	40
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@@H](C)[C@H]1CCCN(C3CCC3)C1)CC2	ZINC000875477147	GG	On-Demand	Anodyne	L3MBTL3	15	40
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@@H](C)[C@@H]1CCCN(C3CCC3)C1)CC2	ZINC000875477148	GG	On-Demand	Anodyne	L3MBTL3	15	40
CC(=O)Nc1ccc2c(c1)CN(C(=O)N[C@H](C)[C@@H]1CCCN(C3CCC3)C1)CC2	ZINC000875477149	GG	On-Demand	Anodyne	L3MBTL3	15	40
N#CCc1ccsc1C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875477183	GH	On-Demand	Mild	DRD4	23	40
N#CCc1ccsc1C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1	ZINC000875477184	GH	On-Demand	Mild	DRD4	23	40
C[C@H](C#N)CNC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875477251	DE	On-Demand	Mild	ROCK1	26	45
C[C@H](C#N)CNC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875477251	DE	On-Demand	Mild	ROCK2	19	45
CC(C)(C#N)CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875477253	DE	On-Demand	Mild	FKBP1A	26	42
CC(C)(C#N)CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875477253	DE	On-Demand	Mild	DPP4	44	43
CC(C)(C#N)CNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875477253	DE	On-Demand	Mild	PREP	50	37
CC(C)(C#N)CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875477254	DE	On-Demand	Mild	FKBP1A	26	42
CC(C)(C#N)CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875477254	DE	On-Demand	Mild	DPP4	44	43
CC(C)(C#N)CNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875477254	DE	On-Demand	Mild	PREP	50	37
CC(C)(C#N)CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875477255	DE	On-Demand	Mild	FKBP1A	26	42
CC(C)(C#N)CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875477255	DE	On-Demand	Mild	DPP4	44	43
CC(C)(C#N)CNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875477255	DE	On-Demand	Mild	PREP	50	37
CC(C)(C#N)CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875477256	DE	On-Demand	Mild	FKBP1A	26	42
CC(C)(C#N)CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875477256	DE	On-Demand	Mild	DPP4	44	43
CC(C)(C#N)CNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875477256	DE	On-Demand	Mild	PREP	50	37
C[C@H](C#N)CNC(=O)NCc1ccc(O)c(Cl)c1	ZINC000875477310	CE	On-Demand	Mild	NCE103	16	46
C[C@H](C#N)CNC(=O)NCc1cccc(OC(C)(C)C)c1	ZINC000875477324	CF	On-Demand	Mild	PDS	49	36
COc1ccc(N2CCN(C(=O)NCCN3CCNC(=O)C3)CC2)c(OC)c1	ZINC000875477368	GB	On-Demand	Clean	HTR1A	61	46
COc1ccc(N2CCN(C(=O)NCCN3CCNC(=O)C3)CC2)c(OC)c1	ZINC000875477368	GB	On-Demand	Clean	DRD2	46	48
COc1ccc(N2CCN(C(=O)NCCN3CCNC(=O)C3)CC2)c(OC)c1	ZINC000875477368	GB	On-Demand	Clean	DRD4	51	40
COc1ccc(N2CCN(C(=O)NCCN3CCNC(=O)C3)CC2)c(OC)c1	ZINC000875477368	GB	On-Demand	Clean	ADRA1D	41	41
COc1ccc(N2CCN(C(=O)NCCN3CCNC(=O)C3)CC2)c(OC)c1	ZINC000875477368	GB	On-Demand	Clean	HTR1B	20	41
COc1ccc(N2CCN(C(=O)NCCN3CCNC(=O)C3)CC2)c(OC)c1	ZINC000875477368	GB	On-Demand	Clean	ADRA1A	41	41
COc1ccc(N2CCN(C(=O)NCCN3CCNC(=O)C3)CC2)c(OC)c1	ZINC000875477368	GB	On-Demand	Clean	DRD3	63	41
COc1ccc(N2CCN(C(=O)NCCN3CCNC(=O)C3)CC2)c(OC)c1	ZINC000875477368	GB	On-Demand	Clean	HTR7	45	38
COc1ccc(N2CCN(C(=O)NCCN3CCNC(=O)C3)CC2)c(OC)c1	ZINC000875477368	GB	On-Demand	Clean	MTNR1B	19	40
O=C(NC1CCC(c2ccc(F)cc2)CC1)N1CCC2(CCNC2=O)CC1	ZINC000875477418	FG	On-Demand	Anodyne	CACNA1H	63	38
O=C(NC1CCC(c2ccc(F)cc2)CC1)N1CCC2(CCNC2=O)CC1	ZINC000875477418	FG	On-Demand	Anodyne	CALCRL	15	49
C[C@H](C#N)CNC(=O)N1CCC(CO[C@@H]2CCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000875477505	GF	On-Demand	Mild	GPR119	29	43
C[C@H](C#N)CNC(=O)N1CCC(CO[C@H]2CCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000875477509	GF	On-Demand	Mild	GPR119	29	43
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCCN1CCNC(=O)C1)CC2	ZINC000875477643	GC	On-Demand	Anodyne	SLC18A2	49	36
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCCN1CCNC(=O)C1)CC2	ZINC000875477644	GC	On-Demand	Anodyne	SLC18A2	49	36
N#Cc1cc(F)ccc1N1CCN(C(=O)NCCN2CCNC(=O)C2)CC1	ZINC000875477649	FB	On-Demand	Mild	PLD2	55	33
Cn1nc(Cl)c(C(=O)NC(C)(C)C(=O)NCC2CCCC2)c1Cl	ZINC000875477750	FF	On-Demand	Anodyne	CACNA1I	55	35
COc1ccccc1[C@H]1CCCN(C(=O)NCCN2CCNC(=O)C2)CC1	ZINC000875477751	FD	On-Demand	Anodyne	HTR1A	29	40
COc1ccccc1[C@H]1CCCN(C(=O)NCCN2CCNC(=O)C2)CC1	ZINC000875477751	FD	On-Demand	Anodyne	DRD2	26	43
COc1ccccc1[C@H]1CCCN(C(=O)NCCN2CCNC(=O)C2)CC1	ZINC000875477751	FD	On-Demand	Anodyne	DRD4	15	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCCN2CCNC(=O)C2)CC1	ZINC000875477752	FD	On-Demand	Anodyne	HTR1A	29	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCCN2CCNC(=O)C2)CC1	ZINC000875477752	FD	On-Demand	Anodyne	DRD2	26	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCCN2CCNC(=O)C2)CC1	ZINC000875477752	FD	On-Demand	Anodyne	DRD4	15	42
CN(C(=O)c1cccn(C(C)(C)C)c1=O)c1c(Cl)cccc1Cl	ZINC000875477868	FI	On-Demand	Anodyne	ECR	48	37
C[C@H](NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1)[C@H]1CCCN(C2CCC2)C1	ZINC000875477890	GG	On-Demand	Anodyne	BIRC3	35	42
C[C@H](NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1)[C@H]1CCCN(C2CCC2)C1	ZINC000875477890	GG	On-Demand	Anodyne	BIRC2	41	38
C[C@@H](NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1)[C@H]1CCCN(C2CCC2)C1	ZINC000875477891	GG	On-Demand	Anodyne	BIRC3	35	42
C[C@@H](NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1)[C@H]1CCCN(C2CCC2)C1	ZINC000875477891	GG	On-Demand	Anodyne	BIRC2	41	38
C[C@@H](NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1)[C@@H]1CCCN(C2CCC2)C1	ZINC000875477892	GG	On-Demand	Anodyne	BIRC3	35	42
C[C@@H](NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1)[C@@H]1CCCN(C2CCC2)C1	ZINC000875477892	GG	On-Demand	Anodyne	BIRC2	41	38
C[C@H](NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1)[C@@H]1CCCN(C2CCC2)C1	ZINC000875477893	GG	On-Demand	Anodyne	BIRC3	35	42
C[C@H](NC(=O)N1C[C@@H]2C[C@H]1CN2c1ccccc1)[C@@H]1CCCN(C2CCC2)C1	ZINC000875477893	GG	On-Demand	Anodyne	BIRC2	41	38
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000875478086	GG	On-Demand	Mild	CTSF	46	32
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000875478086	GG	On-Demand	Mild	MCHR1	38	45
O=C(CCCCNC(=O)N1CC[C@@H]2CC[C@@H](O)[C@@H]21)OCc1ccccc1	ZINC000875478122	FE	On-Demand	Anodyne	FKBP1A	29	41
O=C(CCCCNC(=O)N1CC[C@@H]2CC[C@@H](O)[C@@H]21)OCc1ccccc1	ZINC000875478122	FE	On-Demand	Anodyne	PREP	38	42
O=C(CCCCNC(=O)N1CC=CC1)OCc1ccccc1	ZINC000875478129	DE	On-Demand	Anodyne	PREP	17	43
O=C(CCCCNC(=O)N1CC=CC1)OCc1ccccc1	ZINC000875478129	DE	On-Demand	Anodyne	CAPN2	42	37
O=C(CCCCNC(=O)N1CC=CC1)OCc1ccccc1	ZINC000875478129	DE	On-Demand	Anodyne	TGM2	29	40
O=C(CCCCNC(=O)N1CC=CC1)OCc1ccccc1	ZINC000875478129	DE	On-Demand	Anodyne	NPR	42	36
O=C(CCCCNC(=O)N1CCC(CO)(CO)CC1)OCc1ccccc1	ZINC000875478132	GD	On-Demand	Anodyne	GHRHR	47	31
O=C(CCCCNC(=O)N1CCC(CO)(CO)CC1)OCc1ccccc1	ZINC000875478132	GD	On-Demand	Anodyne	PREP	15	42
O=C(CCCCNC(=O)N1CCC(CO)(CO)CC1)OCc1ccccc1	ZINC000875478132	GD	On-Demand	Anodyne	EPHX2	16	53
O=C(CCCCNC(=O)N1CCC(CO)(CO)CC1)OCc1ccccc1	ZINC000875478132	GD	On-Demand	Anodyne	TGM2	28	42
O=C(CCCCNC(=O)N1CCC(CO)(CO)CC1)OCc1ccccc1	ZINC000875478132	GD	On-Demand	Anodyne	SLC12A5	63	37
CC(C)(C#N)CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875478133	DF	On-Demand	Mild	FKBP1A	31	46
CC(C)(C#N)CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875478133	DF	On-Demand	Mild	CPT1A	42	36
CC(C)(C#N)CNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875478133	DF	On-Demand	Mild	DPP4	25	42
CC(C)(C#N)CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875478134	DF	On-Demand	Mild	FKBP1A	31	46
CC(C)(C#N)CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875478134	DF	On-Demand	Mild	CPT1A	42	36
CC(C)(C#N)CNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875478134	DF	On-Demand	Mild	DPP4	25	42
CC(C)(C#N)CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875478135	DF	On-Demand	Mild	FKBP1A	31	46
CC(C)(C#N)CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875478135	DF	On-Demand	Mild	CPT1A	42	36
CC(C)(C#N)CNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875478135	DF	On-Demand	Mild	DPP4	25	42
CC(C)(C#N)CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875478136	DF	On-Demand	Mild	FKBP1A	31	46
CC(C)(C#N)CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875478136	DF	On-Demand	Mild	CPT1A	42	36
CC(C)(C#N)CNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875478136	DF	On-Demand	Mild	DPP4	25	42
CC(C)(C#N)CNC(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875478145	DE	On-Demand	Mild	NPY2R	60	39
O=C(NCCCCC(=O)OCc1ccccc1)N[C@H]1Cc2ccccc2NC1=O	ZINC000875478262	GF	On-Demand	Anodyne	EPHX2	18	54
O=C(NCCCCC(=O)OCc1ccccc1)N[C@@H]1Cc2ccccc2NC1=O	ZINC000875478263	GF	On-Demand	Anodyne	EPHX2	18	54
CC(=O)NC[C@@H]1CCCCN1C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000875478282	GF	On-Demand	Anodyne	F2	26	40
CC(=O)NC[C@@H]1CCCCN1C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000875478282	GF	On-Demand	Anodyne	ACE	23	40
CC(=O)NC[C@@H]1CCCCN1C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000875478282	GF	On-Demand	Anodyne	FKBP1A	56	49
CC(=O)NC[C@@H]1CCCCN1C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000875478282	GF	On-Demand	Anodyne	OPRM1	23	42
CC(=O)NC[C@@H]1CCCCN1C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000875478282	GF	On-Demand	Anodyne	HTR4	19	41
CC(=O)NC[C@@H]1CCCCN1C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000875478282	GF	On-Demand	Anodyne	CTRA_BOVIN	53	30
CC(=O)NC[C@@H]1CCCCN1C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000875478282	GF	On-Demand	Anodyne	CTSG	40	30
CC(=O)NC[C@@H]1CCCCN1C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000875478282	GF	On-Demand	Anodyne	PREP	67	45
CC(=O)NC[C@@H]1CCCCN1C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000875478282	GF	On-Demand	Anodyne	SLC12A5	59	35
COc1ccccc1[C@H]1CCCN(C(=O)NCC(C)(C)C#N)CC1	ZINC000875478322	EH	On-Demand	Mild	RBP4	38	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCC(C)(C)C#N)CC1	ZINC000875478323	EH	On-Demand	Mild	RBP4	38	41
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000875478325	EG	On-Demand	Mild	FKBP1A	29	41
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000875478325	EG	On-Demand	Mild	SIGMAR1	15	45
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NCC(C)(C)C#N	ZINC000875478325	EG	On-Demand	Mild	CACNA1G	27	41
COc1cccc([C@H](O)C2CCN(C(=O)NCCN3CCNC(=O)C3)CC2)c1	ZINC000875478403	GC	On-Demand	Anodyne	DRD4	48	38
O=C(CCCCNC(=O)N1C[C@@H]2CCC[C@]2(CO)C1)OCc1ccccc1	ZINC000875478415	FF	On-Demand	Anodyne	FKBP1A	17	42
Cn1cc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)c(-c2ccccc2)n1	ZINC000875478435	EE	On-Demand	Anodyne	EPHX2	16	40
Cn1cc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)c(-c2ccccc2)n1	ZINC000875478436	EE	On-Demand	Anodyne	EPHX2	16	40
CC(C)(C#N)CNC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875478456	DF	On-Demand	Mild	MLNR	23	44
CC(C)(C#N)CNC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875478456	DF	On-Demand	Mild	EPHX2	28	48
CC(C)(C#N)CNC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875478456	DF	On-Demand	Mild	LIPG	17	43
COC(=O)C[C@@H]1CCCN1C(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875478457	GG	On-Demand	Anodyne	PREP	30	40
COC(=O)C[C@H]1CCCN1C(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875478458	GG	On-Demand	Anodyne	PREP	30	40
CC(C)(C#N)CNC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875478480	EF	On-Demand	Mild	SMO	37	43
CC(C)(C#N)CNC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875478480	EF	On-Demand	Mild	ETHR	68	56
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000875478492	FD	On-Demand	Anodyne	ANPEP	16	41
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000875478492	FD	On-Demand	Anodyne	PDS	41	32
CC(C)(C#N)CNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875478524	EE	On-Demand	Mild	CTSK	21	42
CC(C)(C#N)CNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875478524	EE	On-Demand	Mild	CTSL	20	42
CC(C)(C#N)CNC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875478524	EE	On-Demand	Mild	SLC12A5	45	34
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000875478528	GF	On-Demand	Anodyne	SLC6A4	25	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000875478528	GF	On-Demand	Anodyne	SLC6A3	51	42
Cn1cc(CNC(=O)N[C@H]2CCN(CC(C)(C)O)C2)c(-c2ccccc2)n1	ZINC000875478532	FD	On-Demand	Anodyne	DRD4	17	40
O=C(NCCCCC(=O)OCc1ccccc1)N[C@@H]1CCOC[C@@H]1O	ZINC000875478547	FD	On-Demand	Anodyne	EPHX2	22	57
O=C(NCCCCC(=O)OCc1ccccc1)N[C@H]1CCOC[C@@H]1O	ZINC000875478548	FD	On-Demand	Anodyne	EPHX2	22	57
O=C(NCCCCC(=O)OCc1ccccc1)N[C@@H]1CCOC[C@H]1O	ZINC000875478549	FD	On-Demand	Anodyne	EPHX2	22	57
O=C(NCCCCC(=O)OCc1ccccc1)N[C@H]1CCOC[C@H]1O	ZINC000875478550	FD	On-Demand	Anodyne	EPHX2	22	57
O=C(CCCCNC(=O)N(C1CC1)C1CC1)OCc1ccccc1	ZINC000875478551	EG	On-Demand	Anodyne	NPR	54	38
CN1CCCC[C@@H](N(C)C(=O)NCCCCC(=O)OCc2ccccc2)C1=O	ZINC000875478556	GF	On-Demand	Anodyne	FKBP1A	46	42
CN1CCCC[C@@H](N(C)C(=O)NCCCCC(=O)OCc2ccccc2)C1=O	ZINC000875478556	GF	On-Demand	Anodyne	PREP	43	35
CN1CCCC[C@H](N(C)C(=O)NCCCCC(=O)OCc2ccccc2)C1=O	ZINC000875478557	GF	On-Demand	Anodyne	FKBP1A	46	42
CN1CCCC[C@H](N(C)C(=O)NCCCCC(=O)OCc2ccccc2)C1=O	ZINC000875478557	GF	On-Demand	Anodyne	PREP	43	35
N#Cc1cc(NC(=O)[C@H]2CCN(Cc3ccccc3)C2)c(Cl)c([N+](=O)[O-])c1	ZINC000875478558	GH	On-Demand	Mild	DRD4	26	42
N#Cc1cc(NC(=O)[C@H]2CCN(Cc3ccccc3)C2)c(Cl)c([N+](=O)[O-])c1	ZINC000875478558	GH	On-Demand	Mild	ACHE	32	44
N#Cc1cc(NC(=O)[C@H]2CCN(Cc3ccccc3)C2)c(Cl)c([N+](=O)[O-])c1	ZINC000875478558	GH	On-Demand	Mild	SIGMAR1	34	48
N#Cc1cc(NC(=O)[C@H]2CCN(Cc3ccccc3)C2)c(Cl)c([N+](=O)[O-])c1	ZINC000875478558	GH	On-Demand	Mild	CCR3	37	44
N#Cc1cc(NC(=O)[C@H]2CCN(Cc3ccccc3)C2)c(Cl)c([N+](=O)[O-])c1	ZINC000875478558	GH	On-Demand	Mild	MLNR	15	40
N#Cc1cc(NC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c(Cl)c([N+](=O)[O-])c1	ZINC000875478559	GH	On-Demand	Mild	DRD4	26	42
N#Cc1cc(NC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c(Cl)c([N+](=O)[O-])c1	ZINC000875478559	GH	On-Demand	Mild	ACHE	32	44
N#Cc1cc(NC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c(Cl)c([N+](=O)[O-])c1	ZINC000875478559	GH	On-Demand	Mild	SIGMAR1	34	48
N#Cc1cc(NC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c(Cl)c([N+](=O)[O-])c1	ZINC000875478559	GH	On-Demand	Mild	CCR3	37	44
N#Cc1cc(NC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c(Cl)c([N+](=O)[O-])c1	ZINC000875478559	GH	On-Demand	Mild	MLNR	15	40
C[C@@]1(CO)CN(C(=O)NCCCCC(=O)OCc2ccccc2)C[C@]1(C)CO	ZINC000875478568	GD	On-Demand	Anodyne	PREP	20	43
C[C@@]1(CO)CN(C(=O)NCCCCC(=O)OCc2ccccc2)C[C@]1(C)CO	ZINC000875478568	GD	On-Demand	Anodyne	CAPN2	47	36
C[C@@]1(CO)CN(C(=O)NCCCCC(=O)OCc2ccccc2)C[C@]1(C)CO	ZINC000875478568	GD	On-Demand	Anodyne	EPHX2	20	53
C[C@@]1(CO)CN(C(=O)NCCCCC(=O)OCc2ccccc2)C[C@]1(C)CO	ZINC000875478568	GD	On-Demand	Anodyne	NPR	44	36
C[C@@]1(CO)CN(C(=O)NCCCCC(=O)OCc2ccccc2)C[C@]1(C)CO	ZINC000875478568	GD	On-Demand	Anodyne	SLC12A5	58	35
C[C@@H](NC(=O)NCC(C)(C)C#N)c1ccnn1C	ZINC000875478576	BD	On-Demand	Mild	CTSV	41	32
C[C@H](NC(=O)NCC(C)(C)C#N)c1ccnn1C	ZINC000875478577	BD	On-Demand	Mild	CTSV	41	32
C[C@@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000875478578	EG	On-Demand	Mild	MCHR1	32	44
C[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000875478579	EG	On-Demand	Mild	MCHR1	32	44
O=C(NCCCCC(=O)OCc1ccccc1)N[C@H]1COC[C@H]1O	ZINC000875478585	EC	On-Demand	Anodyne	EPHX2	20	58
O=C(NCCCCC(=O)OCc1ccccc1)N[C@H]1COC[C@H]1O	ZINC000875478585	EC	On-Demand	Anodyne	NPR	41	36
O=C(NCCCCC(=O)OCc1ccccc1)N[C@H]1COC[C@H]1O	ZINC000875478585	EC	On-Demand	Anodyne	NAAA	37	40
O=C(CCCCNC(=O)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O)OCc1ccccc1	ZINC000875478603	GF	On-Demand	Anodyne	PREP	23	41
O=C(CCCCNC(=O)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O)OCc1ccccc1	ZINC000875478603	GF	On-Demand	Anodyne	TGM2	32	42
O=C(CCCCNC(=O)N1CC[C@H]2CC[C@@H](C1)[S@]2=O)OCc1ccccc1	ZINC000875478604	GF	On-Demand	Anodyne	PREP	23	41
O=C(CCCCNC(=O)N1CC[C@H]2CC[C@@H](C1)[S@]2=O)OCc1ccccc1	ZINC000875478604	GF	On-Demand	Anodyne	TGM2	32	42
O=C(CCCCNC(=O)N1CC2(CCCO2)C1)OCc1ccccc1	ZINC000875478605	EE	On-Demand	Anodyne	SLC12A5	63	34
O=C(NCCCCC(=O)OCc1ccccc1)NC[C@@H]1C[C@H](O)C1	ZINC000875478627	ED	On-Demand	Anodyne	EPHX2	28	62
O=C(NCCCCC(=O)OCc1ccccc1)NCC1CC(O)C1	ZINC000875478628	ED	On-Demand	Anodyne	EPHX2	28	62
O=C(NCCCCC(=O)OCc1ccccc1)NC[C@H]1C[C@H](O)C1	ZINC000875478629	ED	On-Demand	Anodyne	EPHX2	28	62
CN(Cc1ccns1)C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000875478641	FG	On-Demand	Anodyne	CYP3A4	15	42
CN(Cc1ccns1)C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000875478641	FG	On-Demand	Anodyne	NPR	45	35
CN(C(=O)NCCCCC(=O)OCc1ccccc1)[C@@H]1CCCC[C@H]1O	ZINC000875478642	FF	On-Demand	Anodyne	EPHX2	16	53
CN(C(=O)NCCCCC(=O)OCc1ccccc1)[C@@H]1CCCC[C@H]1O	ZINC000875478642	FF	On-Demand	Anodyne	NPR	52	37
CN(C(=O)NCCCCC(=O)OCc1ccccc1)[C@@H]1CCCC[C@H]1O	ZINC000875478642	FF	On-Demand	Anodyne	SLC12A5	40	33
CC(C)(C#N)CNC(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875478649	CF	On-Demand	Mild	GHRHR	39	42
CC(C)(C#N)CNC(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875478650	CF	On-Demand	Mild	GHRHR	39	42
O=C(NCCCCC(=O)OCc1ccccc1)NC1CN(c2ccncn2)C1	ZINC000875478651	GD	On-Demand	Anodyne	EPHX2	18	52
O=C(NCCCCC(=O)OCc1ccccc1)NC1CN(c2ccncn2)C1	ZINC000875478651	GD	On-Demand	Anodyne	TGM2	28	41
CC(C)(C#N)CNC(=O)N[C@@H]1C[C@@H](S(=O)(=O)c2ccccc2)C1	ZINC000875478652	ED	On-Demand	Mild	CTSS	17	44
CC(C)(C#N)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875478657	FF	On-Demand	Mild	FKBP1A	15	46
CC(C)(C#N)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875478657	FF	On-Demand	Mild	GRIN2B	30	42
CC(C)(C#N)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875478657	FF	On-Demand	Mild	CTSK	35	58
CC(C)(C#N)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875478657	FF	On-Demand	Mild	CTSL	39	58
CC(C)(C#N)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875478657	FF	On-Demand	Mild	PREP	24	48
CC(C)(C#N)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875478657	FF	On-Demand	Mild	CAPN2	56	32
CC(C)(C#N)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875478657	FF	On-Demand	Mild	EPHX2	36	40
CC(C)(C#N)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875478657	FF	On-Demand	Mild	TGM2	40	45
CC(C)(C#N)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875478657	FF	On-Demand	Mild	NPR	44	34
CC(C)(C#N)CNC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875478657	FF	On-Demand	Mild	F13A1	26	45
O=C(NCCCCC(=O)OCc1ccccc1)N[C@H]1Cc2cncn2C1	ZINC000875478663	FE	On-Demand	Anodyne	PREP	16	41
O=C(NCCCCC(=O)OCc1ccccc1)N[C@@H]1Cc2cncn2C1	ZINC000875478664	FE	On-Demand	Anodyne	PREP	16	41
C[C@@H](NC(=O)NCC(C)(C)C#N)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875478670	FF	On-Demand	Mild	GPR119	27	42
C[C@H](NC(=O)NCC(C)(C)C#N)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000875478671	FF	On-Demand	Mild	GPR119	27	42
O=C(CCCCNC(=O)N1C[C@H]2C[C@H](O)C[C@H]1C2)OCc1ccccc1	ZINC000875478675	FE	On-Demand	Anodyne	PREP	16	41
O=C(CCCCNC(=O)N1C[C@H]2C[C@H](O)C[C@H]1C2)OCc1ccccc1	ZINC000875478675	FE	On-Demand	Anodyne	EPHX2	16	53
O=C(CCCCNC(=O)N1C[C@H]2C[C@@H](O)C[C@H]1C2)OCc1ccccc1	ZINC000875478676	FE	On-Demand	Anodyne	PREP	16	41
O=C(CCCCNC(=O)N1C[C@H]2C[C@@H](O)C[C@H]1C2)OCc1ccccc1	ZINC000875478676	FE	On-Demand	Anodyne	EPHX2	16	53
O=C(CCCCNC(=O)N1Cc2cccc(O)c2C1)OCc1ccccc1	ZINC000875478699	FG	On-Demand	Clean	PREP	16	49
O=C(CCCCNC(=O)N1Cc2cccc(O)c2C1)OCc1ccccc1	ZINC000875478699	FG	On-Demand	Clean	TGM2	22	44
O=C(CCCCNC(=O)N1C[C@H](O)C[C@H]1C1CC1)OCc1ccccc1	ZINC000875478708	FE	On-Demand	Anodyne	PREP	22	41
O=C(CCCCNC(=O)N1C[C@H](O)C[C@@H]1C1CC1)OCc1ccccc1	ZINC000875478709	FE	On-Demand	Anodyne	PREP	22	41
O=C(CCCCNC(=O)N1C[C@@H](O)C[C@H]1C1CC1)OCc1ccccc1	ZINC000875478710	FE	On-Demand	Anodyne	PREP	22	41
O=C(CCCCNC(=O)N1C[C@@H](O)C[C@@H]1C1CC1)OCc1ccccc1	ZINC000875478711	FE	On-Demand	Anodyne	PREP	22	41
CC(C)(C#N)CNC(=O)NCc1cccc(OC(C)(C)C)c1	ZINC000875478716	DG	On-Demand	Mild	PDS	45	35
COc1ccc(N2CCN(C(=O)NCC(C)(C)C#N)CC2)c(OC)c1	ZINC000875478721	EE	On-Demand	Mild	HTR1A	34	43
COc1ccc(N2CCN(C(=O)NCC(C)(C)C#N)CC2)c(OC)c1	ZINC000875478721	EE	On-Demand	Mild	DRD2	30	41
COc1ccc(N2CCN(C(=O)NCC(C)(C)C#N)CC2)c(OC)c1	ZINC000875478721	EE	On-Demand	Mild	DRD4	44	35
COc1ccc(N2CCN(C(=O)NCC(C)(C)C#N)CC2)c(OC)c1	ZINC000875478721	EE	On-Demand	Mild	ADRA1D	23	41
COc1ccc(N2CCN(C(=O)NCC(C)(C)C#N)CC2)c(OC)c1	ZINC000875478721	EE	On-Demand	Mild	HTR1B	17	43
COc1ccc(N2CCN(C(=O)NCC(C)(C)C#N)CC2)c(OC)c1	ZINC000875478721	EE	On-Demand	Mild	ADRA1A	21	41
COc1ccc(N2CCN(C(=O)NCC(C)(C)C#N)CC2)c(OC)c1	ZINC000875478721	EE	On-Demand	Mild	DRD3	48	40
COc1ccc(N2CCN(C(=O)NCC(C)(C)C#N)CC2)c(OC)c1	ZINC000875478721	EE	On-Demand	Mild	PDGFRB	44	38
COc1ccc(N2CCN(C(=O)NCC(C)(C)C#N)CC2)c(OC)c1	ZINC000875478721	EE	On-Demand	Mild	MTNR1B	28	40
O=C(NCCCCC(=O)OCc1ccccc1)N[C@@H]1COCC[C@H]1O	ZINC000875478722	FD	On-Demand	Anodyne	EPHX2	24	58
O=C(CCCCNC(=O)N1CCCC(F)(F)CC1)OCc1ccccc1	ZINC000875478725	FH	On-Demand	Anodyne	GHRHR	47	31
O=C(CCCCNC(=O)N1CCCC(F)(F)CC1)OCc1ccccc1	ZINC000875478725	FH	On-Demand	Anodyne	PREP	21	44
O=C(CCCCNC(=O)N1CCCC(F)(F)CC1)OCc1ccccc1	ZINC000875478725	FH	On-Demand	Anodyne	EPHX2	17	49
O=C(CCCCNC(=O)N1CCCC(F)(F)CC1)OCc1ccccc1	ZINC000875478725	FH	On-Demand	Anodyne	TGM2	23	51
O=C(CCCCNC(=O)N1CCCC(F)(F)CC1)OCc1ccccc1	ZINC000875478725	FH	On-Demand	Anodyne	SLC12A5	73	38
CN(C[C@@H]1C[C@H](O)C1)C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000875478733	EE	On-Demand	Anodyne	EPHX2	15	52
CN(C[C@@H]1C[C@H](O)C1)C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000875478733	EE	On-Demand	Anodyne	NPR	48	36
CC(C)(C#N)CNC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875478740	DF	On-Demand	Mild	ROCK1	25	45
CC(C)(C#N)CNC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875478740	DF	On-Demand	Mild	ROCK2	18	45
CC(C)(C#N)CNC(=O)N1CCC[C@]1(C)Cc1ccc(F)c(F)c1	ZINC000875478768	EH	On-Demand	Mild	SLC12A5	40	38
CC(C)(C#N)CNC(=O)N1CCC[C@@]1(C)Cc1ccc(F)c(F)c1	ZINC000875478769	EH	On-Demand	Mild	SLC12A5	40	38
CN1CCC(CNC(=O)NCC(C)(C)C#N)(c2ccccc2)CC1	ZINC000875478770	EE	On-Demand	Mild	KCNA3	48	37
CN1CCC(CNC(=O)NCC(C)(C)C#N)(c2ccccc2)CC1	ZINC000875478770	EE	On-Demand	Mild	SOAT1	15	42
O=C(NCCCCC(=O)OCc1ccccc1)N[C@@H]1C[C@H](CO)C1	ZINC000875478771	ED	On-Demand	Anodyne	EPHX2	33	62
CC(C)(C#N)CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875478787	DG	On-Demand	Mild	CTSF	65	33
CC(C)(C#N)CNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875478788	DG	On-Demand	Mild	CTSF	65	33
CN(C)S(=O)(=O)c1cccc(CNC(=O)N2Cc3cccc(O)c3C2)c1	ZINC000875478838	GD	On-Demand	Clean	NAMPT	27	49
COC(=O)N(C)NC(=O)NCCCCC(=O)OCc1ccccc1	ZINC000875478858	ED	On-Demand	Reactive	CAPN2	50	34
COC(=O)N(C)NC(=O)NCCCCC(=O)OCc1ccccc1	ZINC000875478858	ED	On-Demand	Reactive	NPR	63	39
CC(C)(C#N)CNC(=O)N1CCC[C@H]2[C@@H]1CCN2C(=O)OC(C)(C)C	ZINC000875478869	FF	On-Demand	Mild	PREP	22	41
CC(C)(C#N)CNC(=O)N1CCC[C@@H]2[C@@H]1CCN2C(=O)OC(C)(C)C	ZINC000875478870	FF	On-Demand	Mild	PREP	22	41
CC(C)(C#N)CNC(=O)N1CCC[C@H]2[C@H]1CCN2C(=O)OC(C)(C)C	ZINC000875478871	FF	On-Demand	Mild	PREP	22	41
CC(C)(C#N)CNC(=O)N1CCC[C@@H]2[C@H]1CCN2C(=O)OC(C)(C)C	ZINC000875478872	FF	On-Demand	Mild	PREP	22	41
O=CN1CCCN(C(=O)NCCCCC(=O)OCc2ccccc2)CC1	ZINC000875478875	FD	On-Demand	Anodyne	PREP	30	45
O=CN1CCCN(C(=O)NCCCCC(=O)OCc2ccccc2)CC1	ZINC000875478875	FD	On-Demand	Anodyne	TGM2	38	44
Cn1cc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c(-c2ccccc2)n1	ZINC000875478880	GH	On-Demand	Anodyne	EPHX2	25	46
Cn1cc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c(-c2ccccc2)n1	ZINC000875478881	GH	On-Demand	Anodyne	EPHX2	25	46
O=C(CCCCNC(=O)N1CCO[C@H](C(F)F)CC1)OCc1ccccc1	ZINC000875478884	GF	On-Demand	Anodyne	TGM2	25	42
O=C(CCCCNC(=O)N1CCO[C@@H](C(F)F)CC1)OCc1ccccc1	ZINC000875478885	GF	On-Demand	Anodyne	TGM2	25	42
CC(C)(C#N)CNC(=O)NCc1ccc(O)c(Cl)c1	ZINC000875478891	CE	On-Demand	Mild	NCE103	16	48
CC(C)(C#N)CNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875478912	DE	On-Demand	Mild	CTSL	21	44
CC(C)(C#N)CNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875478912	DE	On-Demand	Mild	CTSV	53	44
CC(C)(C#N)CNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875478913	DE	On-Demand	Mild	CTSL	21	44
CC(C)(C#N)CNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875478913	DE	On-Demand	Mild	CTSV	53	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cn(C)nc1-c1ccccc1	ZINC000875478921	FE	On-Demand	Anodyne	SLC6A4	29	42
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cn(C)nc1-c1ccccc1	ZINC000875478921	FE	On-Demand	Anodyne	SLC6A3	57	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cn(C)nc1-c1ccccc1	ZINC000875478922	FE	On-Demand	Anodyne	SLC6A4	29	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cn(C)nc1-c1ccccc1	ZINC000875478922	FE	On-Demand	Anodyne	SLC6A3	57	42
COc1ccccc1[C@@H]1CN(C(=O)NC[C@H]2COC(C)(C)O2)CCO1	ZINC000875478941	FD	On-Demand	Anodyne	ADRA1D	18	41
COc1ccccc1[C@@H]1CN(C(=O)NC[C@H]2COC(C)(C)O2)CCO1	ZINC000875478941	FD	On-Demand	Anodyne	ADRA1B	18	41
COc1ccccc1[C@@H]1CN(C(=O)NC[C@@H]2COC(C)(C)O2)CCO1	ZINC000875478942	FD	On-Demand	Anodyne	ADRA1D	18	41
COc1ccccc1[C@@H]1CN(C(=O)NC[C@@H]2COC(C)(C)O2)CCO1	ZINC000875478942	FD	On-Demand	Anodyne	ADRA1B	18	41
COc1ccccc1[C@H]1CN(C(=O)NC[C@@H]2COC(C)(C)O2)CCO1	ZINC000875478943	FD	On-Demand	Anodyne	ADRA1D	18	41
COc1ccccc1[C@H]1CN(C(=O)NC[C@@H]2COC(C)(C)O2)CCO1	ZINC000875478943	FD	On-Demand	Anodyne	ADRA1B	18	41
COc1ccccc1[C@H]1CN(C(=O)NC[C@H]2COC(C)(C)O2)CCO1	ZINC000875478944	FD	On-Demand	Anodyne	ADRA1D	18	41
COc1ccccc1[C@H]1CN(C(=O)NC[C@H]2COC(C)(C)O2)CCO1	ZINC000875478944	FD	On-Demand	Anodyne	ADRA1B	18	41
CN(C)S(=O)(=O)c1cccc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)c1	ZINC000875479034	GD	On-Demand	Anodyne	WNT3	41	33
CN(C)S(=O)(=O)c1cccc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)c1	ZINC000875479035	GD	On-Demand	Anodyne	WNT3	41	33
CC(=O)C1CCN(C(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)CC1	ZINC000875479081	GI	On-Demand	Mild	MCHR1	36	44
CC(=O)C1CCN(C(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)CC1	ZINC000875479082	GI	On-Demand	Mild	MCHR1	36	44
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NCC(C)(C)C#N)CC2	ZINC000875479120	EF	On-Demand	Mild	SLC18A2	49	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NCC(C)(C)C#N)CC2	ZINC000875479121	EF	On-Demand	Mild	SLC18A2	49	37
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NC[C@@H]1COC(C)(C)O1)CC2	ZINC000875479132	FE	On-Demand	Anodyne	SLC18A2	47	35
COc1cc2c(cc1OC)[C@H](C)N(C(=O)NC[C@H]1COC(C)(C)O1)CC2	ZINC000875479233	FE	On-Demand	Anodyne	SLC18A2	47	35
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NC[C@H]1COC(C)(C)O1)CC2	ZINC000875479234	FE	On-Demand	Anodyne	SLC18A2	47	35
COc1cc2c(cc1OC)[C@@H](C)N(C(=O)NC[C@@H]1COC(C)(C)O1)CC2	ZINC000875479235	FE	On-Demand	Anodyne	SLC18A2	47	35
CC(C)(C#N)CNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875479272	EG	On-Demand	Mild	DRD2	23	46
CC(C)(C#N)CNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875479272	EG	On-Demand	Mild	DRD4	50	42
CC(C)(C#N)CNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875479272	EG	On-Demand	Mild	ACHE	66	62
CC(C)(C#N)CNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875479272	EG	On-Demand	Mild	DRD3	15	44
CC(C)(C#N)CNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875479272	EG	On-Demand	Mild	HTR4	24	41
CC(C)(C#N)CNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875479272	EG	On-Demand	Mild	SIGMAR1	62	44
CC(C)(C#N)CNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875479272	EG	On-Demand	Mild	BCHE	19	49
CC(C)(C#N)CNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875479272	EG	On-Demand	Mild	CCR3	51	43
CC(C)(C#N)CNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875479272	EG	On-Demand	Mild	MCHR1	28	43
CC(C)(C#N)CNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875479272	EG	On-Demand	Mild	CACNA1G	35	46
CC(C)(C#N)CNC(=O)NCCC1CCN(Cc2ccccc2)CC1	ZINC000875479272	EG	On-Demand	Mild	CACNA1I	51	37
COC[C@@H](NC(=O)NCC(C)(C)C#N)c1cccc(Br)c1	ZINC000875479302	FF	On-Demand	Mild	PAPA1_CARPA	28	42
COC[C@H](NC(=O)NCC(C)(C)C#N)c1cccc(Br)c1	ZINC000875479303	FF	On-Demand	Mild	PAPA1_CARPA	28	42
C[C@@H](NC(=O)N1CCCN(C=O)CC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000875479305	GG	On-Demand	Mild	MCHR1	29	41
CN(C)S(=O)(=O)c1cccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875479312	FD	On-Demand	Anodyne	NPY2R	19	41
CN(C)S(=O)(=O)c1cccc(CNC(=O)N2CC[C@H](C(C)(C)O)C2)c1	ZINC000875479312	FD	On-Demand	Anodyne	ST14	66	33
CN(C)S(=O)(=O)c1cccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875479313	FD	On-Demand	Anodyne	NPY2R	19	41
CN(C)S(=O)(=O)c1cccc(CNC(=O)N2CC[C@@H](C(C)(C)O)C2)c1	ZINC000875479313	FD	On-Demand	Anodyne	ST14	66	33
Cn1cc(CNC(=O)N2CCC(C(=O)NCCO)CC2)c(-c2ccccc2)n1	ZINC000875479320	GD	On-Demand	Anodyne	EPHX2	28	47
Cc1ccc(CN2CC[C@H](NC(=O)NC[C@@H]3COC(C)(C)O3)C2)cc1	ZINC000875479381	EE	On-Demand	Anodyne	DRD4	29	43
Cc1ccc(CN2CC[C@H](NC(=O)NC[C@@H]3COC(C)(C)O3)C2)cc1	ZINC000875479381	EE	On-Demand	Anodyne	CCR3	23	41
Cc1ccc(CN2CC[C@H](NC(=O)NC[C@@H]3COC(C)(C)O3)C2)cc1	ZINC000875479381	EE	On-Demand	Anodyne	CCR2	16	47
Cc1ccc(CN2CC[C@H](NC(=O)NC[C@@H]3COC(C)(C)O3)C2)cc1	ZINC000875479381	EE	On-Demand	Anodyne	MCHR1	31	52
Cc1ccc(CN2CC[C@@H](NC(=O)NC[C@@H]3COC(C)(C)O3)C2)cc1	ZINC000875479382	EE	On-Demand	Anodyne	DRD4	29	43
Cc1ccc(CN2CC[C@@H](NC(=O)NC[C@@H]3COC(C)(C)O3)C2)cc1	ZINC000875479382	EE	On-Demand	Anodyne	CCR3	23	41
Cc1ccc(CN2CC[C@@H](NC(=O)NC[C@@H]3COC(C)(C)O3)C2)cc1	ZINC000875479382	EE	On-Demand	Anodyne	CCR2	16	47
Cc1ccc(CN2CC[C@@H](NC(=O)NC[C@@H]3COC(C)(C)O3)C2)cc1	ZINC000875479382	EE	On-Demand	Anodyne	MCHR1	31	52
Cc1ccc(CN2CC[C@H](NC(=O)NC[C@H]3COC(C)(C)O3)C2)cc1	ZINC000875479383	EE	On-Demand	Anodyne	DRD4	29	43
Cc1ccc(CN2CC[C@H](NC(=O)NC[C@H]3COC(C)(C)O3)C2)cc1	ZINC000875479383	EE	On-Demand	Anodyne	CCR3	23	41
Cc1ccc(CN2CC[C@H](NC(=O)NC[C@H]3COC(C)(C)O3)C2)cc1	ZINC000875479383	EE	On-Demand	Anodyne	CCR2	16	47
Cc1ccc(CN2CC[C@H](NC(=O)NC[C@H]3COC(C)(C)O3)C2)cc1	ZINC000875479383	EE	On-Demand	Anodyne	MCHR1	31	52
Cc1ccc(CN2CC[C@@H](NC(=O)NC[C@H]3COC(C)(C)O3)C2)cc1	ZINC000875479384	EE	On-Demand	Anodyne	DRD4	29	43
Cc1ccc(CN2CC[C@@H](NC(=O)NC[C@H]3COC(C)(C)O3)C2)cc1	ZINC000875479384	EE	On-Demand	Anodyne	CCR3	23	41
Cc1ccc(CN2CC[C@@H](NC(=O)NC[C@H]3COC(C)(C)O3)C2)cc1	ZINC000875479384	EE	On-Demand	Anodyne	CCR2	16	47
Cc1ccc(CN2CC[C@@H](NC(=O)NC[C@H]3COC(C)(C)O3)C2)cc1	ZINC000875479384	EE	On-Demand	Anodyne	MCHR1	31	52
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	F2	51	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	PLG	37	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	PRSS1	22	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	ACE	99	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	OPRM1	47	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	OPRD1	39	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	P2RY12	76	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	CELA1	33	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	MME	98	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	TACR1	25	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	TRHR	43	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	PGC	50	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	CMA1	65	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	CTRA_BOVIN	82	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	FCER2	40	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	KLK3	49	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	CTSB	63	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	PAPA1_CARPA	63	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	TRY1_BOVIN	76	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	CYSP_TRYCR	68	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	NTSR1	55	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	CTSG	54	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	CTSK	48	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	CTSL	49	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	NPFFR2	53	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	TIMP3	78	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	PREP	32	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	CAPNS1	84	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	HLA-DRB1	76	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	CELA2A	74	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	REN	78	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	REN1	44	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	PLAT	15	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	CTSS	28	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	CAPN1	116	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	CTRC	33	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	CAPN2	118	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	CTSE	53	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	ACE2	96	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	KLK5	40	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	KLK1	26	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	FPR1	52	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	CTRB_BOVIN	47	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	XIAP	34	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	PSMB8	51	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	Q9N6S8_PLAFA	15	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	BRCA1	68	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@H]1C	ZINC000875479387	ED	On-Demand	Anodyne	TMPRSS11D	55	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	F2	51	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	PLG	37	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	PRSS1	22	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	ACE	99	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	OPRM1	47	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	OPRD1	39	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	P2RY12	76	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	CELA1	33	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	MME	98	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	TACR1	25	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	TRHR	43	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	PGC	50	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	CMA1	65	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	CTRA_BOVIN	82	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	FCER2	40	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	KLK3	49	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	CTSB	63	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	PAPA1_CARPA	63	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	TRY1_BOVIN	76	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	CYSP_TRYCR	68	46
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	NTSR1	55	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	CTSG	54	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	CTSK	48	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	CTSL	49	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	NPFFR2	53	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	TIMP3	78	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	PREP	32	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	CAPNS1	84	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	HLA-DRB1	76	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	CELA2A	74	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	REN	78	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	REN1	44	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	PLAT	15	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	CTSS	28	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	CAPN1	116	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	CTRC	33	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	CAPN2	118	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	CTSE	53	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	ACE2	96	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	KLK5	40	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	KLK1	26	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	FPR1	52	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	CTRB_BOVIN	47	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	XIAP	34	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	PSMB8	51	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	Q9N6S8_PLAFA	15	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	BRCA1	68	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCOC[C@@H]1C	ZINC000875479388	ED	On-Demand	Anodyne	TMPRSS11D	55	37
COc1ccc(N2CCN(C(=O)NC[C@H]3COC(C)(C)O3)CC2)c(OC)c1	ZINC000875479613	GD	On-Demand	Clean	HTR1A	33	46
COc1ccc(N2CCN(C(=O)NC[C@H]3COC(C)(C)O3)CC2)c(OC)c1	ZINC000875479613	GD	On-Demand	Clean	DRD4	42	33
COc1ccc(N2CCN(C(=O)NC[C@H]3COC(C)(C)O3)CC2)c(OC)c1	ZINC000875479613	GD	On-Demand	Clean	ADRA1D	30	46
COc1ccc(N2CCN(C(=O)NC[C@H]3COC(C)(C)O3)CC2)c(OC)c1	ZINC000875479613	GD	On-Demand	Clean	ADRA1A	27	46
COc1ccc(N2CCN(C(=O)NC[C@H]3COC(C)(C)O3)CC2)c(OC)c1	ZINC000875479613	GD	On-Demand	Clean	ADRA1B	24	46
COc1ccc(N2CCN(C(=O)NC[C@@H]3COC(C)(C)O3)CC2)c(OC)c1	ZINC000875479614	GD	On-Demand	Clean	HTR1A	33	46
COc1ccc(N2CCN(C(=O)NC[C@@H]3COC(C)(C)O3)CC2)c(OC)c1	ZINC000875479614	GD	On-Demand	Clean	DRD4	42	33
COc1ccc(N2CCN(C(=O)NC[C@@H]3COC(C)(C)O3)CC2)c(OC)c1	ZINC000875479614	GD	On-Demand	Clean	ADRA1D	30	46
COc1ccc(N2CCN(C(=O)NC[C@@H]3COC(C)(C)O3)CC2)c(OC)c1	ZINC000875479614	GD	On-Demand	Clean	ADRA1A	27	46
COc1ccc(N2CCN(C(=O)NC[C@@H]3COC(C)(C)O3)CC2)c(OC)c1	ZINC000875479614	GD	On-Demand	Clean	ADRA1B	24	46
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCCOC(C)C)C[C@@H]1C2	ZINC000875479738	DD	On-Demand	Anodyne	EPHX2	21	46
Cn1cc(CNC(=O)N2CC[C@@H](c3cccc(Cl)c3)C2(C)C)nn1	ZINC000875479843	EF	On-Demand	Anodyne	MDM2	47	32
Cn1cc(CNC(=O)N2CC[C@H](c3cccc(Cl)c3)C2(C)C)nn1	ZINC000875479844	EF	On-Demand	Anodyne	MDM2	47	32
COC(=O)[C@@H]1CN(C(=O)NCc2ccc(N3CCOC3=O)cc2)C[C@@H](C)O1	ZINC000875479846	GD	On-Demand	Anodyne	NPSR1	26	40
O=C([C@H](Cc1cccnc1)C1CCCC1)n1ccc(=NCC(F)(F)F)cc1	ZINC000875479911	GI	On-Demand	Anodyne	C3AR1	41	39
O=C([C@@H](Cc1cccnc1)C1CCCC1)n1ccc(=NCC(F)(F)F)cc1	ZINC000875479912	GI	On-Demand	Anodyne	C3AR1	41	39
O=C(NCc1ccc(N2CCOC2=O)cc1)N1Cc2cccc(O)c2C1	ZINC000875479913	FF	On-Demand	Clean	NAMPT	23	43
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cn(C)nn1	ZINC000875479941	CC	On-Demand	Anodyne	SLC6A3	49	36
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cn(C)nn1	ZINC000875479942	CC	On-Demand	Anodyne	SLC6A3	49	36
Cn1cc(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)nn1	ZINC000875480176	DC	On-Demand	Anodyne	CTSV	37	42
Cn1cc(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)nn1	ZINC000875480177	DC	On-Demand	Anodyne	CTSV	37	42
C=CCS(=O)(=O)CCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875480313	FD	On-Demand	Mild	TMPRSS11D	41	32
C=CCS(=O)(=O)CCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875480315	FD	On-Demand	Mild	TMPRSS11D	41	32
C=CCS(=O)(=O)CCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875480317	FD	On-Demand	Mild	TMPRSS11D	41	32
C=CCS(=O)(=O)CCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875480319	FD	On-Demand	Mild	TMPRSS11D	41	32
C=CCS(=O)(=O)CCNC(=O)NNc1ccc(OC)cc1Br	ZINC000875480400	GD	On-Demand	Reactive	MTNR1A	45	38
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCCOC(C)C)CC1	ZINC000875480406	FI	On-Demand	Anodyne	DRD2	28	42
COc1ccccc1[C@H]1CCCN(C(=O)NCCCCOC(C)C)CC1	ZINC000875480407	FI	On-Demand	Anodyne	DRD2	28	42
C=CCS(=O)(=O)CCNC(=O)N(CC)[C@H](C)[C@@H](O)c1ccccc1	ZINC000875480457	FD	On-Demand	Mild	NPY5R	21	41
C=CCS(=O)(=O)CCNC(=O)N(CC)[C@@H](C)[C@@H](O)c1ccccc1	ZINC000875480458	FD	On-Demand	Mild	NPY5R	21	41
C=CCS(=O)(=O)CCNC(=O)N(CC)[C@@H](C)[C@H](O)c1ccccc1	ZINC000875480459	FD	On-Demand	Mild	NPY5R	21	41
C=CCS(=O)(=O)CCNC(=O)N(CC)[C@H](C)[C@H](O)c1ccccc1	ZINC000875480460	FD	On-Demand	Mild	NPY5R	21	41
Cn1cc(CNC(=O)N2CCCC[C@@H]2[C@@H](O)c2ccccc2)nn1	ZINC000875480464	ED	On-Demand	Anodyne	TRY1_BOVIN	43	34
Cn1cc(CNC(=O)N2CCCC[C@H]2[C@@H](O)c2ccccc2)nn1	ZINC000875480466	ED	On-Demand	Anodyne	TRY1_BOVIN	43	34
Cn1cc(CNC(=O)N2CCCC[C@@H]2[C@H](O)c2ccccc2)nn1	ZINC000875480468	ED	On-Demand	Anodyne	TRY1_BOVIN	43	34
Cn1cc(CNC(=O)N2CCCC[C@H]2[C@H](O)c2ccccc2)nn1	ZINC000875480469	ED	On-Demand	Anodyne	TRY1_BOVIN	43	34
O=C1OCCN1c1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875480472	GG	On-Demand	Anodyne	F2	35	42
O=C1OCCN1c1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875480472	GG	On-Demand	Anodyne	TRY1_BOVIN	34	40
O=C1OCCN1c1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875480472	GG	On-Demand	Anodyne	PREP	17	42
O=C1OCCN1c1ccc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875480472	GG	On-Demand	Anodyne	TMPRSS11D	67	37
O=C1OCCN1c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875480474	GG	On-Demand	Anodyne	F2	35	42
O=C1OCCN1c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875480474	GG	On-Demand	Anodyne	TRY1_BOVIN	34	40
O=C1OCCN1c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875480474	GG	On-Demand	Anodyne	PREP	17	42
O=C1OCCN1c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)cc1	ZINC000875480474	GG	On-Demand	Anodyne	TMPRSS11D	67	37
O=C1OCCN1c1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875480475	GG	On-Demand	Anodyne	F2	35	42
O=C1OCCN1c1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875480475	GG	On-Demand	Anodyne	TRY1_BOVIN	34	40
O=C1OCCN1c1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875480475	GG	On-Demand	Anodyne	PREP	17	42
O=C1OCCN1c1ccc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)cc1	ZINC000875480475	GG	On-Demand	Anodyne	TMPRSS11D	67	37
O=C1OCCN1c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875480476	GG	On-Demand	Anodyne	F2	35	42
O=C1OCCN1c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875480476	GG	On-Demand	Anodyne	TRY1_BOVIN	34	40
O=C1OCCN1c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875480476	GG	On-Demand	Anodyne	PREP	17	42
O=C1OCCN1c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)cc1	ZINC000875480476	GG	On-Demand	Anodyne	TMPRSS11D	67	37
COc1ccc([C@@H]2CCN(C(=O)NC[C@H]3COC(C)(C)O3)C2)cc1F	ZINC000875480508	FE	On-Demand	Anodyne	ACKR3	50	31
COc1ccc([C@@H]2CCN(C(=O)NC[C@@H]3COC(C)(C)O3)C2)cc1F	ZINC000875480512	FE	On-Demand	Anodyne	ACKR3	50	31
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)N2CCCOC[C@@H]2C)C1	ZINC000875480536	GE	On-Demand	Anodyne	CTRA_BOVIN	50	31
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)N2CCCOC[C@@H]2C)C1	ZINC000875480536	GE	On-Demand	Anodyne	CTSG	40	31
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)N2CCCOC[C@@H]2C)C1	ZINC000875480536	GE	On-Demand	Anodyne	PREP	25	40
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)N2CCCOC[C@@H]2C)C1	ZINC000875480536	GE	On-Demand	Anodyne	CELA2A	40	31
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)N2CCCOC[C@@H]2C)C1	ZINC000875480536	GE	On-Demand	Anodyne	SLC12A5	67	38
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)N2CCCOC[C@@H]2C)C1	ZINC000875480538	GE	On-Demand	Anodyne	CTRA_BOVIN	50	31
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)N2CCCOC[C@@H]2C)C1	ZINC000875480538	GE	On-Demand	Anodyne	CTSG	40	31
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)N2CCCOC[C@@H]2C)C1	ZINC000875480538	GE	On-Demand	Anodyne	PREP	25	40
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)N2CCCOC[C@@H]2C)C1	ZINC000875480538	GE	On-Demand	Anodyne	CELA2A	40	31
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)N2CCCOC[C@@H]2C)C1	ZINC000875480538	GE	On-Demand	Anodyne	SLC12A5	67	38
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)N2CCCOC[C@H]2C)C1	ZINC000875480540	GE	On-Demand	Anodyne	CTRA_BOVIN	50	31
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)N2CCCOC[C@H]2C)C1	ZINC000875480540	GE	On-Demand	Anodyne	CTSG	40	31
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)N2CCCOC[C@H]2C)C1	ZINC000875480540	GE	On-Demand	Anodyne	PREP	25	40
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)N2CCCOC[C@H]2C)C1	ZINC000875480540	GE	On-Demand	Anodyne	CELA2A	40	31
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@](C)(C(=O)N2CCCOC[C@H]2C)C1	ZINC000875480540	GE	On-Demand	Anodyne	SLC12A5	67	38
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)N2CCCOC[C@H]2C)C1	ZINC000875480542	GE	On-Demand	Anodyne	CTRA_BOVIN	50	31
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)N2CCCOC[C@H]2C)C1	ZINC000875480542	GE	On-Demand	Anodyne	CTSG	40	31
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)N2CCCOC[C@H]2C)C1	ZINC000875480542	GE	On-Demand	Anodyne	PREP	25	40
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)N2CCCOC[C@H]2C)C1	ZINC000875480542	GE	On-Demand	Anodyne	CELA2A	40	31
CO[C@@H]1CN(C(=O)OCc2ccccc2)[C@@](C)(C(=O)N2CCCOC[C@H]2C)C1	ZINC000875480542	GE	On-Demand	Anodyne	SLC12A5	67	38
O=C(NCc1ccc(N2CCOC2=O)cc1)N1CC(c2ccccc2)C1	ZINC000875480543	FF	On-Demand	Anodyne	NPSR1	29	44
N#CCCCNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875480606	DF	On-Demand	Mild	CTSL	16	40
N#CCCCNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875480607	DF	On-Demand	Mild	CTSL	16	40
N#Cc1ccc(Cn2cc(NC(=O)NC[C@@H]3CCCCS3)cn2)cc1	ZINC000875480642	FG	On-Demand	Mild	ITK	17	48
N#Cc1ccc(Cn2cc(NC(=O)NC[C@@H]3CCCCS3)cn2)cc1	ZINC000875480642	FG	On-Demand	Mild	PANC	54	36
CCCn1ncc(C(=O)OCC)c1NC(=O)c1cc(C(F)(F)F)cnc1C	ZINC000875480654	GG	On-Demand	Anodyne	ATF1	33	40
CCCn1ncc(C(=O)OCC)c1NC(=O)c1cc(C(F)(F)F)cnc1C	ZINC000875480654	GG	On-Demand	Anodyne	NFKB1	31	40
COc1ccccc1[C@H]1CCCN(C(=O)NCCCC#N)CC1	ZINC000875480657	DG	On-Demand	Mild	DRD2	27	43
COc1ccccc1[C@H]1CCCN(C(=O)NCCCC#N)CC1	ZINC000875480657	DG	On-Demand	Mild	DRD4	15	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCC#N)CC1	ZINC000875480658	DG	On-Demand	Mild	DRD2	27	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCCCC#N)CC1	ZINC000875480658	DG	On-Demand	Mild	DRD4	15	43
O=C(NCc1ccc(N2CCOC2=O)cc1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875480714	GF	On-Demand	Anodyne	NPSR1	28	42
O=C(NCc1ccc(N2CCOC2=O)cc1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875480715	GF	On-Demand	Anodyne	NPSR1	28	42
O=C(NCc1ccc(N2CCOC2=O)cc1)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875480727	GG	On-Demand	Anodyne	DGAT1	22	40
O=C(NCc1ccc(N2CCOC2=O)cc1)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875480728	GG	On-Demand	Anodyne	DGAT1	22	40
Cn1nc(Cl)c(C(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)c1Cl	ZINC000875480915	FG	On-Demand	Bother	COLA	116	39
CCCn1ncc(C(=O)OCC)c1NC(=O)[C@H]1CCCN1C(C)=O	ZINC000875480970	ED	On-Demand	Anodyne	LGMN	64	39
Cn1cc(CNC(=O)N2CCC[C@@]2(C)Cc2ccc(F)c(C(F)(F)F)c2)nn1	ZINC000875481097	GG	On-Demand	Anodyne	SLC12A5	22	45
Cn1cc(CNC(=O)N2CCC[C@]2(C)Cc2ccc(F)c(C(F)(F)F)c2)nn1	ZINC000875481098	GG	On-Demand	Anodyne	SLC12A5	22	45
CCCn1ncc(C(=O)OCC)c1NC(=O)[C@@H]1C[C@H]1c1ccsc1	ZINC000875481241	EG	On-Demand	Anodyne	NPBWR1	72	32
N#CCc1ccsc1C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000875481282	EH	On-Demand	Mild	COLA	109	38
N#CCCCNC(=O)N1CCCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875481295	DF	On-Demand	Mild	DPP4	16	43
N#CCCCNC(=O)N1CCCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875481296	DF	On-Demand	Mild	DPP4	16	43
N#CCCCNC(=O)N1CCCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875481297	DF	On-Demand	Mild	DPP4	16	43
N#CCCCNC(=O)N1CCCC[C@H]1[C@H](O)c1ccccc1	ZINC000875481298	DF	On-Demand	Mild	DPP4	16	43
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cn(C)nn2)CC1	ZINC000875481305	EE	On-Demand	Anodyne	HTR1A	18	40
COc1ccccc1[C@H]1CCCN(C(=O)NCc2cn(C)nn2)CC1	ZINC000875481305	EE	On-Demand	Anodyne	DRD2	15	43
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cn(C)nn2)CC1	ZINC000875481306	EE	On-Demand	Anodyne	HTR1A	18	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCc2cn(C)nn2)CC1	ZINC000875481306	EE	On-Demand	Anodyne	DRD2	15	43
Cn1cc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)nn1	ZINC000875481330	DD	On-Demand	Anodyne	F2	42	37
Cn1cc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)nn1	ZINC000875481330	DD	On-Demand	Anodyne	TRY1_BOVIN	57	36
Cn1cc(CNC(=O)N2CCC[C@@H]2[C@@H](O)c2ccccc2)nn1	ZINC000875481330	DD	On-Demand	Anodyne	TMPRSS11D	45	33
Cn1cc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)nn1	ZINC000875481331	DD	On-Demand	Anodyne	F2	42	37
Cn1cc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)nn1	ZINC000875481331	DD	On-Demand	Anodyne	TRY1_BOVIN	57	36
Cn1cc(CNC(=O)N2CCC[C@H]2[C@@H](O)c2ccccc2)nn1	ZINC000875481331	DD	On-Demand	Anodyne	TMPRSS11D	45	33
Cn1cc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)nn1	ZINC000875481332	DD	On-Demand	Anodyne	F2	42	37
Cn1cc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)nn1	ZINC000875481332	DD	On-Demand	Anodyne	TRY1_BOVIN	57	36
Cn1cc(CNC(=O)N2CCC[C@@H]2[C@H](O)c2ccccc2)nn1	ZINC000875481332	DD	On-Demand	Anodyne	TMPRSS11D	45	33
Cn1cc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)nn1	ZINC000875481333	DD	On-Demand	Anodyne	F2	42	37
Cn1cc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)nn1	ZINC000875481333	DD	On-Demand	Anodyne	TRY1_BOVIN	57	36
Cn1cc(CNC(=O)N2CCC[C@H]2[C@H](O)c2ccccc2)nn1	ZINC000875481333	DD	On-Demand	Anodyne	TMPRSS11D	45	33
C=CCS(=O)(=O)CCNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875481404	GE	On-Demand	Mild	CTSF	50	33
C=CCS(=O)(=O)CCNC(=O)N[C@@H](c1cccc(C#N)c1)C(F)(F)F	ZINC000875481405	GE	On-Demand	Mild	CTSF	50	33
CN1CCC(CNC(=O)NC[C@H]2COC(C)(C)O2)(c2ccccc2)CC1	ZINC000875481456	FE	On-Demand	Anodyne	KCNA3	45	36
CN1CCC(CNC(=O)NC[C@H]2COC(C)(C)O2)(c2ccccc2)CC1	ZINC000875481456	FE	On-Demand	Anodyne	SOAT1	15	40
CN1CCC(CNC(=O)NC[C@@H]2COC(C)(C)O2)(c2ccccc2)CC1	ZINC000875481458	FE	On-Demand	Anodyne	KCNA3	45	36
CN1CCC(CNC(=O)NC[C@@H]2COC(C)(C)O2)(c2ccccc2)CC1	ZINC000875481458	FE	On-Demand	Anodyne	SOAT1	15	40
O=C(NC[C@H]1CCCCS1(=O)=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875481488	GD	On-Demand	Anodyne	FAAH	15	40
O=C([C@H]1CCN(Cc2ccccc2)C1)n1ccc(=NCC(F)(F)F)cc1	ZINC000875481529	FG	On-Demand	Anodyne	DRD4	34	42
O=C([C@H]1CCN(Cc2ccccc2)C1)n1ccc(=NCC(F)(F)F)cc1	ZINC000875481529	FG	On-Demand	Anodyne	ACHE	33	40
O=C([C@H]1CCN(Cc2ccccc2)C1)n1ccc(=NCC(F)(F)F)cc1	ZINC000875481529	FG	On-Demand	Anodyne	SLC6A1	40	32
O=C([C@H]1CCN(Cc2ccccc2)C1)n1ccc(=NCC(F)(F)F)cc1	ZINC000875481529	FG	On-Demand	Anodyne	SIGMAR1	45	43
O=C([C@H]1CCN(Cc2ccccc2)C1)n1ccc(=NCC(F)(F)F)cc1	ZINC000875481529	FG	On-Demand	Anodyne	SLC18A3	21	42
O=C([C@H]1CCN(Cc2ccccc2)C1)n1ccc(=NCC(F)(F)F)cc1	ZINC000875481529	FG	On-Demand	Anodyne	S1PR1	15	46
O=C([C@H]1CCN(Cc2ccccc2)C1)n1ccc(=NCC(F)(F)F)cc1	ZINC000875481529	FG	On-Demand	Anodyne	CACNA1G	29	42
O=C([C@@H]1CCN(Cc2ccccc2)C1)n1ccc(=NCC(F)(F)F)cc1	ZINC000875481532	FG	On-Demand	Anodyne	DRD4	34	42
O=C([C@@H]1CCN(Cc2ccccc2)C1)n1ccc(=NCC(F)(F)F)cc1	ZINC000875481532	FG	On-Demand	Anodyne	ACHE	33	40
O=C([C@@H]1CCN(Cc2ccccc2)C1)n1ccc(=NCC(F)(F)F)cc1	ZINC000875481532	FG	On-Demand	Anodyne	SLC6A1	40	32
O=C([C@@H]1CCN(Cc2ccccc2)C1)n1ccc(=NCC(F)(F)F)cc1	ZINC000875481532	FG	On-Demand	Anodyne	SIGMAR1	45	43
O=C([C@@H]1CCN(Cc2ccccc2)C1)n1ccc(=NCC(F)(F)F)cc1	ZINC000875481532	FG	On-Demand	Anodyne	SLC18A3	21	42
O=C([C@@H]1CCN(Cc2ccccc2)C1)n1ccc(=NCC(F)(F)F)cc1	ZINC000875481532	FG	On-Demand	Anodyne	S1PR1	15	46
O=C([C@@H]1CCN(Cc2ccccc2)C1)n1ccc(=NCC(F)(F)F)cc1	ZINC000875481532	FG	On-Demand	Anodyne	CACNA1G	29	42
CCCn1ncc(C(=O)OCC)c1NC(=O)c1c(C)nc2sccn12	ZINC000875481587	FF	On-Demand	Anodyne	GPR142	40	31
N#CCCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875481892	CE	On-Demand	Mild	TRY1_BOVIN	41	34
N#CCCCNC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875481892	CE	On-Demand	Mild	DPP4	27	44
N#CCCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875481893	CE	On-Demand	Mild	TRY1_BOVIN	41	34
N#CCCCNC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875481893	CE	On-Demand	Mild	DPP4	27	44
N#CCCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875481894	CE	On-Demand	Mild	TRY1_BOVIN	41	34
N#CCCCNC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875481894	CE	On-Demand	Mild	DPP4	27	44
N#CCCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875481895	CE	On-Demand	Mild	TRY1_BOVIN	41	34
N#CCCCNC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875481895	CE	On-Demand	Mild	DPP4	27	44
CCCn1ncc(C(=O)OCC)c1NC(=O)c1ncccc1OC	ZINC000875481961	EE	On-Demand	Anodyne	MAP1	28	41
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000875481966	GG	On-Demand	Anodyne	DRD4	23	46
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000875481966	GG	On-Demand	Anodyne	SIGMAR1	24	48
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000875481966	GG	On-Demand	Anodyne	SSTR5	43	38
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000875481966	GG	On-Demand	Anodyne	CCR3	22	40
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000875481966	GG	On-Demand	Anodyne	CXCR3	29	44
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000875481966	GG	On-Demand	Anodyne	MCHR1	42	44
O=C(NC[C@H]1C[C@H](O)C1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000875481966	GG	On-Demand	Anodyne	CACNA1I	77	47
O=C(NCCCc1nc(-c2ccc(F)cc2)no1)N1Cc2cccc(O)c2C1	ZINC000875481987	GG	On-Demand	Clean	SPHK1	30	40
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NCCCC#N	ZINC000875482052	EF	On-Demand	Mild	SIGMAR1	17	45
CCCn1ncc(C(=O)OCC)c1NC(=O)c1nn(C)c2ccccc12	ZINC000875482064	FF	On-Demand	Anodyne	ELANE	15	44
N#CCCCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875482072	CD	On-Demand	Mild	MAOB	15	42
N#CCCCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875482072	CD	On-Demand	Mild	CTSL	18	46
N#CCCCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875482072	CD	On-Demand	Mild	CTSV	41	46
N#CCCCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875482073	CD	On-Demand	Mild	MAOB	15	42
N#CCCCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875482073	CD	On-Demand	Mild	CTSL	18	46
N#CCCCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875482073	CD	On-Demand	Mild	CTSV	41	46
N#CCCCNC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875482129	CD	On-Demand	Mild	ADRA1A	16	41
N#CCCCNC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875482130	CD	On-Demand	Mild	ADRA1A	16	41
COC(=O)N(C)NC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000875482153	GF	On-Demand	Reactive	DRD4	32	47
COC(=O)N(C)NC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000875482153	GF	On-Demand	Reactive	ACHE	18	44
COC(=O)N(C)NC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000875482153	GF	On-Demand	Reactive	SIGMAR1	30	50
COC(=O)N(C)NC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000875482153	GF	On-Demand	Reactive	SSTR5	58	41
COC(=O)N(C)NC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000875482153	GF	On-Demand	Reactive	UTS2R	15	41
COC(=O)N(C)NC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000875482153	GF	On-Demand	Reactive	PDK1	50	38
COC(=O)N(C)NC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000875482153	GF	On-Demand	Reactive	CXCR3	29	44
COC(=O)N(C)NC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000875482153	GF	On-Demand	Reactive	MCHR1	55	47
COC(=O)N(C)NC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000875482153	GF	On-Demand	Reactive	CACNA1I	57	42
CC(=O)N1CCC[C@@H]1C(=O)O[C@@H](c1ccccn1)C(F)(F)F	ZINC000875482198	DE	On-Demand	Anodyne	FKBP1A	48	41
CC(=O)N1CCC[C@@H]1C(=O)O[C@@H](c1ccccn1)C(F)(F)F	ZINC000875482198	DE	On-Demand	Anodyne	ELANE	45	37
CC(=O)N1CCC[C@@H]1C(=O)O[C@@H](c1ccccn1)C(F)(F)F	ZINC000875482198	DE	On-Demand	Anodyne	PREP	44	35
CC(=O)N1CCC[C@@H]1C(=O)O[C@H](c1ccccn1)C(F)(F)F	ZINC000875482199	DE	On-Demand	Anodyne	FKBP1A	48	41
CC(=O)N1CCC[C@@H]1C(=O)O[C@H](c1ccccn1)C(F)(F)F	ZINC000875482199	DE	On-Demand	Anodyne	ELANE	45	37
CC(=O)N1CCC[C@@H]1C(=O)O[C@H](c1ccccn1)C(F)(F)F	ZINC000875482199	DE	On-Demand	Anodyne	PREP	44	35
COc1ccc2c(c1)CC[C@H](NC(=O)N1CCC(C(C)=O)CC1)C2	ZINC000875482208	EF	On-Demand	Anodyne	MTNR1A	22	44
COc1ccc2c(c1)CC[C@H](NC(=O)N1CCC(C(C)=O)CC1)C2	ZINC000875482208	EF	On-Demand	Anodyne	MTNR1B	23	44
COc1ccc2c(c1)CC[C@H](NC(=O)N1CCC(C(C)=O)CC1)C2	ZINC000875482208	EF	On-Demand	Anodyne	EPHX2	15	40
C[C@H]1CN(C(=O)N[C@H]2CCCN(Cc3ccccn3)C2=O)Cc2ccccc21	ZINC000875482223	GF	On-Demand	Anodyne	CALCRL	37	45
C[C@H]1CN(C(=O)N[C@@H]2CCCN(Cc3ccccn3)C2=O)Cc2ccccc21	ZINC000875482224	GF	On-Demand	Anodyne	CALCRL	37	45
C[C@@H]1CN(C(=O)N[C@@H]2CCCN(Cc3ccccn3)C2=O)Cc2ccccc21	ZINC000875482225	GF	On-Demand	Anodyne	CALCRL	37	45
C[C@@H]1CN(C(=O)N[C@H]2CCCN(Cc3ccccn3)C2=O)Cc2ccccc21	ZINC000875482226	GF	On-Demand	Anodyne	CALCRL	37	45
COc1ccc2c(c1)CC[C@H](NC(=O)N1CCN([S@](C)(=N)=O)CC1)C2	ZINC000875482240	FD	On-Demand	Anodyne	MTNR1B	15	45
COc1ccc2c(c1)CC[C@H](NC(=O)N1CCN([S@@](C)(=N)=O)CC1)C2	ZINC000875482241	FD	On-Demand	Anodyne	MTNR1B	15	45
O=C(NCCc1ccc(F)c(F)c1F)N1CCC[C@H](OC2CCC2)CC1	ZINC000875482249	FH	On-Demand	Anodyne	EPHX2	19	45
O=C(NCCc1ccc(F)c(F)c1F)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875482250	FH	On-Demand	Anodyne	EPHX2	19	45
O=C(NCCO)C1CCN(C(=O)NCCc2ccc(F)c(F)c2F)CC1	ZINC000875482253	FD	On-Demand	Anodyne	EPHX2	17	48
COc1ccc2c(c1)CC[C@H](NC(=O)N1CC(CNC(=O)C(F)(F)F)C1)C2	ZINC000875482260	GD	On-Demand	Anodyne	NQO2	24	55
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	ZINC000875482283	GD	On-Demand	Anodyne	BIRC2	22	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	ZINC000875482284	GD	On-Demand	Anodyne	BIRC2	22	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	ZINC000875482285	GD	On-Demand	Anodyne	BIRC2	22	40
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	ZINC000875482286	GD	On-Demand	Anodyne	BIRC2	22	40
COc1ccc2c(c1)CC[C@H](NC(=O)N1Cc3cccc(O)c3C1)C2	ZINC000875482310	EF	On-Demand	Clean	DRD4	40	31
CONC(=O)C1CCN(C(=O)N[C@H]2CCc3cc(OC)ccc3C2)CC1	ZINC000875482325	FD	On-Demand	Anodyne	MTNR1A	19	42
CONC(=O)C1CCN(C(=O)N[C@H]2CCc3cc(OC)ccc3C2)CC1	ZINC000875482325	FD	On-Demand	Anodyne	MTNR1B	19	42
CONC(=O)C1CCN(C(=O)N[C@@H]2CCc3cc(OC)ccc3C2)CC1	ZINC000875482326	FD	On-Demand	Anodyne	MTNR1A	19	42
CONC(=O)C1CCN(C(=O)N[C@@H]2CCc3cc(OC)ccc3C2)CC1	ZINC000875482326	FD	On-Demand	Anodyne	MTNR1B	19	42
CCCCCNC(=O)C(=O)NCc1cnn(CC)n1	ZINC000875482337	CC	On-Demand	Anodyne	ASAH1	91	35
COc1ccc2c(c1)CC[C@H](NC(=O)N1CCC(C(=O)NCCO)CC1)C2	ZINC000875482371	GD	On-Demand	Anodyne	MTNR1A	34	43
COc1ccc2c(c1)CC[C@H](NC(=O)N1CCC(C(=O)NCCO)CC1)C2	ZINC000875482371	GD	On-Demand	Anodyne	MTNR1B	32	44
COc1ccc2c(c1)CC[C@H](NC(=O)N1CCC(C(=O)NCCO)CC1)C2	ZINC000875482371	GD	On-Demand	Anodyne	EPHX2	19	40
COc1ccc2c(c1)CC[C@H](NC(=O)N1CCC[C@H](C(C)(C)O)C1)C2	ZINC000875482409	EF	On-Demand	Anodyne	MTNR1B	18	40
COc1ccc2c(c1)CC[C@H](NC(=O)N1CCC[C@@H](C(C)(C)O)C1)C2	ZINC000875482410	EF	On-Demand	Anodyne	MTNR1B	18	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCc3cc(OC)ccc3C2)C1	ZINC000875482461	FE	On-Demand	Anodyne	MTNR1A	16	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCc3cc(OC)ccc3C2)C1	ZINC000875482461	FE	On-Demand	Anodyne	MTNR1B	19	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCc3cc(OC)ccc3C2)C1	ZINC000875482462	FE	On-Demand	Anodyne	MTNR1A	16	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCc3cc(OC)ccc3C2)C1	ZINC000875482462	FE	On-Demand	Anodyne	MTNR1B	19	40
CN1CCN(C(=O)N[C@H]2CCCN(Cc3ccccn3)C2=O)CCC1(C)C	ZINC000875482498	FD	On-Demand	Anodyne	CALCRL	32	43
CN1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccn3)C2=O)CCC1(C)C	ZINC000875482499	FD	On-Demand	Anodyne	CALCRL	32	43
C[C@]1(C(F)(F)F)CCN(C(=O)N[C@@H]2CCCN(Cc3ccccn3)C2=O)C1	ZINC000875482521	GF	On-Demand	Anodyne	CALCRL	33	41
C[C@]1(C(F)(F)F)CCN(C(=O)N[C@H]2CCCN(Cc3ccccn3)C2=O)C1	ZINC000875482524	GF	On-Demand	Anodyne	CALCRL	33	41
O=C(N[C@H]1CCCN(Cc2ccccn2)C1=O)N1CCC2(CCNC2=O)CC1	ZINC000875482538	GC	On-Demand	Anodyne	CALCRL	34	51
O=C(N[C@@H]1CCCN(Cc2ccccn2)C1=O)N1CCC2(CCNC2=O)CC1	ZINC000875482539	GC	On-Demand	Anodyne	CALCRL	34	51
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccc(F)c(F)c1F	ZINC000875482555	FE	On-Demand	Anodyne	SLC6A3	40	37
COC(=O)C1(NC(=O)c2cnn(-c3cccc(F)c3)c2C(F)(F)F)CCC1	ZINC000875482573	GF	On-Demand	Anodyne	MST1R	39	40
COc1ccc2c(c1)CC[C@H](NC(=O)NCc1nc(-c3ccncc3)cs1)C2	ZINC000875482584	GH	On-Demand	Anodyne	ROCK1	23	47
COc1ccc2c(c1)CC[C@H](NC(=O)NCc1nc(-c3ccncc3)cs1)C2	ZINC000875482584	GH	On-Demand	Anodyne	ROCK2	21	47
COc1ccc2c(c1)CC[C@H](NC(=O)NC1CC(C(N)=O)C1)C2	ZINC000875482590	DD	On-Demand	Anodyne	NQO2	22	41
COc1ccc2c(c1)CC[C@H](NC(=O)NC1CC(C(N)=O)C1)C2	ZINC000875482590	DD	On-Demand	Anodyne	MTNR1A	24	42
COCC(C)(C)CCNC(=O)N[C@H]1CCc2cc(OC)ccc2C1	ZINC000875482605	EF	On-Demand	Anodyne	NQO2	28	43
COCC(C)(C)CCNC(=O)N[C@H]1CCc2cc(OC)ccc2C1	ZINC000875482605	EF	On-Demand	Anodyne	MTNR1A	28	42
COCC(C)(C)CCNC(=O)N[C@@H]1CCc2cc(OC)ccc2C1	ZINC000875482606	EF	On-Demand	Anodyne	NQO2	28	43
COCC(C)(C)CCNC(=O)N[C@@H]1CCc2cc(OC)ccc2C1	ZINC000875482606	EF	On-Demand	Anodyne	MTNR1A	28	42
O=CN1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccn3)C2=O)CC1	ZINC000875482607	FC	On-Demand	Anodyne	CALCRL	27	46
O=CN1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccn3)C2=O)CC1	ZINC000875482608	FC	On-Demand	Anodyne	CALCRL	27	46
CC[C@@](C)(C#N)NC(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875482612	FE	On-Demand	Mild	LGMN	75	42
CC[C@@](C)(C#N)NC(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875482612	FE	On-Demand	Mild	Q9NAW4_PLAFA	28	42
CC[C@](C)(C#N)NC(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875482613	FE	On-Demand	Mild	LGMN	75	42
CC[C@](C)(C#N)NC(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875482613	FE	On-Demand	Mild	Q9NAW4_PLAFA	28	42
CC[C@](C)(C#N)NC(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875482614	FE	On-Demand	Mild	LGMN	75	42
CC[C@](C)(C#N)NC(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875482614	FE	On-Demand	Mild	Q9NAW4_PLAFA	28	42
CC[C@@](C)(C#N)NC(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875482615	FE	On-Demand	Mild	LGMN	75	42
CC[C@@](C)(C#N)NC(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875482615	FE	On-Demand	Mild	Q9NAW4_PLAFA	28	42
O=C(N[C@H]1CCCN(Cc2ccccn2)C1=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875482628	FE	On-Demand	Anodyne	CALCRL	24	45
O=C(N[C@@H]1CCCN(Cc2ccccn2)C1=O)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875482629	FE	On-Demand	Anodyne	CALCRL	24	45
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CCc2cc(OC)ccc2C1	ZINC000875482636	DE	On-Demand	Anodyne	NQO2	21	42
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CCc2cc(OC)ccc2C1	ZINC000875482638	DE	On-Demand	Anodyne	NQO2	21	42
COc1ccc2c(c1)CC[C@H](NC(=O)N1C[C@@H](OC)CC[C@@H]1C)C2	ZINC000875482642	EF	On-Demand	Anodyne	MTNR1A	21	42
COc1ccc2c(c1)CC[C@H](NC(=O)N1C[C@H](OC)CC[C@@H]1C)C2	ZINC000875482643	EF	On-Demand	Anodyne	MTNR1A	21	42
COc1ccc2c(c1)CC[C@H](NC(=O)N1C[C@H](OC)CC[C@H]1C)C2	ZINC000875482644	EF	On-Demand	Anodyne	MTNR1A	21	42
COc1ccc2c(c1)CC[C@H](NC(=O)N1C[C@@H](OC)CC[C@H]1C)C2	ZINC000875482645	EF	On-Demand	Anodyne	MTNR1A	21	42
O=C(N[C@H]1CCCN(Cc2ccccn2)C1=O)N1Cc2cccc(O)c2C1	ZINC000875482658	FE	On-Demand	Clean	CALCRL	29	43
O=C(N[C@@H]1CCCN(Cc2ccccn2)C1=O)N1Cc2cccc(O)c2C1	ZINC000875482659	FE	On-Demand	Clean	CALCRL	29	43
COc1cc(Oc2ccccc2)ccc1NC(=O)C1(F)CCOCC1	ZINC000875482672	EH	On-Demand	Anodyne	MMP13	27	48
COc1cc(Oc2ccccc2)ccc1NC(=O)C1(F)CCOCC1	ZINC000875482672	EH	On-Demand	Anodyne	MMP2	20	48
COc1cc(Oc2ccccc2)ccc1NC(=O)C1(F)CCOCC1	ZINC000875482672	EH	On-Demand	Anodyne	MMP14	25	43
CC(=O)[C@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccn3)C2=O)C1	ZINC000875482708	FD	On-Demand	Anodyne	CALCRL	25	44
CC(=O)[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccn3)C2=O)C1	ZINC000875482709	FD	On-Demand	Anodyne	CALCRL	25	44
CC(=O)[C@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccn3)C2=O)C1	ZINC000875482710	FD	On-Demand	Anodyne	CALCRL	25	44
CC(=O)[C@@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccn3)C2=O)C1	ZINC000875482711	FD	On-Demand	Anodyne	CALCRL	25	44
COC(=O)c1ccc([C@H](OC(=O)[C@H]2CCCN2C(C)=O)C(F)(F)F)cc1	ZINC000875482727	FF	On-Demand	Anodyne	ELANE	58	47
COC(=O)c1ccc([C@@H](OC(=O)[C@H]2CCCN2C(C)=O)C(F)(F)F)cc1	ZINC000875482728	FF	On-Demand	Anodyne	ELANE	58	47
COc1ccc2c(c1)CC[C@H](NC(=O)NCCC(C)(C)OC)C2	ZINC000875482766	DF	On-Demand	Anodyne	NQO2	30	42
COc1ccc2c(c1)CC[C@H](NC(=O)NCCC(C)(C)OC)C2	ZINC000875482766	DF	On-Demand	Anodyne	MTNR1A	36	41
CC[C@@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482795	EG	On-Demand	Mild	CASP3	18	42
CC[C@@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482795	EG	On-Demand	Mild	BMP1	19	41
CC[C@@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482795	EG	On-Demand	Mild	KLK3	79	38
CC[C@@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482795	EG	On-Demand	Mild	CTSB	95	51
CC[C@@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482795	EG	On-Demand	Mild	PAPA1_CARPA	94	50
CC[C@@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482795	EG	On-Demand	Mild	CYSP_TRYCR	62	43
CC[C@@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482795	EG	On-Demand	Mild	CTSK	51	55
CC[C@@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482795	EG	On-Demand	Mild	CTSL	61	51
CC[C@@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482795	EG	On-Demand	Mild	PGA	22	42
CC[C@@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482795	EG	On-Demand	Mild	CAPNS1	69	39
CC[C@@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482795	EG	On-Demand	Mild	CTSS	36	55
CC[C@@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482795	EG	On-Demand	Mild	CAPN1	90	55
CC[C@@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482795	EG	On-Demand	Mild	CASP1	23	41
CC[C@@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482795	EG	On-Demand	Mild	CAPN2	132	43
CC[C@@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482795	EG	On-Demand	Mild	CASP9	31	41
CC[C@@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482795	EG	On-Demand	Mild	CTSC	25	41
CC[C@@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482795	EG	On-Demand	Mild	CTRB_BOVIN	56	34
CC[C@@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482795	EG	On-Demand	Mild	NPR	73	43
CC[C@@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482795	EG	On-Demand	Mild	PSMB5	44	41
CC[C@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482796	EG	On-Demand	Mild	CASP3	18	42
CC[C@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482796	EG	On-Demand	Mild	BMP1	19	41
CC[C@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482796	EG	On-Demand	Mild	KLK3	79	38
CC[C@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482796	EG	On-Demand	Mild	CTSB	95	51
CC[C@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482796	EG	On-Demand	Mild	PAPA1_CARPA	94	50
CC[C@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482796	EG	On-Demand	Mild	CYSP_TRYCR	62	43
CC[C@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482796	EG	On-Demand	Mild	CTSK	51	55
CC[C@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482796	EG	On-Demand	Mild	CTSL	61	51
CC[C@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482796	EG	On-Demand	Mild	PGA	22	42
CC[C@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482796	EG	On-Demand	Mild	CAPNS1	69	39
CC[C@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482796	EG	On-Demand	Mild	CTSS	36	55
CC[C@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482796	EG	On-Demand	Mild	CAPN1	90	55
CC[C@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482796	EG	On-Demand	Mild	CASP1	23	41
CC[C@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482796	EG	On-Demand	Mild	CAPN2	132	43
CC[C@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482796	EG	On-Demand	Mild	CASP9	31	41
CC[C@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482796	EG	On-Demand	Mild	CTSC	25	41
CC[C@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482796	EG	On-Demand	Mild	CTRB_BOVIN	56	34
CC[C@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482796	EG	On-Demand	Mild	NPR	73	43
CC[C@](C)(C#N)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482796	EG	On-Demand	Mild	PSMB5	44	41
CC[C@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482797	EG	On-Demand	Mild	CASP3	18	42
CC[C@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482797	EG	On-Demand	Mild	BMP1	19	41
CC[C@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482797	EG	On-Demand	Mild	KLK3	79	38
CC[C@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482797	EG	On-Demand	Mild	CTSB	95	51
CC[C@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482797	EG	On-Demand	Mild	PAPA1_CARPA	94	50
CC[C@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482797	EG	On-Demand	Mild	CYSP_TRYCR	62	43
CC[C@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482797	EG	On-Demand	Mild	CTSK	51	55
CC[C@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482797	EG	On-Demand	Mild	CTSL	61	51
CC[C@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482797	EG	On-Demand	Mild	PGA	22	42
CC[C@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482797	EG	On-Demand	Mild	CAPNS1	69	39
CC[C@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482797	EG	On-Demand	Mild	CTSS	36	55
CC[C@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482797	EG	On-Demand	Mild	CAPN1	90	55
CC[C@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482797	EG	On-Demand	Mild	CASP1	23	41
CC[C@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482797	EG	On-Demand	Mild	CAPN2	132	43
CC[C@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482797	EG	On-Demand	Mild	CASP9	31	41
CC[C@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482797	EG	On-Demand	Mild	CTSC	25	41
CC[C@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482797	EG	On-Demand	Mild	CTRB_BOVIN	56	34
CC[C@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482797	EG	On-Demand	Mild	NPR	73	43
CC[C@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482797	EG	On-Demand	Mild	PSMB5	44	41
CC[C@@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482798	EG	On-Demand	Mild	CASP3	18	42
CC[C@@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482798	EG	On-Demand	Mild	BMP1	19	41
CC[C@@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482798	EG	On-Demand	Mild	KLK3	79	38
CC[C@@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482798	EG	On-Demand	Mild	CTSB	95	51
CC[C@@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482798	EG	On-Demand	Mild	PAPA1_CARPA	94	50
CC[C@@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482798	EG	On-Demand	Mild	CYSP_TRYCR	62	43
CC[C@@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482798	EG	On-Demand	Mild	CTSK	51	55
CC[C@@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482798	EG	On-Demand	Mild	CTSL	61	51
CC[C@@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482798	EG	On-Demand	Mild	PGA	22	42
CC[C@@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482798	EG	On-Demand	Mild	CAPNS1	69	39
CC[C@@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482798	EG	On-Demand	Mild	CTSS	36	55
CC[C@@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482798	EG	On-Demand	Mild	CAPN1	90	55
CC[C@@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482798	EG	On-Demand	Mild	CASP1	23	41
CC[C@@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482798	EG	On-Demand	Mild	CAPN2	132	43
CC[C@@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482798	EG	On-Demand	Mild	CASP9	31	41
CC[C@@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482798	EG	On-Demand	Mild	CTSC	25	41
CC[C@@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482798	EG	On-Demand	Mild	CTRB_BOVIN	56	34
CC[C@@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482798	EG	On-Demand	Mild	NPR	73	43
CC[C@@](C)(C#N)NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875482798	EG	On-Demand	Mild	PSMB5	44	41
COc1ccc2c(c1)CC[C@H](NC(=O)N(C)OCC(F)(F)F)C2	ZINC000875482800	EF	On-Demand	Anodyne	NQO2	21	42
COc1ccc2c(c1)CC[C@H](NC(=O)N1CCCN(C=O)CC1)C2	ZINC000875482830	ED	On-Demand	Anodyne	MTNR1A	15	43
COc1ccc2c(c1)CC[C@H](NC(=O)N1CCCN(C=O)CC1)C2	ZINC000875482830	ED	On-Demand	Anodyne	MTNR1B	19	44
COc1ccc2c(c1)CC[C@H](NC(=O)NCC1C[C@@H]3CC[C@H](C1)S3(=O)=O)C2	ZINC000875482842	GE	On-Demand	Anodyne	MTNR1A	20	41
COc1ccc2c(c1)CC[C@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)C2	ZINC000875482858	EE	On-Demand	Anodyne	MTNR1A	15	40
COc1ccc2c(c1)CC[C@H](NC(=O)N1CC[C@@H](C(C)(C)O)C1)C2	ZINC000875482858	EE	On-Demand	Anodyne	MTNR1B	17	40
COc1ccc2c(c1)CC[C@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)C2	ZINC000875482859	EE	On-Demand	Anodyne	MTNR1A	15	40
COc1ccc2c(c1)CC[C@H](NC(=O)N1CC[C@H](C(C)(C)O)C1)C2	ZINC000875482859	EE	On-Demand	Anodyne	MTNR1B	17	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CCCN(Cc3ccccn3)C2=O)C1	ZINC000875482862	GD	On-Demand	Anodyne	CALCRL	23	41
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CCCN(Cc3ccccn3)C2=O)C1	ZINC000875482863	GD	On-Demand	Anodyne	CALCRL	23	41
CC[C@]1(C(=O)Nc2ccc(Oc3ccccc3)cc2OC)CCNC1=O	ZINC000875482986	FG	On-Demand	Anodyne	SLC10A2	44	35
COc1ccc2c(c1)CC[C@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)C2	ZINC000875482988	GD	On-Demand	Anodyne	MTNR1A	16	40
COc1ccc2c(c1)CC[C@H](NC(=O)N1C[C@@H](CN(C)C)[C@H](CN(C)C)C1)C2	ZINC000875482988	GD	On-Demand	Anodyne	MTNR1B	17	40
CC(=O)C1CCN(C(=O)N[C@H]2CCCN(Cc3ccccn3)C2=O)CC1	ZINC000875482990	FD	On-Demand	Anodyne	CALCRL	39	46
CC(=O)C1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccn3)C2=O)CC1	ZINC000875482991	FD	On-Demand	Anodyne	CALCRL	39	46
COc1ccc2c(c1)CC[C@H](NC(=O)N[C@H]1CCN(CC(C)(C)O)C1)C2	ZINC000875482992	FD	On-Demand	Anodyne	DRD4	16	47
COCC[C@@H](Cc1ccco1)NC(=O)N1CCC[C@H](CCC(=O)OC)C1	ZINC000875483000	FF	On-Demand	Anodyne	REN	17	42
COCC[C@@H](Cc1ccco1)NC(=O)N1CCC[C@@H](CCC(=O)OC)C1	ZINC000875483001	FF	On-Demand	Anodyne	REN	17	42
COCC[C@H](Cc1ccco1)NC(=O)N1CCC[C@H](CCC(=O)OC)C1	ZINC000875483002	FF	On-Demand	Anodyne	REN	17	42
COCC[C@H](Cc1ccco1)NC(=O)N1CCC[C@@H](CCC(=O)OC)C1	ZINC000875483003	FF	On-Demand	Anodyne	REN	17	42
O=C(O[C@H](c1ccccn1)C(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875483014	FH	On-Demand	Anodyne	DRD4	36	42
O=C(O[C@H](c1ccccn1)C(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875483014	FH	On-Demand	Anodyne	ACHE	31	43
O=C(O[C@H](c1ccccn1)C(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875483014	FH	On-Demand	Anodyne	SLC6A1	47	32
O=C(O[C@H](c1ccccn1)C(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875483014	FH	On-Demand	Anodyne	SIGMAR1	35	43
O=C(O[C@H](c1ccccn1)C(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875483014	FH	On-Demand	Anodyne	S1PR4	15	44
O=C(O[C@H](c1ccccn1)C(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875483014	FH	On-Demand	Anodyne	S1PR1	22	44
O=C(O[C@H](c1ccccn1)C(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875483014	FH	On-Demand	Anodyne	CACNA1G	32	40
O=C(O[C@H](c1ccccn1)C(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875483015	FH	On-Demand	Anodyne	DRD4	36	42
O=C(O[C@H](c1ccccn1)C(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875483015	FH	On-Demand	Anodyne	ACHE	31	43
O=C(O[C@H](c1ccccn1)C(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875483015	FH	On-Demand	Anodyne	SLC6A1	47	32
O=C(O[C@H](c1ccccn1)C(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875483015	FH	On-Demand	Anodyne	SIGMAR1	35	43
O=C(O[C@H](c1ccccn1)C(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875483015	FH	On-Demand	Anodyne	S1PR4	15	44
O=C(O[C@H](c1ccccn1)C(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875483015	FH	On-Demand	Anodyne	S1PR1	22	44
O=C(O[C@H](c1ccccn1)C(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875483015	FH	On-Demand	Anodyne	CACNA1G	32	40
O=C(O[C@@H](c1ccccn1)C(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875483016	FH	On-Demand	Anodyne	DRD4	36	42
O=C(O[C@@H](c1ccccn1)C(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875483016	FH	On-Demand	Anodyne	ACHE	31	43
O=C(O[C@@H](c1ccccn1)C(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875483016	FH	On-Demand	Anodyne	SLC6A1	47	32
O=C(O[C@@H](c1ccccn1)C(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875483016	FH	On-Demand	Anodyne	SIGMAR1	35	43
O=C(O[C@@H](c1ccccn1)C(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875483016	FH	On-Demand	Anodyne	S1PR4	15	44
O=C(O[C@@H](c1ccccn1)C(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875483016	FH	On-Demand	Anodyne	S1PR1	22	44
O=C(O[C@@H](c1ccccn1)C(F)(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875483016	FH	On-Demand	Anodyne	CACNA1G	32	40
O=C(O[C@@H](c1ccccn1)C(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875483017	FH	On-Demand	Anodyne	DRD4	36	42
O=C(O[C@@H](c1ccccn1)C(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875483017	FH	On-Demand	Anodyne	ACHE	31	43
O=C(O[C@@H](c1ccccn1)C(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875483017	FH	On-Demand	Anodyne	SLC6A1	47	32
O=C(O[C@@H](c1ccccn1)C(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875483017	FH	On-Demand	Anodyne	SIGMAR1	35	43
O=C(O[C@@H](c1ccccn1)C(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875483017	FH	On-Demand	Anodyne	S1PR4	15	44
O=C(O[C@@H](c1ccccn1)C(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875483017	FH	On-Demand	Anodyne	S1PR1	22	44
O=C(O[C@@H](c1ccccn1)C(F)(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875483017	FH	On-Demand	Anodyne	CACNA1G	32	40
COc1ccc2c(c1)CC[C@H](NC(=O)N1CCC(N3CCN(C)CC3)CC1)C2	ZINC000875483037	GD	On-Demand	Anodyne	CHRM2	47	39
COc1ccc2c(c1)CC[C@H](NC(=O)N1CCC(N3CCN(C)CC3)CC1)C2	ZINC000875483037	GD	On-Demand	Anodyne	MTNR1B	15	48
COc1ccc2c(c1)CC[C@H](NC(=O)N1CCC(N3CCN(C)CC3)CC1)C2	ZINC000875483037	GD	On-Demand	Anodyne	L3MBTL3	50	38
COc1ccc2c(c1)CC[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)C2	ZINC000875483046	DD	On-Demand	Anodyne	NQO2	26	41
COc1ccc2c(c1)CC[C@H](NC(=O)NC[C@H]1C[C@H](O)C1)C2	ZINC000875483046	DD	On-Demand	Anodyne	MTNR1A	26	44
COc1ccc2c(c1)CC[C@H](NC(=O)NCCC[C@H]1CCOC1=O)C2	ZINC000875483071	EE	On-Demand	Anodyne	NQO2	29	47
COc1ccc2c(c1)CC[C@H](NC(=O)NCCC[C@@H]1CCOC1=O)C2	ZINC000875483072	EE	On-Demand	Anodyne	NQO2	29	47
COCC[C@H](Cc1ccco1)NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875483098	FD	On-Demand	Anodyne	SLC6A4	20	40
COCC[C@H](Cc1ccco1)NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875483098	FD	On-Demand	Anodyne	SLC6A3	40	40
COCC[C@@H](Cc1ccco1)NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875483099	FD	On-Demand	Anodyne	SLC6A4	20	40
COCC[C@@H](Cc1ccco1)NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875483099	FD	On-Demand	Anodyne	SLC6A3	40	40
COCC[C@@H](Cc1ccco1)NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875483100	FD	On-Demand	Anodyne	SLC6A4	20	40
COCC[C@@H](Cc1ccco1)NC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)OC)C2	ZINC000875483100	FD	On-Demand	Anodyne	SLC6A3	40	40
COCC[C@H](Cc1ccco1)NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875483101	FD	On-Demand	Anodyne	SLC6A4	20	40
COCC[C@H](Cc1ccco1)NC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)OC)C2	ZINC000875483101	FD	On-Demand	Anodyne	SLC6A3	40	40
CCC1(CC)CCCN1C(=O)N[C@H]1CCCN(Cc2ccccn2)C1=O	ZINC000875483111	FF	On-Demand	Anodyne	CALCRL	15	40
CCC1(CC)CCCN1C(=O)N[C@@H]1CCCN(Cc2ccccn2)C1=O	ZINC000875483112	FF	On-Demand	Anodyne	CALCRL	15	40
O=C(N[C@@H]1CCCN(Cc2ccccn2)C1=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875483120	FD	On-Demand	Anodyne	CALCRL	25	45
O=C(N[C@@H]1CCCN(Cc2ccccn2)C1=O)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875483120	FD	On-Demand	Anodyne	BIRC2	22	42
O=C(N[C@@H]1CCCN(Cc2ccccn2)C1=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875483121	FD	On-Demand	Anodyne	CALCRL	25	45
O=C(N[C@@H]1CCCN(Cc2ccccn2)C1=O)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875483121	FD	On-Demand	Anodyne	BIRC2	22	42
O=C(N[C@@H]1CCCN(Cc2ccccn2)C1=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875483122	FD	On-Demand	Anodyne	CALCRL	25	45
O=C(N[C@@H]1CCCN(Cc2ccccn2)C1=O)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875483122	FD	On-Demand	Anodyne	BIRC2	22	42
O=C(N[C@@H]1CCCN(Cc2ccccn2)C1=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875483123	FD	On-Demand	Anodyne	CALCRL	25	45
O=C(N[C@@H]1CCCN(Cc2ccccn2)C1=O)N1CC[C@H]2CSC[C@H]2C1	ZINC000875483123	FD	On-Demand	Anodyne	BIRC2	22	42
COc1ccc2c(c1)CC[C@H](NC(=O)N1CCN(C)C(C)(C)CC1)C2	ZINC000875483161	EF	On-Demand	Anodyne	MTNR1A	15	43
COc1ccc2c(c1)CC[C@H](NC(=O)N1CCN(C)C(C)(C)CC1)C2	ZINC000875483161	EF	On-Demand	Anodyne	MTNR1B	18	43
COc1ccc2c(c1)CC[C@H](NC(=O)NCC(C)(C)C(C)(F)F)C2	ZINC000875483172	EH	On-Demand	Anodyne	NQO2	27	45
COc1ccc2c(c1)CC[C@H](NC(=O)NCC(C)(C)C(C)(F)F)C2	ZINC000875483172	EH	On-Demand	Anodyne	MTNR1A	27	41
O=C1OC[C@H]2CN(C(=O)N[C@@H]3CCCN(Cc4ccccn4)C3=O)C[C@@H]12	ZINC000875483297	FC	On-Demand	Anodyne	CALCRL	15	42
O=C1OC[C@H]2CN(C(=O)N[C@H]3CCCN(Cc4ccccn4)C3=O)C[C@@H]12	ZINC000875483298	FC	On-Demand	Anodyne	CALCRL	15	42
N#CC1(NC(=O)C(F)(F)c2cc(F)cc(F)c2)CC1	ZINC000875483303	CE	On-Demand	Mild	CTSS	24	40
COCC[C@@H](Cc1ccco1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875483326	EE	On-Demand	Anodyne	REN	20	49
COCC[C@@H](Cc1ccco1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875483327	EE	On-Demand	Anodyne	REN	20	49
COCC[C@H](Cc1ccco1)NC(=O)N1CCC[C@@H](C(C)(C)O)C1	ZINC000875483328	EE	On-Demand	Anodyne	REN	20	49
COCC[C@H](Cc1ccco1)NC(=O)N1CCC[C@H](C(C)(C)O)C1	ZINC000875483329	EE	On-Demand	Anodyne	REN	20	49
COc1ccc2c(c1)CC[C@H](NC(=O)N1CCCN(C(=O)CC(C)C)CC1)C2	ZINC000875483337	GF	On-Demand	Anodyne	MTNR1A	18	43
COc1ccc2c(c1)CC[C@H](NC(=O)N1CCCN(C(=O)CC(C)C)CC1)C2	ZINC000875483337	GF	On-Demand	Anodyne	MTNR1B	21	44
Cc1csc([C@H]2CCN(C(=O)N[C@H]3CCCN(Cc4ccccn4)C3=O)C2)n1	ZINC000875483350	GF	On-Demand	Anodyne	CALCRL	21	42
CN1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccn3)C2=O)Cc2cccnc21	ZINC000875483494	GD	On-Demand	Anodyne	CALCRL	27	42
CN1CCN(C(=O)N[C@H]2CCCN(Cc3ccccn3)C2=O)Cc2cccnc21	ZINC000875483495	GD	On-Demand	Anodyne	CALCRL	27	42
COCC[C@@H](Cc1ccco1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875483501	DE	On-Demand	Anodyne	REN	15	42
COCC[C@@H](Cc1ccco1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875483502	DE	On-Demand	Anodyne	REN	15	42
COCC[C@H](Cc1ccco1)NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875483503	DE	On-Demand	Anodyne	REN	15	42
COCC[C@H](Cc1ccco1)NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875483504	DE	On-Demand	Anodyne	REN	15	42
COCC1CC(NC(=O)N[C@@H]2CCc3cc(OC)ccc3C2)C1	ZINC000875483510	DE	On-Demand	Anodyne	NQO2	25	42
COCC1CC(NC(=O)N[C@@H]2CCc3cc(OC)ccc3C2)C1	ZINC000875483510	DE	On-Demand	Anodyne	MTNR1A	28	44
COCC1CC(NC(=O)N[C@H]2CCc3cc(OC)ccc3C2)C1	ZINC000875483511	DE	On-Demand	Anodyne	NQO2	25	42
COCC1CC(NC(=O)N[C@H]2CCc3cc(OC)ccc3C2)C1	ZINC000875483511	DE	On-Demand	Anodyne	MTNR1A	28	44
COc1ccc2c(c1)CC[C@H](NC(=O)N1CCC3(CCNC3=O)CC1)C2	ZINC000875483512	FD	On-Demand	Anodyne	MTNR1A	15	42
COc1ccc2c(c1)CC[C@H](NC(=O)N1CCC3(CCNC3=O)CC1)C2	ZINC000875483512	FD	On-Demand	Anodyne	MTNR1B	17	42
COc1ccc2c(c1)CC[C@H](NC(=O)NC[C@H]1CC(C(F)(F)F)=NO1)C2	ZINC000875483518	FF	On-Demand	Anodyne	NQO2	19	42
COc1ccc2c(c1)CC[C@H](NC(=O)NC[C@@H]1CC(C(F)(F)F)=NO1)C2	ZINC000875483519	FF	On-Demand	Anodyne	NQO2	19	42
COc1ccc2c(c1)CC[C@H](NC(=O)N1CCC(CO)(CO)CC1)C2	ZINC000875483530	ED	On-Demand	Anodyne	MTNR1A	20	44
COc1ccc2c(c1)CC[C@H](NC(=O)N1CCC(CO)(CO)CC1)C2	ZINC000875483530	ED	On-Demand	Anodyne	MTNR1B	23	44
COc1ccc2c(c1)CC[C@H](NC(=O)NCC[C@H]1CCSC1)C2	ZINC000875483547	EF	On-Demand	Anodyne	NQO2	27	44
COc1ccc2c(c1)CC[C@H](NC(=O)NCC[C@H]1CCSC1)C2	ZINC000875483547	EF	On-Demand	Anodyne	MTNR1A	19	42
COc1ccc2c(c1)CC[C@H](NC(=O)NCC[C@@H]1CCSC1)C2	ZINC000875483548	EF	On-Demand	Anodyne	NQO2	27	44
COc1ccc2c(c1)CC[C@H](NC(=O)NCC[C@@H]1CCSC1)C2	ZINC000875483548	EF	On-Demand	Anodyne	MTNR1A	19	42
COc1ccc2c(c1)CC[C@H](NC(=O)N1CCc3c(CC(N)=O)cccc3C1)C2	ZINC000875483551	GE	On-Demand	Anodyne	DRD4	40	31
COc1ccc2c(c1)CC[C@H](NC(=O)N1CCC[C@H](C(C)=O)C1)C2	ZINC000875483573	EF	On-Demand	Anodyne	NQO2	22	41
COc1ccc2c(c1)CC[C@H](NC(=O)N1CCC[C@H](C(C)=O)C1)C2	ZINC000875483573	EF	On-Demand	Anodyne	MTNR1A	22	43
COc1ccc2c(c1)CC[C@H](NC(=O)N1CCC[C@H](C(C)=O)C1)C2	ZINC000875483573	EF	On-Demand	Anodyne	MTNR1B	24	42
COc1ccc2c(c1)CC[C@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)C2	ZINC000875483574	EF	On-Demand	Anodyne	NQO2	22	41
COc1ccc2c(c1)CC[C@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)C2	ZINC000875483574	EF	On-Demand	Anodyne	MTNR1A	22	43
COc1ccc2c(c1)CC[C@H](NC(=O)N1CCC[C@@H](C(C)=O)C1)C2	ZINC000875483574	EF	On-Demand	Anodyne	MTNR1B	24	42
C[C@@H](CCNC(=O)N(C)CCc1cccc(C#N)c1)N1CCCCC1	ZINC000875483579	EG	On-Demand	Mild	DPP7	21	45
C[C@@H](CCNC(=O)N1CCC(c2nc(C3CCC3)no2)CC1)N1CCCCC1	ZINC000875483621	GG	On-Demand	Anodyne	SMO	38	44
C[C@@H](CCNC(=O)N1CCC(c2nc(C3CCC3)no2)CC1)N1CCCCC1	ZINC000875483621	GG	On-Demand	Anodyne	ETHR	56	47
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N(C2CC2)C2CC2)C1	ZINC000875483660	DF	On-Demand	Anodyne	CACNA1I	47	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N(C2CC2)C2CC2)C1	ZINC000875483661	DF	On-Demand	Anodyne	CACNA1I	47	34
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@@H]2Cc3cncn3C2)C1	ZINC000875483668	ED	On-Demand	Anodyne	CACNA1I	48	36
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@H]2Cc3cncn3C2)C1	ZINC000875483669	ED	On-Demand	Anodyne	CACNA1I	48	36
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N[C@@H]2Cc3cncn3C2)C1	ZINC000875483670	ED	On-Demand	Anodyne	CACNA1I	48	36
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N[C@H]2Cc3cncn3C2)C1	ZINC000875483671	ED	On-Demand	Anodyne	CACNA1I	48	36
C[C@@H](CCNC(=O)NCc1nc(-c2ccncc2)cs1)N1CCCCC1	ZINC000875483687	FG	On-Demand	Anodyne	ROCK1	25	41
C[C@@H](CCNC(=O)NCc1nc(-c2ccncc2)cs1)N1CCCCC1	ZINC000875483687	FG	On-Demand	Anodyne	ROCK2	18	41
COc1ccc2c(c1)CC[C@H](NC(=O)NCc1ccc(N(C)C(C)=O)cc1)C2	ZINC000875483805	GG	On-Demand	Anodyne	MTNR1A	21	40
COC(=O)C1(NC(=O)[C@@H]2C[C@@H](OC)CN2C(=O)OCc2ccccc2)CCC1	ZINC000875483815	GD	On-Demand	Anodyne	CELA1	19	40
COC(=O)C1(NC(=O)[C@@H]2C[C@@H](OC)CN2C(=O)OCc2ccccc2)CCC1	ZINC000875483815	GD	On-Demand	Anodyne	PREP	26	42
COC(=O)C1(NC(=O)[C@@H]2C[C@@H](OC)CN2C(=O)OCc2ccccc2)CCC1	ZINC000875483815	GD	On-Demand	Anodyne	LGMN	59	38
COC(=O)C1(NC(=O)[C@@H]2C[C@@H](OC)CN2C(=O)OCc2ccccc2)CCC1	ZINC000875483815	GD	On-Demand	Anodyne	SLC12A5	69	41
COC(=O)C1(NC(=O)[C@@H]2C[C@@H](OC)CN2C(=O)OCc2ccccc2)CCC1	ZINC000875483815	GD	On-Demand	Anodyne	Q9NAW4_PLAFA	38	44
COC(=O)C1(NC(=O)[C@H]2C[C@@H](OC)CN2C(=O)OCc2ccccc2)CCC1	ZINC000875483816	GD	On-Demand	Anodyne	CELA1	19	40
COC(=O)C1(NC(=O)[C@H]2C[C@@H](OC)CN2C(=O)OCc2ccccc2)CCC1	ZINC000875483816	GD	On-Demand	Anodyne	PREP	26	42
COC(=O)C1(NC(=O)[C@H]2C[C@@H](OC)CN2C(=O)OCc2ccccc2)CCC1	ZINC000875483816	GD	On-Demand	Anodyne	LGMN	59	38
COC(=O)C1(NC(=O)[C@H]2C[C@@H](OC)CN2C(=O)OCc2ccccc2)CCC1	ZINC000875483816	GD	On-Demand	Anodyne	SLC12A5	69	41
COC(=O)C1(NC(=O)[C@H]2C[C@@H](OC)CN2C(=O)OCc2ccccc2)CCC1	ZINC000875483816	GD	On-Demand	Anodyne	Q9NAW4_PLAFA	38	44
COc1ccc2c(c1)CC[C@H](NC(=O)N1CCO[C@@H](C(F)(F)F)CC1)C2	ZINC000875483844	FF	On-Demand	Anodyne	NQO2	19	40
COc1ccc2c(c1)CC[C@H](NC(=O)N1CCO[C@H](C(F)(F)F)CC1)C2	ZINC000875483845	FF	On-Demand	Anodyne	NQO2	19	40
COc1cc(Oc2ccccc2)ccc1NC(=O)[C@@H](NC=O)C(C)C	ZINC000875483851	EG	On-Demand	Anodyne	MTNR1B	18	43
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NCC[C@@H](O)C2CCCC2)C1	ZINC000875483868	FE	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NCC[C@@H](O)C2CCCC2)C1	ZINC000875483869	FE	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NCC[C@H](O)C2CCCC2)C1	ZINC000875483870	FE	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NCC[C@H](O)C2CCCC2)C1	ZINC000875483871	FE	On-Demand	Anodyne	CACNA1I	42	33
C[C@@H](CCNC(=O)NNC(=O)c1nc2ccccc2s1)N1CCCCC1	ZINC000875483884	GF	On-Demand	Reactive	TRY1_BOVIN	42	40
C[C@@H](CCNC(=O)NNC(=O)c1nc2ccccc2s1)N1CCCCC1	ZINC000875483884	GF	On-Demand	Reactive	TPSAB1	17	41
C[C@@H](CCNC(=O)NNC(=O)c1nc2ccccc2s1)N1CCCCC1	ZINC000875483884	GF	On-Demand	Reactive	ST14	54	39
C[C@@H](CCNC(=O)NNC(=O)c1nc2ccccc2s1)N1CCCCC1	ZINC000875483884	GF	On-Demand	Reactive	TMPRSS6	83	39
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC(c3ccccc3)C2)C1	ZINC000875483920	FG	On-Demand	Anodyne	EPHX2	29	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC(c3ccccc3)C2)C1	ZINC000875483920	FG	On-Demand	Anodyne	CACNA1I	60	35
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC(c3ccccc3)C2)C1	ZINC000875483920	FG	On-Demand	Anodyne	CCR8	24	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC(c3ccccc3)C2)C1	ZINC000875483920	FG	On-Demand	Anodyne	GPR119	41	45
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC(c3ccccc3)C2)C1	ZINC000875483920	FG	On-Demand	Anodyne	SFRP1	37	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC(c3ccccc3)C2)C1	ZINC000875483920	FG	On-Demand	Anodyne	WNT3	43	35
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC(c3ccccc3)C2)C1	ZINC000875483921	FG	On-Demand	Anodyne	EPHX2	29	41
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC(c3ccccc3)C2)C1	ZINC000875483921	FG	On-Demand	Anodyne	CACNA1I	60	35
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC(c3ccccc3)C2)C1	ZINC000875483921	FG	On-Demand	Anodyne	CCR8	24	41
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC(c3ccccc3)C2)C1	ZINC000875483921	FG	On-Demand	Anodyne	GPR119	41	45
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC(c3ccccc3)C2)C1	ZINC000875483921	FG	On-Demand	Anodyne	SFRP1	37	40
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC(c3ccccc3)C2)C1	ZINC000875483921	FG	On-Demand	Anodyne	WNT3	43	35
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC(Cc3ccco3)C2)C1	ZINC000875483931	FF	On-Demand	Anodyne	CACNA1I	52	35
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC(Cc3ccco3)C2)C1	ZINC000875483932	FF	On-Demand	Anodyne	CACNA1I	52	35
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC[C@H]3CC[C@@H](C2)[S@@]3=O)C1	ZINC000875483933	GD	On-Demand	Anodyne	CACNA1I	47	34
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC[C@H]3CC[C@@H](C2)[S@@]3=O)C1	ZINC000875483933	GD	On-Demand	Anodyne	GPR119	31	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC[C@H]3CC[C@@H](C2)[S@@]3=O)C1	ZINC000875483934	GD	On-Demand	Anodyne	CACNA1I	47	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC[C@H]3CC[C@@H](C2)[S@@]3=O)C1	ZINC000875483934	GD	On-Demand	Anodyne	GPR119	31	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC[C@H]3CC[C@@H](C2)[S@]3=O)C1	ZINC000875483935	GD	On-Demand	Anodyne	CACNA1I	47	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC[C@H]3CC[C@@H](C2)[S@]3=O)C1	ZINC000875483935	GD	On-Demand	Anodyne	GPR119	31	40
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC[C@H]3CC[C@@H](C2)[S@]3=O)C1	ZINC000875483936	GD	On-Demand	Anodyne	CACNA1I	47	34
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC[C@H]3CC[C@@H](C2)[S@]3=O)C1	ZINC000875483936	GD	On-Demand	Anodyne	GPR119	31	40
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875483939	FE	On-Demand	Anodyne	CACNA1I	55	35
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CCC[C@H](C(C)(C)O)C2)C1	ZINC000875483940	FE	On-Demand	Anodyne	CACNA1I	55	35
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875483941	FE	On-Demand	Anodyne	CACNA1I	55	35
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)C1	ZINC000875483942	FE	On-Demand	Anodyne	CACNA1I	55	35
C[C@@H](CCNC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)N1CCCCC1	ZINC000875483944	GE	On-Demand	Anodyne	SMO	36	40
C[C@@H](CCNC(=O)N1CCO[C@@H](c2noc(C3CC3)n2)C1)N1CCCCC1	ZINC000875483944	GE	On-Demand	Anodyne	ETHR	47	36
C[C@@H](CCNC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)N1CCCCC1	ZINC000875483945	GE	On-Demand	Anodyne	SMO	36	40
C[C@@H](CCNC(=O)N1CCO[C@H](c2noc(C3CC3)n2)C1)N1CCCCC1	ZINC000875483945	GE	On-Demand	Anodyne	ETHR	47	36
O=C(Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1)c1ccc(-n2cccn2)nc1	ZINC000875483975	HG	On-Demand	Anodyne	PRNP	40	34
O=C(Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1)c1ccc(-n2cccn2)nc1	ZINC000875483975	HG	On-Demand	Anodyne	CA4	16	41
O=C(Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1)c1ccc(-n2cccn2)nc1	ZINC000875483975	HG	On-Demand	Anodyne	GRM4	29	56
O=C(Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1)c1ccc(-n2cccn2)nc1	ZINC000875483975	HG	On-Demand	Anodyne	HDAC1	15	44
O=C(Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1)c1ccc(-n2cccn2)nc1	ZINC000875483975	HG	On-Demand	Anodyne	LIMK2	34	41
O=C(Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1)c1ccc(-n2cccn2)nc1	ZINC000875483975	HG	On-Demand	Anodyne	NAMPT	31	44
C[C@H]1C[C@H](CCNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CCO1	ZINC000875484017	FG	On-Demand	Mild	CCR3	25	41
C[C@H]1C[C@H](CCNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CCO1	ZINC000875484017	FG	On-Demand	Mild	ITK	16	45
C[C@H]1C[C@H](CCNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)CCO1	ZINC000875484017	FG	On-Demand	Mild	PANC	53	36
CC(=O)N(C)c1ccc(CNC(=O)N[C@H]2CCCN(c3cccnc3)C2=O)cc1	ZINC000875484042	GE	On-Demand	Anodyne	NAMPT	48	38
CC(=O)N(C)c1ccc(CNC(=O)N[C@@H]2CCCN(c3cccnc3)C2=O)cc1	ZINC000875484043	GE	On-Demand	Anodyne	NAMPT	48	38
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NC(C)(C)[C@@H]2CCCCO2)C1	ZINC000875484060	FF	On-Demand	Anodyne	CACNA1I	42	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NC(C)(C)[C@@H]2CCCCO2)C1	ZINC000875484061	FF	On-Demand	Anodyne	CACNA1I	42	34
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NC(C)(C)[C@H]2CCCCO2)C1	ZINC000875484062	FF	On-Demand	Anodyne	CACNA1I	42	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NC(C)(C)[C@H]2CCCCO2)C1	ZINC000875484063	FF	On-Demand	Anodyne	CACNA1I	42	34
CCC[C@@H](CCO)NC(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000875484081	EE	On-Demand	Anodyne	CACNA1I	42	33
CCC[C@@H](CCO)NC(=O)NC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000875484082	EE	On-Demand	Anodyne	CACNA1I	42	33
CCC[C@H](CCO)NC(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000875484083	EE	On-Demand	Anodyne	CACNA1I	42	33
CCC[C@H](CCO)NC(=O)NC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000875484084	EE	On-Demand	Anodyne	CACNA1I	42	33
O=C(N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)N1CCC(CO)(CO)CC1	ZINC000875484090	GD	On-Demand	Anodyne	DRD4	24	40
O=C(N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)N1CCC(CO)(CO)CC1	ZINC000875484090	GD	On-Demand	Anodyne	SIGMAR1	37	40
O=C(N[C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@@H]21)N1CCC(CO)(CO)CC1	ZINC000875484091	GD	On-Demand	Anodyne	DRD4	24	40
O=C(N[C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@@H]21)N1CCC(CO)(CO)CC1	ZINC000875484091	GD	On-Demand	Anodyne	SIGMAR1	37	40
O=C(N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@H]21)N1CCC(CO)(CO)CC1	ZINC000875484092	GD	On-Demand	Anodyne	DRD4	24	40
O=C(N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@H]21)N1CCC(CO)(CO)CC1	ZINC000875484092	GD	On-Demand	Anodyne	SIGMAR1	37	40
O=C(N[C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@H]21)N1CCC(CO)(CO)CC1	ZINC000875484093	GD	On-Demand	Anodyne	DRD4	24	40
O=C(N[C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@H]21)N1CCC(CO)(CO)CC1	ZINC000875484093	GD	On-Demand	Anodyne	SIGMAR1	37	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2O[C@H]3C=C[C@H]2CC3)C1	ZINC000875484094	EE	On-Demand	Anodyne	CACNA1I	43	34
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2O[C@H]3C=C[C@H]2CC3)C1	ZINC000875484095	EE	On-Demand	Anodyne	CACNA1I	43	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC[C@@H](c3ccc(O)cc3)C2)C1	ZINC000875484131	GG	On-Demand	Anodyne	CACNA1I	55	35
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC[C@@H](c3ccc(O)cc3)C2)C1	ZINC000875484131	GG	On-Demand	Anodyne	GPR119	45	46
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC[C@@H](c3ccc(O)cc3)C2)C1	ZINC000875484132	GG	On-Demand	Anodyne	CACNA1I	55	35
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC[C@@H](c3ccc(O)cc3)C2)C1	ZINC000875484132	GG	On-Demand	Anodyne	GPR119	45	46
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC[C@H](c3ccc(O)cc3)C2)C1	ZINC000875484133	GG	On-Demand	Anodyne	CACNA1I	55	35
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC[C@H](c3ccc(O)cc3)C2)C1	ZINC000875484133	GG	On-Demand	Anodyne	GPR119	45	46
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC[C@H](c3ccc(O)cc3)C2)C1	ZINC000875484134	GG	On-Demand	Anodyne	CACNA1I	55	35
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC[C@H](c3ccc(O)cc3)C2)C1	ZINC000875484134	GG	On-Demand	Anodyne	GPR119	45	46
C[C@@H](CCNC(=O)N1Cc2cccnc2N2CCC[C@H]2C1)N1CCCCC1	ZINC000875484139	FF	On-Demand	Anodyne	CCR5	23	43
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CCC[C@H](OC3CCC3)CC2)C1	ZINC000875484146	GG	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)C1	ZINC000875484147	GG	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)C1	ZINC000875484148	GG	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CCC[C@H](OC3CCC3)CC2)C1	ZINC000875484149	GG	On-Demand	Anodyne	CACNA1I	41	32
CCN(Cc1ccc(C)cc1)C(=O)C(=O)NCc1cnn(CC)n1	ZINC000875484160	ED	On-Demand	Anodyne	TSPO	15	40
C[C@@H](CCNC(=O)N1CC2(CC(=O)N2Cc2ccccc2)C1)N1CCCCC1	ZINC000875484288	GE	On-Demand	Anodyne	SAP2	47	37
C[C@@H](CCNC(=O)NC[C@H]1c2ccccc2CN1C)N1CCCCC1	ZINC000875484299	EF	On-Demand	Anodyne	CCR5	22	40
C[C@@H](CCNC(=O)NC[C@@H]1c2ccccc2CN1C)N1CCCCC1	ZINC000875484300	EF	On-Demand	Anodyne	CCR5	22	40
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@]23CCCC[C@H]2C3)C1	ZINC000875484317	EF	On-Demand	Anodyne	CACNA1I	41	34
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@@]23CCCC[C@@H]2C3)C1	ZINC000875484318	EF	On-Demand	Anodyne	CACNA1I	41	34
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@]23CCCC[C@@H]2C3)C1	ZINC000875484319	EF	On-Demand	Anodyne	CACNA1I	41	34
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@@]23CCCC[C@H]2C3)C1	ZINC000875484320	EF	On-Demand	Anodyne	CACNA1I	41	34
CC(=O)[C@@H]1CCCN(C(=O)NCC[C@@H](C)N2CCCCC2)C1	ZINC000875484324	DE	On-Demand	Anodyne	DPP7	28	42
CC(=O)[C@@H]1CCCN(C(=O)NCC[C@H](C)N2CCCCC2)C1	ZINC000875484325	DE	On-Demand	Anodyne	DPP7	28	42
CC(=O)[C@H]1CCCN(C(=O)NCC[C@H](C)N2CCCCC2)C1	ZINC000875484326	DE	On-Demand	Anodyne	DPP7	28	42
CC(=O)[C@H]1CCCN(C(=O)NCC[C@@H](C)N2CCCCC2)C1	ZINC000875484327	DE	On-Demand	Anodyne	DPP7	28	42
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NCC[C@@H](O)C(F)F)C1	ZINC000875484342	FD	On-Demand	Anodyne	CACNA1I	43	34
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NCC[C@H](O)C(F)F)C1	ZINC000875484343	FD	On-Demand	Anodyne	CACNA1I	43	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NCC[C@H](O)C(F)F)C1	ZINC000875484344	FD	On-Demand	Anodyne	CACNA1I	43	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NCC[C@@H](O)C(F)F)C1	ZINC000875484345	FD	On-Demand	Anodyne	CACNA1I	43	34
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@H]2CCC[C@@H]2O)C1	ZINC000875484355	ED	On-Demand	Anodyne	CACNA1I	48	36
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N[C@H]2CCC[C@@H]2O)C1	ZINC000875484356	ED	On-Demand	Anodyne	CACNA1I	48	36
COc1cc(Br)ccc1CCCNC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875484371	FE	On-Demand	Anodyne	MTNR1B	17	41
C#CCOCCNC(=O)NCCc1ccc(OC)c(O)c1	ZINC000875484374	CC	On-Demand	Mild	INHA	47	33
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CCO[C@@H]3CCC[C@@H]32)C1	ZINC000875484376	FE	On-Demand	Anodyne	CACNA1I	41	32
COC(=O)N(C)NC(=O)NCCCc1ccc(Br)cc1OC	ZINC000875484377	FE	On-Demand	Reactive	MTNR1A	29	41
COC(=O)N(C)NC(=O)NCCCc1ccc(Br)cc1OC	ZINC000875484377	FE	On-Demand	Reactive	MTNR1B	25	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CCO[C@@H]3CCC[C@@H]32)C1	ZINC000875484378	FE	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CCCC(F)(F)CC2)C1	ZINC000875484387	FG	On-Demand	Anodyne	CACNA1I	41	33
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CCCC(F)(F)CC2)C1	ZINC000875484389	FG	On-Demand	Anodyne	CACNA1I	41	33
CN1CCN(C2CCN(C(=O)NCc3ccc4c(c3)C(=O)NCC4)CC2)CC1	ZINC000875484392	GC	On-Demand	Anodyne	L3MBTL3	58	38
O=C1NCCc2ccc(CNC(=O)N3CC[C@H](Oc4ccc(F)cc4)C3)cc21	ZINC000875484422	GE	On-Demand	Anodyne	CCR3	23	40
O=C1NCCc2ccc(CNC(=O)N3CC[C@H](Oc4ccc(F)cc4)C3)cc21	ZINC000875484422	GE	On-Demand	Anodyne	MLNR	30	44
O=C1NCCc2ccc(CNC(=O)N3CC[C@H](Oc4ccc(F)cc4)C3)cc21	ZINC000875484422	GE	On-Demand	Anodyne	EPHX2	21	49
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000875484423	FF	On-Demand	Anodyne	SIGMAR1	30	43
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000875484423	FF	On-Demand	Anodyne	CACNA1B	20	46
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000875484423	FF	On-Demand	Anodyne	BIRC2	30	40
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@H]32)CC1	ZINC000875484426	FF	On-Demand	Anodyne	SIGMAR1	30	43
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@H]32)CC1	ZINC000875484426	FF	On-Demand	Anodyne	CACNA1B	20	46
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@H]32)CC1	ZINC000875484426	FF	On-Demand	Anodyne	BIRC2	30	40
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000875484429	FF	On-Demand	Anodyne	SIGMAR1	30	43
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000875484429	FF	On-Demand	Anodyne	CACNA1B	20	46
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000875484429	FF	On-Demand	Anodyne	BIRC2	30	40
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@H]32)CC1	ZINC000875484433	FF	On-Demand	Anodyne	SIGMAR1	30	43
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@H]32)CC1	ZINC000875484433	FF	On-Demand	Anodyne	CACNA1B	20	46
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@H]32)CC1	ZINC000875484433	FF	On-Demand	Anodyne	BIRC2	30	40
C[C@@H](CCNC(=O)NCc1cccc2ncccc12)N1CCCCC1	ZINC000875484439	EG	On-Demand	Anodyne	HNMT	46	35
C[C@@H](CCNC(=O)N1CCC(N2CCN(C)CC2)CC1)N1CCCCC1	ZINC000875484453	FD	On-Demand	Anodyne	L3MBTL3	59	43
CN1CCN(C(=O)NC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)CCC1(C)C	ZINC000875484495	FE	On-Demand	Anodyne	CACNA1I	42	33
CN1CCN(C(=O)NC[C@H]2CCN(C(=O)OC(C)(C)C)C2)CCC1(C)C	ZINC000875484498	FE	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875484535	ED	On-Demand	Anodyne	CACNA1I	56	37
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NCC2CC(O)C2)C1	ZINC000875484537	ED	On-Demand	Anodyne	CACNA1I	56	37
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NC[C@H]2C[C@H](O)C2)C1	ZINC000875484539	ED	On-Demand	Anodyne	CACNA1I	56	37
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NCC2CC(O)C2)C1	ZINC000875484540	ED	On-Demand	Anodyne	CACNA1I	56	37
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NC[C@@H]2C[C@H](O)C2)C1	ZINC000875484541	ED	On-Demand	Anodyne	CACNA1I	56	37
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NC[C@@H]2C[C@H](O)C2)C1	ZINC000875484543	ED	On-Demand	Anodyne	CACNA1I	56	37
C[C@@H](CCNC(=O)NCc1ccc(O)c(Cl)c1)N1CCCCC1	ZINC000875484559	EG	On-Demand	Anodyne	DPP7	41	34
C[C@@H](CCNC(=O)NCc1ccc(O)c(Cl)c1)N1CCCCC1	ZINC000875484559	EG	On-Demand	Anodyne	NCE103	15	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N[C@@H]2CCCC[C@@H]2O)C1	ZINC000875484582	ED	On-Demand	Anodyne	CACNA1I	48	36
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875484584	FE	On-Demand	Anodyne	CACNA1I	57	37
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC[C@H](C(C)(C)O)C2)C1	ZINC000875484588	FE	On-Demand	Anodyne	CACNA1I	57	37
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875484590	FE	On-Demand	Anodyne	CACNA1I	57	37
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC[C@@H](C(C)(C)O)C2)C1	ZINC000875484592	FE	On-Demand	Anodyne	CACNA1I	57	37
Cc1cscc1NC(=O)c1cccc(N(C)C(=O)OC(C)(C)C)c1	ZINC000875484739	EJ	On-Demand	Anodyne	KCNK3	47	34
C[C@H](NC(=O)NC[C@H]1CCN(C(=O)OC(C)(C)C)C1)[C@H](O)C(F)(F)F	ZINC000875484796	FD	On-Demand	Anodyne	CACNA1I	47	34
C[C@H](NC(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)[C@H](O)C(F)(F)F	ZINC000875484811	FD	On-Demand	Anodyne	CACNA1I	47	34
C[C@H](NC(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)[C@@H](O)C(F)(F)F	ZINC000875484813	FD	On-Demand	Anodyne	CACNA1I	47	34
C[C@H](NC(=O)NC[C@H]1CCN(C(=O)OC(C)(C)C)C1)[C@@H](O)C(F)(F)F	ZINC000875484815	FD	On-Demand	Anodyne	CACNA1I	47	34
C#CCOCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875484817	EF	On-Demand	Mild	DRD2	23	43
C#CCOCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875484817	EF	On-Demand	Mild	DRD4	15	43
C#CCOCCNC(=O)N1CCC[C@H](c2ccccc2OC)CC1	ZINC000875484817	EF	On-Demand	Mild	RBP4	34	41
C#CCOCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875484819	EF	On-Demand	Mild	DRD2	23	43
C#CCOCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875484819	EF	On-Demand	Mild	DRD4	15	43
C#CCOCCNC(=O)N1CCC[C@@H](c2ccccc2OC)CC1	ZINC000875484819	EF	On-Demand	Mild	RBP4	34	41
C[C@@H](CCNC(=O)NCc1ccc(Br)cn1)N1CCCCC1	ZINC000875484879	FF	On-Demand	Anodyne	CCR5	17	41
Cc1cncc([C@@H]2CCCN2C(=O)NCC[C@H](C)N2CCCCC2)c1	ZINC000875484903	EH	On-Demand	Anodyne	CCR5	25	44
Cc1cncc([C@H]2CCCN2C(=O)NCC[C@@H](C)N2CCCCC2)c1	ZINC000875484904	EH	On-Demand	Anodyne	CCR5	25	44
Cc1cncc([C@@H]2CCCN2C(=O)NCC[C@@H](C)N2CCCCC2)c1	ZINC000875484905	EH	On-Demand	Anodyne	CCR5	25	44
Cc1cncc([C@H]2CCCN2C(=O)NCC[C@H](C)N2CCCCC2)c1	ZINC000875484906	EH	On-Demand	Anodyne	CCR5	25	44
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N[C@H]2Cc3ccccc3NC2=O)C1	ZINC000875484935	GE	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N[C@H]2Cc3ccccc3NC2=O)C1	ZINC000875484935	GE	On-Demand	Anodyne	GPR119	29	41
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@H]2Cc3ccccc3NC2=O)C1	ZINC000875484937	GE	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@H]2Cc3ccccc3NC2=O)C1	ZINC000875484937	GE	On-Demand	Anodyne	GPR119	29	41
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@@H]2Cc3ccccc3NC2=O)C1	ZINC000875484939	GE	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@@H]2Cc3ccccc3NC2=O)C1	ZINC000875484939	GE	On-Demand	Anodyne	GPR119	29	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N[C@@H]2Cc3ccccc3NC2=O)C1	ZINC000875484941	GE	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N[C@@H]2Cc3ccccc3NC2=O)C1	ZINC000875484941	GE	On-Demand	Anodyne	GPR119	29	41
COCC[C@@H](OC(=O)C1CCN(C(C)C)CC1)c1ccccc1	ZINC000875484948	DG	On-Demand	Anodyne	FKBP1A	55	41
COCC[C@H](OC(=O)C1CCN(C(C)C)CC1)c1ccccc1	ZINC000875484952	DG	On-Demand	Anodyne	FKBP1A	55	41
CN(C(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)[C@@H]1CCCC[C@H]1O	ZINC000875485007	FE	On-Demand	Anodyne	CACNA1I	46	33
CC[C@H](C[C@H](C)O)NC(=O)NCC1(c2ccc(OC)cc2)CCC1	ZINC000875485165	EF	On-Demand	Anodyne	MTNR1A	17	44
N#Cc1ccc(Cn2cc(NC(=O)NCC[C@H]3CCOC3)cn2)cc1	ZINC000875485168	EE	On-Demand	Mild	CCR3	19	43
N#Cc1ccc(Cn2cc(NC(=O)NCC[C@H]3CCOC3)cn2)cc1	ZINC000875485168	EE	On-Demand	Mild	ITK	15	47
N#Cc1ccc(Cn2cc(NC(=O)NCC[C@H]3CCOC3)cn2)cc1	ZINC000875485168	EE	On-Demand	Mild	PANC	53	36
N#Cc1ccc(Cn2cc(NC(=O)NCC[C@@H]3CCOC3)cn2)cc1	ZINC000875485169	EE	On-Demand	Mild	CCR3	19	43
N#Cc1ccc(Cn2cc(NC(=O)NCC[C@@H]3CCOC3)cn2)cc1	ZINC000875485169	EE	On-Demand	Mild	ITK	15	47
N#Cc1ccc(Cn2cc(NC(=O)NCC[C@@H]3CCOC3)cn2)cc1	ZINC000875485169	EE	On-Demand	Mild	PANC	53	36
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@H]21	ZINC000875485275	ED	On-Demand	Anodyne	DRD4	15	40
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000875485278	ED	On-Demand	Anodyne	DRD4	15	40
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@H]21	ZINC000875485280	ED	On-Demand	Anodyne	DRD4	15	40
O=C(NC[C@H]1C[C@H](O)C1)N[C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000875485282	ED	On-Demand	Anodyne	DRD4	15	40
COC(=O)C1(O)CN(C(=O)NCC2(c3ccc(OC)cc3)CCC2)C1	ZINC000875485283	ED	On-Demand	Anodyne	KCNA3	43	34
C[C@@H](CCNC(=O)N1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2)N1CCCCC1	ZINC000875485301	GG	On-Demand	Anodyne	OPRL1	23	43
CN(CCNC(=O)NC[C@H]1CCN(C(=O)OC(C)(C)C)C1)CC(F)F	ZINC000875485315	FD	On-Demand	Anodyne	CACNA1I	41	32
CN(CCNC(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)CC(F)F	ZINC000875485316	FD	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC(Cc3cccs3)C2)C1	ZINC000875485343	GG	On-Demand	Anodyne	CACNA1I	52	35
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC(Cc3cccs3)C2)C1	ZINC000875485344	GG	On-Demand	Anodyne	CACNA1I	52	35
O=C(CNC(=O)c1ccccc1NC(=O)c1cccs1)Nc1cc(Cl)ccc1Cl	ZINC000875485349	IJ	On-Demand	Anodyne	STK33	26	46
CN1CCN(C(=O)NCc2ccc3c(c2)C(=O)NCC3)Cc2cccnc21	ZINC000875485402	FD	On-Demand	Anodyne	NAMPT	21	42
O=C(CCCOC1CCOCC1)Nc1nc2ccc(Cl)cn2n1	ZINC000875485437	EE	On-Demand	Anodyne	MAPK1	42	33
Cn1nc(Cl)c(C(=O)N[C@H](CCC#N)c2ccccc2)c1Cl	ZINC000875485472	EH	On-Demand	Mild	TACR3	49	41
Cn1nc(Cl)c(C(=O)N[C@H](CCC#N)c2ccccc2)c1Cl	ZINC000875485472	EH	On-Demand	Mild	UTS2	54	36
Cn1nc(Cl)c(C(=O)N[C@@H](CCC#N)c2ccccc2)c1Cl	ZINC000875485477	EH	On-Demand	Mild	TACR3	49	41
Cn1nc(Cl)c(C(=O)N[C@@H](CCC#N)c2ccccc2)c1Cl	ZINC000875485477	EH	On-Demand	Mild	UTS2	54	36
C[C@H](NC(=O)C(=O)NCC[C@H]1CCCOC1)c1ccc(C(F)(F)F)nc1	ZINC000875485640	FE	On-Demand	Anodyne	TRPV1	45	35
C[C@H](NC(=O)C(=O)NCC[C@@H]1CCCOC1)c1ccc(C(F)(F)F)nc1	ZINC000875485642	FE	On-Demand	Anodyne	TRPV1	45	35
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N[C@@H]2C[C@H](CO)C2)C1	ZINC000875485665	ED	On-Demand	Anodyne	CACNA1I	42	34
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@@H]2C[C@H](CO)C2)C1	ZINC000875485667	ED	On-Demand	Anodyne	CACNA1I	42	34
COC(=O)[C@@]1(C)CN(C(=O)NC[C@H]2CCN(C(=O)OC(C)(C)C)C2)C[C@@H]1C	ZINC000875485669	GE	On-Demand	Anodyne	CACNA1I	41	33
COC(=O)[C@@]1(C)CN(C(=O)NC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)C[C@@H]1C	ZINC000875485671	GE	On-Demand	Anodyne	CACNA1I	41	33
COC(=O)N(C)NC(=O)N[C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@H]21	ZINC000875485737	ED	On-Demand	Reactive	DRD4	25	40
COC(=O)N(C)NC(=O)N[C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@H]21	ZINC000875485737	ED	On-Demand	Reactive	CACNA1B	16	43
COC(=O)N(C)NC(=O)N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@H]21	ZINC000875485738	ED	On-Demand	Reactive	DRD4	25	40
COC(=O)N(C)NC(=O)N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@H]21	ZINC000875485738	ED	On-Demand	Reactive	CACNA1B	16	43
COC(=O)N(C)NC(=O)N[C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000875485739	ED	On-Demand	Reactive	DRD4	25	40
COC(=O)N(C)NC(=O)N[C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000875485739	ED	On-Demand	Reactive	CACNA1B	16	43
COC(=O)N(C)NC(=O)N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000875485740	ED	On-Demand	Reactive	DRD4	25	40
COC(=O)N(C)NC(=O)N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000875485740	ED	On-Demand	Reactive	CACNA1B	16	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CCCCCCNC(=O)CC2)C1	ZINC000875485750	GE	On-Demand	Anodyne	CACNA1I	41	33
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CCCCCCNC(=O)CC2)C1	ZINC000875485751	GE	On-Demand	Anodyne	CACNA1I	41	33
C#CCOCCNC(=O)NNc1ccc(OC)cc1Br	ZINC000875485756	ED	On-Demand	Reactive	MTNR1A	40	39
O=C1NCCc2ccc(CNC(=O)N3Cc4cccc(O)c4C3)cc21	ZINC000875485772	ED	On-Demand	Clean	NAMPT	23	43
CCN1CCC[C@@H]1CNC(=O)C(=O)NCc1cnn(CC)n1	ZINC000875485898	DB	On-Demand	Anodyne	DRD2	33	42
CCN1CCC[C@H]1CNC(=O)C(=O)NCc1cnn(CC)n1	ZINC000875485901	DB	On-Demand	Anodyne	DRD2	33	42
CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)C(=O)NCc1cnn(CC)n1	ZINC000875485939	GD	On-Demand	Anodyne	PLA2G7	42	34
O=C(N[C@@H]1CCOC[C@H]1O)N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@H]21	ZINC000875486005	FD	On-Demand	Anodyne	DRD4	21	41
O=C(N[C@@H]1CCOC[C@H]1O)N[C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000875486006	FD	On-Demand	Anodyne	DRD4	21	41
O=C(N[C@@H]1CCOC[C@H]1O)N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000875486007	FD	On-Demand	Anodyne	DRD4	21	41
O=C(N[C@@H]1CCOC[C@H]1O)N[C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@H]21	ZINC000875486008	FD	On-Demand	Anodyne	DRD4	21	41
C[C@@H](CCNC(=O)NCc1nc(O)c2c(n1)CCOC2)N1CCCCC1	ZINC000875486015	FD	On-Demand	Anodyne	WNT3A	45	34
COC(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cn1	ZINC000875486049	IC	On-Demand	Reactive	AKR1C3	62	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC[C@@H]3CC[C@@H](O)[C@@H]32)C1	ZINC000875486063	FD	On-Demand	Anodyne	CACNA1I	46	33
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC[C@@H]3CC[C@@H](O)[C@@H]32)C1	ZINC000875486063	FD	On-Demand	Anodyne	GPR119	29	41
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC[C@@H]3CC[C@@H](O)[C@@H]32)C1	ZINC000875486065	FD	On-Demand	Anodyne	CACNA1I	46	33
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC[C@@H]3CC[C@@H](O)[C@@H]32)C1	ZINC000875486065	FD	On-Demand	Anodyne	GPR119	29	41
C[C@@H](NC(=O)NCC[C@@H](C)N1CCCCC1)c1ccccc1O	ZINC000875486071	DG	On-Demand	Clean	DPP7	43	39
C[C@@H](CCNC(=O)N[C@H](C)c1ccccc1O)N1CCCCC1	ZINC000875486073	DG	On-Demand	Clean	DPP7	43	39
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NC2CN(c3ccncn3)C2)C1	ZINC000875486108	GD	On-Demand	Anodyne	GRIN2B	19	43
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NC2CN(c3ccncn3)C2)C1	ZINC000875486108	GD	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NC2CN(c3ccncn3)C2)C1	ZINC000875486108	GD	On-Demand	Anodyne	GPR119	47	58
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NC2CN(c3ccncn3)C2)C1	ZINC000875486111	GD	On-Demand	Anodyne	GRIN2B	19	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NC2CN(c3ccncn3)C2)C1	ZINC000875486111	GD	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NC2CN(c3ccncn3)C2)C1	ZINC000875486111	GD	On-Demand	Anodyne	GPR119	47	58
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NC[C@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875486142	GE	On-Demand	Anodyne	CACNA1I	42	36
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NC[C@@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875486144	GE	On-Demand	Anodyne	CACNA1I	42	36
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NC[C@@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875486146	GE	On-Demand	Anodyne	CACNA1I	42	36
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NC[C@H]2CC(C(F)(F)F)=NO2)C1	ZINC000875486148	GE	On-Demand	Anodyne	CACNA1I	42	36
C[C@@H]1CN(C(=O)NCc2ccc3c(c2)C(=O)NCC3)Cc2ccccc21	ZINC000875486159	EF	On-Demand	Anodyne	NAMPT	17	40
Cn1nnnc1C1CCN(C(=O)NCCSCc2ccnc(Cl)c2)CC1	ZINC000875486235	GE	On-Demand	Anodyne	IL2RA	48	31
CC(=O)N[C@H]1Cc2ccccc2N(C(=O)[C@@H](NC=O)C(C)C)C1	ZINC000875486284	DC	On-Demand	Anodyne	TPP2	52	32
CC(=O)N[C@@H]1Cc2ccccc2N(C(=O)[C@@H](NC=O)C(C)C)C1	ZINC000875486285	DC	On-Demand	Anodyne	TPP2	52	32
O=C(N[C@@H]1CCOC[C@H]1O)N[C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000875486305	FD	On-Demand	Anodyne	DRD4	18	40
O=C(N[C@@H]1CCOC[C@H]1O)N[C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@H]21	ZINC000875486306	FD	On-Demand	Anodyne	DRD4	18	40
O=C(N[C@@H]1CCOC[C@H]1O)N[C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@H]21	ZINC000875486307	FD	On-Demand	Anodyne	DRD4	18	40
O=C(N[C@@H]1CCOC[C@H]1O)N[C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000875486308	FD	On-Demand	Anodyne	DRD4	18	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NCCN2CC[C@H](O)C2)C1	ZINC000875486357	FC	On-Demand	Anodyne	CACNA1H	18	45
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NCCN2CC[C@H](O)C2)C1	ZINC000875486357	FC	On-Demand	Anodyne	CACNA1I	65	39
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NCCN2CC[C@H](O)C2)C1	ZINC000875486358	FC	On-Demand	Anodyne	CACNA1H	18	45
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NCCN2CC[C@H](O)C2)C1	ZINC000875486358	FC	On-Demand	Anodyne	CACNA1I	65	39
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NCCN2CC[C@@H](O)C2)C1	ZINC000875486359	FC	On-Demand	Anodyne	CACNA1H	18	45
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NCCN2CC[C@@H](O)C2)C1	ZINC000875486359	FC	On-Demand	Anodyne	CACNA1I	65	39
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NCCN2CC[C@@H](O)C2)C1	ZINC000875486360	FC	On-Demand	Anodyne	CACNA1H	18	45
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NCCN2CC[C@@H](O)C2)C1	ZINC000875486360	FC	On-Demand	Anodyne	CACNA1I	65	39
CN1CCCC[C@H](N(C)C(=O)NC[C@H]2CCN(C(=O)OC(C)(C)C)C2)C1=O	ZINC000875486365	GD	On-Demand	Anodyne	CACNA1I	41	33
CN1CCCC[C@H](N(C)C(=O)NC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)C1=O	ZINC000875486366	GD	On-Demand	Anodyne	CACNA1I	41	33
CN1CCCC[C@@H](N(C)C(=O)NC[C@H]2CCN(C(=O)OC(C)(C)C)C2)C1=O	ZINC000875486367	GD	On-Demand	Anodyne	CACNA1I	41	33
CN1CCCC[C@@H](N(C)C(=O)NC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)C1=O	ZINC000875486368	GD	On-Demand	Anodyne	CACNA1I	41	33
CC(=O)C1CCN(C(=O)N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@H]32)CC1	ZINC000875486369	FF	On-Demand	Anodyne	DRD4	33	40
CC(=O)C1CCN(C(=O)N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@H]32)CC1	ZINC000875486369	FF	On-Demand	Anodyne	SIGMAR1	34	44
CC(=O)C1CCN(C(=O)N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@H]32)CC1	ZINC000875486369	FF	On-Demand	Anodyne	CACNA1B	17	43
CC(=O)C1CCN(C(=O)N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@H]32)CC1	ZINC000875486369	FF	On-Demand	Anodyne	MLNR	41	34
CC(=O)C1CCN(C(=O)N[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000875486370	FF	On-Demand	Anodyne	DRD4	33	40
CC(=O)C1CCN(C(=O)N[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000875486370	FF	On-Demand	Anodyne	SIGMAR1	34	44
CC(=O)C1CCN(C(=O)N[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000875486370	FF	On-Demand	Anodyne	CACNA1B	17	43
CC(=O)C1CCN(C(=O)N[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000875486370	FF	On-Demand	Anodyne	MLNR	41	34
CC(=O)C1CCN(C(=O)N[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@H]32)CC1	ZINC000875486371	FF	On-Demand	Anodyne	DRD4	33	40
CC(=O)C1CCN(C(=O)N[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@H]32)CC1	ZINC000875486371	FF	On-Demand	Anodyne	SIGMAR1	34	44
CC(=O)C1CCN(C(=O)N[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@H]32)CC1	ZINC000875486371	FF	On-Demand	Anodyne	CACNA1B	17	43
CC(=O)C1CCN(C(=O)N[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@H]32)CC1	ZINC000875486371	FF	On-Demand	Anodyne	MLNR	41	34
CC(=O)C1CCN(C(=O)N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000875486372	FF	On-Demand	Anodyne	DRD4	33	40
CC(=O)C1CCN(C(=O)N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000875486372	FF	On-Demand	Anodyne	SIGMAR1	34	44
CC(=O)C1CCN(C(=O)N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000875486372	FF	On-Demand	Anodyne	CACNA1B	17	43
CC(=O)C1CCN(C(=O)N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000875486372	FF	On-Demand	Anodyne	MLNR	41	34
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CCO[C@@H](C(F)(F)F)CC2)C1	ZINC000875486373	GF	On-Demand	Anodyne	GPR119	22	40
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CCO[C@H](C(F)(F)F)CC2)C1	ZINC000875486374	GF	On-Demand	Anodyne	GPR119	22	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CCO[C@@H](C(F)(F)F)CC2)C1	ZINC000875486375	GF	On-Demand	Anodyne	GPR119	22	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CCO[C@H](C(F)(F)F)CC2)C1	ZINC000875486376	GF	On-Demand	Anodyne	GPR119	22	40
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC=CC2)C1	ZINC000875486388	CD	On-Demand	Anodyne	CACNA1I	57	37
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC=CC2)C1	ZINC000875486389	CD	On-Demand	Anodyne	CACNA1I	57	37
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)C1	ZINC000875486391	GE	On-Demand	Anodyne	GPR119	24	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCN(C(=O)OC(C)(C)C)C2)C1	ZINC000875486393	GE	On-Demand	Anodyne	GPR119	24	41
C#CCOCCNC(=O)N(CC)[C@H](C)[C@@H](O)c1ccccc1	ZINC000875486409	DD	On-Demand	Mild	NPY5R	21	40
C#CCOCCNC(=O)N(CC)[C@@H](C)[C@@H](O)c1ccccc1	ZINC000875486410	DD	On-Demand	Mild	NPY5R	21	40
C#CCOCCNC(=O)N(CC)[C@@H](C)[C@H](O)c1ccccc1	ZINC000875486411	DD	On-Demand	Mild	NPY5R	21	40
C#CCOCCNC(=O)N(CC)[C@H](C)[C@H](O)c1ccccc1	ZINC000875486412	DD	On-Demand	Mild	NPY5R	21	40
C[C@@H](CCNC(=O)NNC(=O)c1ccc(=O)n(C)c1)N1CCCCC1	ZINC000875486418	EC	On-Demand	Reactive	CCR5	15	41
C[C@@H](CCNC(=O)NNC(=O)c1ccc(=O)n(C)c1)N1CCCCC1	ZINC000875486418	EC	On-Demand	Reactive	HCN1	48	34
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875486425	FF	On-Demand	Clean	CACNA1I	60	39
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875486425	FF	On-Demand	Clean	GPR119	35	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875486426	FF	On-Demand	Clean	CACNA1I	60	39
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2Cc3cccc(O)c3C2)C1	ZINC000875486426	FF	On-Demand	Clean	GPR119	35	43
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000875486443	EE	On-Demand	Anodyne	CACNA1I	42	33
CC[C@H](C[C@H](C)O)NC(=O)NC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000875486443	EE	On-Demand	Anodyne	GPR119	21	40
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000875486445	EE	On-Demand	Anodyne	CACNA1I	42	33
CC[C@H](C[C@H](C)O)NC(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000875486445	EE	On-Demand	Anodyne	GPR119	21	40
CN(C[C@@H]1C[C@H](O)C1)C(=O)NC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000875486453	ED	On-Demand	Anodyne	CACNA1I	42	34
CN(C[C@@H]1C[C@H](O)C1)C(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000875486454	ED	On-Demand	Anodyne	CACNA1I	42	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)C1	ZINC000875486455	GG	On-Demand	Anodyne	CACNA1I	43	35
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)C1	ZINC000875486456	GG	On-Demand	Anodyne	CACNA1I	43	35
CC[C@@H](NC(=O)NCc1ccc2c(c1)C(=O)NCC2)c1cccc(OC)c1OC	ZINC000875486500	GF	On-Demand	Anodyne	CSNK1G2	68	37
CONC(=O)C1CCN(C(=O)NCCn2c3ccccc3c3ccccc32)CC1	ZINC000875486522	GF	On-Demand	Anodyne	HTR4	43	32
O=C(NCc1ccc2c(c1)C(=O)NCC2)N[C@@H](Cc1cccnc1)C1CCCC1	ZINC000875486549	GF	On-Demand	Anodyne	NAMPT	47	39
O=C(NCc1ccc2c(c1)C(=O)NCC2)N[C@H](Cc1cccnc1)C1CCCC1	ZINC000875486552	GF	On-Demand	Anodyne	NAMPT	47	39
CN(Cc1ccns1)C(=O)NC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000875486616	FF	On-Demand	Anodyne	CACNA1I	42	32
CN(Cc1ccns1)C(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000875486618	FF	On-Demand	Anodyne	CACNA1I	42	32
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NC(C)(C)C(C)(C)O)C1	ZINC000875486623	EE	On-Demand	Anodyne	CACNA1I	48	36
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NC(C)(C)C(C)(C)O)C1	ZINC000875486625	EE	On-Demand	Anodyne	CACNA1I	48	36
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000875486628	GF	On-Demand	Anodyne	CACNA1B	15	44
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000875486631	GF	On-Demand	Anodyne	CACNA1B	15	44
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@H]32)C1	ZINC000875486633	GF	On-Demand	Anodyne	CACNA1B	15	44
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@H]32)C1	ZINC000875486636	GF	On-Demand	Anodyne	CACNA1B	15	44
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2OC3CCC2CC3)C1	ZINC000875486664	EF	On-Demand	Anodyne	CACNA1I	45	33
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2OC3CCC2CC3)C1	ZINC000875486666	EF	On-Demand	Anodyne	CACNA1I	45	33
COC(=O)C1(O)CN(C(=O)N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@H]32)C1	ZINC000875486710	FC	On-Demand	Anodyne	DRD4	19	40
COC(=O)C1(O)CN(C(=O)N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@H]32)C1	ZINC000875486710	FC	On-Demand	Anodyne	SIGMAR1	26	40
COC(=O)C1(O)CN(C(=O)N[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@H]32)C1	ZINC000875486712	FC	On-Demand	Anodyne	DRD4	19	40
COC(=O)C1(O)CN(C(=O)N[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@H]32)C1	ZINC000875486712	FC	On-Demand	Anodyne	SIGMAR1	26	40
COC(=O)C1(O)CN(C(=O)N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000875486714	FC	On-Demand	Anodyne	DRD4	19	40
COC(=O)C1(O)CN(C(=O)N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000875486714	FC	On-Demand	Anodyne	SIGMAR1	26	40
COC(=O)C1(O)CN(C(=O)N[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000875486717	FC	On-Demand	Anodyne	DRD4	19	40
COC(=O)C1(O)CN(C(=O)N[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@@H]32)C1	ZINC000875486717	FC	On-Demand	Anodyne	SIGMAR1	26	40
O=CN1CCCN(C(=O)N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000875486738	FD	On-Demand	Anodyne	DRD4	22	40
O=CN1CCCN(C(=O)N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000875486738	FD	On-Demand	Anodyne	SIGMAR1	30	40
O=CN1CCCN(C(=O)N[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000875486739	FD	On-Demand	Anodyne	DRD4	22	40
O=CN1CCCN(C(=O)N[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000875486739	FD	On-Demand	Anodyne	SIGMAR1	30	40
O=CN1CCCN(C(=O)N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@H]32)CC1	ZINC000875486740	FD	On-Demand	Anodyne	DRD4	22	40
O=CN1CCCN(C(=O)N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@H]32)CC1	ZINC000875486740	FD	On-Demand	Anodyne	SIGMAR1	30	40
O=CN1CCCN(C(=O)N[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@H]32)CC1	ZINC000875486741	FD	On-Demand	Anodyne	DRD4	22	40
O=CN1CCCN(C(=O)N[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@H]32)CC1	ZINC000875486741	FD	On-Demand	Anodyne	SIGMAR1	30	40
C#CCOCCNC(=O)N[C@@H]1Cc2ccccc2NC1=O	ZINC000875486748	CC	On-Demand	Mild	PYGM	15	45
C#CCOCCNC(=O)N[C@H]1Cc2ccccc2NC1=O	ZINC000875486749	CC	On-Demand	Mild	PYGM	15	45
O=C(NCC[C@H]1CCOC1)NNc1ccc(OCc2ccccc2)cc1	ZINC000875486816	FG	On-Demand	Reactive	LTA4H	19	42
O=C(NCC[C@@H]1CCOC1)NNc1ccc(OCc2ccccc2)cc1	ZINC000875486817	FG	On-Demand	Reactive	LTA4H	19	42
O=CN1CCCN(C(=O)N[C@@H]2CCC[C@@H]3CN(Cc4ccccc4)C[C@H]32)CC1	ZINC000875486856	GE	On-Demand	Anodyne	DRD4	17	41
O=CN1CCCN(C(=O)N[C@@H]2CCC[C@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000875486857	GE	On-Demand	Anodyne	DRD4	17	41
O=CN1CCCN(C(=O)N[C@@H]2CCC[C@H]3CN(Cc4ccccc4)C[C@H]32)CC1	ZINC000875486858	GE	On-Demand	Anodyne	DRD4	17	41
O=CN1CCCN(C(=O)N[C@@H]2CCC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)CC1	ZINC000875486859	GE	On-Demand	Anodyne	DRD4	17	41
COCC[C@H](OC(=O)[C@H]1CCCN1C(C)=O)c1ccccc1	ZINC000875486957	DE	On-Demand	Anodyne	F2	48	43
COCC[C@H](OC(=O)[C@H]1CCCN1C(C)=O)c1ccccc1	ZINC000875486957	DE	On-Demand	Anodyne	ACE	56	42
COCC[C@H](OC(=O)[C@H]1CCCN1C(C)=O)c1ccccc1	ZINC000875486957	DE	On-Demand	Anodyne	FKBP1A	123	56
COCC[C@H](OC(=O)[C@H]1CCCN1C(C)=O)c1ccccc1	ZINC000875486957	DE	On-Demand	Anodyne	ELANE	44	35
COCC[C@H](OC(=O)[C@H]1CCCN1C(C)=O)c1ccccc1	ZINC000875486957	DE	On-Demand	Anodyne	TRY1_BOVIN	78	39
COCC[C@H](OC(=O)[C@H]1CCCN1C(C)=O)c1ccccc1	ZINC000875486957	DE	On-Demand	Anodyne	PREP	86	38
COCC[C@H](OC(=O)[C@H]1CCCN1C(C)=O)c1ccccc1	ZINC000875486957	DE	On-Demand	Anodyne	BRCA1	59	33
COCC[C@@H](OC(=O)[C@H]1CCCN1C(C)=O)c1ccccc1	ZINC000875486958	DE	On-Demand	Anodyne	F2	48	43
COCC[C@@H](OC(=O)[C@H]1CCCN1C(C)=O)c1ccccc1	ZINC000875486958	DE	On-Demand	Anodyne	ACE	56	42
COCC[C@@H](OC(=O)[C@H]1CCCN1C(C)=O)c1ccccc1	ZINC000875486958	DE	On-Demand	Anodyne	FKBP1A	123	56
COCC[C@@H](OC(=O)[C@H]1CCCN1C(C)=O)c1ccccc1	ZINC000875486958	DE	On-Demand	Anodyne	ELANE	44	35
COCC[C@@H](OC(=O)[C@H]1CCCN1C(C)=O)c1ccccc1	ZINC000875486958	DE	On-Demand	Anodyne	TRY1_BOVIN	78	39
COCC[C@@H](OC(=O)[C@H]1CCCN1C(C)=O)c1ccccc1	ZINC000875486958	DE	On-Demand	Anodyne	PREP	86	38
COCC[C@@H](OC(=O)[C@H]1CCCN1C(C)=O)c1ccccc1	ZINC000875486958	DE	On-Demand	Anodyne	BRCA1	59	33
CN1CC[C@@H](C(=O)Nc2nc3ccc(Cl)cn3n2)[C@H](c2cnn(C)c2)C1	ZINC000875486977	FD	On-Demand	Anodyne	SLC6A3	15	42
CN1CC[C@@H](C(=O)Nc2nc3ccc(Cl)cn3n2)[C@@H](c2cnn(C)c2)C1	ZINC000875486979	FD	On-Demand	Anodyne	SLC6A3	15	42
O=C(NCC[C@H]1CCOC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875487202	ED	On-Demand	Anodyne	ACHE	33	46
O=C(NCC[C@@H]1CCOC1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875487203	ED	On-Demand	Anodyne	ACHE	33	46
CC(=O)N1CCC[C@@H]1C(=O)Oc1ccc2c(c1)CN(C(=O)OC(C)(C)C)CC2	ZINC000875487371	GF	On-Demand	Anodyne	PREP	17	43
COC(=O)c1cc(NC(=O)[C@H](CC(C)C)NC(=O)NCc2ccc(C)cc2)ccc1F	ZINC000875487542	IH	On-Demand	Anodyne	ANPEP	31	58
COC(=O)c1cc(NC(=O)[C@H](CC(C)C)NC(=O)NCc2ccc(C)cc2)ccc1F	ZINC000875487542	IH	On-Demand	Anodyne	CTSK	27	41
COC(=O)c1cc(NC(=O)[C@H](CC(C)C)NC(=O)NCc2ccc(C)cc2)ccc1F	ZINC000875487542	IH	On-Demand	Anodyne	CTSL	25	41
COC(=O)c1cc(NC(=O)[C@H](CC(C)C)NC(=O)NCc2ccc(C)cc2)ccc1F	ZINC000875487542	IH	On-Demand	Anodyne	MMP3	21	40
COC(=O)c1cc(NC(=O)[C@H](CC(C)C)NC(=O)NCc2ccc(C)cc2)ccc1F	ZINC000875487542	IH	On-Demand	Anodyne	CTSS	15	41
COC(=O)c1cc(NC(=O)[C@@H](CC(C)C)NC(=O)NCc2ccc(C)cc2)ccc1F	ZINC000875487543	IH	On-Demand	Anodyne	ANPEP	31	58
COC(=O)c1cc(NC(=O)[C@@H](CC(C)C)NC(=O)NCc2ccc(C)cc2)ccc1F	ZINC000875487543	IH	On-Demand	Anodyne	CTSK	27	41
COC(=O)c1cc(NC(=O)[C@@H](CC(C)C)NC(=O)NCc2ccc(C)cc2)ccc1F	ZINC000875487543	IH	On-Demand	Anodyne	CTSL	25	41
COC(=O)c1cc(NC(=O)[C@@H](CC(C)C)NC(=O)NCc2ccc(C)cc2)ccc1F	ZINC000875487543	IH	On-Demand	Anodyne	MMP3	21	40
COC(=O)c1cc(NC(=O)[C@@H](CC(C)C)NC(=O)NCc2ccc(C)cc2)ccc1F	ZINC000875487543	IH	On-Demand	Anodyne	CTSS	15	41
COC(=O)N(C)NC(=O)NCC1(c2ccc(OC)cc2)CCC1	ZINC000875487587	DE	On-Demand	Reactive	KCNA3	43	36
COC(=O)N(C)NC(=O)NCC1(c2ccc(OC)cc2)CCC1	ZINC000875487587	DE	On-Demand	Reactive	MTNR1A	31	44
COC(=O)N(C)NC(=O)NCC1(c2ccc(OC)cc2)CCC1	ZINC000875487587	DE	On-Demand	Reactive	MTNR1B	17	44
O=C(N[C@H]1CCO[C@@H](c2ccc(F)cc2)C1)N1CCC(CO)(CO)CC1	ZINC000875487696	FD	On-Demand	Anodyne	EPHX2	17	40
O=C(N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1)N1CCC(CO)(CO)CC1	ZINC000875487697	FD	On-Demand	Anodyne	EPHX2	17	40
O=C(N[C@H]1CCO[C@H](c2ccc(F)cc2)C1)N1CCC(CO)(CO)CC1	ZINC000875487698	FD	On-Demand	Anodyne	EPHX2	17	40
O=C(N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1)N1CCC(CO)(CO)CC1	ZINC000875487699	FD	On-Demand	Anodyne	EPHX2	17	40
COCCN(CC1CCN(C)CC1)C(=O)NCc1cc(Cl)cc2c1OCC2	ZINC000875487826	GF	On-Demand	Anodyne	CACNA1I	47	35
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000875487979	GF	On-Demand	Anodyne	SLC6A4	24	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000875487979	GF	On-Demand	Anodyne	SLC6A3	52	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCO[C@H](c2ccc(F)cc2)C1	ZINC000875487980	GF	On-Demand	Anodyne	SLC6A4	24	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCO[C@H](c2ccc(F)cc2)C1	ZINC000875487980	GF	On-Demand	Anodyne	SLC6A3	52	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000875487981	GF	On-Demand	Anodyne	SLC6A4	24	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@H]1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000875487981	GF	On-Demand	Anodyne	SLC6A3	52	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1	ZINC000875487982	GF	On-Demand	Anodyne	SLC6A4	24	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1	ZINC000875487982	GF	On-Demand	Anodyne	SLC6A3	52	44
Cc1csc([C@H](C)CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)n1	ZINC000875488064	FG	On-Demand	Anodyne	CTSV	29	40
Cc1csc([C@H](C)CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)n1	ZINC000875488065	FG	On-Demand	Anodyne	CTSV	29	40
O=C(NCCO)C1CCN(C(=O)NCc2cc(Cl)cc3c2OCC3)CC1	ZINC000875488226	GD	On-Demand	Anodyne	EPHX2	19	52
COC(=O)c1ccc(C(=O)NNC(=O)c2cc3c(s2)CC[C@H](C(C)(C)C)C3)cn1	ZINC000875488351	HG	On-Demand	Reactive	PANC	45	34
COC(=O)c1ccc(C(=O)NNC(=O)c2cc3c(s2)CC[C@@H](C(C)(C)C)C3)cn1	ZINC000875488352	HG	On-Demand	Reactive	PANC	45	34
CCO[C@H](C(=O)N(CC1CCCCC1)c1ccccn1)[C@H]1CCOC1	ZINC000875488405	EG	On-Demand	Anodyne	AMY2	45	32
CCO[C@@H](C(=O)N(CC1CCCCC1)c1ccccn1)[C@@H]1CCOC1	ZINC000875488406	EG	On-Demand	Anodyne	AMY2	45	32
CCO[C@H](C(=O)N(CC1CCCCC1)c1ccccn1)[C@@H]1CCOC1	ZINC000875488407	EG	On-Demand	Anodyne	AMY2	45	32
CCO[C@@H](C(=O)N(CC1CCCCC1)c1ccccn1)[C@H]1CCOC1	ZINC000875488408	EG	On-Demand	Anodyne	AMY2	45	32
Cc1csc([C@H](C)CNC(=O)Nc2cnn(Cc3ccc(C#N)cc3)c2)n1	ZINC000875488413	GG	On-Demand	Mild	PANC	40	34
CCO[C@H](C(=O)N(CC1CCCCC1)c1ccccn1)C1CCOCC1	ZINC000875488434	FH	On-Demand	Anodyne	AMY2	44	31
CCO[C@@H](C(=O)N(CC1CCCCC1)c1ccccn1)C1CCOCC1	ZINC000875488435	FH	On-Demand	Anodyne	AMY2	44	31
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H](C)Oc2ncccc21	ZINC000875488530	FF	On-Demand	Anodyne	F2	27	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H](C)Oc2ncccc21	ZINC000875488530	FF	On-Demand	Anodyne	ACE	50	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H](C)Oc2ncccc21	ZINC000875488530	FF	On-Demand	Anodyne	P2RY12	40	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H](C)Oc2ncccc21	ZINC000875488530	FF	On-Demand	Anodyne	MME	42	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H](C)Oc2ncccc21	ZINC000875488530	FF	On-Demand	Anodyne	CMA1	66	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H](C)Oc2ncccc21	ZINC000875488530	FF	On-Demand	Anodyne	CTRA_BOVIN	69	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H](C)Oc2ncccc21	ZINC000875488530	FF	On-Demand	Anodyne	KLK3	41	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H](C)Oc2ncccc21	ZINC000875488530	FF	On-Demand	Anodyne	CTSB	41	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H](C)Oc2ncccc21	ZINC000875488530	FF	On-Demand	Anodyne	PAPA1_CARPA	43	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H](C)Oc2ncccc21	ZINC000875488530	FF	On-Demand	Anodyne	TRY1_BOVIN	51	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H](C)Oc2ncccc21	ZINC000875488530	FF	On-Demand	Anodyne	CYSP_TRYCR	62	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H](C)Oc2ncccc21	ZINC000875488530	FF	On-Demand	Anodyne	CTSK	43	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H](C)Oc2ncccc21	ZINC000875488530	FF	On-Demand	Anodyne	CTSL	43	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H](C)Oc2ncccc21	ZINC000875488530	FF	On-Demand	Anodyne	NPFFR2	50	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H](C)Oc2ncccc21	ZINC000875488530	FF	On-Demand	Anodyne	TIMP3	61	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H](C)Oc2ncccc21	ZINC000875488530	FF	On-Demand	Anodyne	CAPNS1	61	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H](C)Oc2ncccc21	ZINC000875488530	FF	On-Demand	Anodyne	HLA-DRB1	70	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H](C)Oc2ncccc21	ZINC000875488530	FF	On-Demand	Anodyne	CELA2A	54	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H](C)Oc2ncccc21	ZINC000875488530	FF	On-Demand	Anodyne	CAPN1	74	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H](C)Oc2ncccc21	ZINC000875488530	FF	On-Demand	Anodyne	CAPN2	83	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H](C)Oc2ncccc21	ZINC000875488530	FF	On-Demand	Anodyne	ACE2	68	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H](C)Oc2ncccc21	ZINC000875488530	FF	On-Demand	Anodyne	TGM2	20	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H](C)Oc2ncccc21	ZINC000875488530	FF	On-Demand	Anodyne	GAG-PRO	40	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@@H](C)Oc2ncccc21	ZINC000875488530	FF	On-Demand	Anodyne	NPFFR1	62	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H](C)Oc2ncccc21	ZINC000875488531	FF	On-Demand	Anodyne	F2	27	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H](C)Oc2ncccc21	ZINC000875488531	FF	On-Demand	Anodyne	ACE	50	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H](C)Oc2ncccc21	ZINC000875488531	FF	On-Demand	Anodyne	P2RY12	40	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H](C)Oc2ncccc21	ZINC000875488531	FF	On-Demand	Anodyne	MME	42	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H](C)Oc2ncccc21	ZINC000875488531	FF	On-Demand	Anodyne	CMA1	66	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H](C)Oc2ncccc21	ZINC000875488531	FF	On-Demand	Anodyne	CTRA_BOVIN	69	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H](C)Oc2ncccc21	ZINC000875488531	FF	On-Demand	Anodyne	KLK3	41	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H](C)Oc2ncccc21	ZINC000875488531	FF	On-Demand	Anodyne	CTSB	41	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H](C)Oc2ncccc21	ZINC000875488531	FF	On-Demand	Anodyne	PAPA1_CARPA	43	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H](C)Oc2ncccc21	ZINC000875488531	FF	On-Demand	Anodyne	TRY1_BOVIN	51	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H](C)Oc2ncccc21	ZINC000875488531	FF	On-Demand	Anodyne	CYSP_TRYCR	62	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H](C)Oc2ncccc21	ZINC000875488531	FF	On-Demand	Anodyne	CTSK	43	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H](C)Oc2ncccc21	ZINC000875488531	FF	On-Demand	Anodyne	CTSL	43	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H](C)Oc2ncccc21	ZINC000875488531	FF	On-Demand	Anodyne	NPFFR2	50	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H](C)Oc2ncccc21	ZINC000875488531	FF	On-Demand	Anodyne	TIMP3	61	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H](C)Oc2ncccc21	ZINC000875488531	FF	On-Demand	Anodyne	CAPNS1	61	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H](C)Oc2ncccc21	ZINC000875488531	FF	On-Demand	Anodyne	HLA-DRB1	70	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H](C)Oc2ncccc21	ZINC000875488531	FF	On-Demand	Anodyne	CELA2A	54	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H](C)Oc2ncccc21	ZINC000875488531	FF	On-Demand	Anodyne	CAPN1	74	36
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H](C)Oc2ncccc21	ZINC000875488531	FF	On-Demand	Anodyne	CAPN2	83	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H](C)Oc2ncccc21	ZINC000875488531	FF	On-Demand	Anodyne	ACE2	68	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H](C)Oc2ncccc21	ZINC000875488531	FF	On-Demand	Anodyne	TGM2	20	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H](C)Oc2ncccc21	ZINC000875488531	FF	On-Demand	Anodyne	GAG-PRO	40	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1C[C@H](C)Oc2ncccc21	ZINC000875488531	FF	On-Demand	Anodyne	NPFFR1	62	33
CCO[C@H](C(=O)N(CC)c1ccc(C#N)c(Cl)c1)C1CCOCC1	ZINC000875488549	FG	On-Demand	Mild	PGR	29	41
CCO[C@@H](C(=O)N(CC)c1ccc(C#N)c(Cl)c1)C1CCOCC1	ZINC000875488550	FG	On-Demand	Mild	PGR	29	41
CCN(C(=O)CC[C@@H]1CC[C@H](C(N)=O)O1)c1ccc(C#N)c(Cl)c1	ZINC000875488825	EE	On-Demand	Mild	PGR	29	43
CCN(C(=O)c1ccn(CC)c1C)c1ccc(C#N)c(Cl)c1	ZINC000875488911	DI	On-Demand	Mild	PGR	30	41
CCN(C(=O)[C@H](OC)C(=O)OC(C)(C)C)c1ccc(C#N)c(Cl)c1	ZINC000875488966	FF	On-Demand	Mild	PGR	28	40
CCN(C(=O)CC[C@@H]1C[C@H](C(=O)OC)CO1)c1ccc(C#N)c(Cl)c1	ZINC000875488983	FF	On-Demand	Mild	PGR	28	43
CCN(C(=O)[C@H]1CCN(C)C[C@H]1c1cnn(C)c1)c1ccc(C#N)c(Cl)c1	ZINC000875489124	GG	On-Demand	Mild	PGR	29	44
CCN(C(=O)[C@H]1CCN(C)C[C@@H]1c1cnn(C)c1)c1ccc(C#N)c(Cl)c1	ZINC000875489125	GG	On-Demand	Mild	PGR	29	44
CCN(C(=O)CC(F)(F)C(F)(F)F)c1ccc(C#N)c(Cl)c1	ZINC000875489142	EI	On-Demand	Mild	PGR	30	43
CCN(C(=O)c1cccn(C2CC2)c1=O)c1ccc(C#N)c(Cl)c1	ZINC000875489153	EG	On-Demand	Mild	PGR	31	45
CCN(C(=O)[C@H]1COC(=O)N1C)c1ccc(C#N)c(Cl)c1	ZINC000875489369	DE	On-Demand	Mild	PGR	31	42
CCN(C(=O)[C@H]1C[C@@]1(C)Br)c1ccc(C#N)c(Cl)c1	ZINC000875489385	EH	On-Demand	Mild	PGR	30	43
CCN(C(=O)[C@H]1C[C@]1(C)Br)c1ccc(C#N)c(Cl)c1	ZINC000875489387	EH	On-Demand	Mild	PGR	30	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1ccc(Cl)c(C)c1	ZINC000875489391	CF	On-Demand	Anodyne	ANPEP	15	41
Cc1nnc([C@@H](C)NC(=O)NC[C@H](O)Cc2cccc(Cl)c2)s1	ZINC000875489516	FE	On-Demand	Anodyne	CTSV	45	44
Cc1nnc([C@@H](C)NC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)s1	ZINC000875489517	FE	On-Demand	Anodyne	CTSV	45	44
CCN(C(=O)CN1CCCCC(=O)C1=O)c1ccc(C#N)c(Cl)c1	ZINC000875489766	EE	On-Demand	Mild	PGR	34	47
CN1CCC(CNC(=O)NC2COC(C)(C)OC2)(c2ccccc2)CC1	ZINC000875489894	FE	On-Demand	Anodyne	KCNA3	49	42
CN1CCC(CNC(=O)NC2COC(C)(C)OC2)(c2ccccc2)CC1	ZINC000875489894	FE	On-Demand	Anodyne	SOAT1	15	44
Cc1ccc(CN2CC[C@H](NC(=O)NC3COC(C)(C)OC3)C2)cc1	ZINC000875490141	EE	On-Demand	Anodyne	DRD4	38	49
Cc1ccc(CN2CC[C@H](NC(=O)NC3COC(C)(C)OC3)C2)cc1	ZINC000875490141	EE	On-Demand	Anodyne	CHRM3	16	44
Cc1ccc(CN2CC[C@H](NC(=O)NC3COC(C)(C)OC3)C2)cc1	ZINC000875490141	EE	On-Demand	Anodyne	SIGMAR1	30	44
Cc1ccc(CN2CC[C@H](NC(=O)NC3COC(C)(C)OC3)C2)cc1	ZINC000875490141	EE	On-Demand	Anodyne	SSTR5	48	35
Cc1ccc(CN2CC[C@H](NC(=O)NC3COC(C)(C)OC3)C2)cc1	ZINC000875490141	EE	On-Demand	Anodyne	CCR3	31	48
Cc1ccc(CN2CC[C@H](NC(=O)NC3COC(C)(C)OC3)C2)cc1	ZINC000875490141	EE	On-Demand	Anodyne	CCR2	16	48
Cc1ccc(CN2CC[C@H](NC(=O)NC3COC(C)(C)OC3)C2)cc1	ZINC000875490141	EE	On-Demand	Anodyne	MCHR1	39	53
Cc1ccc(CN2CC[C@@H](NC(=O)NC3COC(C)(C)OC3)C2)cc1	ZINC000875490143	EE	On-Demand	Anodyne	DRD4	38	49
Cc1ccc(CN2CC[C@@H](NC(=O)NC3COC(C)(C)OC3)C2)cc1	ZINC000875490143	EE	On-Demand	Anodyne	CHRM3	16	44
Cc1ccc(CN2CC[C@@H](NC(=O)NC3COC(C)(C)OC3)C2)cc1	ZINC000875490143	EE	On-Demand	Anodyne	SIGMAR1	30	44
Cc1ccc(CN2CC[C@@H](NC(=O)NC3COC(C)(C)OC3)C2)cc1	ZINC000875490143	EE	On-Demand	Anodyne	SSTR5	48	35
Cc1ccc(CN2CC[C@@H](NC(=O)NC3COC(C)(C)OC3)C2)cc1	ZINC000875490143	EE	On-Demand	Anodyne	CCR3	31	48
Cc1ccc(CN2CC[C@@H](NC(=O)NC3COC(C)(C)OC3)C2)cc1	ZINC000875490143	EE	On-Demand	Anodyne	CCR2	16	48
Cc1ccc(CN2CC[C@@H](NC(=O)NC3COC(C)(C)OC3)C2)cc1	ZINC000875490143	EE	On-Demand	Anodyne	MCHR1	39	53
COc1cc(NC(=O)c2cc(C)cc(OC)c2C)ncn1	ZINC000875490224	CE	On-Demand	Anodyne	LUCI_LUCLA	16	43
CCN(C(=O)CCCOC1CCOCC1)c1ccc(C#N)c(Cl)c1	ZINC000875490604	FH	On-Demand	Mild	PGR	29	41
CCN(C(=O)c1cn2c(n1)C[C@@H](OC)CC2)c1ccc(C#N)c(Cl)c1	ZINC000875490641	FG	On-Demand	Mild	PGR	27	40
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cl)c(C)c1	ZINC000875490643	EF	On-Demand	Anodyne	SLC6A2	15	49
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cl)c(C)c1	ZINC000875490643	EF	On-Demand	Anodyne	SLC6A4	35	49
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cl)c(C)c1	ZINC000875490643	EF	On-Demand	Anodyne	SLC6A3	61	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cl)c(C)c1	ZINC000875490644	EF	On-Demand	Anodyne	SLC6A2	15	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cl)c(C)c1	ZINC000875490644	EF	On-Demand	Anodyne	SLC6A4	35	49
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(Cl)c(C)c1	ZINC000875490644	EF	On-Demand	Anodyne	SLC6A3	61	49
COc1cc(NC(=O)[C@H](Cc2cccnc2)C2CCCC2)ncn1	ZINC000875490780	EF	On-Demand	Anodyne	C3AR1	42	43
CCOC(=O)[C@@H]1CC[C@H](C(=O)N(CC)c2ccc(C#N)c(Cl)c2)C1	ZINC000875490844	EH	On-Demand	Mild	PGR	31	47
CN(C)c1ncc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)cn1	ZINC000875490899	FG	On-Demand	Anodyne	BTK	22	42
CN(C)c1ncc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)cn1	ZINC000875490899	FG	On-Demand	Anodyne	KCNK3	92	39
CN(C)c1ncc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)cn1	ZINC000875490899	FG	On-Demand	Anodyne	KCNK9	59	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)c1ncccc1OC	ZINC000875490954	FE	On-Demand	Anodyne	MME	51	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)c1ncccc1OC	ZINC000875490954	FE	On-Demand	Anodyne	CTRA_BOVIN	50	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)c1ncccc1OC	ZINC000875490954	FE	On-Demand	Anodyne	KLK3	49	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)c1ncccc1OC	ZINC000875490954	FE	On-Demand	Anodyne	CTSB	53	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)c1ncccc1OC	ZINC000875490954	FE	On-Demand	Anodyne	PAPA1_CARPA	70	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)c1ncccc1OC	ZINC000875490954	FE	On-Demand	Anodyne	CYSP_TRYCR	59	45
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)c1ncccc1OC	ZINC000875490954	FE	On-Demand	Anodyne	CTSK	34	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)c1ncccc1OC	ZINC000875490954	FE	On-Demand	Anodyne	CTSL	42	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)c1ncccc1OC	ZINC000875490954	FE	On-Demand	Anodyne	TIMP3	81	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)c1ncccc1OC	ZINC000875490954	FE	On-Demand	Anodyne	CAPNS1	64	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)c1ncccc1OC	ZINC000875490954	FE	On-Demand	Anodyne	HLA-DRB1	79	43
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)c1ncccc1OC	ZINC000875490954	FE	On-Demand	Anodyne	CELA2A	40	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)c1ncccc1OC	ZINC000875490954	FE	On-Demand	Anodyne	REN	32	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)c1ncccc1OC	ZINC000875490954	FE	On-Demand	Anodyne	CTSS	20	47
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)c1ncccc1OC	ZINC000875490954	FE	On-Demand	Anodyne	CAPN1	89	41
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)c1ncccc1OC	ZINC000875490954	FE	On-Demand	Anodyne	CAPN2	109	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)c1ncccc1OC	ZINC000875490954	FE	On-Demand	Anodyne	ACE2	52	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)c1ncccc1OC	ZINC000875490954	FE	On-Demand	Anodyne	FPR1	44	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N(C)c1ncccc1OC	ZINC000875490954	FE	On-Demand	Anodyne	CTRB_BOVIN	47	38
COc1ccccc1[C@H]1CCCN(C(=O)NCCOC(C)C)CC1	ZINC000875490984	EG	On-Demand	Anodyne	HTR1A	22	41
COc1ccccc1[C@H]1CCCN(C(=O)NCCOC(C)C)CC1	ZINC000875490984	EG	On-Demand	Anodyne	DRD2	23	44
COc1ccccc1[C@H]1CCCN(C(=O)NCCOC(C)C)CC1	ZINC000875490984	EG	On-Demand	Anodyne	RBP4	35	40
COc1ccccc1[C@@H]1CCCN(C(=O)NCCOC(C)C)CC1	ZINC000875490986	EG	On-Demand	Anodyne	HTR1A	22	41
COc1ccccc1[C@@H]1CCCN(C(=O)NCCOC(C)C)CC1	ZINC000875490986	EG	On-Demand	Anodyne	DRD2	23	44
COc1ccccc1[C@@H]1CCCN(C(=O)NCCOC(C)C)CC1	ZINC000875490986	EG	On-Demand	Anodyne	RBP4	35	40
COc1ccccc1[C@H]1CCCN(C(=O)NCCC2(C)OCCO2)CC1	ZINC000875491039	FG	On-Demand	Anodyne	DRD2	15	44
COc1ccccc1[C@@H]1CCCN(C(=O)NCCC2(C)OCCO2)CC1	ZINC000875491041	FG	On-Demand	Anodyne	DRD2	15	44
O=C(N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875491168	GH	On-Demand	Anodyne	EPHX2	22	43
O=C(N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875491169	GH	On-Demand	Anodyne	EPHX2	22	43
O=C(N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875491170	GH	On-Demand	Anodyne	EPHX2	22	43
O=C(N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875491171	GH	On-Demand	Anodyne	EPHX2	22	43
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)NCCC1(C)OCCO1	ZINC000875491282	GF	On-Demand	Anodyne	SIGMAR1	15	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)c1nccs1	ZINC000875491336	DD	On-Demand	Anodyne	SLC6A3	24	41
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)c1nccs1	ZINC000875491338	DD	On-Demand	Anodyne	SLC6A3	24	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@H](C)c1nccs1	ZINC000875491340	DD	On-Demand	Anodyne	SLC6A3	24	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC[C@@H](C)c1nccs1	ZINC000875491341	DD	On-Demand	Anodyne	SLC6A3	24	41
C[C@@H](CNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)c1nccs1	ZINC000875491421	FF	On-Demand	Anodyne	FAAH	15	40
C[C@H](CNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1)c1nccs1	ZINC000875491424	FF	On-Demand	Anodyne	FAAH	15	40
C[C@@H](CNC(=O)N[C@H](c1cccc(C#N)c1)C(F)(F)F)c1nccs1	ZINC000875491446	FH	On-Demand	Mild	CTSK	19	41
C[C@@H](NC(=O)NCCC1(C)OCCO1)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000875491575	GG	On-Demand	Anodyne	PRCP	27	48
C[C@H](NC(=O)NCCC1(C)OCCO1)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000875491577	GG	On-Demand	Anodyne	PRCP	27	48
COc1ccc2c(c1)CC[C@H]2C(=O)N(C)c1ncccc1OC	ZINC000875491605	DF	On-Demand	Anodyne	PPARG	38	40
COc1ccc2c(c1)CC[C@H]2C(=O)N(C)c1ncccc1OC	ZINC000875491605	DF	On-Demand	Anodyne	PPARD	52	42
CN1CCN(C(=O)N[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)CCC1(C)C	ZINC000875491644	FG	On-Demand	Anodyne	CACNA1H	28	40
CN1CCN(C(=O)N[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)CCC1(C)C	ZINC000875491645	FG	On-Demand	Anodyne	CACNA1H	28	40
CN1CCN(C(=O)N[C@H]2CCO[C@H](c3ccc(F)cc3)C2)CCC1(C)C	ZINC000875491646	FG	On-Demand	Anodyne	CACNA1H	28	40
CN1CCN(C(=O)N[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)CCC1(C)C	ZINC000875491647	FG	On-Demand	Anodyne	CACNA1H	28	40
Cn1nc(Cl)c(C(=O)N[C@@H](C[C@@H]2CCOC2)c2ccccc2)c1Cl	ZINC000875491814	FH	On-Demand	Anodyne	TACR3	49	38
Cn1nc(Cl)c(C(=O)N[C@H](C[C@H]2CCOC2)c2ccccc2)c1Cl	ZINC000875491815	FH	On-Demand	Anodyne	TACR3	49	38
Cn1nc(Cl)c(C(=O)N[C@H](C[C@@H]2CCOC2)c2ccccc2)c1Cl	ZINC000875491816	FH	On-Demand	Anodyne	TACR3	49	38
Cn1nc(Cl)c(C(=O)N[C@@H](C[C@H]2CCOC2)c2ccccc2)c1Cl	ZINC000875491817	FH	On-Demand	Anodyne	TACR3	49	38
COCCN(CC1CCN(C)CC1)C(=O)NCC(C)(C)CCOC	ZINC000875491869	EE	On-Demand	Anodyne	CACNA1I	54	37
CN(CC1(C)COC1)C(=O)NC1CCC(O)(c2ccccc2)CC1	ZINC000875491927	EE	On-Demand	Anodyne	KCNA3	16	40
CCOC1CC2(C1)C[C@H]2NC(=O)NCC1(c2ccccc2OC)CCC1	ZINC000875491940	FG	On-Demand	Anodyne	KCNA3	47	38
CCOC1CC2(C1)C[C@H]2NC(=O)NCC1(c2ccccc2OC)CCC1	ZINC000875491940	FG	On-Demand	Anodyne	TIMP3	59	33
CCOC1CC2(C1)C[C@H]2NC(=O)NCC1(c2ccccc2OC)CCC1	ZINC000875491940	FG	On-Demand	Anodyne	HCN1	50	31
CCOC1CC2(C1)C[C@H]2NC(=O)NCC1(c2ccccc2OC)CCC1	ZINC000875491940	FG	On-Demand	Anodyne	HCN4	48	31
CCOC1CC2(C1)C[C@@H]2NC(=O)NCC1(c2ccccc2OC)CCC1	ZINC000875491941	FG	On-Demand	Anodyne	KCNA3	47	38
CCOC1CC2(C1)C[C@@H]2NC(=O)NCC1(c2ccccc2OC)CCC1	ZINC000875491941	FG	On-Demand	Anodyne	TIMP3	59	33
CCOC1CC2(C1)C[C@@H]2NC(=O)NCC1(c2ccccc2OC)CCC1	ZINC000875491941	FG	On-Demand	Anodyne	HCN1	50	31
CCOC1CC2(C1)C[C@@H]2NC(=O)NCC1(c2ccccc2OC)CCC1	ZINC000875491941	FG	On-Demand	Anodyne	HCN4	48	31
CC(C)(C(=O)N1CCCc2c1cccc2[N+](=O)[O-])c1ccc(C#N)cc1	ZINC000875491944	EH	On-Demand	Mild	AR	27	42
COc1cnc(C(=O)N2CCCc3c2cccc3[N+](=O)[O-])c(F)c1	ZINC000875491947	EF	On-Demand	Bother	TAAR1	30	40
Cn1nc(CNC(=O)NC[C@@H](O)Cc2cccc(Cl)c2)c2ccccc21	ZINC000875491972	FF	On-Demand	Anodyne	CTSV	32	41
Cn1nc(CNC(=O)NC[C@H](O)Cc2cccc(Cl)c2)c2ccccc21	ZINC000875491973	FF	On-Demand	Anodyne	CTSV	32	41
COc1ccccc1[C@H]1CCCN(C(=O)NCCc2ccn(C)n2)CC1	ZINC000875491974	FF	On-Demand	Anodyne	DRD2	17	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCCc2ccn(C)n2)CC1	ZINC000875491975	FF	On-Demand	Anodyne	DRD2	17	42
COC(=O)N(C)NC(=O)NCC1(c2ccccc2OC)CCC1	ZINC000875491989	DE	On-Demand	Reactive	KCNA3	47	39
COC(=O)N(C)NC(=O)NCC1(c2ccccc2OC)CCC1	ZINC000875491989	DE	On-Demand	Reactive	HCN1	43	35
COC(=O)C1(O)CN(C(=O)NCC2(c3ccccc3OC)CCC2)C1	ZINC000875491997	ED	On-Demand	Anodyne	KCNA3	46	38
O=C(NCCN1CC[C@@H](O)C1)NC1CCC(O)(c2ccccc2)CC1	ZINC000875492007	ED	On-Demand	Anodyne	DRD4	16	42
O=C(NCCN1CC[C@@H](O)C1)NC1CCC(O)(c2ccccc2)CC1	ZINC000875492007	ED	On-Demand	Anodyne	OPRL1	19	45
O=C(NCCN1CC[C@@H](O)C1)NC1CCC(O)(c2ccccc2)CC1	ZINC000875492007	ED	On-Demand	Anodyne	CCR1	31	45
O=C(NCCN1CC[C@@H](O)C1)NC1CCC(O)(c2ccccc2)CC1	ZINC000875492007	ED	On-Demand	Anodyne	PLD1	43	34
O=C(NCCN1CC[C@@H](O)C1)NC1CCC(O)(c2ccccc2)CC1	ZINC000875492007	ED	On-Demand	Anodyne	PLD2	41	34
CN(C[C@@H]1C[C@H](O)C1)C(=O)NC1CCC(O)(c2ccccc2)CC1	ZINC000875492179	EE	On-Demand	Anodyne	KCNA3	15	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2(c3ccccc3OC)CCC2)C1	ZINC000875492206	FF	On-Demand	Anodyne	KCNA3	46	39
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2(c3ccccc3OC)CCC2)C1	ZINC000875492206	FF	On-Demand	Anodyne	SOAT1	15	43
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2(c3ccccc3OC)CCC2)C1	ZINC000875492206	FF	On-Demand	Anodyne	HCN1	66	35
CCOC(=O)[C@H](C)C1CN(C(=O)NCC2(c3ccccc3OC)CCC2)C1	ZINC000875492206	FF	On-Demand	Anodyne	HCN4	50	35
C=CC[C@@H]1CCN(C(=O)NC2CCC(O)(c3ccccc3)CC2)C1	ZINC000875492319	EG	On-Demand	Mild	GRIN2B	24	43
C=CC[C@H]1CCN(C(=O)NC2CCC(O)(c3ccccc3)CC2)C1	ZINC000875492320	EG	On-Demand	Mild	GRIN2B	24	43
CONC(=O)C1CCN(C(=O)NCC2(c3ccccc3OC)CCC2)CC1	ZINC000875492327	GE	On-Demand	Anodyne	KCNA3	45	39
CONC(=O)C1CCN(C(=O)NCC2(c3ccccc3OC)CCC2)CC1	ZINC000875492327	GE	On-Demand	Anodyne	MTNR1A	15	42
CONC(=O)C1CCN(C(=O)NCC2(c3ccccc3OC)CCC2)CC1	ZINC000875492327	GE	On-Demand	Anodyne	MTNR1B	16	42
CONC(=O)C1CCN(C(=O)NCC2(c3ccccc3OC)CCC2)CC1	ZINC000875492327	GE	On-Demand	Anodyne	CACNA1G	24	42
CONC(=O)C1CCN(C(=O)NCC2(c3ccccc3OC)CCC2)CC1	ZINC000875492327	GE	On-Demand	Anodyne	HCN1	49	37
CONC(=O)C1CCN(C(=O)NCC2(c3ccccc3OC)CCC2)CC1	ZINC000875492327	GE	On-Demand	Anodyne	HCN4	41	34
COc1ccc2c(c1)CC[C@H]2C(=O)Nc1cc(OC)ncn1	ZINC000875492341	CE	On-Demand	Anodyne	PPARD	35	40
Cn1nc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c2ccccc21	ZINC000875492355	FG	On-Demand	Anodyne	HTR4	29	41
Cn1nc(CNC(=O)N2CCC[C@H](OC3CCC3)CC2)c2ccccc21	ZINC000875492355	FG	On-Demand	Anodyne	EPHX2	20	41
Cn1nc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c2ccccc21	ZINC000875492356	FG	On-Demand	Anodyne	HTR4	29	41
Cn1nc(CNC(=O)N2CCC[C@@H](OC3CCC3)CC2)c2ccccc21	ZINC000875492356	FG	On-Demand	Anodyne	EPHX2	20	41
O=C(NC1CCC(O)(c2ccccc2)CC1)N1[C@H]2CC[C@H]1CC(F)(F)C2	ZINC000875492361	FH	On-Demand	Anodyne	OPRL1	22	41
CCn1ncc(C(=O)N2CCCc3c2cccc3[N+](=O)[O-])c1Br	ZINC000875492393	GG	On-Demand	Bother	AVPR2	24	41
C[C@@H](OC(=O)COCc1ccnc(O)c1)c1ccc(F)c(C(F)(F)F)c1	ZINC000875492401	FH	On-Demand	Anodyne	SUCNR1	36	40
COC(=O)N(C)NC(=O)NCc1nc2ccccc2n1C1CC1	ZINC000875492520	DD	On-Demand	Reactive	FPR2	22	40
CCn1ncnc1-c1ccc(C(=O)N2CCCc3c2cccc3[N+](=O)[O-])cc1	ZINC000875492542	GG	On-Demand	Bother	AVPR2	46	44
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCCC(F)(F)CC1	ZINC000875492554	FH	On-Demand	Anodyne	OPRL1	18	40
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCCC(F)(F)CC1	ZINC000875492554	FH	On-Demand	Anodyne	EPHX2	37	42
CCOC1CC2(C1)C[C@H]2C(=O)Nc1ncccc1CC	ZINC000875492692	CF	On-Demand	Anodyne	TIMP3	57	35
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nn(C)c2ccccc12	ZINC000875492705	ED	On-Demand	Anodyne	SLC6A3	54	39
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1nn(C)c2ccccc12	ZINC000875492709	ED	On-Demand	Anodyne	SLC6A3	54	39
COCC1CC(NC(=O)NCC2(c3ccccc3OC)CCC2)C1	ZINC000875492717	EF	On-Demand	Anodyne	KCNA3	50	44
C[C@@]1(CO)CN(C(=O)NC2CCC(O)(c3ccccc3)CC2)C[C@]1(C)CO	ZINC000875492742	GD	On-Demand	Anodyne	OPRL1	20	44
C[C@@]1(CO)CN(C(=O)NC2CCC(O)(c3ccccc3)CC2)C[C@]1(C)CO	ZINC000875492742	GD	On-Demand	Anodyne	EPHX2	23	41
O=C(c1c(C(F)F)nc2n1CCCC2)N1CCCc2c1cccc2[N+](=O)[O-]	ZINC000875492790	GH	On-Demand	Bother	AVPR2	23	41
O=C(NC1CCC(O)(c2ccccc2)CC1)N(C1CC1)C1CC1	ZINC000875492792	DG	On-Demand	Anodyne	OPRL1	19	50
O=C(NC[C@@H]1C[C@H](O)C1)NC1CCC(O)(c2ccccc2)CC1	ZINC000875492828	DD	On-Demand	Anodyne	EPHX2	19	42
O=C(NCC1CC(O)C1)NC1CCC(O)(c2ccccc2)CC1	ZINC000875492829	DD	On-Demand	Anodyne	EPHX2	19	42
COCCN(CC1CCN(C)CC1)C(=O)NCc1nn(C)c2ccccc12	ZINC000875492830	FE	On-Demand	Anodyne	HTR4	45	40
Cn1nc(CNC(=O)N2CCC[C@@H](C(C)(C)O)C2)c2ccccc21	ZINC000875492852	EE	On-Demand	Anodyne	HTR4	30	41
Cn1nc(CNC(=O)N2CCC[C@H](C(C)(C)O)C2)c2ccccc21	ZINC000875492853	EE	On-Demand	Anodyne	HTR4	30	41
O=C(c1cccn(C2CC2)c1=O)N1CCCc2c1cccc2[N+](=O)[O-]	ZINC000875492863	EF	On-Demand	Bother	AVPR2	28	45
Cn1nc(Cl)c(C(=O)N2CCCc3c2cccc3[N+](=O)[O-])c1Cl	ZINC000875492864	FG	On-Demand	Bother	AVPR2	28	43
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CC[C@H]2CC[C@@H](C1)S2	ZINC000875492886	FG	On-Demand	Anodyne	EPHX2	29	40
C#CC[C@@H](COC)NC(=O)NCC1(c2ccccc2OC)CCC1	ZINC000875492887	EE	On-Demand	Mild	KCNA3	41	36
C#CC[C@H](COC)NC(=O)NCC1(c2ccccc2OC)CCC1	ZINC000875492888	EE	On-Demand	Mild	KCNA3	41	36
COc1cc(NC(=O)[C@H](F)[C@H]2CCN(C(=O)OC(C)(C)C)C2)ncn1	ZINC000875492915	FE	On-Demand	Anodyne	GPR119	48	40
Cc1ncc(NC(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)s1	ZINC000875492917	EI	On-Demand	Anodyne	HSD17B2	15	40
O=C(N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875492941	GI	On-Demand	Anodyne	EPHX2	21	41
O=C(N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875492942	GI	On-Demand	Anodyne	EPHX2	21	41
O=C(N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875492943	GI	On-Demand	Anodyne	EPHX2	21	41
O=C(N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875492944	GI	On-Demand	Anodyne	EPHX2	21	41
COc1cc(NC(=O)[C@H](F)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)ncn1	ZINC000875493048	FE	On-Demand	Anodyne	GPR119	48	40
Cn1nc(CNC(=O)N2CCC(C(=O)NCCO)CC2)c2ccccc21	ZINC000875493074	FC	On-Demand	Anodyne	EPHX2	17	42
C#CC[C@@H](CCOC)NC(=O)NCC1(c2ccccc2OC)CCC1	ZINC000875493100	EF	On-Demand	Mild	KCNA3	44	38
C#CC[C@H](CCOC)NC(=O)NCC1(c2ccccc2OC)CCC1	ZINC000875493101	EF	On-Demand	Mild	KCNA3	44	38
O=CN1CCCN(C(=O)NCc2nc3ccccc3n2C2CC2)CC1	ZINC000875493102	ED	On-Demand	Anodyne	SMO	41	39
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCc2c(O)cccc2C1	ZINC000875493104	FG	On-Demand	Anodyne	EPHX2	15	41
CC[C@H](C[C@H](C)O)NC(=O)NCC1(c2ccccc2OC)CCC1	ZINC000875493112	EF	On-Demand	Anodyne	KCNA3	44	39
CC[C@H](C[C@H](C)O)NC(=O)NCC1(c2ccccc2OC)CCC1	ZINC000875493112	EF	On-Demand	Anodyne	NMBR	17	40
CC[C@H](C[C@H](C)O)NC(=O)NCC1(c2ccccc2OC)CCC1	ZINC000875493112	EF	On-Demand	Anodyne	HCN1	43	35
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCCC2(CC1)CC2	ZINC000875493119	EH	On-Demand	Anodyne	OPRL1	16	40
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCCC2(CC1)CC2	ZINC000875493119	EH	On-Demand	Anodyne	EPHX2	33	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccn(C)n1	ZINC000875493134	DC	On-Demand	Anodyne	SLC6A3	55	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccn(C)n1	ZINC000875493135	DC	On-Demand	Anodyne	SLC6A3	55	37
CC(C)n1ncc(C(=O)N2CCCc3c2cccc3[N+](=O)[O-])c1Cl	ZINC000875493160	EH	On-Demand	Bother	AVPR2	22	41
CCOC(=O)[C@H](C)C1CN(C(=O)NC2Cc3ccccc3C2)C1	ZINC000875493194	DD	On-Demand	Anodyne	ACE	29	42
CCOC(=O)[C@H](C)C1CN(C(=O)NC2Cc3ccccc3C2)C1	ZINC000875493194	DD	On-Demand	Anodyne	TPP2	45	32
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CC[C@H](O)[C@H]2CCCC[C@@H]21	ZINC000875493201	FG	On-Demand	Anodyne	OPRL1	16	42
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CC[C@H](O)[C@@H]2CCCC[C@H]21	ZINC000875493202	FG	On-Demand	Anodyne	OPRL1	16	42
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CC[C@H](O)[C@H]2CCCC[C@H]21	ZINC000875493203	FG	On-Demand	Anodyne	OPRL1	16	42
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CC[C@H](O)[C@@H]2CCCC[C@@H]21	ZINC000875493204	FG	On-Demand	Anodyne	OPRL1	16	42
CCC[C@H](CCO)NC(=O)NC1CCC(O)(c2ccccc2)CC1	ZINC000875493205	EF	On-Demand	Anodyne	OPRL1	15	41
CCC[C@@H](CCO)NC(=O)NC1CCC(O)(c2ccccc2)CC1	ZINC000875493206	EF	On-Demand	Anodyne	OPRL1	15	41
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NC2Cc3ccccc3C2)[C@H](O)C1	ZINC000875493212	GD	On-Demand	Anodyne	CCR8	22	40
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NC2Cc3ccccc3C2)[C@H](O)C1	ZINC000875493212	GD	On-Demand	Anodyne	GPR119	40	41
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NC2Cc3ccccc3C2)[C@H](O)C1	ZINC000875493212	GD	On-Demand	Anodyne	SFRP1	22	41
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NC2Cc3ccccc3C2)[C@H](O)C1	ZINC000875493213	GD	On-Demand	Anodyne	CCR8	22	40
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NC2Cc3ccccc3C2)[C@H](O)C1	ZINC000875493213	GD	On-Demand	Anodyne	GPR119	40	41
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NC2Cc3ccccc3C2)[C@H](O)C1	ZINC000875493213	GD	On-Demand	Anodyne	SFRP1	22	41
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NC2Cc3ccccc3C2)[C@@H](O)C1	ZINC000875493214	GD	On-Demand	Anodyne	CCR8	22	40
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NC2Cc3ccccc3C2)[C@@H](O)C1	ZINC000875493214	GD	On-Demand	Anodyne	GPR119	40	41
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)NC2Cc3ccccc3C2)[C@@H](O)C1	ZINC000875493214	GD	On-Demand	Anodyne	SFRP1	22	41
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NC2Cc3ccccc3C2)[C@@H](O)C1	ZINC000875493215	GD	On-Demand	Anodyne	CCR8	22	40
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NC2Cc3ccccc3C2)[C@@H](O)C1	ZINC000875493215	GD	On-Demand	Anodyne	GPR119	40	41
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NC2Cc3ccccc3C2)[C@@H](O)C1	ZINC000875493215	GD	On-Demand	Anodyne	SFRP1	22	41
CC(C)n1ncc(C(=O)N2CCCc3c2cccc3[N+](=O)[O-])c1Br	ZINC000875493216	GH	On-Demand	Bother	AVPR2	16	41
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875493222	GH	On-Demand	Anodyne	EPHX2	37	42
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875493223	GH	On-Demand	Anodyne	EPHX2	37	42
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875493232	GH	On-Demand	Anodyne	GRIN2B	16	52
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875493232	GH	On-Demand	Anodyne	EPHX2	33	40
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CC[C@H](c2ccc(O)cc2)C1	ZINC000875493232	GH	On-Demand	Anodyne	SMO	20	41
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875493233	GH	On-Demand	Anodyne	GRIN2B	16	52
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875493233	GH	On-Demand	Anodyne	EPHX2	33	40
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CC[C@@H](c2ccc(O)cc2)C1	ZINC000875493233	GH	On-Demand	Anodyne	SMO	20	41
O=C(NC1CCC(O)(c2ccccc2)CC1)N[C@@H]1C[C@H](CO)C1	ZINC000875493236	DD	On-Demand	Anodyne	EPHX2	17	40
COC(=O)C1=NO[C@]2(CCN(C(=O)NC3Cc4ccccc4C3)C2)C1	ZINC000875493266	ED	On-Demand	Anodyne	EPHX2	16	46
COC(=O)C1=NO[C@@]2(CCN(C(=O)NC3Cc4ccccc4C3)C2)C1	ZINC000875493267	ED	On-Demand	Anodyne	EPHX2	16	46
COC(=O)C1(O)CN(C(=O)NC2CCC(O)(c3ccccc3)CC2)C1	ZINC000875493289	EC	On-Demand	Anodyne	OPRL1	15	40
O=C(NC1Cc2ccccc2C1)N1CCC(c2nccc(-c3cccnc3)n2)CC1	ZINC000875493293	GH	On-Demand	Anodyne	EPHX2	15	53
CN(Cc1ccc2cc[nH]c2c1)C(=O)NC1CCC(O)(c2ccccc2)CC1	ZINC000875493313	GI	On-Demand	Anodyne	KCNA3	17	40
CCC1(N(C)C)CCN(C(=O)NC2CCC(O)(c3ccccc3)CC2)CC1	ZINC000875493316	FG	On-Demand	Anodyne	OPRL1	21	45
CCC1(N(C)C)CCN(C(=O)NC2CCC(O)(c3ccccc3)CC2)CC1	ZINC000875493316	FG	On-Demand	Anodyne	SIGMAR1	16	40
CCC1(N(C)C)CCN(C(=O)NC2CCC(O)(c3ccccc3)CC2)CC1	ZINC000875493316	FG	On-Demand	Anodyne	EPHX2	30	42
O=C(NCCN1CC[C@H](O)C1)NC1CCC(O)(c2ccccc2)CC1	ZINC000875493343	ED	On-Demand	Anodyne	DRD4	16	42
O=C(NCCN1CC[C@H](O)C1)NC1CCC(O)(c2ccccc2)CC1	ZINC000875493343	ED	On-Demand	Anodyne	OPRL1	19	45
O=C(NCCN1CC[C@H](O)C1)NC1CCC(O)(c2ccccc2)CC1	ZINC000875493343	ED	On-Demand	Anodyne	CCR1	31	45
O=C(NCCN1CC[C@H](O)C1)NC1CCC(O)(c2ccccc2)CC1	ZINC000875493343	ED	On-Demand	Anodyne	PLD1	43	34
O=C(NCCN1CC[C@H](O)C1)NC1CCC(O)(c2ccccc2)CC1	ZINC000875493343	ED	On-Demand	Anodyne	PLD2	41	34
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCC(CCO)(CCO)CC1	ZINC000875493353	GE	On-Demand	Anodyne	EPHX2	29	41
Cc1cc(C(F)(F)F)nc(C(=O)N2CCCc3c2cccc3[N+](=O)[O-])n1	ZINC000875493359	FG	On-Demand	Bother	AVPR2	17	41
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875493396	GE	On-Demand	Anodyne	CCR2	16	43
O=C(NC1Cc2ccccc2C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875493399	EG	On-Demand	Anodyne	EPHX2	29	45
O=C(NC1Cc2ccccc2C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875493400	EG	On-Demand	Anodyne	EPHX2	29	45
CC(=O)C1CCN(C(=O)NC2CCC(O)(c3ccccc3)CC2)CC1	ZINC000875493407	EF	On-Demand	Anodyne	OPRL1	23	41
CC(=O)C1CCN(C(=O)NC2CCC(O)(c3ccccc3)CC2)CC1	ZINC000875493407	EF	On-Demand	Anodyne	SIGMAR1	15	41
CC(=O)C1CCN(C(=O)NC2CCC(O)(c3ccccc3)CC2)CC1	ZINC000875493407	EF	On-Demand	Anodyne	EPHX2	45	40
O=CN1CCCN(C(=O)NC2CCC(O)(c3ccccc3)CC2)CC1	ZINC000875493421	ED	On-Demand	Anodyne	EPHX2	25	40
O=C(NC1Cc2ccccc2C1)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875493426	EG	On-Demand	Anodyne	PREP	41	37
O=C(NC1Cc2ccccc2C1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875493427	EG	On-Demand	Anodyne	PREP	41	37
O=C(NC1Cc2ccccc2C1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875493428	EG	On-Demand	Anodyne	PREP	41	37
O=C(NC1Cc2ccccc2C1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875493429	EG	On-Demand	Anodyne	PREP	41	37
N#CCCN1CCN(C(=O)NC2CCC(O)(c3ccccc3)CC2)CC1	ZINC000875493430	FE	On-Demand	Mild	SIGMAR1	23	41
N#CCCN1CCN(C(=O)NC2CCC(O)(c3ccccc3)CC2)CC1	ZINC000875493430	FE	On-Demand	Mild	CCR1	47	39
CC(=O)c1cccc(COC(=O)C2CCN(C(C)C)CC2)c1	ZINC000875493491	DG	On-Demand	Anodyne	HRH3	17	40
N#C[C@H]1CCC[C@@H]1NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875493521	EF	On-Demand	Mild	SMO	33	40
N#C[C@H]1CCC[C@@H]1NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875493521	EF	On-Demand	Mild	ETHR	55	50
N#C[C@@H]1CCC[C@@H]1NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875493522	EF	On-Demand	Mild	SMO	33	40
N#C[C@@H]1CCC[C@@H]1NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875493522	EF	On-Demand	Mild	ETHR	55	50
N#C[C@H]1CCC[C@H]1NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875493523	EF	On-Demand	Mild	SMO	33	40
N#C[C@H]1CCC[C@H]1NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875493523	EF	On-Demand	Mild	ETHR	55	50
N#C[C@@H]1CCC[C@H]1NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875493524	EF	On-Demand	Mild	SMO	33	40
N#C[C@@H]1CCC[C@H]1NC(=O)N1CCC(c2nc(C3CCC3)no2)CC1	ZINC000875493524	EF	On-Demand	Mild	ETHR	55	50
COc1ccccc1[C@H]1CCCN(C(=O)NCCc2ccnn2C)CC1	ZINC000875493546	FF	On-Demand	Anodyne	DRD2	19	42
COc1ccccc1[C@@H]1CCCN(C(=O)NCCc2ccnn2C)CC1	ZINC000875493547	FF	On-Demand	Anodyne	DRD2	19	42
N#C[C@H]1CCC[C@@H]1NC(=O)NCc1cccc2ncccc12	ZINC000875493552	CF	On-Demand	Mild	CDK5	17	40
N#C[C@H]1CCC[C@H]1NC(=O)NCc1cccc2ncccc12	ZINC000875493553	CF	On-Demand	Mild	CDK5	17	40
N#C[C@@H]1CCC[C@H]1NC(=O)NCc1cccc2ncccc12	ZINC000875493554	CF	On-Demand	Mild	CDK5	17	40
N#C[C@@H]1CCC[C@@H]1NC(=O)NCc1cccc2ncccc12	ZINC000875493555	CF	On-Demand	Mild	CDK5	17	40
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CCC[C@@H]2C#N)CC1	ZINC000875493580	EH	On-Demand	Mild	EPHX2	18	45
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2CCC[C@@H]2C#N)CC1	ZINC000875493581	EH	On-Demand	Mild	EPHX2	18	45
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@H]2CCC[C@H]2C#N)CC1	ZINC000875493582	EH	On-Demand	Mild	EPHX2	18	45
COc1ccccc1[C@@H]1CCCN(C(=O)N[C@@H]2CCC[C@H]2C#N)CC1	ZINC000875493583	EH	On-Demand	Mild	EPHX2	18	45
O=C(NCCO)C1CCN(C(=O)NC2Cc3ccccc3C2)CC1	ZINC000875493602	EC	On-Demand	Anodyne	EPHX2	37	44
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCC(Cc2nccs2)CC1	ZINC000875493649	GH	On-Demand	Anodyne	GRIN2B	46	43
O=C(Nc1ccc(Br)c([N+](=O)[O-])c1)c1cnn(CC2CC2)c1	ZINC000875493656	FG	On-Demand	Bother	TAAR1	19	43
C[C@]1(C(F)(F)F)CCN(C(=O)NC2CCC(O)(c3ccccc3)CC2)C1	ZINC000875493657	FH	On-Demand	Anodyne	EPHX2	43	41
C[C@]1(C(F)(F)F)CCN(C(=O)NC2CCC(O)(c3ccccc3)CC2)C1	ZINC000875493657	FH	On-Demand	Anodyne	SFRP1	41	32
CONC(=O)C1CCN(C(=O)NC2CCC(O)(c3ccccc3)CC2)CC1	ZINC000875493663	GD	On-Demand	Anodyne	EPHX2	36	41
CN1CCN(C(=O)NC2CCC(O)(c3ccccc3)CC2)CCC1(C)C	ZINC000875493717	FF	On-Demand	Anodyne	EPHX2	26	41
N#C[C@H]1CCC[C@@H]1NC(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875493772	EE	On-Demand	Mild	SLC6A9	20	41
N#C[C@H]1CCC[C@H]1NC(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875493773	EE	On-Demand	Mild	SLC6A9	20	41
N#C[C@@H]1CCC[C@H]1NC(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875493774	EE	On-Demand	Mild	SLC6A9	20	41
N#C[C@@H]1CCC[C@@H]1NC(=O)N1CCN(c2ccc(F)cc2F)CC1	ZINC000875493775	EE	On-Demand	Mild	SLC6A9	20	41
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCC2(CCNC2=O)CC1	ZINC000875493821	FE	On-Demand	Anodyne	EPHX2	21	44
O=C(NC1CCC(O)(c2ccccc2)CC1)N1OC2CCC1CC2	ZINC000875493823	EG	On-Demand	Anodyne	OPRL1	22	44
O=C(NC1CCC(O)(c2ccccc2)CC1)N1OC2CCC1CC2	ZINC000875493823	EG	On-Demand	Anodyne	SIGMAR1	20	41
CCO[C@@H](C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1)C1CC1	ZINC000875493824	EG	On-Demand	Bother	TAAR1	19	46
CN1CC[C@H]2CN(C(=O)NC3CCC(O)(c4ccccc4)CC3)CC[C@@H]21	ZINC000875493831	FF	On-Demand	Anodyne	OPRL1	15	40
CN1CC[C@H]2CN(C(=O)NC3CCC(O)(c4ccccc4)CC3)CC[C@H]21	ZINC000875493833	FF	On-Demand	Anodyne	OPRL1	15	40
N#C[C@@H]1CCC[C@@H]1NC(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875493834	DF	On-Demand	Mild	OXTR	57	38
N#C[C@@H]1CCC[C@H]1NC(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875493841	DF	On-Demand	Mild	OXTR	57	38
N#C[C@@H]1CCC[C@@H]1NC(=O)N1CC[C@]2(CCc3ccccc32)C1	ZINC000875493843	DF	On-Demand	Mild	OXTR	57	38
N#C[C@@H]1CCC[C@H]1NC(=O)N1CC[C@@]2(CCc3ccccc32)C1	ZINC000875493860	DF	On-Demand	Mild	OXTR	57	38
Cn1nnnc1C1CCN(C(=O)NC2CCC(O)(c3ccccc3)CC2)CC1	ZINC000875493861	GD	On-Demand	Anodyne	EPHX2	23	41
Cn1nnnc1C1CCN(C(=O)NC2CCC(O)(c3ccccc3)CC2)CC1	ZINC000875493861	GD	On-Demand	Anodyne	SMO	17	40
CN1Cc2ccccc2[C@@H]1CNC(=O)C(=O)NCc1c(C(F)(F)F)cnn1C	ZINC000875493870	GD	On-Demand	Anodyne	P2RX7	15	41
CN1Cc2ccccc2[C@H]1CNC(=O)C(=O)NCc1c(C(F)(F)F)cnn1C	ZINC000875493871	GD	On-Demand	Anodyne	P2RX7	15	41
N#C[C@@H]1CCC[C@H]1NC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875493887	EE	On-Demand	Mild	CTSK	16	44
N#C[C@@H]1CCC[C@H]1NC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875493887	EE	On-Demand	Mild	CTSL	16	44
N#C[C@@H]1CCC[C@H]1NC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875493887	EE	On-Demand	Mild	PREP	18	41
N#C[C@@H]1CCC[C@@H]1NC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875493888	EE	On-Demand	Mild	CTSK	16	44
N#C[C@@H]1CCC[C@@H]1NC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875493888	EE	On-Demand	Mild	CTSL	16	44
N#C[C@@H]1CCC[C@@H]1NC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875493888	EE	On-Demand	Mild	PREP	18	41
N#C[C@H]1CCC[C@H]1NC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875493889	EE	On-Demand	Mild	CTSK	16	44
N#C[C@H]1CCC[C@H]1NC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875493889	EE	On-Demand	Mild	CTSL	16	44
N#C[C@H]1CCC[C@H]1NC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875493889	EE	On-Demand	Mild	PREP	18	41
N#C[C@H]1CCC[C@@H]1NC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875493890	EE	On-Demand	Mild	CTSK	16	44
N#C[C@H]1CCC[C@@H]1NC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875493890	EE	On-Demand	Mild	CTSL	16	44
N#C[C@H]1CCC[C@@H]1NC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2)C1	ZINC000875493890	EE	On-Demand	Mild	PREP	18	41
N#C[C@H]1CCC[C@H]1NC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875493935	EF	On-Demand	Mild	ROCK1	20	41
N#C[C@H]1CCC[C@@H]1NC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875493940	EF	On-Demand	Mild	ROCK1	20	41
N#C[C@@H]1CCC[C@H]1NC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875493941	EF	On-Demand	Mild	ROCK1	20	41
N#C[C@@H]1CCC[C@@H]1NC(=O)NCc1nc(-c2ccncc2)cs1	ZINC000875493942	EF	On-Demand	Mild	ROCK1	20	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1Cc2ccccc2C1	ZINC000875493973	DD	On-Demand	Anodyne	SLC6A4	27	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1Cc2ccccc2C1	ZINC000875493973	DD	On-Demand	Anodyne	SLC6A3	54	43
N#Cc1ccc(Cn2cc(NC(=O)NCCC[C@@H]3CCCCO3)cn2)cc1	ZINC000875493978	FG	On-Demand	Mild	CCR3	26	42
N#Cc1ccc(Cn2cc(NC(=O)NCCC[C@@H]3CCCCO3)cn2)cc1	ZINC000875493978	FG	On-Demand	Mild	ITK	23	46
N#Cc1ccc(Cn2cc(NC(=O)NCCC[C@@H]3CCCCO3)cn2)cc1	ZINC000875493978	FG	On-Demand	Mild	PANC	57	38
N#Cc1ccc(Cn2cc(NC(=O)NCCC[C@H]3CCCCO3)cn2)cc1	ZINC000875493979	FG	On-Demand	Mild	CCR3	26	42
N#Cc1ccc(Cn2cc(NC(=O)NCCC[C@H]3CCCCO3)cn2)cc1	ZINC000875493979	FG	On-Demand	Mild	ITK	23	46
N#Cc1ccc(Cn2cc(NC(=O)NCCC[C@H]3CCCCO3)cn2)cc1	ZINC000875493979	FG	On-Demand	Mild	PANC	57	38
CCO[C@@H](C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1)C1CCOCC1	ZINC000875493996	GG	On-Demand	Bother	TAAR1	18	43
COC(=O)N(C)NC(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000875494110	EC	On-Demand	Reactive	STAT6	48	33
CCc1noc(C)c1NC(=O)c1c(C)ccc([N+](=O)[O-])c1C	ZINC000875494115	DG	On-Demand	Bother	GSTM2	45	35
CCc1noc(C)c1NC(=O)c1sccc1CC#N	ZINC000875494132	CF	On-Demand	Mild	EDNRA	32	47
O=C(NCc1cnc(N2CCOCC2)c(F)c1)NCC1CCC2(CC1)CC2	ZINC000875494140	GF	On-Demand	Anodyne	STAT6	50	34
C[S@](=N)(=O)N1CCN(C(=O)NC2CCC(O)(c3ccccc3)CC2)CC1	ZINC000875494207	GD	On-Demand	Anodyne	EPHX2	34	41
O=C(NCC[C@H](O)C1CCCC1)NC1Cc2ccccc2C1	ZINC000875494240	DE	On-Demand	Anodyne	EPHX2	15	48
O=C(NCC[C@@H](O)C1CCCC1)NC1Cc2ccccc2C1	ZINC000875494241	DE	On-Demand	Anodyne	EPHX2	15	48
CC[C@@H](CC(F)(F)F)NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875494251	FH	On-Demand	Mild	ITK	16	49
CC[C@@H](CC(F)(F)F)NC(=O)Nc1cnn(Cc2ccc(C#N)cc2)c1	ZINC000875494251	FH	On-Demand	Mild	PANC	40	35
CC(=O)[C@@H]1CCCN(C(=O)NC2CCC(O)(c3ccccc3)CC2)C1	ZINC000875494279	EF	On-Demand	Anodyne	OPRL1	20	41
CC(=O)[C@@H]1CCCN(C(=O)NC2CCC(O)(c3ccccc3)CC2)C1	ZINC000875494279	EF	On-Demand	Anodyne	EPHX2	28	42
CC(=O)[C@H]1CCCN(C(=O)NC2CCC(O)(c3ccccc3)CC2)C1	ZINC000875494281	EF	On-Demand	Anodyne	OPRL1	20	41
CC(=O)[C@H]1CCCN(C(=O)NC2CCC(O)(c3ccccc3)CC2)C1	ZINC000875494281	EF	On-Demand	Anodyne	EPHX2	28	42
CN1CCN(C(=O)N[C@H](c2ccc(Cl)cc2)c2ccn(C)n2)CCC1(C)C	ZINC000875494311	GG	On-Demand	Anodyne	CCR1	43	38
CN1CCN(C(=O)N[C@@H](c2ccc(Cl)cc2)c2ccn(C)n2)CCC1(C)C	ZINC000875494312	GG	On-Demand	Anodyne	CCR1	43	38
COC1CC(C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)C1	ZINC000875494327	EF	On-Demand	Bother	TAAR1	18	47
Cn1nccc1CCNC(=O)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875494374	ED	On-Demand	Anodyne	FAAH	19	41
C#CC[C@@H](COC)NC(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000875494392	FC	On-Demand	Mild	STAT6	43	31
C#CC[C@H](COC)NC(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000875494393	FC	On-Demand	Mild	STAT6	43	31
O=C(NCc1cnc(N2CCOCC2)c(F)c1)N1Cc2cccc(O)c2C1	ZINC000875494439	FD	On-Demand	Clean	STAT6	46	34
O=C(NCc1cnc(N2CCOCC2)c(F)c1)N1Cc2cccc(O)c2C1	ZINC000875494439	FD	On-Demand	Clean	NAMPT	30	40
O=C(Nc1cccc(S(=O)(=O)Nc2ccccc2Cl)c1)c1ccc(-n2cccn2)nc1	ZINC000875494447	JH	On-Demand	Anodyne	GRM4	60	48
O=C(Nc1cccc(S(=O)(=O)Nc2ccccc2Cl)c1)c1ccc(-n2cccn2)nc1	ZINC000875494447	JH	On-Demand	Anodyne	MAPK10	19	40
O=C(Nc1cccc(S(=O)(=O)Nc2ccccc2Cl)c1)c1ccc(-n2cccn2)nc1	ZINC000875494447	JH	On-Demand	Anodyne	TYK2	42	35
O=C(Nc1cccc(S(=O)(=O)Nc2ccccc2Cl)c1)c1ccc(-n2cccn2)nc1	ZINC000875494447	JH	On-Demand	Anodyne	EPHB3	43	33
Cn1nccc1CCNC(=O)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875494500	ED	On-Demand	Anodyne	CTSV	42	42
Cn1nccc1CCNC(=O)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875494501	ED	On-Demand	Anodyne	CTSV	42	42
N#C[C@@H]1CCC[C@H]1NC(=O)NCc1ccc(O)c(Cl)c1	ZINC000875494612	CF	On-Demand	Mild	SSTR3	22	41
CN1CCCC[C@@H](N(C)C(=O)NC2CCC(O)(c3ccccc3)CC2)C1=O	ZINC000875494614	FE	On-Demand	Anodyne	OPRL1	24	44
CN1CCCC[C@H](N(C)C(=O)NC2CCC(O)(c3ccccc3)CC2)C1=O	ZINC000875494615	FE	On-Demand	Anodyne	OPRL1	24	44
CO[C@@H]1CC[C@@H](C)N(C(=O)NC2CCC(O)(c3ccccc3)CC2)C1	ZINC000875494622	EG	On-Demand	Anodyne	KCNA3	41	39
COCCN(CC1CCN(C)CC1)C(=O)NC1Cc2ccccc2C1	ZINC000875494625	EE	On-Demand	Anodyne	ADAM9	44	31
CCC[C@H](CNC(=O)C(=O)N(C)C[C@](C)(O)c1ccccc1)OCC	ZINC000875494626	FD	On-Demand	Anodyne	AMY2	53	30
CCC[C@@H](CNC(=O)C(=O)N(C)C[C@](C)(O)c1ccccc1)OCC	ZINC000875494627	FD	On-Demand	Anodyne	AMY2	53	30
CCC[C@@H](CNC(=O)C(=O)N(C)C[C@@](C)(O)c1ccccc1)OCC	ZINC000875494628	FD	On-Demand	Anodyne	AMY2	53	30
CCC[C@H](CNC(=O)C(=O)N(C)C[C@@](C)(O)c1ccccc1)OCC	ZINC000875494629	FD	On-Demand	Anodyne	AMY2	53	30
N#C[C@@H]1CCC[C@@H]1NC(=O)NCc1ccc(O)c(Cl)c1	ZINC000875494636	CF	On-Demand	Mild	SSTR3	22	41
N#C[C@H]1CCC[C@@H]1NC(=O)NCc1ccc(O)c(Cl)c1	ZINC000875494637	CF	On-Demand	Mild	SSTR3	22	41
N#C[C@H]1CCC[C@H]1NC(=O)NCc1ccc(O)c(Cl)c1	ZINC000875494638	CF	On-Demand	Mild	SSTR3	22	41
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CC=CC1	ZINC000875494643	CE	On-Demand	Anodyne	OPRL1	19	43
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CC=CC1	ZINC000875494643	CE	On-Demand	Anodyne	EPHX2	26	40
O=C(NC[C@H]1C[C@H](O)C1)NC1CCC(O)(c2ccccc2)CC1	ZINC000875494644	DD	On-Demand	Anodyne	EPHX2	19	42
CC(=O)NC[C@@H]1CCCCN1C(=O)NC1CCC(O)(c2ccccc2)CC1	ZINC000875494680	FF	On-Demand	Anodyne	FKBP1A	22	43
CC(=O)NC[C@@H]1CCCCN1C(=O)NC1CCC(O)(c2ccccc2)CC1	ZINC000875494680	FF	On-Demand	Anodyne	HCRTR1	16	40
O=C(NCc1cnc(N2CCOCC2)c(F)c1)NNc1cccc(F)c1Cl	ZINC000875494701	GF	On-Demand	Reactive	SCN10A	17	40
O=C(NCc1cnc(N2CCOCC2)c(F)c1)NNc1cccc(F)c1Cl	ZINC000875494701	GF	On-Demand	Reactive	STAT6	56	36
O=C(Nc1cccc(S(=O)(=O)Nc2ccc(Cl)cc2)c1)c1ccc(-n2cccn2)nc1	ZINC000875494714	JH	On-Demand	Anodyne	CPT1A	45	36
O=C(Nc1cccc(S(=O)(=O)Nc2ccc(Cl)cc2)c1)c1ccc(-n2cccn2)nc1	ZINC000875494714	JH	On-Demand	Anodyne	GRM4	46	41
CCc1noc(C)c1NC(=O)c1ccc(OC(F)(F)F)cc1C(F)(F)F	ZINC000875494715	GJ	On-Demand	Anodyne	SHH	40	39
CN1CCC(CNC(=O)N[C@H]2CCC[C@@H]2C#N)(c2ccccc2)CC1	ZINC000875494737	EF	On-Demand	Mild	KCNA3	50	40
CN1CCC(CNC(=O)N[C@@H]2CCC[C@H]2C#N)(c2ccccc2)CC1	ZINC000875494738	EF	On-Demand	Mild	KCNA3	50	40
CN1CCC(CNC(=O)N[C@@H]2CCC[C@@H]2C#N)(c2ccccc2)CC1	ZINC000875494739	EF	On-Demand	Mild	KCNA3	50	40
CN1CCC(CNC(=O)N[C@H]2CCC[C@H]2C#N)(c2ccccc2)CC1	ZINC000875494740	EF	On-Demand	Mild	KCNA3	50	40
COCCCn1cc(C(=O)Nc2ccc(Br)c([N+](=O)[O-])c2)cn1	ZINC000875494753	GF	On-Demand	Bother	TAAR1	21	48
CCC1(CNC(=O)N2CCC(N3CCN(C)CC3)CC2)CCCCC1	ZINC000875494760	FF	On-Demand	Anodyne	L3MBTL3	53	40
O=C(NCc1ccc(N2CCCS2(=O)=O)cc1)N1Cc2cccc(O)c2C1	ZINC000875494783	GE	On-Demand	Clean	NAMPT	23	44
C[C@@H](NC(=O)NC1CCC(O)(c2ccccc2)CC1)c1ccccc1O	ZINC000875494890	FH	On-Demand	Clean	OPRL1	16	40
C[C@H](NC(=O)NC1CCC(O)(c2ccccc2)CC1)c1ccccc1O	ZINC000875494891	FH	On-Demand	Clean	OPRL1	16	40
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCO[C@@H](C(F)F)CC1	ZINC000875494892	FF	On-Demand	Anodyne	SMO	20	44
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCO[C@H](C(F)F)CC1	ZINC000875494893	FF	On-Demand	Anodyne	SMO	20	44
O=C1CCN(C(=O)NC2CCC(O)(c3ccccc3)CC2)CCCCCCN1	ZINC000875494897	GF	On-Demand	Anodyne	EPHX2	20	40
CC(=O)N[C@H](CC(C)C)C(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1C	ZINC000875494912	GH	On-Demand	Anodyne	ANPEP	24	40
CC(=O)N[C@H](CC(C)C)C(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1C	ZINC000875494912	GH	On-Demand	Anodyne	PAPA1_CARPA	32	40
CC(=O)N[C@H](CC(C)C)C(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1C	ZINC000875494912	GH	On-Demand	Anodyne	CTSK	27	42
CC(=O)N[C@H](CC(C)C)C(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1C	ZINC000875494912	GH	On-Demand	Anodyne	CAPN1	33	46
CC(=O)N[C@H](CC(C)C)C(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1C	ZINC000875494912	GH	On-Demand	Anodyne	FPR1	57	42
O=C(Nc1ccccc1C(=O)NCCCN1CCCCCC1)c1cccs1	ZINC000875494964	GH	On-Demand	Anodyne	HTR1A	28	51
O=C(Nc1ccccc1C(=O)NCCCN1CCCCCC1)c1cccs1	ZINC000875494964	GH	On-Demand	Anodyne	DRD2	38	56
O=C(Nc1ccccc1C(=O)NCCCN1CCCCCC1)c1cccs1	ZINC000875494964	GH	On-Demand	Anodyne	DRD4	21	41
O=C(Nc1ccccc1C(=O)NCCCN1CCCCCC1)c1cccs1	ZINC000875494964	GH	On-Demand	Anodyne	ADRA1A	40	38
O=C(Nc1ccccc1C(=O)NCCCN1CCCCCC1)c1cccs1	ZINC000875494964	GH	On-Demand	Anodyne	DRD3	69	54
O=C(Nc1ccccc1C(=O)NCCCN1CCCCCC1)c1cccs1	ZINC000875494964	GH	On-Demand	Anodyne	HTR4	15	41
O=C(Nc1ccccc1C(=O)NCCCN1CCCCCC1)c1cccs1	ZINC000875494964	GH	On-Demand	Anodyne	CCR3	15	41
O=C(Nc1ccccc1C(=O)NCCCN1CCCCCC1)c1cccs1	ZINC000875494964	GH	On-Demand	Anodyne	CHRNA7	24	47
O=C(Nc1ccccc1C(=O)NCCCN1CCCCCC1)c1cccs1	ZINC000875494964	GH	On-Demand	Anodyne	NOS1	15	40
O=C(Nc1ccccc1C(=O)NCCCN1CCCCCC1)c1cccs1	ZINC000875494964	GH	On-Demand	Anodyne	HNMT	51	35
O=C(Nc1ccccc1C(=O)NCCCN1CCCCCC1)c1cccs1	ZINC000875494964	GH	On-Demand	Anodyne	POLR1A	26	41
O=C(NC1Cc2ccccc2C1)N1CCC(CO)(CO)CC1	ZINC000875494978	DC	On-Demand	Anodyne	EPHX2	25	52
C[C@@H](NC(=O)NC1CCC(O)(c2ccccc2)CC1)[C@H](O)C(F)(F)F	ZINC000875494992	FE	On-Demand	Anodyne	OPRL1	15	41
C[C@H](NC(=O)NC1CCC(O)(c2ccccc2)CC1)[C@H](O)C(F)(F)F	ZINC000875494994	FE	On-Demand	Anodyne	OPRL1	15	41
C[C@H](NC(=O)NC1CCC(O)(c2ccccc2)CC1)[C@@H](O)C(F)(F)F	ZINC000875494997	FE	On-Demand	Anodyne	OPRL1	15	41
C[C@@H](NC(=O)NC1CCC(O)(c2ccccc2)CC1)[C@@H](O)C(F)(F)F	ZINC000875494999	FE	On-Demand	Anodyne	OPRL1	15	41
CCc1noc(C)c1NC(=O)C1(CNC(=O)OCc2ccccc2)CCCC1	ZINC000875495063	GH	On-Demand	Anodyne	CAPNS1	42	32
CCc1noc(C)c1NC(=O)C1(CNC(=O)OCc2ccccc2)CCCC1	ZINC000875495063	GH	On-Demand	Anodyne	CAPN1	45	34
CCc1noc(C)c1NC(=O)C1(CNC(=O)OCc2ccccc2)CCCC1	ZINC000875495063	GH	On-Demand	Anodyne	CAPN2	78	34
CCc1noc(C)c1NC(=O)C1(CNC(=O)OCc2ccccc2)CCCC1	ZINC000875495063	GH	On-Demand	Anodyne	NPR	58	32
CCc1noc(C)c1NC(=O)C1(CNC(=O)OCc2ccccc2)CCCC1	ZINC000875495063	GH	On-Demand	Anodyne	SLC12A5	45	32
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@@H]21	ZINC000875495092	GE	On-Demand	Anodyne	F2	27	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@@H]21	ZINC000875495092	GE	On-Demand	Anodyne	PLG	25	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@@H]21	ZINC000875495092	GE	On-Demand	Anodyne	ACE	52	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@@H]21	ZINC000875495092	GE	On-Demand	Anodyne	CMA1	45	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@@H]21	ZINC000875495092	GE	On-Demand	Anodyne	CTRA_BOVIN	70	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@@H]21	ZINC000875495092	GE	On-Demand	Anodyne	CTSB	42	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@@H]21	ZINC000875495092	GE	On-Demand	Anodyne	PAPA1_CARPA	43	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@@H]21	ZINC000875495092	GE	On-Demand	Anodyne	TRY1_BOVIN	56	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@@H]21	ZINC000875495092	GE	On-Demand	Anodyne	CYSP_TRYCR	61	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@@H]21	ZINC000875495092	GE	On-Demand	Anodyne	CTSG	49	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@@H]21	ZINC000875495092	GE	On-Demand	Anodyne	CTSK	30	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@@H]21	ZINC000875495092	GE	On-Demand	Anodyne	CTSL	40	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@@H]21	ZINC000875495092	GE	On-Demand	Anodyne	TIMP3	76	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@@H]21	ZINC000875495092	GE	On-Demand	Anodyne	CAPNS1	78	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@@H]21	ZINC000875495092	GE	On-Demand	Anodyne	HLA-DRB1	57	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@@H]21	ZINC000875495092	GE	On-Demand	Anodyne	CELA2A	68	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@@H]21	ZINC000875495092	GE	On-Demand	Anodyne	REN	36	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@@H]21	ZINC000875495092	GE	On-Demand	Anodyne	CTSS	16	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@@H]21	ZINC000875495092	GE	On-Demand	Anodyne	CAPN1	86	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@@H]21	ZINC000875495092	GE	On-Demand	Anodyne	CAPN2	94	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@@H]21	ZINC000875495092	GE	On-Demand	Anodyne	ACE2	56	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@@H]21	ZINC000875495092	GE	On-Demand	Anodyne	KLK1	20	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@@H]21	ZINC000875495092	GE	On-Demand	Anodyne	BRCA1	62	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@H]21	ZINC000875495098	GE	On-Demand	Anodyne	F2	27	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@H]21	ZINC000875495098	GE	On-Demand	Anodyne	PLG	25	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@H]21	ZINC000875495098	GE	On-Demand	Anodyne	ACE	52	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@H]21	ZINC000875495098	GE	On-Demand	Anodyne	CMA1	45	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@H]21	ZINC000875495098	GE	On-Demand	Anodyne	CTRA_BOVIN	70	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@H]21	ZINC000875495098	GE	On-Demand	Anodyne	CTSB	42	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@H]21	ZINC000875495098	GE	On-Demand	Anodyne	PAPA1_CARPA	43	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@H]21	ZINC000875495098	GE	On-Demand	Anodyne	TRY1_BOVIN	56	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@H]21	ZINC000875495098	GE	On-Demand	Anodyne	CYSP_TRYCR	61	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@H]21	ZINC000875495098	GE	On-Demand	Anodyne	CTSG	49	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@H]21	ZINC000875495098	GE	On-Demand	Anodyne	CTSK	30	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@H]21	ZINC000875495098	GE	On-Demand	Anodyne	CTSL	40	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@H]21	ZINC000875495098	GE	On-Demand	Anodyne	TIMP3	76	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@H]21	ZINC000875495098	GE	On-Demand	Anodyne	CAPNS1	78	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@H]21	ZINC000875495098	GE	On-Demand	Anodyne	HLA-DRB1	57	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@H]21	ZINC000875495098	GE	On-Demand	Anodyne	CELA2A	68	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@H]21	ZINC000875495098	GE	On-Demand	Anodyne	REN	36	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@H]21	ZINC000875495098	GE	On-Demand	Anodyne	CTSS	16	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@H]21	ZINC000875495098	GE	On-Demand	Anodyne	CAPN1	86	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@H]21	ZINC000875495098	GE	On-Demand	Anodyne	CAPN2	94	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@H]21	ZINC000875495098	GE	On-Demand	Anodyne	ACE2	56	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@H]21	ZINC000875495098	GE	On-Demand	Anodyne	KLK1	20	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@@H](OC)C[C@H]21	ZINC000875495098	GE	On-Demand	Anodyne	BRCA1	62	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@H]21	ZINC000875495099	GE	On-Demand	Anodyne	F2	27	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@H]21	ZINC000875495099	GE	On-Demand	Anodyne	PLG	25	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@H]21	ZINC000875495099	GE	On-Demand	Anodyne	ACE	52	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@H]21	ZINC000875495099	GE	On-Demand	Anodyne	CMA1	45	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@H]21	ZINC000875495099	GE	On-Demand	Anodyne	CTRA_BOVIN	70	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@H]21	ZINC000875495099	GE	On-Demand	Anodyne	CTSB	42	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@H]21	ZINC000875495099	GE	On-Demand	Anodyne	PAPA1_CARPA	43	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@H]21	ZINC000875495099	GE	On-Demand	Anodyne	TRY1_BOVIN	56	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@H]21	ZINC000875495099	GE	On-Demand	Anodyne	CYSP_TRYCR	61	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@H]21	ZINC000875495099	GE	On-Demand	Anodyne	CTSG	49	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@H]21	ZINC000875495099	GE	On-Demand	Anodyne	CTSK	30	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@H]21	ZINC000875495099	GE	On-Demand	Anodyne	CTSL	40	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@H]21	ZINC000875495099	GE	On-Demand	Anodyne	TIMP3	76	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@H]21	ZINC000875495099	GE	On-Demand	Anodyne	CAPNS1	78	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@H]21	ZINC000875495099	GE	On-Demand	Anodyne	HLA-DRB1	57	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@H]21	ZINC000875495099	GE	On-Demand	Anodyne	CELA2A	68	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@H]21	ZINC000875495099	GE	On-Demand	Anodyne	REN	36	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@H]21	ZINC000875495099	GE	On-Demand	Anodyne	CTSS	16	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@H]21	ZINC000875495099	GE	On-Demand	Anodyne	CAPN1	86	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@H]21	ZINC000875495099	GE	On-Demand	Anodyne	CAPN2	94	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@H]21	ZINC000875495099	GE	On-Demand	Anodyne	ACE2	56	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@H]21	ZINC000875495099	GE	On-Demand	Anodyne	KLK1	20	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@H]21	ZINC000875495099	GE	On-Demand	Anodyne	BRCA1	62	33
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@@H]21	ZINC000875495101	GE	On-Demand	Anodyne	F2	27	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@@H]21	ZINC000875495101	GE	On-Demand	Anodyne	PLG	25	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@@H]21	ZINC000875495101	GE	On-Demand	Anodyne	ACE	52	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@@H]21	ZINC000875495101	GE	On-Demand	Anodyne	CMA1	45	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@@H]21	ZINC000875495101	GE	On-Demand	Anodyne	CTRA_BOVIN	70	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@@H]21	ZINC000875495101	GE	On-Demand	Anodyne	CTSB	42	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@@H]21	ZINC000875495101	GE	On-Demand	Anodyne	PAPA1_CARPA	43	34
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@@H]21	ZINC000875495101	GE	On-Demand	Anodyne	TRY1_BOVIN	56	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@@H]21	ZINC000875495101	GE	On-Demand	Anodyne	CYSP_TRYCR	61	42
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@@H]21	ZINC000875495101	GE	On-Demand	Anodyne	CTSG	49	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@@H]21	ZINC000875495101	GE	On-Demand	Anodyne	CTSK	30	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@@H]21	ZINC000875495101	GE	On-Demand	Anodyne	CTSL	40	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@@H]21	ZINC000875495101	GE	On-Demand	Anodyne	TIMP3	76	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@@H]21	ZINC000875495101	GE	On-Demand	Anodyne	CAPNS1	78	35
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@@H]21	ZINC000875495101	GE	On-Demand	Anodyne	HLA-DRB1	57	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@@H]21	ZINC000875495101	GE	On-Demand	Anodyne	CELA2A	68	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@@H]21	ZINC000875495101	GE	On-Demand	Anodyne	REN	36	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@@H]21	ZINC000875495101	GE	On-Demand	Anodyne	CTSS	16	44
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@@H]21	ZINC000875495101	GE	On-Demand	Anodyne	CAPN1	86	39
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@@H]21	ZINC000875495101	GE	On-Demand	Anodyne	CAPN2	94	38
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@@H]21	ZINC000875495101	GE	On-Demand	Anodyne	ACE2	56	37
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@@H]21	ZINC000875495101	GE	On-Demand	Anodyne	KLK1	20	40
CCOC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H]2CC[C@H](OC)C[C@@H]21	ZINC000875495101	GE	On-Demand	Anodyne	BRCA1	62	33
O=C(NCc1cnc(N2CCOCC2)c(F)c1)N1C[C@H]2CC=CC[C@H]2C1	ZINC000875495104	FE	On-Demand	Anodyne	STAT6	44	34
Cn1nccc1CCNC(=O)N1CCC[C@@]1(C)Cc1ccc(F)c(F)c1	ZINC000875495142	FG	On-Demand	Anodyne	ABCC1	40	33
Cn1nccc1CCNC(=O)N1CCC[C@]1(C)Cc1ccc(F)c(F)c1	ZINC000875495143	FG	On-Demand	Anodyne	ABCC1	40	33
CCc1noc(C)c1NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875495146	FH	On-Demand	Anodyne	KLK3	76	37
CCc1noc(C)c1NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875495146	FH	On-Demand	Anodyne	CTSB	65	40
CCc1noc(C)c1NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875495146	FH	On-Demand	Anodyne	PAPA1_CARPA	74	37
CCc1noc(C)c1NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875495146	FH	On-Demand	Anodyne	CYSP_TRYCR	54	41
CCc1noc(C)c1NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875495146	FH	On-Demand	Anodyne	CTSK	37	42
CCc1noc(C)c1NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875495146	FH	On-Demand	Anodyne	CTSL	43	40
CCc1noc(C)c1NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875495146	FH	On-Demand	Anodyne	CAPNS1	63	36
CCc1noc(C)c1NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875495146	FH	On-Demand	Anodyne	CTSS	18	41
CCc1noc(C)c1NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875495146	FH	On-Demand	Anodyne	CAPN1	77	52
CCc1noc(C)c1NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875495146	FH	On-Demand	Anodyne	CAPN2	118	39
CCc1noc(C)c1NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875495146	FH	On-Demand	Anodyne	TPSAB1	44	34
CCc1noc(C)c1NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875495146	FH	On-Demand	Anodyne	NPR	65	39
CCc1noc(C)c1NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875495146	FH	On-Demand	Anodyne	PSMB5	42	38
CCc1noc(C)c1NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875495148	FH	On-Demand	Anodyne	KLK3	76	37
CCc1noc(C)c1NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875495148	FH	On-Demand	Anodyne	CTSB	65	40
CCc1noc(C)c1NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875495148	FH	On-Demand	Anodyne	PAPA1_CARPA	74	37
CCc1noc(C)c1NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875495148	FH	On-Demand	Anodyne	CYSP_TRYCR	54	41
CCc1noc(C)c1NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875495148	FH	On-Demand	Anodyne	CTSK	37	42
CCc1noc(C)c1NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875495148	FH	On-Demand	Anodyne	CTSL	43	40
CCc1noc(C)c1NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875495148	FH	On-Demand	Anodyne	CAPNS1	63	36
CCc1noc(C)c1NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875495148	FH	On-Demand	Anodyne	CTSS	18	41
CCc1noc(C)c1NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875495148	FH	On-Demand	Anodyne	CAPN1	77	52
CCc1noc(C)c1NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875495148	FH	On-Demand	Anodyne	CAPN2	118	39
CCc1noc(C)c1NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875495148	FH	On-Demand	Anodyne	TPSAB1	44	34
CCc1noc(C)c1NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875495148	FH	On-Demand	Anodyne	NPR	65	39
CCc1noc(C)c1NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)(C)C	ZINC000875495148	FH	On-Demand	Anodyne	PSMB5	42	38
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCC(O)(c2ccccc2)CC1	ZINC000875495194	FF	On-Demand	Anodyne	SLC6A4	21	42
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NC1CCC(O)(c2ccccc2)CC1	ZINC000875495194	FF	On-Demand	Anodyne	SLC6A3	43	44
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875495212	FD	On-Demand	Anodyne	OPRL1	19	42
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCC(CO)(CO)CC1	ZINC000875495212	FD	On-Demand	Anodyne	EPHX2	33	46
O=C(N[C@@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NC2Cc3ccccc3C2)C1	ZINC000875495239	GD	On-Demand	Anodyne	EPHX2	29	42
O=C(N[C@H]1CCC[C@H](O)C1)[C@@H]1CCCN(C(=O)NC2Cc3ccccc3C2)C1	ZINC000875495241	GD	On-Demand	Anodyne	EPHX2	29	42
O=C(N[C@@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NC2Cc3ccccc3C2)C1	ZINC000875495243	GD	On-Demand	Anodyne	EPHX2	29	42
O=C(N[C@H]1CCC[C@@H](O)C1)[C@@H]1CCCN(C(=O)NC2Cc3ccccc3C2)C1	ZINC000875495245	GD	On-Demand	Anodyne	EPHX2	29	42
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCC(CCF)CC1	ZINC000875495266	EH	On-Demand	Anodyne	OPRL1	20	42
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCC(CCF)CC1	ZINC000875495266	EH	On-Demand	Anodyne	GRIN2B	37	46
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCC(CCF)CC1	ZINC000875495266	EH	On-Demand	Anodyne	EPHX2	46	40
O=C(NC1Cc2ccccc2C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875495466	EF	On-Demand	Anodyne	EPHX2	25	43
O=C(NC1Cc2ccccc2C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875495467	EF	On-Demand	Anodyne	EPHX2	25	43
O=C(NC1Cc2ccccc2C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875495479	EF	On-Demand	Anodyne	EPHX2	20	47
O=C(NC1Cc2ccccc2C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875495482	EF	On-Demand	Anodyne	EPHX2	20	47
CCC1(CNC(=O)N2CCO[C@H](c3noc(C4CC4)n3)C2)CCCCC1	ZINC000875495485	FG	On-Demand	Anodyne	SMO	37	45
CCC1(CNC(=O)N2CCO[C@H](c3noc(C4CC4)n3)C2)CCCCC1	ZINC000875495485	FG	On-Demand	Anodyne	ETHR	41	37
CCC1(CNC(=O)N2CCO[C@@H](c3noc(C4CC4)n3)C2)CCCCC1	ZINC000875495488	FG	On-Demand	Anodyne	SMO	37	45
CCC1(CNC(=O)N2CCO[C@@H](c3noc(C4CC4)n3)C2)CCCCC1	ZINC000875495488	FG	On-Demand	Anodyne	ETHR	41	37
O=C(NCC[C@@H](O)C1CCCC1)NC1CCC(O)(c2ccccc2)CC1	ZINC000875495491	FG	On-Demand	Anodyne	EPHX2	18	51
O=C(NCC[C@H](O)C1CCCC1)NC1CCC(O)(c2ccccc2)CC1	ZINC000875495494	FG	On-Demand	Anodyne	EPHX2	18	51
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1	ZINC000875495572	FE	On-Demand	Bother	LGMN	57	35
CC(=O)N1CCC[C@@H]1C(=O)Nc1ccc(Br)c([N+](=O)[O-])c1	ZINC000875495572	FE	On-Demand	Bother	XIAP	21	41
CN1CCN(C2CCN(C(=O)N[C@@H]3CCC[C@@H]3C#N)CC2)CC1	ZINC000875495660	DD	On-Demand	Mild	L3MBTL3	40	40
CN1CCN(C2CCN(C(=O)N[C@@H]3CCC[C@H]3C#N)CC2)CC1	ZINC000875495663	DD	On-Demand	Mild	L3MBTL3	40	40
CN1CCN(C2CCN(C(=O)N[C@H]3CCC[C@H]3C#N)CC2)CC1	ZINC000875495664	DD	On-Demand	Mild	L3MBTL3	40	40
CN1CCN(C2CCN(C(=O)N[C@H]3CCC[C@@H]3C#N)CC2)CC1	ZINC000875495665	DD	On-Demand	Mild	L3MBTL3	40	40
N#C[C@@H]1CCC[C@H]1NC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875495689	DE	On-Demand	Mild	EPHX2	25	50
N#C[C@@H]1CCC[C@@H]1NC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875495690	DE	On-Demand	Mild	EPHX2	25	50
N#C[C@@H]1CCC[C@H]1NC(=O)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875495691	DE	On-Demand	Mild	EPHX2	25	50
N#C[C@@H]1CCC[C@@H]1NC(=O)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875495692	DE	On-Demand	Mild	EPHX2	25	50
CCc1noc(C)c1NC(=O)[C@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875495709	GF	On-Demand	Anodyne	Q9NAW4_PLAFA	26	40
CCc1noc(C)c1NC(=O)[C@@H]1C[C@@H](OC)CN1C(=O)OCc1ccccc1	ZINC000875495710	GF	On-Demand	Anodyne	Q9NAW4_PLAFA	26	40
O=CN1CCCN(C(=O)NCc2cccc(N3CCCS3(=O)=O)c2)CC1	ZINC000875495760	GC	On-Demand	Anodyne	CDK1	17	42
CN1CC[C@H]2CN(C(=O)NCc3cnc(N4CCOCC4)c(F)c3)CC[C@H]21	ZINC000875495774	GD	On-Demand	Anodyne	STAT6	44	33
CN1CC[C@H]2CN(C(=O)NCc3cnc(N4CCOCC4)c(F)c3)CC[C@@H]21	ZINC000875495776	GD	On-Demand	Anodyne	STAT6	44	33
O=C(NCc1cnc(N2CCOCC2)c(F)c1)NC[C@@H]1CCC12CCOCC2	ZINC000875495803	GE	On-Demand	Anodyne	STAT6	45	34
O=C(NCc1cnc(N2CCOCC2)c(F)c1)NC[C@H]1CCC12CCOCC2	ZINC000875495806	GE	On-Demand	Anodyne	STAT6	45	34
CC(C)[C@H]1CCc2ccccc2[C@@H]1NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875495835	FG	On-Demand	Anodyne	GHRHR	53	32
CC(C)[C@H]1CCc2ccccc2[C@@H]1NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875495835	FG	On-Demand	Anodyne	CALCRL	18	46
CC(C)[C@H]1CCc2ccccc2[C@H]1NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875495836	FG	On-Demand	Anodyne	GHRHR	53	32
CC(C)[C@H]1CCc2ccccc2[C@H]1NC(=O)N1CCC2(CCNC2=O)CC1	ZINC000875495836	FG	On-Demand	Anodyne	CALCRL	18	46
CCC1(CC)CCCN1C(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000875495839	GG	On-Demand	Anodyne	CDK1	16	41
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875495853	GD	On-Demand	Anodyne	DRD4	17	45
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875495854	GD	On-Demand	Anodyne	DRD4	17	45
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875495855	GD	On-Demand	Anodyne	DRD4	17	45
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875495861	GD	On-Demand	Anodyne	DRD4	17	45
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000875495865	FD	On-Demand	Anodyne	CDK1	17	40
CCC1(CNC(=O)NNC(=O)c2ccc(=O)n(C)c2)CCCCC1	ZINC000875495898	ED	On-Demand	Reactive	HCN1	68	38
CCC1(CNC(=O)NNC(=O)c2ccc(=O)n(C)c2)CCCCC1	ZINC000875495898	ED	On-Demand	Reactive	HCN4	55	36
N#C[C@H]1CCC[C@@H]1NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875495920	FF	On-Demand	Mild	CTSK	26	58
N#C[C@H]1CCC[C@@H]1NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875495920	FF	On-Demand	Mild	CTSL	32	58
N#C[C@H]1CCC[C@@H]1NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875495920	FF	On-Demand	Mild	PREP	31	48
N#C[C@H]1CCC[C@@H]1NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875495920	FF	On-Demand	Mild	TGM2	22	43
N#C[C@H]1CCC[C@@H]1NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875495920	FF	On-Demand	Mild	F13A1	23	43
N#C[C@@H]1CCC[C@H]1NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875495921	FF	On-Demand	Mild	CTSK	26	58
N#C[C@@H]1CCC[C@H]1NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875495921	FF	On-Demand	Mild	CTSL	32	58
N#C[C@@H]1CCC[C@H]1NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875495921	FF	On-Demand	Mild	PREP	31	48
N#C[C@@H]1CCC[C@H]1NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875495921	FF	On-Demand	Mild	TGM2	22	43
N#C[C@@H]1CCC[C@H]1NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875495921	FF	On-Demand	Mild	F13A1	23	43
N#C[C@H]1CCC[C@H]1NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875495922	FF	On-Demand	Mild	CTSK	26	58
N#C[C@H]1CCC[C@H]1NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875495922	FF	On-Demand	Mild	CTSL	32	58
N#C[C@H]1CCC[C@H]1NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875495922	FF	On-Demand	Mild	PREP	31	48
N#C[C@H]1CCC[C@H]1NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875495922	FF	On-Demand	Mild	TGM2	22	43
N#C[C@H]1CCC[C@H]1NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875495922	FF	On-Demand	Mild	F13A1	23	43
N#C[C@@H]1CCC[C@@H]1NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875495923	FF	On-Demand	Mild	CTSK	26	58
N#C[C@@H]1CCC[C@@H]1NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875495923	FF	On-Demand	Mild	CTSL	32	58
N#C[C@@H]1CCC[C@@H]1NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875495923	FF	On-Demand	Mild	PREP	31	48
N#C[C@@H]1CCC[C@@H]1NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875495923	FF	On-Demand	Mild	TGM2	22	43
N#C[C@@H]1CCC[C@@H]1NC(=O)N1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000875495923	FF	On-Demand	Mild	F13A1	23	43
C[C@@H](NC(=O)NCCc1ccnn1C)c1nc2cc(Cl)c(Cl)cc2[nH]1	ZINC000875495938	GG	On-Demand	Anodyne	PRCP	34	51
CCC(CC)(CNC(=O)NN(C)C(=O)OC)c1ccc(OC)c(OC)c1	ZINC000875495950	FF	On-Demand	Reactive	MT-ND1	24	41
Cn1nccc1CCNC(=O)NCCC1(O)CCN(c2ccccc2)CC1	ZINC000875495996	FD	On-Demand	Anodyne	UTS2R	15	41
COc1ccccc1CONC(=O)C(=O)NCc1c(C(F)(F)F)cnn1C	ZINC000875496037	GD	On-Demand	Anodyne	P2RX7	17	43
N#Cc1ccc(Cn2cc(NC(=O)NCCOCC3CCC3)cn2)cc1	ZINC000875496124	FF	On-Demand	Mild	CCR3	25	44
N#Cc1ccc(Cn2cc(NC(=O)NCCOCC3CCC3)cn2)cc1	ZINC000875496124	FF	On-Demand	Mild	ITK	18	48
N#Cc1ccc(Cn2cc(NC(=O)NCCOCC3CCC3)cn2)cc1	ZINC000875496124	FF	On-Demand	Mild	PANC	54	36
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000875496126	EE	On-Demand	Anodyne	SIGMAR1	19	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000875496127	EE	On-Demand	Anodyne	SIGMAR1	19	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000875496129	EE	On-Demand	Anodyne	SIGMAR1	19	40
CC[C@H](C[C@H](C)O)NC(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000875496130	EE	On-Demand	Anodyne	SIGMAR1	19	40
O=C(NCCOCC1CCC1)NC1([C@@H]2CCCCO2)CCC1	ZINC000875496131	DF	On-Demand	Anodyne	SPHK1	15	43
O=C(NCCOCC1CCC1)NC1([C@H]2CCCCO2)CCC1	ZINC000875496133	DF	On-Demand	Anodyne	SPHK1	15	43
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccnn1C	ZINC000875496143	DC	On-Demand	Anodyne	SLC6A3	49	37
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCCc1ccnn1C	ZINC000875496144	DC	On-Demand	Anodyne	SLC6A3	49	37
N#C[C@H]1CCC[C@@H]1NC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875496145	DF	On-Demand	Mild	EPHX2	28	48
N#C[C@@H]1CCC[C@@H]1NC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875496146	DF	On-Demand	Mild	EPHX2	28	48
N#C[C@H]1CCC[C@H]1NC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875496147	DF	On-Demand	Mild	EPHX2	28	48
N#C[C@@H]1CCC[C@H]1NC(=O)N1CC[C@H](Oc2ccc(F)cc2)C1	ZINC000875496148	DF	On-Demand	Mild	EPHX2	28	48
O=C(NCc1cnc(N2CCOCC2)c(F)c1)NCc1ccc(O)c(Cl)c1	ZINC000875496209	GE	On-Demand	Anodyne	SCN10A	17	41
O=C(NCc1cnc(N2CCOCC2)c(F)c1)NCc1ccc(O)c(Cl)c1	ZINC000875496209	GE	On-Demand	Anodyne	CXCR3	15	42
O=C(NCc1cnc(N2CCOCC2)c(F)c1)NCc1ccc(O)c(Cl)c1	ZINC000875496209	GE	On-Demand	Anodyne	STAT6	51	35
COC(=O)N(C)NC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000875496216	DD	On-Demand	Reactive	DRD4	26	54
COC(=O)N(C)NC(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000875496217	DD	On-Demand	Reactive	DRD4	26	54
COC(=O)N(C)NC(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000875496218	DD	On-Demand	Reactive	DRD4	26	54
COC(=O)N(C)NC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000875496219	DD	On-Demand	Reactive	DRD4	26	54
O=C(NCc1cnc(N2CCOCC2)c(F)c1)NC[C@H]1C[C@H](O)C1	ZINC000875496221	EC	On-Demand	Anodyne	STAT6	46	34
O=C(NCCOCC1CCC1)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000875496240	EE	On-Demand	Anodyne	ADRB1	26	42
O=C(NCCOCC1CCC1)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000875496241	EE	On-Demand	Anodyne	ADRB1	26	42
N#C[C@H]1CCC[C@H]1NC(=O)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875496292	DG	On-Demand	Mild	EPHX2	21	43
N#C[C@H]1CCC[C@@H]1NC(=O)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875496293	DG	On-Demand	Mild	EPHX2	21	43
N#C[C@@H]1CCC[C@H]1NC(=O)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875496294	DG	On-Demand	Mild	EPHX2	21	43
N#C[C@@H]1CCC[C@@H]1NC(=O)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1	ZINC000875496295	DG	On-Demand	Mild	EPHX2	21	43
N#C[C@@H]1CCC[C@@H]1NC(=O)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875496342	DF	On-Demand	Mild	DPP4	22	41
N#C[C@@H]1CCC[C@@H]1NC(=O)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875496343	DF	On-Demand	Mild	DPP4	22	41
N#C[C@@H]1CCC[C@@H]1NC(=O)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875496344	DF	On-Demand	Mild	DPP4	22	41
N#C[C@@H]1CCC[C@@H]1NC(=O)N1CCC[C@H]1[C@@H](O)c1ccccc1	ZINC000875496345	DF	On-Demand	Mild	DPP4	22	41
CCC[C@H](CC)C(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1N1CCOCC1	ZINC000875496346	GF	On-Demand	Anodyne	KCNQ2	45	37
CCC[C@@H](CC)C(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1N1CCOCC1	ZINC000875496347	GF	On-Demand	Anodyne	KCNQ2	45	37
CC(=O)C1CCN(C(=O)NCc2cnc(N3CCOCC3)c(F)c2)CC1	ZINC000875496383	FD	On-Demand	Anodyne	STAT6	44	33
COCC1CC(NC(=O)NCc2cnc(N3CCOCC3)c(F)c2)C1	ZINC000875496385	FD	On-Demand	Anodyne	STAT6	43	31
CC(=O)C1CCN(C(=O)N[C@H]2c3ccccc3CCC[C@H]2C)CC1	ZINC000875496429	EH	On-Demand	Anodyne	EPHX2	15	40
CC(=O)C1CCN(C(=O)N[C@H]2c3ccccc3CCC[C@@H]2C)CC1	ZINC000875496430	EH	On-Demand	Anodyne	EPHX2	15	40
CC(=O)C1CCN(C(=O)N[C@@H]2c3ccccc3CCC[C@H]2C)CC1	ZINC000875496431	EH	On-Demand	Anodyne	EPHX2	15	40
CC(=O)C1CCN(C(=O)N[C@@H]2c3ccccc3CCC[C@@H]2C)CC1	ZINC000875496432	EH	On-Demand	Anodyne	EPHX2	15	40
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CCCN(C=O)CC1	ZINC000875496438	ED	On-Demand	Anodyne	DRD4	26	47
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CCCN(C=O)CC1	ZINC000875496439	ED	On-Demand	Anodyne	DRD4	26	47
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CCCN(C=O)CC1	ZINC000875496440	ED	On-Demand	Anodyne	DRD4	26	47
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CCCN(C=O)CC1	ZINC000875496441	ED	On-Demand	Anodyne	DRD4	26	47
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496473	FD	On-Demand	Anodyne	CHRM2	18	44
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496473	FD	On-Demand	Anodyne	CHRM1	15	44
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496473	FD	On-Demand	Anodyne	DRD2	15	52
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496473	FD	On-Demand	Anodyne	DRD4	42	52
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496473	FD	On-Demand	Anodyne	ACHE	38	42
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496473	FD	On-Demand	Anodyne	CHRM3	26	44
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496473	FD	On-Demand	Anodyne	SIGMAR1	39	48
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496473	FD	On-Demand	Anodyne	CCR3	32	45
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496473	FD	On-Demand	Anodyne	CCR2	15	42
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496473	FD	On-Demand	Anodyne	EPHX2	15	44
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496473	FD	On-Demand	Anodyne	MCHR1	26	46
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496474	FD	On-Demand	Anodyne	CHRM2	18	44
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496474	FD	On-Demand	Anodyne	CHRM1	15	44
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496474	FD	On-Demand	Anodyne	DRD2	15	52
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496474	FD	On-Demand	Anodyne	DRD4	42	52
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496474	FD	On-Demand	Anodyne	ACHE	38	42
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496474	FD	On-Demand	Anodyne	CHRM3	26	44
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496474	FD	On-Demand	Anodyne	SIGMAR1	39	48
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496474	FD	On-Demand	Anodyne	CCR3	32	45
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496474	FD	On-Demand	Anodyne	CCR2	15	42
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496474	FD	On-Demand	Anodyne	EPHX2	15	44
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496474	FD	On-Demand	Anodyne	MCHR1	26	46
N#C[C@@H]1CCC[C@H]1NC(=O)N1CCC[C@@](F)(c2ccccc2)C1	ZINC000875496529	DG	On-Demand	Mild	EPHX2	24	49
N#C[C@@H]1CCC[C@@H]1NC(=O)N1CCC[C@](F)(c2ccccc2)C1	ZINC000875496530	DG	On-Demand	Mild	EPHX2	24	49
N#C[C@@H]1CCC[C@H]1NC(=O)N1CCC[C@](F)(c2ccccc2)C1	ZINC000875496531	DG	On-Demand	Mild	EPHX2	24	49
N#C[C@@H]1CCC[C@@H]1NC(=O)N1CCC[C@@](F)(c2ccccc2)C1	ZINC000875496532	DG	On-Demand	Mild	EPHX2	24	49
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496575	FD	On-Demand	Anodyne	CHRM2	18	44
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496575	FD	On-Demand	Anodyne	CHRM1	15	44
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496575	FD	On-Demand	Anodyne	DRD2	15	52
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496575	FD	On-Demand	Anodyne	DRD4	42	52
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496575	FD	On-Demand	Anodyne	ACHE	38	42
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496575	FD	On-Demand	Anodyne	CHRM3	26	44
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496575	FD	On-Demand	Anodyne	SIGMAR1	39	48
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496575	FD	On-Demand	Anodyne	CCR3	32	45
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496575	FD	On-Demand	Anodyne	CCR2	15	42
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496575	FD	On-Demand	Anodyne	EPHX2	15	44
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496575	FD	On-Demand	Anodyne	MCHR1	26	46
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496576	FD	On-Demand	Anodyne	CHRM2	18	44
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496576	FD	On-Demand	Anodyne	CHRM1	15	44
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496576	FD	On-Demand	Anodyne	DRD2	15	52
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496576	FD	On-Demand	Anodyne	DRD4	42	52
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496576	FD	On-Demand	Anodyne	ACHE	38	42
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496576	FD	On-Demand	Anodyne	CHRM3	26	44
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496576	FD	On-Demand	Anodyne	SIGMAR1	39	48
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496576	FD	On-Demand	Anodyne	CCR3	32	45
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496576	FD	On-Demand	Anodyne	CCR2	15	42
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496576	FD	On-Demand	Anodyne	EPHX2	15	44
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@H]1CCN(CC(C)(C)O)C1	ZINC000875496576	FD	On-Demand	Anodyne	MCHR1	26	46
O=CN1CCCN(C(=O)NCc2cnc(N3CCOCC3)c(F)c2)CC1	ZINC000875496578	FC	On-Demand	Anodyne	STAT6	44	33
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)NC[C@H]1C[C@H](O)C1	ZINC000875496605	FC	On-Demand	Anodyne	CDK1	17	42
CCc1noc(C)c1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875496773	EF	On-Demand	Anodyne	CTSK	18	49
CCc1noc(C)c1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875496773	EF	On-Demand	Anodyne	CAPN1	41	33
CCc1noc(C)c1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875496773	EF	On-Demand	Anodyne	CAPN2	66	33
CCc1noc(C)c1NC(=O)C1(NC(=O)OCc2ccccc2)CC1	ZINC000875496773	EF	On-Demand	Anodyne	SLC12A5	57	33
COC(=O)[C@@]12C[C@@H](NC(=O)NCCCC(=O)OC(C)C)C[C@@H]1C2	ZINC000875496844	ED	On-Demand	Anodyne	EPHX2	20	50
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875496845	GD	On-Demand	Anodyne	DRD4	28	44
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875496845	GD	On-Demand	Anodyne	SIGMAR1	27	52
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875496845	GD	On-Demand	Anodyne	MLNR	46	36
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875496845	GD	On-Demand	Anodyne	CACNA1G	39	43
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875496846	GD	On-Demand	Anodyne	DRD4	28	44
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875496846	GD	On-Demand	Anodyne	SIGMAR1	27	52
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875496846	GD	On-Demand	Anodyne	MLNR	46	36
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875496846	GD	On-Demand	Anodyne	CACNA1G	39	43
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875496847	GD	On-Demand	Anodyne	DRD4	28	44
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875496847	GD	On-Demand	Anodyne	SIGMAR1	27	52
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875496847	GD	On-Demand	Anodyne	MLNR	46	36
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875496847	GD	On-Demand	Anodyne	CACNA1G	39	43
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875496848	GD	On-Demand	Anodyne	DRD4	28	44
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875496848	GD	On-Demand	Anodyne	SIGMAR1	27	52
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875496848	GD	On-Demand	Anodyne	MLNR	46	36
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875496848	GD	On-Demand	Anodyne	CACNA1G	39	43
CCn1ncc(CNC(=O)NCc2cnc(N3CCOCC3)c(F)c2)n1	ZINC000875496880	FC	On-Demand	Anodyne	STAT6	43	32
O=C(NCc1ncc(-c2ccccc2)cn1)N1CCC[C@@H]1[C@H](O)c1ccccc1	ZINC000875496885	GH	On-Demand	Anodyne	PREP	43	41
O=C(NCc1ncc(-c2ccccc2)cn1)N1CCC[C@@H]1[C@@H](O)c1ccccc1	ZINC000875496886	GH	On-Demand	Anodyne	PREP	43	41
O=C(NCc1ncc(-c2ccccc2)cn1)N1CCC[C@H]1[C@H](O)c1ccccc1	ZINC000875496887	GH	On-Demand	Anodyne	PREP	43	41
CN1Cc2ccccc2[C@@H]1CNC(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000875496995	GE	On-Demand	Anodyne	STAT6	48	32
CN1Cc2ccccc2[C@H]1CNC(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000875496996	GE	On-Demand	Anodyne	STAT6	48	32
CONC(=O)C1CCN(C(=O)NCc2cnc(N3CCOCC3)c(F)c2)CC1	ZINC000875496997	GC	On-Demand	Anodyne	STAT6	48	33
C[C@]1(C(F)(F)F)CCN(C(=O)NCc2cnc(N3CCOCC3)c(F)c2)C1	ZINC000875496999	GF	On-Demand	Anodyne	STAT6	50	35
CC(C)[C@H]1CCc2ccccc2[C@@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875497035	FF	On-Demand	Anodyne	BIRC2	44	32
CC(C)[C@H]1CCc2ccccc2[C@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875497036	FF	On-Demand	Anodyne	BIRC2	44	32
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@@]2(OC)CCOC2)CC1	ZINC000875497071	FF	On-Demand	Anodyne	RBP4	31	40
COc1ccccc1[C@H]1CCCN(C(=O)NC[C@]2(OC)CCOC2)CC1	ZINC000875497072	FF	On-Demand	Anodyne	RBP4	31	40
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@]2(OC)CCOC2)CC1	ZINC000875497073	FF	On-Demand	Anodyne	RBP4	31	40
COc1ccccc1[C@@H]1CCCN(C(=O)NC[C@@]2(OC)CCOC2)CC1	ZINC000875497074	FF	On-Demand	Anodyne	RBP4	31	40
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875497078	FE	On-Demand	Anodyne	DRD4	17	48
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875497080	FE	On-Demand	Anodyne	DRD4	17	48
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875497082	FE	On-Demand	Anodyne	DRD4	17	48
CCOC(=O)[C@H](C)C1CN(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875497084	FE	On-Demand	Anodyne	DRD4	17	48
O=C(NCc1cnc(N2CCOCC2)c(F)c1)N1CC[C@@H]2CSC[C@@H]2C1	ZINC000875497125	GD	On-Demand	Anodyne	STAT6	45	34
O=C(NCc1cnc(N2CCOCC2)c(F)c1)N1CC[C@H]2CSC[C@@H]2C1	ZINC000875497127	GD	On-Demand	Anodyne	STAT6	45	34
O=C(NCc1cnc(N2CCOCC2)c(F)c1)N1CC[C@@H]2CSC[C@H]2C1	ZINC000875497129	GD	On-Demand	Anodyne	STAT6	45	34
O=C(NCc1cnc(N2CCOCC2)c(F)c1)N1CC[C@H]2CSC[C@H]2C1	ZINC000875497131	GD	On-Demand	Anodyne	STAT6	45	34
COCC(C)(C)CCNC(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000875497141	FD	On-Demand	Anodyne	STAT6	48	33
O=C(NCc1ccnc(F)c1)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000875497168	FD	On-Demand	Anodyne	SCN10A	17	40
O=C(NCc1ccnc(F)c1)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000875497168	FD	On-Demand	Anodyne	STAT6	56	35
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NC1(C)CC(F)(F)C1	ZINC000875497171	EF	On-Demand	Anodyne	DRD4	18	48
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NC1(C)CC(F)(F)C1	ZINC000875497172	EF	On-Demand	Anodyne	DRD4	18	48
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NC1(C)CC(F)(F)C1	ZINC000875497173	EF	On-Demand	Anodyne	DRD4	18	48
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NC1(C)CC(F)(F)C1	ZINC000875497174	EF	On-Demand	Anodyne	DRD4	18	48
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875497184	EE	On-Demand	Anodyne	CHRM2	22	43
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875497184	EE	On-Demand	Anodyne	DRD4	41	48
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875497184	EE	On-Demand	Anodyne	CHRM3	25	44
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875497184	EE	On-Demand	Anodyne	SIGMAR1	42	42
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875497184	EE	On-Demand	Anodyne	MLNR	50	37
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875497184	EE	On-Demand	Anodyne	CYP2J2	45	32
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875497185	EE	On-Demand	Anodyne	CHRM2	22	43
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875497185	EE	On-Demand	Anodyne	DRD4	41	48
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875497185	EE	On-Demand	Anodyne	CHRM3	25	44
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875497185	EE	On-Demand	Anodyne	SIGMAR1	42	42
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875497185	EE	On-Demand	Anodyne	MLNR	50	37
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875497185	EE	On-Demand	Anodyne	CYP2J2	45	32
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875497186	EE	On-Demand	Anodyne	CHRM2	22	43
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875497186	EE	On-Demand	Anodyne	DRD4	41	48
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875497186	EE	On-Demand	Anodyne	CHRM3	25	44
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875497186	EE	On-Demand	Anodyne	SIGMAR1	42	42
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875497186	EE	On-Demand	Anodyne	MLNR	50	37
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CC[C@H](C(C)(C)O)C1	ZINC000875497186	EE	On-Demand	Anodyne	CYP2J2	45	32
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875497187	EE	On-Demand	Anodyne	CHRM2	22	43
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875497187	EE	On-Demand	Anodyne	DRD4	41	48
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875497187	EE	On-Demand	Anodyne	CHRM3	25	44
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875497187	EE	On-Demand	Anodyne	SIGMAR1	42	42
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875497187	EE	On-Demand	Anodyne	MLNR	50	37
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CC[C@@H](C(C)(C)O)C1	ZINC000875497187	EE	On-Demand	Anodyne	CYP2J2	45	32
COc1cccc([C@H](O)C2CCN(C(=O)NCCCC(=O)OC(C)C)CC2)c1	ZINC000875497205	GF	On-Demand	Anodyne	DRD4	42	33
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875497209	FD	On-Demand	Anodyne	DRD4	31	48
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875497209	FD	On-Demand	Anodyne	SIGMAR1	46	40
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875497209	FD	On-Demand	Anodyne	MLNR	40	36
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875497210	FD	On-Demand	Anodyne	DRD4	31	48
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875497210	FD	On-Demand	Anodyne	SIGMAR1	46	40
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875497210	FD	On-Demand	Anodyne	MLNR	40	36
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875497211	FD	On-Demand	Anodyne	DRD4	31	48
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875497211	FD	On-Demand	Anodyne	SIGMAR1	46	40
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875497211	FD	On-Demand	Anodyne	MLNR	40	36
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875497212	FD	On-Demand	Anodyne	DRD4	31	48
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875497212	FD	On-Demand	Anodyne	SIGMAR1	46	40
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875497212	FD	On-Demand	Anodyne	MLNR	40	36
C[C@@H]1CCCc2ccccc2[C@H]1NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875497222	FE	On-Demand	Anodyne	EPHX2	19	40
C[C@@H]1CCCc2ccccc2[C@@H]1NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875497223	FE	On-Demand	Anodyne	EPHX2	19	40
C[C@H]1CCCc2ccccc2[C@@H]1NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875497224	FE	On-Demand	Anodyne	EPHX2	19	40
C[C@H]1CCCc2ccccc2[C@H]1NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875497225	FE	On-Demand	Anodyne	EPHX2	19	40
O=C(NCc1cnc(N2CCOCC2)c(F)c1)NCc1cccc2ncccc12	ZINC000875497233	GF	On-Demand	Anodyne	TRPV1	15	45
O=C(NCc1cnc(N2CCOCC2)c(F)c1)NCc1cccc2ncccc12	ZINC000875497233	GF	On-Demand	Anodyne	SCN10A	21	47
O=C(NCc1cnc(N2CCOCC2)c(F)c1)NCc1cccc2ncccc12	ZINC000875497233	GF	On-Demand	Anodyne	STAT6	57	37
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cnc(N3CCOCC3)c(F)c2)C1	ZINC000875497235	GD	On-Demand	Anodyne	P2RY12	15	42
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cnc(N3CCOCC3)c(F)c2)C1	ZINC000875497235	GD	On-Demand	Anodyne	STAT6	47	32
C[C@H]1CCCc2ccccc2[C@H]1NC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875497252	GG	On-Demand	Anodyne	L3MBTL3	89	42
C[C@@H]1CCCc2ccccc2[C@H]1NC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875497253	GG	On-Demand	Anodyne	L3MBTL3	89	42
C[C@H]1CCCc2ccccc2[C@@H]1NC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875497254	GG	On-Demand	Anodyne	L3MBTL3	89	42
C[C@@H]1CCCc2ccccc2[C@@H]1NC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875497255	GG	On-Demand	Anodyne	L3MBTL3	89	42
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875497271	DD	On-Demand	Anodyne	DRD4	19	48
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875497272	DD	On-Demand	Anodyne	DRD4	19	48
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875497273	DD	On-Demand	Anodyne	DRD4	19	48
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NC[C@H]1C[C@H](O)C1	ZINC000875497274	DD	On-Demand	Anodyne	DRD4	19	48
CC(C)[C@H]1CCc2ccccc2[C@@H]1NC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875497303	GG	On-Demand	Anodyne	L3MBTL3	61	40
CC(C)[C@H]1CCc2ccccc2[C@H]1NC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000875497304	GG	On-Demand	Anodyne	L3MBTL3	61	40
CN(Cc1ccc2cc[nH]c2c1)C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000875497310	GF	On-Demand	Anodyne	STAT6	47	32
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CCC([C@@H](C)O)CC1	ZINC000875497317	EE	On-Demand	Anodyne	DRD4	35	47
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CCC([C@@H](C)O)CC1	ZINC000875497317	EE	On-Demand	Anodyne	SIGMAR1	37	45
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CCC([C@@H](C)O)CC1	ZINC000875497317	EE	On-Demand	Anodyne	MLNR	51	38
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1CCC([C@@H](C)O)CC1	ZINC000875497317	EE	On-Demand	Anodyne	BIRC2	29	42
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875497318	EE	On-Demand	Anodyne	DRD4	35	47
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875497318	EE	On-Demand	Anodyne	SIGMAR1	37	45
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875497318	EE	On-Demand	Anodyne	MLNR	51	38
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000875497318	EE	On-Demand	Anodyne	BIRC2	29	42
O=C(Oc1ccccc1-c1nnco1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875497364	EG	On-Demand	Anodyne	SLC6A1	53	33
O=C(Oc1ccccc1-c1nnco1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875497364	EG	On-Demand	Anodyne	SIGMAR1	34	42
O=C(Oc1ccccc1-c1nnco1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000875497364	EG	On-Demand	Anodyne	SLC18A3	15	41
O=C(Oc1ccccc1-c1nnco1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875497365	EG	On-Demand	Anodyne	SLC6A1	53	33
O=C(Oc1ccccc1-c1nnco1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875497365	EG	On-Demand	Anodyne	SIGMAR1	34	42
O=C(Oc1ccccc1-c1nnco1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000875497365	EG	On-Demand	Anodyne	SLC18A3	15	41
CC(C)[C@H]1CCc2ccccc2[C@H]1NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875497372	GE	On-Demand	Anodyne	BIRC2	44	32
CC(C)[C@H]1CCc2ccccc2[C@@H]1NC(=O)N1CCC(C(=O)NCCO)CC1	ZINC000875497373	GE	On-Demand	Anodyne	BIRC2	44	32
CCC1(CC)CCCN1C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000875497381	FF	On-Demand	Anodyne	STAT6	49	33
COC(=O)C1(O)CN(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875497383	EC	On-Demand	Anodyne	DRD4	21	54
COC(=O)C1(O)CN(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875497383	EC	On-Demand	Anodyne	SIGMAR1	27	40
COC(=O)C1(O)CN(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875497384	EC	On-Demand	Anodyne	DRD4	21	54
COC(=O)C1(O)CN(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875497384	EC	On-Demand	Anodyne	SIGMAR1	27	40
COC(=O)C1(O)CN(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875497385	EC	On-Demand	Anodyne	DRD4	21	54
COC(=O)C1(O)CN(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)C1	ZINC000875497385	EC	On-Demand	Anodyne	SIGMAR1	27	40
COC(=O)C1(O)CN(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875497386	EC	On-Demand	Anodyne	DRD4	21	54
COC(=O)C1(O)CN(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)C1	ZINC000875497386	EC	On-Demand	Anodyne	SIGMAR1	27	40
C[C@@H]1CCCc2ccccc2[C@@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875497390	EE	On-Demand	Anodyne	EPHX2	19	43
C[C@H]1CCCc2ccccc2[C@@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875497391	EE	On-Demand	Anodyne	EPHX2	19	43
C[C@@H]1CCCc2ccccc2[C@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875497392	EE	On-Demand	Anodyne	EPHX2	19	43
C[C@H]1CCCc2ccccc2[C@H]1NC(=O)N1CCC(CO)(CO)CC1	ZINC000875497393	EE	On-Demand	Anodyne	EPHX2	19	43
O=C(NCc1cnc(N2CCOCC2)c(F)c1)NC1CC(Nc2ccccc2)C1	ZINC000875497413	GE	On-Demand	Anodyne	STAT6	56	35
C=CC(C)(C)CCCNC(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000875497419	FF	On-Demand	Mild	STAT6	50	34
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875497432	EC	On-Demand	Anodyne	DRD4	28	48
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875497432	EC	On-Demand	Anodyne	SIGMAR1	30	40
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875497433	EC	On-Demand	Anodyne	DRD4	28	48
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875497433	EC	On-Demand	Anodyne	SIGMAR1	30	40
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875497434	EC	On-Demand	Anodyne	DRD4	28	48
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N[C@@H]1CCOC[C@H]1O	ZINC000875497434	EC	On-Demand	Anodyne	SIGMAR1	30	40
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875497436	EF	On-Demand	Anodyne	DRD4	20	48
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875497437	EF	On-Demand	Anodyne	DRD4	20	48
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875497438	EF	On-Demand	Anodyne	DRD4	20	48
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N(C)OCC(F)(F)F	ZINC000875497439	EF	On-Demand	Anodyne	DRD4	20	48
CC(=O)C1CCN(C(=O)NCc2ccc(OCc3ccccc3F)cc2)CC1	ZINC000875497467	GH	On-Demand	Anodyne	GRIN2B	18	43
CC(=O)C1CCN(C(=O)NCc2ccc(OCc3ccccc3F)cc2)CC1	ZINC000875497467	GH	On-Demand	Anodyne	ADAM17	64	44
CC(=O)C1CCN(C(=O)NCc2ccc(OCc3ccccc3F)cc2)CC1	ZINC000875497467	GH	On-Demand	Anodyne	GYS1	66	32
CC(=O)C1CCN(C(=O)NCc2ccc(OCc3ccccc3F)cc2)CC1	ZINC000875497467	GH	On-Demand	Anodyne	EPHX2	32	40
CC(=O)c1cc(F)c(NC(=O)[C@@H](Cc2cccnc2)C2CCCC2)c(F)c1	ZINC000875497475	FJ	On-Demand	Anodyne	C3AR1	45	45
CC(=O)c1cc(F)c(NC(=O)[C@H](Cc2cccnc2)C2CCCC2)c(F)c1	ZINC000875497476	FJ	On-Demand	Anodyne	C3AR1	45	45
O=C(NCc1cccc(-c2cccnc2)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875497498	GI	On-Demand	Anodyne	GRIN2B	16	44
O=C(NCc1cccc(-c2cccnc2)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875497498	GI	On-Demand	Anodyne	CHRNA7	42	37
O=C(NCc1cccc(-c2cccnc2)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875497498	GI	On-Demand	Anodyne	EPHX2	22	41
O=C(NCc1cccc(-c2cccnc2)c1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875497498	GI	On-Demand	Anodyne	NAMPT	59	39
O=C(NCc1cccc(-c2cccnc2)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875497499	GI	On-Demand	Anodyne	GRIN2B	16	44
O=C(NCc1cccc(-c2cccnc2)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875497499	GI	On-Demand	Anodyne	CHRNA7	42	37
O=C(NCc1cccc(-c2cccnc2)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875497499	GI	On-Demand	Anodyne	EPHX2	22	41
O=C(NCc1cccc(-c2cccnc2)c1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875497499	GI	On-Demand	Anodyne	NAMPT	59	39
O=C(NC1CC(OCc2ccccc2)C1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875497504	GE	On-Demand	Anodyne	RBP4	48	33
O=C(NCc1cccc(-c2cccnc2)c1)N1CCC(CO)(CO)CC1	ZINC000875497509	FE	On-Demand	Anodyne	NAMPT	77	39
C[C@@H](O)C1CCN(C(=O)N[C@H]2CCO[C@@H](c3ccccc3)C2)CC1	ZINC000875497662	EF	On-Demand	Anodyne	EPHX2	27	43
C[C@@H](O)C1CCN(C(=O)N[C@@H]2CCO[C@@H](c3ccccc3)C2)CC1	ZINC000875497663	EF	On-Demand	Anodyne	EPHX2	27	43
O=C(NCc1cccc(-c2cccnc2)c1)NC[C@H]1C[C@H](O)C1	ZINC000875497696	DE	On-Demand	Anodyne	NAMPT	46	42
COC(=O)c1ccc(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000875497739	EC	On-Demand	Reactive	CACNA1C	65	42
COC(=O)c1ccc(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000875497739	EC	On-Demand	Reactive	CACNA1D	100	42
COC(=O)c1ccc(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000875497739	EC	On-Demand	Reactive	CTRB1	28	41
O=C(NCc1cccc(-c2cccnc2)c1)N1CC(CNC(=O)C(F)(F)F)C1	ZINC000875497744	GF	On-Demand	Anodyne	NAMPT	50	37
CC(=O)c1cc(F)c(NC(=O)c2cccc(OC(C)(C)C)c2)c(F)c1	ZINC000875497746	EJ	On-Demand	Anodyne	KCNJ11	29	41
CC(=O)c1cc(F)c(NC(=O)c2cccc(OC(C)(C)C)c2)c(F)c1	ZINC000875497746	EJ	On-Demand	Anodyne	TAAR1	29	44
CC(=O)c1cc(F)c(NC(=O)c2cccc(OC(C)(C)C)c2)c(F)c1	ZINC000875497746	EJ	On-Demand	Anodyne	KCNK3	74	40
CC(=O)c1cc(F)c(NC(=O)c2cccc(OC(C)(C)C)c2)c(F)c1	ZINC000875497746	EJ	On-Demand	Anodyne	KCNK9	40	35
O=C(N[C@@H]1CCO[C@@H](c2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875497776	FG	On-Demand	Anodyne	EPHX2	26	40
O=C(N[C@@H]1CCO[C@@H](c2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875497777	FG	On-Demand	Anodyne	EPHX2	26	40
O=C(N[C@@H]1CCO[C@H](c2ccccc2)C1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875497778	FG	On-Demand	Anodyne	EPHX2	26	40
O=C(N[C@@H]1CCO[C@H](c2ccccc2)C1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875497779	FG	On-Demand	Anodyne	EPHX2	26	40
O=C(NCc1ccc(C(F)F)cc1)N1Cc2cccnc2N2C[C@H](O)C[C@H]2C1	ZINC000875497854	GF	On-Demand	Anodyne	NAMPT	23	43
COC(=O)N(C)NC(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000875497911	DE	On-Demand	Reactive	NQO2	33	45
COC(=O)N(C)NC(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000875497911	DE	On-Demand	Reactive	HTR6	39	41
COC(=O)N(C)NC(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000875497911	DE	On-Demand	Reactive	PPARD	40	41
COC(=O)N(C)NC(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000875497911	DE	On-Demand	Reactive	MTNR1A	62	48
COC(=O)N(C)NC(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000875497911	DE	On-Demand	Reactive	MTNR1B	50	39
COC(=O)N(C)NC(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000875497911	DE	On-Demand	Reactive	EBP	19	47
COC(=O)N(C)NC(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000875497912	DE	On-Demand	Reactive	NQO2	33	45
COC(=O)N(C)NC(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000875497912	DE	On-Demand	Reactive	HTR6	39	41
COC(=O)N(C)NC(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000875497912	DE	On-Demand	Reactive	PPARD	40	41
COC(=O)N(C)NC(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000875497912	DE	On-Demand	Reactive	MTNR1A	62	48
COC(=O)N(C)NC(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000875497912	DE	On-Demand	Reactive	MTNR1B	50	39
COC(=O)N(C)NC(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000875497912	DE	On-Demand	Reactive	EBP	19	47
O=C(NC1CC(OCc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875497949	ED	On-Demand	Anodyne	EPHX2	30	44
O=C(NC1CC(OCc2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875497949	ED	On-Demand	Anodyne	SLC12A5	68	34
O=C1OC[C@H]2CN(C(=O)NCc3ccc(OCc4ccccc4F)cc3)C[C@@H]12	ZINC000875497989	GF	On-Demand	Anodyne	ADAM17	26	40
CN1CCN(C(=O)N[C@@H]2CCO[C@H](c3ccccc3)C2)CCC1(C)C	ZINC000875498030	EG	On-Demand	Anodyne	EPHX2	25	42
CN1CCN(C(=O)N[C@@H]2CCO[C@@H](c3ccccc3)C2)CCC1(C)C	ZINC000875498032	EG	On-Demand	Anodyne	EPHX2	25	42
CN1CCN(C(=O)N[C@H]2CCO[C@H](c3ccccc3)C2)CCC1(C)C	ZINC000875498034	EG	On-Demand	Anodyne	EPHX2	25	42
CN1CCN(C(=O)N[C@H]2CCO[C@@H](c3ccccc3)C2)CCC1(C)C	ZINC000875498036	EG	On-Demand	Anodyne	EPHX2	25	42
CN(C)C[C@@H]1CN(C(=O)NC2CC(OCc3ccccc3)C2)C[C@H]1CN(C)C	ZINC000875498103	GE	On-Demand	Anodyne	EPHX2	19	40
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000875498123	EG	On-Demand	Anodyne	ANPEP	16	43
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000875498123	EG	On-Demand	Anodyne	NAMPT	40	39
CC[C@H](C[C@H](C)O)NC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000875498123	EG	On-Demand	Anodyne	PDS	43	33
CN1CCN(C2CCN(C(=O)C(=O)N[C@@H]3[C@@H](c4ccccc4)C3(C)C)CC2)CC1	ZINC000875498149	GD	On-Demand	Anodyne	L3MBTL3	67	40
COC(=O)C1(O)CN(C(=O)NCCc2c(C)oc3ccccc23)C1	ZINC000875498154	ED	On-Demand	Anodyne	MTNR1A	23	40
COC(=O)C1(O)CN(C(=O)NCCc2c(C)oc3ccccc23)C1	ZINC000875498154	ED	On-Demand	Anodyne	MTNR1B	24	40
CN1CCN(C2CCN(C(=O)N[C@H]3CCCc4sccc43)CC2)CC1	ZINC000875498258	FF	On-Demand	Anodyne	L3MBTL3	78	44
CN1CCN(C2CCN(C(=O)N[C@@H]3CCCc4sccc43)CC2)CC1	ZINC000875498260	FF	On-Demand	Anodyne	L3MBTL3	78	44
O=C1CCN(C(=O)NCc2cccc(-c3cccnc3)c2)CCCCCCN1	ZINC000875498294	GG	On-Demand	Anodyne	P2RY14	30	40
O=C1CCN(C(=O)NCc2cccc(-c3cccnc3)c2)CCCCCCN1	ZINC000875498294	GG	On-Demand	Anodyne	NAMPT	63	42
O=CN1CCCN(C(=O)NCc2ccc(OCc3ccccc3F)cc2)CC1	ZINC000875498352	GF	On-Demand	Anodyne	ADAM17	22	41
O=CN1CCCN(C(=O)NCc2ccc(OCc3ccccc3F)cc2)CC1	ZINC000875498352	GF	On-Demand	Anodyne	GYS1	43	32
O=CN1CCCN(C(=O)NCc2ccc(OCc3ccccc3F)cc2)CC1	ZINC000875498352	GF	On-Demand	Anodyne	DPP7	23	40
CCOC(=O)[C@@H]1CCCCN1C(=O)c1c(Cl)nn(C)c1Cl	ZINC000875498426	EE	On-Demand	Anodyne	FKBP1A	44	40
C#CC[C@@H](NC(=O)c1cc(C)nn1C1CCOCC1)c1ccccc1	ZINC000875498446	EG	On-Demand	Mild	TACR3	47	37
C#CC[C@H](NC(=O)c1cc(C)nn1C1CCOCC1)c1ccccc1	ZINC000875498447	EG	On-Demand	Mild	TACR3	47	37
COC(=O)C1(O)CN(C(=O)NC2CC(OCc3ccccc3)C2)C1	ZINC000875498453	EC	On-Demand	Anodyne	EPHX2	17	43
COC(=O)C1(O)CN(C(=O)NC2CC(OCc3ccccc3)C2)C1	ZINC000875498453	EC	On-Demand	Anodyne	SLC12A5	69	37
C[C@@H]1CN(C(=O)NCc2cccc(-c3cccnc3)c2)CC[C@@H](C(F)(F)F)O1	ZINC000875498458	GH	On-Demand	Anodyne	NAMPT	61	42
C[C@@H]1CN(C(=O)NCc2cccc(-c3cccnc3)c2)CC[C@H](C(F)(F)F)O1	ZINC000875498460	GH	On-Demand	Anodyne	NAMPT	61	42
O=C(NC[C@H]1C[C@H](O)C1)NC1CC(OCc2ccccc2)C1	ZINC000875498461	DD	On-Demand	Anodyne	EPHX2	17	49
O=C(NCc1cccc(-c2cccnc2)c1)N1[C@H]2CC[C@H]1CC(CCO)C2	ZINC000875498462	FH	On-Demand	Anodyne	NAMPT	46	36
O=C(NCCO)C1CCN(C(=O)NC2CC(OCc3ccccc3)C2)CC1	ZINC000875498484	GD	On-Demand	Anodyne	EPHX2	36	40
CCOC(=O)[C@@H]1CCCCN1C(=O)c1c(C(F)(F)F)coc1C	ZINC000875498509	EG	On-Demand	Anodyne	FKBP1A	53	38
CCOC(=O)[C@@H]1CCCCN1C(=O)c1c(C(F)(F)F)coc1C	ZINC000875498509	EG	On-Demand	Anodyne	WNT3	40	31
CN(C)[C@@H](CNC(=O)N[C@@H]1CCOC[C@H]1O)c1cccc(C(F)(F)F)c1	ZINC000875498529	GD	On-Demand	Anodyne	CCR2	50	40
C[C@@H](NC(=O)N1CCC2(CCNC2=O)CC1)c1ccc(Cl)c2ccccc12	ZINC000875498553	GH	On-Demand	Anodyne	CACNA1H	45	40
COC(=O)C1=NO[C@]2(CCN(C(=O)NC3CC(OCc4ccccc4)C3)C2)C1	ZINC000875498554	GD	On-Demand	Anodyne	SLC12A5	44	32
COC(=O)C1=NO[C@@]2(CCN(C(=O)NC3CC(OCc4ccccc4)C3)C2)C1	ZINC000875498557	GD	On-Demand	Anodyne	SLC12A5	44	32
C#CC[C@@H](NC(=O)[C@@H]1COCCN1CC)c1ccccc1	ZINC000875498559	CD	On-Demand	Mild	CCR5	20	40
C#CC[C@H](NC(=O)[C@@H]1COCCN1CC)c1ccccc1	ZINC000875498561	CD	On-Demand	Mild	CCR5	20	40
C#CC[C@@H](NC(=O)[C@H]1COCCN1CC)c1ccccc1	ZINC000875498563	CD	On-Demand	Mild	CCR5	20	40
C#CC[C@H](NC(=O)[C@H]1COCCN1CC)c1ccccc1	ZINC000875498565	CD	On-Demand	Mild	CCR5	20	40
CONC(=O)C1CCN(C(=O)N[C@H](C)c2ccc(Cl)c3ccccc23)CC1	ZINC000875498573	GH	On-Demand	Anodyne	Q6PRC7_IXORI	53	32
CONC(=O)C1CCN(C(=O)N[C@@H](C)c2ccc(Cl)c3ccccc23)CC1	ZINC000875498585	GH	On-Demand	Anodyne	Q6PRC7_IXORI	53	32
COCC1CC(NC(=O)NC[C@@H](c2cccc(C(F)(F)F)c2)N(C)C)C1	ZINC000875498650	FG	On-Demand	Anodyne	CCR2	42	38
COCC1CC(NC(=O)NC[C@H](c2cccc(C(F)(F)F)c2)N(C)C)C1	ZINC000875498651	FG	On-Demand	Anodyne	CCR2	42	38
COC(=O)[C@@]12C[C@@H](NC(=O)NCc3cccc(-c4cccnc4)c3)C[C@@H]1C2	ZINC000875498664	FF	On-Demand	Anodyne	CYP11B2	26	41
CC(=O)c1cc(F)c(NC(=O)[C@@H]2CCC(=O)N2C(C)C)c(F)c1	ZINC000875498683	DF	On-Demand	Anodyne	P2RX7	17	49
O=C(Nc1nc(-c2cccnc2)ns1)[C@@H]1CC[C@H](Cc2ccccc2)O1	ZINC000875498697	FG	On-Demand	Anodyne	CHRNA7	43	38
O=C(N[C@@H]1CCO[C@H](c2ccccc2)C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875498698	FI	On-Demand	Anodyne	EPHX2	29	47
O=C(N[C@@H]1CCO[C@@H](c2ccccc2)C1)N1CCC[C@H](OC2CCC2)CC1	ZINC000875498699	FI	On-Demand	Anodyne	EPHX2	29	47
O=C(N[C@@H]1CCO[C@@H](c2ccccc2)C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875498700	FI	On-Demand	Anodyne	EPHX2	29	47
O=C(N[C@@H]1CCO[C@H](c2ccccc2)C1)N1CCC[C@@H](OC2CCC2)CC1	ZINC000875498701	FI	On-Demand	Anodyne	EPHX2	29	47
COC(=O)[C@@H]1CCN(C(=O)c2c(C(F)(F)F)coc2C)c2ccccc21	ZINC000875498767	FH	On-Demand	Anodyne	RBP4	48	37
COC(=O)[C@H]1CCN(C(=O)c2c(C(F)(F)F)coc2C)c2ccccc21	ZINC000875498768	FH	On-Demand	Anodyne	RBP4	48	37
COC(=O)[C@@H]1CCN(C(=O)c2cnc(F)cc2C)c2ccccc21	ZINC000875498775	EF	On-Demand	Anodyne	AVPR2	52	39
COC(=O)[C@@H]1CCN(C(=O)c2cnc(F)cc2C)c2ccccc21	ZINC000875498775	EF	On-Demand	Anodyne	GPBAR1	49	38
COC(=O)[C@H]1CCN(C(=O)c2cnc(F)cc2C)c2ccccc21	ZINC000875498776	EF	On-Demand	Anodyne	AVPR2	52	39
COC(=O)[C@H]1CCN(C(=O)c2cnc(F)cc2C)c2ccccc21	ZINC000875498776	EF	On-Demand	Anodyne	GPBAR1	49	38
O=C(NCc1ccc(OCc2ccccc2F)cc1)NC[C@H]1C[C@H](O)C1	ZINC000875498821	FF	On-Demand	Anodyne	ADAM17	31	46
O=CN1CCCN(C(=O)NC2CC(OCc3ccccc3)C2)CC1	ZINC000875498824	ED	On-Demand	Anodyne	EPHX2	22	40
COCCN(CC1CCN(C)CC1)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000875498829	GG	On-Demand	Anodyne	CHRNA7	44	35
COCCN(CC1CCN(C)CC1)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000875498829	GG	On-Demand	Anodyne	NAMPT	46	35
CN(C)C[C@@H]1CN(C(=O)NCc2cccc(-c3cccnc3)c2)C[C@H]1CN(C)C	ZINC000875498840	GF	On-Demand	Anodyne	NAMPT	68	35
O=C(NCc1cccc(-c2cccnc2)c1)N1CCO[C@H](C(F)(F)F)CC1	ZINC000875498842	GH	On-Demand	Anodyne	NAMPT	51	37
O=C(NCc1cccc(-c2cccnc2)c1)N1CCO[C@@H](C(F)(F)F)CC1	ZINC000875498844	GH	On-Demand	Anodyne	NAMPT	51	37
O=C(CCCOc1ccc(F)cc1)NNC(=O)c1ccc2ccccc2n1	ZINC000875498866	FF	On-Demand	Reactive	CYSLTR1	56	47
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCCc3cc(OC)ccc32)C1	ZINC000875498872	FF	On-Demand	Anodyne	NQO2	22	40
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCCc3cc(OC)ccc32)C1	ZINC000875498872	FF	On-Demand	Anodyne	MTNR1A	27	42
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCCc3cc(OC)ccc32)C1	ZINC000875498872	FF	On-Demand	Anodyne	MTNR1B	29	44
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@H]2CCCc3cc(OC)ccc32)C1	ZINC000875498872	FF	On-Demand	Anodyne	EBP	16	43
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCCc3cc(OC)ccc32)C1	ZINC000875498877	FF	On-Demand	Anodyne	NQO2	22	40
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCCc3cc(OC)ccc32)C1	ZINC000875498877	FF	On-Demand	Anodyne	MTNR1A	27	42
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCCc3cc(OC)ccc32)C1	ZINC000875498877	FF	On-Demand	Anodyne	MTNR1B	29	44
CCOC(=O)[C@H](C)C1CN(C(=O)NC[C@@H]2CCCc3cc(OC)ccc32)C1	ZINC000875498877	FF	On-Demand	Anodyne	EBP	16	43
COC(=O)c1ccc(C(=O)NNC(=O)c2ccccn2)cn1	ZINC000875498890	DC	On-Demand	Reactive	GRM4	62	42
COC(=O)N(C)NC(=O)NCc1c(OC(C)C)ccc2ccccc12	ZINC000875498896	EG	On-Demand	Reactive	NCEH1	29	42
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCCc3cc(OC)ccc32)C1	ZINC000875498947	ED	On-Demand	Anodyne	NQO2	26	43
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCCc3cc(OC)ccc32)C1	ZINC000875498947	ED	On-Demand	Anodyne	PPARD	36	42
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCCc3cc(OC)ccc32)C1	ZINC000875498947	ED	On-Demand	Anodyne	MTNR1A	33	46
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCCc3cc(OC)ccc32)C1	ZINC000875498947	ED	On-Demand	Anodyne	MTNR1B	36	46
COC(=O)C1(O)CN(C(=O)NC[C@H]2CCCc3cc(OC)ccc32)C1	ZINC000875498947	ED	On-Demand	Anodyne	EBP	21	47
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCCc3cc(OC)ccc32)C1	ZINC000875498949	ED	On-Demand	Anodyne	NQO2	26	43
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCCc3cc(OC)ccc32)C1	ZINC000875498949	ED	On-Demand	Anodyne	PPARD	36	42
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCCc3cc(OC)ccc32)C1	ZINC000875498949	ED	On-Demand	Anodyne	MTNR1A	33	46
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCCc3cc(OC)ccc32)C1	ZINC000875498949	ED	On-Demand	Anodyne	MTNR1B	36	46
COC(=O)C1(O)CN(C(=O)NC[C@@H]2CCCc3cc(OC)ccc32)C1	ZINC000875498949	ED	On-Demand	Anodyne	EBP	21	47
O=C(NCCO)C1CCN(C(=O)NCc2ccc(C(F)F)cc2)CC1	ZINC000875498952	FD	On-Demand	Anodyne	EPHX2	16	44
C[C@@H](NC(=O)N1CCC(CO)(CO)CC1)c1ccc(Cl)c2ccccc12	ZINC000875499052	GG	On-Demand	Anodyne	Q6PRC7_IXORI	59	32
O=C(NCc1cccc(-c2cccnc2)c1)N1Cc2cccnc2N2CCC[C@H]2C1	ZINC000875499073	GH	On-Demand	Anodyne	NAMPT	45	41
O=C(Nc1ccc(OC(F)(F)F)cc1Br)C1(F)CCOCC1	ZINC000875499087	GH	On-Demand	Anodyne	MMP13	29	47
O=C(Nc1ccc(OC(F)(F)F)cc1Br)C1(F)CCOCC1	ZINC000875499087	GH	On-Demand	Anodyne	MMP2	36	47
CCOC(=O)[C@@H]1CCCCN1C(=O)c1sccc1CC#N	ZINC000875499090	DE	On-Demand	Mild	FKBP1A	56	37
CCOC(=O)[C@@H]1CCCCN1C(=O)c1sccc1CC#N	ZINC000875499090	DE	On-Demand	Mild	PREP	40	34
CCOC(=O)[C@@H]1CCCCN1C(=O)c1sccc1CC#N	ZINC000875499090	DE	On-Demand	Mild	LGMN	71	34
O=C(NCCO)C1CCN(C(=O)NCc2cccc(-c3cccnc3)c2)CC1	ZINC000875499097	GD	On-Demand	Anodyne	NAMPT	73	37
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2c(C)oc3ccccc23)C1	ZINC000875499112	FG	On-Demand	Anodyne	MTNR1A	26	40
CCOC(=O)[C@H](C)C1CN(C(=O)NCCc2c(C)oc3ccccc23)C1	ZINC000875499112	FG	On-Demand	Anodyne	MTNR1B	28	40
CC(C)[C@H]1CCC[C@H](NC(=O)N2CCC(N3CCN(C)CC3)CC2)CC1	ZINC000875499157	FG	On-Demand	Anodyne	L3MBTL3	49	42
CC(C)[C@H]1CCC[C@@H](NC(=O)N2CCC(N3CCN(C)CC3)CC2)CC1	ZINC000875499159	FG	On-Demand	Anodyne	L3MBTL3	49	42
O=C(N[C@H]1CCCc2sccc21)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875499216	FG	On-Demand	Anodyne	ETHR	51	36
O=C(N[C@@H]1CCCc2sccc21)N1CCO[C@H](c2noc(C3CC3)n2)C1	ZINC000875499217	FG	On-Demand	Anodyne	ETHR	51	36
O=C(N[C@H]1CCCc2sccc21)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875499218	FG	On-Demand	Anodyne	ETHR	51	36
O=C(N[C@@H]1CCCc2sccc21)N1CCO[C@@H](c2noc(C3CC3)n2)C1	ZINC000875499219	FG	On-Demand	Anodyne	ETHR	51	36
CC(=O)C1CCN(C(=O)NC[C@@H](c2cccc(C(F)(F)F)c2)N(C)C)CC1	ZINC000875499235	GG	On-Demand	Anodyne	TACR1	40	36
CC(=O)C1CCN(C(=O)NC[C@@H](c2cccc(C(F)(F)F)c2)N(C)C)CC1	ZINC000875499235	GG	On-Demand	Anodyne	CACNA1B	43	35
CC(=O)C1CCN(C(=O)NC[C@@H](c2cccc(C(F)(F)F)c2)N(C)C)CC1	ZINC000875499235	GG	On-Demand	Anodyne	CCR2	82	41
CC(=O)C1CCN(C(=O)NC[C@@H](c2cccc(C(F)(F)F)c2)N(C)C)CC1	ZINC000875499235	GG	On-Demand	Anodyne	EPHX2	15	42
CC(=O)C1CCN(C(=O)NC[C@H](c2cccc(C(F)(F)F)c2)N(C)C)CC1	ZINC000875499236	GG	On-Demand	Anodyne	TACR1	40	36
CC(=O)C1CCN(C(=O)NC[C@H](c2cccc(C(F)(F)F)c2)N(C)C)CC1	ZINC000875499236	GG	On-Demand	Anodyne	CACNA1B	43	35
CC(=O)C1CCN(C(=O)NC[C@H](c2cccc(C(F)(F)F)c2)N(C)C)CC1	ZINC000875499236	GG	On-Demand	Anodyne	CCR2	82	41
CC(=O)C1CCN(C(=O)NC[C@H](c2cccc(C(F)(F)F)c2)N(C)C)CC1	ZINC000875499236	GG	On-Demand	Anodyne	EPHX2	15	42
O=C(N[C@@H]1CCO[C@@H](C2CC2)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875499308	EF	On-Demand	Anodyne	EPHX2	20	44
O=C(N[C@@H]1CCO[C@H](C2CC2)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875499309	EF	On-Demand	Anodyne	EPHX2	20	44
O=C(N[C@@H]1CCO[C@@H](C2CC2)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875499310	EF	On-Demand	Anodyne	EPHX2	20	44
O=C(N[C@@H]1CCO[C@H](C2CC2)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875499311	EF	On-Demand	Anodyne	EPHX2	20	44
CC[C@@H](NC(=O)NCc1ccc(C(F)F)cc1)[C@H](O)c1ccccc1	ZINC000875499321	EH	On-Demand	Anodyne	ANPEP	16	45
CC[C@@H](NC(=O)NCc1ccc(C(F)F)cc1)[C@H](O)c1ccccc1	ZINC000875499321	EH	On-Demand	Anodyne	PDS	46	35
CC[C@@H](NC(=O)NCc1ccc(C(F)F)cc1)[C@@H](O)c1ccccc1	ZINC000875499323	EH	On-Demand	Anodyne	ANPEP	16	45
CC[C@@H](NC(=O)NCc1ccc(C(F)F)cc1)[C@@H](O)c1ccccc1	ZINC000875499323	EH	On-Demand	Anodyne	PDS	46	35
O=C(N[C@@H]1CCO[C@H](C2CC2)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875499326	FE	On-Demand	Anodyne	SIGMAR1	23	40
O=C(N[C@H]1CCO[C@H](C2CC2)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875499327	FE	On-Demand	Anodyne	SIGMAR1	23	40
O=C(N[C@H]1CCO[C@@H](C2CC2)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875499328	FE	On-Demand	Anodyne	SIGMAR1	23	40
O=C(N[C@@H]1CCO[C@@H](C2CC2)C1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC000875499329	FE	On-Demand	Anodyne	SIGMAR1	23	40
O=C(N[C@H]1CCO[C@@H](c2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875499334	ED	On-Demand	Anodyne	EPHX2	27	43
O=C(N[C@@H]1CCO[C@@H](c2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875499335	ED	On-Demand	Anodyne	EPHX2	27	43
O=C(N[C@H]1CCO[C@H](c2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875499336	ED	On-Demand	Anodyne	EPHX2	27	43
O=C(N[C@@H]1CCO[C@H](c2ccccc2)C1)N1CCC(CO)(CO)CC1	ZINC000875499337	ED	On-Demand	Anodyne	EPHX2	27	43
CCOC(=O)[C@H](C)C1CN(C(=O)NCc2cccc(-c3cccnc3)c2)C1	ZINC000875499379	FG	On-Demand	Anodyne	NAMPT	49	34
COC(=O)C1(O)CN(C(=O)NCc2cccc(-c3cccnc3)c2)C1	ZINC000875499394	ED	On-Demand	Anodyne	CYP11B2	42	42
COC(=O)C1(O)CN(C(=O)NCc2cccc(-c3cccnc3)c2)C1	ZINC000875499394	ED	On-Demand	Anodyne	ROCK2	26	40
COC(=O)C1(O)CN(C(=O)NCc2cccc(-c3cccnc3)c2)C1	ZINC000875499394	ED	On-Demand	Anodyne	NAMPT	62	37
CC[C@H](C[C@H](C)O)NC(=O)NC1CC(OCc2ccccc2)C1	ZINC000875499403	DF	On-Demand	Anodyne	KLK3	56	34
CC[C@H](C[C@H](C)O)NC(=O)NC1CC(OCc2ccccc2)C1	ZINC000875499403	DF	On-Demand	Anodyne	CTSB	47	35
CC[C@H](C[C@H](C)O)NC(=O)NC1CC(OCc2ccccc2)C1	ZINC000875499403	DF	On-Demand	Anodyne	PAPA1_CARPA	53	34
CC[C@H](C[C@H](C)O)NC(=O)NC1CC(OCc2ccccc2)C1	ZINC000875499403	DF	On-Demand	Anodyne	CTSK	33	41
CC[C@H](C[C@H](C)O)NC(=O)NC1CC(OCc2ccccc2)C1	ZINC000875499403	DF	On-Demand	Anodyne	CAPNS1	55	34
CC[C@H](C[C@H](C)O)NC(=O)NC1CC(OCc2ccccc2)C1	ZINC000875499403	DF	On-Demand	Anodyne	CAPN1	87	40
CC[C@H](C[C@H](C)O)NC(=O)NC1CC(OCc2ccccc2)C1	ZINC000875499403	DF	On-Demand	Anodyne	CAPN2	121	38
CC[C@H](C[C@H](C)O)NC(=O)NC1CC(OCc2ccccc2)C1	ZINC000875499403	DF	On-Demand	Anodyne	NPR	69	34
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000875499407	FF	On-Demand	Anodyne	SLC6A4	22	50
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000875499407	FF	On-Demand	Anodyne	SLC6A3	39	50
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000875499407	FF	On-Demand	Anodyne	NAMPT	43	36
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000875499408	FF	On-Demand	Anodyne	SLC6A4	22	50
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000875499408	FF	On-Demand	Anodyne	SLC6A3	39	50
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000875499408	FF	On-Demand	Anodyne	NAMPT	43	36
COC(=O)N(C)NC(=O)NCCc1c(C)oc2ccccc12	ZINC000875499502	DE	On-Demand	Reactive	MTNR1A	39	44
COC(=O)N(C)NC(=O)NCCc1c(C)oc2ccccc12	ZINC000875499502	DE	On-Demand	Reactive	MTNR1B	31	44
CC(=O)c1cc(F)c(NC(=O)[C@H](C)CCc2ccc(F)cc2)c(F)c1	ZINC000875499512	EJ	On-Demand	Anodyne	LEF	67	38
CC(=O)c1cc(F)c(NC(=O)[C@@H](C)CCc2ccc(F)cc2)c(F)c1	ZINC000875499514	EJ	On-Demand	Anodyne	LEF	67	38
CN(C)[C@@H](CNC(=O)N1C[C@H]2C(=O)OC[C@H]2C1)c1cccc(C(F)(F)F)c1	ZINC000875499538	GE	On-Demand	Anodyne	TACR1	20	40
O=CN1CCCN(C(=O)NCc2cccc(-c3cccnc3)c2)CC1	ZINC000875499688	EE	On-Demand	Anodyne	NAMPT	63	40
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)N1CCCN(C=O)CC1	ZINC000875499772	FE	On-Demand	Anodyne	Q6PRC7_IXORI	62	41
COC(=O)[C@@H]1CCN(C(=O)c2cnn(C(C)C)c2Cl)c2ccccc21	ZINC000875499803	FG	On-Demand	Anodyne	GPBAR1	48	36
COC(=O)[C@H]1CCN(C(=O)c2cnn(C(C)C)c2Cl)c2ccccc21	ZINC000875499804	FG	On-Demand	Anodyne	GPBAR1	48	36
O=C(CCCOC1CCOCC1)Nc1nc(-c2cccnc2)ns1	ZINC000875499846	EF	On-Demand	Anodyne	CHRNA7	19	42
O=C(N[C@@H]1CCO[C@H](c2ccccc2)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875499871	GH	On-Demand	Anodyne	EPHX2	32	48
O=C(N[C@@H]1CCO[C@H](c2ccccc2)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875499872	GH	On-Demand	Anodyne	EPHX2	32	48
O=C(N[C@@H]1CCO[C@@H](c2ccccc2)C1)N1CCC[C@](O)(c2ccccc2)C1	ZINC000875499873	GH	On-Demand	Anodyne	EPHX2	32	48
O=C(N[C@@H]1CCO[C@@H](c2ccccc2)C1)N1CCC[C@@](O)(c2ccccc2)C1	ZINC000875499874	GH	On-Demand	Anodyne	EPHX2	32	48
O=C(NCc1ccc(C(F)F)cc1)N1CCC(CO)(CO)CC1	ZINC000875499911	ED	On-Demand	Anodyne	NAMPT	21	41
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(F)F)cc1	ZINC000875499914	EF	On-Demand	Anodyne	SLC6A4	39	44
COC(=O)[C@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(F)F)cc1	ZINC000875499914	EF	On-Demand	Anodyne	SLC6A3	83	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(F)F)cc1	ZINC000875499915	EF	On-Demand	Anodyne	SLC6A4	39	44
COC(=O)[C@@H]1C[C@H]2CC[C@H]1N2C(=O)NCc1ccc(C(F)F)cc1	ZINC000875499915	EF	On-Demand	Anodyne	SLC6A3	83	44
COC(=O)[C@@H]1CCN(C(=O)c2cc(C)cnc2F)c2ccccc21	ZINC000875499919	EF	On-Demand	Anodyne	GPBAR1	53	39
COC(=O)[C@H]1CCN(C(=O)c2cc(C)cnc2F)c2ccccc21	ZINC000875499920	EF	On-Demand	Anodyne	GPBAR1	53	39